NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
403329 |
1wjl   |
10061 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wjl
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 1777
_Distance_constraint_stats_list.Viol_count 1833
_Distance_constraint_stats_list.Viol_total 2055.038
_Distance_constraint_stats_list.Viol_max 0.951
_Distance_constraint_stats_list.Viol_rms 0.0278
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0029
_Distance_constraint_stats_list.Viol_average_violations_only 0.0561
_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 6 SER 0.005 0.002 15 0 "[ . 1 . 2]"
1 7 GLY 0.093 0.015 15 0 "[ . 1 . 2]"
1 8 MET 4.731 0.770 17 6 "[ ** - 1* * . + 2]"
1 9 SER 17.451 0.951 5 6 "[ +* * 1* - . * 2]"
1 10 TYR 4.267 0.454 6 0 "[ . 1 . 2]"
1 11 SER 5.231 0.447 10 0 "[ . 1 . 2]"
1 12 VAL 1.309 0.232 12 0 "[ . 1 . 2]"
1 13 THR 0.306 0.067 12 0 "[ . 1 . 2]"
1 14 LEU 0.190 0.024 11 0 "[ . 1 . 2]"
1 15 THR 0.054 0.023 14 0 "[ . 1 . 2]"
1 16 GLY 0.101 0.023 14 0 "[ . 1 . 2]"
1 17 PRO 1.015 0.150 9 0 "[ . 1 . 2]"
1 18 GLY 1.015 0.150 9 0 "[ . 1 . 2]"
1 19 PRO 1.476 0.103 1 0 "[ . 1 . 2]"
1 20 TRP 0.302 0.024 11 0 "[ . 1 . 2]"
1 21 GLY 1.606 0.103 1 0 "[ . 1 . 2]"
1 22 PHE 0.438 0.060 5 0 "[ . 1 . 2]"
1 23 ARG 0.133 0.019 6 0 "[ . 1 . 2]"
1 24 LEU 0.202 0.029 4 0 "[ . 1 . 2]"
1 25 GLN 1.605 0.455 4 0 "[ . 1 . 2]"
1 26 GLY 3.499 0.245 10 0 "[ . 1 . 2]"
1 27 GLY 2.454 0.172 12 0 "[ . 1 . 2]"
1 28 LYS 2.738 0.539 15 2 "[ -. 1 + 2]"
1 29 ASP 0.835 0.607 1 1 "[+ . 1 . 2]"
1 30 PHE 0.232 0.025 12 0 "[ . 1 . 2]"
1 31 ASN 0.314 0.069 12 0 "[ . 1 . 2]"
1 32 MET 12.220 0.455 4 0 "[ . 1 . 2]"
1 33 PRO 8.268 0.146 12 0 "[ . 1 . 2]"
1 34 LEU 2.663 0.105 4 0 "[ . 1 . 2]"
1 35 THR 3.800 0.167 4 0 "[ . 1 . 2]"
1 36 ILE 3.822 0.153 20 0 "[ . 1 . 2]"
1 37 SER 0.370 0.053 15 0 "[ . 1 . 2]"
1 38 ARG 4.589 0.373 10 0 "[ . 1 . 2]"
1 39 ILE 0.495 0.034 1 0 "[ . 1 . 2]"
1 40 THR 0.102 0.019 6 0 "[ . 1 . 2]"
1 41 PRO 3.821 0.557 10 3 "[ .- + .* 2]"
1 42 GLY 4.549 0.624 4 3 "[ +. * .- 2]"
1 43 SER 0.092 0.023 8 0 "[ . 1 . 2]"
1 44 LYS 1.074 0.147 20 0 "[ . 1 . 2]"
1 45 ALA 0.030 0.010 17 0 "[ . 1 . 2]"
1 46 ALA 8.610 0.624 4 4 "[ +.- * .* 2]"
1 47 GLN 2.169 0.142 11 0 "[ . 1 . 2]"
1 48 SER 1.362 0.134 10 0 "[ . 1 . 2]"
1 49 GLN 2.280 0.203 10 0 "[ . 1 . 2]"
1 50 LEU 1.405 0.134 10 0 "[ . 1 . 2]"
1 51 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 GLN 0.409 0.044 16 0 "[ . 1 . 2]"
1 53 GLY 1.514 0.092 17 0 "[ . 1 . 2]"
1 54 ASP 4.475 0.153 20 0 "[ . 1 . 2]"
1 55 LEU 3.185 0.145 7 0 "[ . 1 . 2]"
1 56 VAL 3.597 0.145 7 0 "[ . 1 . 2]"
1 57 VAL 2.638 0.074 2 0 "[ . 1 . 2]"
1 58 ALA 2.957 0.454 6 0 "[ . 1 . 2]"
1 59 ILE 5.157 0.693 11 2 "[ . 1+ . - 2]"
1 60 ASP 2.564 0.330 1 0 "[ . 1 . 2]"
1 61 GLY 2.960 0.454 6 0 "[ . 1 . 2]"
1 62 VAL 4.141 0.312 1 0 "[ . 1 . 2]"
1 63 ASN 1.975 0.312 1 0 "[ . 1 . 2]"
1 64 THR 0.478 0.054 7 0 "[ . 1 . 2]"
1 65 ASP 0.025 0.010 5 0 "[ . 1 . 2]"
1 66 THR 0.476 0.109 9 0 "[ . 1 . 2]"
1 67 MET 0.814 0.105 4 0 "[ . 1 . 2]"
1 68 THR 3.357 0.607 1 3 "[+ -. 1 * 2]"
1 69 HIS 0.567 0.045 4 0 "[ . 1 . 2]"
1 70 LEU 1.252 0.296 11 0 "[ . 1 . 2]"
1 71 GLU 0.980 0.296 11 0 "[ . 1 . 2]"
1 72 ALA 0.306 0.032 6 0 "[ . 1 . 2]"
1 73 GLN 0.446 0.043 7 0 "[ . 1 . 2]"
1 74 ASN 3.928 0.609 9 4 "[ .-* +1 .* 2]"
1 75 LYS 2.839 0.693 11 2 "[ . 1+ . - 2]"
1 76 ILE 0.322 0.038 15 0 "[ . 1 . 2]"
1 77 LYS 3.732 0.609 9 4 "[ .-* +1 .* 2]"
1 78 SER 1.936 0.308 1 0 "[ . 1 . 2]"
1 79 ALA 1.718 0.308 1 0 "[ . 1 . 2]"
1 80 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 TYR 0.047 0.008 16 0 "[ . 1 . 2]"
1 82 ASN 0.170 0.067 12 0 "[ . 1 . 2]"
1 83 LEU 0.062 0.022 20 0 "[ . 1 . 2]"
1 84 SER 1.716 0.171 4 0 "[ . 1 . 2]"
1 85 LEU 2.790 0.171 4 0 "[ . 1 . 2]"
1 86 THR 2.834 0.599 11 2 "[ . 1+ - . 2]"
1 87 LEU 4.788 0.447 10 0 "[ . 1 . 2]"
1 88 GLN 8.393 0.951 5 6 "[ +* - 1* * . * 2]"
1 89 LYS 0.172 0.016 4 0 "[ . 1 . 2]"
1 90 SER 0.005 0.005 10 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 SER H 1 6 SER QB . . 3.560 3.002 2.467 3.474 . 0 0 "[ . 1 . 2]" 1
2 1 6 SER HA 1 7 GLY H . . 3.170 2.617 2.418 2.864 . 0 0 "[ . 1 . 2]" 1
3 1 6 SER HA 1 7 GLY HA3 . . 5.120 4.386 4.351 4.456 . 0 0 "[ . 1 . 2]" 1
4 1 6 SER HA 1 8 MET H . . 4.970 4.361 4.154 4.679 . 0 0 "[ . 1 . 2]" 1
5 1 6 SER QB 1 7 GLY H . . 4.160 2.304 1.933 2.686 . 0 0 "[ . 1 . 2]" 1
6 1 6 SER QB 1 88 GLN HE21 . . 5.110 3.787 2.777 4.373 . 0 0 "[ . 1 . 2]" 1
7 1 6 SER QB 1 88 GLN HG2 . . 4.740 3.835 3.270 4.271 . 0 0 "[ . 1 . 2]" 1
8 1 6 SER QB 1 88 GLN HG3 . . 4.300 4.261 4.143 4.302 0.002 15 0 "[ . 1 . 2]" 1
9 1 7 GLY H 1 8 MET H . . 3.800 1.927 1.898 2.003 . 0 0 "[ . 1 . 2]" 1
10 1 7 GLY H 1 9 SER H . . 4.880 4.805 4.468 4.890 0.010 14 0 "[ . 1 . 2]" 1
11 1 7 GLY H 1 88 GLN HG2 . . 5.330 4.307 3.718 4.680 . 0 0 "[ . 1 . 2]" 1
12 1 7 GLY H 1 89 LYS H . . 5.500 3.992 3.601 4.203 . 0 0 "[ . 1 . 2]" 1
13 1 7 GLY H 1 89 LYS HB2 . . 4.640 3.514 3.295 3.730 . 0 0 "[ . 1 . 2]" 1
14 1 7 GLY H 1 89 LYS HB3 . . 4.840 4.421 4.010 4.815 . 0 0 "[ . 1 . 2]" 1
15 1 7 GLY HA2 1 8 MET QB . . 5.090 4.362 4.235 4.538 . 0 0 "[ . 1 . 2]" 1
16 1 7 GLY HA2 1 89 LYS HB2 . . 5.110 4.753 4.555 5.124 0.014 8 0 "[ . 1 . 2]" 1
17 1 7 GLY HA3 1 8 MET H . . 3.530 2.848 2.805 2.924 . 0 0 "[ . 1 . 2]" 1
18 1 7 GLY HA3 1 8 MET HA . . 5.260 4.677 4.628 4.741 . 0 0 "[ . 1 . 2]" 1
19 1 7 GLY HA3 1 8 MET QB . . 4.640 3.707 3.687 3.749 . 0 0 "[ . 1 . 2]" 1
20 1 7 GLY HA3 1 89 LYS HB2 . . 4.970 3.376 3.154 3.790 . 0 0 "[ . 1 . 2]" 1
21 1 7 GLY HA3 1 89 LYS HB3 . . 5.050 3.411 3.152 3.842 . 0 0 "[ . 1 . 2]" 1
22 1 7 GLY HA3 1 89 LYS QG . . 4.880 4.854 4.697 4.895 0.015 15 0 "[ . 1 . 2]" 1
23 1 8 MET H 1 8 MET QB . . 3.120 2.899 2.808 2.970 . 0 0 "[ . 1 . 2]" 1
24 1 8 MET H 1 8 MET QG . . 4.300 4.129 4.008 4.318 0.018 4 0 "[ . 1 . 2]" 1
25 1 8 MET H 1 9 SER H . . 4.150 3.689 3.471 3.888 . 0 0 "[ . 1 . 2]" 1
26 1 8 MET H 1 88 GLN HG2 . . 5.360 3.887 3.336 4.308 . 0 0 "[ . 1 . 2]" 1
27 1 8 MET H 1 89 LYS H . . 4.580 2.768 2.510 2.994 . 0 0 "[ . 1 . 2]" 1
28 1 8 MET H 1 89 LYS HB2 . . 4.020 1.990 1.942 2.129 . 0 0 "[ . 1 . 2]" 1
29 1 8 MET HA 1 8 MET ME . . 4.820 4.280 3.858 4.429 . 0 0 "[ . 1 . 2]" 1
30 1 8 MET HA 1 9 SER H . . 2.850 2.215 2.202 2.237 . 0 0 "[ . 1 . 2]" 1
31 1 8 MET HA 1 9 SER HB3 . . 4.970 4.885 4.389 5.740 0.770 17 6 "[ ** - 1* * . + 2]" 1
32 1 8 MET HA 1 10 TYR QD . . 5.060 5.053 4.956 5.086 0.026 10 0 "[ . 1 . 2]" 1
33 1 8 MET QB 1 9 SER H . . 3.850 3.824 3.729 3.872 0.022 11 0 "[ . 1 . 2]" 1
34 1 8 MET QB 1 10 TYR QD . . 5.070 3.491 3.298 3.635 . 0 0 "[ . 1 . 2]" 1
35 1 8 MET QB 1 89 LYS H . . 3.930 3.776 3.434 3.941 0.011 6 0 "[ . 1 . 2]" 1
36 1 8 MET QB 1 89 LYS HB2 . . 4.250 2.538 2.241 2.742 . 0 0 "[ . 1 . 2]" 1
37 1 8 MET QB 1 89 LYS QD . . 4.700 3.537 2.527 4.133 . 0 0 "[ . 1 . 2]" 1
38 1 8 MET QB 1 89 LYS QG . . 4.460 2.053 1.896 2.265 . 0 0 "[ . 1 . 2]" 1
39 1 8 MET ME 1 10 TYR HB3 . . 4.680 3.789 2.837 4.589 . 0 0 "[ . 1 . 2]" 1
40 1 8 MET ME 1 10 TYR QD . . 4.780 4.330 3.761 4.701 . 0 0 "[ . 1 . 2]" 1
41 1 8 MET ME 1 89 LYS QE . . 5.060 3.532 2.344 4.745 . 0 0 "[ . 1 . 2]" 1
42 1 8 MET QG 1 9 SER H . . 4.770 3.609 3.267 3.886 . 0 0 "[ . 1 . 2]" 1
43 1 8 MET QG 1 10 TYR QD . . 5.060 4.909 4.582 5.063 0.003 4 0 "[ . 1 . 2]" 1
44 1 9 SER H 1 9 SER HB3 . . 3.350 2.907 2.418 3.643 0.293 8 0 "[ . 1 . 2]" 1
45 1 9 SER H 1 10 TYR H . . 4.970 4.504 4.434 4.567 . 0 0 "[ . 1 . 2]" 1
46 1 9 SER H 1 88 GLN HA . . 5.070 4.702 4.635 4.785 . 0 0 "[ . 1 . 2]" 1
47 1 9 SER HA 1 10 TYR H . . 2.880 2.230 2.215 2.256 . 0 0 "[ . 1 . 2]" 1
48 1 9 SER HA 1 10 TYR QD . . 4.060 2.705 2.593 2.848 . 0 0 "[ . 1 . 2]" 1
49 1 9 SER HA 1 10 TYR QE . . 5.100 4.104 3.990 4.293 . 0 0 "[ . 1 . 2]" 1
50 1 9 SER HA 1 86 THR MG . . 4.880 4.753 4.562 4.895 0.015 11 0 "[ . 1 . 2]" 1
51 1 9 SER HA 1 88 GLN H . . 5.500 4.820 4.738 4.939 . 0 0 "[ . 1 . 2]" 1
52 1 9 SER HA 1 88 GLN HA . . 3.090 2.044 1.978 2.176 . 0 0 "[ . 1 . 2]" 1
53 1 9 SER HA 1 88 GLN HB2 . . 4.410 4.249 4.057 4.395 . 0 0 "[ . 1 . 2]" 1
54 1 9 SER HA 1 88 GLN HG2 . . 4.360 2.323 2.064 2.563 . 0 0 "[ . 1 . 2]" 1
55 1 9 SER HA 1 88 GLN HG3 . . 4.320 3.470 2.571 3.825 . 0 0 "[ . 1 . 2]" 1
56 1 9 SER HA 1 89 LYS H . . 4.020 2.921 2.639 3.232 . 0 0 "[ . 1 . 2]" 1
57 1 9 SER HB2 1 10 TYR H . . 3.600 3.616 3.304 4.054 0.454 6 0 "[ . 1 . 2]" 1
58 1 9 SER HB2 1 10 TYR QD . . 4.990 4.885 4.637 5.142 0.152 6 0 "[ . 1 . 2]" 1
59 1 9 SER HB2 1 86 THR MG . . 3.850 3.767 3.348 4.449 0.599 11 2 "[ . 1+ - . 2]" 1
60 1 9 SER HB2 1 88 GLN HA . . 4.520 3.988 3.531 4.566 0.046 11 0 "[ . 1 . 2]" 1
61 1 9 SER HB2 1 88 GLN HB2 . . 4.920 4.889 4.314 5.871 0.951 5 6 "[ +* - 1* * . * 2]" 1
62 1 9 SER HB3 1 88 GLN HA . . 4.530 3.733 3.189 4.327 . 0 0 "[ . 1 . 2]" 1
63 1 9 SER HB3 1 88 GLN HG2 . . 4.980 2.617 2.123 3.098 . 0 0 "[ . 1 . 2]" 1
64 1 10 TYR H 1 10 TYR QD . . 3.550 2.024 1.950 2.130 . 0 0 "[ . 1 . 2]" 1
65 1 10 TYR H 1 10 TYR QE . . 4.930 3.736 3.704 3.824 . 0 0 "[ . 1 . 2]" 1
66 1 10 TYR H 1 11 SER H . . 5.070 4.422 4.403 4.436 . 0 0 "[ . 1 . 2]" 1
67 1 10 TYR H 1 86 THR MG . . 4.300 3.978 3.643 4.139 . 0 0 "[ . 1 . 2]" 1
68 1 10 TYR H 1 87 LEU H . . 3.700 3.549 3.430 3.627 . 0 0 "[ . 1 . 2]" 1
69 1 10 TYR H 1 87 LEU HB2 . . 4.490 4.028 3.875 4.191 . 0 0 "[ . 1 . 2]" 1
70 1 10 TYR H 1 87 LEU HB3 . . 5.090 4.744 4.568 4.949 . 0 0 "[ . 1 . 2]" 1
71 1 10 TYR H 1 87 LEU MD1 . . 5.280 5.259 5.216 5.303 0.023 15 0 "[ . 1 . 2]" 1
72 1 10 TYR H 1 88 GLN HG3 . . 5.420 5.046 4.128 5.375 . 0 0 "[ . 1 . 2]" 1
73 1 10 TYR HA 1 11 SER H . . 3.020 2.612 2.606 2.616 . 0 0 "[ . 1 . 2]" 1
74 1 10 TYR HA 1 11 SER HA . . 4.950 4.458 4.435 4.480 . 0 0 "[ . 1 . 2]" 1
75 1 10 TYR HA 1 87 LEU H . . 5.070 4.857 4.784 4.952 . 0 0 "[ . 1 . 2]" 1
76 1 10 TYR HB2 1 11 SER H . . 3.290 2.248 2.243 2.256 . 0 0 "[ . 1 . 2]" 1
77 1 10 TYR HB3 1 11 SER H . . 3.630 3.665 3.646 3.691 0.061 20 0 "[ . 1 . 2]" 1
78 1 10 TYR QD 1 11 SER H . . 3.820 3.396 3.301 3.463 . 0 0 "[ . 1 . 2]" 1
79 1 10 TYR QD 1 11 SER HA . . 5.100 3.998 3.873 4.130 . 0 0 "[ . 1 . 2]" 1
80 1 10 TYR QD 1 12 VAL QG . . 3.280 2.817 2.677 2.902 . 0 0 "[ . 1 . 2]" 1
81 1 10 TYR QD 1 49 GLN HB2 . . 5.000 3.583 3.029 4.360 . 0 0 "[ . 1 . 2]" 1
82 1 10 TYR QD 1 49 GLN HB3 . . 4.260 3.028 2.429 3.651 . 0 0 "[ . 1 . 2]" 1
83 1 10 TYR QD 1 87 LEU H . . 5.330 4.111 3.989 4.228 . 0 0 "[ . 1 . 2]" 1
84 1 10 TYR QD 1 87 LEU HB2 . . 4.270 3.459 3.285 3.600 . 0 0 "[ . 1 . 2]" 1
85 1 10 TYR QD 1 87 LEU HB3 . . 4.660 4.464 4.326 4.663 0.003 8 0 "[ . 1 . 2]" 1
86 1 10 TYR QD 1 87 LEU MD1 . . 4.860 4.660 4.524 4.776 . 0 0 "[ . 1 . 2]" 1
87 1 10 TYR QD 1 87 LEU MD2 . . 3.880 3.804 3.666 3.893 0.013 17 0 "[ . 1 . 2]" 1
88 1 10 TYR QD 1 88 GLN HA . . 3.820 3.172 2.789 3.412 . 0 0 "[ . 1 . 2]" 1
89 1 10 TYR QD 1 88 GLN HG2 . . 4.700 4.565 4.334 4.724 0.024 11 0 "[ . 1 . 2]" 1
90 1 10 TYR QD 1 89 LYS H . . 4.250 3.312 3.049 3.700 . 0 0 "[ . 1 . 2]" 1
91 1 10 TYR QD 1 89 LYS HA . . 5.170 4.747 4.486 5.089 . 0 0 "[ . 1 . 2]" 1
92 1 10 TYR QD 1 89 LYS HB2 . . 4.410 4.254 4.085 4.414 0.004 9 0 "[ . 1 . 2]" 1
93 1 10 TYR QD 1 89 LYS QD . . 4.830 4.789 4.613 4.844 0.014 10 0 "[ . 1 . 2]" 1
94 1 10 TYR QD 1 89 LYS QE . . 4.830 4.306 3.971 4.623 . 0 0 "[ . 1 . 2]" 1
95 1 10 TYR QD 1 89 LYS QG . . 3.790 2.862 2.679 2.986 . 0 0 "[ . 1 . 2]" 1
96 1 10 TYR QE 1 12 VAL QG . . 3.160 3.112 2.919 3.198 0.038 10 0 "[ . 1 . 2]" 1
97 1 10 TYR QE 1 49 GLN HB2 . . 4.660 4.233 3.533 4.669 0.009 3 0 "[ . 1 . 2]" 1
98 1 10 TYR QE 1 49 GLN HB3 . . 4.030 3.309 2.750 4.030 . 15 0 "[ . 1 . 2]" 1
99 1 10 TYR QE 1 50 LEU H . . 5.140 5.013 4.579 5.167 0.027 11 0 "[ . 1 . 2]" 1
100 1 10 TYR QE 1 51 SER H . . 5.210 4.152 3.779 4.422 . 0 0 "[ . 1 . 2]" 1
101 1 10 TYR QE 1 87 LEU HB2 . . 3.810 2.820 2.594 3.050 . 0 0 "[ . 1 . 2]" 1
102 1 10 TYR QE 1 87 LEU HB3 . . 3.970 3.245 3.005 3.560 . 0 0 "[ . 1 . 2]" 1
103 1 10 TYR QE 1 87 LEU MD2 . . 3.160 2.275 2.030 2.519 . 0 0 "[ . 1 . 2]" 1
104 1 10 TYR QE 1 87 LEU HG . . 5.000 4.614 4.340 4.906 . 0 0 "[ . 1 . 2]" 1
105 1 10 TYR QE 1 88 GLN HA . . 5.060 3.147 2.671 3.440 . 0 0 "[ . 1 . 2]" 1
106 1 10 TYR QE 1 88 GLN HG2 . . 5.200 4.915 4.565 5.160 . 0 0 "[ . 1 . 2]" 1
107 1 10 TYR QE 1 89 LYS H . . 4.190 2.909 2.576 3.371 . 0 0 "[ . 1 . 2]" 1
108 1 10 TYR QE 1 89 LYS HA . . 3.420 2.810 2.465 3.259 . 0 0 "[ . 1 . 2]" 1
109 1 10 TYR QE 1 89 LYS HB2 . . 4.080 3.968 3.810 4.076 . 0 0 "[ . 1 . 2]" 1
110 1 10 TYR QE 1 89 LYS QD . . 4.260 3.654 2.830 4.240 . 0 0 "[ . 1 . 2]" 1
111 1 10 TYR QE 1 89 LYS QE . . 4.280 3.690 2.492 4.296 0.016 4 0 "[ . 1 . 2]" 1
112 1 10 TYR QE 1 89 LYS QG . . 3.530 2.009 1.948 2.166 . 0 0 "[ . 1 . 2]" 1
113 1 10 TYR QE 1 90 SER H . . 5.470 4.732 4.309 5.314 . 0 0 "[ . 1 . 2]" 1
114 1 11 SER H 1 11 SER HB2 . . 3.920 3.599 2.786 3.845 . 0 0 "[ . 1 . 2]" 1
115 1 11 SER H 1 11 SER HB3 . . 3.540 3.498 3.238 3.919 0.379 12 0 "[ . 1 . 2]" 1
116 1 11 SER H 1 12 VAL QG . . 5.160 3.960 3.868 4.039 . 0 0 "[ . 1 . 2]" 1
117 1 11 SER H 1 86 THR HA . . 4.810 4.542 4.483 4.625 . 0 0 "[ . 1 . 2]" 1
118 1 11 SER H 1 86 THR MG . . 4.840 4.468 4.369 4.654 . 0 0 "[ . 1 . 2]" 1
119 1 11 SER H 1 87 LEU H . . 4.900 4.436 4.367 4.503 . 0 0 "[ . 1 . 2]" 1
120 1 11 SER H 1 87 LEU MD1 . . 5.500 5.516 5.498 5.532 0.032 10 0 "[ . 1 . 2]" 1
121 1 11 SER HA 1 12 VAL H . . 2.790 2.493 2.412 2.574 . 0 0 "[ . 1 . 2]" 1
122 1 11 SER HA 1 12 VAL QG . . 4.080 3.158 3.083 3.376 . 0 0 "[ . 1 . 2]" 1
123 1 11 SER HA 1 86 THR H . . 5.410 4.570 4.517 4.629 . 0 0 "[ . 1 . 2]" 1
124 1 11 SER HA 1 86 THR HA . . 3.140 1.996 1.974 2.051 . 0 0 "[ . 1 . 2]" 1
125 1 11 SER HA 1 86 THR HB . . 5.190 5.042 5.012 5.105 . 0 0 "[ . 1 . 2]" 1
126 1 11 SER HA 1 86 THR MG . . 4.040 3.349 3.216 3.481 . 0 0 "[ . 1 . 2]" 1
127 1 11 SER HA 1 87 LEU H . . 3.830 2.388 2.276 2.496 . 0 0 "[ . 1 . 2]" 1
128 1 11 SER HA 1 87 LEU HB2 . . 4.810 4.016 3.873 4.184 . 0 0 "[ . 1 . 2]" 1
129 1 11 SER HA 1 87 LEU MD1 . . 3.800 3.197 3.147 3.252 . 0 0 "[ . 1 . 2]" 1
130 1 11 SER HA 1 87 LEU MD2 . . 4.400 4.405 4.332 4.435 0.035 5 0 "[ . 1 . 2]" 1
131 1 11 SER HB2 1 12 VAL H . . 3.310 2.722 2.414 3.542 0.232 12 0 "[ . 1 . 2]" 1
132 1 11 SER HB2 1 86 THR MG . . 4.560 3.876 3.525 4.357 . 0 0 "[ . 1 . 2]" 1
133 1 11 SER HB2 1 87 LEU H . . 4.930 4.832 4.531 5.377 0.447 10 0 "[ . 1 . 2]" 1
134 1 11 SER HB3 1 12 VAL H . . 4.170 3.466 2.337 3.842 . 0 0 "[ . 1 . 2]" 1
135 1 11 SER HB3 1 12 VAL QG . . 5.210 4.780 4.312 4.970 . 0 0 "[ . 1 . 2]" 1
136 1 11 SER HB3 1 86 THR MG . . 4.690 2.636 2.000 3.704 . 0 0 "[ . 1 . 2]" 1
137 1 12 VAL H 1 12 VAL HB . . 3.510 2.742 2.619 2.826 . 0 0 "[ . 1 . 2]" 1
138 1 12 VAL H 1 12 VAL QG . . 3.650 2.629 2.488 2.821 . 0 0 "[ . 1 . 2]" 1
139 1 12 VAL H 1 85 LEU H . . 3.840 2.375 2.307 2.476 . 0 0 "[ . 1 . 2]" 1
140 1 12 VAL H 1 85 LEU HB2 . . 4.370 3.565 3.343 3.769 . 0 0 "[ . 1 . 2]" 1
141 1 12 VAL H 1 85 LEU HB3 . . 4.970 4.793 4.628 4.988 0.018 7 0 "[ . 1 . 2]" 1
142 1 12 VAL H 1 85 LEU MD1 . . 5.500 4.905 4.684 5.153 . 0 0 "[ . 1 . 2]" 1
143 1 12 VAL H 1 86 THR HA . . 4.430 3.575 3.474 3.666 . 0 0 "[ . 1 . 2]" 1
144 1 12 VAL H 1 87 LEU MD1 . . 4.030 3.633 3.462 3.794 . 0 0 "[ . 1 . 2]" 1
145 1 12 VAL H 1 87 LEU MD2 . . 4.690 4.496 4.273 4.689 . 0 0 "[ . 1 . 2]" 1
146 1 12 VAL HA 1 13 THR H . . 2.850 2.273 2.223 2.342 . 0 0 "[ . 1 . 2]" 1
147 1 12 VAL HA 1 13 THR HB . . 4.660 4.482 4.354 4.559 . 0 0 "[ . 1 . 2]" 1
148 1 12 VAL HB 1 13 THR H . . 3.990 3.922 3.753 4.008 0.018 3 0 "[ . 1 . 2]" 1
149 1 12 VAL HB 1 50 LEU MD2 . . 3.610 2.827 1.966 3.612 0.002 7 0 "[ . 1 . 2]" 1
150 1 12 VAL HB 1 84 SER HA . . 4.740 4.585 4.317 4.711 . 0 0 "[ . 1 . 2]" 1
151 1 12 VAL HB 1 85 LEU H . . 5.060 3.425 3.186 3.612 . 0 0 "[ . 1 . 2]" 1
152 1 12 VAL HB 1 85 LEU HB2 . . 3.960 2.951 2.715 3.077 . 0 0 "[ . 1 . 2]" 1
153 1 12 VAL HB 1 85 LEU HB3 . . 4.740 4.674 4.402 4.780 0.040 3 0 "[ . 1 . 2]" 1
154 1 12 VAL HB 1 85 LEU MD1 . . 4.420 3.419 3.135 3.641 . 0 0 "[ . 1 . 2]" 1
155 1 12 VAL HB 1 87 LEU MD1 . . 4.050 3.977 3.798 4.066 0.016 10 0 "[ . 1 . 2]" 1
156 1 12 VAL QG 1 13 THR H . . 3.510 2.182 1.918 2.528 . 0 0 "[ . 1 . 2]" 1
157 1 12 VAL QG 1 13 THR HA . . 4.970 3.950 3.738 4.124 . 0 0 "[ . 1 . 2]" 1
158 1 12 VAL QG 1 14 LEU HG . . 4.110 2.377 1.975 2.770 . 0 0 "[ . 1 . 2]" 1
159 1 12 VAL QG 1 48 SER HB2 . . 2.910 1.981 1.798 2.280 . 0 0 "[ . 1 . 2]" 1
160 1 12 VAL QG 1 48 SER HB3 . . 3.790 2.887 1.865 3.385 . 0 0 "[ . 1 . 2]" 1
161 1 12 VAL QG 1 49 GLN H . . 4.030 2.056 1.838 2.979 . 0 0 "[ . 1 . 2]" 1
162 1 12 VAL QG 1 49 GLN HB2 . . 4.330 2.302 1.916 2.730 . 0 0 "[ . 1 . 2]" 1
163 1 12 VAL QG 1 49 GLN HB3 . . 4.350 3.115 2.742 3.611 . 0 0 "[ . 1 . 2]" 1
164 1 12 VAL QG 1 49 GLN HG2 . . 4.550 4.316 4.035 4.680 0.130 10 0 "[ . 1 . 2]" 1
165 1 12 VAL QG 1 49 GLN HG3 . . 4.900 3.740 3.453 4.170 . 0 0 "[ . 1 . 2]" 1
166 1 12 VAL QG 1 50 LEU H . . 4.160 2.399 1.779 3.046 . 0 0 "[ . 1 . 2]" 1
167 1 12 VAL QG 1 50 LEU HA . . 4.560 2.912 2.665 3.297 . 0 0 "[ . 1 . 2]" 1
168 1 12 VAL QG 1 50 LEU QB . . 3.420 2.554 1.773 3.265 . 0 0 "[ . 1 . 2]" 1
169 1 12 VAL QG 1 50 LEU MD2 . . 2.930 2.036 1.604 2.666 . 0 0 "[ . 1 . 2]" 1
170 1 12 VAL QG 1 50 LEU HG . . 3.690 2.321 1.715 3.701 0.011 10 0 "[ . 1 . 2]" 1
171 1 12 VAL QG 1 85 LEU H . . 4.350 3.891 3.766 3.957 . 0 0 "[ . 1 . 2]" 1
172 1 12 VAL QG 1 85 LEU HB2 . . 3.880 3.247 3.192 3.319 . 0 0 "[ . 1 . 2]" 1
173 1 12 VAL QG 1 85 LEU HB3 . . 4.360 4.370 4.321 4.396 0.036 10 0 "[ . 1 . 2]" 1
174 1 12 VAL QG 1 85 LEU MD1 . . 3.670 3.543 3.303 3.689 0.019 16 0 "[ . 1 . 2]" 1
175 1 12 VAL QG 1 87 LEU MD1 . . 3.400 2.735 2.532 2.907 . 0 0 "[ . 1 . 2]" 1
176 1 13 THR H 1 13 THR HB . . 3.350 2.534 2.423 2.697 . 0 0 "[ . 1 . 2]" 1
177 1 13 THR H 1 13 THR MG . . 4.460 3.820 3.771 3.894 . 0 0 "[ . 1 . 2]" 1
178 1 13 THR H 1 14 LEU H . . 5.060 4.054 3.873 4.298 . 0 0 "[ . 1 . 2]" 1
179 1 13 THR H 1 14 LEU HG . . 5.370 4.169 3.788 4.683 . 0 0 "[ . 1 . 2]" 1
180 1 13 THR H 1 84 SER HA . . 5.200 4.881 4.785 4.942 . 0 0 "[ . 1 . 2]" 1
181 1 13 THR HA 1 13 THR MG . . 3.390 2.315 2.265 2.394 . 0 0 "[ . 1 . 2]" 1
