NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
420297 |
2eej   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2eej
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 1525
_Distance_constraint_stats_list.Viol_count 488
_Distance_constraint_stats_list.Viol_total 139.651
_Distance_constraint_stats_list.Viol_max 0.165
_Distance_constraint_stats_list.Viol_rms 0.0032
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0143
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 8 PRO 0.005 0.002 8 0 "[ . 1 . 2]"
1 9 LYS 0.014 0.007 8 0 "[ . 1 . 2]"
1 10 LEU 0.015 0.010 15 0 "[ . 1 . 2]"
1 11 CYS 0.032 0.029 15 0 "[ . 1 . 2]"
1 12 ARG 0.043 0.029 15 0 "[ . 1 . 2]"
1 13 LEU 0.044 0.014 16 0 "[ . 1 . 2]"
1 14 ALA 0.001 0.001 7 0 "[ . 1 . 2]"
1 15 LYS 0.182 0.057 20 0 "[ . 1 . 2]"
1 16 GLY 0.062 0.028 20 0 "[ . 1 . 2]"
1 17 GLU 0.020 0.016 5 0 "[ . 1 . 2]"
1 18 ASN 0.020 0.016 5 0 "[ . 1 . 2]"
1 19 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 TYR 0.034 0.010 8 0 "[ . 1 . 2]"
1 21 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 PHE 0.211 0.055 16 0 "[ . 1 . 2]"
1 23 HIS 0.134 0.040 9 0 "[ . 1 . 2]"
1 24 LEU 0.092 0.019 9 0 "[ . 1 . 2]"
1 25 ASN 0.016 0.007 15 0 "[ . 1 . 2]"
1 26 ALA 0.015 0.007 15 0 "[ . 1 . 2]"
1 27 ILE 0.858 0.165 19 0 "[ . 1 . 2]"
1 28 ARG 0.863 0.165 19 0 "[ . 1 . 2]"
1 29 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 LEU 0.015 0.014 2 0 "[ . 1 . 2]"
1 31 PRO 0.015 0.014 2 0 "[ . 1 . 2]"
1 32 GLY 0.011 0.005 9 0 "[ . 1 . 2]"
1 33 SER 0.028 0.006 2 0 "[ . 1 . 2]"
1 34 PHE 0.116 0.022 13 0 "[ . 1 . 2]"
1 35 ILE 0.037 0.005 15 0 "[ . 1 . 2]"
1 36 LYS 0.016 0.011 12 0 "[ . 1 . 2]"
1 37 GLU 0.144 0.082 16 0 "[ . 1 . 2]"
1 38 VAL 0.200 0.082 16 0 "[ . 1 . 2]"
1 39 GLN 0.060 0.024 16 0 "[ . 1 . 2]"
1 40 LYS 0.004 0.004 17 0 "[ . 1 . 2]"
1 41 GLY 0.005 0.004 17 0 "[ . 1 . 2]"
1 42 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 PRO 0.011 0.003 10 0 "[ . 1 . 2]"
1 44 ALA 0.005 0.004 9 0 "[ . 1 . 2]"
1 45 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 LEU 0.001 0.001 15 0 "[ . 1 . 2]"
1 47 ALA 0.009 0.006 16 0 "[ . 1 . 2]"
1 48 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 LEU 0.016 0.005 16 0 "[ . 1 . 2]"
1 50 GLU 0.117 0.064 20 0 "[ . 1 . 2]"
1 51 ASP 0.148 0.064 20 0 "[ . 1 . 2]"
1 52 GLU 0.093 0.018 10 0 "[ . 1 . 2]"
1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 VAL 0.130 0.022 13 0 "[ . 1 . 2]"
1 55 ILE 0.132 0.011 7 0 "[ . 1 . 2]"
1 56 ILE 0.174 0.050 7 0 "[ . 1 . 2]"
1 57 GLU 0.153 0.024 19 0 "[ . 1 . 2]"
1 58 VAL 0.084 0.045 14 0 "[ . 1 . 2]"
1 59 ASN 0.021 0.009 14 0 "[ . 1 . 2]"
1 60 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 VAL 0.463 0.045 14 0 "[ . 1 . 2]"
1 62 ASN 0.076 0.028 10 0 "[ . 1 . 2]"
1 63 VAL 0.098 0.024 14 0 "[ . 1 . 2]"
1 64 LEU 1.075 0.075 16 0 "[ . 1 . 2]"
1 65 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 GLU 0.034 0.007 16 0 "[ . 1 . 2]"
1 67 PRO 0.066 0.037 13 0 "[ . 1 . 2]"
1 68 TYR 0.138 0.018 17 0 "[ . 1 . 2]"
1 69 GLU 0.182 0.037 12 0 "[ . 1 . 2]"
1 70 LYS 0.549 0.085 20 0 "[ . 1 . 2]"
1 71 VAL 0.155 0.034 13 0 "[ . 1 . 2]"
1 72 VAL 1.303 0.077 12 0 "[ . 1 . 2]"
1 73 ASP 1.485 0.077 12 0 "[ . 1 . 2]"
1 74 ARG 0.360 0.051 6 0 "[ . 1 . 2]"
1 75 ILE 0.057 0.009 8 0 "[ . 1 . 2]"
1 76 GLN 0.142 0.121 17 0 "[ . 1 . 2]"
1 77 SER 0.136 0.121 17 0 "[ . 1 . 2]"
1 78 SER 0.333 0.050 18 0 "[ . 1 . 2]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 LYS 0.065 0.035 9 0 "[ . 1 . 2]"
1 81 ASN 0.046 0.035 9 0 "[ . 1 . 2]"
1 82 VAL 0.019 0.006 8 0 "[ . 1 . 2]"
1 83 THR 0.014 0.009 14 0 "[ . 1 . 2]"
1 84 LEU 0.020 0.007 8 0 "[ . 1 . 2]"
1 85 LEU 0.167 0.050 7 0 "[ . 1 . 2]"
1 86 VAL 0.032 0.011 7 0 "[ . 1 . 2]"
1 87 CYS 0.031 0.015 14 0 "[ . 1 . 2]"
1 88 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 LYS 0.001 0.001 18 0 "[ . 1 . 2]"
1 90 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 PRO HA 1 9 LYS QG . . 4.010 3.770 3.419 4.000 . 0 0 "[ . 1 . 2]" 1
2 1 8 PRO QB 1 9 LYS H . . 3.550 2.314 1.889 3.070 . 0 0 "[ . 1 . 2]" 1
3 1 8 PRO QB 1 56 ILE MD . . 3.730 3.075 2.471 3.726 . 0 0 "[ . 1 . 2]" 1
4 1 8 PRO QB 1 85 LEU MD1 . . 4.660 3.317 2.745 3.802 . 0 0 "[ . 1 . 2]" 1
5 1 8 PRO QB 1 85 LEU MD2 . . 3.160 2.095 1.769 2.623 . 0 0 "[ . 1 . 2]" 1
6 1 8 PRO QB 1 87 CYS QB . . 4.210 2.674 1.978 3.141 . 0 0 "[ . 1 . 2]" 1
7 1 8 PRO HB2 1 9 LYS H . . 4.050 2.368 1.904 3.238 . 0 0 "[ . 1 . 2]" 1
8 1 8 PRO HB2 1 56 ILE MD . . 4.540 3.969 3.320 4.413 . 0 0 "[ . 1 . 2]" 1
9 1 8 PRO HB2 1 85 LEU HG . . 4.420 2.681 2.220 3.146 . 0 0 "[ . 1 . 2]" 1
10 1 8 PRO HB3 1 9 LYS H . . 4.050 3.348 3.146 3.808 . 0 0 "[ . 1 . 2]" 1
11 1 8 PRO HB3 1 56 ILE MD . . 4.540 3.216 2.549 4.077 . 0 0 "[ . 1 . 2]" 1
12 1 8 PRO HB3 1 85 LEU HG . . 4.420 3.923 3.473 4.416 . 0 0 "[ . 1 . 2]" 1
13 1 8 PRO HG2 1 56 ILE MD . . 5.420 5.021 4.140 5.422 0.002 8 0 "[ . 1 . 2]" 1
14 1 8 PRO HG2 1 85 LEU MD1 . . 4.320 3.020 2.023 3.729 . 0 0 "[ . 1 . 2]" 1
15 1 8 PRO HG2 1 85 LEU MD2 . . 4.470 3.188 2.448 3.787 . 0 0 "[ . 1 . 2]" 1
16 1 8 PRO HG3 1 56 ILE MD . . 4.460 3.900 2.963 4.462 0.002 8 0 "[ . 1 . 2]" 1
17 1 8 PRO HG3 1 85 LEU MD1 . . 4.490 2.991 2.033 3.778 . 0 0 "[ . 1 . 2]" 1
18 1 8 PRO HG3 1 85 LEU MD2 . . 4.130 2.395 2.023 3.004 . 0 0 "[ . 1 . 2]" 1
19 1 8 PRO HG3 1 85 LEU HG . . 4.890 3.828 3.067 4.590 . 0 0 "[ . 1 . 2]" 1
20 1 8 PRO HG3 1 87 CYS QB . . 4.730 4.399 3.755 4.723 . 0 0 "[ . 1 . 2]" 1
21 1 9 LYS H 1 9 LYS QB . . 3.490 2.849 2.370 3.233 . 0 0 "[ . 1 . 2]" 1
22 1 9 LYS H 1 9 LYS QG . . 3.790 2.389 1.853 3.478 . 0 0 "[ . 1 . 2]" 1
23 1 9 LYS H 1 85 LEU MD2 . . 4.500 3.953 2.857 4.501 0.001 19 0 "[ . 1 . 2]" 1
24 1 9 LYS H 1 86 VAL MG2 . . 3.870 3.146 2.785 3.696 . 0 0 "[ . 1 . 2]" 1
25 1 9 LYS HA 1 10 LEU H . . 3.060 2.211 2.142 2.332 . 0 0 "[ . 1 . 2]" 1
26 1 9 LYS HA 1 86 VAL MG2 . . 4.950 4.738 4.149 4.957 0.007 8 0 "[ . 1 . 2]" 1
27 1 9 LYS QB 1 9 LYS QE . . 3.770 2.864 2.016 3.643 . 0 0 "[ . 1 . 2]" 1
28 1 9 LYS QB 1 10 LEU H . . 4.080 2.978 2.577 3.631 . 0 0 "[ . 1 . 2]" 1
29 1 9 LYS QB 1 86 VAL MG2 . . 3.840 3.297 1.763 3.832 . 0 0 "[ . 1 . 2]" 1
30 1 9 LYS HB2 1 86 VAL MG2 . . 4.390 3.618 1.783 4.356 . 0 0 "[ . 1 . 2]" 1
31 1 9 LYS HB3 1 86 VAL MG2 . . 4.390 3.976 2.759 4.391 0.001 16 0 "[ . 1 . 2]" 1
32 1 9 LYS QD 1 86 VAL MG2 . . 3.500 2.911 1.967 3.489 . 0 0 "[ . 1 . 2]" 1
33 1 9 LYS QE 1 86 VAL MG2 . . 3.320 2.432 1.771 3.324 0.004 9 0 "[ . 1 . 2]" 1
34 1 9 LYS HE2 1 86 VAL MG2 . . 3.790 2.852 1.828 3.785 . 0 0 "[ . 1 . 2]" 1
35 1 9 LYS HE3 1 86 VAL MG2 . . 3.790 2.922 1.961 3.747 . 0 0 "[ . 1 . 2]" 1
36 1 9 LYS QG 1 10 LEU H . . 4.750 4.026 3.690 4.418 . 0 0 "[ . 1 . 2]" 1
37 1 9 LYS QG 1 86 VAL MG2 . . 4.440 2.541 1.853 4.391 . 0 0 "[ . 1 . 2]" 1
38 1 9 LYS HG2 1 10 LEU H . . 5.500 4.858 3.868 5.292 . 0 0 "[ . 1 . 2]" 1
39 1 9 LYS HG2 1 86 VAL MG2 . . 5.150 2.909 1.960 4.824 . 0 0 "[ . 1 . 2]" 1
40 1 9 LYS HG3 1 10 LEU H . . 5.500 4.371 3.837 4.970 . 0 0 "[ . 1 . 2]" 1
41 1 9 LYS HG3 1 86 VAL MG2 . . 5.150 2.879 1.973 5.138 . 0 0 "[ . 1 . 2]" 1
42 1 10 LEU H 1 10 LEU HB2 . . 3.630 2.577 2.418 2.746 . 0 0 "[ . 1 . 2]" 1
43 1 10 LEU H 1 10 LEU HB3 . . 3.630 2.742 2.618 2.920 . 0 0 "[ . 1 . 2]" 1
44 1 10 LEU H 1 10 LEU MD1 . . 4.550 4.180 4.103 4.273 . 0 0 "[ . 1 . 2]" 1
45 1 10 LEU H 1 10 LEU MD2 . . 4.380 4.004 3.876 4.127 . 0 0 "[ . 1 . 2]" 1
46 1 10 LEU H 1 10 LEU HG . . 4.970 4.743 4.623 4.904 . 0 0 "[ . 1 . 2]" 1
47 1 10 LEU HA 1 10 LEU MD2 . . 3.270 2.054 1.962 2.261 . 0 0 "[ . 1 . 2]" 1
48 1 10 LEU HA 1 10 LEU HG . . 4.240 3.714 3.651 3.774 . 0 0 "[ . 1 . 2]" 1
49 1 10 LEU HA 1 11 CYS H . . 3.370 2.148 2.139 2.170 . 0 0 "[ . 1 . 2]" 1
50 1 10 LEU HA 1 85 LEU HA . . 3.860 3.371 2.590 3.865 0.005 14 0 "[ . 1 . 2]" 1
51 1 10 LEU HA 1 86 VAL H . . 4.760 4.102 3.530 4.555 . 0 0 "[ . 1 . 2]" 1
52 1 10 LEU QB 1 10 LEU MD1 . . 3.230 2.266 2.173 2.419 . 0 0 "[ . 1 . 2]" 1
53 1 10 LEU QB 1 10 LEU MD2 . . 3.070 2.256 2.177 2.335 . 0 0 "[ . 1 . 2]" 1
54 1 10 LEU MD1 1 11 CYS H . . 3.800 2.367 2.025 2.770 . 0 0 "[ . 1 . 2]" 1
55 1 10 LEU MD1 1 12 ARG H . . 4.270 3.753 3.274 4.061 . 0 0 "[ . 1 . 2]" 1
56 1 10 LEU MD1 1 12 ARG QB . . 4.660 4.170 3.692 4.670 0.010 15 0 "[ . 1 . 2]" 1
57 1 10 LEU MD1 1 83 THR MG . . 3.010 1.884 1.659 2.215 . 0 0 "[ . 1 . 2]" 1
58 1 10 LEU MD1 1 84 LEU H . . 4.930 3.780 3.143 4.159 . 0 0 "[ . 1 . 2]" 1
59 1 10 LEU MD2 1 11 CYS H . . 3.610 3.123 2.595 3.533 . 0 0 "[ . 1 . 2]" 1
60 1 10 LEU MD2 1 83 THR MG . . 3.330 2.133 1.772 2.679 . 0 0 "[ . 1 . 2]" 1
61 1 10 LEU MD2 1 84 LEU H . . 5.360 4.023 2.958 4.556 . 0 0 "[ . 1 . 2]" 1
62 1 10 LEU MD2 1 85 LEU H . . 5.200 4.523 3.285 5.082 . 0 0 "[ . 1 . 2]" 1
63 1 10 LEU MD2 1 85 LEU HA . . 3.660 3.071 2.061 3.642 . 0 0 "[ . 1 . 2]" 1
64 1 10 LEU MD2 1 85 LEU HB2 . . 4.140 3.274 1.840 3.956 . 0 0 "[ . 1 . 2]" 1
65 1 10 LEU HG 1 11 CYS H . . 5.100 4.855 4.443 5.099 . 0 0 "[ . 1 . 2]" 1
66 1 10 LEU HG 1 83 THR MG . . 3.990 3.491 3.005 3.967 . 0 0 "[ . 1 . 2]" 1
67 1 11 CYS H 1 12 ARG QG . . 5.340 4.880 4.412 5.369 0.029 15 0 "[ . 1 . 2]" 1
68 1 11 CYS H 1 47 ALA MB . . 5.500 5.230 4.964 5.499 . 0 0 "[ . 1 . 2]" 1
69 1 11 CYS H 1 83 THR MG . . 4.550 3.811 3.177 4.549 . 0 0 "[ . 1 . 2]" 1
70 1 11 CYS H 1 84 LEU H . . 4.210 3.927 3.584 4.202 . 0 0 "[ . 1 . 2]" 1
71 1 11 CYS H 1 85 LEU HA . . 4.510 4.039 3.495 4.508 . 0 0 "[ . 1 . 2]" 1
72 1 11 CYS H 1 86 VAL H . . 4.780 4.462 3.986 4.773 . 0 0 "[ . 1 . 2]" 1
73 1 11 CYS QB 1 12 ARG H . . 3.890 3.066 2.689 3.452 . 0 0 "[ . 1 . 2]" 1
74 1 11 CYS QB 1 49 LEU MD1 . . 4.400 3.458 2.730 4.100 . 0 0 "[ . 1 . 2]" 1
75 1 11 CYS HB2 1 12 ARG H . . 4.460 3.692 2.738 4.424 . 0 0 "[ . 1 . 2]" 1
76 1 11 CYS HB2 1 47 ALA MB . . 3.770 2.844 1.933 3.761 . 0 0 "[ . 1 . 2]" 1
77 1 11 CYS HB2 1 49 LEU MD2 . . 4.000 3.360 2.157 3.956 . 0 0 "[ . 1 . 2]" 1
78 1 11 CYS HB3 1 12 ARG H . . 4.460 3.624 2.840 4.280 . 0 0 "[ . 1 . 2]" 1
79 1 11 CYS HB3 1 47 ALA MB . . 3.770 2.621 1.955 3.548 . 0 0 "[ . 1 . 2]" 1
80 1 11 CYS HB3 1 49 LEU MD2 . . 4.000 3.640 2.826 4.003 0.003 15 0 "[ . 1 . 2]" 1
81 1 12 ARG H 1 12 ARG HB2 . . 3.910 2.415 2.254 2.633 . 0 0 "[ . 1 . 2]" 1
82 1 12 ARG H 1 12 ARG HB3 . . 3.910 3.625 3.530 3.772 . 0 0 "[ . 1 . 2]" 1
83 1 12 ARG H 1 47 ALA MB . . 4.460 3.338 2.285 4.029 . 0 0 "[ . 1 . 2]" 1
84 1 12 ARG HA 1 13 LEU H . . 3.430 2.209 2.141 2.383 . 0 0 "[ . 1 . 2]" 1
85 1 12 ARG HA 1 83 THR HA . . 4.040 2.858 2.460 3.319 . 0 0 "[ . 1 . 2]" 1
86 1 12 ARG HA 1 83 THR MG . . 4.380 3.613 2.892 4.274 . 0 0 "[ . 1 . 2]" 1
87 1 12 ARG HA 1 84 LEU H . . 4.350 3.821 3.372 4.290 . 0 0 "[ . 1 . 2]" 1
88 1 12 ARG QB 1 12 ARG QD . . 3.300 2.212 2.025 2.638 . 0 0 "[ . 1 . 2]" 1
89 1 12 ARG HD2 1 83 THR MG . . 5.500 4.737 3.190 5.504 0.004 16 0 "[ . 1 . 2]" 1
90 1 12 ARG HD3 1 83 THR MG . . 5.500 4.612 2.104 5.479 . 0 0 "[ . 1 . 2]" 1
91 1 12 ARG QG 1 83 THR HA . . 4.450 3.481 2.639 4.012 . 0 0 "[ . 1 . 2]" 1
92 1 12 ARG QG 1 83 THR MG . . 3.790 2.941 2.225 3.321 . 0 0 "[ . 1 . 2]" 1
93 1 12 ARG HG2 1 83 THR MG . . 4.470 3.388 2.287 4.462 . 0 0 "[ . 1 . 2]" 1
94 1 12 ARG HG3 1 83 THR MG . . 4.470 3.535 2.602 4.288 . 0 0 "[ . 1 . 2]" 1