182 1 13 THR HA 1 14 LEU H . . 3.010 2.203 2.158 2.223 . 0 0 "[ . 1 . 2]" 1
183 1 13 THR HA 1 14 LEU HG . . 4.660 4.044 3.635 4.622 . 0 0 "[ . 1 . 2]" 1
184 1 13 THR HA 1 82 ASN HB2 . . 5.140 4.731 4.082 5.207 0.067 12 0 "[ . 1 . 2]" 1
185 1 13 THR HA 1 84 SER H . . 5.360 4.747 4.659 4.833 . 0 0 "[ . 1 . 2]" 1
186 1 13 THR HA 1 84 SER HA . . 3.230 2.557 2.432 2.684 . 0 0 "[ . 1 . 2]" 1
187 1 13 THR HA 1 84 SER HB2 . . 5.010 4.807 4.662 5.016 0.006 20 0 "[ . 1 . 2]" 1
188 1 13 THR HA 1 84 SER HB3 . . 4.940 4.715 4.434 4.972 0.032 4 0 "[ . 1 . 2]" 1
189 1 13 THR HA 1 85 LEU H . . 4.190 4.055 3.917 4.198 0.008 10 0 "[ . 1 . 2]" 1
190 1 13 THR HB 1 14 LEU H . . 4.760 4.571 4.507 4.619 . 0 0 "[ . 1 . 2]" 1
191 1 13 THR MG 1 14 LEU H . . 3.710 3.402 3.066 3.538 . 0 0 "[ . 1 . 2]" 1
192 1 13 THR MG 1 82 ASN HB2 . . 3.830 3.227 2.551 3.826 . 0 0 "[ . 1 . 2]" 1
193 1 13 THR MG 1 82 ASN HB3 . . 3.620 3.215 2.541 3.637 0.017 9 0 "[ . 1 . 2]" 1
194 1 13 THR MG 1 82 ASN HD21 . . 4.330 3.564 2.348 4.014 . 0 0 "[ . 1 . 2]" 1
195 1 13 THR MG 1 82 ASN HD22 . . 5.000 4.552 3.455 4.975 . 0 0 "[ . 1 . 2]" 1
196 1 13 THR MG 1 83 LEU H . . 4.350 4.176 3.729 4.372 0.022 20 0 "[ . 1 . 2]" 1
197 1 13 THR MG 1 84 SER H . . 5.110 4.968 4.839 5.115 0.005 18 0 "[ . 1 . 2]" 1
198 1 14 LEU H 1 14 LEU QB . . 3.490 2.501 2.215 2.700 . 0 0 "[ . 1 . 2]" 1
199 1 14 LEU H 1 14 LEU MD1 . . 4.280 3.774 3.424 4.208 . 0 0 "[ . 1 . 2]" 1
200 1 14 LEU H 1 14 LEU MD2 . . 4.650 3.611 3.196 3.924 . 0 0 "[ . 1 . 2]" 1
201 1 14 LEU H 1 14 LEU HG . . 4.180 2.619 2.238 3.036 . 0 0 "[ . 1 . 2]" 1
202 1 14 LEU H 1 15 THR H . . 5.440 4.191 3.958 4.565 . 0 0 "[ . 1 . 2]" 1
203 1 14 LEU H 1 83 LEU H . . 3.920 3.088 2.865 3.328 . 0 0 "[ . 1 . 2]" 1
204 1 14 LEU H 1 83 LEU HA . . 5.360 4.821 4.661 5.006 . 0 0 "[ . 1 . 2]" 1
205 1 14 LEU H 1 83 LEU HB3 . . 4.590 3.885 3.425 4.192 . 0 0 "[ . 1 . 2]" 1
206 1 14 LEU H 1 84 SER H . . 5.450 4.629 4.341 4.896 . 0 0 "[ . 1 . 2]" 1
207 1 14 LEU H 1 84 SER HA . . 4.250 3.130 2.827 3.420 . 0 0 "[ . 1 . 2]" 1
208 1 14 LEU H 1 85 LEU H . . 5.470 4.732 4.456 4.986 . 0 0 "[ . 1 . 2]" 1
209 1 14 LEU H 1 85 LEU MD1 . . 5.170 4.658 4.328 4.907 . 0 0 "[ . 1 . 2]" 1
210 1 14 LEU HA 1 15 THR H . . 3.260 2.231 2.177 2.350 . 0 0 "[ . 1 . 2]" 1
211 1 14 LEU QB 1 20 TRP HE3 . . 4.510 2.373 2.168 2.631 . 0 0 "[ . 1 . 2]" 1
212 1 14 LEU QB 1 20 TRP HZ3 . . 5.170 1.974 1.847 2.078 . 0 0 "[ . 1 . 2]" 1
213 1 14 LEU QB 1 44 LYS HB3 . . 5.100 3.442 2.603 4.390 . 0 0 "[ . 1 . 2]" 1
214 1 14 LEU QB 1 83 LEU H . . 4.440 3.310 3.011 3.674 . 0 0 "[ . 1 . 2]" 1
215 1 14 LEU QB 1 83 LEU HB3 . . 4.190 2.527 2.143 2.929 . 0 0 "[ . 1 . 2]" 1
216 1 14 LEU QB 1 83 LEU MD2 . . 4.790 2.811 2.055 3.293 . 0 0 "[ . 1 . 2]" 1
217 1 14 LEU MD1 1 20 TRP HB2 . . 4.520 4.507 4.318 4.544 0.024 11 0 "[ . 1 . 2]" 1
218 1 14 LEU MD1 1 20 TRP HB3 . . 3.880 3.004 2.796 3.063 . 0 0 "[ . 1 . 2]" 1
219 1 14 LEU MD1 1 20 TRP HE3 . . 4.090 2.341 2.101 2.620 . 0 0 "[ . 1 . 2]" 1
220 1 14 LEU MD1 1 45 ALA H . . 5.040 4.059 3.270 4.686 . 0 0 "[ . 1 . 2]" 1
221 1 14 LEU MD1 1 45 ALA HA . . 4.530 2.985 2.100 3.489 . 0 0 "[ . 1 . 2]" 1
222 1 14 LEU MD1 1 83 LEU MD2 . . 4.200 2.510 1.904 2.975 . 0 0 "[ . 1 . 2]" 1
223 1 14 LEU MD1 1 85 LEU MD1 . . 4.150 2.235 1.894 2.671 . 0 0 "[ . 1 . 2]" 1
224 1 14 LEU MD2 1 15 THR H . . 4.540 3.916 3.593 4.316 . 0 0 "[ . 1 . 2]" 1
225 1 14 LEU MD2 1 20 TRP HE3 . . 4.910 3.880 3.265 4.210 . 0 0 "[ . 1 . 2]" 1
226 1 14 LEU MD2 1 44 LYS HA . . 4.990 4.089 3.630 4.785 . 0 0 "[ . 1 . 2]" 1
227 1 14 LEU MD2 1 44 LYS HB2 . . 4.360 3.448 2.746 4.174 . 0 0 "[ . 1 . 2]" 1
228 1 14 LEU MD2 1 44 LYS HB3 . . 3.870 2.172 1.790 2.859 . 0 0 "[ . 1 . 2]" 1
229 1 14 LEU MD2 1 44 LYS HD3 . . 4.360 2.743 2.103 4.291 . 0 0 "[ . 1 . 2]" 1
230 1 14 LEU MD2 1 45 ALA HA . . 3.370 2.698 2.091 3.130 . 0 0 "[ . 1 . 2]" 1
231 1 14 LEU MD2 1 48 SER H . . 4.820 4.345 3.596 4.825 0.005 5 0 "[ . 1 . 2]" 1
232 1 14 LEU MD2 1 48 SER HB2 . . 3.970 2.868 2.431 3.898 . 0 0 "[ . 1 . 2]" 1
233 1 14 LEU MD2 1 48 SER HB3 . . 3.630 2.373 1.825 3.250 . 0 0 "[ . 1 . 2]" 1
234 1 15 THR H 1 15 THR HB . . 3.490 2.376 2.187 2.582 . 0 0 "[ . 1 . 2]" 1
235 1 15 THR H 1 15 THR MG . . 4.080 3.681 3.647 3.785 . 0 0 "[ . 1 . 2]" 1
236 1 15 THR HA 1 15 THR MG . . 3.400 2.379 2.155 2.545 . 0 0 "[ . 1 . 2]" 1
237 1 15 THR HA 1 16 GLY H . . 3.010 2.201 2.155 2.271 . 0 0 "[ . 1 . 2]" 1
238 1 15 THR HA 1 16 GLY HA2 . . 4.920 4.358 4.351 4.372 . 0 0 "[ . 1 . 2]" 1
239 1 15 THR HA 1 82 ASN HA . . 3.800 2.152 2.013 2.438 . 0 0 "[ . 1 . 2]" 1
240 1 15 THR HA 1 82 ASN HB3 . . 4.480 2.815 2.339 3.105 . 0 0 "[ . 1 . 2]" 1
241 1 15 THR HA 1 82 ASN HD21 . . 5.500 3.882 1.954 5.270 . 0 0 "[ . 1 . 2]" 1
242 1 15 THR HB 1 16 GLY H . . 4.330 4.237 4.034 4.353 0.023 14 0 "[ . 1 . 2]" 1
243 1 15 THR MG 1 16 GLY H . . 3.790 2.595 2.374 2.886 . 0 0 "[ . 1 . 2]" 1
244 1 15 THR MG 1 16 GLY HA2 . . 5.130 4.117 3.816 4.475 . 0 0 "[ . 1 . 2]" 1
245 1 15 THR MG 1 81 TYR QB . . 5.220 4.665 4.247 5.066 . 0 0 "[ . 1 . 2]" 1
246 1 15 THR MG 1 82 ASN HB3 . . 5.160 3.755 3.202 4.575 . 0 0 "[ . 1 . 2]" 1
247 1 15 THR MG 1 82 ASN HD21 . . 5.500 3.897 1.929 5.295 . 0 0 "[ . 1 . 2]" 1
248 1 16 GLY H 1 17 PRO HA . . 4.610 4.499 4.243 4.535 . 0 0 "[ . 1 . 2]" 1
249 1 16 GLY H 1 20 TRP HH2 . . 4.470 2.679 2.509 2.877 . 0 0 "[ . 1 . 2]" 1
250 1 16 GLY H 1 20 TRP HZ3 . . 5.500 4.429 4.168 4.660 . 0 0 "[ . 1 . 2]" 1
251 1 16 GLY H 1 81 TYR QD . . 4.980 4.860 4.517 4.988 0.008 16 0 "[ . 1 . 2]" 1
252 1 16 GLY H 1 82 ASN H . . 5.500 4.309 4.124 4.604 . 0 0 "[ . 1 . 2]" 1
253 1 16 GLY H 1 82 ASN HA . . 3.670 2.174 1.944 2.542 . 0 0 "[ . 1 . 2]" 1
254 1 16 GLY H 1 82 ASN HB3 . . 4.950 4.040 3.312 4.535 . 0 0 "[ . 1 . 2]" 1
255 1 16 GLY H 1 83 LEU H . . 5.270 4.078 3.681 4.645 . 0 0 "[ . 1 . 2]" 1
256 1 16 GLY HA2 1 18 GLY H . . 4.980 2.743 2.468 3.991 . 0 0 "[ . 1 . 2]" 1
257 1 16 GLY HA2 1 20 TRP HH2 . . 4.080 2.359 2.127 2.559 . 0 0 "[ . 1 . 2]" 1
258 1 16 GLY HA2 1 20 TRP HZ2 . . 4.420 3.513 3.356 3.712 . 0 0 "[ . 1 . 2]" 1
259 1 16 GLY HA2 1 20 TRP HZ3 . . 4.470 3.620 3.444 3.771 . 0 0 "[ . 1 . 2]" 1
260 1 16 GLY HA3 1 17 PRO HA . . 3.530 2.408 1.984 2.498 . 0 0 "[ . 1 . 2]" 1
261 1 16 GLY HA3 1 18 GLY H . . 5.210 3.770 3.408 4.222 . 0 0 "[ . 1 . 2]" 1
262 1 16 GLY HA3 1 20 TRP HH2 . . 4.370 2.297 2.123 2.432 . 0 0 "[ . 1 . 2]" 1
263 1 16 GLY HA3 1 20 TRP HZ2 . . 5.060 2.827 2.684 2.966 . 0 0 "[ . 1 . 2]" 1
264 1 17 PRO HA 1 18 GLY H . . 3.460 2.257 2.185 2.625 . 0 0 "[ . 1 . 2]" 1
265 1 17 PRO HA 1 20 TRP HZ2 . . 4.940 3.598 3.300 3.775 . 0 0 "[ . 1 . 2]" 1
266 1 17 PRO HB2 1 18 GLY H . . 4.260 3.228 2.274 3.490 . 0 0 "[ . 1 . 2]" 1
267 1 17 PRO HB3 1 18 GLY H . . 3.810 3.693 3.206 3.856 0.046 9 0 "[ . 1 . 2]" 1
268 1 17 PRO HG3 1 18 GLY H . . 5.500 5.513 4.921 5.650 0.150 9 0 "[ . 1 . 2]" 1
269 1 18 GLY H 1 19 PRO HA . . 5.160 2.430 2.137 4.072 . 0 0 "[ . 1 . 2]" 1
270 1 18 GLY H 1 20 TRP HZ2 . . 4.890 3.700 3.412 3.883 . 0 0 "[ . 1 . 2]" 1
271 1 19 PRO HA 1 20 TRP HD1 . . 5.110 4.916 4.560 5.090 . 0 0 "[ . 1 . 2]" 1
272 1 19 PRO HA 1 21 GLY H . . 5.490 5.396 5.361 5.545 0.055 5 0 "[ . 1 . 2]" 1
273 1 19 PRO HB2 1 20 TRP H . . 4.410 2.540 2.532 2.546 . 0 0 "[ . 1 . 2]" 1
274 1 19 PRO HB2 1 21 GLY H . . 4.590 4.653 4.438 4.693 0.103 1 0 "[ . 1 . 2]" 1
275 1 19 PRO HB3 1 20 TRP H . . 4.750 3.317 3.312 3.319 . 0 0 "[ . 1 . 2]" 1
276 1 20 TRP H 1 20 TRP HD1 . . 4.590 3.065 2.785 3.618 . 0 0 "[ . 1 . 2]" 1
277 1 20 TRP H 1 21 GLY H . . 4.430 4.176 4.058 4.190 . 0 0 "[ . 1 . 2]" 1
278 1 20 TRP HB2 1 20 TRP HD1 . . 3.730 2.627 2.603 2.678 . 0 0 "[ . 1 . 2]" 1
279 1 20 TRP HB2 1 21 GLY H . . 4.780 4.302 4.248 4.493 . 0 0 "[ . 1 . 2]" 1
280 1 20 TRP HB2 1 22 PHE H . . 4.470 3.388 3.174 3.651 . 0 0 "[ . 1 . 2]" 1
281 1 20 TRP HB2 1 22 PHE QD . . 4.190 3.287 2.870 3.623 . 0 0 "[ . 1 . 2]" 1
282 1 20 TRP HB2 1 22 PHE QE . . 3.960 3.093 2.739 3.403 . 0 0 "[ . 1 . 2]" 1
283 1 20 TRP HB3 1 21 GLY H . . 5.030 4.046 3.950 4.079 . 0 0 "[ . 1 . 2]" 1
284 1 20 TRP HB3 1 22 PHE H . . 5.140 3.914 3.531 4.141 . 0 0 "[ . 1 . 2]" 1
285 1 20 TRP HB3 1 22 PHE QD . . 3.990 2.314 1.999 2.568 . 0 0 "[ . 1 . 2]" 1
286 1 20 TRP HB3 1 22 PHE QE . . 3.710 2.017 1.994 2.112 . 0 0 "[ . 1 . 2]" 1
287 1 20 TRP HB3 1 45 ALA MB . . 4.590 4.390 4.130 4.600 0.010 17 0 "[ . 1 . 2]" 1
288 1 20 TRP HB3 1 83 LEU MD2 . . 5.170 2.588 2.358 3.170 . 0 0 "[ . 1 . 2]" 1
289 1 20 TRP HD1 1 76 ILE HB . . 4.360 4.315 4.181 4.365 0.005 12 0 "[ . 1 . 2]" 1
290 1 20 TRP HD1 1 76 ILE MD . . 4.530 4.215 4.086 4.382 . 0 0 "[ . 1 . 2]" 1
291 1 20 TRP HD1 1 76 ILE MG . . 3.530 2.014 1.906 2.185 . 0 0 "[ . 1 . 2]" 1
292 1 20 TRP HD1 1 83 LEU MD2 . . 4.580 3.292 3.072 3.910 . 0 0 "[ . 1 . 2]" 1
293 1 20 TRP HE1 1 76 ILE MG . . 4.260 2.897 2.665 3.123 . 0 0 "[ . 1 . 2]" 1
294 1 20 TRP HE1 1 79 ALA MB . . 4.430 3.805 3.480 4.169 . 0 0 "[ . 1 . 2]" 1
295 1 20 TRP HE1 1 83 LEU MD2 . . 5.500 3.334 3.139 3.904 . 0 0 "[ . 1 . 2]" 1
296 1 20 TRP HE3 1 44 LYS HB2 . . 4.910 4.332 3.588 4.933 0.023 10 0 "[ . 1 . 2]" 1
297 1 20 TRP HE3 1 44 LYS HB3 . . 4.930 4.549 3.921 4.945 0.015 5 0 "[ . 1 . 2]" 1
298 1 20 TRP HH2 1 79 ALA MB . . 4.890 4.302 3.945 4.664 . 0 0 "[ . 1 . 2]" 1
299 1 20 TRP HH2 1 82 ASN HA . . 4.270 3.134 2.702 3.561 . 0 0 "[ . 1 . 2]" 1
300 1 20 TRP HH2 1 83 LEU H . . 5.060 3.300 2.907 3.621 . 0 0 "[ . 1 . 2]" 1
301 1 20 TRP HZ2 1 79 ALA MB . . 3.620 3.091 2.633 3.421 . 0 0 "[ . 1 . 2]" 1
302 1 20 TRP HZ2 1 82 ASN HA . . 4.980 4.801 4.248 4.993 0.013 5 0 "[ . 1 . 2]" 1
303 1 20 TRP HZ2 1 83 LEU H . . 5.460 4.862 4.413 5.281 . 0 0 "[ . 1 . 2]" 1
304 1 20 TRP HZ2 1 83 LEU HB2 . . 4.280 3.208 2.994 3.389 . 0 0 "[ . 1 . 2]" 1
305 1 20 TRP HZ2 1 83 LEU HB3 . . 4.990 3.783 3.336 4.360 . 0 0 "[ . 1 . 2]" 1
306 1 20 TRP HZ2 1 83 LEU MD1 . . 4.880 4.638 4.231 4.847 . 0 0 "[ . 1 . 2]" 1
307 1 20 TRP HZ2 1 83 LEU MD2 . . 4.980 3.760 3.480 4.113 . 0 0 "[ . 1 . 2]" 1
308 1 21 GLY H 1 22 PHE H . . 3.520 3.447 3.103 3.580 0.060 5 0 "[ . 1 . 2]" 1
309 1 21 GLY H 1 45 ALA MB . . 4.730 3.254 2.676 3.613 . 0 0 "[ . 1 . 2]" 1
310 1 21 GLY HA3 1 45 ALA MB . . 5.040 3.895 3.261 4.247 . 0 0 "[ . 1 . 2]" 1
311 1 22 PHE H 1 45 ALA MB . . 4.840 3.994 3.652 4.299 . 0 0 "[ . 1 . 2]" 1
312 1 22 PHE HA 1 23 ARG H . . 3.010 2.240 2.214 2.326 . 0 0 "[ . 1 . 2]" 1
313 1 22 PHE HA 1 23 ARG QG . . 4.230 3.927 3.709 4.200 . 0 0 "[ . 1 . 2]" 1
314 1 22 PHE HA 1 36 ILE MG . . 4.570 4.048 3.801 4.300 . 0 0 "[ . 1 . 2]" 1
315 1 22 PHE HA 1 38 ARG H . . 4.920 4.250 4.079 4.425 . 0 0 "[ . 1 . 2]" 1
316 1 22 PHE HA 1 39 ILE HA . . 3.340 2.303 2.184 2.429 . 0 0 "[ . 1 . 2]" 1
317 1 22 PHE HA 1 39 ILE MD . . 4.800 4.613 4.107 4.807 0.007 11 0 "[ . 1 . 2]" 1
318 1 22 PHE HA 1 39 ILE HG12 . . 4.180 3.072 2.440 3.272 . 0 0 "[ . 1 . 2]" 1
319 1 22 PHE HA 1 39 ILE HG13 . . 5.060 3.627 3.327 3.945 . 0 0 "[ . 1 . 2]" 1
320 1 22 PHE HA 1 39 ILE MG . . 4.740 3.829 3.262 4.110 . 0 0 "[ . 1 . 2]" 1
321 1 22 PHE HA 1 40 THR H . . 4.150 3.628 3.496 3.829 . 0 0 "[ . 1 . 2]" 1
322 1 22 PHE HA 1 45 ALA MB . . 4.680 3.769 3.362 4.161 . 0 0 "[ . 1 . 2]" 1
323 1 22 PHE HB2 1 23 ARG H . . 3.440 3.328 3.027 3.451 0.011 5 0 "[ . 1 . 2]" 1
324 1 22 PHE HB2 1 36 ILE MD . . 4.390 3.216 2.907 3.469 . 0 0 "[ . 1 . 2]" 1
325 1 22 PHE HB2 1 36 ILE MG . . 3.380 2.773 2.623 3.046 . 0 0 "[ . 1 . 2]" 1
326 1 22 PHE HB2 1 39 ILE HA . . 4.320 3.568 3.280 4.191 . 0 0 "[ . 1 . 2]" 1
327 1 22 PHE HB2 1 39 ILE MD . . 4.280 3.413 3.275 3.505 . 0 0 "[ . 1 . 2]" 1
328 1 22 PHE HB2 1 39 ILE HG12 . . 3.450 2.155 1.993 2.400 . 0 0 "[ . 1 . 2]" 1
329 1 22 PHE HB2 1 39 ILE HG13 . . 4.730 3.147 2.745 3.654 . 0 0 "[ . 1 . 2]" 1
330 1 22 PHE HB2 1 39 ILE MG . . 4.760 3.848 3.320 4.034 . 0 0 "[ . 1 . 2]" 1
331 1 22 PHE HB2 1 45 ALA MB . . 4.080 3.008 2.686 3.263 . 0 0 "[ . 1 . 2]" 1
332 1 22 PHE HB2 1 50 LEU MD1 . . 4.660 3.469 2.514 4.393 . 0 0 "[ . 1 . 2]" 1
333 1 22 PHE HB3 1 36 ILE MD . . 4.770 4.340 4.024 4.570 . 0 0 "[ . 1 . 2]" 1
334 1 22 PHE HB3 1 39 ILE HA . . 4.370 3.752 3.452 4.370 . 0 0 "[ . 1 . 2]" 1
335 1 22 PHE HB3 1 39 ILE MD . . 4.040 4.038 3.913 4.065 0.025 15 0 "[ . 1 . 2]" 1
336 1 22 PHE HB3 1 39 ILE HG12 . . 3.600 2.776 2.494 3.147 . 0 0 "[ . 1 . 2]" 1
337 1 22 PHE HB3 1 39 ILE MG . . 4.420 3.465 2.836 3.744 . 0 0 "[ . 1 . 2]" 1
338 1 22 PHE HB3 1 40 THR H . . 5.220 4.495 4.119 5.064 . 0 0 "[ . 1 . 2]" 1
339 1 22 PHE HB3 1 45 ALA MB . . 3.520 2.068 1.864 2.339 . 0 0 "[ . 1 . 2]" 1
340 1 22 PHE HB3 1 50 LEU MD1 . . 4.240 3.257 2.428 4.013 . 0 0 "[ . 1 . 2]" 1
341 1 22 PHE QD 1 23 ARG H . . 4.410 3.410 3.034 3.674 . 0 0 "[ . 1 . 2]" 1
342 1 22 PHE QD 1 24 LEU H . . 5.160 4.691 4.504 5.053 . 0 0 "[ . 1 . 2]" 1
343 1 22 PHE QD 1 24 LEU HG . . 4.150 3.413 3.099 3.637 . 0 0 "[ . 1 . 2]" 1
344 1 22 PHE QD 1 36 ILE HA . . 4.860 3.913 3.717 4.181 . 0 0 "[ . 1 . 2]" 1
345 1 22 PHE QD 1 36 ILE MD . . 3.690 2.766 2.357 3.088 . 0 0 "[ . 1 . 2]" 1
346 1 22 PHE QD 1 36 ILE MG . . 3.410 3.193 2.861 3.421 0.011 17 0 "[ . 1 . 2]" 1
347 1 22 PHE QD 1 37 SER H . . 5.500 4.519 4.207 4.822 . 0 0 "[ . 1 . 2]" 1
348 1 22 PHE QD 1 39 ILE MD . . 4.890 4.703 4.321 4.813 . 0 0 "[ . 1 . 2]" 1
349 1 22 PHE QD 1 45 ALA MB . . 3.270 2.730 2.535 3.049 . 0 0 "[ . 1 . 2]" 1
350 1 22 PHE QD 1 50 LEU MD1 . . 4.090 3.345 2.964 3.851 . 0 0 "[ . 1 . 2]" 1
351 1 22 PHE QD 1 83 LEU MD2 . . 4.910 3.775 3.464 4.083 . 0 0 "[ . 1 . 2]" 1
352 1 22 PHE QE 1 24 LEU MD1 . . 3.760 3.038 2.618 3.336 . 0 0 "[ . 1 . 2]" 1
353 1 22 PHE QE 1 24 LEU MD2 . . 3.370 2.249 1.897 2.775 . 0 0 "[ . 1 . 2]" 1
354 1 22 PHE QE 1 24 LEU HG . . 4.150 2.416 2.226 2.747 . 0 0 "[ . 1 . 2]" 1
355 1 22 PHE QE 1 36 ILE MD . . 4.740 3.418 2.856 3.739 . 0 0 "[ . 1 . 2]" 1
356 1 22 PHE QE 1 45 ALA MB . . 5.080 4.553 4.326 4.807 . 0 0 "[ . 1 . 2]" 1
357 1 22 PHE QE 1 50 LEU MD1 . . 4.870 4.136 3.388 4.611 . 0 0 "[ . 1 . 2]" 1
358 1 22 PHE QE 1 76 ILE HB . . 5.140 5.090 4.895 5.167 0.027 6 0 "[ . 1 . 2]" 1
359 1 22 PHE QE 1 76 ILE MD . . 3.310 2.059 1.951 2.552 . 0 0 "[ . 1 . 2]" 1
360 1 22 PHE QE 1 76 ILE HG12 . . 4.800 3.422 3.187 3.815 . 0 0 "[ . 1 . 2]" 1
361 1 22 PHE QE 1 76 ILE MG . . 3.760 2.839 2.467 3.187 . 0 0 "[ . 1 . 2]" 1
362 1 22 PHE QE 1 83 LEU MD2 . . 3.850 1.908 1.813 2.259 . 0 0 "[ . 1 . 2]" 1
363 1 22 PHE QE 1 85 LEU MD1 . . 3.740 2.518 2.285 2.849 . 0 0 "[ . 1 . 2]" 1
364 1 22 PHE QE 1 85 LEU MD2 . . 3.790 3.687 3.382 3.808 0.018 4 0 "[ . 1 . 2]" 1
365 1 23 ARG H 1 23 ARG HB2 . . 3.440 2.363 2.237 2.444 . 0 0 "[ . 1 . 2]" 1
366 1 23 ARG H 1 23 ARG HB3 . . 4.120 3.585 3.492 3.632 . 0 0 "[ . 1 . 2]" 1
367 1 23 ARG H 1 23 ARG QD . . 4.970 4.246 3.448 4.606 . 0 0 "[ . 1 . 2]" 1
368 1 23 ARG H 1 23 ARG QG . . 4.130 2.891 2.726 3.109 . 0 0 "[ . 1 . 2]" 1
369 1 23 ARG H 1 24 LEU H . . 5.250 4.542 4.497 4.568 . 0 0 "[ . 1 . 2]" 1
370 1 23 ARG H 1 24 LEU HA . . 5.500 5.051 4.898 5.128 . 0 0 "[ . 1 . 2]" 1
371 1 23 ARG H 1 36 ILE MD . . 5.500 4.829 4.525 5.061 . 0 0 "[ . 1 . 2]" 1
372 1 23 ARG H 1 36 ILE MG . . 4.070 3.626 3.382 3.826 . 0 0 "[ . 1 . 2]" 1
373 1 23 ARG H 1 37 SER H . . 4.800 4.356 4.065 4.666 . 0 0 "[ . 1 . 2]" 1
374 1 23 ARG H 1 37 SER HB2 . . 5.500 5.287 5.013 5.516 0.016 19 0 "[ . 1 . 2]" 1
375 1 23 ARG H 1 38 ARG H . . 3.590 2.421 2.311 2.562 . 0 0 "[ . 1 . 2]" 1
376 1 23 ARG H 1 40 THR H . . 5.500 5.486 5.398 5.519 0.019 6 0 "[ . 1 . 2]" 1
377 1 23 ARG HB2 1 23 ARG QD . . 3.900 2.749 2.080 3.350 . 0 0 "[ . 1 . 2]" 1
378 1 23 ARG HB2 1 24 LEU H . . 4.520 3.669 3.540 3.905 . 0 0 "[ . 1 . 2]" 1
379 1 23 ARG HB2 1 37 SER H . . 4.630 4.113 3.832 4.450 . 0 0 "[ . 1 . 2]" 1
380 1 23 ARG HB2 1 37 SER HB2 . . 4.010 3.702 3.549 3.946 . 0 0 "[ . 1 . 2]" 1
381 1 23 ARG HB2 1 37 SER HB3 . . 4.290 2.209 2.056 2.618 . 0 0 "[ . 1 . 2]" 1
382 1 23 ARG HB2 1 38 ARG H . . 3.470 2.207 1.945 2.542 . 0 0 "[ . 1 . 2]" 1
383 1 23 ARG HB3 1 23 ARG QD . . 3.780 2.341 2.040 2.784 . 0 0 "[ . 1 . 2]" 1
384 1 23 ARG HB3 1 24 LEU H . . 3.620 2.335 2.280 2.568 . 0 0 "[ . 1 . 2]" 1
385 1 23 ARG HB3 1 37 SER HB2 . . 4.900 3.427 3.138 3.626 . 0 0 "[ . 1 . 2]" 1
386 1 23 ARG HB3 1 37 SER HB3 . . 3.610 2.380 2.092 2.606 . 0 0 "[ . 1 . 2]" 1
387 1 23 ARG HB3 1 38 ARG H . . 4.300 3.646 3.388 3.936 . 0 0 "[ . 1 . 2]" 1
388 1 23 ARG QD 1 24 LEU H . . 5.110 3.873 2.425 4.892 . 0 0 "[ . 1 . 2]" 1
389 1 23 ARG QD 1 38 ARG H . . 5.500 4.535 3.393 5.406 . 0 0 "[ . 1 . 2]" 1
390 1 23 ARG QG 1 24 LEU H . . 4.530 3.834 3.441 4.206 . 0 0 "[ . 1 . 2]" 1
391 1 23 ARG QG 1 37 SER HB3 . . 5.250 4.080 3.862 4.360 . 0 0 "[ . 1 . 2]" 1
392 1 23 ARG QG 1 38 ARG H . . 4.880 4.007 3.695 4.446 . 0 0 "[ . 1 . 2]" 1
393 1 24 LEU H 1 24 LEU HB2 . . 3.130 2.453 2.401 2.526 . 0 0 "[ . 1 . 2]" 1
394 1 24 LEU H 1 24 LEU HB3 . . 4.080 3.640 3.606 3.687 . 0 0 "[ . 1 . 2]" 1
395 1 24 LEU H 1 24 LEU MD1 . . 4.650 3.858 3.630 3.987 . 0 0 "[ . 1 . 2]" 1
396 1 24 LEU H 1 24 LEU MD2 . . 4.290 4.059 3.905 4.296 0.006 9 0 "[ . 1 . 2]" 1
397 1 24 LEU H 1 73 GLN HE21 . . 5.440 2.899 2.467 3.502 . 0 0 "[ . 1 . 2]" 1
398 1 24 LEU H 1 73 GLN HE22 . . 5.060 3.826 3.167 4.544 . 0 0 "[ . 1 . 2]" 1
399 1 24 LEU HA 1 24 LEU MD2 . . 3.150 2.218 1.979 2.444 . 0 0 "[ . 1 . 2]" 1
400 1 24 LEU HA 1 25 GLN H . . 2.960 2.413 2.337 2.473 . 0 0 "[ . 1 . 2]" 1
401 1 24 LEU HA 1 25 GLN QB . . 4.730 3.952 3.865 4.563 . 0 0 "[ . 1 . 2]" 1
402 1 24 LEU HA 1 35 THR H . . 4.900 4.761 4.693 4.824 . 0 0 "[ . 1 . 2]" 1
403 1 24 LEU HA 1 36 ILE HA . . 3.660 2.931 2.644 3.045 . 0 0 "[ . 1 . 2]" 1
404 1 24 LEU HA 1 36 ILE MD . . 5.190 3.799 3.683 3.996 . 0 0 "[ . 1 . 2]" 1
405 1 24 LEU HA 1 36 ILE HG12 . . 5.500 5.406 5.032 5.511 0.011 3 0 "[ . 1 . 2]" 1
406 1 24 LEU HA 1 36 ILE MG . . 5.190 4.368 4.003 4.531 . 0 0 "[ . 1 . 2]" 1
407 1 24 LEU HA 1 37 SER H . . 3.570 2.256 1.966 2.410 . 0 0 "[ . 1 . 2]" 1
408 1 24 LEU HA 1 37 SER HB2 . . 4.680 3.688 3.313 4.012 . 0 0 "[ . 1 . 2]" 1
409 1 24 LEU HA 1 38 ARG H . . 5.140 4.779 4.530 4.958 . 0 0 "[ . 1 . 2]" 1
410 1 24 LEU HB2 1 24 LEU MD1 . . 3.350 2.233 2.040 2.325 . 0 0 "[ . 1 . 2]" 1