95 1 13 LEU H 1 13 LEU HB2 . . 3.710 2.386 2.207 2.686 . 0 0 "[ . 1 . 2]" 1
96 1 13 LEU H 1 13 LEU HB3 . . 3.950 3.615 3.483 3.804 . 0 0 "[ . 1 . 2]" 1
97 1 13 LEU H 1 13 LEU MD1 . . 3.950 3.596 3.287 3.945 . 0 0 "[ . 1 . 2]" 1
98 1 13 LEU H 1 13 LEU MD2 . . 4.850 4.193 3.935 4.373 . 0 0 "[ . 1 . 2]" 1
99 1 13 LEU H 1 13 LEU HG . . 4.010 3.122 2.704 3.402 . 0 0 "[ . 1 . 2]" 1
100 1 13 LEU H 1 82 VAL H . . 4.120 3.130 2.704 3.542 . 0 0 "[ . 1 . 2]" 1
101 1 13 LEU H 1 82 VAL MG1 . . 4.330 3.355 2.697 3.742 . 0 0 "[ . 1 . 2]" 1
102 1 13 LEU H 1 83 THR HA . . 4.290 3.616 3.154 4.190 . 0 0 "[ . 1 . 2]" 1
103 1 13 LEU HB2 1 14 ALA H . . 4.120 3.998 3.863 4.100 . 0 0 "[ . 1 . 2]" 1
104 1 13 LEU HB2 1 20 TYR QD . . 4.560 4.257 3.810 4.531 . 0 0 "[ . 1 . 2]" 1
105 1 13 LEU HB2 1 20 TYR QE . . 4.180 3.635 2.864 4.062 . 0 0 "[ . 1 . 2]" 1
106 1 13 LEU HB2 1 22 PHE QE . . 4.740 4.390 3.990 4.655 . 0 0 "[ . 1 . 2]" 1
107 1 13 LEU HB2 1 82 VAL H . . 4.820 3.100 2.449 3.527 . 0 0 "[ . 1 . 2]" 1
108 1 13 LEU HB2 1 82 VAL MG1 . . 3.630 2.095 1.921 2.317 . 0 0 "[ . 1 . 2]" 1
109 1 13 LEU HB3 1 13 LEU MD2 . . 3.060 2.117 2.014 2.342 . 0 0 "[ . 1 . 2]" 1
110 1 13 LEU HB3 1 14 ALA H . . 3.500 2.780 2.528 2.962 . 0 0 "[ . 1 . 2]" 1
111 1 13 LEU HB3 1 20 TYR QB . . 5.020 4.144 3.424 4.835 . 0 0 "[ . 1 . 2]" 1
112 1 13 LEU HB3 1 20 TYR QD . . 3.580 2.820 2.245 3.561 . 0 0 "[ . 1 . 2]" 1
113 1 13 LEU HB3 1 20 TYR QE . . 3.830 2.950 2.180 3.819 . 0 0 "[ . 1 . 2]" 1
114 1 13 LEU HB3 1 22 PHE QE . . 4.410 3.688 3.256 4.132 . 0 0 "[ . 1 . 2]" 1
115 1 13 LEU HB3 1 43 PRO HB2 . . 4.760 3.358 2.985 3.585 . 0 0 "[ . 1 . 2]" 1
116 1 13 LEU HB3 1 43 PRO HB3 . . 4.760 4.663 4.330 4.762 0.002 17 0 "[ . 1 . 2]" 1
117 1 13 LEU HB3 1 82 VAL H . . 4.470 4.231 3.629 4.466 . 0 0 "[ . 1 . 2]" 1
118 1 13 LEU HB3 1 82 VAL MG1 . . 3.640 3.176 2.722 3.580 . 0 0 "[ . 1 . 2]" 1
119 1 13 LEU MD1 1 20 TYR QB . . 5.340 3.710 3.323 4.132 . 0 0 "[ . 1 . 2]" 1
120 1 13 LEU MD1 1 20 TYR QE . . 4.640 3.944 3.291 4.268 . 0 0 "[ . 1 . 2]" 1
121 1 13 LEU MD1 1 22 PHE QE . . 3.540 2.042 1.853 2.426 . 0 0 "[ . 1 . 2]" 1
122 1 13 LEU MD1 1 22 PHE HZ . . 4.390 2.361 1.963 2.772 . 0 0 "[ . 1 . 2]" 1
123 1 13 LEU MD1 1 82 VAL MG1 . . 3.420 2.271 1.781 2.572 . 0 0 "[ . 1 . 2]" 1
124 1 13 LEU MD1 1 84 LEU HG . . 4.590 2.973 2.290 4.159 . 0 0 "[ . 1 . 2]" 1
125 1 13 LEU MD2 1 14 ALA H . . 4.050 3.153 2.520 3.444 . 0 0 "[ . 1 . 2]" 1
126 1 13 LEU MD2 1 20 TYR HA . . 4.450 4.291 3.786 4.446 . 0 0 "[ . 1 . 2]" 1
127 1 13 LEU MD2 1 20 TYR QB . . 3.870 3.038 2.494 3.687 . 0 0 "[ . 1 . 2]" 1
128 1 13 LEU MD2 1 20 TYR QD . . 3.880 3.035 2.599 3.791 . 0 0 "[ . 1 . 2]" 1
129 1 13 LEU MD2 1 20 TYR QE . . 5.040 4.225 3.496 4.931 . 0 0 "[ . 1 . 2]" 1
130 1 13 LEU MD2 1 22 PHE H . . 4.650 4.465 4.203 4.664 0.014 16 0 "[ . 1 . 2]" 1
131 1 13 LEU MD2 1 22 PHE HB3 . . 4.570 4.361 3.994 4.571 0.001 5 0 "[ . 1 . 2]" 1
132 1 13 LEU MD2 1 22 PHE QD . . 4.200 2.923 2.500 3.112 . 0 0 "[ . 1 . 2]" 1
133 1 13 LEU MD2 1 22 PHE QE . . 3.700 2.368 1.949 2.885 . 0 0 "[ . 1 . 2]" 1
134 1 13 LEU MD2 1 43 PRO HA . . 4.730 4.082 3.771 4.443 . 0 0 "[ . 1 . 2]" 1
135 1 13 LEU MD2 1 43 PRO HB2 . . 4.310 2.333 1.967 2.747 . 0 0 "[ . 1 . 2]" 1
136 1 13 LEU MD2 1 43 PRO QB . . 3.790 2.313 1.956 2.715 . 0 0 "[ . 1 . 2]" 1
137 1 13 LEU MD2 1 43 PRO HB3 . . 4.310 3.826 3.447 4.249 . 0 0 "[ . 1 . 2]" 1
138 1 13 LEU MD2 1 44 ALA H . . 4.020 3.044 2.626 3.631 . 0 0 "[ . 1 . 2]" 1
139 1 13 LEU MD2 1 44 ALA HA . . 3.270 1.963 1.776 2.295 . 0 0 "[ . 1 . 2]" 1
140 1 13 LEU MD2 1 44 ALA MB . . 3.040 2.371 2.038 2.801 . 0 0 "[ . 1 . 2]" 1
141 1 13 LEU MD2 1 47 ALA H . . 4.640 4.446 4.113 4.646 0.006 16 0 "[ . 1 . 2]" 1
142 1 13 LEU MD2 1 47 ALA MB . . 3.330 3.124 2.663 3.332 0.002 5 0 "[ . 1 . 2]" 1
143 1 13 LEU HG 1 14 ALA H . . 4.830 4.594 4.188 4.783 . 0 0 "[ . 1 . 2]" 1
144 1 13 LEU HG 1 22 PHE QE . . 4.560 4.374 3.879 4.573 0.013 15 0 "[ . 1 . 2]" 1
145 1 13 LEU HG 1 44 ALA HA . . 4.740 3.918 3.391 4.621 . 0 0 "[ . 1 . 2]" 1
146 1 13 LEU HG 1 49 LEU MD1 . . 4.570 2.903 2.271 3.266 . 0 0 "[ . 1 . 2]" 1
147 1 13 LEU HG 1 82 VAL MG1 . . 4.290 3.966 3.532 4.296 0.006 8 0 "[ . 1 . 2]" 1
148 1 14 ALA H 1 14 ALA MB . . 3.050 2.506 2.396 2.613 . 0 0 "[ . 1 . 2]" 1
149 1 14 ALA H 1 20 TYR QD . . 4.880 3.693 2.775 4.285 . 0 0 "[ . 1 . 2]" 1
150 1 14 ALA H 1 20 TYR QE . . 4.860 3.981 2.678 4.856 . 0 0 "[ . 1 . 2]" 1
151 1 14 ALA H 1 43 PRO HA . . 5.050 3.970 3.541 4.271 . 0 0 "[ . 1 . 2]" 1
152 1 14 ALA H 1 43 PRO HB2 . . 4.830 2.263 1.940 2.996 . 0 0 "[ . 1 . 2]" 1
153 1 14 ALA H 1 43 PRO QB . . 4.010 2.139 1.864 2.749 . 0 0 "[ . 1 . 2]" 1
154 1 14 ALA H 1 43 PRO HB3 . . 4.830 2.655 2.336 3.198 . 0 0 "[ . 1 . 2]" 1
155 1 14 ALA HA 1 15 LYS H . . 2.930 2.155 2.141 2.164 . 0 0 "[ . 1 . 2]" 1
156 1 14 ALA HA 1 20 TYR QE . . 4.010 3.533 2.294 4.003 . 0 0 "[ . 1 . 2]" 1
157 1 14 ALA HA 1 81 ASN HA . . 3.610 2.914 2.631 3.088 . 0 0 "[ . 1 . 2]" 1
158 1 14 ALA HA 1 81 ASN QB . . 4.570 3.774 2.847 4.269 . 0 0 "[ . 1 . 2]" 1
159 1 14 ALA HA 1 82 VAL H . . 4.740 4.364 4.073 4.699 . 0 0 "[ . 1 . 2]" 1
160 1 14 ALA MB 1 81 ASN HA . . 4.350 4.216 4.015 4.347 . 0 0 "[ . 1 . 2]" 1
161 1 14 ALA MB 1 81 ASN QB . . 4.500 4.127 3.417 4.501 0.001 7 0 "[ . 1 . 2]" 1
162 1 15 LYS H 1 15 LYS HB2 . . 3.400 2.400 2.159 2.646 . 0 0 "[ . 1 . 2]" 1
163 1 15 LYS H 1 15 LYS QB . . 2.850 2.217 2.119 2.286 . 0 0 "[ . 1 . 2]" 1
164 1 15 LYS H 1 15 LYS HB3 . . 3.400 2.708 2.401 3.457 0.057 20 0 "[ . 1 . 2]" 1
165 1 15 LYS H 1 15 LYS HG2 . . 4.570 4.517 4.364 4.590 0.020 7 0 "[ . 1 . 2]" 1
166 1 15 LYS H 1 15 LYS HG3 . . 4.570 4.310 3.268 4.499 . 0 0 "[ . 1 . 2]" 1
167 1 15 LYS H 1 16 GLY H . . 4.590 4.476 4.284 4.610 0.020 14 0 "[ . 1 . 2]" 1
168 1 15 LYS H 1 20 TYR QD . . 4.520 4.016 3.376 4.470 . 0 0 "[ . 1 . 2]" 1
169 1 15 LYS H 1 20 TYR QE . . 3.680 2.733 1.936 3.055 . 0 0 "[ . 1 . 2]" 1
170 1 15 LYS H 1 80 LYS HA . . 4.300 3.356 3.003 3.678 . 0 0 "[ . 1 . 2]" 1
171 1 15 LYS H 1 80 LYS QB . . 4.760 3.300 2.294 4.490 . 0 0 "[ . 1 . 2]" 1
172 1 15 LYS H 1 81 ASN HA . . 3.920 3.520 2.980 3.906 . 0 0 "[ . 1 . 2]" 1
173 1 15 LYS HA 1 15 LYS HG2 . . 4.120 3.177 2.706 3.652 . 0 0 "[ . 1 . 2]" 1
174 1 15 LYS HA 1 15 LYS QG . . 3.510 2.361 2.224 2.579 . 0 0 "[ . 1 . 2]" 1
175 1 15 LYS HA 1 15 LYS HG3 . . 4.120 2.447 2.316 2.783 . 0 0 "[ . 1 . 2]" 1
176 1 15 LYS HA 1 16 GLY H . . 2.990 2.162 2.145 2.233 . 0 0 "[ . 1 . 2]" 1
177 1 15 LYS HA 1 20 TYR HA . . 4.290 3.276 2.681 3.910 . 0 0 "[ . 1 . 2]" 1
178 1 15 LYS HA 1 20 TYR QD . . 3.940 2.995 2.341 3.568 . 0 0 "[ . 1 . 2]" 1
179 1 15 LYS HA 1 20 TYR QE . . 4.010 3.423 2.464 3.992 . 0 0 "[ . 1 . 2]" 1
180 1 15 LYS QB 1 16 GLY H . . 3.970 3.772 2.974 3.964 . 0 0 "[ . 1 . 2]" 1
181 1 15 LYS QB 1 20 TYR QD . . 4.490 3.868 3.213 4.359 . 0 0 "[ . 1 . 2]" 1
182 1 15 LYS QB 1 20 TYR QE . . 3.600 2.892 2.079 3.602 0.002 20 0 "[ . 1 . 2]" 1
183 1 15 LYS QB 1 80 LYS HA . . 3.340 2.012 1.800 2.269 . 0 0 "[ . 1 . 2]" 1
184 1 15 LYS QB 1 80 LYS QB . . 4.090 2.632 1.900 3.767 . 0 0 "[ . 1 . 2]" 1
185 1 15 LYS HB2 1 16 GLY H . . 4.590 4.374 4.225 4.556 . 0 0 "[ . 1 . 2]" 1
186 1 15 LYS HB3 1 16 GLY H . . 4.590 4.147 3.039 4.428 . 0 0 "[ . 1 . 2]" 1
187 1 15 LYS QD 1 19 GLY QA . . 4.380 3.197 2.122 4.284 . 0 0 "[ . 1 . 2]" 1
188 1 15 LYS QD 1 80 LYS HA . . 3.440 2.531 1.827 3.291 . 0 0 "[ . 1 . 2]" 1
189 1 15 LYS HD2 1 20 TYR QE . . 5.500 4.452 3.094 5.508 0.008 13 0 "[ . 1 . 2]" 1
190 1 15 LYS HD3 1 20 TYR QE . . 5.500 4.983 2.894 5.510 0.010 8 0 "[ . 1 . 2]" 1
191 1 15 LYS QE 1 15 LYS QG . . 3.290 2.220 2.039 2.545 . 0 0 "[ . 1 . 2]" 1
192 1 15 LYS QE 1 19 GLY QA . . 4.070 2.829 1.872 4.060 . 0 0 "[ . 1 . 2]" 1
193 1 15 LYS QE 1 20 TYR QE . . 4.400 3.207 2.511 4.398 . 0 0 "[ . 1 . 2]" 1
194 1 15 LYS QE 1 80 LYS HA . . 4.120 3.290 1.989 4.090 . 0 0 "[ . 1 . 2]" 1
195 1 15 LYS HE2 1 80 LYS HA . . 4.830 4.182 2.003 4.830 . 0 0 "[ . 1 . 2]" 1
196 1 15 LYS HE3 1 80 LYS HA . . 4.830 3.622 2.144 4.670 . 0 0 "[ . 1 . 2]" 1
197 1 15 LYS QG 1 16 GLY H . . 3.610 3.006 2.409 3.453 . 0 0 "[ . 1 . 2]" 1
198 1 15 LYS QG 1 19 GLY QA . . 3.900 2.353 1.929 3.512 . 0 0 "[ . 1 . 2]" 1
199 1 15 LYS HG2 1 16 GLY H . . 4.130 3.582 2.864 4.118 . 0 0 "[ . 1 . 2]" 1
200 1 15 LYS HG3 1 16 GLY H . . 4.130 3.341 2.426 4.158 0.028 20 0 "[ . 1 . 2]" 1
201 1 16 GLY H 1 20 TYR HA . . 4.260 3.732 3.140 4.262 0.002 10 0 "[ . 1 . 2]" 1
202 1 16 GLY H 1 20 TYR QD . . 4.960 4.511 3.634 4.959 . 0 0 "[ . 1 . 2]" 1
203 1 16 GLY H 1 43 PRO HG3 . . 4.000 3.549 2.905 3.993 . 0 0 "[ . 1 . 2]" 1
204 1 17 GLU HA 1 17 GLU QG . . 3.730 2.674 2.177 3.495 . 0 0 "[ . 1 . 2]" 1
205 1 17 GLU QB 1 18 ASN HA . . 4.660 4.219 3.792 4.676 0.016 5 0 "[ . 1 . 2]" 1
206 1 17 GLU QB 1 18 ASN QD . . 4.940 3.896 2.456 4.886 . 0 0 "[ . 1 . 2]" 1
207 1 20 TYR HA 1 20 TYR QD . . 3.540 2.522 2.006 3.060 . 0 0 "[ . 1 . 2]" 1
208 1 20 TYR HA 1 20 TYR QE . . 4.790 4.556 4.229 4.780 . 0 0 "[ . 1 . 2]" 1
209 1 20 TYR HA 1 43 PRO HB2 . . 4.850 4.331 3.836 4.661 . 0 0 "[ . 1 . 2]" 1
210 1 20 TYR HA 1 43 PRO QB . . 4.180 3.934 3.501 4.183 0.003 10 0 "[ . 1 . 2]" 1
211 1 20 TYR HA 1 43 PRO HB3 . . 4.850 4.525 4.043 4.804 . 0 0 "[ . 1 . 2]" 1
212 1 20 TYR HA 1 43 PRO QD . . 4.600 3.697 3.384 4.307 . 0 0 "[ . 1 . 2]" 1
213 1 20 TYR HA 1 43 PRO HG2 . . 4.580 2.938 2.407 3.207 . 0 0 "[ . 1 . 2]" 1
214 1 20 TYR HA 1 43 PRO HG3 . . 4.070 2.401 2.019 2.890 . 0 0 "[ . 1 . 2]" 1
215 1 20 TYR HA 1 44 ALA H . . 5.450 4.931 4.193 5.420 . 0 0 "[ . 1 . 2]" 1
216 1 20 TYR QB 1 22 PHE H . . 3.900 2.976 2.605 3.348 . 0 0 "[ . 1 . 2]" 1
217 1 20 TYR QB 1 22 PHE QD . . 3.560 2.347 2.042 2.610 . 0 0 "[ . 1 . 2]" 1
218 1 20 TYR QB 1 22 PHE QE . . 3.530 2.347 1.916 2.713 . 0 0 "[ . 1 . 2]" 1
219 1 20 TYR QB 1 44 ALA MB . . 5.270 3.731 3.381 4.237 . 0 0 "[ . 1 . 2]" 1
220 1 20 TYR HB2 1 22 PHE H . . 4.470 3.588 2.710 4.446 . 0 0 "[ . 1 . 2]" 1
221 1 20 TYR HB2 1 22 PHE QD . . 4.160 3.326 2.390 4.052 . 0 0 "[ . 1 . 2]" 1
222 1 20 TYR HB2 1 22 PHE QE . . 4.060 3.275 2.448 3.923 . 0 0 "[ . 1 . 2]" 1
223 1 20 TYR HB3 1 22 PHE H . . 4.470 3.264 2.789 3.593 . 0 0 "[ . 1 . 2]" 1
224 1 20 TYR HB3 1 22 PHE QD . . 4.160 2.431 2.090 2.803 . 0 0 "[ . 1 . 2]" 1
225 1 20 TYR HB3 1 22 PHE QE . . 4.060 2.436 2.001 2.920 . 0 0 "[ . 1 . 2]" 1
226 1 20 TYR QD 1 22 PHE QD . . 4.510 4.164 3.642 4.456 . 0 0 "[ . 1 . 2]" 1
227 1 20 TYR QD 1 43 PRO HB2 . . 4.770 3.492 2.731 4.214 . 0 0 "[ . 1 . 2]" 1
228 1 20 TYR QD 1 43 PRO QB . . 4.130 3.319 2.584 3.942 . 0 0 "[ . 1 . 2]" 1
229 1 20 TYR QD 1 43 PRO HB3 . . 4.770 4.169 3.191 4.741 . 0 0 "[ . 1 . 2]" 1
230 1 20 TYR QD 1 75 ILE MG . . 3.820 3.450 2.955 3.804 . 0 0 "[ . 1 . 2]" 1
231 1 20 TYR QD 1 82 VAL MG1 . . 4.260 3.979 3.670 4.250 . 0 0 "[ . 1 . 2]" 1
232 1 20 TYR QE 1 75 ILE MG . . 3.480 2.836 2.173 3.292 . 0 0 "[ . 1 . 2]" 1
233 1 20 TYR QE 1 76 GLN HA . . 4.690 3.206 2.384 4.533 . 0 0 "[ . 1 . 2]" 1
234 1 20 TYR QE 1 81 ASN HA . . 3.910 3.633 2.891 3.916 0.006 13 0 "[ . 1 . 2]" 1
235 1 20 TYR QE 1 82 VAL H . . 4.410 4.073 3.679 4.364 . 0 0 "[ . 1 . 2]" 1
236 1 20 TYR QE 1 82 VAL HB . . 4.730 4.267 3.601 4.726 . 0 0 "[ . 1 . 2]" 1
237 1 20 TYR QE 1 82 VAL MG1 . . 3.670 2.814 2.489 3.121 . 0 0 "[ . 1 . 2]" 1
238 1 21 GLY H 1 22 PHE H . . 3.220 2.852 2.409 3.209 . 0 0 "[ . 1 . 2]" 1
239 1 21 GLY QA 1 22 PHE QD . . 4.930 4.157 3.710 4.372 . 0 0 "[ . 1 . 2]" 1
240 1 21 GLY QA 1 39 GLN H . . 4.290 3.353 2.885 3.671 . 0 0 "[ . 1 . 2]" 1
241 1 21 GLY QA 1 39 GLN QB . . 3.990 3.135 2.758 3.411 . 0 0 "[ . 1 . 2]" 1
242 1 21 GLY QA 1 43 PRO QD . . 3.470 2.935 2.054 3.464 . 0 0 "[ . 1 . 2]" 1
243 1 22 PHE H 1 22 PHE HB3 . . 4.000 2.524 2.316 3.323 . 0 0 "[ . 1 . 2]" 1
244 1 22 PHE H 1 22 PHE QD . . 3.950 2.036 1.892 2.682 . 0 0 "[ . 1 . 2]" 1
245 1 22 PHE H 1 22 PHE QE . . 4.530 4.207 3.991 4.472 . 0 0 "[ . 1 . 2]" 1
246 1 22 PHE H 1 23 HIS H . . 4.680 4.571 4.368 4.631 . 0 0 "[ . 1 . 2]" 1
247 1 22 PHE H 1 38 VAL HA . . 4.340 3.892 3.679 4.337 . 0 0 "[ . 1 . 2]" 1
248 1 22 PHE H 1 39 GLN QB . . 5.340 5.249 5.043 5.364 0.024 16 0 "[ . 1 . 2]" 1
249 1 22 PHE H 1 44 ALA MB . . 4.420 2.986 2.386 4.070 . 0 0 "[ . 1 . 2]" 1
250 1 22 PHE HA 1 22 PHE QD . . 4.480 3.706 3.649 3.721 . 0 0 "[ . 1 . 2]" 1
251 1 22 PHE HA 1 23 HIS H . . 3.060 2.427 2.352 2.506 . 0 0 "[ . 1 . 2]" 1
252 1 22 PHE HA 1 35 ILE MG . . 4.660 3.927 3.611 4.226 . 0 0 "[ . 1 . 2]" 1
253 1 22 PHE HA 1 38 VAL HA . . 3.820 2.013 1.956 2.094 . 0 0 "[ . 1 . 2]" 1
254 1 22 PHE HA 1 38 VAL MG1 . . 4.480 4.313 4.017 4.535 0.055 16 0 "[ . 1 . 2]" 1
255 1 22 PHE HA 1 39 GLN H . . 4.160 3.568 3.317 3.740 . 0 0 "[ . 1 . 2]" 1
256 1 22 PHE HA 1 44 ALA MB . . 4.650 4.071 3.724 4.408 . 0 0 "[ . 1 . 2]" 1
257 1 22 PHE HB2 1 23 HIS H . . 3.210 2.514 2.319 2.668 . 0 0 "[ . 1 . 2]" 1
258 1 22 PHE HB2 1 24 LEU MD1 . . 4.900 4.802 4.632 4.913 0.013 13 0 "[ . 1 . 2]" 1
259 1 22 PHE HB2 1 35 ILE MD . . 4.830 4.094 3.746 4.470 . 0 0 "[ . 1 . 2]" 1
260 1 22 PHE HB2 1 35 ILE MG . . 3.660 2.120 1.830 2.347 . 0 0 "[ . 1 . 2]" 1
261 1 22 PHE HB2 1 36 LYS H . . 4.550 3.816 3.475 4.041 . 0 0 "[ . 1 . 2]" 1
262 1 22 PHE HB2 1 38 VAL HA . . 4.410 3.218 2.886 3.570 . 0 0 "[ . 1 . 2]" 1
263 1 22 PHE HB2 1 38 VAL MG1 . . 4.020 3.817 3.671 4.028 0.008 16 0 "[ . 1 . 2]" 1
264 1 22 PHE HB2 1 44 ALA MB . . 3.890 3.332 3.045 3.671 . 0 0 "[ . 1 . 2]" 1
265 1 22 PHE HB3 1 23 HIS H . . 3.960 3.901 3.771 4.000 0.040 9 0 "[ . 1 . 2]" 1
266 1 22 PHE HB3 1 35 ILE MG . . 3.860 3.177 2.748 3.520 . 0 0 "[ . 1 . 2]" 1
267 1 22 PHE HB3 1 38 VAL HA . . 4.270 3.020 2.725 3.408 . 0 0 "[ . 1 . 2]" 1
268 1 22 PHE HB3 1 38 VAL MG1 . . 4.360 4.189 4.006 4.295 . 0 0 "[ . 1 . 2]" 1
269 1 22 PHE HB3 1 39 GLN H . . 4.830 4.425 4.073 4.839 0.009 15 0 "[ . 1 . 2]" 1
270 1 22 PHE HB3 1 44 ALA MB . . 3.580 2.127 1.883 2.464 . 0 0 "[ . 1 . 2]" 1
271 1 22 PHE QD 1 23 HIS H . . 3.990 3.006 2.572 3.404 . 0 0 "[ . 1 . 2]" 1
272 1 22 PHE QD 1 24 LEU MD1 . . 4.030 2.946 2.739 3.187 . 0 0 "[ . 1 . 2]" 1
273 1 22 PHE QD 1 24 LEU HG . . 5.330 4.956 4.860 5.047 . 0 0 "[ . 1 . 2]" 1
274 1 22 PHE QD 1 35 ILE HA . . 4.280 2.890 2.450 3.114 . 0 0 "[ . 1 . 2]" 1
275 1 22 PHE QD 1 35 ILE HB . . 5.350 4.448 4.096 4.767 . 0 0 "[ . 1 . 2]" 1
276 1 22 PHE QD 1 35 ILE MD . . 4.150 3.412 2.878 3.665 . 0 0 "[ . 1 . 2]" 1
277 1 22 PHE QD 1 35 ILE QG . . 4.460 2.501 2.003 2.880 . 0 0 "[ . 1 . 2]" 1
278 1 22 PHE QD 1 35 ILE MG . . 3.430 2.092 1.948 2.367 . 0 0 "[ . 1 . 2]" 1
279 1 22 PHE QD 1 36 LYS H . . 4.310 3.404 3.058 3.707 . 0 0 "[ . 1 . 2]" 1
280 1 22 PHE QD 1 38 VAL HB . . 5.500 4.147 3.878 4.282 . 0 0 "[ . 1 . 2]" 1
281 1 22 PHE QD 1 38 VAL MG1 . . 5.070 5.028 4.832 5.076 0.006 14 0 "[ . 1 . 2]" 1
282 1 22 PHE QD 1 44 ALA HA . . 5.440 4.225 3.751 4.958 . 0 0 "[ . 1 . 2]" 1
283 1 22 PHE QD 1 44 ALA MB . . 3.240 2.169 1.954 2.746 . 0 0 "[ . 1 . 2]" 1
284 1 22 PHE QD 1 49 LEU MD1 . . 4.570 3.769 3.434 4.021 . 0 0 "[ . 1 . 2]" 1
285 1 22 PHE QE 1 24 LEU MD1 . . 3.900 2.066 1.877 2.227 . 0 0 "[ . 1 . 2]" 1
286 1 22 PHE QE 1 24 LEU MD2 . . 4.390 4.154 4.026 4.303 . 0 0 "[ . 1 . 2]" 1
287 1 22 PHE QE 1 24 LEU HG . . 4.480 4.074 3.816 4.288 . 0 0 "[ . 1 . 2]" 1
288 1 22 PHE QE 1 35 ILE MD . . 4.280 3.562 3.157 3.816 . 0 0 "[ . 1 . 2]" 1
289 1 22 PHE QE 1 35 ILE MG . . 4.590 3.753 3.442 3.972 . 0 0 "[ . 1 . 2]" 1
290 1 22 PHE QE 1 44 ALA MB . . 4.080 3.529 3.234 3.803 . 0 0 "[ . 1 . 2]" 1
291 1 22 PHE QE 1 49 LEU MD1 . . 3.890 3.778 3.605 3.893 0.003 9 0 "[ . 1 . 2]" 1
292 1 22 PHE QE 1 55 ILE MD . . 4.120 2.762 2.339 3.122 . 0 0 "[ . 1 . 2]" 1
293 1 22 PHE QE 1 75 ILE MD . . 3.860 3.366 2.835 3.691 . 0 0 "[ . 1 . 2]" 1
294 1 22 PHE QE 1 75 ILE MG . . 4.360 3.620 3.153 4.034 . 0 0 "[ . 1 . 2]" 1
295 1 22 PHE QE 1 82 VAL MG1 . . 4.880 4.123 3.741 4.411 . 0 0 "[ . 1 . 2]" 1
296 1 22 PHE HZ 1 75 ILE MD . . 3.370 3.216 2.597 3.371 0.001 18 0 "[ . 1 . 2]" 1
297 1 22 PHE HZ 1 75 ILE MG . . 3.630 2.809 2.348 3.255 . 0 0 "[ . 1 . 2]" 1
298 1 23 HIS H 1 23 HIS HB2 . . 3.470 2.741 2.668 2.833 . 0 0 "[ . 1 . 2]" 1
299 1 23 HIS H 1 23 HIS HB3 . . 4.050 3.823 3.745 3.890 . 0 0 "[ . 1 . 2]" 1
300 1 23 HIS H 1 24 LEU H . . 4.420 4.402 4.365 4.439 0.019 9 0 "[ . 1 . 2]" 1
301 1 23 HIS H 1 35 ILE HA . . 4.760 4.188 3.788 4.480 . 0 0 "[ . 1 . 2]" 1
302 1 23 HIS H 1 35 ILE MG . . 3.990 3.227 2.888 3.570 . 0 0 "[ . 1 . 2]" 1
303 1 23 HIS H 1 36 LYS HB3 . . 4.890 4.600 4.294 4.787 . 0 0 "[ . 1 . 2]" 1
304 1 23 HIS H 1 37 GLU H . . 5.060 4.942 4.780 5.063 0.003 14 0 "[ . 1 . 2]" 1
305 1 23 HIS H 1 37 GLU HB2 . . 4.100 3.346 3.024 3.655 . 0 0 "[ . 1 . 2]" 1
306 1 23 HIS H 1 38 VAL HA . . 4.470 3.998 3.807 4.219 . 0 0 "[ . 1 . 2]" 1
307 1 23 HIS H 1 38 VAL MG1 . . 4.940 4.822 4.636 4.977 0.037 16 0 "[ . 1 . 2]" 1
308 1 23 HIS HA 1 24 LEU H . . 3.300 2.517 2.225 2.634 . 0 0 "[ . 1 . 2]" 1
309 1 23 HIS HB2 1 24 LEU H . . 4.080 3.480 3.177 4.007 . 0 0 "[ . 1 . 2]" 1
310 1 23 HIS HB2 1 36 LYS H . . 4.890 4.054 3.762 4.306 . 0 0 "[ . 1 . 2]" 1
311 1 23 HIS HB2 1 36 LYS HB3 . . 4.580 3.998 3.655 4.403 . 0 0 "[ . 1 . 2]" 1
312 1 23 HIS HB2 1 36 LYS QG . . 5.180 4.795 4.122 5.095 . 0 0 "[ . 1 . 2]" 1
313 1 23 HIS HB2 1 37 GLU HB2 . . 4.190 2.391 2.164 2.592 . 0 0 "[ . 1 . 2]" 1
314 1 23 HIS HB2 1 37 GLU HB3 . . 4.490 3.974 3.714 4.211 . 0 0 "[ . 1 . 2]" 1
315 1 23 HIS HB2 1 37 GLU HG2 . . 5.120 4.693 3.560 5.121 0.001 9 0 "[ . 1 . 2]" 1
316 1 23 HIS HB2 1 37 GLU QG . . 4.290 3.315 2.486 3.814 . 0 0 "[ . 1 . 2]" 1
317 1 23 HIS HB2 1 37 GLU HG3 . . 5.120 3.395 2.537 3.934 . 0 0 "[ . 1 . 2]" 1
318 1 23 HIS HB3 1 24 LEU H . . 3.700 2.221 1.957 2.937 . 0 0 "[ . 1 . 2]" 1
319 1 23 HIS HB3 1 24 LEU HB2 . . 5.130 4.519 4.355 4.930 . 0 0 "[ . 1 . 2]" 1
320 1 23 HIS HB3 1 36 LYS HB3 . . 5.500 4.885 4.227 5.387 . 0 0 "[ . 1 . 2]" 1
321 1 23 HIS HB3 1 37 GLU HB2 . . 4.520 4.068 3.851 4.287 . 0 0 "[ . 1 . 2]" 1
322 1 23 HIS HD2 1 37 GLU HB2 . . 4.390 2.403 1.997 3.236 . 0 0 "[ . 1 . 2]" 1
323 1 23 HIS HD2 1 37 GLU HB3 . . 4.440 2.958 2.448 3.609 . 0 0 "[ . 1 . 2]" 1
324 1 23 HIS HD2 1 37 GLU HG2 . . 5.500 4.913 4.367 5.474 . 0 0 "[ . 1 . 2]" 1
325 1 23 HIS HD2 1 37 GLU QG . . 4.780 4.102 3.168 4.656 . 0 0 "[ . 1 . 2]" 1
326 1 23 HIS HD2 1 37 GLU HG3 . . 5.500 4.421 3.252 5.041 . 0 0 "[ . 1 . 2]" 1
327 1 24 LEU H 1 24 LEU HB2 . . 3.380 2.353 2.179 2.426 . 0 0 "[ . 1 . 2]" 1
328 1 24 LEU H 1 24 LEU HB3 . . 3.660 3.561 3.473 3.605 . 0 0 "[ . 1 . 2]" 1
329 1 24 LEU H 1 24 LEU HG . . 4.410 4.338 4.162 4.411 0.001 14 0 "[ . 1 . 2]" 1
330 1 24 LEU HA 1 24 LEU MD1 . . 3.550 2.530 2.406 2.658 . 0 0 "[ . 1 . 2]" 1
331 1 24 LEU HA 1 24 LEU MD2 . . 4.130 3.784 3.740 3.810 . 0 0 "[ . 1 . 2]" 1
332 1 24 LEU HA 1 24 LEU HG . . 3.890 2.478 2.394 2.542 . 0 0 "[ . 1 . 2]" 1
333 1 24 LEU HA 1 25 ASN H . . 3.110 2.294 2.245 2.347 . 0 0 "[ . 1 . 2]" 1
334 1 24 LEU HA 1 35 ILE HA . . 4.010 3.110 2.847 3.309 . 0 0 "[ . 1 . 2]" 1
335 1 24 LEU HA 1 36 LYS H . . 3.860 3.362 3.060 3.649 . 0 0 "[ . 1 . 2]" 1
336 1 24 LEU HA 1 55 ILE MD . . 4.580 3.943 3.650 4.150 . 0 0 "[ . 1 . 2]" 1
337 1 24 LEU HB2 1 24 LEU MD2 . . 3.620 2.402 2.292 2.498 . 0 0 "[ . 1 . 2]" 1
338 1 24 LEU HB2 1 25 ASN H . . 4.380 4.051 3.936 4.163 . 0 0 "[ . 1 . 2]" 1
339 1 24 LEU HB2 1 68 TYR QE . . 3.960 2.374 2.103 2.499 . 0 0 "[ . 1 . 2]" 1
340 1 24 LEU HB3 1 24 LEU MD2 . . 3.560 2.278 2.134 2.401 . 0 0 "[ . 1 . 2]" 1
341 1 24 LEU HB3 1 25 ASN H . . 3.680 2.770 2.603 2.943 . 0 0 "[ . 1 . 2]" 1
342 1 24 LEU HB3 1 33 SER QB . . 4.100 2.880 2.432 3.674 . 0 0 "[ . 1 . 2]" 1
343 1 24 LEU HB3 1 34 PHE H . . 5.080 3.868 3.499 4.254 . 0 0 "[ . 1 . 2]" 1
344 1 24 LEU HB3 1 55 ILE MD . . 4.580 4.192 3.816 4.536 . 0 0 "[ . 1 . 2]" 1
345 1 24 LEU HB3 1 68 TYR QD . . 4.090 2.583 2.140 2.925 . 0 0 "[ . 1 . 2]" 1
346 1 24 LEU HB3 1 68 TYR QE . . 3.310 2.033 1.996 2.188 . 0 0 "[ . 1 . 2]" 1
347 1 24 LEU MD1 1 25 ASN H . . 4.410 4.344 4.274 4.405 . 0 0 "[ . 1 . 2]" 1
348 1 24 LEU MD1 1 33 SER QB . . 3.930 3.858 3.694 3.936 0.006 2 0 "[ . 1 . 2]" 1
349 1 24 LEU MD1 1 34 PHE H . . 5.300 4.880 4.472 5.201 . 0 0 "[ . 1 . 2]" 1
350 1 24 LEU MD1 1 35 ILE H . . 5.500 5.204 5.000 5.382 . 0 0 "[ . 1 . 2]" 1
351 1 24 LEU MD1 1 35 ILE HA . . 3.870 3.307 3.065 3.527 . 0 0 "[ . 1 . 2]" 1
352 1 24 LEU MD1 1 35 ILE MD . . 4.560 4.457 4.164 4.562 0.002 16 0 "[ . 1 . 2]" 1
353 1 24 LEU MD1 1 35 ILE QG . . 4.390 3.298 3.000 3.433 . 0 0 "[ . 1 . 2]" 1
354 1 24 LEU MD1 1 36 LYS H . . 4.470 4.069 3.697 4.394 . 0 0 "[ . 1 . 2]" 1
355 1 24 LEU MD1 1 68 TYR QE . . 4.330 4.279 4.080 4.341 0.011 13 0 "[ . 1 . 2]" 1
356 1 24 LEU MD1 1 72 VAL HA . . 4.280 3.877 3.422 4.279 . 0 0 "[ . 1 . 2]" 1
357 1 24 LEU MD2 1 25 ASN H . . 4.390 4.341 4.117 4.393 0.003 19 0 "[ . 1 . 2]" 1
358 1 24 LEU MD2 1 33 SER HB2 . . 3.960 2.507 2.022 2.939 . 0 0 "[ . 1 . 2]" 1
359 1 24 LEU MD2 1 33 SER QB . . 3.350 2.231 1.773 2.603 . 0 0 "[ . 1 . 2]" 1
360 1 24 LEU MD2 1 33 SER HB3 . . 3.960 2.537 1.961 2.906 . 0 0 "[ . 1 . 2]" 1
361 1 24 LEU MD2 1 34 PHE H . . 4.640 4.230 3.417 4.575 . 0 0 "[ . 1 . 2]" 1
362 1 24 LEU MD2 1 55 ILE MD . . 2.970 2.209 1.807 2.625 . 0 0 "[ . 1 . 2]" 1
363 1 24 LEU MD2 1 68 TYR QD . . 4.290 3.124 2.588 3.394 . 0 0 "[ . 1 . 2]" 1
364 1 24 LEU MD2 1 68 TYR QE . . 4.200 3.414 2.911 3.646 . 0 0 "[ . 1 . 2]" 1
365 1 24 LEU MD2 1 71 VAL HB . . 4.280 3.177 2.908 3.765 . 0 0 "[ . 1 . 2]" 1
366 1 24 LEU MD2 1 72 VAL H . . 4.550 3.430 3.135 3.755 . 0 0 "[ . 1 . 2]" 1
367 1 24 LEU MD2 1 72 VAL HA . . 3.330 2.417 1.976 2.809 . 0 0 "[ . 1 . 2]" 1
368 1 24 LEU MD2 1 75 ILE HB . . 4.280 3.884 3.378 4.280 0.000 9 0 "[ . 1 . 2]" 1
369 1 24 LEU HG 1 25 ASN H . . 4.660 3.581 3.460 3.675 . 0 0 "[ . 1 . 2]" 1
370 1 24 LEU HG 1 33 SER QB . . 4.720 2.430 2.144 2.712 . 0 0 "[ . 1 . 2]" 1
371 1 24 LEU HG 1 34 PHE H . . 5.320 3.543 2.906 3.948 . 0 0 "[ . 1 . 2]" 1
372 1 24 LEU HG 1 35 ILE HA . . 4.870 3.961 3.655 4.322 . 0 0 "[ . 1 . 2]" 1
373 1 24 LEU HG 1 68 TYR QD . . 4.760 4.515 4.258 4.719 . 0 0 "[ . 1 . 2]" 1
374 1 24 LEU HG 1 68 TYR QE . . 4.550 4.431 4.377 4.548 . 0 0 "[ . 1 . 2]" 1
375 1 24 LEU HG 1 75 ILE MD . . 4.160 3.836 3.478 4.148 . 0 0 "[ . 1 . 2]" 1
376 1 25 ASN H 1 25 ASN HB2 . . 4.100 3.257 2.641 3.957 . 0 0 "[ . 1 . 2]" 1