411 1 24 LEU HB2 1 25 GLN H . . 4.310 3.863 3.664 3.994 . 0 0 "[ . 1 . 2]" 1
412 1 24 LEU HB2 1 69 HIS HE1 . . 4.150 3.899 3.527 4.170 0.020 6 0 "[ . 1 . 2]" 1
413 1 24 LEU HB2 1 73 GLN HE21 . . 5.070 2.947 2.579 3.249 . 0 0 "[ . 1 . 2]" 1
414 1 24 LEU HB2 1 73 GLN HE22 . . 4.880 4.546 4.144 4.883 0.003 18 0 "[ . 1 . 2]" 1
415 1 24 LEU HB2 1 73 GLN HG2 . . 4.790 3.091 2.666 3.671 . 0 0 "[ . 1 . 2]" 1
416 1 24 LEU HB3 1 24 LEU MD2 . . 3.190 2.245 2.115 2.384 . 0 0 "[ . 1 . 2]" 1
417 1 24 LEU HB3 1 25 GLN H . . 3.690 2.616 2.469 2.797 . 0 0 "[ . 1 . 2]" 1
418 1 24 LEU HB3 1 35 THR H . . 5.390 4.645 4.316 4.801 . 0 0 "[ . 1 . 2]" 1
419 1 24 LEU HB3 1 69 HIS HE1 . . 4.460 4.445 4.349 4.489 0.029 4 0 "[ . 1 . 2]" 1
420 1 24 LEU MD1 1 72 ALA H . . 5.160 4.424 3.964 4.959 . 0 0 "[ . 1 . 2]" 1
421 1 24 LEU MD1 1 72 ALA MB . . 3.000 2.113 1.861 2.592 . 0 0 "[ . 1 . 2]" 1
422 1 24 LEU MD1 1 73 GLN H . . 4.490 2.999 2.716 3.623 . 0 0 "[ . 1 . 2]" 1
423 1 24 LEU MD1 1 73 GLN HA . . 4.020 2.214 1.938 2.858 . 0 0 "[ . 1 . 2]" 1
424 1 24 LEU MD1 1 73 GLN HB2 . . 5.100 3.784 3.388 4.334 . 0 0 "[ . 1 . 2]" 1
425 1 24 LEU MD1 1 73 GLN HB3 . . 4.940 4.070 3.810 4.522 . 0 0 "[ . 1 . 2]" 1
426 1 24 LEU MD1 1 73 GLN HE21 . . 5.420 3.788 3.413 4.097 . 0 0 "[ . 1 . 2]" 1
427 1 24 LEU MD1 1 73 GLN HE22 . . 5.320 4.959 4.684 5.288 . 0 0 "[ . 1 . 2]" 1
428 1 24 LEU MD1 1 73 GLN HG2 . . 4.320 2.024 1.855 2.359 . 0 0 "[ . 1 . 2]" 1
429 1 24 LEU MD1 1 73 GLN HG3 . . 4.760 2.643 1.972 3.100 . 0 0 "[ . 1 . 2]" 1
430 1 24 LEU MD2 1 25 GLN H . . 3.710 3.116 2.904 3.337 . 0 0 "[ . 1 . 2]" 1
431 1 24 LEU MD2 1 36 ILE HA . . 3.520 3.057 2.240 3.392 . 0 0 "[ . 1 . 2]" 1
432 1 24 LEU MD2 1 36 ILE MD . . 3.430 2.599 2.249 2.841 . 0 0 "[ . 1 . 2]" 1
433 1 24 LEU MD2 1 37 SER H . . 4.480 3.743 3.358 4.000 . 0 0 "[ . 1 . 2]" 1
434 1 24 LEU MD2 1 37 SER HB3 . . 5.500 4.964 4.637 5.322 . 0 0 "[ . 1 . 2]" 1
435 1 24 LEU HG 1 36 ILE MD . . 4.590 4.273 3.426 4.593 0.003 6 0 "[ . 1 . 2]" 1
436 1 25 GLN H 1 25 GLN QB . . 3.880 2.534 2.382 3.195 . 0 0 "[ . 1 . 2]" 1
437 1 25 GLN H 1 25 GLN QG . . 3.910 3.706 2.016 3.944 0.034 7 0 "[ . 1 . 2]" 1
438 1 25 GLN H 1 26 GLY H . . 4.960 4.464 4.441 4.502 . 0 0 "[ . 1 . 2]" 1
439 1 25 GLN H 1 34 LEU HA . . 5.070 3.585 3.325 4.017 . 0 0 "[ . 1 . 2]" 1
440 1 25 GLN H 1 35 THR HA . . 5.460 4.526 4.426 4.661 . 0 0 "[ . 1 . 2]" 1
441 1 25 GLN H 1 35 THR MG . . 5.500 5.105 5.009 5.220 . 0 0 "[ . 1 . 2]" 1
442 1 25 GLN H 1 36 ILE HA . . 4.630 4.049 3.879 4.362 . 0 0 "[ . 1 . 2]" 1
443 1 25 GLN H 1 37 SER HB2 . . 4.430 3.783 3.433 4.113 . 0 0 "[ . 1 . 2]" 1
444 1 25 GLN H 1 37 SER HB3 . . 4.930 4.457 3.963 4.717 . 0 0 "[ . 1 . 2]" 1
445 1 25 GLN H 1 69 HIS HE1 . . 5.100 4.555 4.387 4.897 . 0 0 "[ . 1 . 2]" 1
446 1 25 GLN QB 1 26 GLY H . . 3.700 2.599 2.269 2.818 . 0 0 "[ . 1 . 2]" 1
447 1 25 GLN QB 1 35 THR H . . 4.860 2.850 2.619 4.224 . 0 0 "[ . 1 . 2]" 1
448 1 25 GLN QB 1 35 THR HB . . 4.560 3.594 3.258 4.636 0.076 19 0 "[ . 1 . 2]" 1
449 1 25 GLN QB 1 37 SER H . . 4.870 3.159 2.694 4.368 . 0 0 "[ . 1 . 2]" 1
450 1 25 GLN QB 1 37 SER HB2 . . 3.290 2.968 2.234 3.237 . 0 0 "[ . 1 . 2]" 1
451 1 25 GLN QB 1 37 SER HB3 . . 4.250 4.118 3.631 4.270 0.020 9 0 "[ . 1 . 2]" 1
452 1 25 GLN QB 1 69 HIS HE1 . . 4.910 4.882 4.677 4.933 0.023 11 0 "[ . 1 . 2]" 1
453 1 25 GLN HE21 1 32 MET ME . . 4.410 3.787 3.041 4.865 0.455 4 0 "[ . 1 . 2]" 1
454 1 25 GLN HE21 1 37 SER HA . . 5.500 4.747 3.893 5.335 . 0 0 "[ . 1 . 2]" 1
455 1 25 GLN HE22 1 32 MET ME . . 4.840 3.325 2.575 4.072 . 0 0 "[ . 1 . 2]" 1
456 1 25 GLN QG 1 26 GLY H . . 4.060 3.434 2.709 4.072 0.012 9 0 "[ . 1 . 2]" 1
457 1 25 GLN QG 1 35 THR H . . 4.750 4.513 2.326 4.917 0.167 4 0 "[ . 1 . 2]" 1
458 1 25 GLN QG 1 35 THR HB . . 4.920 4.623 2.864 4.951 0.031 12 0 "[ . 1 . 2]" 1
459 1 25 GLN QG 1 37 SER H . . 4.720 3.660 2.608 3.994 . 0 0 "[ . 1 . 2]" 1
460 1 25 GLN QG 1 37 SER HA . . 4.520 2.084 1.902 2.339 . 0 0 "[ . 1 . 2]" 1
461 1 25 GLN QG 1 37 SER HB2 . . 3.770 2.158 1.972 3.079 . 0 0 "[ . 1 . 2]" 1
462 1 25 GLN QG 1 37 SER HB3 . . 4.000 3.602 3.422 3.896 . 0 0 "[ . 1 . 2]" 1
463 1 26 GLY H 1 27 GLY H . . 5.020 4.636 4.597 4.658 . 0 0 "[ . 1 . 2]" 1
464 1 26 GLY H 1 32 MET ME . . 4.750 3.614 2.568 4.145 . 0 0 "[ . 1 . 2]" 1
465 1 26 GLY HA2 1 27 GLY H . . 3.500 3.097 3.018 3.222 . 0 0 "[ . 1 . 2]" 1
466 1 26 GLY HA2 1 30 PHE QD . . 4.940 3.201 2.757 3.502 . 0 0 "[ . 1 . 2]" 1
467 1 26 GLY HA2 1 32 MET HB2 . . 3.850 2.486 2.248 2.775 . 0 0 "[ . 1 . 2]" 1
468 1 26 GLY HA2 1 32 MET HB3 . . 4.150 3.489 3.129 3.931 . 0 0 "[ . 1 . 2]" 1
469 1 26 GLY HA3 1 27 GLY H . . 3.250 2.259 2.210 2.299 . 0 0 "[ . 1 . 2]" 1
470 1 26 GLY HA3 1 32 MET H . . 5.450 4.053 3.773 4.370 . 0 0 "[ . 1 . 2]" 1
471 1 26 GLY HA3 1 32 MET HB2 . . 4.210 2.192 1.973 2.325 . 0 0 "[ . 1 . 2]" 1
472 1 26 GLY HA3 1 32 MET HB3 . . 4.610 2.383 2.177 2.693 . 0 0 "[ . 1 . 2]" 1
473 1 26 GLY HA3 1 32 MET ME . . 4.270 3.046 2.129 3.509 . 0 0 "[ . 1 . 2]" 1
474 1 26 GLY HA3 1 32 MET HG2 . . 4.590 4.737 4.314 4.835 0.245 10 0 "[ . 1 . 2]" 1
475 1 26 GLY HA3 1 32 MET HG3 . . 4.800 4.126 3.815 4.608 . 0 0 "[ . 1 . 2]" 1
476 1 27 GLY H 1 28 LYS H . . 4.860 4.353 4.257 4.427 . 0 0 "[ . 1 . 2]" 1
477 1 27 GLY H 1 30 PHE H . . 5.440 3.985 3.756 4.163 . 0 0 "[ . 1 . 2]" 1
478 1 27 GLY H 1 30 PHE HB2 . . 4.160 3.121 2.852 3.445 . 0 0 "[ . 1 . 2]" 1
479 1 27 GLY H 1 30 PHE HB3 . . 4.910 4.132 3.517 4.915 0.005 4 0 "[ . 1 . 2]" 1
480 1 27 GLY H 1 32 MET H . . 4.380 2.591 2.405 2.978 . 0 0 "[ . 1 . 2]" 1
481 1 27 GLY H 1 32 MET HB2 . . 4.120 2.426 1.940 2.583 . 0 0 "[ . 1 . 2]" 1
482 1 27 GLY H 1 32 MET HB3 . . 4.500 3.090 2.812 3.247 . 0 0 "[ . 1 . 2]" 1
483 1 27 GLY H 1 32 MET HG2 . . 4.830 4.942 4.869 5.002 0.172 12 0 "[ . 1 . 2]" 1
484 1 27 GLY H 1 32 MET HG3 . . 4.990 4.715 4.310 4.844 . 0 0 "[ . 1 . 2]" 1
485 1 27 GLY H 1 33 PRO HA . . 4.720 4.064 3.857 4.392 . 0 0 "[ . 1 . 2]" 1
486 1 27 GLY H 1 33 PRO HD3 . . 5.500 4.998 4.855 5.153 . 0 0 "[ . 1 . 2]" 1
487 1 27 GLY H 1 34 LEU H . . 4.790 4.236 4.060 4.560 . 0 0 "[ . 1 . 2]" 1
488 1 27 GLY H 1 34 LEU HB2 . . 5.330 4.863 4.703 5.127 . 0 0 "[ . 1 . 2]" 1
489 1 27 GLY H 1 34 LEU MD1 . . 4.500 3.911 3.609 4.257 . 0 0 "[ . 1 . 2]" 1
490 1 27 GLY H 1 34 LEU HG . . 5.410 5.387 5.138 5.446 0.036 15 0 "[ . 1 . 2]" 1
491 1 27 GLY H 1 35 THR H . . 5.500 5.046 4.481 5.290 . 0 0 "[ . 1 . 2]" 1
492 1 27 GLY HA2 1 28 LYS H . . 3.190 2.514 2.394 2.688 . 0 0 "[ . 1 . 2]" 1
493 1 27 GLY HA2 1 28 LYS HB2 . . 4.880 4.788 4.674 4.901 0.021 1 0 "[ . 1 . 2]" 1
494 1 27 GLY HA2 1 30 PHE H . . 5.500 4.487 4.361 4.611 . 0 0 "[ . 1 . 2]" 1
495 1 27 GLY HA2 1 34 LEU H . . 5.010 3.488 3.330 3.672 . 0 0 "[ . 1 . 2]" 1
496 1 27 GLY HA2 1 34 LEU HB2 . . 4.580 3.140 2.956 3.337 . 0 0 "[ . 1 . 2]" 1
497 1 27 GLY HA2 1 34 LEU HB3 . . 4.880 4.738 4.579 4.885 0.005 20 0 "[ . 1 . 2]" 1
498 1 27 GLY HA2 1 34 LEU MD1 . . 3.660 2.066 1.953 2.230 . 0 0 "[ . 1 . 2]" 1
499 1 27 GLY HA2 1 34 LEU HG . . 4.270 4.165 3.929 4.288 0.018 20 0 "[ . 1 . 2]" 1
500 1 27 GLY HA2 1 68 THR HA . . 5.160 4.411 4.033 4.715 . 0 0 "[ . 1 . 2]" 1
501 1 27 GLY HA2 1 69 HIS H . . 5.200 4.617 4.158 5.199 . 0 0 "[ . 1 . 2]" 1
502 1 27 GLY HA3 1 28 LYS H . . 3.490 2.734 2.553 2.875 . 0 0 "[ . 1 . 2]" 1
503 1 27 GLY HA3 1 29 ASP H . . 5.500 3.259 3.082 3.541 . 0 0 "[ . 1 . 2]" 1
504 1 27 GLY HA3 1 30 PHE H . . 4.950 3.400 3.230 3.594 . 0 0 "[ . 1 . 2]" 1
505 1 27 GLY HA3 1 69 HIS H . . 4.090 3.119 2.638 3.648 . 0 0 "[ . 1 . 2]" 1
506 1 27 GLY HA3 1 69 HIS HA . . 4.130 2.978 2.681 3.285 . 0 0 "[ . 1 . 2]" 1
507 1 27 GLY HA3 1 69 HIS HB2 . . 4.480 2.760 2.314 3.125 . 0 0 "[ . 1 . 2]" 1
508 1 27 GLY HA3 1 69 HIS HB3 . . 5.200 4.255 3.854 4.620 . 0 0 "[ . 1 . 2]" 1
509 1 28 LYS H 1 28 LYS HB2 . . 3.280 2.608 2.524 2.924 . 0 0 "[ . 1 . 2]" 1
510 1 28 LYS H 1 28 LYS HB3 . . 3.390 2.331 2.162 2.404 . 0 0 "[ . 1 . 2]" 1
511 1 28 LYS H 1 28 LYS HG2 . . 4.660 4.403 4.129 4.511 . 0 0 "[ . 1 . 2]" 1
512 1 28 LYS H 1 28 LYS HG3 . . 4.430 4.345 4.295 4.415 . 0 0 "[ . 1 . 2]" 1
513 1 28 LYS H 1 29 ASP H . . 3.750 2.713 2.456 2.842 . 0 0 "[ . 1 . 2]" 1
514 1 28 LYS H 1 30 PHE H . . 4.780 4.268 3.633 4.432 . 0 0 "[ . 1 . 2]" 1
515 1 28 LYS H 1 34 LEU MD1 . . 5.140 3.328 3.145 3.433 . 0 0 "[ . 1 . 2]" 1
516 1 28 LYS H 1 68 THR HA . . 3.330 2.393 2.068 2.776 . 0 0 "[ . 1 . 2]" 1
517 1 28 LYS H 1 68 THR MG . . 4.630 4.191 3.787 4.599 . 0 0 "[ . 1 . 2]" 1
518 1 28 LYS H 1 69 HIS H . . 4.730 3.858 3.202 4.284 . 0 0 "[ . 1 . 2]" 1
519 1 28 LYS HA 1 28 LYS HG2 . . 4.000 3.702 3.321 3.819 . 0 0 "[ . 1 . 2]" 1
520 1 28 LYS HA 1 28 LYS HG3 . . 4.140 2.621 2.409 2.751 . 0 0 "[ . 1 . 2]" 1
521 1 28 LYS HA 1 30 PHE H . . 4.520 4.365 3.536 4.521 0.001 2 0 "[ . 1 . 2]" 1
522 1 28 LYS HA 1 31 ASN H . . 4.080 3.286 2.825 3.550 . 0 0 "[ . 1 . 2]" 1
523 1 28 LYS HA 1 31 ASN HA . . 3.990 3.125 2.761 3.399 . 0 0 "[ . 1 . 2]" 1
524 1 28 LYS HA 1 32 MET H . . 4.340 3.842 3.415 4.176 . 0 0 "[ . 1 . 2]" 1
525 1 28 LYS HB2 1 29 ASP H . . 4.570 4.176 4.058 4.258 . 0 0 "[ . 1 . 2]" 1
526 1 28 LYS HB2 1 66 THR HA . . 4.400 3.591 3.347 4.099 . 0 0 "[ . 1 . 2]" 1
527 1 28 LYS HB2 1 67 MET H . . 5.040 3.972 3.015 4.471 . 0 0 "[ . 1 . 2]" 1
528 1 28 LYS HB2 1 68 THR HA . . 4.530 3.587 3.329 3.861 . 0 0 "[ . 1 . 2]" 1
529 1 28 LYS HB2 1 68 THR MG . . 4.390 4.011 3.419 4.334 . 0 0 "[ . 1 . 2]" 1
530 1 28 LYS HB3 1 28 LYS QE . . 5.000 3.738 3.384 4.000 . 0 0 "[ . 1 . 2]" 1
531 1 28 LYS HB3 1 29 ASP H . . 4.220 2.970 2.823 3.132 . 0 0 "[ . 1 . 2]" 1
532 1 28 LYS HB3 1 66 THR HA . . 5.040 4.614 4.314 4.825 . 0 0 "[ . 1 . 2]" 1
533 1 28 LYS HB3 1 67 MET H . . 5.400 4.403 3.428 4.830 . 0 0 "[ . 1 . 2]" 1
534 1 28 LYS HB3 1 68 THR H . . 5.250 3.580 3.189 3.973 . 0 0 "[ . 1 . 2]" 1
535 1 28 LYS HB3 1 68 THR HA . . 4.130 2.057 1.992 2.244 . 0 0 "[ . 1 . 2]" 1
536 1 28 LYS HD2 1 66 THR HA . . 3.940 3.335 2.623 4.049 0.109 9 0 "[ . 1 . 2]" 1
537 1 28 LYS HD3 1 66 THR HA . . 4.050 2.194 2.013 2.735 . 0 0 "[ . 1 . 2]" 1
538 1 28 LYS QE 1 28 LYS HG3 . . 3.590 3.042 2.691 3.379 . 0 0 "[ . 1 . 2]" 1
539 1 28 LYS QE 1 66 THR HA . . 4.760 2.760 1.995 4.030 . 0 0 "[ . 1 . 2]" 1
540 1 28 LYS QE 1 67 MET H . . 5.480 5.025 4.661 5.412 . 0 0 "[ . 1 . 2]" 1
541 1 28 LYS QE 1 68 THR H . . 5.490 5.133 4.579 5.487 . 0 0 "[ . 1 . 2]" 1
542 1 28 LYS QE 1 68 THR MG . . 3.880 3.469 2.876 3.872 . 0 0 "[ . 1 . 2]" 1
543 1 28 LYS HG2 1 29 ASP H . . 4.870 4.103 3.527 4.513 . 0 0 "[ . 1 . 2]" 1
544 1 28 LYS HG2 1 66 THR HA . . 4.910 4.546 4.035 5.016 0.106 4 0 "[ . 1 . 2]" 1
545 1 28 LYS HG2 1 68 THR HA . . 4.990 3.846 3.469 4.112 . 0 0 "[ . 1 . 2]" 1
546 1 28 LYS HG3 1 29 ASP H . . 4.940 4.136 3.868 4.788 . 0 0 "[ . 1 . 2]" 1
547 1 28 LYS HG3 1 66 THR HA . . 5.010 4.967 4.658 5.028 0.018 14 0 "[ . 1 . 2]" 1
548 1 28 LYS HG3 1 68 THR HA . . 4.450 4.563 4.412 4.989 0.539 15 2 "[ -. 1 + 2]" 1
549 1 29 ASP H 1 29 ASP HB2 . . 3.880 2.733 2.005 3.534 . 0 0 "[ . 1 . 2]" 1
550 1 29 ASP H 1 29 ASP HB3 . . 4.150 2.302 2.152 3.139 . 0 0 "[ . 1 . 2]" 1
551 1 29 ASP H 1 30 PHE H . . 3.270 2.645 2.560 2.759 . 0 0 "[ . 1 . 2]" 1
552 1 29 ASP H 1 31 ASN H . . 4.760 3.763 3.595 3.968 . 0 0 "[ . 1 . 2]" 1
553 1 29 ASP H 1 68 THR HA . . 3.860 2.194 1.981 2.336 . 0 0 "[ . 1 . 2]" 1
554 1 29 ASP H 1 68 THR HB . . 5.300 2.898 2.430 3.176 . 0 0 "[ . 1 . 2]" 1
555 1 29 ASP H 1 68 THR MG . . 3.920 3.144 2.550 3.592 . 0 0 "[ . 1 . 2]" 1
556 1 29 ASP H 1 69 HIS H . . 4.250 2.610 2.290 2.942 . 0 0 "[ . 1 . 2]" 1
557 1 29 ASP HA 1 29 ASP HB2 . . 3.010 2.411 2.346 2.837 . 0 0 "[ . 1 . 2]" 1
558 1 29 ASP HA 1 31 ASN H . . 4.420 3.744 3.606 4.011 . 0 0 "[ . 1 . 2]" 1
559 1 29 ASP HA 1 68 THR MG . . 4.260 3.125 2.441 3.736 . 0 0 "[ . 1 . 2]" 1
560 1 29 ASP HB2 1 68 THR HA . . 5.000 3.775 2.891 5.206 0.206 1 0 "[ . 1 . 2]" 1
561 1 29 ASP HB2 1 68 THR MG . . 3.500 3.007 2.559 4.107 0.607 1 1 "[+ . 1 . 2]" 1
562 1 29 ASP HB2 1 69 HIS H . . 5.500 3.035 1.989 4.418 . 0 0 "[ . 1 . 2]" 1
563 1 29 ASP HB3 1 30 PHE H . . 5.070 2.722 2.525 4.389 . 0 0 "[ . 1 . 2]" 1
564 1 29 ASP HB3 1 68 THR MG . . 4.150 3.907 2.582 4.163 0.013 7 0 "[ . 1 . 2]" 1
565 1 30 PHE H 1 30 PHE HB2 . . 3.260 2.096 2.021 2.246 . 0 0 "[ . 1 . 2]" 1
566 1 30 PHE H 1 30 PHE HB3 . . 3.880 3.404 3.331 3.501 . 0 0 "[ . 1 . 2]" 1
567 1 30 PHE H 1 30 PHE QD . . 4.000 2.894 2.479 3.711 . 0 0 "[ . 1 . 2]" 1
568 1 30 PHE H 1 31 ASN HA . . 4.660 4.595 4.188 4.674 0.014 11 0 "[ . 1 . 2]" 1
569 1 30 PHE H 1 32 MET H . . 4.370 3.367 3.123 3.553 . 0 0 "[ . 1 . 2]" 1
570 1 30 PHE H 1 32 MET HB2 . . 5.270 4.471 4.196 4.728 . 0 0 "[ . 1 . 2]" 1
571 1 30 PHE H 1 69 HIS H . . 5.470 4.024 3.707 4.539 . 0 0 "[ . 1 . 2]" 1
572 1 30 PHE HA 1 30 PHE QD . . 4.400 2.685 2.353 3.027 . 0 0 "[ . 1 . 2]" 1
573 1 30 PHE HA 1 32 MET H . . 5.450 4.380 4.209 4.650 . 0 0 "[ . 1 . 2]" 1
574 1 30 PHE HB2 1 31 ASN H . . 4.300 3.722 3.475 4.018 . 0 0 "[ . 1 . 2]" 1
575 1 30 PHE HB2 1 32 MET H . . 3.680 3.049 2.698 3.368 . 0 0 "[ . 1 . 2]" 1
576 1 30 PHE HB2 1 32 MET HB2 . . 4.360 2.893 2.693 3.415 . 0 0 "[ . 1 . 2]" 1
577 1 30 PHE HB3 1 31 ASN H . . 4.580 4.201 3.910 4.362 . 0 0 "[ . 1 . 2]" 1
578 1 30 PHE HB3 1 32 MET H . . 4.430 3.449 3.139 3.823 . 0 0 "[ . 1 . 2]" 1
579 1 30 PHE HB3 1 32 MET HB2 . . 4.400 2.706 2.364 3.553 . 0 0 "[ . 1 . 2]" 1
580 1 30 PHE HB3 1 32 MET ME . . 4.060 3.967 3.536 4.077 0.017 14 0 "[ . 1 . 2]" 1
581 1 30 PHE HB3 1 32 MET HG2 . . 4.320 4.153 3.931 4.345 0.025 12 0 "[ . 1 . 2]" 1
582 1 30 PHE HB3 1 32 MET HG3 . . 4.350 3.053 2.884 3.285 . 0 0 "[ . 1 . 2]" 1
583 1 30 PHE QD 1 69 HIS H . . 4.780 4.185 3.773 4.478 . 0 0 "[ . 1 . 2]" 1
584 1 30 PHE QD 1 69 HIS HB2 . . 3.780 2.493 2.094 3.006 . 0 0 "[ . 1 . 2]" 1
585 1 30 PHE QE 1 69 HIS HB2 . . 4.070 3.539 3.083 3.982 . 0 0 "[ . 1 . 2]" 1
586 1 30 PHE QE 1 69 HIS HB3 . . 3.840 3.486 2.824 3.843 0.003 9 0 "[ . 1 . 2]" 1
587 1 31 ASN H 1 31 ASN HA . . 2.900 2.175 2.167 2.189 . 0 0 "[ . 1 . 2]" 1
588 1 31 ASN H 1 31 ASN HB3 . . 4.030 3.954 3.684 4.099 0.069 12 0 "[ . 1 . 2]" 1
589 1 31 ASN H 1 32 MET H . . 3.580 2.716 2.495 2.907 . 0 0 "[ . 1 . 2]" 1
590 1 31 ASN H 1 32 MET HA . . 5.500 5.247 5.072 5.384 . 0 0 "[ . 1 . 2]" 1
591 1 31 ASN HA 1 32 MET H . . 3.320 3.030 2.921 3.185 . 0 0 "[ . 1 . 2]" 1
592 1 31 ASN HA 1 32 MET HA . . 5.030 4.465 4.411 4.561 . 0 0 "[ . 1 . 2]" 1
593 1 31 ASN HB2 1 32 MET H . . 5.130 4.295 4.023 4.554 . 0 0 "[ . 1 . 2]" 1
594 1 31 ASN HB3 1 31 ASN HD22 . . 4.090 3.719 3.445 4.155 0.065 8 0 "[ . 1 . 2]" 1
595 1 31 ASN HB3 1 32 MET H . . 5.040 4.207 3.909 4.526 . 0 0 "[ . 1 . 2]" 1
596 1 32 MET H 1 32 MET HB2 . . 3.640 2.455 2.318 2.672 . 0 0 "[ . 1 . 2]" 1
597 1 32 MET H 1 32 MET HB3 . . 4.120 3.601 3.502 3.778 . 0 0 "[ . 1 . 2]" 1
598 1 32 MET H 1 32 MET ME . . 5.260 4.931 4.492 5.210 . 0 0 "[ . 1 . 2]" 1
599 1 32 MET H 1 32 MET HG2 . . 4.460 3.709 3.477 4.314 . 0 0 "[ . 1 . 2]" 1
600 1 32 MET H 1 32 MET HG3 . . 4.490 3.776 2.714 4.132 . 0 0 "[ . 1 . 2]" 1
601 1 32 MET H 1 33 PRO HD2 . . 5.220 4.929 4.905 4.969 . 0 0 "[ . 1 . 2]" 1
602 1 32 MET H 1 33 PRO HD3 . . 5.040 4.779 4.719 4.807 . 0 0 "[ . 1 . 2]" 1
603 1 32 MET HA 1 32 MET ME . . 4.720 4.219 4.096 4.305 . 0 0 "[ . 1 . 2]" 1
604 1 32 MET HA 1 32 MET HG2 . . 3.980 2.370 2.131 2.842 . 0 0 "[ . 1 . 2]" 1
605 1 32 MET HA 1 32 MET HG3 . . 4.000 3.400 2.696 3.616 . 0 0 "[ . 1 . 2]" 1
606 1 32 MET HA 1 33 PRO HB3 . . 5.200 5.013 4.995 5.021 . 0 0 "[ . 1 . 2]" 1
607 1 32 MET HA 1 33 PRO HD2 . . 2.960 2.869 2.785 2.903 . 0 0 "[ . 1 . 2]" 1
608 1 32 MET HA 1 33 PRO HD3 . . 2.840 2.098 2.044 2.122 . 0 0 "[ . 1 . 2]" 1
609 1 32 MET HA 1 33 PRO HG2 . . 4.650 4.768 4.701 4.796 0.146 12 0 "[ . 1 . 2]" 1
610 1 32 MET HA 1 33 PRO HG3 . . 4.750 4.351 4.305 4.372 . 0 0 "[ . 1 . 2]" 1
611 1 32 MET HB2 1 33 PRO HD2 . . 3.580 3.658 3.606 3.676 0.096 7 0 "[ . 1 . 2]" 1
612 1 32 MET HB2 1 33 PRO HD3 . . 4.470 4.331 4.317 4.356 . 0 0 "[ . 1 . 2]" 1
613 1 32 MET HB3 1 33 PRO HD2 . . 3.410 1.995 1.980 2.049 . 0 0 "[ . 1 . 2]" 1
614 1 32 MET HB3 1 33 PRO HD3 . . 3.950 3.081 3.042 3.108 . 0 0 "[ . 1 . 2]" 1
615 1 32 MET ME 1 33 PRO HD2 . . 4.200 3.067 2.713 3.457 . 0 0 "[ . 1 . 2]" 1
616 1 32 MET ME 1 35 THR MG . . 4.790 4.467 4.083 4.842 0.052 4 0 "[ . 1 . 2]" 1
617 1 32 MET HG2 1 33 PRO HD2 . . 4.160 3.711 3.422 3.903 . 0 0 "[ . 1 . 2]" 1
618 1 32 MET HG2 1 33 PRO HD3 . . 5.140 3.668 3.311 3.875 . 0 0 "[ . 1 . 2]" 1
619 1 32 MET HG3 1 33 PRO HD2 . . 4.490 4.254 4.182 4.518 0.028 15 0 "[ . 1 . 2]" 1
620 1 32 MET HG3 1 33 PRO HD3 . . 4.650 4.683 4.431 4.776 0.126 8 0 "[ . 1 . 2]" 1
621 1 33 PRO HA 1 34 LEU H . . 2.890 2.161 2.157 2.171 . 0 0 "[ . 1 . 2]" 1
622 1 33 PRO HA 1 34 LEU HA . . 5.070 4.255 4.246 4.261 . 0 0 "[ . 1 . 2]" 1
623 1 33 PRO HA 1 34 LEU HB2 . . 4.770 4.148 4.131 4.169 . 0 0 "[ . 1 . 2]" 1
624 1 33 PRO HA 1 34 LEU HB3 . . 5.160 5.017 4.978 5.064 . 0 0 "[ . 1 . 2]" 1
625 1 33 PRO HA 1 35 THR MG . . 4.390 4.456 4.403 4.510 0.120 9 0 "[ . 1 . 2]" 1
626 1 33 PRO HA 1 55 LEU QD . . 5.040 3.882 3.344 4.358 . 0 0 "[ . 1 . 2]" 1
627 1 33 PRO HB2 1 34 LEU H . . 3.830 3.640 3.569 3.673 . 0 0 "[ . 1 . 2]" 1
628 1 33 PRO HB2 1 35 THR MG . . 3.660 2.717 2.667 2.785 . 0 0 "[ . 1 . 2]" 1
629 1 33 PRO HB2 1 55 LEU QD . . 3.370 2.130 1.886 2.371 . 0 0 "[ . 1 . 2]" 1
630 1 33 PRO HB2 1 55 LEU HG . . 4.280 2.304 2.138 2.478 . 0 0 "[ . 1 . 2]" 1
631 1 33 PRO HB3 1 34 LEU H . . 3.940 3.961 3.911 3.985 0.045 3 0 "[ . 1 . 2]" 1
632 1 33 PRO HB3 1 35 THR MG . . 4.580 4.170 4.140 4.224 . 0 0 "[ . 1 . 2]" 1
633 1 33 PRO HB3 1 55 LEU QD . . 3.680 2.507 2.077 2.953 . 0 0 "[ . 1 . 2]" 1
634 1 33 PRO HB3 1 55 LEU HG . . 4.640 3.626 3.329 3.944 . 0 0 "[ . 1 . 2]" 1
635 1 33 PRO HG2 1 34 LEU H . . 5.290 5.333 5.300 5.347 0.057 3 0 "[ . 1 . 2]" 1
636 1 33 PRO HG2 1 35 THR MG . . 3.810 2.795 2.712 2.933 . 0 0 "[ . 1 . 2]" 1
637 1 33 PRO HG2 1 55 LEU QD . . 3.600 2.690 2.341 3.075 . 0 0 "[ . 1 . 2]" 1
638 1 33 PRO HG2 1 55 LEU HG . . 3.800 3.707 3.524 3.841 0.041 4 0 "[ . 1 . 2]" 1
639 1 33 PRO HG3 1 35 THR MG . . 4.520 4.197 4.144 4.273 . 0 0 "[ . 1 . 2]" 1