377 1 25 ASN H 1 25 ASN QB . . 3.530 2.752 2.585 3.132 . 0 0 "[ . 1 . 2]" 1
378 1 25 ASN H 1 25 ASN HB3 . . 4.100 3.020 2.756 3.674 . 0 0 "[ . 1 . 2]" 1
379 1 25 ASN H 1 26 ALA H . . 4.650 4.180 4.074 4.362 . 0 0 "[ . 1 . 2]" 1
380 1 25 ASN H 1 34 PHE H . . 3.710 2.554 2.144 2.789 . 0 0 "[ . 1 . 2]" 1
381 1 25 ASN H 1 35 ILE HA . . 4.690 4.538 4.266 4.686 . 0 0 "[ . 1 . 2]" 1
382 1 25 ASN H 1 36 LYS H . . 4.820 4.725 4.407 4.821 0.001 7 0 "[ . 1 . 2]" 1
383 1 25 ASN H 1 68 TYR QE . . 4.680 3.705 3.298 4.210 . 0 0 "[ . 1 . 2]" 1
384 1 25 ASN HA 1 25 ASN QD . . 4.580 3.210 2.079 4.243 . 0 0 "[ . 1 . 2]" 1
385 1 25 ASN HA 1 26 ALA H . . 3.010 2.151 2.140 2.187 . 0 0 "[ . 1 . 2]" 1
386 1 25 ASN HA 1 26 ALA MB . . 4.440 3.947 3.902 3.987 . 0 0 "[ . 1 . 2]" 1
387 1 25 ASN HA 1 68 TYR QE . . 4.070 3.378 2.876 4.072 0.002 2 0 "[ . 1 . 2]" 1
388 1 25 ASN QB 1 26 ALA H . . 3.900 3.643 2.998 3.816 . 0 0 "[ . 1 . 2]" 1
389 1 25 ASN QB 1 36 LYS HB2 . . 4.390 3.032 2.644 3.626 . 0 0 "[ . 1 . 2]" 1
390 1 25 ASN QB 1 36 LYS HB3 . . 3.960 2.729 2.600 2.981 . 0 0 "[ . 1 . 2]" 1
391 1 25 ASN QB 1 36 LYS QD . . 4.990 3.303 2.219 4.670 . 0 0 "[ . 1 . 2]" 1
392 1 25 ASN QB 1 36 LYS QG . . 4.420 3.650 2.917 4.357 . 0 0 "[ . 1 . 2]" 1
393 1 25 ASN HB2 1 26 ALA H . . 4.560 4.179 3.086 4.463 . 0 0 "[ . 1 . 2]" 1
394 1 25 ASN HB2 1 36 LYS HB3 . . 4.600 3.034 2.647 4.473 . 0 0 "[ . 1 . 2]" 1
395 1 25 ASN HB3 1 26 ALA H . . 4.560 4.103 3.404 4.358 . 0 0 "[ . 1 . 2]" 1
396 1 25 ASN HB3 1 36 LYS HB3 . . 4.600 3.631 2.788 4.421 . 0 0 "[ . 1 . 2]" 1
397 1 25 ASN QD 1 26 ALA H . . 4.650 3.809 2.219 4.657 0.007 15 0 "[ . 1 . 2]" 1
398 1 26 ALA H 1 26 ALA MB . . 3.240 2.128 2.049 2.222 . 0 0 "[ . 1 . 2]" 1
399 1 26 ALA H 1 68 TYR QD . . 4.810 3.862 3.376 4.335 . 0 0 "[ . 1 . 2]" 1
400 1 26 ALA H 1 68 TYR QE . . 4.570 4.094 3.722 4.567 . 0 0 "[ . 1 . 2]" 1
401 1 26 ALA HA 1 27 ILE H . . 3.340 2.158 2.141 2.206 . 0 0 "[ . 1 . 2]" 1
402 1 26 ALA HA 1 27 ILE HB . . 4.830 4.725 4.470 4.832 0.002 17 0 "[ . 1 . 2]" 1
403 1 26 ALA HA 1 33 SER HA . . 4.660 3.575 3.108 3.959 . 0 0 "[ . 1 . 2]" 1
404 1 26 ALA HA 1 34 PHE QD . . 4.400 3.634 3.010 4.215 . 0 0 "[ . 1 . 2]" 1
405 1 26 ALA HA 1 34 PHE QE . . 4.710 3.966 3.140 4.597 . 0 0 "[ . 1 . 2]" 1
406 1 26 ALA HA 1 68 TYR QD . . 4.170 3.831 3.214 4.173 0.003 19 0 "[ . 1 . 2]" 1
407 1 26 ALA MB 1 27 ILE H . . 3.660 3.302 3.009 3.525 . 0 0 "[ . 1 . 2]" 1
408 1 26 ALA MB 1 27 ILE HA . . 4.590 4.202 3.863 4.393 . 0 0 "[ . 1 . 2]" 1
409 1 26 ALA MB 1 33 SER HA . . 5.150 4.682 4.123 5.116 . 0 0 "[ . 1 . 2]" 1
410 1 26 ALA MB 1 68 TYR HA . . 4.860 4.510 4.143 4.853 . 0 0 "[ . 1 . 2]" 1
411 1 26 ALA MB 1 68 TYR HB2 . . 3.890 2.500 2.067 2.889 . 0 0 "[ . 1 . 2]" 1
412 1 26 ALA MB 1 68 TYR HB3 . . 4.070 2.681 2.056 3.086 . 0 0 "[ . 1 . 2]" 1
413 1 26 ALA MB 1 68 TYR QD . . 3.550 3.233 2.458 3.459 . 0 0 "[ . 1 . 2]" 1
414 1 26 ALA MB 1 68 TYR QE . . 4.530 4.228 3.235 4.533 0.003 11 0 "[ . 1 . 2]" 1
415 1 27 ILE H 1 27 ILE HB . . 3.670 2.634 2.354 3.035 . 0 0 "[ . 1 . 2]" 1
416 1 27 ILE H 1 27 ILE MD . . 4.740 3.696 3.456 4.266 . 0 0 "[ . 1 . 2]" 1
417 1 27 ILE H 1 27 ILE HG12 . . 4.510 2.982 1.933 3.881 . 0 0 "[ . 1 . 2]" 1
418 1 27 ILE H 1 27 ILE QG . . 3.850 2.418 1.920 2.784 . 0 0 "[ . 1 . 2]" 1
419 1 27 ILE H 1 27 ILE HG13 . . 4.510 3.186 2.260 4.069 . 0 0 "[ . 1 . 2]" 1
420 1 27 ILE H 1 27 ILE MG . . 4.460 3.834 3.712 4.002 . 0 0 "[ . 1 . 2]" 1
421 1 27 ILE H 1 34 PHE QE . . 4.820 2.600 1.983 3.274 . 0 0 "[ . 1 . 2]" 1
422 1 27 ILE HA 1 27 ILE MD . . 4.220 2.902 1.974 3.924 . 0 0 "[ . 1 . 2]" 1
423 1 27 ILE HA 1 27 ILE HG12 . . 4.040 2.836 2.521 3.134 . 0 0 "[ . 1 . 2]" 1
424 1 27 ILE HA 1 27 ILE HG13 . . 4.040 3.479 2.967 3.861 . 0 0 "[ . 1 . 2]" 1
425 1 27 ILE HA 1 27 ILE MG . . 3.320 2.293 2.134 2.462 . 0 0 "[ . 1 . 2]" 1
426 1 27 ILE HA 1 28 ARG H . . 3.150 2.272 2.140 3.315 0.165 19 0 "[ . 1 . 2]" 1
427 1 27 ILE HA 1 28 ARG HB2 . . 5.500 4.573 4.216 5.614 0.114 17 0 "[ . 1 . 2]" 1
428 1 27 ILE HA 1 28 ARG QB . . 4.750 4.108 4.011 4.655 . 0 0 "[ . 1 . 2]" 1
429 1 27 ILE HA 1 28 ARG HB3 . . 5.500 4.944 4.143 5.576 0.076 4 0 "[ . 1 . 2]" 1
430 1 27 ILE HA 1 34 PHE QD . . 5.410 5.213 4.965 5.408 . 0 0 "[ . 1 . 2]" 1
431 1 27 ILE HB 1 27 ILE MD . . 3.520 2.835 2.196 3.231 . 0 0 "[ . 1 . 2]" 1
432 1 27 ILE HB 1 30 LEU H . . 4.180 3.622 3.132 4.117 . 0 0 "[ . 1 . 2]" 1
433 1 27 ILE HB 1 34 PHE QD . . 4.470 3.664 3.383 4.126 . 0 0 "[ . 1 . 2]" 1
434 1 27 ILE HB 1 34 PHE QE . . 4.240 2.546 2.008 3.150 . 0 0 "[ . 1 . 2]" 1
435 1 27 ILE MD 1 27 ILE MG . . 3.100 1.997 1.873 2.295 . 0 0 "[ . 1 . 2]" 1
436 1 27 ILE MD 1 34 PHE HB2 . . 4.670 3.187 2.015 4.304 . 0 0 "[ . 1 . 2]" 1
437 1 27 ILE MD 1 34 PHE QD . . 4.490 3.370 2.478 4.330 . 0 0 "[ . 1 . 2]" 1
438 1 27 ILE MD 1 34 PHE QE . . 4.530 3.846 2.698 4.531 0.001 2 0 "[ . 1 . 2]" 1
439 1 27 ILE QG 1 34 PHE QE . . 4.570 3.113 2.838 3.524 . 0 0 "[ . 1 . 2]" 1
440 1 27 ILE HG12 1 34 PHE QD . . 4.240 3.348 2.378 4.241 0.001 7 0 "[ . 1 . 2]" 1
441 1 27 ILE HG13 1 34 PHE QD . . 4.240 2.918 2.454 3.618 . 0 0 "[ . 1 . 2]" 1
442 1 27 ILE MG 1 28 ARG H . . 3.740 2.780 1.882 3.795 0.055 19 0 "[ . 1 . 2]" 1
443 1 27 ILE MG 1 30 LEU H . . 3.960 3.304 2.118 3.960 . 0 0 "[ . 1 . 2]" 1
444 1 28 ARG H 1 28 ARG HB2 . . 4.050 2.646 2.210 3.749 . 0 0 "[ . 1 . 2]" 1
445 1 28 ARG H 1 28 ARG QB . . 3.430 2.359 2.178 2.853 . 0 0 "[ . 1 . 2]" 1
446 1 28 ARG H 1 28 ARG HB3 . . 4.050 3.020 2.310 3.734 . 0 0 "[ . 1 . 2]" 1
447 1 28 ARG H 1 28 ARG QG . . 4.530 3.315 2.069 4.079 . 0 0 "[ . 1 . 2]" 1
448 1 28 ARG HA 1 28 ARG HD2 . . 5.460 3.739 2.090 5.468 0.008 20 0 "[ . 1 . 2]" 1
449 1 28 ARG HA 1 28 ARG QD . . 4.680 3.282 1.979 4.406 . 0 0 "[ . 1 . 2]" 1
450 1 28 ARG HA 1 28 ARG HD3 . . 5.460 3.912 2.447 4.820 . 0 0 "[ . 1 . 2]" 1
451 1 28 ARG HA 1 28 ARG QG . . 3.670 2.588 2.220 3.329 . 0 0 "[ . 1 . 2]" 1
452 1 28 ARG HA 1 30 LEU H . . 4.470 4.283 4.035 4.467 . 0 0 "[ . 1 . 2]" 1
453 1 28 ARG HB2 1 29 GLY H . . 5.370 4.393 3.808 4.617 . 0 0 "[ . 1 . 2]" 1
454 1 28 ARG HB3 1 29 GLY H . . 5.370 3.904 2.541 4.604 . 0 0 "[ . 1 . 2]" 1
455 1 29 GLY H 1 30 LEU H . . 3.790 2.714 1.802 3.432 . 0 0 "[ . 1 . 2]" 1
456 1 30 LEU H 1 30 LEU HB2 . . 3.220 2.503 2.251 2.736 . 0 0 "[ . 1 . 2]" 1
457 1 30 LEU H 1 30 LEU MD1 . . 4.680 4.029 3.662 4.435 . 0 0 "[ . 1 . 2]" 1
458 1 30 LEU H 1 30 LEU MD2 . . 4.450 3.896 2.500 4.328 . 0 0 "[ . 1 . 2]" 1
459 1 30 LEU H 1 30 LEU HG . . 4.200 3.369 2.948 4.137 . 0 0 "[ . 1 . 2]" 1
460 1 30 LEU HA 1 30 LEU MD1 . . 4.190 3.681 2.520 3.900 . 0 0 "[ . 1 . 2]" 1
461 1 30 LEU HA 1 30 LEU MD2 . . 3.130 2.124 1.988 2.364 . 0 0 "[ . 1 . 2]" 1
462 1 30 LEU HA 1 30 LEU HG . . 4.250 2.988 2.649 3.716 . 0 0 "[ . 1 . 2]" 1
463 1 30 LEU HA 1 31 PRO HD2 . . 3.240 2.323 2.247 2.419 . 0 0 "[ . 1 . 2]" 1
464 1 30 LEU HA 1 31 PRO HD3 . . 3.130 2.278 2.259 2.307 . 0 0 "[ . 1 . 2]" 1
465 1 30 LEU HA 1 31 PRO HG2 . . 4.760 4.450 4.389 4.528 . 0 0 "[ . 1 . 2]" 1
466 1 30 LEU HA 1 31 PRO QG . . 4.190 3.955 3.910 4.014 . 0 0 "[ . 1 . 2]" 1
467 1 30 LEU HA 1 31 PRO HG3 . . 4.760 4.430 4.389 4.484 . 0 0 "[ . 1 . 2]" 1
468 1 30 LEU HB2 1 30 LEU MD1 . . 3.260 2.362 2.079 3.122 . 0 0 "[ . 1 . 2]" 1
469 1 30 LEU HB2 1 31 PRO HD2 . . 3.990 3.800 3.599 3.985 . 0 0 "[ . 1 . 2]" 1
470 1 30 LEU HB2 1 31 PRO HD3 . . 5.160 4.802 4.675 4.913 . 0 0 "[ . 1 . 2]" 1
471 1 30 LEU HB3 1 30 LEU MD1 . . 3.190 2.408 1.995 2.586 . 0 0 "[ . 1 . 2]" 1
472 1 30 LEU HB3 1 30 LEU MD2 . . 3.270 2.405 2.133 3.160 . 0 0 "[ . 1 . 2]" 1
473 1 30 LEU HB3 1 31 PRO HD2 . . 3.570 2.262 2.004 2.561 . 0 0 "[ . 1 . 2]" 1
474 1 30 LEU HB3 1 31 PRO HD3 . . 3.900 3.664 3.449 3.901 0.001 15 0 "[ . 1 . 2]" 1
475 1 30 LEU MD1 1 31 PRO HD2 . . 4.180 3.706 1.960 4.164 . 0 0 "[ . 1 . 2]" 1
476 1 30 LEU MD1 1 34 PHE QE . . 4.740 3.118 2.350 4.348 . 0 0 "[ . 1 . 2]" 1
477 1 30 LEU MD1 1 34 PHE HZ . . 4.450 3.380 2.375 4.330 . 0 0 "[ . 1 . 2]" 1
478 1 30 LEU MD2 1 31 PRO HD2 . . 3.540 2.332 1.949 3.537 . 0 0 "[ . 1 . 2]" 1
479 1 30 LEU MD2 1 31 PRO HD3 . . 3.770 3.064 2.704 3.756 . 0 0 "[ . 1 . 2]" 1
480 1 30 LEU HG 1 31 PRO HD2 . . 4.430 4.232 3.894 4.427 . 0 0 "[ . 1 . 2]" 1
481 1 30 LEU HG 1 31 PRO HD3 . . 5.500 5.012 4.623 5.514 0.014 2 0 "[ . 1 . 2]" 1
482 1 30 LEU HG 1 34 PHE HZ . . 4.610 4.369 3.618 4.599 . 0 0 "[ . 1 . 2]" 1
483 1 31 PRO HA 1 32 GLY H . . 2.960 2.416 2.178 2.624 . 0 0 "[ . 1 . 2]" 1
484 1 31 PRO QB 1 32 GLY H . . 3.380 2.548 2.086 3.182 . 0 0 "[ . 1 . 2]" 1
485 1 31 PRO QB 1 64 LEU MD2 . . 4.650 3.565 2.751 4.431 . 0 0 "[ . 1 . 2]" 1
486 1 31 PRO HB2 1 32 GLY H . . 3.900 2.631 2.113 3.375 . 0 0 "[ . 1 . 2]" 1
487 1 31 PRO HB3 1 32 GLY H . . 3.900 3.480 3.227 3.897 . 0 0 "[ . 1 . 2]" 1
488 1 32 GLY H 1 33 SER H . . 4.800 4.494 4.029 4.646 . 0 0 "[ . 1 . 2]" 1
489 1 32 GLY H 1 64 LEU MD2 . . 5.060 4.366 3.539 5.014 . 0 0 "[ . 1 . 2]" 1
490 1 32 GLY H 1 71 VAL MG1 . . 5.500 4.923 4.171 5.423 . 0 0 "[ . 1 . 2]" 1
491 1 32 GLY QA 1 68 TYR HA . . 5.230 5.113 4.746 5.235 0.005 9 0 "[ . 1 . 2]" 1
492 1 32 GLY QA 1 71 VAL MG1 . . 4.080 3.223 2.711 3.557 . 0 0 "[ . 1 . 2]" 1
493 1 32 GLY QA 1 71 VAL MG2 . . 4.220 3.997 3.639 4.217 . 0 0 "[ . 1 . 2]" 1
494 1 32 GLY HA2 1 33 SER H . . 3.420 2.598 2.186 3.003 . 0 0 "[ . 1 . 2]" 1
495 1 32 GLY HA2 1 64 LEU MD2 . . 4.460 3.868 3.210 4.351 . 0 0 "[ . 1 . 2]" 1
496 1 32 GLY HA3 1 33 SER H . . 3.420 2.560 2.214 3.060 . 0 0 "[ . 1 . 2]" 1
497 1 32 GLY HA3 1 64 LEU MD2 . . 4.460 2.947 2.211 3.365 . 0 0 "[ . 1 . 2]" 1
498 1 33 SER H 1 33 SER HB2 . . 3.950 2.952 2.204 3.863 . 0 0 "[ . 1 . 2]" 1
499 1 33 SER H 1 33 SER HB3 . . 3.950 3.285 2.638 3.727 . 0 0 "[ . 1 . 2]" 1
500 1 33 SER H 1 71 VAL MG2 . . 4.200 3.675 2.804 4.205 0.005 16 0 "[ . 1 . 2]" 1
501 1 33 SER HA 1 34 PHE H . . 3.450 2.527 2.315 2.651 . 0 0 "[ . 1 . 2]" 1
502 1 33 SER HA 1 34 PHE QD . . 4.330 2.636 2.338 2.962 . 0 0 "[ . 1 . 2]" 1
503 1 33 SER HA 1 68 TYR QD . . 4.460 4.020 3.457 4.439 . 0 0 "[ . 1 . 2]" 1
504 1 33 SER QB 1 34 PHE H . . 3.550 2.291 1.924 3.078 . 0 0 "[ . 1 . 2]" 1
505 1 33 SER QB 1 55 ILE HB . . 4.130 3.384 2.792 3.980 . 0 0 "[ . 1 . 2]" 1
506 1 33 SER QB 1 68 TYR QD . . 3.790 3.046 2.391 3.611 . 0 0 "[ . 1 . 2]" 1
507 1 33 SER QB 1 71 VAL MG1 . . 4.230 3.598 3.197 3.920 . 0 0 "[ . 1 . 2]" 1
508 1 33 SER HB2 1 34 PHE H . . 4.120 3.109 1.969 3.925 . 0 0 "[ . 1 . 2]" 1
509 1 33 SER HB2 1 55 ILE MD . . 4.190 3.034 2.331 4.175 . 0 0 "[ . 1 . 2]" 1
510 1 33 SER HB2 1 68 TYR QD . . 4.330 3.715 2.898 4.333 0.003 9 0 "[ . 1 . 2]" 1
511 1 33 SER HB2 1 71 VAL MG2 . . 3.930 2.851 2.005 3.485 . 0 0 "[ . 1 . 2]" 1
512 1 33 SER HB3 1 34 PHE H . . 4.120 2.822 1.934 3.863 . 0 0 "[ . 1 . 2]" 1
513 1 33 SER HB3 1 55 ILE MD . . 4.190 3.261 2.078 4.194 0.004 10 0 "[ . 1 . 2]" 1
514 1 33 SER HB3 1 68 TYR QD . . 4.330 3.336 2.455 4.321 . 0 0 "[ . 1 . 2]" 1
515 1 33 SER HB3 1 71 VAL MG2 . . 3.930 2.931 1.924 3.868 . 0 0 "[ . 1 . 2]" 1
516 1 33 SER HG 1 34 PHE H . . 4.660 3.752 2.417 4.587 . 0 0 "[ . 1 . 2]" 1
517 1 33 SER HG 1 55 ILE MD . . 5.150 3.615 1.918 5.116 . 0 0 "[ . 1 . 2]" 1
518 1 34 PHE H 1 34 PHE HB2 . . 3.560 2.897 2.618 3.099 . 0 0 "[ . 1 . 2]" 1
519 1 34 PHE H 1 34 PHE QD . . 3.650 2.389 1.972 2.823 . 0 0 "[ . 1 . 2]" 1
520 1 34 PHE H 1 35 ILE H . . 4.690 4.391 4.304 4.469 . 0 0 "[ . 1 . 2]" 1
521 1 34 PHE H 1 55 ILE H . . 4.820 4.816 4.789 4.829 0.009 14 0 "[ . 1 . 2]" 1
522 1 34 PHE H 1 55 ILE MD . . 4.920 3.835 3.451 4.154 . 0 0 "[ . 1 . 2]" 1
523 1 34 PHE HA 1 34 PHE QD . . 4.360 3.224 3.146 3.292 . 0 0 "[ . 1 . 2]" 1
524 1 34 PHE HA 1 35 ILE H . . 3.210 2.270 2.210 2.494 . 0 0 "[ . 1 . 2]" 1
525 1 34 PHE HA 1 35 ILE QG . . 4.620 3.660 3.534 3.844 . 0 0 "[ . 1 . 2]" 1
526 1 34 PHE HA 1 54 VAL HA . . 3.630 2.196 2.045 2.363 . 0 0 "[ . 1 . 2]" 1
527 1 34 PHE HA 1 54 VAL HB . . 4.720 3.729 3.346 4.242 . 0 0 "[ . 1 . 2]" 1
528 1 34 PHE HA 1 54 VAL MG1 . . 4.120 2.903 2.080 3.416 . 0 0 "[ . 1 . 2]" 1
529 1 34 PHE HA 1 55 ILE H . . 4.070 3.284 3.029 3.465 . 0 0 "[ . 1 . 2]" 1
530 1 34 PHE HA 1 55 ILE MD . . 4.690 3.525 2.735 4.108 . 0 0 "[ . 1 . 2]" 1
531 1 34 PHE HB3 1 35 ILE H . . 3.570 2.838 2.385 3.016 . 0 0 "[ . 1 . 2]" 1
532 1 34 PHE HB3 1 35 ILE HB . . 4.960 4.912 4.641 4.964 0.004 19 0 "[ . 1 . 2]" 1
533 1 34 PHE HB3 1 52 GLU HA . . 4.290 4.172 3.854 4.291 0.001 17 0 "[ . 1 . 2]" 1
534 1 34 PHE HB3 1 54 VAL HA . . 4.150 3.949 3.692 4.172 0.022 13 0 "[ . 1 . 2]" 1
535 1 34 PHE HB3 1 54 VAL HB . . 5.400 5.127 4.790 5.388 . 0 0 "[ . 1 . 2]" 1
536 1 34 PHE HB3 1 54 VAL MG1 . . 3.670 3.110 2.682 3.495 . 0 0 "[ . 1 . 2]" 1
537 1 34 PHE QD 1 35 ILE H . . 4.520 4.355 4.149 4.482 . 0 0 "[ . 1 . 2]" 1
538 1 34 PHE QD 1 52 GLU HA . . 4.680 4.455 3.742 4.679 . 0 0 "[ . 1 . 2]" 1
539 1 34 PHE QD 1 54 VAL HA . . 4.510 3.980 3.638 4.291 . 0 0 "[ . 1 . 2]" 1
540 1 34 PHE QD 1 54 VAL HB . . 4.460 4.081 3.838 4.343 . 0 0 "[ . 1 . 2]" 1
541 1 34 PHE QD 1 54 VAL MG1 . . 3.980 1.961 1.804 2.426 . 0 0 "[ . 1 . 2]" 1
542 1 34 PHE QE 1 54 VAL HB . . 4.500 4.402 3.980 4.514 0.014 8 0 "[ . 1 . 2]" 1
543 1 34 PHE QE 1 54 VAL MG1 . . 4.170 2.496 2.175 2.710 . 0 0 "[ . 1 . 2]" 1
544 1 35 ILE H 1 35 ILE HB . . 3.340 2.450 2.384 2.532 . 0 0 "[ . 1 . 2]" 1
545 1 35 ILE H 1 35 ILE MD . . 4.130 3.718 3.532 3.892 . 0 0 "[ . 1 . 2]" 1
546 1 35 ILE H 1 35 ILE HG12 . . 3.880 3.622 3.403 3.882 0.002 17 0 "[ . 1 . 2]" 1
547 1 35 ILE H 1 35 ILE QG . . 3.360 2.381 2.217 2.668 . 0 0 "[ . 1 . 2]" 1
548 1 35 ILE H 1 35 ILE HG13 . . 3.880 2.415 2.241 2.718 . 0 0 "[ . 1 . 2]" 1
549 1 35 ILE H 1 35 ILE MG . . 4.130 3.756 3.726 3.786 . 0 0 "[ . 1 . 2]" 1
550 1 35 ILE H 1 53 ASP H . . 4.650 4.243 3.162 4.638 . 0 0 "[ . 1 . 2]" 1
551 1 35 ILE H 1 53 ASP HB2 . . 4.750 4.204 3.757 4.569 . 0 0 "[ . 1 . 2]" 1
552 1 35 ILE H 1 54 VAL HA . . 4.270 3.198 2.873 3.919 . 0 0 "[ . 1 . 2]" 1
553 1 35 ILE H 1 55 ILE H . . 4.910 4.573 4.288 4.812 . 0 0 "[ . 1 . 2]" 1
554 1 35 ILE H 1 55 ILE MD . . 4.470 3.832 3.247 4.473 0.003 16 0 "[ . 1 . 2]" 1
555 1 35 ILE H 1 86 VAL MG1 . . 5.500 5.151 4.780 5.401 . 0 0 "[ . 1 . 2]" 1
556 1 35 ILE HA 1 35 ILE MD . . 3.920 3.802 3.722 3.840 . 0 0 "[ . 1 . 2]" 1
557 1 35 ILE HA 1 35 ILE HG12 . . 4.090 2.484 2.348 2.577 . 0 0 "[ . 1 . 2]" 1
558 1 35 ILE HA 1 35 ILE HG13 . . 4.090 2.969 2.812 3.159 . 0 0 "[ . 1 . 2]" 1
559 1 35 ILE HA 1 35 ILE MG . . 3.490 2.425 2.282 2.487 . 0 0 "[ . 1 . 2]" 1
560 1 35 ILE HA 1 36 LYS H . . 2.920 2.149 2.138 2.160 . 0 0 "[ . 1 . 2]" 1
561 1 35 ILE HA 1 36 LYS HB3 . . 4.820 4.662 4.509 4.823 0.003 16 0 "[ . 1 . 2]" 1
562 1 35 ILE HB 1 35 ILE MD . . 3.490 2.413 2.323 2.501 . 0 0 "[ . 1 . 2]" 1
563 1 35 ILE HB 1 36 LYS H . . 4.490 4.230 4.149 4.346 . 0 0 "[ . 1 . 2]" 1
564 1 35 ILE HB 1 51 ASP HA . . 4.190 3.275 2.921 3.624 . 0 0 "[ . 1 . 2]" 1
565 1 35 ILE HB 1 52 GLU H . . 4.070 3.971 3.541 4.075 0.005 15 0 "[ . 1 . 2]" 1
566 1 35 ILE HB 1 53 ASP H . . 3.630 3.321 2.554 3.626 . 0 0 "[ . 1 . 2]" 1
567 1 35 ILE HB 1 53 ASP HB2 . . 3.880 2.900 2.489 3.401 . 0 0 "[ . 1 . 2]" 1
568 1 35 ILE HB 1 55 ILE MD . . 5.500 4.675 4.151 5.396 . 0 0 "[ . 1 . 2]" 1
569 1 35 ILE MD 1 35 ILE MG . . 2.950 1.994 1.915 2.159 . 0 0 "[ . 1 . 2]" 1
570 1 35 ILE MD 1 36 LYS H . . 5.160 5.055 4.935 5.161 0.001 17 0 "[ . 1 . 2]" 1
571 1 35 ILE MD 1 38 VAL MG1 . . 4.760 4.574 4.353 4.754 . 0 0 "[ . 1 . 2]" 1
572 1 35 ILE MD 1 44 ALA MB . . 3.910 3.557 3.231 3.828 . 0 0 "[ . 1 . 2]" 1
573 1 35 ILE MD 1 49 LEU HA . . 4.680 3.721 3.312 4.091 . 0 0 "[ . 1 . 2]" 1
574 1 35 ILE MD 1 49 LEU HB2 . . 4.100 3.396 3.020 3.699 . 0 0 "[ . 1 . 2]" 1
575 1 35 ILE MD 1 49 LEU HB3 . . 3.580 2.128 1.849 2.451 . 0 0 "[ . 1 . 2]" 1
576 1 35 ILE MD 1 49 LEU MD1 . . 3.390 2.165 1.923 2.570 . 0 0 "[ . 1 . 2]" 1
577 1 35 ILE MD 1 49 LEU MD2 . . 3.140 2.016 1.820 2.432 . 0 0 "[ . 1 . 2]" 1
578 1 35 ILE MD 1 49 LEU HG . . 4.300 3.926 3.758 4.180 . 0 0 "[ . 1 . 2]" 1
579 1 35 ILE MD 1 50 GLU H . . 4.550 3.383 2.757 3.894 . 0 0 "[ . 1 . 2]" 1
580 1 35 ILE MD 1 53 ASP H . . 4.200 3.860 3.639 4.084 . 0 0 "[ . 1 . 2]" 1
581 1 35 ILE MD 1 53 ASP HB2 . . 3.610 2.066 1.970 2.222 . 0 0 "[ . 1 . 2]" 1
582 1 35 ILE MD 1 53 ASP HB3 . . 3.930 2.521 2.009 3.183 . 0 0 "[ . 1 . 2]" 1
583 1 35 ILE MD 1 55 ILE MD . . 3.880 3.347 2.756 3.884 0.004 16 0 "[ . 1 . 2]" 1
584 1 35 ILE MD 1 55 ILE QG . . 3.390 3.343 3.151 3.393 0.003 17 0 "[ . 1 . 2]" 1
585 1 35 ILE MD 1 86 VAL MG1 . . 3.600 2.513 2.187 2.767 . 0 0 "[ . 1 . 2]" 1
586 1 35 ILE MD 1 86 VAL MG2 . . 4.420 3.942 3.558 4.274 . 0 0 "[ . 1 . 2]" 1
587 1 35 ILE QG 1 53 ASP HB2 . . 4.640 3.462 2.976 3.784 . 0 0 "[ . 1 . 2]" 1
588 1 35 ILE QG 1 55 ILE MD . . 3.470 2.355 1.846 3.002 . 0 0 "[ . 1 . 2]" 1
589 1 35 ILE HG12 1 35 ILE MG . . 3.620 2.356 2.249 2.510 . 0 0 "[ . 1 . 2]" 1
590 1 35 ILE HG12 1 55 ILE MD . . 3.950 2.733 2.102 3.364 . 0 0 "[ . 1 . 2]" 1
591 1 35 ILE HG13 1 35 ILE MG . . 3.620 3.191 3.182 3.202 . 0 0 "[ . 1 . 2]" 1
592 1 35 ILE HG13 1 55 ILE MD . . 3.950 2.636 2.013 3.612 . 0 0 "[ . 1 . 2]" 1
593 1 35 ILE MG 1 36 LYS H . . 3.490 2.485 2.297 2.666 . 0 0 "[ . 1 . 2]" 1
594 1 35 ILE MG 1 36 LYS HA . . 4.290 3.318 3.159 3.565 . 0 0 "[ . 1 . 2]" 1
595 1 35 ILE MG 1 37 GLU H . . 4.730 4.636 4.499 4.726 . 0 0 "[ . 1 . 2]" 1
596 1 35 ILE MG 1 49 LEU HB3 . . 3.840 2.959 2.748 3.250 . 0 0 "[ . 1 . 2]" 1
597 1 35 ILE MG 1 50 GLU H . . 4.230 3.996 3.341 4.228 . 0 0 "[ . 1 . 2]" 1
598 1 35 ILE MG 1 51 ASP HA . . 3.700 2.730 2.025 3.260 . 0 0 "[ . 1 . 2]" 1
599 1 35 ILE MG 1 52 GLU H . . 4.600 4.396 4.211 4.599 . 0 0 "[ . 1 . 2]" 1
600 1 35 ILE MG 1 53 ASP HB2 . . 4.210 3.766 3.360 4.116 . 0 0 "[ . 1 . 2]" 1
601 1 36 LYS H 1 36 LYS HB2 . . 3.740 3.230 3.111 3.317 . 0 0 "[ . 1 . 2]" 1
602 1 36 LYS H 1 36 LYS HB3 . . 3.660 2.915 2.764 3.033 . 0 0 "[ . 1 . 2]" 1
603 1 36 LYS H 1 36 LYS HG2 . . 5.070 4.775 4.514 5.064 . 0 0 "[ . 1 . 2]" 1
604 1 36 LYS H 1 36 LYS QG . . 4.360 4.182 4.092 4.237 . 0 0 "[ . 1 . 2]" 1
605 1 36 LYS H 1 36 LYS HG3 . . 5.070 4.662 4.391 4.933 . 0 0 "[ . 1 . 2]" 1
606 1 36 LYS H 1 37 GLU H . . 4.560 4.382 4.365 4.408 . 0 0 "[ . 1 . 2]" 1
607 1 36 LYS H 1 38 VAL MG1 . . 4.950 4.676 4.457 4.885 . 0 0 "[ . 1 . 2]" 1
608 1 36 LYS HA 1 37 GLU H . . 3.470 2.307 2.256 2.359 . 0 0 "[ . 1 . 2]" 1
609 1 36 LYS HA 1 38 VAL H . . 4.850 3.654 3.233 3.908 . 0 0 "[ . 1 . 2]" 1
610 1 36 LYS HB2 1 36 LYS QE . . 4.350 3.095 1.984 4.170 . 0 0 "[ . 1 . 2]" 1
611 1 36 LYS HB2 1 37 GLU H . . 4.030 3.988 3.922 4.041 0.011 12 0 "[ . 1 . 2]" 1
612 1 36 LYS HB2 1 37 GLU QG . . 4.290 4.155 3.941 4.284 . 0 0 "[ . 1 . 2]" 1
613 1 36 LYS HB3 1 36 LYS QE . . 4.730 3.610 2.336 4.436 . 0 0 "[ . 1 . 2]" 1
614 1 36 LYS HB3 1 37 GLU H . . 4.020 3.707 3.467 3.933 . 0 0 "[ . 1 . 2]" 1
615 1 36 LYS HB3 1 37 GLU QG . . 4.050 2.880 2.569 3.209 . 0 0 "[ . 1 . 2]" 1
616 1 36 LYS QD 1 37 GLU H . . 4.320 3.562 2.465 4.254 . 0 0 "[ . 1 . 2]" 1
617 1 36 LYS QD 1 37 GLU QG . . 4.470 3.343 2.106 4.019 . 0 0 "[ . 1 . 2]" 1
618 1 36 LYS HD2 1 37 GLU H . . 4.920 4.081 2.490 4.911 . 0 0 "[ . 1 . 2]" 1
619 1 36 LYS HD3 1 37 GLU H . . 4.920 4.079 2.776 4.854 . 0 0 "[ . 1 . 2]" 1
620 1 36 LYS QE 1 37 GLU QG . . 5.180 3.759 2.163 4.777 . 0 0 "[ . 1 . 2]" 1
621 1 36 LYS QG 1 37 GLU H . . 4.090 2.018 1.886 2.178 . 0 0 "[ . 1 . 2]" 1
622 1 36 LYS QG 1 37 GLU HB2 . . 4.730 3.925 3.515 4.318 . 0 0 "[ . 1 . 2]" 1
623 1 36 LYS QG 1 37 GLU HB3 . . 5.190 4.408 4.148 4.719 . 0 0 "[ . 1 . 2]" 1
624 1 36 LYS QG 1 37 GLU QG . . 3.870 2.039 1.874 2.395 . 0 0 "[ . 1 . 2]" 1
625 1 36 LYS HG2 1 37 GLU H . . 4.690 2.852 1.898 3.836 . 0 0 "[ . 1 . 2]" 1
626 1 36 LYS HG3 1 37 GLU H . . 4.690 2.423 1.921 3.255 . 0 0 "[ . 1 . 2]" 1
627 1 37 GLU H 1 37 GLU HG2 . . 4.420 3.217 2.545 3.795 . 0 0 "[ . 1 . 2]" 1
628 1 37 GLU H 1 37 GLU QG . . 3.600 2.771 2.523 2.844 . 0 0 "[ . 1 . 2]" 1
629 1 37 GLU H 1 37 GLU HG3 . . 4.420 3.133 2.708 4.145 . 0 0 "[ . 1 . 2]" 1
630 1 37 GLU H 1 38 VAL H . . 3.600 2.663 2.526 2.748 . 0 0 "[ . 1 . 2]" 1
631 1 37 GLU H 1 38 VAL MG1 . . 4.420 3.632 3.490 3.845 . 0 0 "[ . 1 . 2]" 1
632 1 37 GLU HA 1 37 GLU HG2 . . 3.860 2.623 2.486 2.979 . 0 0 "[ . 1 . 2]" 1
633 1 37 GLU HA 1 37 GLU QG . . 3.320 2.526 2.422 2.855 . 0 0 "[ . 1 . 2]" 1
634 1 37 GLU HA 1 37 GLU HG3 . . 3.860 3.345 2.996 3.903 0.043 16 0 "[ . 1 . 2]" 1
635 1 37 GLU HA 1 38 VAL H . . 3.110 2.760 2.648 2.984 . 0 0 "[ . 1 . 2]" 1
636 1 37 GLU QG 1 38 VAL H . . 4.770 4.471 4.341 4.517 . 0 0 "[ . 1 . 2]" 1
637 1 37 GLU HG2 1 38 VAL H . . 5.500 5.017 4.525 5.441 . 0 0 "[ . 1 . 2]" 1
638 1 37 GLU HG3 1 38 VAL H . . 5.500 5.055 4.644 5.582 0.082 16 0 "[ . 1 . 2]" 1
639 1 38 VAL H 1 38 VAL HB . . 3.050 2.981 2.717 3.051 0.001 19 0 "[ . 1 . 2]" 1
640 1 38 VAL H 1 38 VAL MG1 . . 3.150 1.891 1.830 2.008 . 0 0 "[ . 1 . 2]" 1
641 1 38 VAL H 1 38 VAL MG2 . . 4.140 3.736 3.699 3.782 . 0 0 "[ . 1 . 2]" 1
642 1 38 VAL H 1 39 GLN H . . 4.920 4.373 4.275 4.522 . 0 0 "[ . 1 . 2]" 1
643 1 38 VAL HA 1 38 VAL MG1 . . 3.290 3.179 3.168 3.199 . 0 0 "[ . 1 . 2]" 1
644 1 38 VAL HA 1 38 VAL MG2 . . 3.390 2.480 2.440 2.539 . 0 0 "[ . 1 . 2]" 1
645 1 38 VAL HA 1 39 GLN H . . 2.950 2.148 2.141 2.168 . 0 0 "[ . 1 . 2]" 1
646 1 38 VAL HA 1 39 GLN HA . . 4.730 4.403 4.368 4.438 . 0 0 "[ . 1 . 2]" 1
647 1 38 VAL HA 1 44 ALA MB . . 4.160 3.893 3.583 4.147 . 0 0 "[ . 1 . 2]" 1
648 1 38 VAL MG1 1 39 GLN H . . 4.360 4.213 4.109 4.281 . 0 0 "[ . 1 . 2]" 1
649 1 38 VAL MG1 1 39 GLN HA . . 4.980 4.560 4.340 4.704 . 0 0 "[ . 1 . 2]" 1
650 1 38 VAL MG1 1 44 ALA MB . . 4.130 3.961 3.762 4.105 . 0 0 "[ . 1 . 2]" 1
651 1 38 VAL MG1 1 45 ASP HA . . 4.900 4.755 4.523 4.893 . 0 0 "[ . 1 . 2]" 1
652 1 38 VAL MG1 1 49 LEU HB3 . . 4.830 4.605 4.324 4.831 0.001 15 0 "[ . 1 . 2]" 1
653 1 38 VAL MG1 1 50 GLU HA . . 3.670 2.922 2.510 3.387 . 0 0 "[ . 1 . 2]" 1
654 1 38 VAL MG1 1 51 ASP H . . 3.830 3.309 2.811 3.664 . 0 0 "[ . 1 . 2]" 1
655 1 38 VAL MG1 1 51 ASP HA . . 3.680 2.884 2.214 3.433 . 0 0 "[ . 1 . 2]" 1
656 1 38 VAL MG1 1 51 ASP QB . . 4.480 2.937 2.170 3.745 . 0 0 "[ . 1 . 2]" 1
657 1 38 VAL MG2 1 39 GLN H . . 3.740 2.845 2.416 3.058 . 0 0 "[ . 1 . 2]" 1
658 1 38 VAL MG2 1 41 GLY H . . 4.860 4.739 4.651 4.861 0.001 17 0 "[ . 1 . 2]" 1
659 1 38 VAL MG2 1 44 ALA H . . 4.670 4.034 3.765 4.327 . 0 0 "[ . 1 . 2]" 1
660 1 38 VAL MG2 1 44 ALA MB . . 3.170 1.942 1.825 2.154 . 0 0 "[ . 1 . 2]" 1