640 1 33 PRO HG3 1 55 LEU QD . . 4.110 3.033 2.977 3.092 . 0 0 "[ . 1 . 2]" 1
641 1 33 PRO HG3 1 55 LEU HG . . 4.460 4.418 4.354 4.467 0.007 7 0 "[ . 1 . 2]" 1
642 1 34 LEU H 1 34 LEU HB2 . . 3.170 2.073 2.043 2.102 . 0 0 "[ . 1 . 2]" 1
643 1 34 LEU H 1 34 LEU HB3 . . 3.260 2.892 2.849 2.943 . 0 0 "[ . 1 . 2]" 1
644 1 34 LEU H 1 34 LEU MD1 . . 4.010 3.556 3.410 3.656 . 0 0 "[ . 1 . 2]" 1
645 1 34 LEU H 1 34 LEU MD2 . . 4.540 4.370 4.352 4.390 . 0 0 "[ . 1 . 2]" 1
646 1 34 LEU H 1 34 LEU HG . . 4.370 4.286 4.237 4.323 . 0 0 "[ . 1 . 2]" 1
647 1 34 LEU H 1 35 THR H . . 4.790 4.353 4.347 4.363 . 0 0 "[ . 1 . 2]" 1
648 1 34 LEU H 1 35 THR MG . . 5.010 4.376 4.325 4.432 . 0 0 "[ . 1 . 2]" 1
649 1 34 LEU H 1 64 THR HB . . 4.970 4.712 4.278 4.977 0.007 20 0 "[ . 1 . 2]" 1
650 1 34 LEU HA 1 34 LEU MD1 . . 3.310 2.784 2.667 2.923 . 0 0 "[ . 1 . 2]" 1
651 1 34 LEU HA 1 34 LEU MD2 . . 3.880 3.636 3.571 3.691 . 0 0 "[ . 1 . 2]" 1
652 1 34 LEU HA 1 34 LEU HG . . 4.210 2.257 2.201 2.316 . 0 0 "[ . 1 . 2]" 1
653 1 34 LEU HA 1 35 THR H . . 2.900 2.207 2.204 2.209 . 0 0 "[ . 1 . 2]" 1
654 1 34 LEU HA 1 35 THR MG . . 4.820 4.146 4.080 4.189 . 0 0 "[ . 1 . 2]" 1
655 1 34 LEU HA 1 56 VAL MG2 . . 5.110 4.590 4.485 4.708 . 0 0 "[ . 1 . 2]" 1
656 1 34 LEU HB2 1 34 LEU MD1 . . 3.130 2.140 1.965 2.197 . 0 0 "[ . 1 . 2]" 1
657 1 34 LEU HB2 1 35 THR H . . 4.770 4.668 4.656 4.678 . 0 0 "[ . 1 . 2]" 1
658 1 34 LEU HB2 1 56 VAL HB . . 4.030 3.715 3.690 3.750 . 0 0 "[ . 1 . 2]" 1
659 1 34 LEU HB2 1 56 VAL MG1 . . 4.340 4.361 4.309 4.391 0.051 3 0 "[ . 1 . 2]" 1
660 1 34 LEU HB2 1 64 THR HG1 . . 4.710 3.850 3.326 4.278 . 0 0 "[ . 1 . 2]" 1
661 1 34 LEU HB2 1 64 THR MG . . 5.030 4.042 3.712 4.313 . 0 0 "[ . 1 . 2]" 1
662 1 34 LEU HB2 1 72 ALA MB . . 5.280 4.085 3.882 4.238 . 0 0 "[ . 1 . 2]" 1
663 1 34 LEU HB3 1 34 LEU MD2 . . 3.230 2.117 2.039 2.173 . 0 0 "[ . 1 . 2]" 1
664 1 34 LEU HB3 1 35 THR H . . 4.550 4.292 4.263 4.317 . 0 0 "[ . 1 . 2]" 1
665 1 34 LEU HB3 1 56 VAL HB . . 3.840 1.983 1.975 1.999 . 0 0 "[ . 1 . 2]" 1
666 1 34 LEU HB3 1 56 VAL MG1 . . 4.420 3.093 3.056 3.120 . 0 0 "[ . 1 . 2]" 1
667 1 34 LEU HB3 1 56 VAL MG2 . . 4.150 3.393 3.326 3.519 . 0 0 "[ . 1 . 2]" 1
668 1 34 LEU HB3 1 64 THR HB . . 4.740 3.403 3.116 3.732 . 0 0 "[ . 1 . 2]" 1
669 1 34 LEU HB3 1 64 THR HG1 . . 4.660 3.546 2.750 4.131 . 0 0 "[ . 1 . 2]" 1
670 1 34 LEU HB3 1 64 THR MG . . 4.550 3.492 3.169 3.710 . 0 0 "[ . 1 . 2]" 1
671 1 34 LEU HB3 1 72 ALA MB . . 5.070 4.259 4.021 4.406 . 0 0 "[ . 1 . 2]" 1
672 1 34 LEU MD1 1 64 THR HA . . 5.220 4.390 3.966 4.719 . 0 0 "[ . 1 . 2]" 1
673 1 34 LEU MD1 1 64 THR HB . . 3.560 2.673 2.361 3.021 . 0 0 "[ . 1 . 2]" 1
674 1 34 LEU MD1 1 67 MET QB . . 4.070 3.854 3.483 4.175 0.105 4 0 "[ . 1 . 2]" 1
675 1 34 LEU MD1 1 69 HIS HA . . 3.520 2.143 1.999 2.437 . 0 0 "[ . 1 . 2]" 1
676 1 34 LEU MD1 1 69 HIS HD2 . . 5.030 4.982 4.694 5.075 0.045 4 0 "[ . 1 . 2]" 1
677 1 34 LEU MD1 1 72 ALA H . . 4.990 3.601 3.366 3.941 . 0 0 "[ . 1 . 2]" 1
678 1 34 LEU MD1 1 72 ALA MB . . 2.990 1.930 1.759 2.237 . 0 0 "[ . 1 . 2]" 1
679 1 34 LEU MD2 1 35 THR H . . 4.620 4.523 4.361 4.638 0.018 8 0 "[ . 1 . 2]" 1
680 1 34 LEU MD2 1 56 VAL HB . . 3.430 2.393 2.209 2.610 . 0 0 "[ . 1 . 2]" 1
681 1 34 LEU MD2 1 64 THR HA . . 4.580 4.509 4.104 4.604 0.024 4 0 "[ . 1 . 2]" 1
682 1 34 LEU MD2 1 64 THR HB . . 3.640 2.471 1.973 2.801 . 0 0 "[ . 1 . 2]" 1
683 1 34 LEU MD2 1 64 THR HG1 . . 4.240 3.830 3.231 4.252 0.012 4 0 "[ . 1 . 2]" 1
684 1 34 LEU MD2 1 72 ALA H . . 4.670 4.500 4.221 4.675 0.005 5 0 "[ . 1 . 2]" 1
685 1 34 LEU MD2 1 72 ALA HA . . 4.230 3.964 3.772 4.149 . 0 0 "[ . 1 . 2]" 1
686 1 34 LEU MD2 1 72 ALA MB . . 2.710 1.850 1.701 2.006 . 0 0 "[ . 1 . 2]" 1
687 1 34 LEU HG 1 35 THR H . . 4.350 3.522 3.487 3.552 . 0 0 "[ . 1 . 2]" 1
688 1 34 LEU HG 1 56 VAL HB . . 4.070 4.016 3.806 4.112 0.042 4 0 "[ . 1 . 2]" 1
689 1 34 LEU HG 1 56 VAL MG2 . . 4.140 4.039 3.942 4.148 0.008 15 0 "[ . 1 . 2]" 1
690 1 35 THR H 1 35 THR HB . . 3.730 3.582 3.557 3.616 . 0 0 "[ . 1 . 2]" 1
691 1 35 THR H 1 35 THR MG . . 3.830 3.042 2.962 3.098 . 0 0 "[ . 1 . 2]" 1
692 1 35 THR H 1 36 ILE H . . 4.900 4.521 4.507 4.531 . 0 0 "[ . 1 . 2]" 1
693 1 35 THR H 1 36 ILE HA . . 5.500 5.123 5.064 5.159 . 0 0 "[ . 1 . 2]" 1
694 1 35 THR H 1 56 VAL MG2 . . 4.710 4.233 4.113 4.334 . 0 0 "[ . 1 . 2]" 1
695 1 35 THR HA 1 35 THR MG . . 3.150 2.262 2.212 2.336 . 0 0 "[ . 1 . 2]" 1
696 1 35 THR HA 1 36 ILE H . . 3.020 2.403 2.365 2.475 . 0 0 "[ . 1 . 2]" 1
697 1 35 THR HA 1 36 ILE HA . . 5.090 4.255 4.247 4.270 . 0 0 "[ . 1 . 2]" 1
698 1 35 THR HA 1 36 ILE HB . . 4.870 4.779 4.712 4.825 . 0 0 "[ . 1 . 2]" 1
699 1 35 THR HA 1 36 ILE HG12 . . 4.480 3.529 3.457 3.586 . 0 0 "[ . 1 . 2]" 1
700 1 35 THR HA 1 55 LEU HA . . 3.190 2.622 2.500 2.780 . 0 0 "[ . 1 . 2]" 1
701 1 35 THR HA 1 55 LEU QD . . 4.240 3.982 3.790 4.120 . 0 0 "[ . 1 . 2]" 1
702 1 35 THR HA 1 55 LEU HG . . 4.690 4.281 4.007 4.594 . 0 0 "[ . 1 . 2]" 1
703 1 35 THR HA 1 56 VAL H . . 3.540 2.433 2.383 2.476 . 0 0 "[ . 1 . 2]" 1
704 1 35 THR HA 1 56 VAL HB . . 4.890 3.959 3.904 3.987 . 0 0 "[ . 1 . 2]" 1
705 1 35 THR HA 1 56 VAL MG2 . . 3.640 2.716 2.557 2.791 . 0 0 "[ . 1 . 2]" 1
706 1 35 THR HB 1 36 ILE H . . 3.150 2.680 2.515 2.780 . 0 0 "[ . 1 . 2]" 1
707 1 35 THR HB 1 36 ILE HB . . 4.570 4.542 4.500 4.573 0.003 14 0 "[ . 1 . 2]" 1
708 1 35 THR HB 1 53 GLY H . . 4.540 3.635 3.429 3.792 . 0 0 "[ . 1 . 2]" 1
709 1 35 THR HB 1 53 GLY HA2 . . 3.700 3.082 2.994 3.163 . 0 0 "[ . 1 . 2]" 1
710 1 35 THR HB 1 53 GLY HA3 . . 4.630 4.572 4.480 4.645 0.015 6 0 "[ . 1 . 2]" 1
711 1 35 THR HB 1 55 LEU HA . . 4.500 3.963 3.841 4.095 . 0 0 "[ . 1 . 2]" 1
712 1 35 THR HB 1 56 VAL H . . 4.870 4.880 4.795 4.904 0.034 16 0 "[ . 1 . 2]" 1
713 1 35 THR HB 1 56 VAL MG2 . . 4.920 4.798 4.706 4.851 . 0 0 "[ . 1 . 2]" 1
714 1 35 THR MG 1 36 ILE H . . 3.680 3.648 3.502 3.721 0.041 1 0 "[ . 1 . 2]" 1
715 1 35 THR MG 1 53 GLY H . . 4.850 4.842 4.686 4.887 0.037 12 0 "[ . 1 . 2]" 1
716 1 35 THR MG 1 53 GLY HA2 . . 3.900 3.839 3.714 3.929 0.029 16 0 "[ . 1 . 2]" 1
717 1 35 THR MG 1 53 GLY HA3 . . 4.750 4.799 4.765 4.842 0.092 17 0 "[ . 1 . 2]" 1
718 1 35 THR MG 1 55 LEU H . . 5.250 4.063 3.865 4.241 . 0 0 "[ . 1 . 2]" 1
719 1 35 THR MG 1 55 LEU HA . . 3.190 1.963 1.926 2.024 . 0 0 "[ . 1 . 2]" 1
720 1 35 THR MG 1 55 LEU HB3 . . 4.770 4.037 3.896 4.151 . 0 0 "[ . 1 . 2]" 1
721 1 35 THR MG 1 55 LEU HG . . 3.630 2.255 1.863 2.616 . 0 0 "[ . 1 . 2]" 1
722 1 35 THR MG 1 56 VAL H . . 3.990 3.040 2.919 3.159 . 0 0 "[ . 1 . 2]" 1
723 1 36 ILE H 1 36 ILE HB . . 3.300 2.397 2.332 2.444 . 0 0 "[ . 1 . 2]" 1
724 1 36 ILE H 1 36 ILE MD . . 4.450 3.526 3.342 3.791 . 0 0 "[ . 1 . 2]" 1
725 1 36 ILE H 1 36 ILE HG12 . . 3.570 2.123 1.982 2.370 . 0 0 "[ . 1 . 2]" 1
726 1 36 ILE H 1 36 ILE HG13 . . 3.330 3.382 3.359 3.432 0.102 9 0 "[ . 1 . 2]" 1
727 1 36 ILE H 1 36 ILE MG . . 4.140 3.709 3.697 3.721 . 0 0 "[ . 1 . 2]" 1
728 1 36 ILE H 1 37 SER H . . 5.130 4.310 4.173 4.468 . 0 0 "[ . 1 . 2]" 1
729 1 36 ILE H 1 52 GLN HA . . 4.930 4.422 4.220 4.612 . 0 0 "[ . 1 . 2]" 1
730 1 36 ILE H 1 53 GLY H . . 4.550 3.160 2.930 3.381 . 0 0 "[ . 1 . 2]" 1
731 1 36 ILE H 1 53 GLY HA2 . . 4.710 4.237 3.872 4.398 . 0 0 "[ . 1 . 2]" 1
732 1 36 ILE H 1 54 ASP H . . 4.790 3.531 3.410 3.615 . 0 0 "[ . 1 . 2]" 1
733 1 36 ILE H 1 54 ASP HB2 . . 5.080 2.932 2.824 3.111 . 0 0 "[ . 1 . 2]" 1
734 1 36 ILE H 1 55 LEU HA . . 4.610 4.208 4.057 4.382 . 0 0 "[ . 1 . 2]" 1
735 1 36 ILE H 1 56 VAL MG2 . . 3.960 3.349 3.253 3.476 . 0 0 "[ . 1 . 2]" 1
736 1 36 ILE HA 1 36 ILE MD . . 3.500 2.068 1.959 2.236 . 0 0 "[ . 1 . 2]" 1
737 1 36 ILE HA 1 36 ILE HG12 . . 3.870 2.875 2.721 2.971 . 0 0 "[ . 1 . 2]" 1
738 1 36 ILE HA 1 36 ILE MG . . 3.190 2.370 2.308 2.496 . 0 0 "[ . 1 . 2]" 1
739 1 36 ILE HA 1 37 SER H . . 2.960 2.221 2.177 2.283 . 0 0 "[ . 1 . 2]" 1
740 1 36 ILE HA 1 37 SER HA . . 4.460 4.397 4.328 4.459 . 0 0 "[ . 1 . 2]" 1
741 1 36 ILE HA 1 38 ARG H . . 4.670 4.454 4.197 4.655 . 0 0 "[ . 1 . 2]" 1
742 1 36 ILE HA 1 56 VAL MG2 . . 4.570 3.673 3.517 3.870 . 0 0 "[ . 1 . 2]" 1
743 1 36 ILE HB 1 39 ILE MD . . 4.780 3.497 3.297 3.687 . 0 0 "[ . 1 . 2]" 1
744 1 36 ILE HB 1 39 ILE HG13 . . 4.940 4.516 4.352 4.645 . 0 0 "[ . 1 . 2]" 1
745 1 36 ILE HB 1 52 GLN HA . . 3.310 2.414 2.233 2.505 . 0 0 "[ . 1 . 2]" 1
746 1 36 ILE HB 1 53 GLY H . . 3.470 2.474 2.077 2.780 . 0 0 "[ . 1 . 2]" 1
747 1 36 ILE HB 1 54 ASP H . . 3.870 2.879 2.719 3.006 . 0 0 "[ . 1 . 2]" 1
748 1 36 ILE HB 1 54 ASP HB2 . . 4.400 2.714 2.610 2.825 . 0 0 "[ . 1 . 2]" 1
749 1 36 ILE HB 1 54 ASP HB3 . . 5.050 4.454 4.355 4.560 . 0 0 "[ . 1 . 2]" 1
750 1 36 ILE HB 1 56 VAL MG2 . . 4.680 4.597 4.440 4.701 0.021 7 0 "[ . 1 . 2]" 1
751 1 36 ILE MD 1 36 ILE MG . . 2.990 1.949 1.835 2.017 . 0 0 "[ . 1 . 2]" 1
752 1 36 ILE MD 1 37 SER H . . 4.790 3.855 3.670 4.075 . 0 0 "[ . 1 . 2]" 1
753 1 36 ILE MD 1 39 ILE HG13 . . 4.350 4.146 3.834 4.297 . 0 0 "[ . 1 . 2]" 1
754 1 36 ILE MD 1 50 LEU HA . . 5.010 4.212 3.675 4.664 . 0 0 "[ . 1 . 2]" 1
755 1 36 ILE MD 1 50 LEU QB . . 4.050 2.681 2.444 2.987 . 0 0 "[ . 1 . 2]" 1
756 1 36 ILE MD 1 51 SER H . . 5.190 4.408 3.898 4.790 . 0 0 "[ . 1 . 2]" 1
757 1 36 ILE MD 1 54 ASP HB2 . . 4.140 3.549 3.454 3.705 . 0 0 "[ . 1 . 2]" 1
758 1 36 ILE MD 1 54 ASP HB3 . . 4.860 4.321 4.196 4.569 . 0 0 "[ . 1 . 2]" 1
759 1 36 ILE MD 1 56 VAL HB . . 5.140 4.889 4.738 5.139 . 0 0 "[ . 1 . 2]" 1
760 1 36 ILE MD 1 56 VAL MG2 . . 3.140 2.423 2.254 2.681 . 0 0 "[ . 1 . 2]" 1
761 1 36 ILE HG12 1 52 GLN HA . . 4.960 4.948 4.760 5.004 0.044 16 0 "[ . 1 . 2]" 1
762 1 36 ILE HG12 1 53 GLY H . . 5.220 4.542 4.140 4.943 . 0 0 "[ . 1 . 2]" 1
763 1 36 ILE HG12 1 54 ASP HB2 . . 4.020 2.190 2.016 2.591 . 0 0 "[ . 1 . 2]" 1
764 1 36 ILE HG12 1 54 ASP HB3 . . 5.150 3.318 3.165 3.652 . 0 0 "[ . 1 . 2]" 1
765 1 36 ILE HG12 1 56 VAL MG2 . . 3.260 2.570 2.414 2.685 . 0 0 "[ . 1 . 2]" 1
766 1 36 ILE HG13 1 36 ILE MG . . 3.210 2.503 2.430 2.636 . 0 0 "[ . 1 . 2]" 1
767 1 36 ILE HG13 1 54 ASP HB2 . . 4.710 1.983 1.966 1.996 . 0 0 "[ . 1 . 2]" 1
768 1 36 ILE HG13 1 56 VAL MG2 . . 3.850 3.711 3.546 3.859 0.009 5 0 "[ . 1 . 2]" 1
769 1 36 ILE MG 1 37 SER H . . 3.580 3.272 2.830 3.497 . 0 0 "[ . 1 . 2]" 1
770 1 36 ILE MG 1 37 SER HA . . 4.790 4.492 4.280 4.667 . 0 0 "[ . 1 . 2]" 1
771 1 36 ILE MG 1 37 SER HB2 . . 5.490 5.310 5.090 5.495 0.005 20 0 "[ . 1 . 2]" 1
772 1 36 ILE MG 1 38 ARG H . . 3.500 3.319 3.009 3.517 0.017 18 0 "[ . 1 . 2]" 1
773 1 36 ILE MG 1 38 ARG HA . . 4.700 3.591 3.348 3.758 . 0 0 "[ . 1 . 2]" 1
774 1 36 ILE MG 1 39 ILE HB . . 4.350 3.860 3.728 3.977 . 0 0 "[ . 1 . 2]" 1
775 1 36 ILE MG 1 39 ILE MD . . 2.540 1.799 1.713 1.937 . 0 0 "[ . 1 . 2]" 1
776 1 36 ILE MG 1 39 ILE HG13 . . 3.330 2.092 1.970 2.185 . 0 0 "[ . 1 . 2]" 1
777 1 36 ILE MG 1 50 LEU QB . . 4.280 3.162 2.583 3.774 . 0 0 "[ . 1 . 2]" 1
778 1 36 ILE MG 1 51 SER H . . 5.250 3.913 3.349 4.329 . 0 0 "[ . 1 . 2]" 1
779 1 36 ILE MG 1 51 SER HA . . 4.380 3.842 3.537 4.075 . 0 0 "[ . 1 . 2]" 1
780 1 36 ILE MG 1 52 GLN H . . 3.840 3.772 3.628 3.862 0.022 16 0 "[ . 1 . 2]" 1
781 1 36 ILE MG 1 52 GLN HA . . 3.090 2.179 1.974 2.449 . 0 0 "[ . 1 . 2]" 1
782 1 36 ILE MG 1 52 GLN QB . . 4.020 3.601 3.348 3.832 . 0 0 "[ . 1 . 2]" 1
783 1 36 ILE MG 1 52 GLN HG3 . . 4.340 3.146 2.685 3.502 . 0 0 "[ . 1 . 2]" 1
784 1 36 ILE MG 1 53 GLY H . . 3.850 3.471 3.173 3.709 . 0 0 "[ . 1 . 2]" 1
785 1 36 ILE MG 1 54 ASP H . . 4.530 4.227 4.051 4.385 . 0 0 "[ . 1 . 2]" 1
786 1 36 ILE MG 1 54 ASP HB2 . . 3.740 3.845 3.809 3.893 0.153 20 0 "[ . 1 . 2]" 1
787 1 37 SER H 1 37 SER HB2 . . 3.530 2.721 2.411 3.058 . 0 0 "[ . 1 . 2]" 1
788 1 37 SER H 1 37 SER HB3 . . 3.890 2.274 2.044 2.583 . 0 0 "[ . 1 . 2]" 1
789 1 37 SER H 1 38 ARG H . . 3.180 3.148 2.951 3.233 0.053 15 0 "[ . 1 . 2]" 1
790 1 37 SER HA 1 52 GLN HE21 . . 5.260 4.536 4.057 5.048 . 0 0 "[ . 1 . 2]" 1
791 1 37 SER HA 1 52 GLN HG2 . . 4.790 4.215 3.892 4.546 . 0 0 "[ . 1 . 2]" 1
792 1 37 SER HA 1 52 GLN HG3 . . 4.630 4.330 4.005 4.490 . 0 0 "[ . 1 . 2]" 1
793 1 37 SER HA 1 53 GLY H . . 4.870 4.665 4.483 4.858 . 0 0 "[ . 1 . 2]" 1
794 1 37 SER HB2 1 38 ARG H . . 4.140 3.699 3.597 3.861 . 0 0 "[ . 1 . 2]" 1
795 1 37 SER HB3 1 38 ARG H . . 4.030 2.298 2.051 2.733 . 0 0 "[ . 1 . 2]" 1
796 1 37 SER HB3 1 38 ARG HB2 . . 4.420 4.091 3.691 4.432 0.012 7 0 "[ . 1 . 2]" 1
797 1 38 ARG H 1 38 ARG HB2 . . 3.790 2.778 2.595 3.035 . 0 0 "[ . 1 . 2]" 1
798 1 38 ARG H 1 38 ARG HB3 . . 4.030 3.368 3.048 3.572 . 0 0 "[ . 1 . 2]" 1
799 1 38 ARG H 1 38 ARG QD . . 4.540 4.308 3.440 4.583 0.043 4 0 "[ . 1 . 2]" 1
800 1 38 ARG H 1 38 ARG HG2 . . 4.700 4.759 3.911 5.073 0.373 10 0 "[ . 1 . 2]" 1
801 1 38 ARG H 1 38 ARG HG3 . . 5.090 4.552 4.226 5.003 . 0 0 "[ . 1 . 2]" 1
802 1 38 ARG H 1 39 ILE H . . 4.810 4.413 4.356 4.444 . 0 0 "[ . 1 . 2]" 1
803 1 38 ARG H 1 39 ILE MD . . 5.500 5.237 5.004 5.401 . 0 0 "[ . 1 . 2]" 1
804 1 38 ARG HA 1 38 ARG QD . . 3.830 3.123 2.002 3.808 . 0 0 "[ . 1 . 2]" 1
805 1 38 ARG HA 1 38 ARG HG2 . . 3.950 2.967 2.115 3.484 . 0 0 "[ . 1 . 2]" 1
806 1 38 ARG HA 1 38 ARG HG3 . . 4.020 2.482 1.993 3.590 . 0 0 "[ . 1 . 2]" 1
807 1 38 ARG HA 1 39 ILE H . . 2.840 2.538 2.372 2.612 . 0 0 "[ . 1 . 2]" 1
808 1 38 ARG HA 1 39 ILE HB . . 4.550 4.369 4.285 4.549 . 0 0 "[ . 1 . 2]" 1
809 1 38 ARG HA 1 39 ILE HG13 . . 4.980 3.565 3.322 3.733 . 0 0 "[ . 1 . 2]" 1
810 1 38 ARG HA 1 52 GLN HA . . 4.600 4.140 3.871 4.393 . 0 0 "[ . 1 . 2]" 1
811 1 38 ARG HA 1 52 GLN QB . . 4.210 3.531 3.134 3.842 . 0 0 "[ . 1 . 2]" 1
812 1 38 ARG HA 1 52 GLN HE21 . . 5.270 4.317 3.612 4.731 . 0 0 "[ . 1 . 2]" 1
813 1 38 ARG HA 1 52 GLN HG2 . . 4.290 3.574 3.379 3.724 . 0 0 "[ . 1 . 2]" 1
814 1 38 ARG HA 1 52 GLN HG3 . . 4.210 2.001 1.987 2.061 . 0 0 "[ . 1 . 2]" 1
815 1 38 ARG HB2 1 38 ARG QD . . 3.620 2.439 1.975 3.417 . 0 0 "[ . 1 . 2]" 1
816 1 38 ARG HB2 1 39 ILE H . . 4.340 4.019 3.848 4.277 . 0 0 "[ . 1 . 2]" 1
817 1 38 ARG HB3 1 38 ARG QD . . 3.740 2.822 2.009 3.355 . 0 0 "[ . 1 . 2]" 1
818 1 38 ARG HB3 1 39 ILE H . . 4.320 2.816 2.404 3.454 . 0 0 "[ . 1 . 2]" 1
819 1 38 ARG QD 1 39 ILE H . . 4.530 3.722 1.897 4.543 0.013 10 0 "[ . 1 . 2]" 1
820 1 38 ARG HG2 1 39 ILE H . . 4.210 3.197 2.183 4.242 0.032 1 0 "[ . 1 . 2]" 1
821 1 38 ARG HG3 1 39 ILE H . . 4.240 3.286 2.469 4.274 0.034 1 0 "[ . 1 . 2]" 1
822 1 39 ILE H 1 39 ILE HB . . 3.200 2.719 2.521 2.768 . 0 0 "[ . 1 . 2]" 1
823 1 39 ILE H 1 39 ILE HG12 . . 4.460 4.364 4.230 4.476 0.016 19 0 "[ . 1 . 2]" 1
824 1 39 ILE H 1 39 ILE HG13 . . 3.830 3.265 2.945 3.419 . 0 0 "[ . 1 . 2]" 1
825 1 39 ILE H 1 39 ILE MG . . 4.220 3.807 3.723 3.866 . 0 0 "[ . 1 . 2]" 1
826 1 39 ILE H 1 40 THR H . . 4.550 4.336 4.255 4.427 . 0 0 "[ . 1 . 2]" 1
827 1 39 ILE HA 1 39 ILE HG12 . . 3.850 2.570 2.449 2.752 . 0 0 "[ . 1 . 2]" 1
828 1 39 ILE HA 1 39 ILE HG13 . . 3.800 2.768 2.612 2.858 . 0 0 "[ . 1 . 2]" 1
829 1 39 ILE HA 1 39 ILE MG . . 3.260 2.483 2.370 2.563 . 0 0 "[ . 1 . 2]" 1
830 1 39 ILE HA 1 40 THR H . . 3.030 2.259 2.216 2.313 . 0 0 "[ . 1 . 2]" 1
831 1 39 ILE HB 1 39 ILE MD . . 3.250 2.275 2.128 2.370 . 0 0 "[ . 1 . 2]" 1
832 1 39 ILE HB 1 40 THR H . . 4.890 4.176 3.972 4.301 . 0 0 "[ . 1 . 2]" 1
833 1 39 ILE HB 1 45 ALA MB . . 4.670 4.117 3.812 4.483 . 0 0 "[ . 1 . 2]" 1
834 1 39 ILE HB 1 52 GLN QB . . 4.930 3.817 3.323 4.198 . 0 0 "[ . 1 . 2]" 1
835 1 39 ILE MD 1 40 THR H . . 5.190 4.972 4.867 5.053 . 0 0 "[ . 1 . 2]" 1
836 1 39 ILE MD 1 45 ALA MB . . 3.750 2.770 2.507 3.167 . 0 0 "[ . 1 . 2]" 1
837 1 39 ILE MD 1 46 ALA H . . 5.500 5.024 4.620 5.423 . 0 0 "[ . 1 . 2]" 1
838 1 39 ILE MD 1 46 ALA HA . . 4.370 3.850 3.401 4.307 . 0 0 "[ . 1 . 2]" 1
839 1 39 ILE MD 1 46 ALA MB . . 4.810 4.120 3.492 4.567 . 0 0 "[ . 1 . 2]" 1
840 1 39 ILE MD 1 50 LEU HA . . 4.550 3.952 3.596 4.361 . 0 0 "[ . 1 . 2]" 1
841 1 39 ILE MD 1 50 LEU QB . . 3.460 2.586 1.928 3.392 . 0 0 "[ . 1 . 2]" 1
842 1 39 ILE MD 1 51 SER H . . 4.660 3.423 3.154 3.716 . 0 0 "[ . 1 . 2]" 1
843 1 39 ILE MD 1 51 SER HA . . 3.270 2.241 1.989 2.554 . 0 0 "[ . 1 . 2]" 1
844 1 39 ILE MD 1 51 SER QB . . 4.820 3.804 3.552 4.111 . 0 0 "[ . 1 . 2]" 1
845 1 39 ILE MD 1 52 GLN H . . 3.500 2.757 2.468 2.978 . 0 0 "[ . 1 . 2]" 1
846 1 39 ILE MD 1 52 GLN HA . . 4.050 3.006 2.793 3.198 . 0 0 "[ . 1 . 2]" 1
847 1 39 ILE MD 1 52 GLN QB . . 4.040 3.311 2.998 3.642 . 0 0 "[ . 1 . 2]" 1
848 1 39 ILE MD 1 52 GLN HG2 . . 5.050 5.008 4.856 5.067 0.017 7 0 "[ . 1 . 2]" 1
849 1 39 ILE MD 1 52 GLN HG3 . . 4.310 4.137 3.929 4.313 0.003 16 0 "[ . 1 . 2]" 1
850 1 39 ILE MD 1 53 GLY H . . 4.850 4.792 4.572 4.870 0.020 17 0 "[ . 1 . 2]" 1
851 1 39 ILE HG12 1 40 THR H . . 5.210 4.186 4.018 4.412 . 0 0 "[ . 1 . 2]" 1
852 1 39 ILE HG13 1 39 ILE MG . . 3.460 3.223 3.202 3.240 . 0 0 "[ . 1 . 2]" 1
853 1 39 ILE HG13 1 52 GLN HA . . 4.740 3.889 3.617 4.219 . 0 0 "[ . 1 . 2]" 1
854 1 39 ILE HG13 1 52 GLN QB . . 5.070 4.114 3.784 4.446 . 0 0 "[ . 1 . 2]" 1
855 1 39 ILE MG 1 40 THR H . . 3.450 2.254 2.049 2.480 . 0 0 "[ . 1 . 2]" 1
856 1 39 ILE MG 1 40 THR HB . . 4.530 3.840 3.608 3.944 . 0 0 "[ . 1 . 2]" 1
857 1 39 ILE MG 1 41 PRO HA . . 4.700 4.081 3.924 4.404 . 0 0 "[ . 1 . 2]" 1
858 1 39 ILE MG 1 43 SER H . . 4.880 4.366 4.035 4.870 . 0 0 "[ . 1 . 2]" 1
859 1 39 ILE MG 1 43 SER HB3 . . 4.890 4.370 4.003 4.663 . 0 0 "[ . 1 . 2]" 1
860 1 39 ILE MG 1 43 SER HG . . 4.210 2.691 2.428 2.989 . 0 0 "[ . 1 . 2]" 1
861 1 39 ILE MG 1 45 ALA MB . . 3.120 1.875 1.692 2.334 . 0 0 "[ . 1 . 2]" 1
862 1 39 ILE MG 1 46 ALA H . . 3.700 3.174 2.708 3.472 . 0 0 "[ . 1 . 2]" 1
863 1 39 ILE MG 1 46 ALA HA . . 3.050 2.793 2.491 3.038 . 0 0 "[ . 1 . 2]" 1
864 1 39 ILE MG 1 46 ALA MB . . 3.000 2.165 1.812 2.536 . 0 0 "[ . 1 . 2]" 1
865 1 40 THR H 1 40 THR HB . . 3.100 2.206 2.111 2.307 . 0 0 "[ . 1 . 2]" 1
866 1 40 THR H 1 40 THR MG . . 4.190 3.651 3.558 3.708 . 0 0 "[ . 1 . 2]" 1
867 1 40 THR H 1 41 PRO HD2 . . 5.300 5.035 5.022 5.049 . 0 0 "[ . 1 . 2]" 1
868 1 40 THR H 1 41 PRO HD3 . . 5.100 4.680 4.597 4.729 . 0 0 "[ . 1 . 2]" 1