661 1 38 VAL MG2 1 45 ASP H . . 3.730 2.902 2.695 3.150 . 0 0 "[ . 1 . 2]" 1
662 1 38 VAL MG2 1 45 ASP HA . . 3.380 3.229 2.933 3.380 . 0 0 "[ . 1 . 2]" 1
663 1 38 VAL MG2 1 45 ASP HB2 . . 3.230 2.764 2.599 2.989 . 0 0 "[ . 1 . 2]" 1
664 1 38 VAL MG2 1 49 LEU H . . 4.610 4.438 4.145 4.607 . 0 0 "[ . 1 . 2]" 1
665 1 38 VAL MG2 1 49 LEU HB2 . . 4.710 3.388 3.039 3.730 . 0 0 "[ . 1 . 2]" 1
666 1 39 GLN H 1 39 GLN QB . . 3.150 2.241 2.140 2.319 . 0 0 "[ . 1 . 2]" 1
667 1 39 GLN H 1 39 GLN HG2 . . 4.560 3.927 2.516 4.566 0.006 13 0 "[ . 1 . 2]" 1
668 1 39 GLN H 1 39 GLN HG3 . . 4.560 4.058 2.640 4.567 0.007 10 0 "[ . 1 . 2]" 1
669 1 39 GLN H 1 44 ALA MB . . 4.620 4.416 4.081 4.624 0.004 9 0 "[ . 1 . 2]" 1
670 1 39 GLN HA 1 39 GLN HG2 . . 4.250 3.008 2.274 3.880 . 0 0 "[ . 1 . 2]" 1
671 1 39 GLN HA 1 39 GLN QG . . 3.700 2.547 2.233 2.886 . 0 0 "[ . 1 . 2]" 1
672 1 39 GLN HA 1 39 GLN HG3 . . 4.250 3.051 2.340 3.726 . 0 0 "[ . 1 . 2]" 1
673 1 39 GLN HA 1 40 LYS H . . 3.290 2.243 2.157 2.495 . 0 0 "[ . 1 . 2]" 1
674 1 39 GLN HA 1 40 LYS HA . . 5.050 4.348 4.330 4.451 . 0 0 "[ . 1 . 2]" 1
675 1 39 GLN HA 1 40 LYS QB . . 4.340 4.059 4.010 4.115 . 0 0 "[ . 1 . 2]" 1
676 1 39 GLN HB2 1 40 LYS H . . 5.270 4.104 3.704 4.490 . 0 0 "[ . 1 . 2]" 1
677 1 39 GLN HB3 1 40 LYS H . . 5.270 3.505 2.266 4.240 . 0 0 "[ . 1 . 2]" 1
678 1 40 LYS H 1 40 LYS HB2 . . 3.790 2.564 2.245 3.022 . 0 0 "[ . 1 . 2]" 1
679 1 40 LYS H 1 40 LYS HB3 . . 3.790 2.630 2.390 3.531 . 0 0 "[ . 1 . 2]" 1
680 1 40 LYS H 1 40 LYS HG2 . . 5.500 4.484 3.759 4.694 . 0 0 "[ . 1 . 2]" 1
681 1 40 LYS H 1 40 LYS QG . . 4.730 3.970 3.459 4.090 . 0 0 "[ . 1 . 2]" 1
682 1 40 LYS H 1 40 LYS HG3 . . 5.500 4.447 4.041 4.680 . 0 0 "[ . 1 . 2]" 1
683 1 40 LYS HA 1 40 LYS HD2 . . 4.240 3.200 2.280 4.021 . 0 0 "[ . 1 . 2]" 1
684 1 40 LYS HA 1 40 LYS QD . . 3.590 2.622 2.181 3.236 . 0 0 "[ . 1 . 2]" 1
685 1 40 LYS HA 1 40 LYS HD3 . . 4.240 3.081 2.207 4.153 . 0 0 "[ . 1 . 2]" 1
686 1 40 LYS HA 1 40 LYS HE2 . . 5.500 4.850 4.020 5.420 . 0 0 "[ . 1 . 2]" 1
687 1 40 LYS HA 1 40 LYS HE3 . . 5.500 4.826 4.008 5.317 . 0 0 "[ . 1 . 2]" 1
688 1 40 LYS HA 1 41 GLY H . . 2.900 2.156 2.144 2.296 . 0 0 "[ . 1 . 2]" 1
689 1 40 LYS HA 1 41 GLY QA . . 4.380 3.919 3.900 4.013 . 0 0 "[ . 1 . 2]" 1
690 1 40 LYS HA 1 42 GLY H . . 3.840 3.619 3.411 3.838 . 0 0 "[ . 1 . 2]" 1
691 1 40 LYS HA 1 45 ASP HB2 . . 3.950 2.582 1.999 2.925 . 0 0 "[ . 1 . 2]" 1
692 1 40 LYS QB 1 41 GLY QA . . 5.180 4.159 3.557 4.329 . 0 0 "[ . 1 . 2]" 1
693 1 40 LYS HB2 1 41 GLY H . . 4.550 4.347 4.096 4.535 . 0 0 "[ . 1 . 2]" 1
694 1 40 LYS HB3 1 41 GLY H . . 4.550 4.146 2.824 4.382 . 0 0 "[ . 1 . 2]" 1
695 1 40 LYS QD 1 41 GLY H . . 4.130 3.122 2.509 4.015 . 0 0 "[ . 1 . 2]" 1
696 1 40 LYS HD2 1 41 GLY H . . 4.900 3.628 2.662 4.747 . 0 0 "[ . 1 . 2]" 1
697 1 40 LYS HD3 1 41 GLY H . . 4.900 3.872 2.549 4.904 0.004 17 0 "[ . 1 . 2]" 1
698 1 40 LYS QG 1 41 GLY QA . . 4.760 3.705 3.117 4.760 . 0 0 "[ . 1 . 2]" 1
699 1 40 LYS HG2 1 41 GLY H . . 5.500 4.172 3.079 4.763 . 0 0 "[ . 1 . 2]" 1
700 1 40 LYS HG3 1 41 GLY H . . 5.500 3.615 2.825 5.148 . 0 0 "[ . 1 . 2]" 1
701 1 41 GLY H 1 42 GLY H . . 3.490 2.416 2.056 2.980 . 0 0 "[ . 1 . 2]" 1
702 1 41 GLY H 1 45 ASP HB3 . . 3.570 1.960 1.900 2.113 . 0 0 "[ . 1 . 2]" 1
703 1 41 GLY H 1 46 LEU H . . 4.960 3.850 3.654 4.089 . 0 0 "[ . 1 . 2]" 1
704 1 41 GLY H 1 46 LEU MD2 . . 4.790 4.627 4.376 4.776 . 0 0 "[ . 1 . 2]" 1
705 1 41 GLY QA 1 46 LEU MD1 . . 5.060 3.923 3.691 4.185 . 0 0 "[ . 1 . 2]" 1
706 1 41 GLY QA 1 46 LEU MD2 . . 3.660 3.243 2.915 3.575 . 0 0 "[ . 1 . 2]" 1
707 1 41 GLY HA2 1 45 ASP HB3 . . 4.800 3.539 3.108 3.856 . 0 0 "[ . 1 . 2]" 1
708 1 41 GLY HA2 1 46 LEU HG . . 4.860 3.217 2.900 3.411 . 0 0 "[ . 1 . 2]" 1
709 1 41 GLY HA3 1 45 ASP HB3 . . 4.800 4.523 4.318 4.764 . 0 0 "[ . 1 . 2]" 1
710 1 41 GLY HA3 1 46 LEU HG . . 4.860 4.579 4.248 4.834 . 0 0 "[ . 1 . 2]" 1
711 1 42 GLY H 1 43 PRO HD2 . . 5.200 4.277 4.198 4.336 . 0 0 "[ . 1 . 2]" 1
712 1 42 GLY H 1 43 PRO HD3 . . 5.200 5.032 5.005 5.063 . 0 0 "[ . 1 . 2]" 1
713 1 42 GLY H 1 45 ASP H . . 4.420 3.757 3.036 4.305 . 0 0 "[ . 1 . 2]" 1
714 1 42 GLY H 1 45 ASP HB2 . . 3.920 3.260 2.559 3.884 . 0 0 "[ . 1 . 2]" 1
715 1 42 GLY H 1 45 ASP HB3 . . 4.130 2.870 1.984 3.581 . 0 0 "[ . 1 . 2]" 1
716 1 42 GLY H 1 46 LEU H . . 4.770 3.883 2.811 4.609 . 0 0 "[ . 1 . 2]" 1
717 1 42 GLY H 1 46 LEU HG . . 4.550 4.117 3.243 4.547 . 0 0 "[ . 1 . 2]" 1
718 1 42 GLY QA 1 43 PRO QD . . 2.990 1.932 1.908 1.958 . 0 0 "[ . 1 . 2]" 1
719 1 42 GLY QA 1 46 LEU MD1 . . 4.140 3.458 3.007 3.887 . 0 0 "[ . 1 . 2]" 1
720 1 43 PRO HA 1 46 LEU H . . 4.320 4.088 3.871 4.281 . 0 0 "[ . 1 . 2]" 1
721 1 43 PRO HA 1 46 LEU HB2 . . 3.740 2.872 2.579 3.112 . 0 0 "[ . 1 . 2]" 1
722 1 43 PRO HA 1 46 LEU HB3 . . 4.630 4.370 4.040 4.631 0.001 15 0 "[ . 1 . 2]" 1
723 1 43 PRO HA 1 46 LEU MD1 . . 3.700 2.926 2.556 3.422 . 0 0 "[ . 1 . 2]" 1
724 1 43 PRO HA 1 46 LEU HG . . 5.180 4.389 4.097 4.714 . 0 0 "[ . 1 . 2]" 1
725 1 43 PRO HA 1 47 ALA H . . 4.370 4.102 3.791 4.305 . 0 0 "[ . 1 . 2]" 1
726 1 43 PRO HA 1 47 ALA MB . . 4.600 4.417 4.097 4.601 0.001 10 0 "[ . 1 . 2]" 1
727 1 43 PRO QB 1 44 ALA H . . 3.400 2.986 2.801 3.159 . 0 0 "[ . 1 . 2]" 1
728 1 43 PRO QB 1 46 LEU MD1 . . 5.060 4.263 3.894 4.724 . 0 0 "[ . 1 . 2]" 1
729 1 43 PRO HB2 1 44 ALA H . . 4.110 3.084 2.873 3.282 . 0 0 "[ . 1 . 2]" 1
730 1 43 PRO HB3 1 44 ALA H . . 4.110 3.996 3.875 4.111 0.001 14 0 "[ . 1 . 2]" 1
731 1 43 PRO QD 1 44 ALA H . . 3.790 2.645 2.603 2.711 . 0 0 "[ . 1 . 2]" 1
732 1 43 PRO HD2 1 44 ALA H . . 4.390 2.694 2.648 2.767 . 0 0 "[ . 1 . 2]" 1
733 1 43 PRO HD3 1 44 ALA H . . 4.390 3.851 3.835 3.879 . 0 0 "[ . 1 . 2]" 1
734 1 43 PRO HG3 1 44 ALA H . . 4.410 3.679 3.527 3.835 . 0 0 "[ . 1 . 2]" 1
735 1 44 ALA H 1 44 ALA MB . . 3.050 2.171 2.051 2.265 . 0 0 "[ . 1 . 2]" 1
736 1 44 ALA H 1 45 ASP H . . 3.610 2.756 2.410 3.065 . 0 0 "[ . 1 . 2]" 1
737 1 44 ALA HA 1 47 ALA H . . 4.430 3.873 3.501 4.056 . 0 0 "[ . 1 . 2]" 1
738 1 44 ALA HA 1 47 ALA MB . . 3.450 3.001 2.631 3.337 . 0 0 "[ . 1 . 2]" 1
739 1 44 ALA HA 1 48 GLY H . . 5.060 4.575 4.372 4.936 . 0 0 "[ . 1 . 2]" 1
740 1 44 ALA HA 1 49 LEU MD1 . . 3.650 2.079 1.937 2.376 . 0 0 "[ . 1 . 2]" 1
741 1 44 ALA MB 1 45 ASP H . . 3.720 2.390 1.981 2.627 . 0 0 "[ . 1 . 2]" 1
742 1 44 ALA MB 1 45 ASP HA . . 4.520 3.748 3.676 3.849 . 0 0 "[ . 1 . 2]" 1
743 1 44 ALA MB 1 45 ASP HB2 . . 4.830 3.867 3.652 4.053 . 0 0 "[ . 1 . 2]" 1
744 1 44 ALA MB 1 45 ASP HB3 . . 5.500 4.720 4.480 4.918 . 0 0 "[ . 1 . 2]" 1
745 1 44 ALA MB 1 49 LEU H . . 4.580 4.037 3.813 4.259 . 0 0 "[ . 1 . 2]" 1
746 1 44 ALA MB 1 49 LEU HB3 . . 3.910 3.278 3.002 3.671 . 0 0 "[ . 1 . 2]" 1
747 1 44 ALA MB 1 49 LEU MD1 . . 3.140 2.140 1.917 2.530 . 0 0 "[ . 1 . 2]" 1
748 1 45 ASP H 1 45 ASP HB2 . . 3.400 2.325 2.201 2.482 . 0 0 "[ . 1 . 2]" 1
749 1 45 ASP H 1 45 ASP HB3 . . 3.880 2.772 2.583 2.950 . 0 0 "[ . 1 . 2]" 1
750 1 45 ASP H 1 46 LEU H . . 3.590 2.859 2.701 3.014 . 0 0 "[ . 1 . 2]" 1
751 1 45 ASP HA 1 49 LEU H . . 4.320 2.794 2.551 3.192 . 0 0 "[ . 1 . 2]" 1
752 1 45 ASP HB3 1 46 LEU H . . 3.230 2.230 2.112 2.523 . 0 0 "[ . 1 . 2]" 1
753 1 45 ASP HB3 1 46 LEU HA . . 4.630 3.943 3.825 4.144 . 0 0 "[ . 1 . 2]" 1
754 1 45 ASP HB3 1 46 LEU MD1 . . 5.500 4.866 4.535 5.187 . 0 0 "[ . 1 . 2]" 1
755 1 45 ASP HB3 1 46 LEU MD2 . . 4.420 4.328 4.197 4.420 . 0 0 "[ . 1 . 2]" 1
756 1 45 ASP HB3 1 46 LEU HG . . 4.670 3.572 3.362 3.880 . 0 0 "[ . 1 . 2]" 1
757 1 45 ASP HB3 1 47 ALA H . . 4.950 4.857 4.781 4.949 . 0 0 "[ . 1 . 2]" 1
758 1 46 LEU H 1 46 LEU HB2 . . 3.120 2.397 2.215 2.519 . 0 0 "[ . 1 . 2]" 1
759 1 46 LEU H 1 46 LEU HB3 . . 3.730 3.579 3.513 3.597 . 0 0 "[ . 1 . 2]" 1
760 1 46 LEU H 1 46 LEU MD1 . . 3.900 3.598 3.415 3.849 . 0 0 "[ . 1 . 2]" 1
761 1 46 LEU H 1 46 LEU MD2 . . 3.930 3.584 3.437 3.705 . 0 0 "[ . 1 . 2]" 1
762 1 46 LEU H 1 46 LEU HG . . 3.300 2.454 2.219 2.811 . 0 0 "[ . 1 . 2]" 1
763 1 46 LEU H 1 47 ALA H . . 3.370 2.928 2.654 3.016 . 0 0 "[ . 1 . 2]" 1
764 1 46 LEU H 1 47 ALA MB . . 4.830 4.533 4.341 4.640 . 0 0 "[ . 1 . 2]" 1
765 1 46 LEU H 1 48 GLY H . . 4.660 4.181 3.968 4.302 . 0 0 "[ . 1 . 2]" 1
766 1 46 LEU HA 1 46 LEU MD1 . . 4.600 3.849 3.794 3.894 . 0 0 "[ . 1 . 2]" 1
767 1 46 LEU HA 1 46 LEU MD2 . . 2.880 2.171 2.001 2.376 . 0 0 "[ . 1 . 2]" 1
768 1 46 LEU HA 1 46 LEU HG . . 3.860 2.873 2.815 2.945 . 0 0 "[ . 1 . 2]" 1
769 1 46 LEU HA 1 48 GLY H . . 4.550 4.269 3.597 4.510 . 0 0 "[ . 1 . 2]" 1
770 1 46 LEU HB2 1 46 LEU MD1 . . 3.170 2.243 2.119 2.384 . 0 0 "[ . 1 . 2]" 1
771 1 46 LEU HB2 1 47 ALA H . . 3.580 2.610 2.415 2.888 . 0 0 "[ . 1 . 2]" 1
772 1 46 LEU HB2 1 48 GLY H . . 5.010 4.927 4.619 5.009 . 0 0 "[ . 1 . 2]" 1
773 1 46 LEU HB3 1 46 LEU MD1 . . 3.590 2.424 2.260 2.505 . 0 0 "[ . 1 . 2]" 1
774 1 46 LEU HB3 1 46 LEU MD2 . . 3.290 2.241 2.129 2.330 . 0 0 "[ . 1 . 2]" 1
775 1 46 LEU HB3 1 47 ALA H . . 3.680 3.367 3.198 3.669 . 0 0 "[ . 1 . 2]" 1
776 1 46 LEU MD1 1 47 ALA H . . 4.890 4.454 4.194 4.697 . 0 0 "[ . 1 . 2]" 1
777 1 46 LEU MD2 1 47 ALA H . . 5.340 4.674 4.572 4.782 . 0 0 "[ . 1 . 2]" 1
778 1 47 ALA H 1 47 ALA MB . . 2.880 2.135 2.031 2.238 . 0 0 "[ . 1 . 2]" 1
779 1 47 ALA H 1 48 GLY H . . 3.220 2.633 2.418 2.766 . 0 0 "[ . 1 . 2]" 1
780 1 47 ALA H 1 48 GLY QA . . 5.020 4.522 4.381 4.667 . 0 0 "[ . 1 . 2]" 1
781 1 47 ALA H 1 49 LEU H . . 4.250 4.158 3.846 4.243 . 0 0 "[ . 1 . 2]" 1
782 1 47 ALA MB 1 48 GLY H . . 3.660 2.740 2.562 3.085 . 0 0 "[ . 1 . 2]" 1
783 1 47 ALA MB 1 48 GLY QA . . 4.650 3.800 3.715 3.936 . 0 0 "[ . 1 . 2]" 1
784 1 47 ALA MB 1 49 LEU H . . 3.900 3.473 3.082 3.704 . 0 0 "[ . 1 . 2]" 1
785 1 47 ALA MB 1 49 LEU MD1 . . 3.870 2.991 2.428 3.286 . 0 0 "[ . 1 . 2]" 1
786 1 49 LEU H 1 49 LEU HB2 . . 3.020 2.412 2.286 2.556 . 0 0 "[ . 1 . 2]" 1
787 1 49 LEU H 1 49 LEU HB3 . . 3.850 3.630 3.558 3.692 . 0 0 "[ . 1 . 2]" 1
788 1 49 LEU H 1 49 LEU MD1 . . 3.950 3.774 3.499 3.947 . 0 0 "[ . 1 . 2]" 1
789 1 49 LEU H 1 49 LEU MD2 . . 4.130 3.887 3.608 4.064 . 0 0 "[ . 1 . 2]" 1
790 1 49 LEU H 1 49 LEU HG . . 3.310 2.866 2.411 3.153 . 0 0 "[ . 1 . 2]" 1
791 1 49 LEU HA 1 49 LEU MD2 . . 3.370 2.097 1.970 2.393 . 0 0 "[ . 1 . 2]" 1
792 1 49 LEU HA 1 49 LEU HG . . 4.140 2.949 2.800 3.160 . 0 0 "[ . 1 . 2]" 1
793 1 49 LEU HA 1 50 GLU H . . 3.040 2.246 2.158 2.606 . 0 0 "[ . 1 . 2]" 1
794 1 49 LEU HA 1 86 VAL MG2 . . 4.610 4.056 3.385 4.589 . 0 0 "[ . 1 . 2]" 1
795 1 49 LEU HB2 1 49 LEU MD1 . . 3.420 2.206 2.071 2.365 . 0 0 "[ . 1 . 2]" 1
796 1 49 LEU HB2 1 50 GLU H . . 4.280 4.008 3.366 4.262 . 0 0 "[ . 1 . 2]" 1
797 1 49 LEU HB3 1 49 LEU MD1 . . 3.560 2.463 2.318 2.573 . 0 0 "[ . 1 . 2]" 1
798 1 49 LEU HB3 1 49 LEU MD2 . . 3.640 2.289 2.117 2.397 . 0 0 "[ . 1 . 2]" 1
799 1 49 LEU HB3 1 50 GLU H . . 3.820 2.891 1.990 3.244 . 0 0 "[ . 1 . 2]" 1
800 1 49 LEU MD2 1 50 GLU H . . 3.830 3.198 2.855 3.558 . 0 0 "[ . 1 . 2]" 1
801 1 49 LEU MD2 1 53 ASP HB2 . . 4.470 3.058 2.734 3.602 . 0 0 "[ . 1 . 2]" 1
802 1 49 LEU MD2 1 53 ASP HB3 . . 4.700 2.991 2.508 3.477 . 0 0 "[ . 1 . 2]" 1
803 1 49 LEU MD2 1 86 VAL HB . . 4.390 3.786 3.454 4.245 . 0 0 "[ . 1 . 2]" 1
804 1 49 LEU MD2 1 86 VAL MG2 . . 3.200 2.342 1.935 2.762 . 0 0 "[ . 1 . 2]" 1
805 1 49 LEU HG 1 50 GLU H . . 4.980 4.878 4.580 4.985 0.005 16 0 "[ . 1 . 2]" 1
806 1 50 GLU H 1 50 GLU HB2 . . 3.940 2.670 2.370 3.803 . 0 0 "[ . 1 . 2]" 1
807 1 50 GLU H 1 50 GLU QB . . 3.370 2.531 2.337 3.291 . 0 0 "[ . 1 . 2]" 1
808 1 50 GLU H 1 50 GLU HB3 . . 3.940 3.482 2.875 3.783 . 0 0 "[ . 1 . 2]" 1
809 1 50 GLU H 1 50 GLU HG2 . . 4.920 3.892 2.161 4.799 . 0 0 "[ . 1 . 2]" 1
810 1 50 GLU H 1 50 GLU QG . . 4.170 3.319 2.138 4.214 0.044 19 0 "[ . 1 . 2]" 1
811 1 50 GLU H 1 50 GLU HG3 . . 4.920 3.853 2.769 4.804 . 0 0 "[ . 1 . 2]" 1
812 1 50 GLU H 1 51 ASP H . . 4.740 4.436 4.377 4.531 . 0 0 "[ . 1 . 2]" 1
813 1 50 GLU H 1 53 ASP H . . 4.480 3.458 3.177 4.345 . 0 0 "[ . 1 . 2]" 1
814 1 50 GLU H 1 53 ASP HB2 . . 4.470 2.770 2.220 3.434 . 0 0 "[ . 1 . 2]" 1
815 1 50 GLU HA 1 50 GLU HG2 . . 3.920 2.904 2.169 3.715 . 0 0 "[ . 1 . 2]" 1
816 1 50 GLU HA 1 50 GLU QG . . 3.440 2.535 2.148 3.336 . 0 0 "[ . 1 . 2]" 1
817 1 50 GLU HA 1 50 GLU HG3 . . 3.920 3.156 2.240 3.780 . 0 0 "[ . 1 . 2]" 1
818 1 50 GLU HA 1 51 ASP H . . 2.960 2.571 2.390 2.651 . 0 0 "[ . 1 . 2]" 1
819 1 50 GLU QB 1 51 ASP H . . 3.230 2.218 1.904 3.101 . 0 0 "[ . 1 . 2]" 1
820 1 50 GLU HB2 1 51 ASP H . . 3.940 3.372 2.173 4.004 0.064 20 0 "[ . 1 . 2]" 1
821 1 50 GLU HB3 1 51 ASP H . . 3.940 2.385 1.916 3.663 . 0 0 "[ . 1 . 2]" 1
822 1 50 GLU QG 1 51 ASP H . . 4.070 3.340 1.874 3.930 . 0 0 "[ . 1 . 2]" 1
823 1 51 ASP H 1 51 ASP HB2 . . 3.660 2.969 2.263 3.600 . 0 0 "[ . 1 . 2]" 1
824 1 51 ASP H 1 51 ASP QB . . 3.030 2.555 2.238 2.862 . 0 0 "[ . 1 . 2]" 1
825 1 51 ASP H 1 51 ASP HB3 . . 3.660 3.102 2.412 3.641 . 0 0 "[ . 1 . 2]" 1
826 1 51 ASP H 1 52 GLU H . . 4.690 2.758 2.567 3.095 . 0 0 "[ . 1 . 2]" 1
827 1 51 ASP HA 1 52 GLU H . . 3.260 3.076 2.851 3.214 . 0 0 "[ . 1 . 2]" 1
828 1 51 ASP HA 1 52 GLU HA . . 4.550 4.465 4.409 4.510 . 0 0 "[ . 1 . 2]" 1
829 1 51 ASP HA 1 53 ASP H . . 4.440 4.078 3.696 4.396 . 0 0 "[ . 1 . 2]" 1
830 1 51 ASP QB 1 52 GLU H . . 3.890 3.804 3.626 3.906 0.016 10 0 "[ . 1 . 2]" 1
831 1 51 ASP QB 1 52 GLU QG . . 4.380 3.720 3.005 4.234 . 0 0 "[ . 1 . 2]" 1
832 1 51 ASP HB2 1 52 GLU H . . 4.550 4.216 3.847 4.560 0.010 7 0 "[ . 1 . 2]" 1
833 1 51 ASP HB3 1 52 GLU H . . 4.550 4.386 3.904 4.568 0.018 10 0 "[ . 1 . 2]" 1
834 1 52 GLU H 1 52 GLU QG . . 4.230 3.152 2.199 3.763 . 0 0 "[ . 1 . 2]" 1
835 1 52 GLU H 1 53 ASP H . . 3.620 1.889 1.792 2.369 . 0 0 "[ . 1 . 2]" 1
836 1 52 GLU H 1 53 ASP HA . . 4.670 4.482 4.383 4.542 . 0 0 "[ . 1 . 2]" 1
837 1 52 GLU HA 1 52 GLU HG2 . . 3.830 2.828 2.306 3.757 . 0 0 "[ . 1 . 2]" 1
838 1 52 GLU HA 1 52 GLU QG . . 3.340 2.602 2.254 3.329 . 0 0 "[ . 1 . 2]" 1
839 1 52 GLU HA 1 52 GLU HG3 . . 3.830 3.292 2.406 3.774 . 0 0 "[ . 1 . 2]" 1
840 1 52 GLU QB 1 89 LYS QB . . 4.180 3.081 2.182 4.116 . 0 0 "[ . 1 . 2]" 1
841 1 52 GLU QB 1 89 LYS QD . . 4.380 2.777 2.149 3.841 . 0 0 "[ . 1 . 2]" 1
842 1 52 GLU HB2 1 89 LYS HB2 . . 5.500 4.355 2.716 5.477 . 0 0 "[ . 1 . 2]" 1
843 1 52 GLU HB2 1 89 LYS HB3 . . 5.500 4.453 3.431 5.474 . 0 0 "[ . 1 . 2]" 1
844 1 52 GLU HB3 1 89 LYS HB2 . . 5.500 3.925 2.985 5.497 . 0 0 "[ . 1 . 2]" 1
845 1 52 GLU HB3 1 89 LYS HB3 . . 5.500 4.061 2.229 5.093 . 0 0 "[ . 1 . 2]" 1
846 1 52 GLU QG 1 89 LYS QB . . 4.760 4.314 3.707 4.752 . 0 0 "[ . 1 . 2]" 1
847 1 52 GLU QG 1 89 LYS QD . . 4.320 3.764 2.183 4.321 0.001 18 0 "[ . 1 . 2]" 1
848 1 53 ASP H 1 53 ASP HB2 . . 3.320 2.317 2.205 2.537 . 0 0 "[ . 1 . 2]" 1
849 1 53 ASP H 1 53 ASP HB3 . . 3.700 3.554 3.492 3.593 . 0 0 "[ . 1 . 2]" 1
850 1 53 ASP H 1 54 VAL H . . 4.740 4.612 4.507 4.648 . 0 0 "[ . 1 . 2]" 1
851 1 53 ASP HA 1 54 VAL H . . 3.200 2.268 2.142 2.385 . 0 0 "[ . 1 . 2]" 1
852 1 53 ASP HA 1 54 VAL MG1 . . 4.400 3.482 3.231 3.727 . 0 0 "[ . 1 . 2]" 1
853 1 53 ASP HB2 1 54 VAL H . . 4.580 4.060 3.696 4.368 . 0 0 "[ . 1 . 2]" 1
854 1 53 ASP HB2 1 86 VAL HB . . 4.540 4.068 3.665 4.536 . 0 0 "[ . 1 . 2]" 1
855 1 53 ASP HB2 1 86 VAL MG1 . . 3.960 3.423 3.082 3.875 . 0 0 "[ . 1 . 2]" 1
856 1 53 ASP HB3 1 54 VAL H . . 4.040 2.859 2.473 3.416 . 0 0 "[ . 1 . 2]" 1
857 1 53 ASP HB3 1 86 VAL HB . . 3.820 2.402 1.999 2.896 . 0 0 "[ . 1 . 2]" 1
858 1 53 ASP HB3 1 86 VAL MG1 . . 3.820 2.184 1.958 2.565 . 0 0 "[ . 1 . 2]" 1
859 1 53 ASP HB3 1 86 VAL MG2 . . 3.850 3.163 2.681 3.800 . 0 0 "[ . 1 . 2]" 1
860 1 54 VAL H 1 54 VAL HB . . 3.830 3.801 3.700 3.844 0.014 10 0 "[ . 1 . 2]" 1
861 1 54 VAL H 1 54 VAL MG1 . . 3.520 2.768 2.308 3.106 . 0 0 "[ . 1 . 2]" 1
862 1 54 VAL H 1 54 VAL MG2 . . 4.000 2.151 2.007 2.254 . 0 0 "[ . 1 . 2]" 1
863 1 54 VAL H 1 86 VAL MG1 . . 4.740 3.207 2.755 3.834 . 0 0 "[ . 1 . 2]" 1
864 1 54 VAL H 1 87 CYS H . . 3.930 3.118 2.653 3.525 . 0 0 "[ . 1 . 2]" 1
865 1 54 VAL HA 1 54 VAL MG1 . . 3.260 2.370 2.211 2.501 . 0 0 "[ . 1 . 2]" 1
866 1 54 VAL HA 1 54 VAL MG2 . . 3.500 3.194 3.178 3.203 . 0 0 "[ . 1 . 2]" 1
867 1 54 VAL HA 1 55 ILE H . . 3.180 2.227 2.143 2.315 . 0 0 "[ . 1 . 2]" 1
868 1 54 VAL HA 1 55 ILE HB . . 4.810 4.644 4.529 4.703 . 0 0 "[ . 1 . 2]" 1
869 1 54 VAL HA 1 55 ILE MD . . 5.460 3.644 3.057 4.454 . 0 0 "[ . 1 . 2]" 1
870 1 54 VAL HB 1 55 ILE H . . 4.600 2.921 2.630 3.377 . 0 0 "[ . 1 . 2]" 1
871 1 54 VAL HB 1 55 ILE HA . . 5.430 4.896 4.747 5.125 . 0 0 "[ . 1 . 2]" 1
872 1 54 VAL HB 1 55 ILE MD . . 5.500 4.880 4.310 5.504 0.004 14 0 "[ . 1 . 2]" 1
873 1 54 VAL HB 1 87 CYS H . . 5.500 5.440 5.157 5.505 0.005 8 0 "[ . 1 . 2]" 1
874 1 54 VAL MG1 1 55 ILE H . . 4.080 3.925 3.765 4.089 0.009 17 0 "[ . 1 . 2]" 1
875 1 54 VAL MG2 1 55 ILE H . . 3.990 3.681 3.339 3.962 . 0 0 "[ . 1 . 2]" 1
876 1 54 VAL MG2 1 56 ILE HA . . 4.690 3.878 3.451 4.163 . 0 0 "[ . 1 . 2]" 1
877 1 54 VAL MG2 1 56 ILE QG . . 4.180 2.294 2.074 2.530 . 0 0 "[ . 1 . 2]" 1
878 1 54 VAL MG2 1 87 CYS HB2 . . 4.710 4.296 3.628 4.696 . 0 0 "[ . 1 . 2]" 1
879 1 54 VAL MG2 1 87 CYS QB . . 3.960 3.348 2.716 3.812 . 0 0 "[ . 1 . 2]" 1
880 1 54 VAL MG2 1 87 CYS HB3 . . 4.710 3.500 2.776 4.052 . 0 0 "[ . 1 . 2]" 1
881 1 55 ILE H 1 55 ILE HB . . 3.480 2.474 2.358 2.521 . 0 0 "[ . 1 . 2]" 1
882 1 55 ILE H 1 55 ILE MD . . 3.980 2.465 1.856 3.359 . 0 0 "[ . 1 . 2]" 1
883 1 55 ILE H 1 55 ILE HG12 . . 4.390 3.969 3.889 4.128 . 0 0 "[ . 1 . 2]" 1
884 1 55 ILE H 1 55 ILE QG . . 3.710 2.830 2.436 3.257 . 0 0 "[ . 1 . 2]" 1
885 1 55 ILE H 1 55 ILE HG13 . . 4.390 2.911 2.461 3.410 . 0 0 "[ . 1 . 2]" 1
886 1 55 ILE H 1 55 ILE MG . . 4.050 3.768 3.718 3.792 . 0 0 "[ . 1 . 2]" 1
887 1 55 ILE HA 1 55 ILE MD . . 4.030 3.558 3.250 3.887 . 0 0 "[ . 1 . 2]" 1
888 1 55 ILE HA 1 55 ILE HG12 . . 4.210 3.217 2.804 3.512 . 0 0 "[ . 1 . 2]" 1
889 1 55 ILE HA 1 55 ILE QG . . 3.570 2.331 2.177 2.461 . 0 0 "[ . 1 . 2]" 1
890 1 55 ILE HA 1 55 ILE HG13 . . 4.210 2.443 2.201 2.703 . 0 0 "[ . 1 . 2]" 1
891 1 55 ILE HA 1 55 ILE MG . . 3.470 2.377 2.304 2.485 . 0 0 "[ . 1 . 2]" 1
892 1 55 ILE HA 1 56 ILE H . . 3.310 2.204 2.146 2.272 . 0 0 "[ . 1 . 2]" 1
893 1 55 ILE HA 1 56 ILE HA . . 4.730 4.457 4.406 4.506 . 0 0 "[ . 1 . 2]" 1
894 1 55 ILE HA 1 57 GLU H . . 4.500 4.212 3.810 4.499 . 0 0 "[ . 1 . 2]" 1
895 1 55 ILE HA 1 86 VAL HA . . 3.930 3.697 3.428 3.858 . 0 0 "[ . 1 . 2]" 1
896 1 55 ILE HA 1 86 VAL HB . . 5.500 5.013 4.593 5.422 . 0 0 "[ . 1 . 2]" 1
897 1 55 ILE HA 1 86 VAL MG1 . . 3.340 2.840 2.276 3.245 . 0 0 "[ . 1 . 2]" 1
898 1 55 ILE HA 1 86 VAL MG2 . . 5.500 5.333 4.973 5.502 0.002 1 0 "[ . 1 . 2]" 1
899 1 55 ILE HB 1 55 ILE MD . . 3.440 2.176 2.096 2.288 . 0 0 "[ . 1 . 2]" 1
900 1 55 ILE HB 1 86 VAL MG1 . . 5.500 5.109 4.678 5.395 . 0 0 "[ . 1 . 2]" 1
901 1 55 ILE MD 1 75 ILE HB . . 5.500 5.423 5.073 5.509 0.009 8 0 "[ . 1 . 2]" 1
902 1 55 ILE QG 1 55 ILE MG . . 3.290 2.034 1.943 2.191 . 0 0 "[ . 1 . 2]" 1
903 1 55 ILE MG 1 56 ILE H . . 3.710 3.179 2.804 3.432 . 0 0 "[ . 1 . 2]" 1
904 1 55 ILE MG 1 57 GLU H . . 3.880 3.468 2.861 3.867 . 0 0 "[ . 1 . 2]" 1
905 1 55 ILE MG 1 57 GLU HA . . 4.700 4.065 3.693 4.348 . 0 0 "[ . 1 . 2]" 1
906 1 55 ILE MG 1 58 VAL HA . . 4.400 4.050 3.777 4.308 . 0 0 "[ . 1 . 2]" 1
907 1 55 ILE MG 1 84 LEU HA . . 4.440 3.626 3.075 4.030 . 0 0 "[ . 1 . 2]" 1
908 1 55 ILE MG 1 85 LEU H . . 4.440 3.440 2.970 3.824 . 0 0 "[ . 1 . 2]" 1
909 1 55 ILE MG 1 86 VAL HA . . 5.420 5.299 5.092 5.431 0.011 7 0 "[ . 1 . 2]" 1
910 1 56 ILE H 1 56 ILE HB . . 3.730 2.432 2.339 2.500 . 0 0 "[ . 1 . 2]" 1
911 1 56 ILE H 1 56 ILE MD . . 4.130 3.645 3.336 3.913 . 0 0 "[ . 1 . 2]" 1
912 1 56 ILE H 1 56 ILE HG12 . . 4.200 3.669 3.343 3.963 . 0 0 "[ . 1 . 2]" 1
913 1 56 ILE H 1 56 ILE HG13 . . 4.200 2.423 2.213 2.666 . 0 0 "[ . 1 . 2]" 1
914 1 56 ILE H 1 56 ILE MG . . 4.220 3.748 3.709 3.779 . 0 0 "[ . 1 . 2]" 1
915 1 56 ILE H 1 57 GLU H . . 3.440 2.724 2.421 2.970 . 0 0 "[ . 1 . 2]" 1
916 1 56 ILE H 1 64 LEU MD2 . . 5.200 4.486 4.073 5.137 . 0 0 "[ . 1 . 2]" 1
917 1 56 ILE H 1 85 LEU H . . 4.760 3.763 3.269 4.148 . 0 0 "[ . 1 . 2]" 1
918 1 56 ILE H 1 85 LEU HB3 . . 4.540 3.684 3.127 4.270 . 0 0 "[ . 1 . 2]" 1
919 1 56 ILE H 1 85 LEU MD2 . . 4.330 3.588 3.337 3.818 . 0 0 "[ . 1 . 2]" 1
920 1 56 ILE H 1 86 VAL HA . . 3.820 3.129 2.508 3.697 . 0 0 "[ . 1 . 2]" 1
921 1 56 ILE H 1 86 VAL MG1 . . 4.450 3.646 3.001 4.137 . 0 0 "[ . 1 . 2]" 1
922 1 56 ILE H 1 87 CYS H . . 5.270 4.779 4.376 5.278 0.008 14 0 "[ . 1 . 2]" 1
923 1 56 ILE HA 1 56 ILE MD . . 3.850 3.805 3.712 3.863 0.013 19 0 "[ . 1 . 2]" 1
924 1 56 ILE HA 1 56 ILE QG . . 3.720 2.360 2.300 2.420 . 0 0 "[ . 1 . 2]" 1
925 1 56 ILE HA 1 56 ILE MG . . 3.320 2.425 2.344 2.483 . 0 0 "[ . 1 . 2]" 1
926 1 56 ILE HA 1 63 VAL H . . 4.930 4.696 4.371 4.932 0.002 19 0 "[ . 1 . 2]" 1
927 1 56 ILE HA 1 63 VAL MG2 . . 4.310 3.915 3.629 4.178 . 0 0 "[ . 1 . 2]" 1
928 1 56 ILE HA 1 64 LEU MD2 . . 3.280 2.198 1.926 2.887 . 0 0 "[ . 1 . 2]" 1
929 1 56 ILE HA 1 64 LEU HG . . 3.850 2.727 2.003 3.308 . 0 0 "[ . 1 . 2]" 1
930 1 56 ILE HB 1 56 ILE MD . . 3.560 2.378 2.110 2.590 . 0 0 "[ . 1 . 2]" 1
931 1 56 ILE HB 1 57 GLU H . . 3.530 2.236 2.007 2.568 . 0 0 "[ . 1 . 2]" 1
932 1 56 ILE HB 1 85 LEU MD2 . . 4.470 2.023 1.915 2.314 . 0 0 "[ . 1 . 2]" 1
933 1 56 ILE HB 1 85 LEU HG . . 4.470 4.452 4.363 4.520 0.050 7 0 "[ . 1 . 2]" 1
934 1 56 ILE HB 1 86 VAL HA . . 4.880 4.041 3.323 4.717 . 0 0 "[ . 1 . 2]" 1
935 1 56 ILE MD 1 56 ILE MG . . 2.870 2.034 1.860 2.413 . 0 0 "[ . 1 . 2]" 1
936 1 56 ILE MD 1 57 GLU H . . 4.790 4.253 4.014 4.687 . 0 0 "[ . 1 . 2]" 1
937 1 56 ILE MD 1 64 LEU MD2 . . 3.870 3.709 3.175 3.873 0.003 11 0 "[ . 1 . 2]" 1
938 1 56 ILE MD 1 64 LEU HG . . 5.500 4.630 4.145 5.048 . 0 0 "[ . 1 . 2]" 1
939 1 56 ILE MD 1 85 LEU MD2 . . 3.090 1.856 1.683 2.215 . 0 0 "[ . 1 . 2]" 1
940 1 56 ILE MD 1 85 LEU HG . . 4.300 4.165 3.891 4.308 0.008 8 0 "[ . 1 . 2]" 1
941 1 56 ILE MD 1 86 VAL HA . . 4.760 3.274 2.662 3.796 . 0 0 "[ . 1 . 2]" 1
942 1 56 ILE MD 1 87 CYS H . . 3.920 2.959 2.165 3.737 . 0 0 "[ . 1 . 2]" 1
943 1 56 ILE MD 1 87 CYS HA . . 4.280 3.748 2.893 4.295 0.015 14 0 "[ . 1 . 2]" 1
944 1 56 ILE MD 1 87 CYS HB2 . . 3.800 2.307 1.787 3.724 . 0 0 "[ . 1 . 2]" 1