869 1 40 THR H 1 43 SER HB3 . . 4.190 3.947 3.731 4.175 . 0 0 "[ . 1 . 2]" 1
870 1 40 THR H 1 43 SER HG . . 4.250 3.186 2.439 3.820 . 0 0 "[ . 1 . 2]" 1
871 1 40 THR H 1 45 ALA MB . . 4.670 3.490 2.845 4.067 . 0 0 "[ . 1 . 2]" 1
872 1 40 THR H 1 46 ALA MB . . 4.410 4.267 3.895 4.413 0.003 19 0 "[ . 1 . 2]" 1
873 1 40 THR HA 1 40 THR MG . . 3.200 2.571 2.498 2.650 . 0 0 "[ . 1 . 2]" 1
874 1 40 THR HA 1 41 PRO HD2 . . 2.860 2.493 2.385 2.571 . 0 0 "[ . 1 . 2]" 1
875 1 40 THR HA 1 41 PRO HD3 . . 3.020 1.900 1.889 1.918 . 0 0 "[ . 1 . 2]" 1
876 1 40 THR HA 1 41 PRO HG2 . . 5.040 4.471 4.404 4.523 . 0 0 "[ . 1 . 2]" 1
877 1 40 THR HB 1 43 SER H . . 4.640 4.033 3.660 4.359 . 0 0 "[ . 1 . 2]" 1
878 1 40 THR HB 1 43 SER HB2 . . 4.080 3.651 3.228 4.054 . 0 0 "[ . 1 . 2]" 1
879 1 40 THR HB 1 43 SER HB3 . . 3.170 2.528 2.245 2.873 . 0 0 "[ . 1 . 2]" 1
880 1 40 THR HB 1 43 SER HG . . 4.150 3.231 2.342 4.018 . 0 0 "[ . 1 . 2]" 1
881 1 40 THR HB 1 45 ALA MB . . 5.230 4.476 3.812 4.945 . 0 0 "[ . 1 . 2]" 1
882 1 40 THR HB 1 46 ALA MB . . 5.030 4.832 4.612 5.017 . 0 0 "[ . 1 . 2]" 1
883 1 40 THR MG 1 41 PRO HA . . 5.030 3.908 3.806 4.073 . 0 0 "[ . 1 . 2]" 1
884 1 40 THR MG 1 41 PRO HD2 . . 3.780 1.886 1.784 1.973 . 0 0 "[ . 1 . 2]" 1
885 1 40 THR MG 1 41 PRO HD3 . . 3.250 3.027 2.882 3.211 . 0 0 "[ . 1 . 2]" 1
886 1 40 THR MG 1 41 PRO HG3 . . 4.720 4.293 4.153 4.516 . 0 0 "[ . 1 . 2]" 1
887 1 40 THR MG 1 43 SER H . . 4.510 3.082 2.517 3.414 . 0 0 "[ . 1 . 2]" 1
888 1 40 THR MG 1 43 SER HB2 . . 4.820 4.033 3.305 4.586 . 0 0 "[ . 1 . 2]" 1
889 1 40 THR MG 1 43 SER HB3 . . 3.880 2.618 2.013 3.181 . 0 0 "[ . 1 . 2]" 1
890 1 40 THR MG 1 43 SER HG . . 4.960 3.748 3.086 4.395 . 0 0 "[ . 1 . 2]" 1
891 1 41 PRO HA 1 42 GLY H . . 2.970 2.162 2.149 2.202 . 0 0 "[ . 1 . 2]" 1
892 1 41 PRO HA 1 42 GLY HA2 . . 4.790 4.331 4.285 4.391 . 0 0 "[ . 1 . 2]" 1
893 1 41 PRO HA 1 43 SER H . . 4.160 3.473 3.252 3.806 . 0 0 "[ . 1 . 2]" 1
894 1 41 PRO HA 1 46 ALA MB . . 3.340 2.581 2.232 2.913 . 0 0 "[ . 1 . 2]" 1
895 1 41 PRO HB2 1 42 GLY H . . 4.250 3.739 3.410 4.009 . 0 0 "[ . 1 . 2]" 1
896 1 41 PRO HB2 1 46 ALA MB . . 4.520 4.673 4.263 5.077 0.557 10 3 "[ .- + .* 2]" 1
897 1 41 PRO HB3 1 42 GLY H . . 4.600 4.037 3.803 4.244 . 0 0 "[ . 1 . 2]" 1
898 1 41 PRO HG2 1 42 GLY H . . 5.500 5.365 5.213 5.456 . 0 0 "[ . 1 . 2]" 1
899 1 42 GLY H 1 43 SER H . . 3.670 2.637 2.067 3.212 . 0 0 "[ . 1 . 2]" 1
900 1 42 GLY H 1 43 SER HG . . 5.360 4.199 3.702 5.224 . 0 0 "[ . 1 . 2]" 1
901 1 42 GLY H 1 46 ALA MB . . 3.490 2.182 1.878 2.673 . 0 0 "[ . 1 . 2]" 1
902 1 42 GLY HA2 1 43 SER HA . . 5.090 4.749 4.623 4.851 . 0 0 "[ . 1 . 2]" 1
903 1 42 GLY HA2 1 46 ALA MB . . 5.060 3.756 3.404 4.189 . 0 0 "[ . 1 . 2]" 1
904 1 42 GLY HA3 1 46 ALA MB . . 4.170 4.388 4.083 4.794 0.624 4 3 "[ +. * .- 2]" 1
905 1 43 SER H 1 43 SER HB2 . . 4.030 3.547 3.461 3.616 . 0 0 "[ . 1 . 2]" 1
906 1 43 SER H 1 43 SER HB3 . . 3.360 2.435 2.168 2.615 . 0 0 "[ . 1 . 2]" 1
907 1 43 SER H 1 43 SER HG . . 3.310 2.477 2.055 3.297 . 0 0 "[ . 1 . 2]" 1
908 1 43 SER H 1 44 LYS H . . 5.160 4.628 4.572 4.666 . 0 0 "[ . 1 . 2]" 1
909 1 43 SER H 1 46 ALA H . . 4.190 3.839 3.447 4.177 . 0 0 "[ . 1 . 2]" 1
910 1 43 SER H 1 46 ALA MB . . 3.150 2.667 2.270 3.068 . 0 0 "[ . 1 . 2]" 1
911 1 43 SER HA 1 44 LYS H . . 3.310 2.540 2.436 2.681 . 0 0 "[ . 1 . 2]" 1
912 1 43 SER HA 1 44 LYS HA . . 4.980 4.309 4.300 4.321 . 0 0 "[ . 1 . 2]" 1
913 1 43 SER HA 1 46 ALA H . . 5.410 4.454 4.310 4.540 . 0 0 "[ . 1 . 2]" 1
914 1 43 SER HA 1 46 ALA MB . . 5.010 4.416 4.166 4.646 . 0 0 "[ . 1 . 2]" 1
915 1 43 SER HB2 1 44 LYS H . . 3.390 2.493 2.378 2.626 . 0 0 "[ . 1 . 2]" 1
916 1 43 SER HB2 1 44 LYS HB2 . . 4.280 4.191 4.103 4.283 0.003 16 0 "[ . 1 . 2]" 1
917 1 43 SER HB2 1 45 ALA H . . 4.540 2.940 2.549 3.467 . 0 0 "[ . 1 . 2]" 1
918 1 43 SER HB2 1 45 ALA MB . . 4.820 3.560 3.036 4.163 . 0 0 "[ . 1 . 2]" 1
919 1 43 SER HB2 1 46 ALA H . . 4.870 4.107 3.686 4.455 . 0 0 "[ . 1 . 2]" 1
920 1 43 SER HB2 1 46 ALA MB . . 5.110 4.569 4.232 4.828 . 0 0 "[ . 1 . 2]" 1
921 1 43 SER HB3 1 44 LYS H . . 3.880 3.875 3.802 3.903 0.023 8 0 "[ . 1 . 2]" 1
922 1 43 SER HB3 1 45 ALA H . . 4.630 4.207 3.952 4.636 0.006 10 0 "[ . 1 . 2]" 1
923 1 43 SER HB3 1 45 ALA MB . . 4.670 4.273 4.099 4.474 . 0 0 "[ . 1 . 2]" 1
924 1 43 SER HB3 1 46 ALA H . . 4.650 4.491 4.273 4.612 . 0 0 "[ . 1 . 2]" 1
925 1 43 SER HB3 1 46 ALA MB . . 4.780 4.150 3.788 4.472 . 0 0 "[ . 1 . 2]" 1
926 1 43 SER HG 1 44 LYS H . . 5.390 4.209 3.767 4.711 . 0 0 "[ . 1 . 2]" 1
927 1 43 SER HG 1 45 ALA MB . . 4.960 2.940 2.328 3.743 . 0 0 "[ . 1 . 2]" 1
928 1 43 SER HG 1 46 ALA H . . 3.730 2.623 1.949 3.477 . 0 0 "[ . 1 . 2]" 1
929 1 43 SER HG 1 46 ALA MB . . 3.900 2.530 1.938 3.490 . 0 0 "[ . 1 . 2]" 1
930 1 44 LYS H 1 44 LYS HB2 . . 3.440 2.071 2.031 2.153 . 0 0 "[ . 1 . 2]" 1
931 1 44 LYS H 1 44 LYS HB3 . . 4.080 3.367 3.308 3.450 . 0 0 "[ . 1 . 2]" 1
932 1 44 LYS H 1 44 LYS HG2 . . 3.470 3.284 2.921 3.472 0.002 5 0 "[ . 1 . 2]" 1
933 1 44 LYS H 1 44 LYS HG3 . . 3.900 3.603 3.399 3.941 0.041 20 0 "[ . 1 . 2]" 1
934 1 44 LYS H 1 45 ALA H . . 4.020 2.623 2.510 2.750 . 0 0 "[ . 1 . 2]" 1
935 1 44 LYS H 1 46 ALA H . . 5.470 4.015 3.849 4.173 . 0 0 "[ . 1 . 2]" 1
936 1 44 LYS HA 1 44 LYS HD2 . . 4.980 4.038 2.047 4.232 . 0 0 "[ . 1 . 2]" 1
937 1 44 LYS HA 1 44 LYS HD3 . . 4.670 3.714 3.363 3.903 . 0 0 "[ . 1 . 2]" 1
938 1 44 LYS HA 1 44 LYS HG2 . . 3.630 2.093 1.998 2.555 . 0 0 "[ . 1 . 2]" 1
939 1 44 LYS HA 1 44 LYS HG3 . . 3.400 3.414 3.338 3.547 0.147 20 0 "[ . 1 . 2]" 1
940 1 44 LYS HA 1 47 GLN H . . 4.140 3.338 2.801 3.564 . 0 0 "[ . 1 . 2]" 1
941 1 44 LYS HA 1 47 GLN HB2 . . 3.890 2.299 2.003 2.586 . 0 0 "[ . 1 . 2]" 1
942 1 44 LYS HA 1 47 GLN HB3 . . 4.330 3.987 3.627 4.331 0.001 3 0 "[ . 1 . 2]" 1
943 1 44 LYS HA 1 47 GLN HE21 . . 5.340 4.997 3.858 5.346 0.006 7 0 "[ . 1 . 2]" 1
944 1 44 LYS HA 1 47 GLN HG2 . . 4.440 4.423 4.249 4.538 0.098 13 0 "[ . 1 . 2]" 1
945 1 44 LYS HA 1 47 GLN HG3 . . 4.690 3.143 2.682 3.581 . 0 0 "[ . 1 . 2]" 1
946 1 44 LYS HB2 1 44 LYS HD3 . . 4.130 3.368 3.241 4.261 0.131 20 0 "[ . 1 . 2]" 1
947 1 44 LYS HB2 1 45 ALA H . . 4.260 3.258 2.940 3.447 . 0 0 "[ . 1 . 2]" 1
948 1 44 LYS HB2 1 45 ALA MB . . 4.930 4.546 4.390 4.666 . 0 0 "[ . 1 . 2]" 1
949 1 44 LYS HB3 1 44 LYS HD3 . . 3.700 2.207 2.061 3.629 . 0 0 "[ . 1 . 2]" 1
950 1 44 LYS HB3 1 45 ALA H . . 4.340 3.539 3.117 3.948 . 0 0 "[ . 1 . 2]" 1
951 1 44 LYS HB3 1 45 ALA HA . . 5.060 4.172 3.994 4.392 . 0 0 "[ . 1 . 2]" 1
952 1 44 LYS QE 1 44 LYS HG3 . . 3.800 3.281 2.588 3.466 . 0 0 "[ . 1 . 2]" 1
953 1 44 LYS QE 1 47 GLN HA . . 5.200 4.787 4.558 5.041 . 0 0 "[ . 1 . 2]" 1
954 1 44 LYS QE 1 47 GLN HB2 . . 3.670 2.373 2.076 3.061 . 0 0 "[ . 1 . 2]" 1
955 1 44 LYS HG2 1 45 ALA H . . 5.480 4.974 4.854 5.038 . 0 0 "[ . 1 . 2]" 1
956 1 45 ALA H 1 45 ALA MB . . 3.220 2.089 1.942 2.176 . 0 0 "[ . 1 . 2]" 1
957 1 45 ALA H 1 46 ALA H . . 3.790 2.557 2.333 2.763 . 0 0 "[ . 1 . 2]" 1
958 1 45 ALA H 1 46 ALA MB . . 5.180 4.190 4.002 4.450 . 0 0 "[ . 1 . 2]" 1
959 1 45 ALA HA 1 46 ALA MB . . 4.980 4.925 4.872 4.963 . 0 0 "[ . 1 . 2]" 1
960 1 45 ALA HA 1 47 GLN H . . 4.280 3.593 3.438 3.972 . 0 0 "[ . 1 . 2]" 1
961 1 45 ALA HA 1 50 LEU QB . . 5.090 3.532 2.562 4.609 . 0 0 "[ . 1 . 2]" 1
962 1 45 ALA HA 1 50 LEU MD1 . . 3.570 2.469 2.118 2.844 . 0 0 "[ . 1 . 2]" 1
963 1 45 ALA MB 1 46 ALA H . . 3.570 2.955 2.779 3.148 . 0 0 "[ . 1 . 2]" 1
964 1 45 ALA MB 1 46 ALA HA . . 4.540 4.012 3.947 4.094 . 0 0 "[ . 1 . 2]" 1
965 1 45 ALA MB 1 47 GLN H . . 4.940 4.292 4.190 4.420 . 0 0 "[ . 1 . 2]" 1
966 1 45 ALA MB 1 48 SER H . . 5.120 4.908 4.747 5.125 0.005 16 0 "[ . 1 . 2]" 1
967 1 45 ALA MB 1 50 LEU QB . . 5.050 3.362 2.453 4.326 . 0 0 "[ . 1 . 2]" 1
968 1 45 ALA MB 1 50 LEU MD1 . . 3.230 2.206 1.706 2.894 . 0 0 "[ . 1 . 2]" 1
969 1 46 ALA H 1 46 ALA MB . . 2.930 2.187 2.095 2.282 . 0 0 "[ . 1 . 2]" 1
970 1 46 ALA H 1 47 GLN HA . . 5.410 4.833 4.654 4.949 . 0 0 "[ . 1 . 2]" 1
971 1 46 ALA H 1 47 GLN HB2 . . 5.370 4.295 4.136 4.556 . 0 0 "[ . 1 . 2]" 1
972 1 46 ALA H 1 47 GLN HG3 . . 5.430 3.932 3.508 4.253 . 0 0 "[ . 1 . 2]" 1
973 1 46 ALA HA 1 48 SER H . . 4.290 3.762 3.641 4.299 0.009 19 0 "[ . 1 . 2]" 1
974 1 46 ALA MB 1 47 GLN H . . 3.570 3.512 3.156 3.620 0.050 12 0 "[ . 1 . 2]" 1
975 1 46 ALA MB 1 47 GLN HE21 . . 5.500 4.616 3.980 5.053 . 0 0 "[ . 1 . 2]" 1
976 1 46 ALA MB 1 47 GLN HG2 . . 4.250 3.288 2.737 3.716 . 0 0 "[ . 1 . 2]" 1
977 1 46 ALA MB 1 47 GLN HG3 . . 4.650 3.691 3.450 3.869 . 0 0 "[ . 1 . 2]" 1
978 1 46 ALA MB 1 48 SER H . . 4.890 4.716 4.563 4.899 0.009 19 0 "[ . 1 . 2]" 1
979 1 47 GLN H 1 47 GLN HB2 . . 3.380 2.756 2.556 2.883 . 0 0 "[ . 1 . 2]" 1
980 1 47 GLN H 1 47 GLN HB3 . . 3.800 3.819 3.710 3.887 0.087 11 0 "[ . 1 . 2]" 1
981 1 47 GLN H 1 47 GLN HG2 . . 3.880 3.377 2.895 3.614 . 0 0 "[ . 1 . 2]" 1
982 1 47 GLN H 1 47 GLN HG3 . . 3.960 3.534 3.077 3.845 . 0 0 "[ . 1 . 2]" 1
983 1 47 GLN H 1 49 GLN H . . 5.500 5.346 4.249 5.642 0.142 11 0 "[ . 1 . 2]" 1
984 1 47 GLN HA 1 47 GLN HG2 . . 3.740 2.386 2.263 2.593 . 0 0 "[ . 1 . 2]" 1
985 1 47 GLN HA 1 47 GLN HG3 . . 3.710 3.592 3.393 3.754 0.044 17 0 "[ . 1 . 2]" 1
986 1 47 GLN HB2 1 48 SER H . . 4.190 3.922 2.992 4.203 0.013 6 0 "[ . 1 . 2]" 1
987 1 47 GLN HB3 1 47 GLN HG2 . . 2.880 2.846 2.739 2.890 0.010 10 0 "[ . 1 . 2]" 1
988 1 47 GLN HB3 1 48 SER H . . 4.540 4.473 3.946 4.622 0.082 3 0 "[ . 1 . 2]" 1
989 1 47 GLN HG2 1 48 SER H . . 5.110 4.732 4.600 4.842 . 0 0 "[ . 1 . 2]" 1
990 1 48 SER H 1 48 SER HB2 . . 3.990 3.651 2.821 3.786 . 0 0 "[ . 1 . 2]" 1
991 1 48 SER H 1 48 SER HB3 . . 3.680 3.140 2.549 3.803 0.123 18 0 "[ . 1 . 2]" 1
992 1 48 SER H 1 48 SER HG . . 3.600 3.010 1.942 3.658 0.058 15 0 "[ . 1 . 2]" 1
993 1 48 SER H 1 49 GLN H . . 3.870 3.566 2.585 3.957 0.087 11 0 "[ . 1 . 2]" 1
994 1 48 SER H 1 50 LEU H . . 5.040 3.828 3.318 4.512 . 0 0 "[ . 1 . 2]" 1
995 1 48 SER H 1 50 LEU MD1 . . 5.200 4.841 4.476 5.316 0.116 10 0 "[ . 1 . 2]" 1
996 1 48 SER HB2 1 49 GLN H . . 3.080 2.053 1.800 2.730 . 0 0 "[ . 1 . 2]" 1
997 1 48 SER HB2 1 50 LEU H . . 3.640 3.417 2.187 3.682 0.042 4 0 "[ . 1 . 2]" 1
998 1 48 SER HB2 1 50 LEU QB . . 5.500 4.706 3.292 5.276 . 0 0 "[ . 1 . 2]" 1
999 1 48 SER HB2 1 50 LEU MD1 . . 5.500 4.469 2.677 5.524 0.024 8 0 "[ . 1 . 2]" 1
1000 1 48 SER HB2 1 50 LEU HG . . 4.820 4.275 3.441 4.821 0.001 9 0 "[ . 1 . 2]" 1
1001 1 48 SER HB3 1 49 GLN H . . 3.750 3.262 2.055 3.498 . 0 0 "[ . 1 . 2]" 1
1002 1 48 SER HB3 1 50 LEU H . . 4.600 4.257 3.525 4.661 0.061 17 0 "[ . 1 . 2]" 1
1003 1 48 SER HB3 1 50 LEU MD1 . . 5.500 4.552 3.525 5.634 0.134 10 0 "[ . 1 . 2]" 1
1004 1 48 SER HG 1 49 GLN H . . 5.190 2.667 1.895 3.966 . 0 0 "[ . 1 . 2]" 1
1005 1 48 SER HG 1 50 LEU H . . 4.050 2.682 1.933 4.095 0.045 18 0 "[ . 1 . 2]" 1
1006 1 48 SER HG 1 50 LEU QB . . 5.240 3.417 2.505 4.956 . 0 0 "[ . 1 . 2]" 1
1007 1 48 SER HG 1 50 LEU MD1 . . 4.950 2.919 1.977 3.815 . 0 0 "[ . 1 . 2]" 1
1008 1 49 GLN H 1 49 GLN HB2 . . 3.540 2.633 2.407 3.055 . 0 0 "[ . 1 . 2]" 1
1009 1 49 GLN H 1 49 GLN HB3 . . 3.800 3.714 3.563 3.901 0.101 10 0 "[ . 1 . 2]" 1
1010 1 49 GLN H 1 49 GLN HG2 . . 4.080 3.809 3.439 4.137 0.057 10 0 "[ . 1 . 2]" 1
1011 1 49 GLN H 1 49 GLN HG3 . . 4.010 3.727 3.244 4.213 0.203 10 0 "[ . 1 . 2]" 1
1012 1 49 GLN H 1 50 LEU H . . 3.660 1.964 1.693 2.466 . 0 0 "[ . 1 . 2]" 1
1013 1 49 GLN H 1 50 LEU MD1 . . 5.390 4.203 3.349 5.089 . 0 0 "[ . 1 . 2]" 1
1014 1 49 GLN H 1 50 LEU MD2 . . 5.230 4.263 2.275 5.241 0.011 9 0 "[ . 1 . 2]" 1
1015 1 49 GLN HA 1 49 GLN HG2 . . 3.890 2.152 2.063 2.271 . 0 0 "[ . 1 . 2]" 1
1016 1 49 GLN HA 1 49 GLN HG3 . . 3.640 3.344 3.207 3.561 . 0 0 "[ . 1 . 2]" 1
1017 1 49 GLN HB2 1 50 LEU H . . 4.760 3.635 2.887 4.129 . 0 0 "[ . 1 . 2]" 1
1018 1 49 GLN HG3 1 50 LEU H . . 5.450 5.197 4.796 5.484 0.034 12 0 "[ . 1 . 2]" 1
1019 1 50 LEU H 1 50 LEU QB . . 3.250 2.422 2.178 2.716 . 0 0 "[ . 1 . 2]" 1
1020 1 50 LEU H 1 50 LEU MD1 . . 3.840 3.391 3.003 3.824 . 0 0 "[ . 1 . 2]" 1
1021 1 50 LEU H 1 51 SER H . . 5.190 4.513 4.448 4.576 . 0 0 "[ . 1 . 2]" 1
1022 1 50 LEU HA 1 50 LEU HG . . 4.120 3.095 2.451 3.684 . 0 0 "[ . 1 . 2]" 1
1023 1 50 LEU HA 1 51 SER H . . 3.040 2.184 2.179 2.195 . 0 0 "[ . 1 . 2]" 1
1024 1 50 LEU HA 1 51 SER QB . . 4.600 4.294 4.017 4.421 . 0 0 "[ . 1 . 2]" 1
1025 1 50 LEU HA 1 54 ASP HB2 . . 4.740 4.460 4.328 4.624 . 0 0 "[ . 1 . 2]" 1
1026 1 50 LEU HA 1 54 ASP HB3 . . 4.650 4.646 4.474 4.722 0.072 5 0 "[ . 1 . 2]" 1
1027 1 50 LEU HA 1 87 LEU MD1 . . 4.760 4.720 4.520 4.789 0.029 11 0 "[ . 1 . 2]" 1
1028 1 50 LEU HA 1 87 LEU MD2 . . 4.860 2.460 2.205 2.612 . 0 0 "[ . 1 . 2]" 1
1029 1 50 LEU QB 1 50 LEU MD2 . . 3.240 2.070 1.915 2.326 . 0 0 "[ . 1 . 2]" 1
1030 1 50 LEU QB 1 51 SER H . . 4.100 3.326 3.224 3.402 . 0 0 "[ . 1 . 2]" 1
1031 1 50 LEU HG 1 51 SER H . . 5.480 4.796 4.555 5.136 . 0 0 "[ . 1 . 2]" 1
1032 1 51 SER H 1 51 SER QB . . 3.630 2.569 2.345 2.804 . 0 0 "[ . 1 . 2]" 1
1033 1 51 SER H 1 52 GLN H . . 4.940 4.441 4.382 4.492 . 0 0 "[ . 1 . 2]" 1
1034 1 51 SER H 1 54 ASP HB2 . . 4.580 3.394 3.208 3.701 . 0 0 "[ . 1 . 2]" 1
1035 1 51 SER H 1 54 ASP HB3 . . 5.260 4.047 3.939 4.205 . 0 0 "[ . 1 . 2]" 1
1036 1 51 SER HA 1 52 GLN H . . 2.940 2.475 2.314 2.630 . 0 0 "[ . 1 . 2]" 1
1037 1 51 SER HA 1 52 GLN HA . . 4.800 4.282 4.276 4.290 . 0 0 "[ . 1 . 2]" 1
1038 1 51 SER HA 1 52 GLN QB . . 4.290 4.187 4.121 4.282 . 0 0 "[ . 1 . 2]" 1
1039 1 51 SER QB 1 52 GLN H . . 3.460 2.551 2.171 2.901 . 0 0 "[ . 1 . 2]" 1
1040 1 51 SER QB 1 52 GLN QB . . 4.730 4.041 3.793 4.342 . 0 0 "[ . 1 . 2]" 1
1041 1 51 SER QB 1 54 ASP H . . 4.950 3.824 3.547 4.437 . 0 0 "[ . 1 . 2]" 1
1042 1 52 GLN H 1 53 GLY H . . 4.990 4.572 4.440 4.643 . 0 0 "[ . 1 . 2]" 1
1043 1 52 GLN HA 1 52 GLN HG2 . . 4.000 2.617 2.417 2.895 . 0 0 "[ . 1 . 2]" 1
1044 1 52 GLN HA 1 52 GLN HG3 . . 4.000 2.544 2.374 2.713 . 0 0 "[ . 1 . 2]" 1
1045 1 52 GLN HA 1 53 GLY H . . 2.730 2.233 2.204 2.313 . 0 0 "[ . 1 . 2]" 1
1046 1 52 GLN HA 1 54 ASP H . . 4.200 3.496 3.363 3.692 . 0 0 "[ . 1 . 2]" 1
1047 1 52 GLN QB 1 52 GLN HE22 . . 4.970 3.949 3.647 4.108 . 0 0 "[ . 1 . 2]" 1
1048 1 52 GLN QB 1 53 GLY H . . 4.040 3.738 3.581 3.931 . 0 0 "[ . 1 . 2]" 1
1049 1 52 GLN HE21 1 53 GLY HA2 . . 5.220 4.826 4.307 5.195 . 0 0 "[ . 1 . 2]" 1
1050 1 52 GLN HG2 1 53 GLY H . . 4.460 2.753 2.183 3.114 . 0 0 "[ . 1 . 2]" 1
1051 1 52 GLN HG2 1 53 GLY HA2 . . 4.680 3.946 3.530 4.349 . 0 0 "[ . 1 . 2]" 1
1052 1 52 GLN HG3 1 53 GLY H . . 4.320 3.703 3.150 4.227 . 0 0 "[ . 1 . 2]" 1
1053 1 53 GLY H 1 54 ASP H . . 3.680 2.694 2.485 2.920 . 0 0 "[ . 1 . 2]" 1
1054 1 54 ASP H 1 54 ASP HB2 . . 3.500 2.488 2.392 2.578 . 0 0 "[ . 1 . 2]" 1
1055 1 54 ASP H 1 54 ASP HB3 . . 3.940 3.574 3.560 3.581 . 0 0 "[ . 1 . 2]" 1
1056 1 54 ASP H 1 55 LEU H . . 5.210 4.673 4.671 4.675 . 0 0 "[ . 1 . 2]" 1
1057 1 54 ASP HA 1 55 LEU H . . 3.120 2.454 2.429 2.472 . 0 0 "[ . 1 . 2]" 1
1058 1 54 ASP HA 1 88 GLN H . . 5.310 4.702 4.584 4.793 . 0 0 "[ . 1 . 2]" 1
1059 1 54 ASP HB2 1 55 LEU H . . 4.130 3.899 3.822 3.979 . 0 0 "[ . 1 . 2]" 1
1060 1 54 ASP HB2 1 87 LEU HB2 . . 5.500 5.190 5.085 5.307 . 0 0 "[ . 1 . 2]" 1
1061 1 54 ASP HB2 1 87 LEU HB3 . . 4.740 4.145 4.070 4.241 . 0 0 "[ . 1 . 2]" 1
1062 1 54 ASP HB2 1 87 LEU MD1 . . 4.700 4.674 4.565 4.734 0.034 10 0 "[ . 1 . 2]" 1
1063 1 54 ASP HB2 1 87 LEU MD2 . . 3.920 2.722 2.530 2.929 . 0 0 "[ . 1 . 2]" 1
1064 1 54 ASP HB2 1 87 LEU HG . . 4.580 3.381 3.303 3.425 . 0 0 "[ . 1 . 2]" 1
1065 1 54 ASP HB2 1 88 GLN H . . 5.500 5.555 5.528 5.572 0.072 5 0 "[ . 1 . 2]" 1
1066 1 54 ASP HB3 1 55 LEU H . . 3.580 2.639 2.601 2.718 . 0 0 "[ . 1 . 2]" 1
1067 1 54 ASP HB3 1 55 LEU HB2 . . 4.990 5.023 4.997 5.057 0.067 19 0 "[ . 1 . 2]" 1
1068 1 54 ASP HB3 1 87 LEU HB2 . . 4.680 3.734 3.647 3.843 . 0 0 "[ . 1 . 2]" 1
1069 1 54 ASP HB3 1 87 LEU HB3 . . 3.930 2.464 2.397 2.591 . 0 0 "[ . 1 . 2]" 1
1070 1 54 ASP HB3 1 87 LEU MD1 . . 4.820 4.059 3.939 4.150 . 0 0 "[ . 1 . 2]" 1
1071 1 54 ASP HB3 1 87 LEU MD2 . . 3.850 2.348 2.202 2.469 . 0 0 "[ . 1 . 2]" 1
1072 1 54 ASP HB3 1 87 LEU HG . . 5.010 2.472 2.332 2.580 . 0 0 "[ . 1 . 2]" 1
1073 1 54 ASP HB3 1 88 GLN H . . 4.590 3.901 3.855 3.981 . 0 0 "[ . 1 . 2]" 1
1074 1 55 LEU H 1 55 LEU HB2 . . 3.210 2.452 2.391 2.503 . 0 0 "[ . 1 . 2]" 1
1075 1 55 LEU H 1 55 LEU HB3 . . 3.450 3.035 2.977 3.109 . 0 0 "[ . 1 . 2]" 1
1076 1 55 LEU H 1 87 LEU HA . . 5.300 4.260 4.182 4.332 . 0 0 "[ . 1 . 2]" 1
1077 1 55 LEU H 1 87 LEU HB3 . . 4.940 3.022 2.910 3.121 . 0 0 "[ . 1 . 2]" 1
1078 1 55 LEU H 1 87 LEU MD2 . . 4.680 4.348 4.189 4.469 . 0 0 "[ . 1 . 2]" 1
1079 1 55 LEU H 1 88 GLN H . . 3.860 2.514 2.417 2.587 . 0 0 "[ . 1 . 2]" 1
1080 1 55 LEU H 1 88 GLN HB2 . . 4.900 4.882 4.749 4.928 0.028 15 0 "[ . 1 . 2]" 1
1081 1 55 LEU H 1 88 GLN HB3 . . 4.590 4.504 4.387 4.614 0.024 20 0 "[ . 1 . 2]" 1
1082 1 55 LEU H 1 89 LYS HA . . 4.820 4.468 4.257 4.740 . 0 0 "[ . 1 . 2]" 1
1083 1 55 LEU H 1 90 SER QB . . 5.320 4.533 3.800 5.073 . 0 0 "[ . 1 . 2]" 1
1084 1 55 LEU HA 1 55 LEU QD . . 3.440 2.543 2.353 2.722 . 0 0 "[ . 1 . 2]" 1
1085 1 55 LEU HA 1 55 LEU HG . . 3.990 2.296 2.196 2.381 . 0 0 "[ . 1 . 2]" 1
1086 1 55 LEU HA 1 56 VAL H . . 2.900 2.190 2.177 2.207 . 0 0 "[ . 1 . 2]" 1
1087 1 55 LEU HA 1 56 VAL HB . . 4.620 4.640 4.623 4.661 0.041 9 0 "[ . 1 . 2]" 1
1088 1 55 LEU HA 1 56 VAL MG2 . . 4.120 3.584 3.505 3.645 . 0 0 "[ . 1 . 2]" 1
1089 1 55 LEU HA 1 88 GLN H . . 5.430 4.332 4.267 4.376 . 0 0 "[ . 1 . 2]" 1
1090 1 55 LEU HB2 1 88 GLN H . . 3.800 3.693 3.586 3.797 . 0 0 "[ . 1 . 2]" 1
1091 1 55 LEU HB2 1 90 SER QB . . 4.550 2.981 2.217 3.490 . 0 0 "[ . 1 . 2]" 1
1092 1 55 LEU HB3 1 56 VAL H . . 4.180 4.141 4.070 4.223 0.043 9 0 "[ . 1 . 2]" 1
1093 1 55 LEU HB3 1 57 VAL MG1 . . 3.850 3.855 3.781 3.892 0.042 13 0 "[ . 1 . 2]" 1
1094 1 55 LEU HB3 1 57 VAL MG2 . . 4.500 4.461 4.338 4.504 0.004 5 0 "[ . 1 . 2]" 1
1095 1 55 LEU HB3 1 88 GLN H . . 4.100 3.017 2.946 3.112 . 0 0 "[ . 1 . 2]" 1
1096 1 55 LEU HB3 1 88 GLN HB3 . . 3.680 2.645 2.539 2.769 . 0 0 "[ . 1 . 2]" 1
1097 1 55 LEU QD 1 56 VAL H . . 4.180 3.520 2.897 3.996 . 0 0 "[ . 1 . 2]" 1
1098 1 55 LEU QD 1 88 GLN H . . 4.850 4.247 4.089 4.411 . 0 0 "[ . 1 . 2]" 1
1099 1 55 LEU QD 1 88 GLN HB3 . . 3.750 3.208 3.057 3.299 . 0 0 "[ . 1 . 2]" 1
1100 1 55 LEU QD 1 88 GLN HE21 . . 4.810 3.724 3.349 4.044 . 0 0 "[ . 1 . 2]" 1
1101 1 55 LEU QD 1 90 SER H . . 5.460 4.230 3.931 4.591 . 0 0 "[ . 1 . 2]" 1
1102 1 55 LEU QD 1 90 SER HA . . 4.040 3.486 3.093 3.879 . 0 0 "[ . 1 . 2]" 1
1103 1 55 LEU QD 1 90 SER QB . . 3.990 2.479 1.956 2.958 . 0 0 "[ . 1 . 2]" 1
1104 1 55 LEU HG 1 56 VAL H . . 3.670 3.727 3.588 3.815 0.145 7 0 "[ . 1 . 2]" 1
1105 1 56 VAL H 1 56 VAL HB . . 3.320 2.471 2.455 2.493 . 0 0 "[ . 1 . 2]" 1
1106 1 56 VAL H 1 56 VAL MG2 . . 3.180 2.174 1.924 2.295 . 0 0 "[ . 1 . 2]" 1
1107 1 56 VAL H 1 57 VAL H . . 4.820 4.573 4.555 4.590 . 0 0 "[ . 1 . 2]" 1
1108 1 56 VAL H 1 57 VAL MG1 . . 5.230 5.204 5.136 5.265 0.035 11 0 "[ . 1 . 2]" 1
1109 1 56 VAL H 1 87 LEU HA . . 4.770 4.343 4.268 4.447 . 0 0 "[ . 1 . 2]" 1
1110 1 56 VAL H 1 87 LEU MD1 . . 5.380 4.395 4.295 4.503 . 0 0 "[ . 1 . 2]" 1
1111 1 56 VAL HA 1 56 VAL MG1 . . 2.930 2.377 2.360 2.391 . 0 0 "[ . 1 . 2]" 1
1112 1 56 VAL HA 1 56 VAL MG2 . . 3.190 2.450 2.397 2.518 . 0 0 "[ . 1 . 2]" 1
1113 1 56 VAL HA 1 57 VAL H . . 2.890 2.211 2.203 2.218 . 0 0 "[ . 1 . 2]" 1
1114 1 56 VAL HA 1 87 LEU H . . 5.500 4.587 4.510 4.686 . 0 0 "[ . 1 . 2]" 1
1115 1 56 VAL HA 1 87 LEU HA . . 3.390 2.035 1.988 2.122 . 0 0 "[ . 1 . 2]" 1
1116 1 56 VAL HA 1 87 LEU HB2 . . 4.920 4.642 4.575 4.728 . 0 0 "[ . 1 . 2]" 1
1117 1 56 VAL HA 1 87 LEU HB3 . . 5.070 3.930 3.851 4.032 . 0 0 "[ . 1 . 2]" 1
1118 1 56 VAL HA 1 87 LEU MD1 . . 3.350 2.208 2.132 2.285 . 0 0 "[ . 1 . 2]" 1
1119 1 56 VAL HA 1 87 LEU HG . . 3.780 2.883 2.831 2.965 . 0 0 "[ . 1 . 2]" 1
1120 1 56 VAL HA 1 88 GLN H . . 4.470 3.889 3.817 3.938 . 0 0 "[ . 1 . 2]" 1
1121 1 56 VAL HB 1 64 THR HG1 . . 4.910 3.891 3.005 4.595 . 0 0 "[ . 1 . 2]" 1
1122 1 56 VAL HB 1 64 THR MG . . 4.450 3.486 3.187 3.758 . 0 0 "[ . 1 . 2]" 1
1123 1 56 VAL MG1 1 57 VAL H . . 3.650 2.398 2.341 2.470 . 0 0 "[ . 1 . 2]" 1
1124 1 56 VAL MG1 1 58 ALA H . . 3.630 3.164 2.694 3.482 . 0 0 "[ . 1 . 2]" 1
1125 1 56 VAL MG1 1 58 ALA HA . . 4.640 4.011 3.855 4.195 . 0 0 "[ . 1 . 2]" 1
1126 1 56 VAL MG1 1 59 ILE H . . 5.090 4.299 4.103 4.493 . 0 0 "[ . 1 . 2]" 1
1127 1 56 VAL MG1 1 59 ILE HA . . 4.540 3.673 3.540 3.817 . 0 0 "[ . 1 . 2]" 1
1128 1 56 VAL MG1 1 59 ILE HG13 . . 3.290 2.386 2.230 2.569 . 0 0 "[ . 1 . 2]" 1
1129 1 56 VAL MG1 1 64 THR H . . 5.200 4.803 4.617 5.005 . 0 0 "[ . 1 . 2]" 1
1130 1 56 VAL MG1 1 64 THR HB . . 4.800 3.816 3.577 4.190 . 0 0 "[ . 1 . 2]" 1
1131 1 56 VAL MG1 1 64 THR HG1 . . 4.280 3.220 2.603 3.649 . 0 0 "[ . 1 . 2]" 1
1132 1 56 VAL MG1 1 64 THR MG . . 3.060 2.027 1.876 2.270 . 0 0 "[ . 1 . 2]" 1
1133 1 56 VAL MG1 1 85 LEU HA . . 4.570 3.923 3.797 4.019 . 0 0 "[ . 1 . 2]" 1
1134 1 56 VAL MG1 1 85 LEU HB2 . . 4.160 4.200 4.178 4.225 0.065 3 0 "[ . 1 . 2]" 1
1135 1 56 VAL MG1 1 85 LEU MD1 . . 4.100 3.998 3.866 4.079 . 0 0 "[ . 1 . 2]" 1
1136 1 56 VAL MG1 1 86 THR H . . 3.800 3.487 3.217 3.639 . 0 0 "[ . 1 . 2]" 1
1137 1 56 VAL MG1 1 87 LEU HA . . 4.630 3.746 3.684 3.817 . 0 0 "[ . 1 . 2]" 1
1138 1 56 VAL MG2 1 57 VAL H . . 4.300 4.166 4.154 4.196 . 0 0 "[ . 1 . 2]" 1
1139 1 56 VAL MG2 1 87 LEU HA . . 4.780 3.645 3.592 3.722 . 0 0 "[ . 1 . 2]" 1
1140 1 56 VAL MG2 1 87 LEU HG . . 4.050 2.272 2.115 2.449 . 0 0 "[ . 1 . 2]" 1
1141 1 57 VAL H 1 57 VAL HB . . 3.510 3.410 3.392 3.423 . 0 0 "[ . 1 . 2]" 1
1142 1 57 VAL H 1 57 VAL MG1 . . 3.690 3.379 3.335 3.402 . 0 0 "[ . 1 . 2]" 1
1143 1 57 VAL H 1 57 VAL MG2 . . 3.030 1.812 1.797 1.821 . 0 0 "[ . 1 . 2]" 1
1144 1 57 VAL H 1 58 ALA H . . 3.030 2.257 2.034 2.404 . 0 0 "[ . 1 . 2]" 1
1145 1 57 VAL H 1 86 THR H . . 4.540 4.158 3.985 4.265 . 0 0 "[ . 1 . 2]" 1
1146 1 57 VAL H 1 86 THR HB . . 4.590 3.494 3.341 3.622 . 0 0 "[ . 1 . 2]" 1
1147 1 57 VAL H 1 86 THR MG . . 4.430 4.003 3.817 4.169 . 0 0 "[ . 1 . 2]" 1
1148 1 57 VAL H 1 87 LEU HA . . 2.880 2.793 2.728 2.823 . 0 0 "[ . 1 . 2]" 1
1149 1 57 VAL H 1 87 LEU HB3 . . 5.300 5.307 5.246 5.340 0.040 5 0 "[ . 1 . 2]" 1
1150 1 57 VAL H 1 87 LEU MD1 . . 3.970 3.200 3.146 3.284 . 0 0 "[ . 1 . 2]" 1
1151 1 57 VAL H 1 87 LEU HG . . 4.790 4.824 4.804 4.859 0.069 10 0 "[ . 1 . 2]" 1
1152 1 57 VAL HA 1 57 VAL MG1 . . 3.240 2.106 2.083 2.167 . 0 0 "[ . 1 . 2]" 1
1153 1 57 VAL HA 1 57 VAL MG2 . . 3.250 3.100 3.091 3.109 . 0 0 "[ . 1 . 2]" 1
1154 1 57 VAL HA 1 58 ALA HA . . 4.900 4.547 4.539 4.553 . 0 0 "[ . 1 . 2]" 1
1155 1 57 VAL HA 1 64 THR H . . 4.480 3.633 3.523 3.695 . 0 0 "[ . 1 . 2]" 1
1156 1 57 VAL HA 1 64 THR HG1 . . 3.070 2.772 2.561 3.066 . 0 0 "[ . 1 . 2]" 1
1157 1 57 VAL HA 1 64 THR MG . . 3.960 3.867 3.548 3.975 0.015 8 0 "[ . 1 . 2]" 1
1158 1 57 VAL HB 1 58 ALA H . . 3.800 2.897 2.676 3.245 . 0 0 "[ . 1 . 2]" 1
1159 1 57 VAL HB 1 58 ALA MB . . 3.660 3.226 3.092 3.373 . 0 0 "[ . 1 . 2]" 1
1160 1 57 VAL HB 1 86 THR HB . . 3.990 3.925 3.709 4.009 0.019 18 0 "[ . 1 . 2]" 1
1161 1 57 VAL MG1 1 58 ALA H . . 4.420 4.084 3.992 4.239 . 0 0 "[ . 1 . 2]" 1
1162 1 57 VAL MG1 1 63 ASN HA . . 5.060 5.094 5.049 5.134 0.074 2 0 "[ . 1 . 2]" 1
1163 1 57 VAL MG1 1 63 ASN HD21 . . 5.200 4.252 3.803 5.201 0.001 6 0 "[ . 1 . 2]" 1
1164 1 57 VAL MG1 1 63 ASN HD22 . . 5.500 3.707 3.168 4.253 . 0 0 "[ . 1 . 2]" 1
1165 1 57 VAL MG1 1 64 THR H . . 4.940 4.699 4.595 4.763 . 0 0 "[ . 1 . 2]" 1
1166 1 57 VAL MG1 1 64 THR HG1 . . 4.860 4.397 4.204 4.680 . 0 0 "[ . 1 . 2]" 1
1167 1 57 VAL MG1 1 87 LEU HA . . 4.590 4.370 4.345 4.418 . 0 0 "[ . 1 . 2]" 1
1168 1 57 VAL MG1 1 88 GLN H . . 4.410 4.411 4.351 4.444 0.034 11 0 "[ . 1 . 2]" 1
1169 1 57 VAL MG1 1 88 GLN HB2 . . 4.040 2.457 2.297 2.537 . 0 0 "[ . 1 . 2]" 1
1170 1 57 VAL MG1 1 88 GLN HB3 . . 4.000 3.529 3.397 3.623 . 0 0 "[ . 1 . 2]" 1
1171 1 57 VAL MG1 1 88 GLN HE21 . . 5.120 3.620 2.811 4.939 . 0 0 "[ . 1 . 2]" 1
1172 1 57 VAL MG1 1 88 GLN HE22 . . 5.260 4.627 4.213 5.233 . 0 0 "[ . 1 . 2]" 1
1173 1 57 VAL MG1 1 88 GLN HG2 . . 4.940 4.366 4.008 4.636 . 0 0 "[ . 1 . 2]" 1
1174 1 57 VAL MG1 1 88 GLN HG3 . . 4.090 3.072 2.612 3.513 . 0 0 "[ . 1 . 2]" 1
1175 1 57 VAL MG2 1 58 ALA H . . 3.320 1.984 1.898 2.260 . 0 0 "[ . 1 . 2]" 1
1176 1 57 VAL MG2 1 58 ALA HA . . 5.200 4.503 4.471 4.597 . 0 0 "[ . 1 . 2]" 1
1177 1 57 VAL MG2 1 64 THR HG1 . . 4.790 4.797 4.735 4.814 0.024 15 0 "[ . 1 . 2]" 1
1178 1 57 VAL MG2 1 86 THR H . . 4.700 3.952 3.857 4.008 . 0 0 "[ . 1 . 2]" 1
1179 1 57 VAL MG2 1 86 THR HA . . 5.140 3.749 3.599 3.824 . 0 0 "[ . 1 . 2]" 1
1180 1 57 VAL MG2 1 86 THR HB . . 3.510 2.239 2.073 2.389 . 0 0 "[ . 1 . 2]" 1
1181 1 57 VAL MG2 1 86 THR MG . . 2.990 2.087 1.871 2.292 . 0 0 "[ . 1 . 2]" 1
1182 1 57 VAL MG2 1 87 LEU H . . 4.670 3.634 3.462 3.711 . 0 0 "[ . 1 . 2]" 1
1183 1 57 VAL MG2 1 87 LEU HA . . 3.590 2.514 2.455 2.567 . 0 0 "[ . 1 . 2]" 1
1184 1 57 VAL MG2 1 88 GLN H . . 4.090 3.529 3.441 3.600 . 0 0 "[ . 1 . 2]" 1
1185 1 57 VAL MG2 1 88 GLN HA . . 4.770 3.903 3.725 4.030 . 0 0 "[ . 1 . 2]" 1
1186 1 57 VAL MG2 1 88 GLN HB2 . . 3.520 2.591 2.457 2.632 . 0 0 "[ . 1 . 2]" 1
1187 1 57 VAL MG2 1 88 GLN HB3 . . 4.090 4.062 3.927 4.103 0.013 8 0 "[ . 1 . 2]" 1
1188 1 57 VAL MG2 1 88 GLN HE21 . . 5.370 4.809 4.340 5.390 0.020 10 0 "[ . 1 . 2]" 1
1189 1 57 VAL MG2 1 88 GLN HG2 . . 4.470 4.152 3.818 4.481 0.011 20 0 "[ . 1 . 2]" 1
1190 1 57 VAL MG2 1 88 GLN HG3 . . 3.930 3.212 2.944 3.425 . 0 0 "[ . 1 . 2]" 1
1191 1 58 ALA H 1 58 ALA MB . . 3.220 2.475 2.374 2.626 . 0 0 "[ . 1 . 2]" 1
1192 1 58 ALA H 1 59 ILE H . . 5.150 4.386 4.334 4.456 . 0 0 "[ . 1 . 2]" 1
1193 1 58 ALA H 1 59 ILE HA . . 4.970 4.680 4.632 4.775 . 0 0 "[ . 1 . 2]" 1
1194 1 58 ALA H 1 59 ILE HG13 . . 5.140 4.586 4.314 4.771 . 0 0 "[ . 1 . 2]" 1
1195 1 58 ALA H 1 63 ASN HA . . 4.630 4.171 4.082 4.307 . 0 0 "[ . 1 . 2]" 1
1196 1 58 ALA H 1 86 THR H . . 3.510 3.236 2.932 3.386 . 0 0 "[ . 1 . 2]" 1
1197 1 58 ALA H 1 86 THR HA . . 5.500 4.531 4.353 4.618 . 0 0 "[ . 1 . 2]" 1
1198 1 58 ALA H 1 86 THR HB . . 3.370 1.956 1.936 2.145 . 0 0 "[ . 1 . 2]" 1
1199 1 58 ALA H 1 87 LEU HA . . 4.800 4.606 4.395 4.766 . 0 0 "[ . 1 . 2]" 1
1200 1 58 ALA H 1 87 LEU MD1 . . 5.100 4.278 3.955 4.462 . 0 0 "[ . 1 . 2]" 1
1201 1 58 ALA HA 1 59 ILE H . . 2.890 2.276 2.214 2.389 . 0 0 "[ . 1 . 2]" 1
1202 1 58 ALA HA 1 59 ILE HA . . 4.930 4.369 4.349 4.420 . 0 0 "[ . 1 . 2]" 1
1203 1 58 ALA HA 1 59 ILE HB . . 4.590 4.452 4.328 4.518 . 0 0 "[ . 1 . 2]" 1
1204 1 58 ALA HA 1 59 ILE MD . . 5.240 4.670 4.401 4.944 . 0 0 "[ . 1 . 2]" 1
1205 1 58 ALA HA 1 62 VAL H . . 4.730 3.699 3.471 3.969 . 0 0 "[ . 1 . 2]" 1
1206 1 58 ALA HA 1 63 ASN H . . 5.180 3.802 3.664 3.956 . 0 0 "[ . 1 . 2]" 1
1207 1 58 ALA HA 1 63 ASN HA . . 3.480 2.070 1.987 2.255 . 0 0 "[ . 1 . 2]" 1
1208 1 58 ALA HA 1 64 THR H . . 3.650 3.124 2.777 3.293 . 0 0 "[ . 1 . 2]" 1
1209 1 58 ALA HA 1 64 THR MG . . 2.880 2.084 1.955 2.343 . 0 0 "[ . 1 . 2]" 1
1210 1 58 ALA HA 1 67 MET ME . . 4.810 4.464 3.607 4.794 . 0 0 "[ . 1 . 2]" 1
1211 1 58 ALA HA 1 86 THR HB . . 4.950 4.213 4.030 4.347 . 0 0 "[ . 1 . 2]" 1
1212 1 58 ALA MB 1 59 ILE H . . 3.220 2.970 2.632 3.189 . 0 0 "[ . 1 . 2]" 1
1213 1 58 ALA MB 1 59 ILE HA . . 4.380 4.187 4.044 4.326 . 0 0 "[ . 1 . 2]" 1
1214 1 58 ALA MB 1 61 GLY H . . 3.930 2.747 2.541 3.021 . 0 0 "[ . 1 . 2]" 1
1215 1 58 ALA MB 1 61 GLY HA2 . . 4.450 2.625 2.290 3.023 . 0 0 "[ . 1 . 2]" 1
1216 1 58 ALA MB 1 61 GLY HA3 . . 3.810 3.936 3.693 4.264 0.454 6 0 "[ . 1 . 2]" 1
1217 1 58 ALA MB 1 62 VAL H . . 3.800 2.568 2.410 2.807 . 0 0 "[ . 1 . 2]" 1
1218 1 58 ALA MB 1 62 VAL HA . . 3.760 3.355 3.133 3.501 . 0 0 "[ . 1 . 2]" 1
1219 1 58 ALA MB 1 63 ASN H . . 4.030 2.803 2.514 3.184 . 0 0 "[ . 1 . 2]" 1
1220 1 58 ALA MB 1 63 ASN HA . . 3.280 2.174 2.007 2.460 . 0 0 "[ . 1 . 2]" 1
1221 1 58 ALA MB 1 63 ASN HB2 . . 4.830 3.538 3.380 3.704 . 0 0 "[ . 1 . 2]" 1
1222 1 58 ALA MB 1 63 ASN HB3 . . 4.730 4.452 4.257 4.723 . 0 0 "[ . 1 . 2]" 1
1223 1 59 ILE H 1 59 ILE HB . . 3.330 2.422 2.328 2.601 . 0 0 "[ . 1 . 2]" 1
1224 1 59 ILE H 1 59 ILE MD . . 4.550 3.651 3.228 4.219 . 0 0 "[ . 1 . 2]" 1
1225 1 59 ILE H 1 59 ILE MG . . 3.950 3.729 3.688 3.797 . 0 0 "[ . 1 . 2]" 1
1226 1 59 ILE H 1 60 ASP H . . 5.070 4.261 4.122 4.347 . 0 0 "[ . 1 . 2]" 1
1227 1 59 ILE H 1 62 VAL H . . 3.570 2.411 2.191 2.585 . 0 0 "[ . 1 . 2]" 1
1228 1 59 ILE H 1 62 VAL HA . . 5.240 4.236 4.062 4.447 . 0 0 "[ . 1 . 2]" 1
1229 1 59 ILE H 1 62 VAL HB . . 4.320 3.803 2.926 4.445 0.125 8 0 "[ . 1 . 2]" 1
1230 1 59 ILE H 1 62 VAL QG . . 4.720 2.590 1.839 3.619 . 0 0 "[ . 1 . 2]" 1
1231 1 59 ILE H 1 63 ASN H . . 5.410 4.511 4.375 4.719 . 0 0 "[ . 1 . 2]" 1
1232 1 59 ILE H 1 63 ASN HA . . 4.370 3.944 3.821 4.140 . 0 0 "[ . 1 . 2]" 1
1233 1 59 ILE H 1 67 MET ME . . 3.960 3.619 3.217 3.885 . 0 0 "[ . 1 . 2]" 1
1234 1 59 ILE HA 1 59 ILE MD . . 4.160 3.830 3.764 3.865 . 0 0 "[ . 1 . 2]" 1
1235 1 59 ILE HA 1 59 ILE HG12 . . 3.990 2.620 2.402 2.777 . 0 0 "[ . 1 . 2]" 1
1236 1 59 ILE HA 1 59 ILE HG13 . . 3.970 2.756 2.541 2.975 . 0 0 "[ . 1 . 2]" 1
1237 1 59 ILE HA 1 59 ILE MG . . 3.080 2.436 2.387 2.583 . 0 0 "[ . 1 . 2]" 1
1238 1 59 ILE HA 1 60 ASP H . . 3.050 2.186 2.182 2.190 . 0 0 "[ . 1 . 2]" 1
1239 1 59 ILE HA 1 75 LYS QG . . 5.230 4.865 4.563 5.238 0.008 11 0 "[ . 1 . 2]" 1
1240 1 59 ILE HA 1 85 LEU HA . . 3.670 2.133 2.048 2.262 . 0 0 "[ . 1 . 2]" 1
1241 1 59 ILE HA 1 85 LEU MD2 . . 3.390 2.149 1.978 2.421 . 0 0 "[ . 1 . 2]" 1
1242 1 59 ILE HA 1 86 THR H . . 4.360 2.832 2.629 3.050 . 0 0 "[ . 1 . 2]" 1
1243 1 59 ILE HB 1 59 ILE MD . . 2.740 2.194 2.027 2.410 . 0 0 "[ . 1 . 2]" 1
1244 1 59 ILE HB 1 62 VAL H . . 4.840 3.952 3.812 4.157 . 0 0 "[ . 1 . 2]" 1
1245 1 59 ILE HB 1 62 VAL HB . . 4.680 4.183 3.195 4.730 0.050 16 0 "[ . 1 . 2]" 1
1246 1 59 ILE HB 1 64 THR MG . . 3.130 2.985 2.833 3.068 . 0 0 "[ . 1 . 2]" 1
1247 1 59 ILE HB 1 67 MET ME . . 3.250 2.997 2.361 3.280 0.030 14 0 "[ . 1 . 2]" 1
1248 1 59 ILE HB 1 75 LYS QB . . 3.950 3.268 3.026 3.689 . 0 0 "[ . 1 . 2]" 1
1249 1 59 ILE HB 1 75 LYS HD2 . . 5.180 5.069 3.949 5.213 0.033 5 0 "[ . 1 . 2]" 1
1250 1 59 ILE HB 1 75 LYS HD3 . . 4.610 4.064 3.661 5.193 0.583 11 2 "[ . 1+ . - 2]" 1
1251 1 59 ILE HB 1 75 LYS QE . . 4.890 3.897 2.976 4.356 . 0 0 "[ . 1 . 2]" 1
1252 1 59 ILE HB 1 75 LYS QG . . 3.860 2.595 2.110 3.138 . 0 0 "[ . 1 . 2]" 1
1253 1 59 ILE MD 1 64 THR HA . . 5.150 4.051 3.611 4.669 . 0 0 "[ . 1 . 2]" 1
1254 1 59 ILE MD 1 64 THR HB . . 5.140 3.196 2.672 3.694 . 0 0 "[ . 1 . 2]" 1
1255 1 59 ILE MD 1 64 THR HG1 . . 5.050 4.471 4.071 5.029 . 0 0 "[ . 1 . 2]" 1
1256 1 59 ILE MD 1 64 THR MG . . 2.820 1.961 1.718 2.423 . 0 0 "[ . 1 . 2]" 1
1257 1 59 ILE MD 1 67 MET QB . . 4.880 4.008 3.582 4.786 . 0 0 "[ . 1 . 2]" 1
1258 1 59 ILE MD 1 67 MET ME . . 3.270 2.631 2.123 3.102 . 0 0 "[ . 1 . 2]" 1
1259 1 59 ILE MD 1 75 LYS QB . . 3.570 2.532 2.229 2.828 . 0 0 "[ . 1 . 2]" 1
1260 1 59 ILE MD 1 75 LYS HD3 . . 4.680 4.130 3.525 5.373 0.693 11 2 "[ . 1+ . - 2]" 1
1261 1 59 ILE MD 1 75 LYS QE . . 5.240 4.702 4.079 5.250 0.010 5 0 "[ . 1 . 2]" 1
1262 1 59 ILE MD 1 75 LYS QG . . 4.080 3.306 2.616 3.818 . 0 0 "[ . 1 . 2]" 1
1263 1 59 ILE MD 1 76 ILE H . . 4.750 4.183 3.875 4.377 . 0 0 "[ . 1 . 2]" 1
1264 1 59 ILE MD 1 76 ILE HG13 . . 3.600 3.471 2.886 3.608 0.008 14 0 "[ . 1 . 2]" 1
1265 1 59 ILE HG12 1 64 THR MG . . 4.010 3.116 2.955 3.271 . 0 0 "[ . 1 . 2]" 1
1266 1 59 ILE HG13 1 67 MET ME . . 5.050 4.132 3.503 4.733 . 0 0 "[ . 1 . 2]" 1
1267 1 59 ILE HG13 1 75 LYS QB . . 5.140 4.830 4.592 5.104 . 0 0 "[ . 1 . 2]" 1
1268 1 59 ILE MG 1 60 ASP H . . 3.740 2.998 2.919 3.188 . 0 0 "[ . 1 . 2]" 1
1269 1 59 ILE MG 1 60 ASP HA . . 4.470 4.096 3.976 4.216 . 0 0 "[ . 1 . 2]" 1
1270 1 59 ILE MG 1 60 ASP HB2 . . 4.560 2.716 2.527 2.857 . 0 0 "[ . 1 . 2]" 1
1271 1 59 ILE MG 1 60 ASP HB3 . . 3.890 3.739 3.263 4.220 0.330 1 0 "[ . 1 . 2]" 1
1272 1 59 ILE MG 1 61 GLY H . . 5.140 4.422 4.334 4.567 . 0 0 "[ . 1 . 2]" 1
1273 1 59 ILE MG 1 62 VAL H . . 5.210 4.405 4.265 4.549 . 0 0 "[ . 1 . 2]" 1
1274 1 59 ILE MG 1 75 LYS HA . . 4.900 4.230 3.873 4.499 . 0 0 "[ . 1 . 2]" 1
1275 1 59 ILE MG 1 75 LYS QB . . 3.260 2.159 1.774 2.834 . 0 0 "[ . 1 . 2]" 1
1276 1 59 ILE MG 1 75 LYS HD3 . . 4.280 3.927 3.423 4.280 . 0 0 "[ . 1 . 2]" 1
1277 1 59 ILE MG 1 75 LYS QE . . 3.900 3.506 2.411 3.923 0.023 13 0 "[ . 1 . 2]" 1
1278 1 59 ILE MG 1 75 LYS QG . . 3.390 1.961 1.759 2.439 . 0 0 "[ . 1 . 2]" 1
1279 1 59 ILE MG 1 76 ILE H . . 4.330 3.953 3.690 4.248 . 0 0 "[ . 1 . 2]" 1
1280 1 59 ILE MG 1 76 ILE HA . . 4.170 3.665 3.080 3.958 . 0 0 "[ . 1 . 2]" 1
1281 1 59 ILE MG 1 76 ILE HG13 . . 3.830 3.588 3.013 3.832 0.002 2 0 "[ . 1 . 2]" 1
1282 1 59 ILE MG 1 85 LEU HA . . 4.960 3.353 3.026 3.684 . 0 0 "[ . 1 . 2]" 1
1283 1 60 ASP H 1 61 GLY H . . 3.790 2.584 2.524 2.624 . 0 0 "[ . 1 . 2]" 1
1284 1 60 ASP H 1 62 VAL H . . 5.340 3.967 3.927 4.008 . 0 0 "[ . 1 . 2]" 1
1285 1 60 ASP H 1 84 SER H . . 4.670 4.372 3.979 4.671 0.001 14 0 "[ . 1 . 2]" 1
1286 1 60 ASP H 1 84 SER HB2 . . 4.280 3.823 3.556 3.977 . 0 0 "[ . 1 . 2]" 1
1287 1 60 ASP H 1 84 SER HB3 . . 4.390 3.110 2.803 3.360 . 0 0 "[ . 1 . 2]" 1
1288 1 60 ASP H 1 85 LEU HA . . 4.710 2.230 1.949 2.550 . 0 0 "[ . 1 . 2]" 1
1289 1 60 ASP H 1 85 LEU MD2 . . 4.390 3.109 2.615 3.418 . 0 0 "[ . 1 . 2]" 1
1290 1 60 ASP H 1 86 THR H . . 5.310 3.285 2.964 3.819 . 0 0 "[ . 1 . 2]" 1
1291 1 60 ASP HA 1 61 GLY H . . 3.410 3.221 3.097 3.285 . 0 0 "[ . 1 . 2]" 1
1292 1 60 ASP HA 1 61 GLY HA3 . . 4.830 4.537 4.481 4.577 . 0 0 "[ . 1 . 2]" 1
1293 1 60 ASP HA 1 62 VAL H . . 4.650 4.727 4.666 4.805 0.155 14 0 "[ . 1 . 2]" 1
1294 1 60 ASP HA 1 84 SER H . . 4.350 3.246 2.829 3.558 . 0 0 "[ . 1 . 2]" 1
1295 1 60 ASP HA 1 84 SER HB2 . . 3.540 2.091 2.001 2.289 . 0 0 "[ . 1 . 2]" 1
1296 1 60 ASP HA 1 84 SER HB3 . . 3.470 2.133 1.994 2.552 . 0 0 "[ . 1 . 2]" 1
1297 1 60 ASP HB2 1 61 GLY H . . 4.970 4.240 4.073 4.354 . 0 0 "[ . 1 . 2]" 1
1298 1 60 ASP HB2 1 62 VAL H . . 5.200 4.686 4.286 4.990 . 0 0 "[ . 1 . 2]" 1
1299 1 60 ASP HB2 1 62 VAL QG . . 4.890 4.077 3.534 4.686 . 0 0 "[ . 1 . 2]" 1
1300 1 60 ASP HB2 1 84 SER HB2 . . 5.090 3.874 3.243 4.703 . 0 0 "[ . 1 . 2]" 1
1301 1 60 ASP HB3 1 61 GLY H . . 5.300 3.813 3.683 4.137 . 0 0 "[ . 1 . 2]" 1
1302 1 60 ASP HB3 1 62 VAL H . . 4.980 3.993 3.769 4.448 . 0 0 "[ . 1 . 2]" 1
1303 1 60 ASP HB3 1 62 VAL QG . . 4.660 3.319 2.955 3.688 . 0 0 "[ . 1 . 2]" 1
1304 1 60 ASP HB3 1 75 LYS QG . . 5.120 4.188 3.612 4.675 . 0 0 "[ . 1 . 2]" 1
1305 1 61 GLY H 1 62 VAL H . . 3.580 1.993 1.892 2.194 . 0 0 "[ . 1 . 2]" 1
1306 1 61 GLY H 1 62 VAL QG . . 5.000 3.695 3.386 4.252 . 0 0 "[ . 1 . 2]" 1
1307 1 61 GLY H 1 84 SER HB3 . . 5.180 4.476 3.932 4.847 . 0 0 "[ . 1 . 2]" 1
1308 1 61 GLY HA2 1 62 VAL QG . . 4.700 4.524 4.134 4.704 0.004 15 0 "[ . 1 . 2]" 1
1309 1 61 GLY HA3 1 62 VAL QG . . 4.890 4.225 3.528 4.661 . 0 0 "[ . 1 . 2]" 1
1310 1 62 VAL H 1 62 VAL HB . . 3.100 2.761 2.409 2.966 . 0 0 "[ . 1 . 2]" 1
1311 1 62 VAL H 1 62 VAL QG . . 3.140 2.412 2.041 2.974 . 0 0 "[ . 1 . 2]" 1
1312 1 62 VAL H 1 63 ASN H . . 4.810 4.140 4.073 4.210 . 0 0 "[ . 1 . 2]" 1
1313 1 62 VAL H 1 75 LYS QE . . 4.990 4.501 3.877 4.985 . 0 0 "[ . 1 . 2]" 1
1314 1 62 VAL HA 1 62 VAL QG . . 2.820 2.187 2.045 2.297 . 0 0 "[ . 1 . 2]" 1
1315 1 62 VAL HA 1 63 ASN H . . 2.640 2.193 2.185 2.209 . 0 0 "[ . 1 . 2]" 1
1316 1 62 VAL HA 1 63 ASN HA . . 4.700 4.358 4.338 4.385 . 0 0 "[ . 1 . 2]" 1
1317 1 62 VAL HA 1 63 ASN HB2 . . 4.420 4.470 4.352 4.732 0.312 1 0 "[ . 1 . 2]" 1
1318 1 62 VAL HA 1 63 ASN HB3 . . 4.730 4.681 4.424 4.810 0.080 20 0 "[ . 1 . 2]" 1
1319 1 62 VAL HB 1 63 ASN H . . 4.630 4.510 4.385 4.574 . 0 0 "[ . 1 . 2]" 1
1320 1 62 VAL HB 1 75 LYS QE . . 3.390 2.639 1.979 3.171 . 0 0 "[ . 1 . 2]" 1
1321 1 62 VAL QG 1 63 ASN H . . 3.340 3.036 2.871 3.195 . 0 0 "[ . 1 . 2]" 1
1322 1 62 VAL QG 1 63 ASN HB2 . . 4.760 4.524 4.369 4.726 . 0 0 "[ . 1 . 2]" 1
1323 1 62 VAL QG 1 63 ASN HB3 . . 4.940 3.965 3.787 4.140 . 0 0 "[ . 1 . 2]" 1
1324 1 62 VAL QG 1 64 THR H . . 5.500 4.941 4.768 5.310 . 0 0 "[ . 1 . 2]" 1
1325 1 62 VAL QG 1 64 THR HA . . 4.850 4.144 3.955 4.456 . 0 0 "[ . 1 . 2]" 1
1326 1 62 VAL QG 1 67 MET ME . . 2.680 1.879 1.607 2.590 . 0 0 "[ . 1 . 2]" 1
1327 1 62 VAL QG 1 67 MET QG . . 4.740 3.359 2.817 4.740 . 0 0 "[ . 1 . 2]" 1
1328 1 62 VAL QG 1 75 LYS QE . . 3.320 1.875 1.658 2.231 . 0 0 "[ . 1 . 2]" 1
1329 1 63 ASN H 1 63 ASN HB2 . . 3.090 2.299 2.191 2.562 . 0 0 "[ . 1 . 2]" 1
1330 1 63 ASN H 1 63 ASN HB3 . . 3.210 2.743 2.432 2.904 . 0 0 "[ . 1 . 2]" 1
1331 1 63 ASN H 1 63 ASN HD21 . . 4.880 4.082 3.895 4.478 . 0 0 "[ . 1 . 2]" 1
1332 1 63 ASN H 1 64 THR H . . 5.000 4.668 4.653 4.675 . 0 0 "[ . 1 . 2]" 1
1333 1 63 ASN HA 1 63 ASN HD22 . . 5.500 3.701 3.385 4.365 . 0 0 "[ . 1 . 2]" 1
1334 1 63 ASN HA 1 64 THR H . . 2.950 2.431 2.363 2.518 . 0 0 "[ . 1 . 2]" 1
1335 1 63 ASN HA 1 64 THR HA . . 4.900 4.465 4.438 4.489 . 0 0 "[ . 1 . 2]" 1
1336 1 63 ASN HB2 1 64 THR H . . 4.430 4.072 3.810 4.210 . 0 0 "[ . 1 . 2]" 1
1337 1 63 ASN HB3 1 64 THR H . . 4.200 3.723 3.505 4.045 . 0 0 "[ . 1 . 2]" 1
1338 1 63 ASN HB3 1 65 ASP H . . 4.590 4.000 3.025 4.587 . 0 0 "[ . 1 . 2]" 1
1339 1 63 ASN HB3 1 66 THR MG . . 4.630 2.472 2.028 3.316 . 0 0 "[ . 1 . 2]" 1
1340 1 63 ASN HD21 1 64 THR H . . 5.500 3.558 2.834 4.836 . 0 0 "[ . 1 . 2]" 1
1341 1 63 ASN HD21 1 66 THR MG . . 5.500 5.101 4.689 5.513 0.013 7 0 "[ . 1 . 2]" 1
1342 1 63 ASN HD22 1 65 ASP H . . 5.140 3.246 2.142 3.865 . 0 0 "[ . 1 . 2]" 1
1343 1 64 THR H 1 64 THR HG1 . . 4.010 2.394 1.938 3.305 . 0 0 "[ . 1 . 2]" 1
1344 1 64 THR H 1 64 THR MG . . 3.110 2.488 2.174 2.831 . 0 0 "[ . 1 . 2]" 1
1345 1 64 THR H 1 65 ASP H . . 3.430 1.933 1.867 2.356 . 0 0 "[ . 1 . 2]" 1
1346 1 64 THR H 1 65 ASP QB . . 4.990 3.741 3.483 4.309 . 0 0 "[ . 1 . 2]" 1
1347 1 64 THR H 1 66 THR MG . . 4.700 4.225 3.794 4.653 . 0 0 "[ . 1 . 2]" 1
1348 1 64 THR H 1 67 MET ME . . 4.950 4.595 3.811 4.959 0.009 9 0 "[ . 1 . 2]" 1
1349 1 64 THR HA 1 64 THR MG . . 3.090 2.531 2.301 2.608 . 0 0 "[ . 1 . 2]" 1
1350 1 64 THR HA 1 66 THR H . . 4.440 3.445 2.960 3.994 . 0 0 "[ . 1 . 2]" 1
1351 1 64 THR HA 1 66 THR MG . . 3.920 3.499 3.323 3.803 . 0 0 "[ . 1 . 2]" 1
1352 1 64 THR HA 1 67 MET H . . 4.200 2.668 2.417 3.430 . 0 0 "[ . 1 . 2]" 1
1353 1 64 THR HA 1 67 MET QB . . 3.770 2.217 1.985 3.166 . 0 0 "[ . 1 . 2]" 1
1354 1 64 THR HA 1 67 MET ME . . 3.100 2.626 1.859 3.098 . 0 0 "[ . 1 . 2]" 1
1355 1 64 THR HA 1 67 MET QG . . 3.250 2.442 1.946 2.852 . 0 0 "[ . 1 . 2]" 1
1356 1 64 THR HA 1 72 ALA MB . . 4.910 3.963 3.609 4.647 . 0 0 "[ . 1 . 2]" 1
1357 1 64 THR HB 1 67 MET QB . . 4.480 3.409 2.867 4.534 0.054 7 0 "[ . 1 . 2]" 1
1358 1 64 THR HB 1 67 MET ME . . 4.420 3.934 3.118 4.422 0.002 15 0 "[ . 1 . 2]" 1
1359 1 64 THR HB 1 67 MET QG . . 4.870 4.317 2.306 4.892 0.022 3 0 "[ . 1 . 2]" 1
1360 1 64 THR HB 1 72 ALA MB . . 4.930 2.927 2.463 3.513 . 0 0 "[ . 1 . 2]" 1
1361 1 64 THR HG1 1 64 THR MG . . 2.960 2.089 1.971 2.235 . 0 0 "[ . 1 . 2]" 1
1362 1 64 THR MG 1 65 ASP H . . 4.320 3.927 3.658 4.153 . 0 0 "[ . 1 . 2]" 1
1363 1 64 THR MG 1 67 MET QB . . 4.450 3.643 3.196 4.401 . 0 0 "[ . 1 . 2]" 1
1364 1 64 THR MG 1 67 MET ME . . 3.230 2.687 2.021 3.130 . 0 0 "[ . 1 . 2]" 1
1365 1 64 THR MG 1 67 MET QG . . 4.410 3.895 3.320 4.315 . 0 0 "[ . 1 . 2]" 1
1366 1 65 ASP H 1 65 ASP QB . . 3.110 2.248 1.981 2.749 . 0 0 "[ . 1 . 2]" 1
1367 1 65 ASP H 1 66 THR H . . 3.730 2.783 2.561 3.579 . 0 0 "[ . 1 . 2]" 1
1368 1 65 ASP H 1 66 THR MG . . 4.820 3.805 3.091 4.138 . 0 0 "[ . 1 . 2]" 1
1369 1 65 ASP H 1 67 MET H . . 4.610 4.027 3.589 4.304 . 0 0 "[ . 1 . 2]" 1
1370 1 65 ASP HA 1 67 MET H . . 4.520 4.280 3.751 4.525 0.005 3 0 "[ . 1 . 2]" 1
1371 1 65 ASP QB 1 66 THR H . . 4.060 2.978 2.426 4.032 . 0 0 "[ . 1 . 2]" 1
1372 1 65 ASP QB 1 66 THR HA . . 5.020 4.065 3.777 4.940 . 0 0 "[ . 1 . 2]" 1
1373 1 65 ASP QB 1 66 THR MG . . 4.040 3.842 3.103 4.050 0.010 5 0 "[ . 1 . 2]" 1
1374 1 65 ASP QB 1 67 MET H . . 5.220 4.674 4.253 5.145 . 0 0 "[ . 1 . 2]" 1
1375 1 66 THR H 1 66 THR MG . . 3.410 2.031 1.892 2.727 . 0 0 "[ . 1 . 2]" 1
1376 1 66 THR H 1 67 MET H . . 3.210 2.180 1.893 2.436 . 0 0 "[ . 1 . 2]" 1
1377 1 66 THR H 1 67 MET QB . . 5.030 4.157 3.551 4.491 . 0 0 "[ . 1 . 2]" 1
1378 1 66 THR H 1 67 MET QG . . 4.600 3.661 3.052 4.203 . 0 0 "[ . 1 . 2]" 1
1379 1 66 THR HA 1 66 THR MG . . 3.240 3.239 3.216 3.245 0.005 10 0 "[ . 1 . 2]" 1
1380 1 66 THR HB 1 67 MET H . . 4.670 4.236 4.024 4.654 . 0 0 "[ . 1 . 2]" 1
1381 1 66 THR MG 1 67 MET H . . 4.850 2.458 2.025 3.424 . 0 0 "[ . 1 . 2]" 1
1382 1 67 MET H 1 67 MET QB . . 3.070 2.418 2.246 2.904 . 0 0 "[ . 1 . 2]" 1
1383 1 67 MET H 1 67 MET ME . . 4.550 4.039 3.350 4.486 . 0 0 "[ . 1 . 2]" 1
1384 1 67 MET H 1 67 MET QG . . 3.380 2.469 2.188 3.124 . 0 0 "[ . 1 . 2]" 1
1385 1 67 MET H 1 68 THR H . . 5.230 4.573 4.384 4.641 . 0 0 "[ . 1 . 2]" 1
1386 1 67 MET H 1 72 ALA MB . . 5.160 5.034 4.731 5.192 0.032 6 0 "[ . 1 . 2]" 1
1387 1 67 MET QB 1 68 THR H . . 3.780 2.932 2.665 3.351 . 0 0 "[ . 1 . 2]" 1
1388 1 67 MET QB 1 71 GLU H . . 5.080 4.611 4.352 4.995 . 0 0 "[ . 1 . 2]" 1
1389 1 67 MET QB 1 71 GLU HA . . 4.880 4.503 4.261 4.892 0.012 2 0 "[ . 1 . 2]" 1
1390 1 67 MET QB 1 71 GLU HB2 . . 3.810 2.375 1.985 2.843 . 0 0 "[ . 1 . 2]" 1
1391 1 67 MET QB 1 72 ALA H . . 3.780 2.995 2.792 3.516 . 0 0 "[ . 1 . 2]" 1
1392 1 67 MET QB 1 72 ALA HA . . 4.430 3.382 2.848 3.660 . 0 0 "[ . 1 . 2]" 1
1393 1 67 MET QB 1 72 ALA MB . . 3.470 2.951 2.524 3.485 0.015 6 0 "[ . 1 . 2]" 1
1394 1 67 MET ME 1 67 MET QG . . 2.840 2.203 1.974 2.587 . 0 0 "[ . 1 . 2]" 1
1395 1 67 MET ME 1 72 ALA HA . . 3.740 2.573 1.963 3.435 . 0 0 "[ . 1 . 2]" 1
1396 1 67 MET ME 1 72 ALA MB . . 4.260 3.343 2.591 3.817 . 0 0 "[ . 1 . 2]" 1
1397 1 67 MET ME 1 75 LYS QE . . 3.560 2.860 1.954 3.565 0.005 12 0 "[ . 1 . 2]" 1
1398 1 67 MET ME 1 75 LYS QG . . 3.330 2.956 2.030 3.356 0.026 6 0 "[ . 1 . 2]" 1
1399 1 67 MET QG 1 68 THR H . . 4.490 4.097 3.513 4.365 . 0 0 "[ . 1 . 2]" 1
1400 1 67 MET QG 1 71 GLU HB2 . . 4.350 4.143 3.633 4.363 0.013 3 0 "[ . 1 . 2]" 1
1401 1 67 MET QG 1 71 GLU HB3 . . 3.960 3.704 3.234 3.989 0.029 4 0 "[ . 1 . 2]" 1
1402 1 67 MET QG 1 72 ALA H . . 5.160 4.822 3.076 5.189 0.029 5 0 "[ . 1 . 2]" 1
1403 1 67 MET QG 1 72 ALA HA . . 5.170 4.632 3.566 5.098 . 0 0 "[ . 1 . 2]" 1
1404 1 67 MET QG 1 72 ALA MB . . 4.850 4.201 2.081 4.797 . 0 0 "[ . 1 . 2]" 1
1405 1 68 THR H 1 68 THR HG1 . . 5.450 2.777 1.904 3.365 . 0 0 "[ . 1 . 2]" 1
1406 1 68 THR H 1 68 THR MG . . 3.090 2.078 1.896 2.360 . 0 0 "[ . 1 . 2]" 1
1407 1 68 THR H 1 69 HIS H . . 5.380 4.551 4.374 4.642 . 0 0 "[ . 1 . 2]" 1
1408 1 68 THR H 1 71 GLU H . . 4.300 3.658 3.484 3.845 . 0 0 "[ . 1 . 2]" 1
1409 1 68 THR H 1 71 GLU HA . . 4.960 4.853 4.681 4.995 0.035 3 0 "[ . 1 . 2]" 1
1410 1 68 THR H 1 71 GLU HB2 . . 3.260 2.020 1.937 2.300 . 0 0 "[ . 1 . 2]" 1
1411 1 68 THR H 1 71 GLU HB3 . . 3.800 3.275 3.109 3.469 . 0 0 "[ . 1 . 2]" 1
1412 1 68 THR H 1 71 GLU HG2 . . 4.300 3.725 3.332 4.265 . 0 0 "[ . 1 . 2]" 1
1413 1 68 THR H 1 71 GLU HG3 . . 4.290 2.316 1.950 2.924 . 0 0 "[ . 1 . 2]" 1
1414 1 68 THR H 1 72 ALA H . . 5.030 3.963 3.554 4.262 . 0 0 "[ . 1 . 2]" 1
1415 1 68 THR HA 1 68 THR MG . . 3.160 2.523 2.406 2.595 . 0 0 "[ . 1 . 2]" 1
1416 1 68 THR HA 1 69 HIS H . . 3.270 2.581 2.394 2.828 . 0 0 "[ . 1 . 2]" 1
1417 1 68 THR HA 1 69 HIS HA . . 4.870 4.236 4.219 4.271 . 0 0 "[ . 1 . 2]" 1
1418 1 68 THR HA 1 69 HIS HB3 . . 5.140 5.003 4.860 5.173 0.033 3 0 "[ . 1 . 2]" 1
1419 1 68 THR HA 1 70 LEU H . . 5.080 4.750 4.507 5.100 0.020 2 0 "[ . 1 . 2]" 1
1420 1 68 THR HB 1 69 HIS H . . 3.220 2.366 1.945 2.678 . 0 0 "[ . 1 . 2]" 1
1421 1 68 THR HB 1 70 LEU H . . 3.830 3.428 3.276 3.587 . 0 0 "[ . 1 . 2]" 1
1422 1 68 THR HG1 1 71 GLU H . . 4.850 2.165 1.918 2.794 . 0 0 "[ . 1 . 2]" 1
1423 1 68 THR MG 1 69 HIS H . . 4.150 3.845 3.609 4.081 . 0 0 "[ . 1 . 2]" 1
1424 1 68 THR MG 1 70 LEU H . . 4.830 4.709 4.312 4.838 0.008 2 0 "[ . 1 . 2]" 1
1425 1 68 THR MG 1 71 GLU H . . 4.650 4.112 3.690 4.391 . 0 0 "[ . 1 . 2]" 1
1426 1 68 THR MG 1 71 GLU HB2 . . 4.750 3.644 3.245 3.829 . 0 0 "[ . 1 . 2]" 1
1427 1 68 THR MG 1 71 GLU HB3 . . 4.840 4.686 4.385 4.863 0.023 2 0 "[ . 1 . 2]" 1
1428 1 68 THR MG 1 71 GLU HG2 . . 5.070 3.949 3.315 4.528 . 0 0 "[ . 1 . 2]" 1
1429 1 68 THR MG 1 71 GLU HG3 . . 4.270 2.779 2.354 3.288 . 0 0 "[ . 1 . 2]" 1
1430 1 69 HIS H 1 69 HIS HB2 . . 3.380 2.479 2.305 2.629 . 0 0 "[ . 1 . 2]" 1
1431 1 69 HIS H 1 69 HIS HB3 . . 3.430 2.445 2.290 2.612 . 0 0 "[ . 1 . 2]" 1
1432 1 69 HIS H 1 70 LEU H . . 3.770 2.877 2.644 3.112 . 0 0 "[ . 1 . 2]" 1
1433 1 69 HIS H 1 71 GLU H . . 5.130 4.467 4.150 4.632 . 0 0 "[ . 1 . 2]" 1
1434 1 69 HIS HA 1 69 HIS HD2 . . 4.520 3.786 3.538 3.935 . 0 0 "[ . 1 . 2]" 1
1435 1 69 HIS HA 1 70 LEU QB . . 5.200 5.203 5.169 5.213 0.013 11 0 "[ . 1 . 2]" 1
1436 1 69 HIS HA 1 72 ALA H . . 4.350 3.903 3.759 3.990 . 0 0 "[ . 1 . 2]" 1
1437 1 69 HIS HA 1 72 ALA MB . . 3.600 2.996 2.814 3.151 . 0 0 "[ . 1 . 2]" 1
1438 1 69 HIS HB2 1 70 LEU H . . 4.040 3.877 3.777 3.988 . 0 0 "[ . 1 . 2]" 1
1439 1 69 HIS HB3 1 69 HIS HD2 . . 3.980 3.126 3.060 3.231 . 0 0 "[ . 1 . 2]" 1
1440 1 69 HIS HB3 1 70 LEU H . . 3.430 2.499 2.360 2.807 . 0 0 "[ . 1 . 2]" 1
1441 1 69 HIS HB3 1 70 LEU HA . . 5.010 4.373 4.222 4.491 . 0 0 "[ . 1 . 2]" 1
1442 1 69 HIS HB3 1 70 LEU QB . . 4.870 3.898 3.814 4.043 . 0 0 "[ . 1 . 2]" 1
1443 1 69 HIS HB3 1 71 GLU H . . 5.440 5.212 5.075 5.463 0.023 5 0 "[ . 1 . 2]" 1
1444 1 69 HIS HD2 1 70 LEU H . . 4.850 3.407 2.982 4.026 . 0 0 "[ . 1 . 2]" 1
1445 1 69 HIS HD2 1 70 LEU HA . . 4.210 2.691 2.358 3.167 . 0 0 "[ . 1 . 2]" 1
1446 1 69 HIS HD2 1 70 LEU QB . . 4.580 3.882 3.347 4.397 . 0 0 "[ . 1 . 2]" 1
1447 1 69 HIS HD2 1 70 LEU QD . . 4.770 3.328 3.040 4.209 . 0 0 "[ . 1 . 2]" 1
1448 1 69 HIS HD2 1 72 ALA MB . . 4.980 4.876 4.387 4.988 0.008 11 0 "[ . 1 . 2]" 1
1449 1 69 HIS HD2 1 73 GLN HE21 . . 5.180 3.354 2.365 3.914 . 0 0 "[ . 1 . 2]" 1
1450 1 69 HIS HD2 1 73 GLN HG2 . . 4.740 4.400 3.660 4.750 0.010 11 0 "[ . 1 . 2]" 1
1451 1 69 HIS HD2 1 73 GLN HG3 . . 4.350 2.689 1.991 3.059 . 0 0 "[ . 1 . 2]" 1
1452 1 69 HIS HE1 1 73 GLN HE21 . . 4.690 3.765 3.241 4.147 . 0 0 "[ . 1 . 2]" 1
1453 1 69 HIS HE1 1 73 GLN HE22 . . 5.280 4.814 4.129 5.172 . 0 0 "[ . 1 . 2]" 1
1454 1 70 LEU H 1 70 LEU QB . . 2.960 2.097 2.001 2.203 . 0 0 "[ . 1 . 2]" 1
1455 1 70 LEU H 1 70 LEU QD . . 4.560 3.448 3.167 3.636 . 0 0 "[ . 1 . 2]" 1
1456 1 70 LEU H 1 70 LEU HG . . 4.520 4.533 4.493 4.549 0.029 20 0 "[ . 1 . 2]" 1
1457 1 70 LEU H 1 71 GLU H . . 3.550 2.864 2.702 3.019 . 0 0 "[ . 1 . 2]" 1
1458 1 70 LEU H 1 71 GLU HB2 . . 5.250 4.709 4.443 4.874 . 0 0 "[ . 1 . 2]" 1
1459 1 70 LEU H 1 72 ALA H . . 5.180 4.427 3.984 4.686 . 0 0 "[ . 1 . 2]" 1
1460 1 70 LEU H 1 73 GLN H . . 5.500 4.670 4.478 4.811 . 0 0 "[ . 1 . 2]" 1
1461 1 70 LEU HA 1 70 LEU QD . . 3.070 1.979 1.910 2.251 . 0 0 "[ . 1 . 2]" 1
1462 1 70 LEU HA 1 70 LEU HG . . 4.240 3.140 2.953 3.892 . 0 0 "[ . 1 . 2]" 1
1463 1 70 LEU HA 1 72 ALA MB . . 5.110 4.833 4.679 4.951 . 0 0 "[ . 1 . 2]" 1
1464 1 70 LEU HA 1 73 GLN H . . 3.720 3.287 3.023 3.491 . 0 0 "[ . 1 . 2]" 1
1465 1 70 LEU HA 1 73 GLN HB2 . . 3.400 2.223 2.137 2.331 . 0 0 "[ . 1 . 2]" 1
1466 1 70 LEU HA 1 73 GLN HB3 . . 3.720 3.685 3.564 3.754 0.034 6 0 "[ . 1 . 2]" 1
1467 1 70 LEU HA 1 73 GLN HG3 . . 4.320 3.559 3.099 3.984 . 0 0 "[ . 1 . 2]" 1
1468 1 70 LEU HA 1 74 ASN H . . 4.320 3.916 3.526 4.221 . 0 0 "[ . 1 . 2]" 1
1469 1 70 LEU QB 1 71 GLU H . . 3.450 2.299 2.136 2.758 . 0 0 "[ . 1 . 2]" 1
1470 1 70 LEU QB 1 71 GLU HA . . 4.960 3.893 3.747 4.533 . 0 0 "[ . 1 . 2]" 1
1471 1 70 LEU QB 1 71 GLU HG2 . . 4.750 3.571 3.303 4.099 . 0 0 "[ . 1 . 2]" 1
1472 1 70 LEU QB 1 71 GLU HG3 . . 5.050 4.567 4.210 5.075 0.025 11 0 "[ . 1 . 2]" 1
1473 1 70 LEU QB 1 72 ALA H . . 5.290 4.847 4.608 5.174 . 0 0 "[ . 1 . 2]" 1
1474 1 70 LEU QB 1 73 GLN H . . 5.410 4.839 4.668 5.015 . 0 0 "[ . 1 . 2]" 1
1475 1 70 LEU QB 1 73 GLN HB2 . . 4.920 4.306 3.983 4.466 . 0 0 "[ . 1 . 2]" 1
1476 1 70 LEU QD 1 71 GLU H . . 5.010 3.745 1.822 3.983 . 0 0 "[ . 1 . 2]" 1
1477 1 70 LEU QD 1 71 GLU HA . . 5.270 4.256 1.966 4.650 . 0 0 "[ . 1 . 2]" 1
1478 1 70 LEU QD 1 71 GLU HG2 . . 4.820 4.372 1.906 4.632 . 0 0 "[ . 1 . 2]" 1
1479 1 70 LEU QD 1 73 GLN H . . 5.070 4.162 3.341 4.445 . 0 0 "[ . 1 . 2]" 1
1480 1 70 LEU QD 1 73 GLN HB2 . . 4.010 2.715 2.296 3.008 . 0 0 "[ . 1 . 2]" 1
1481 1 70 LEU QD 1 73 GLN HB3 . . 4.420 3.170 2.994 3.403 . 0 0 "[ . 1 . 2]" 1
1482 1 70 LEU QD 1 73 GLN HG3 . . 4.850 4.092 3.601 4.588 . 0 0 "[ . 1 . 2]" 1
1483 1 70 LEU QD 1 74 ASN H . . 4.570 3.689 2.186 4.261 . 0 0 "[ . 1 . 2]" 1
1484 1 70 LEU QD 1 74 ASN HB2 . . 5.020 4.164 1.942 4.724 . 0 0 "[ . 1 . 2]" 1
1485 1 70 LEU QD 1 74 ASN HD21 . . 4.370 2.871 1.993 3.262 . 0 0 "[ . 1 . 2]" 1
1486 1 70 LEU QD 1 74 ASN HD22 . . 3.940 3.158 2.162 3.510 . 0 0 "[ . 1 . 2]" 1
1487 1 70 LEU HG 1 71 GLU H . . 5.100 4.026 3.809 4.111 . 0 0 "[ . 1 . 2]" 1
1488 1 70 LEU HG 1 71 GLU HA . . 4.500 4.371 4.024 4.796 0.296 11 0 "[ . 1 . 2]" 1
1489 1 70 LEU HG 1 74 ASN H . . 4.950 4.434 4.057 5.063 0.113 11 0 "[ . 1 . 2]" 1
1490 1 70 LEU HG 1 74 ASN HD21 . . 4.330 2.601 2.171 3.911 . 0 0 "[ . 1 . 2]" 1
1491 1 70 LEU HG 1 74 ASN HD22 . . 4.280 3.055 2.575 3.690 . 0 0 "[ . 1 . 2]" 1
1492 1 71 GLU H 1 71 GLU HB2 . . 3.100 2.458 2.363 2.536 . 0 0 "[ . 1 . 2]" 1
1493 1 71 GLU H 1 71 GLU HB3 . . 3.700 3.564 3.549 3.577 . 0 0 "[ . 1 . 2]" 1
1494 1 71 GLU H 1 71 GLU HG2 . . 3.830 2.387 2.132 2.860 . 0 0 "[ . 1 . 2]" 1
1495 1 71 GLU H 1 71 GLU HG3 . . 3.780 3.052 2.781 3.300 . 0 0 "[ . 1 . 2]" 1
1496 1 71 GLU H 1 72 ALA H . . 3.370 3.141 3.017 3.207 . 0 0 "[ . 1 . 2]" 1
1497 1 71 GLU H 1 72 ALA MB . . 4.780 4.629 4.564 4.674 . 0 0 "[ . 1 . 2]" 1
1498 1 71 GLU H 1 73 GLN H . . 4.770 4.349 4.230 4.500 . 0 0 "[ . 1 . 2]" 1
1499 1 71 GLU H 1 74 ASN H . . 4.650 4.574 4.463 4.696 0.046 7 0 "[ . 1 . 2]" 1
1500 1 71 GLU HA 1 71 GLU HG2 . . 3.730 2.355 2.119 2.526 . 0 0 "[ . 1 . 2]" 1
1501 1 71 GLU HA 1 71 GLU HG3 . . 3.680 3.596 3.369 3.688 0.008 12 0 "[ . 1 . 2]" 1
1502 1 71 GLU HA 1 74 ASN H . . 3.970 3.423 3.254 3.573 . 0 0 "[ . 1 . 2]" 1
1503 1 71 GLU HA 1 74 ASN HA . . 5.400 5.322 5.105 5.451 0.051 6 0 "[ . 1 . 2]" 1
1504 1 71 GLU HA 1 74 ASN HB2 . . 3.420 2.471 2.280 2.594 . 0 0 "[ . 1 . 2]" 1
1505 1 71 GLU HA 1 74 ASN HB3 . . 4.030 3.829 3.608 3.991 . 0 0 "[ . 1 . 2]" 1
1506 1 71 GLU HA 1 74 ASN HD21 . . 4.360 3.490 2.988 3.922 . 0 0 "[ . 1 . 2]" 1
1507 1 71 GLU HA 1 74 ASN HD22 . . 5.120 4.845 4.431 5.106 . 0 0 "[ . 1 . 2]" 1
1508 1 71 GLU HB2 1 72 ALA H . . 3.640 2.447 2.251 2.759 . 0 0 "[ . 1 . 2]" 1
1509 1 71 GLU HB2 1 72 ALA HA . . 4.750 4.435 4.321 4.590 . 0 0 "[ . 1 . 2]" 1
1510 1 71 GLU HB2 1 72 ALA MB . . 4.650 3.952 3.856 4.077 . 0 0 "[ . 1 . 2]" 1
1511 1 71 GLU HB3 1 72 ALA H . . 3.920 3.233 3.116 3.446 . 0 0 "[ . 1 . 2]" 1
1512 1 71 GLU HB3 1 72 ALA HA . . 4.880 4.129 4.023 4.210 . 0 0 "[ . 1 . 2]" 1
1513 1 71 GLU HG2 1 72 ALA H . . 4.840 4.611 4.462 4.853 0.013 6 0 "[ . 1 . 2]" 1
1514 1 71 GLU HG2 1 74 ASN HB2 . . 5.190 4.665 4.383 4.950 . 0 0 "[ . 1 . 2]" 1
1515 1 71 GLU HG3 1 72 ALA H . . 4.780 4.643 4.520 4.797 0.017 4 0 "[ . 1 . 2]" 1
1516 1 72 ALA H 1 72 ALA MB . . 2.960 2.141 2.060 2.167 . 0 0 "[ . 1 . 2]" 1
1517 1 72 ALA H 1 73 GLN HB2 . . 5.100 4.667 4.530 4.762 . 0 0 "[ . 1 . 2]" 1
1518 1 72 ALA H 1 74 ASN H . . 4.780 4.210 3.888 4.588 . 0 0 "[ . 1 . 2]" 1
1519 1 72 ALA HA 1 75 LYS QB . . 3.450 2.527 2.265 2.697 . 0 0 "[ . 1 . 2]" 1
1520 1 72 ALA HA 1 75 LYS QG . . 4.580 4.277 3.841 4.575 . 0 0 "[ . 1 . 2]" 1
1521 1 72 ALA HA 1 76 ILE H . . 4.920 4.854 4.644 4.930 0.010 19 0 "[ . 1 . 2]" 1
1522 1 72 ALA HA 1 76 ILE HG13 . . 5.160 4.987 4.751 5.158 . 0 0 "[ . 1 . 2]" 1
1523 1 72 ALA MB 1 73 GLN H . . 3.340 2.479 2.359 2.630 . 0 0 "[ . 1 . 2]" 1
1524 1 72 ALA MB 1 73 GLN HA . . 3.790 3.779 3.706 3.821 0.031 11 0 "[ . 1 . 2]" 1
1525 1 72 ALA MB 1 73 GLN HB2 . . 5.140 4.255 4.129 4.391 . 0 0 "[ . 1 . 2]" 1
1526 1 72 ALA MB 1 73 GLN HG3 . . 5.270 4.054 3.843 4.214 . 0 0 "[ . 1 . 2]" 1
1527 1 72 ALA MB 1 74 ASN H . . 4.870 4.522 4.256 4.843 . 0 0 "[ . 1 . 2]" 1
1528 1 72 ALA MB 1 75 LYS H . . 4.870 4.382 4.204 4.587 . 0 0 "[ . 1 . 2]" 1
1529 1 72 ALA MB 1 75 LYS QB . . 4.280 3.755 3.544 3.904 . 0 0 "[ . 1 . 2]" 1
1530 1 73 GLN H 1 73 GLN HB2 . . 3.250 2.159 2.093 2.233 . 0 0 "[ . 1 . 2]" 1
1531 1 73 GLN H 1 73 GLN HB3 . . 3.500 3.450 3.400 3.494 . 0 0 "[ . 1 . 2]" 1
1532 1 73 GLN H 1 73 GLN HG2 . . 3.700 3.445 3.093 3.695 . 0 0 "[ . 1 . 2]" 1
1533 1 73 GLN H 1 73 GLN HG3 . . 3.870 3.000 2.802 3.194 . 0 0 "[ . 1 . 2]" 1
1534 1 73 GLN H 1 74 ASN H . . 3.480 2.782 2.675 2.895 . 0 0 "[ . 1 . 2]" 1
1535 1 73 GLN H 1 74 ASN HB2 . . 5.170 4.548 4.445 4.664 . 0 0 "[ . 1 . 2]" 1
1536 1 73 GLN HA 1 73 GLN HG2 . . 3.980 2.064 2.002 2.104 . 0 0 "[ . 1 . 2]" 1
1537 1 73 GLN HA 1 73 GLN HG3 . . 4.120 3.147 2.935 3.373 . 0 0 "[ . 1 . 2]" 1
1538 1 73 GLN HA 1 74 ASN HA . . 4.820 4.800 4.723 4.850 0.030 11 0 "[ . 1 . 2]" 1
1539 1 73 GLN HA 1 75 LYS H . . 4.390 3.957 3.764 4.108 . 0 0 "[ . 1 . 2]" 1
1540 1 73 GLN HA 1 76 ILE H . . 4.130 3.272 3.187 3.417 . 0 0 "[ . 1 . 2]" 1
1541 1 73 GLN HA 1 76 ILE HB . . 3.900 3.355 3.082 3.526 . 0 0 "[ . 1 . 2]" 1
1542 1 73 GLN HA 1 76 ILE MD . . 3.640 2.146 1.968 2.612 . 0 0 "[ . 1 . 2]" 1
1543 1 73 GLN HA 1 76 ILE HG12 . . 4.380 4.207 4.026 4.362 . 0 0 "[ . 1 . 2]" 1
1544 1 73 GLN HA 1 76 ILE HG13 . . 4.210 2.689 2.425 2.836 . 0 0 "[ . 1 . 2]" 1
1545 1 73 GLN HA 1 76 ILE MG . . 4.530 4.489 4.315 4.557 0.027 7 0 "[ . 1 . 2]" 1
1546 1 73 GLN HA 1 77 LYS H . . 5.500 4.902 4.651 5.054 . 0 0 "[ . 1 . 2]" 1
1547 1 73 GLN HB2 1 74 ASN H . . 3.570 2.864 2.565 3.154 . 0 0 "[ . 1 . 2]" 1
1548 1 73 GLN HB2 1 75 LYS H . . 5.230 4.969 4.784 5.136 . 0 0 "[ . 1 . 2]" 1
1549 1 73 GLN HB3 1 74 ASN H . . 3.770 3.288 2.951 3.653 . 0 0 "[ . 1 . 2]" 1
1550 1 73 GLN HB3 1 77 LYS QE . . 5.260 4.441 3.315 5.258 . 0 0 "[ . 1 . 2]" 1
1551 1 73 GLN HG2 1 74 ASN H . . 4.990 4.942 4.819 5.033 0.043 7 0 "[ . 1 . 2]" 1
1552 1 73 GLN HG3 1 74 ASN H . . 5.090 4.904 4.721 5.085 . 0 0 "[ . 1 . 2]" 1
1553 1 74 ASN H 1 74 ASN HB2 . . 3.190 2.064 2.032 2.157 . 0 0 "[ . 1 . 2]" 1
1554 1 74 ASN H 1 74 ASN HB3 . . 3.610 3.341 3.190 3.452 . 0 0 "[ . 1 . 2]" 1
1555 1 74 ASN H 1 74 ASN HD21 . . 4.890 2.913 2.463 4.109 . 0 0 "[ . 1 . 2]" 1
1556 1 74 ASN H 1 74 ASN HD22 . . 5.500 4.390 4.111 4.869 . 0 0 "[ . 1 . 2]" 1
1557 1 74 ASN H 1 75 LYS H . . 3.420 2.652 2.436 2.826 . 0 0 "[ . 1 . 2]" 1
1558 1 74 ASN H 1 75 LYS QB . . 5.020 4.307 4.098 4.466 . 0 0 "[ . 1 . 2]" 1
1559 1 74 ASN H 1 76 ILE H . . 5.500 4.235 4.007 4.563 . 0 0 "[ . 1 . 2]" 1
1560 1 74 ASN HA 1 76 ILE H . . 5.230 4.170 3.781 4.753 . 0 0 "[ . 1 . 2]" 1
1561 1 74 ASN HA 1 77 LYS QB . . 3.340 2.959 2.787 3.192 . 0 0 "[ . 1 . 2]" 1
1562 1 74 ASN HA 1 77 LYS QD . . 4.370 2.976 2.293 3.825 . 0 0 "[ . 1 . 2]" 1
1563 1 74 ASN HA 1 77 LYS HG3 . . 5.210 5.099 3.790 5.819 0.609 9 4 "[ .-* +1 .* 2]" 1
1564 1 74 ASN HA 1 78 SER H . . 4.910 4.175 3.993 4.531 . 0 0 "[ . 1 . 2]" 1
1565 1 74 ASN HB2 1 74 ASN HD21 . . 3.630 2.297 2.183 2.431 . 0 0 "[ . 1 . 2]" 1
1566 1 74 ASN HB2 1 74 ASN HD22 . . 4.120 3.526 3.478 3.583 . 0 0 "[ . 1 . 2]" 1
1567 1 74 ASN HB2 1 75 LYS H . . 3.820 3.182 3.042 3.428 . 0 0 "[ . 1 . 2]" 1
1568 1 74 ASN HB2 1 75 LYS HA . . 5.170 4.872 4.733 5.071 . 0 0 "[ . 1 . 2]" 1
1569 1 74 ASN HB2 1 75 LYS QB . . 4.910 4.572 4.421 4.755 . 0 0 "[ . 1 . 2]" 1
1570 1 74 ASN HB3 1 75 LYS H . . 4.000 3.328 3.169 3.520 . 0 0 "[ . 1 . 2]" 1
1571 1 74 ASN HB3 1 75 LYS HA . . 5.140 3.904 3.833 4.013 . 0 0 "[ . 1 . 2]" 1
1572 1 74 ASN HB3 1 75 LYS QB . . 4.950 4.511 4.331 4.626 . 0 0 "[ . 1 . 2]" 1
1573 1 75 LYS H 1 75 LYS QB . . 2.950 2.080 1.987 2.216 . 0 0 "[ . 1 . 2]" 1
1574 1 75 LYS H 1 75 LYS HD2 . . 4.940 4.041 3.432 4.839 . 0 0 "[ . 1 . 2]" 1
1575 1 75 LYS H 1 75 LYS HD3 . . 5.080 4.397 3.625 5.068 . 0 0 "[ . 1 . 2]" 1
1576 1 75 LYS H 1 75 LYS QG . . 3.990 3.924 3.710 4.002 0.012 19 0 "[ . 1 . 2]" 1
1577 1 75 LYS H 1 76 ILE H . . 3.160 2.631 2.473 2.766 . 0 0 "[ . 1 . 2]" 1
1578 1 75 LYS H 1 76 ILE HG13 . . 4.710 4.018 3.754 4.203 . 0 0 "[ . 1 . 2]" 1
1579 1 75 LYS HA 1 75 LYS HD2 . . 3.350 2.618 2.012 3.137 . 0 0 "[ . 1 . 2]" 1
1580 1 75 LYS HA 1 75 LYS HD3 . . 3.850 3.586 2.037 3.873 0.023 2 0 "[ . 1 . 2]" 1
1581 1 75 LYS HA 1 75 LYS QE . . 4.690 4.039 3.549 4.701 0.011 4 0 "[ . 1 . 2]" 1
1582 1 75 LYS HA 1 75 LYS QG . . 3.560 2.292 1.972 2.860 . 0 0 "[ . 1 . 2]" 1
1583 1 75 LYS QB 1 75 LYS HD3 . . 3.730 2.473 2.102 3.212 . 0 0 "[ . 1 . 2]" 1
1584 1 75 LYS QB 1 75 LYS QE . . 4.300 3.646 3.502 3.766 . 0 0 "[ . 1 . 2]" 1
1585 1 75 LYS QB 1 76 ILE H . . 3.460 2.805 2.474 3.110 . 0 0 "[ . 1 . 2]" 1
1586 1 75 LYS QB 1 76 ILE HA . . 4.900 3.956 3.798 4.279 . 0 0 "[ . 1 . 2]" 1
1587 1 75 LYS HD3 1 75 LYS QG . . 2.740 2.370 2.281 2.502 . 0 0 "[ . 1 . 2]" 1
1588 1 75 LYS QE 1 75 LYS QG . . 3.220 2.126 2.044 2.281 . 0 0 "[ . 1 . 2]" 1
1589 1 75 LYS QG 1 76 ILE H . . 5.100 4.317 3.959 4.713 . 0 0 "[ . 1 . 2]" 1
1590 1 76 ILE H 1 76 ILE HB . . 3.240 2.434 2.343 2.500 . 0 0 "[ . 1 . 2]" 1
1591 1 76 ILE H 1 76 ILE MD . . 4.220 3.456 3.350 3.592 . 0 0 "[ . 1 . 2]" 1
1592 1 76 ILE H 1 76 ILE HG12 . . 3.740 3.268 3.025 3.568 . 0 0 "[ . 1 . 2]" 1
1593 1 76 ILE H 1 76 ILE HG13 . . 3.580 1.996 1.943 2.302 . 0 0 "[ . 1 . 2]" 1
1594 1 76 ILE H 1 76 ILE MG . . 3.960 3.707 3.702 3.717 . 0 0 "[ . 1 . 2]" 1
1595 1 76 ILE H 1 77 LYS HA . . 5.500 5.321 5.113 5.485 . 0 0 "[ . 1 . 2]" 1
1596 1 76 ILE HA 1 76 ILE MD . . 3.910 3.815 3.739 3.855 . 0 0 "[ . 1 . 2]" 1
1597 1 76 ILE HA 1 76 ILE HG12 . . 3.530 2.520 2.409 2.594 . 0 0 "[ . 1 . 2]" 1
1598 1 76 ILE HA 1 76 ILE HG13 . . 3.710 2.979 2.903 3.086 . 0 0 "[ . 1 . 2]" 1
1599 1 76 ILE HA 1 76 ILE MG . . 3.320 2.467 2.361 2.516 . 0 0 "[ . 1 . 2]" 1
1600 1 76 ILE HA 1 78 SER H . . 5.260 4.554 4.004 4.899 . 0 0 "[ . 1 . 2]" 1
1601 1 76 ILE HA 1 79 ALA H . . 4.460 3.758 3.549 3.880 . 0 0 "[ . 1 . 2]" 1
1602 1 76 ILE HA 1 79 ALA MB . . 3.950 3.105 2.894 3.388 . 0 0 "[ . 1 . 2]" 1
1603 1 76 ILE HA 1 83 LEU MD1 . . 3.350 1.923 1.799 2.211 . 0 0 "[ . 1 . 2]" 1
1604 1 76 ILE HA 1 83 LEU MD2 . . 4.400 2.984 2.527 3.460 . 0 0 "[ . 1 . 2]" 1
1605 1 76 ILE HB 1 76 ILE MD . . 3.390 2.379 2.213 2.466 . 0 0 "[ . 1 . 2]" 1
1606 1 76 ILE HB 1 77 LYS H . . 3.670 2.557 2.478 2.705 . 0 0 "[ . 1 . 2]" 1
1607 1 76 ILE HB 1 77 LYS HA . . 5.220 4.386 4.337 4.460 . 0 0 "[ . 1 . 2]" 1
1608 1 76 ILE HB 1 83 LEU MD1 . . 4.630 4.249 3.869 4.566 . 0 0 "[ . 1 . 2]" 1
1609 1 76 ILE HB 1 83 LEU MD2 . . 4.840 4.229 4.006 4.590 . 0 0 "[ . 1 . 2]" 1
1610 1 76 ILE MD 1 77 LYS H . . 5.060 4.496 4.355 4.688 . 0 0 "[ . 1 . 2]" 1
1611 1 76 ILE MD 1 83 LEU MD2 . . 4.170 3.410 3.194 3.633 . 0 0 "[ . 1 . 2]" 1
1612 1 76 ILE HG12 1 76 ILE MG . . 3.530 2.372 2.298 2.469 . 0 0 "[ . 1 . 2]" 1
1613 1 76 ILE HG12 1 77 LYS H . . 5.010 5.011 4.969 5.048 0.038 15 0 "[ . 1 . 2]" 1
1614 1 76 ILE HG12 1 83 LEU MD1 . . 3.680 2.555 2.311 2.868 . 0 0 "[ . 1 . 2]" 1
1615 1 76 ILE HG12 1 83 LEU MD2 . . 4.410 2.832 2.407 3.409 . 0 0 "[ . 1 . 2]" 1
1616 1 76 ILE HG13 1 83 LEU MD2 . . 5.050 4.290 3.901 4.740 . 0 0 "[ . 1 . 2]" 1
1617 1 76 ILE MG 1 77 LYS H . . 4.320 3.384 3.282 3.534 . 0 0 "[ . 1 . 2]" 1
1618 1 76 ILE MG 1 77 LYS HA . . 4.330 3.496 3.384 3.645 . 0 0 "[ . 1 . 2]" 1
1619 1 76 ILE MG 1 83 LEU MD2 . . 3.650 1.863 1.751 1.990 . 0 0 "[ . 1 . 2]" 1
1620 1 77 LYS H 1 77 LYS QB . . 3.080 2.171 2.004 2.351 . 0 0 "[ . 1 . 2]" 1
1621 1 77 LYS H 1 77 LYS QD . . 4.370 2.761 2.084 4.100 . 0 0 "[ . 1 . 2]" 1
1622 1 77 LYS H 1 77 LYS HG2 . . 4.280 4.046 3.519 4.274 . 0 0 "[ . 1 . 2]" 1
1623 1 77 LYS H 1 77 LYS HG3 . . 4.410 3.237 2.255 4.481 0.071 19 0 "[ . 1 . 2]" 1
1624 1 77 LYS H 1 78 SER H . . 3.350 2.638 2.555 2.681 . 0 0 "[ . 1 . 2]" 1
1625 1 77 LYS H 1 78 SER HA . . 5.140 5.122 5.009 5.158 0.018 15 0 "[ . 1 . 2]" 1
1626 1 77 LYS H 1 79 ALA H . . 5.020 4.373 4.195 4.517 . 0 0 "[ . 1 . 2]" 1
1627 1 77 LYS HA 1 77 LYS QD . . 4.120 3.478 2.698 4.038 . 0 0 "[ . 1 . 2]" 1
1628 1 77 LYS HA 1 77 LYS QE . . 4.970 4.496 3.640 4.869 . 0 0 "[ . 1 . 2]" 1
1629 1 77 LYS HA 1 77 LYS HG2 . . 4.180 3.077 2.228 3.506 . 0 0 "[ . 1 . 2]" 1
1630 1 77 LYS HA 1 77 LYS HG3 . . 3.880 2.355 2.043 3.893 0.013 19 0 "[ . 1 . 2]" 1
1631 1 77 LYS HA 1 79 ALA H . . 4.810 4.335 3.531 4.528 . 0 0 "[ . 1 . 2]" 1
1632 1 77 LYS QB 1 77 LYS QE . . 4.310 3.368 2.564 3.667 . 0 0 "[ . 1 . 2]" 1
1633 1 77 LYS QB 1 78 SER H . . 3.690 2.738 2.546 3.345 . 0 0 "[ . 1 . 2]" 1
1634 1 77 LYS QB 1 78 SER HB2 . . 5.500 4.474 4.216 5.093 . 0 0 "[ . 1 . 2]" 1
1635 1 77 LYS QB 1 79 ALA H . . 4.970 4.881 4.777 4.987 0.017 5 0 "[ . 1 . 2]" 1
1636 1 77 LYS QE 1 77 LYS HG3 . . 3.830 2.648 1.978 3.195 . 0 0 "[ . 1 . 2]" 1
1637 1 78 SER H 1 78 SER HB2 . . 3.600 2.248 2.022 2.783 . 0 0 "[ . 1 . 2]" 1
1638 1 78 SER H 1 78 SER HB3 . . 3.360 2.872 2.430 3.544 0.184 12 0 "[ . 1 . 2]" 1
1639 1 78 SER H 1 79 ALA H . . 3.360 2.982 2.693 3.090 . 0 0 "[ . 1 . 2]" 1
1640 1 78 SER H 1 79 ALA MB . . 4.670 4.398 4.189 4.503 . 0 0 "[ . 1 . 2]" 1
1641 1 78 SER HB2 1 79 ALA H . . 4.360 3.538 2.313 3.924 . 0 0 "[ . 1 . 2]" 1
1642 1 78 SER HB2 1 79 ALA MB . . 5.060 4.994 3.821 5.368 0.308 1 0 "[ . 1 . 2]" 1
1643 1 78 SER HB3 1 79 ALA H . . 4.790 2.574 2.320 3.594 . 0 0 "[ . 1 . 2]" 1
1644 1 79 ALA H 1 79 ALA MB . . 3.030 1.966 1.941 2.018 . 0 0 "[ . 1 . 2]" 1
1645 1 79 ALA H 1 80 SER H . . 4.850 4.668 4.652 4.674 . 0 0 "[ . 1 . 2]" 1
1646 1 79 ALA H 1 83 LEU MD1 . . 5.140 3.464 3.299 3.669 . 0 0 "[ . 1 . 2]" 1
1647 1 79 ALA HA 1 80 SER H . . 2.950 2.364 2.295 2.448 . 0 0 "[ . 1 . 2]" 1
1648 1 79 ALA MB 1 80 SER H . . 3.880 2.817 2.656 2.961 . 0 0 "[ . 1 . 2]" 1
1649 1 79 ALA MB 1 82 ASN H . . 4.990 4.024 3.759 4.252 . 0 0 "[ . 1 . 2]" 1
1650 1 79 ALA MB 1 83 LEU H . . 5.300 4.104 3.804 4.343 . 0 0 "[ . 1 . 2]" 1
1651 1 79 ALA MB 1 83 LEU HB2 . . 3.790 2.157 1.907 2.768 . 0 0 "[ . 1 . 2]" 1
1652 1 79 ALA MB 1 83 LEU HB3 . . 4.570 3.558 3.240 4.141 . 0 0 "[ . 1 . 2]" 1
1653 1 79 ALA MB 1 83 LEU MD1 . . 3.060 1.952 1.875 2.094 . 0 0 "[ . 1 . 2]" 1
1654 1 79 ALA MB 1 83 LEU MD2 . . 4.300 3.349 3.112 3.635 . 0 0 "[ . 1 . 2]" 1
1655 1 80 SER H 1 80 SER QB . . 3.590 2.582 2.458 2.788 . 0 0 "[ . 1 . 2]" 1
1656 1 80 SER H 1 81 TYR H . . 3.810 2.541 1.978 2.955 . 0 0 "[ . 1 . 2]" 1
1657 1 80 SER H 1 81 TYR QB . . 5.440 3.868 3.687 4.003 . 0 0 "[ . 1 . 2]" 1
1658 1 80 SER H 1 82 ASN H . . 5.060 3.201 3.069 3.272 . 0 0 "[ . 1 . 2]" 1
1659 1 80 SER QB 1 81 TYR H . . 4.250 2.078 1.877 2.436 . 0 0 "[ . 1 . 2]" 1
1660 1 80 SER QB 1 81 TYR QB . . 5.040 3.383 3.230 3.535 . 0 0 "[ . 1 . 2]" 1
1661 1 80 SER QB 1 81 TYR QD . . 4.720 4.080 3.637 4.537 . 0 0 "[ . 1 . 2]" 1
1662 1 80 SER QB 1 82 ASN H . . 4.980 4.411 4.214 4.719 . 0 0 "[ . 1 . 2]" 1
1663 1 81 TYR H 1 81 TYR QB . . 3.680 1.926 1.857 1.962 . 0 0 "[ . 1 . 2]" 1
1664 1 81 TYR H 1 81 TYR QD . . 4.930 3.482 3.176 3.893 . 0 0 "[ . 1 . 2]" 1
1665 1 81 TYR H 1 82 ASN H . . 3.800 2.794 2.403 3.045 . 0 0 "[ . 1 . 2]" 1
1666 1 81 TYR HA 1 81 TYR QD . . 3.660 2.505 2.093 3.098 . 0 0 "[ . 1 . 2]" 1
1667 1 81 TYR QB 1 82 ASN H . . 3.430 2.292 2.136 2.375 . 0 0 "[ . 1 . 2]" 1
1668 1 81 TYR QB 1 82 ASN HB3 . . 5.210 4.164 3.507 4.704 . 0 0 "[ . 1 . 2]" 1
1669 1 81 TYR QB 1 82 ASN HD21 . . 5.500 4.168 3.156 5.110 . 0 0 "[ . 1 . 2]" 1
1670 1 81 TYR QB 1 82 ASN HD22 . . 4.720 3.720 2.867 4.546 . 0 0 "[ . 1 . 2]" 1
1671 1 81 TYR QD 1 82 ASN H . . 5.100 4.307 3.946 4.427 . 0 0 "[ . 1 . 2]" 1
1672 1 82 ASN H 1 82 ASN HB2 . . 3.840 3.352 2.787 3.782 . 0 0 "[ . 1 . 2]" 1
1673 1 82 ASN H 1 82 ASN HD21 . . 5.270 4.485 3.689 5.186 . 0 0 "[ . 1 . 2]" 1
1674 1 82 ASN HA 1 83 LEU H . . 3.180 2.470 2.315 2.647 . 0 0 "[ . 1 . 2]" 1
1675 1 82 ASN HB2 1 83 LEU H . . 3.860 3.040 2.242 3.860 . 0 0 "[ . 1 . 2]" 1
1676 1 82 ASN HB3 1 83 LEU H . . 3.980 3.253 2.345 3.984 0.004 5 0 "[ . 1 . 2]" 1
1677 1 83 LEU H 1 83 LEU HB2 . . 4.040 3.264 2.981 3.470 . 0 0 "[ . 1 . 2]" 1
1678 1 83 LEU H 1 83 LEU HB3 . . 3.640 2.488 2.314 2.689 . 0 0 "[ . 1 . 2]" 1
1679 1 83 LEU H 1 83 LEU MD1 . . 5.060 4.423 4.286 4.582 . 0 0 "[ . 1 . 2]" 1
1680 1 83 LEU H 1 83 LEU MD2 . . 5.430 4.331 4.016 4.543 . 0 0 "[ . 1 . 2]" 1
1681 1 83 LEU H 1 83 LEU HG . . 5.130 4.177 4.093 4.377 . 0 0 "[ . 1 . 2]" 1
1682 1 83 LEU H 1 84 SER H . . 5.120 3.878 3.687 4.142 . 0 0 "[ . 1 . 2]" 1
1683 1 83 LEU HA 1 83 LEU MD1 . . 3.280 2.394 2.104 2.685 . 0 0 "[ . 1 . 2]" 1
1684 1 83 LEU HA 1 84 SER H . . 3.020 2.268 2.184 2.325 . 0 0 "[ . 1 . 2]" 1
1685 1 83 LEU HA 1 84 SER HA . . 4.560 4.401 4.344 4.434 . 0 0 "[ . 1 . 2]" 1
1686 1 83 LEU HB2 1 83 LEU MD1 . . 3.530 2.299 2.090 2.455 . 0 0 "[ . 1 . 2]" 1
1687 1 83 LEU HB2 1 84 SER H . . 4.870 4.488 4.294 4.585 . 0 0 "[ . 1 . 2]" 1
1688 1 83 LEU HB3 1 84 SER H . . 5.210 4.638 4.595 4.659 . 0 0 "[ . 1 . 2]" 1
1689 1 83 LEU MD1 1 84 SER H . . 3.620 3.297 3.083 3.495 . 0 0 "[ . 1 . 2]" 1
1690 1 83 LEU MD1 1 84 SER HA . . 4.820 4.626 4.313 4.819 . 0 0 "[ . 1 . 2]" 1
1691 1 83 LEU MD2 1 85 LEU MD1 . . 3.650 2.382 1.928 2.597 . 0 0 "[ . 1 . 2]" 1
1692 1 83 LEU MD2 1 85 LEU MD2 . . 3.630 3.333 3.039 3.531 . 0 0 "[ . 1 . 2]" 1
1693 1 83 LEU MD2 1 85 LEU HG . . 4.760 3.830 3.336 4.063 . 0 0 "[ . 1 . 2]" 1
1694 1 83 LEU HG 1 84 SER H . . 4.310 4.090 3.601 4.314 0.004 4 0 "[ . 1 . 2]" 1
1695 1 83 LEU HG 1 85 LEU HG . . 3.940 2.602 2.410 2.777 . 0 0 "[ . 1 . 2]" 1
1696 1 84 SER H 1 84 SER HB2 . . 3.410 2.139 2.086 2.216 . 0 0 "[ . 1 . 2]" 1
1697 1 84 SER H 1 84 SER HB3 . . 3.400 3.387 3.264 3.452 0.052 20 0 "[ . 1 . 2]" 1
1698 1 84 SER HA 1 85 LEU H . . 2.890 2.327 2.269 2.361 . 0 0 "[ . 1 . 2]" 1
1699 1 84 SER HA 1 85 LEU HB2 . . 4.590 4.612 4.553 4.661 0.071 2 0 "[ . 1 . 2]" 1
1700 1 84 SER HA 1 85 LEU HG . . 4.840 3.500 3.406 3.622 . 0 0 "[ . 1 . 2]" 1
1701 1 84 SER HB2 1 85 LEU H . . 4.240 4.280 4.235 4.411 0.171 4 0 "[ . 1 . 2]" 1
1702 1 85 LEU H 1 85 LEU HB2 . . 3.680 2.905 2.850 2.966 . 0 0 "[ . 1 . 2]" 1
1703 1 85 LEU H 1 85 LEU MD1 . . 4.700 3.985 3.828 4.158 . 0 0 "[ . 1 . 2]" 1
1704 1 85 LEU H 1 85 LEU MD2 . . 4.460 4.089 3.949 4.249 . 0 0 "[ . 1 . 2]" 1
1705 1 85 LEU H 1 85 LEU HG . . 4.020 3.108 3.019 3.190 . 0 0 "[ . 1 . 2]" 1
1706 1 85 LEU H 1 86 THR H . . 5.110 4.146 4.049 4.272 . 0 0 "[ . 1 . 2]" 1
1707 1 85 LEU H 1 87 LEU MD1 . . 4.990 4.294 4.241 4.401 . 0 0 "[ . 1 . 2]" 1
1708 1 85 LEU HA 1 85 LEU MD2 . . 3.200 2.233 2.091 2.477 . 0 0 "[ . 1 . 2]" 1
1709 1 85 LEU HA 1 85 LEU HG . . 4.180 2.993 2.852 3.116 . 0 0 "[ . 1 . 2]" 1
1710 1 85 LEU HA 1 86 THR H . . 2.950 2.188 2.176 2.226 . 0 0 "[ . 1 . 2]" 1
1711 1 85 LEU HA 1 86 THR HB . . 4.920 4.666 4.583 4.774 . 0 0 "[ . 1 . 2]" 1
1712 1 85 LEU HA 1 87 LEU MD1 . . 5.070 3.783 3.685 3.885 . 0 0 "[ . 1 . 2]" 1
1713 1 85 LEU HB2 1 85 LEU MD1 . . 3.380 2.223 2.127 2.286 . 0 0 "[ . 1 . 2]" 1
1714 1 85 LEU HB2 1 86 THR H . . 4.430 4.245 4.062 4.314 . 0 0 "[ . 1 . 2]" 1
1715 1 85 LEU HB2 1 87 LEU MD1 . . 3.490 2.674 2.598 2.738 . 0 0 "[ . 1 . 2]" 1
1716 1 85 LEU HB3 1 85 LEU MD1 . . 3.580 2.577 2.491 2.686 . 0 0 "[ . 1 . 2]" 1
1717 1 85 LEU HB3 1 86 THR H . . 4.160 3.427 3.175 3.553 . 0 0 "[ . 1 . 2]" 1
1718 1 85 LEU HB3 1 87 LEU MD1 . . 3.440 2.453 2.357 2.577 . 0 0 "[ . 1 . 2]" 1
1719 1 85 LEU MD1 1 86 THR H . . 5.380 5.339 5.191 5.408 0.028 12 0 "[ . 1 . 2]" 1
1720 1 85 LEU MD2 1 86 THR H . . 4.250 3.811 3.711 3.965 . 0 0 "[ . 1 . 2]" 1
1721 1 85 LEU HG 1 86 THR H . . 5.240 5.094 4.970 5.197 . 0 0 "[ . 1 . 2]" 1
1722 1 86 THR H 1 86 THR HB . . 3.330 2.526 2.442 2.610 . 0 0 "[ . 1 . 2]" 1
1723 1 86 THR H 1 87 LEU H . . 4.890 4.415 4.348 4.459 . 0 0 "[ . 1 . 2]" 1
1724 1 86 THR H 1 87 LEU HA . . 5.490 5.066 4.939 5.127 . 0 0 "[ . 1 . 2]" 1
1725 1 86 THR H 1 87 LEU MD1 . . 4.490 3.299 3.152 3.410 . 0 0 "[ . 1 . 2]" 1
1726 1 86 THR HA 1 87 LEU H . . 3.050 2.151 2.149 2.152 . 0 0 "[ . 1 . 2]" 1
1727 1 86 THR HA 1 87 LEU HA . . 5.000 4.344 4.341 4.347 . 0 0 "[ . 1 . 2]" 1
1728 1 86 THR HA 1 87 LEU HB2 . . 5.060 4.437 4.392 4.466 . 0 0 "[ . 1 . 2]" 1
1729 1 86 THR HA 1 87 LEU MD1 . . 4.350 2.951 2.925 2.993 . 0 0 "[ . 1 . 2]" 1
1730 1 86 THR HB 1 87 LEU H . . 4.680 4.371 4.296 4.430 . 0 0 "[ . 1 . 2]" 1
1731 1 86 THR HB 1 87 LEU HA . . 4.940 4.867 4.782 4.930 . 0 0 "[ . 1 . 2]" 1
1732 1 86 THR MG 1 87 LEU H . . 3.370 3.100 2.997 3.169 . 0 0 "[ . 1 . 2]" 1
1733 1 86 THR MG 1 87 LEU HA . . 4.430 4.262 4.124 4.354 . 0 0 "[ . 1 . 2]" 1
1734 1 87 LEU H 1 87 LEU HB2 . . 3.560 2.412 2.386 2.420 . 0 0 "[ . 1 . 2]" 1
1735 1 87 LEU H 1 87 LEU HB3 . . 4.080 3.619 3.600 3.625 . 0 0 "[ . 1 . 2]" 1
1736 1 87 LEU H 1 87 LEU MD1 . . 3.540 2.329 2.268 2.375 . 0 0 "[ . 1 . 2]" 1
1737 1 87 LEU H 1 87 LEU MD2 . . 4.020 3.767 3.677 3.830 . 0 0 "[ . 1 . 2]" 1
1738 1 87 LEU H 1 87 LEU HG . . 4.410 4.295 4.253 4.316 . 0 0 "[ . 1 . 2]" 1
1739 1 87 LEU H 1 88 GLN H . . 4.890 4.503 4.497 4.512 . 0 0 "[ . 1 . 2]" 1
1740 1 87 LEU HA 1 87 LEU MD1 . . 3.340 2.233 2.204 2.267 . 0 0 "[ . 1 . 2]" 1
1741 1 87 LEU HA 1 87 LEU MD2 . . 4.180 3.876 3.862 3.884 . 0 0 "[ . 1 . 2]" 1
1742 1 87 LEU HA 1 87 LEU HG . . 3.580 2.763 2.714 2.788 . 0 0 "[ . 1 . 2]" 1
1743 1 87 LEU HA 1 88 GLN H . . 3.020 2.558 2.534 2.570 . 0 0 "[ . 1 . 2]" 1
1744 1 87 LEU HB2 1 87 LEU MD2 . . 3.320 2.215 2.125 2.296 . 0 0 "[ . 1 . 2]" 1
1745 1 87 LEU HB2 1 88 GLN H . . 3.940 3.614 3.587 3.658 . 0 0 "[ . 1 . 2]" 1
1746 1 87 LEU HB3 1 87 LEU MD1 . . 3.390 3.184 3.178 3.194 . 0 0 "[ . 1 . 2]" 1
1747 1 87 LEU HB3 1 87 LEU MD2 . . 3.220 2.502 2.456 2.542 . 0 0 "[ . 1 . 2]" 1
1748 1 87 LEU HB3 1 88 GLN H . . 3.350 2.293 2.270 2.340 . 0 0 "[ . 1 . 2]" 1
1749 1 87 LEU MD1 1 88 GLN H . . 4.200 4.259 4.239 4.272 0.072 15 0 "[ . 1 . 2]" 1
1750 1 87 LEU MD2 1 88 GLN H . . 4.590 4.450 4.381 4.478 . 0 0 "[ . 1 . 2]" 1
1751 1 87 LEU HG 1 88 GLN H . . 4.590 3.866 3.783 3.918 . 0 0 "[ . 1 . 2]" 1
1752 1 88 GLN H 1 88 GLN HB2 . . 3.600 2.848 2.798 2.902 . 0 0 "[ . 1 . 2]" 1
1753 1 88 GLN H 1 88 GLN HG2 . . 5.370 4.506 4.450 4.614 . 0 0 "[ . 1 . 2]" 1
1754 1 88 GLN H 1 88 GLN HG3 . . 4.980 4.769 4.561 4.888 . 0 0 "[ . 1 . 2]" 1
1755 1 88 GLN H 1 89 LYS HA . . 5.500 4.672 4.577 4.768 . 0 0 "[ . 1 . 2]" 1
1756 1 88 GLN HA 1 88 GLN HG2 . . 4.280 2.073 2.001 2.258 . 0 0 "[ . 1 . 2]" 1
1757 1 88 GLN HA 1 88 GLN HG3 . . 4.010 3.083 2.677 3.311 . 0 0 "[ . 1 . 2]" 1
1758 1 88 GLN HA 1 89 LYS H . . 2.860 2.267 2.225 2.328 . 0 0 "[ . 1 . 2]" 1
1759 1 88 GLN HA 1 89 LYS HA . . 5.110 4.336 4.320 4.350 . 0 0 "[ . 1 . 2]" 1
1760 1 88 GLN HA 1 89 LYS QG . . 4.880 4.119 3.887 4.337 . 0 0 "[ . 1 . 2]" 1
1761 1 88 GLN HB3 1 88 GLN HE22 . . 5.500 3.415 3.193 3.722 . 0 0 "[ . 1 . 2]" 1
1762 1 88 GLN HG2 1 89 LYS H . . 3.810 2.782 2.581 2.929 . 0 0 "[ . 1 . 2]" 1
1763 1 89 LYS H 1 89 LYS HB2 . . 3.170 2.207 2.108 2.311 . 0 0 "[ . 1 . 2]" 1
1764 1 89 LYS H 1 89 LYS HB3 . . 3.670 3.479 3.408 3.532 . 0 0 "[ . 1 . 2]" 1
1765 1 89 LYS H 1 89 LYS QD . . 4.630 4.318 4.025 4.610 . 0 0 "[ . 1 . 2]" 1
1766 1 89 LYS H 1 89 LYS QG . . 3.580 2.782 2.575 2.958 . 0 0 "[ . 1 . 2]" 1
1767 1 89 LYS H 1 90 SER H . . 4.690 4.454 4.354 4.558 . 0 0 "[ . 1 . 2]" 1
1768 1 89 LYS HA 1 89 LYS QD . . 3.670 2.717 1.963 3.357 . 0 0 "[ . 1 . 2]" 1
1769 1 89 LYS HA 1 89 LYS QG . . 3.490 2.317 2.114 2.555 . 0 0 "[ . 1 . 2]" 1
1770 1 89 LYS HA 1 90 SER H . . 2.810 2.182 2.175 2.202 . 0 0 "[ . 1 . 2]" 1
1771 1 89 LYS HB2 1 89 LYS QE . . 4.770 4.076 3.260 4.450 . 0 0 "[ . 1 . 2]" 1
1772 1 89 LYS HB2 1 90 SER H . . 4.610 4.560 4.501 4.609 . 0 0 "[ . 1 . 2]" 1
1773 1 89 LYS HB3 1 89 LYS QE . . 4.920 3.733 3.403 4.115 . 0 0 "[ . 1 . 2]" 1
1774 1 89 LYS HB3 1 90 SER H . . 3.890 3.716 3.534 3.895 0.005 10 0 "[ . 1 . 2]" 1
1775 1 89 LYS QD 1 90 SER H . . 4.530 3.899 2.965 4.517 . 0 0 "[ . 1 . 2]" 1
1776 1 89 LYS QG 1 90 SER H . . 4.400 4.284 4.060 4.400 . 0 0 "[ . 1 . 2]" 1
1777 1 90 SER H 1 90 SER QB . . 3.140 2.342 2.148 2.767 . 0 0 "[ . 1 . 2]" 1
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