945 1 56 ILE MD 1 87 CYS HB3 . . 3.800 2.459 1.919 3.326 . 0 0 "[ . 1 . 2]" 1
946 1 56 ILE QG 1 64 LEU MD2 . . 3.860 2.453 1.997 2.780 . 0 0 "[ . 1 . 2]" 1
947 1 56 ILE QG 1 85 LEU MD2 . . 4.060 3.074 2.498 3.557 . 0 0 "[ . 1 . 2]" 1
948 1 56 ILE QG 1 86 VAL HA . . 4.280 3.100 2.623 3.532 . 0 0 "[ . 1 . 2]" 1
949 1 56 ILE QG 1 87 CYS H . . 4.410 3.460 3.023 3.919 . 0 0 "[ . 1 . 2]" 1
950 1 56 ILE HG12 1 64 LEU MD2 . . 4.430 2.500 2.016 2.830 . 0 0 "[ . 1 . 2]" 1
951 1 56 ILE HG12 1 86 VAL HA . . 5.150 4.822 4.337 5.143 . 0 0 "[ . 1 . 2]" 1
952 1 56 ILE HG13 1 64 LEU MD2 . . 4.430 3.622 3.031 4.221 . 0 0 "[ . 1 . 2]" 1
953 1 56 ILE HG13 1 86 VAL HA . . 5.150 3.140 2.645 3.609 . 0 0 "[ . 1 . 2]" 1
954 1 56 ILE MG 1 57 GLU H . . 4.160 2.899 2.538 3.418 . 0 0 "[ . 1 . 2]" 1
955 1 56 ILE MG 1 57 GLU HA . . 4.620 3.618 3.345 3.858 . 0 0 "[ . 1 . 2]" 1
956 1 56 ILE MG 1 57 GLU QB . . 3.300 3.074 2.508 3.314 0.014 19 0 "[ . 1 . 2]" 1
957 1 56 ILE MG 1 57 GLU HG2 . . 4.750 3.379 2.762 4.139 . 0 0 "[ . 1 . 2]" 1
958 1 56 ILE MG 1 57 GLU QG . . 3.950 2.391 1.894 3.670 . 0 0 "[ . 1 . 2]" 1
959 1 56 ILE MG 1 57 GLU HG3 . . 4.750 2.754 1.904 4.481 . 0 0 "[ . 1 . 2]" 1
960 1 56 ILE MG 1 62 ASN HA . . 4.510 3.593 3.081 4.224 . 0 0 "[ . 1 . 2]" 1
961 1 56 ILE MG 1 62 ASN HB2 . . 5.500 4.770 4.228 5.374 . 0 0 "[ . 1 . 2]" 1
962 1 56 ILE MG 1 62 ASN HD21 . . 3.800 2.949 2.305 3.599 . 0 0 "[ . 1 . 2]" 1
963 1 56 ILE MG 1 62 ASN HD22 . . 3.680 2.775 1.981 3.660 . 0 0 "[ . 1 . 2]" 1
964 1 56 ILE MG 1 63 VAL H . . 4.410 3.977 3.634 4.246 . 0 0 "[ . 1 . 2]" 1
965 1 56 ILE MG 1 64 LEU H . . 4.450 4.101 3.735 4.420 . 0 0 "[ . 1 . 2]" 1
966 1 56 ILE MG 1 85 LEU HG . . 5.010 4.913 4.707 5.010 . 16 0 "[ . 1 . 2]" 1
967 1 56 ILE MG 1 87 CYS QB . . 5.340 4.518 3.934 4.937 . 0 0 "[ . 1 . 2]" 1
968 1 57 GLU H 1 57 GLU QB . . 3.580 2.654 2.329 3.212 . 0 0 "[ . 1 . 2]" 1
969 1 57 GLU H 1 57 GLU HG2 . . 5.160 3.803 2.352 4.531 . 0 0 "[ . 1 . 2]" 1
970 1 57 GLU H 1 57 GLU QG . . 4.350 2.846 1.967 3.403 . 0 0 "[ . 1 . 2]" 1
971 1 57 GLU H 1 57 GLU HG3 . . 5.160 2.982 1.977 3.529 . 0 0 "[ . 1 . 2]" 1
972 1 57 GLU H 1 85 LEU H . . 3.860 2.782 2.291 3.178 . 0 0 "[ . 1 . 2]" 1
973 1 57 GLU H 1 85 LEU HB2 . . 3.940 3.539 3.072 3.962 0.022 8 0 "[ . 1 . 2]" 1
974 1 57 GLU H 1 85 LEU HB3 . . 3.710 2.160 1.903 2.527 . 0 0 "[ . 1 . 2]" 1
975 1 57 GLU H 1 85 LEU MD1 . . 4.770 4.112 3.873 4.403 . 0 0 "[ . 1 . 2]" 1
976 1 57 GLU H 1 85 LEU MD2 . . 4.380 3.268 2.351 3.873 . 0 0 "[ . 1 . 2]" 1
977 1 57 GLU HA 1 58 VAL H . . 3.020 2.445 2.262 2.609 . 0 0 "[ . 1 . 2]" 1
978 1 57 GLU HA 1 58 VAL HB . . 5.050 4.399 4.274 4.571 . 0 0 "[ . 1 . 2]" 1
979 1 57 GLU HA 1 61 VAL H . . 4.430 3.995 3.696 4.215 . 0 0 "[ . 1 . 2]" 1
980 1 57 GLU HA 1 62 ASN HA . . 3.820 2.856 2.548 3.249 . 0 0 "[ . 1 . 2]" 1
981 1 57 GLU HA 1 63 VAL H . . 3.820 2.384 1.896 2.835 . 0 0 "[ . 1 . 2]" 1
982 1 57 GLU HA 1 63 VAL MG1 . . 3.920 3.392 2.813 3.816 . 0 0 "[ . 1 . 2]" 1
983 1 57 GLU HA 1 63 VAL MG2 . . 3.740 2.386 1.927 2.877 . 0 0 "[ . 1 . 2]" 1
984 1 57 GLU HA 1 64 LEU H . . 4.780 4.661 4.291 4.782 0.002 11 0 "[ . 1 . 2]" 1
985 1 57 GLU HA 1 85 LEU HB3 . . 5.500 4.614 4.239 5.023 . 0 0 "[ . 1 . 2]" 1
986 1 57 GLU QB 1 58 VAL H . . 3.510 2.330 1.989 2.746 . 0 0 "[ . 1 . 2]" 1
987 1 57 GLU QB 1 61 VAL H . . 3.650 2.209 1.955 2.445 . 0 0 "[ . 1 . 2]" 1
988 1 57 GLU QB 1 62 ASN H . . 4.960 4.433 3.475 4.954 . 0 0 "[ . 1 . 2]" 1
989 1 57 GLU QB 1 62 ASN HA . . 3.900 3.245 2.031 3.908 0.008 18 0 "[ . 1 . 2]" 1
990 1 57 GLU QB 1 62 ASN HB2 . . 5.340 4.791 3.743 5.339 . 0 0 "[ . 1 . 2]" 1
991 1 57 GLU QB 1 62 ASN HD21 . . 5.340 4.072 2.604 5.148 . 0 0 "[ . 1 . 2]" 1
992 1 57 GLU QB 1 63 VAL H . . 4.840 4.031 3.050 4.777 . 0 0 "[ . 1 . 2]" 1
993 1 57 GLU QB 1 85 LEU H . . 4.680 3.894 3.084 4.681 0.001 16 0 "[ . 1 . 2]" 1
994 1 57 GLU QB 1 85 LEU HB2 . . 4.340 3.197 2.268 4.227 . 0 0 "[ . 1 . 2]" 1
995 1 57 GLU QB 1 85 LEU HB3 . . 4.000 2.835 1.987 4.013 0.013 14 0 "[ . 1 . 2]" 1
996 1 57 GLU QB 1 85 LEU MD1 . . 3.810 3.135 2.579 3.815 0.005 14 0 "[ . 1 . 2]" 1
997 1 57 GLU HB2 1 58 VAL H . . 4.100 3.216 2.001 3.972 . 0 0 "[ . 1 . 2]" 1
998 1 57 GLU HB2 1 61 VAL H . . 4.240 3.327 1.966 4.210 . 0 0 "[ . 1 . 2]" 1
999 1 57 GLU HB2 1 62 ASN HA . . 4.690 4.138 3.127 4.714 0.024 19 0 "[ . 1 . 2]" 1
1000 1 57 GLU HB3 1 58 VAL H . . 4.100 2.848 2.204 3.818 . 0 0 "[ . 1 . 2]" 1
1001 1 57 GLU HB3 1 61 VAL H . . 4.240 2.764 1.990 3.966 . 0 0 "[ . 1 . 2]" 1
1002 1 57 GLU HB3 1 62 ASN HA . . 4.690 3.415 2.055 4.249 . 0 0 "[ . 1 . 2]" 1
1003 1 57 GLU QG 1 85 LEU MD1 . . 4.250 3.141 1.980 4.112 . 0 0 "[ . 1 . 2]" 1
1004 1 57 GLU QG 1 85 LEU MD2 . . 4.720 3.498 2.636 4.318 . 0 0 "[ . 1 . 2]" 1
1005 1 57 GLU HG2 1 62 ASN HA . . 5.500 2.901 1.992 4.757 . 0 0 "[ . 1 . 2]" 1
1006 1 57 GLU HG2 1 63 VAL H . . 5.500 4.216 2.842 5.524 0.024 14 0 "[ . 1 . 2]" 1
1007 1 57 GLU HG3 1 62 ASN HA . . 5.500 3.619 2.317 5.287 . 0 0 "[ . 1 . 2]" 1
1008 1 57 GLU HG3 1 63 VAL H . . 5.500 4.499 3.541 5.506 0.006 17 0 "[ . 1 . 2]" 1
1009 1 58 VAL H 1 58 VAL HB . . 3.500 3.401 3.230 3.511 0.011 16 0 "[ . 1 . 2]" 1
1010 1 58 VAL H 1 58 VAL MG1 . . 3.900 2.221 1.976 2.449 . 0 0 "[ . 1 . 2]" 1
1011 1 58 VAL H 1 58 VAL MG2 . . 4.160 3.939 3.851 3.999 . 0 0 "[ . 1 . 2]" 1
1012 1 58 VAL H 1 59 ASN H . . 4.840 4.056 3.805 4.344 . 0 0 "[ . 1 . 2]" 1
1013 1 58 VAL H 1 61 VAL H . . 3.560 2.568 2.311 2.874 . 0 0 "[ . 1 . 2]" 1
1014 1 58 VAL H 1 61 VAL HB . . 4.600 4.539 4.334 4.645 0.045 14 0 "[ . 1 . 2]" 1
1015 1 58 VAL H 1 61 VAL MG1 . . 4.730 2.070 1.901 2.386 . 0 0 "[ . 1 . 2]" 1
1016 1 58 VAL H 1 62 ASN H . . 5.470 5.141 4.983 5.256 . 0 0 "[ . 1 . 2]" 1
1017 1 58 VAL H 1 62 ASN HA . . 4.590 4.368 4.074 4.596 0.006 10 0 "[ . 1 . 2]" 1
1018 1 58 VAL H 1 63 VAL H . . 4.590 4.106 3.677 4.564 . 0 0 "[ . 1 . 2]" 1
1019 1 58 VAL H 1 63 VAL MG1 . . 3.390 3.188 2.745 3.393 0.003 18 0 "[ . 1 . 2]" 1
1020 1 58 VAL H 1 63 VAL MG2 . . 3.910 3.280 2.802 3.735 . 0 0 "[ . 1 . 2]" 1
1021 1 58 VAL HA 1 58 VAL MG1 . . 3.470 3.190 3.169 3.202 . 0 0 "[ . 1 . 2]" 1
1022 1 58 VAL HA 1 58 VAL MG2 . . 3.430 2.353 2.212 2.439 . 0 0 "[ . 1 . 2]" 1
1023 1 58 VAL HA 1 59 ASN H . . 3.050 2.162 2.141 2.275 . 0 0 "[ . 1 . 2]" 1
1024 1 58 VAL HA 1 63 VAL MG2 . . 4.740 4.511 4.179 4.741 0.001 18 0 "[ . 1 . 2]" 1
1025 1 58 VAL HA 1 82 VAL MG2 . . 4.700 3.964 3.609 4.544 . 0 0 "[ . 1 . 2]" 1
1026 1 58 VAL HA 1 84 LEU HA . . 4.230 2.860 2.524 3.182 . 0 0 "[ . 1 . 2]" 1
1027 1 58 VAL HA 1 84 LEU QD . . 3.460 2.720 2.033 3.461 0.001 13 0 "[ . 1 . 2]" 1
1028 1 58 VAL HA 1 85 LEU H . . 4.860 4.026 3.574 4.412 . 0 0 "[ . 1 . 2]" 1
1029 1 58 VAL HB 1 63 VAL MG2 . . 3.770 3.059 2.664 3.327 . 0 0 "[ . 1 . 2]" 1
1030 1 58 VAL HB 1 74 ARG HB2 . . 4.870 4.704 3.763 4.873 0.003 13 0 "[ . 1 . 2]" 1
1031 1 58 VAL HB 1 74 ARG QD . . 4.630 4.381 4.143 4.632 0.002 17 0 "[ . 1 . 2]" 1
1032 1 58 VAL MG1 1 59 ASN H . . 4.400 4.072 3.617 4.239 . 0 0 "[ . 1 . 2]" 1
1033 1 58 VAL MG2 1 59 ASN H . . 3.820 2.619 1.921 3.015 . 0 0 "[ . 1 . 2]" 1
1034 1 58 VAL MG2 1 59 ASN HB2 . . 4.710 2.954 2.462 3.504 . 0 0 "[ . 1 . 2]" 1
1035 1 58 VAL MG2 1 59 ASN QB . . 4.040 2.893 2.440 3.356 . 0 0 "[ . 1 . 2]" 1
1036 1 58 VAL MG2 1 59 ASN HB3 . . 4.710 4.207 3.983 4.383 . 0 0 "[ . 1 . 2]" 1
1037 1 58 VAL MG2 1 59 ASN HD21 . . 4.460 2.658 1.855 4.041 . 0 0 "[ . 1 . 2]" 1
1038 1 58 VAL MG2 1 59 ASN QD . . 3.920 2.443 1.844 3.399 . 0 0 "[ . 1 . 2]" 1
1039 1 58 VAL MG2 1 59 ASN HD22 . . 4.460 3.162 2.025 3.931 . 0 0 "[ . 1 . 2]" 1
1040 1 58 VAL MG2 1 63 VAL MG2 . . 4.320 4.092 3.786 4.310 . 0 0 "[ . 1 . 2]" 1
1041 1 58 VAL MG2 1 74 ARG HA . . 4.710 4.430 4.018 4.709 . 0 0 "[ . 1 . 2]" 1
1042 1 58 VAL MG2 1 74 ARG HB2 . . 3.650 3.385 2.995 3.651 0.001 12 0 "[ . 1 . 2]" 1
1043 1 58 VAL MG2 1 74 ARG HB3 . . 4.000 2.407 2.024 2.628 . 0 0 "[ . 1 . 2]" 1
1044 1 58 VAL MG2 1 74 ARG HD2 . . 4.840 4.094 3.333 4.845 0.005 7 0 "[ . 1 . 2]" 1
1045 1 58 VAL MG2 1 74 ARG QD . . 4.100 3.254 2.825 3.684 . 0 0 "[ . 1 . 2]" 1
1046 1 58 VAL MG2 1 74 ARG HD3 . . 4.840 3.479 2.887 4.058 . 0 0 "[ . 1 . 2]" 1
1047 1 58 VAL MG2 1 75 ILE H . . 4.180 3.794 3.333 4.110 . 0 0 "[ . 1 . 2]" 1
1048 1 58 VAL MG2 1 75 ILE HA . . 3.810 3.009 2.518 3.371 . 0 0 "[ . 1 . 2]" 1
1049 1 58 VAL MG2 1 75 ILE HG12 . . 3.620 2.583 2.026 3.048 . 0 0 "[ . 1 . 2]" 1
1050 1 58 VAL MG2 1 75 ILE HG13 . . 4.040 2.993 2.426 3.502 . 0 0 "[ . 1 . 2]" 1
1051 1 58 VAL MG2 1 78 SER QB . . 4.690 3.850 3.457 4.408 . 0 0 "[ . 1 . 2]" 1
1052 1 58 VAL MG2 1 82 VAL MG1 . . 4.470 4.041 3.511 4.418 . 0 0 "[ . 1 . 2]" 1
1053 1 58 VAL MG2 1 82 VAL MG2 . . 3.080 2.339 1.940 2.645 . 0 0 "[ . 1 . 2]" 1
1054 1 58 VAL MG2 1 83 THR H . . 4.550 3.980 3.546 4.545 . 0 0 "[ . 1 . 2]" 1
1055 1 58 VAL MG2 1 84 LEU HG . . 5.030 4.091 2.922 4.650 . 0 0 "[ . 1 . 2]" 1
1056 1 59 ASN H 1 60 GLY H . . 4.130 2.680 2.537 2.948 . 0 0 "[ . 1 . 2]" 1
1057 1 59 ASN H 1 82 VAL MG2 . . 4.430 3.614 2.908 4.060 . 0 0 "[ . 1 . 2]" 1
1058 1 59 ASN H 1 83 THR H . . 4.230 3.617 3.049 4.124 . 0 0 "[ . 1 . 2]" 1
1059 1 59 ASN H 1 83 THR HB . . 3.990 3.082 2.250 3.698 . 0 0 "[ . 1 . 2]" 1
1060 1 59 ASN H 1 83 THR MG . . 4.580 4.032 3.304 4.589 0.009 14 0 "[ . 1 . 2]" 1
1061 1 59 ASN H 1 84 LEU HA . . 4.520 3.985 3.540 4.523 0.003 14 0 "[ . 1 . 2]" 1
1062 1 59 ASN H 1 84 LEU QD . . 4.040 3.644 3.157 4.039 . 0 0 "[ . 1 . 2]" 1
1063 1 59 ASN HA 1 83 THR HB . . 3.950 3.137 2.486 3.887 . 0 0 "[ . 1 . 2]" 1
1064 1 59 ASN QB 1 61 VAL H . . 5.040 4.922 4.709 5.042 0.002 16 0 "[ . 1 . 2]" 1
1065 1 59 ASN QB 1 61 VAL MG1 . . 4.290 3.319 2.996 3.643 . 0 0 "[ . 1 . 2]" 1
1066 1 59 ASN HB2 1 61 VAL MG1 . . 5.040 3.427 3.114 3.814 . 0 0 "[ . 1 . 2]" 1
1067 1 59 ASN HB3 1 61 VAL MG1 . . 5.040 4.490 3.894 4.842 . 0 0 "[ . 1 . 2]" 1
1068 1 59 ASN QD 1 78 SER HA . . 4.520 3.626 2.779 4.521 0.001 18 0 "[ . 1 . 2]" 1
1069 1 59 ASN QD 1 78 SER QB . . 3.650 2.685 2.154 3.532 . 0 0 "[ . 1 . 2]" 1
1070 1 59 ASN QD 1 82 VAL HA . . 4.480 3.584 2.304 4.475 . 0 0 "[ . 1 . 2]" 1
1071 1 59 ASN QD 1 82 VAL MG2 . . 3.580 2.353 1.811 3.472 . 0 0 "[ . 1 . 2]" 1
1072 1 59 ASN QD 1 83 THR H . . 4.500 3.733 2.193 4.457 . 0 0 "[ . 1 . 2]" 1
1073 1 59 ASN HD21 1 82 VAL MG2 . . 4.290 3.279 2.277 4.295 0.005 8 0 "[ . 1 . 2]" 1
1074 1 59 ASN HD22 1 82 VAL MG2 . . 4.290 2.443 1.829 3.666 . 0 0 "[ . 1 . 2]" 1
1075 1 60 GLY H 1 61 VAL H . . 3.790 2.753 2.591 3.007 . 0 0 "[ . 1 . 2]" 1
1076 1 61 VAL H 1 61 VAL HB . . 3.440 3.400 3.299 3.473 0.033 18 0 "[ . 1 . 2]" 1
1077 1 61 VAL H 1 61 VAL MG1 . . 3.160 2.601 2.455 2.823 . 0 0 "[ . 1 . 2]" 1
1078 1 61 VAL H 1 61 VAL MG2 . . 4.040 4.050 3.994 4.075 0.035 2 0 "[ . 1 . 2]" 1
1079 1 61 VAL H 1 62 ASN H . . 4.580 4.096 3.900 4.263 . 0 0 "[ . 1 . 2]" 1
1080 1 61 VAL HA 1 61 VAL MG1 . . 3.260 3.182 3.168 3.192 . 0 0 "[ . 1 . 2]" 1
1081 1 61 VAL HA 1 61 VAL MG2 . . 3.190 2.205 2.047 2.314 . 0 0 "[ . 1 . 2]" 1
1082 1 61 VAL HA 1 62 ASN H . . 2.790 2.178 2.142 2.262 . 0 0 "[ . 1 . 2]" 1
1083 1 61 VAL HA 1 62 ASN HB2 . . 4.840 4.342 4.218 4.650 . 0 0 "[ . 1 . 2]" 1
1084 1 61 VAL HA 1 62 ASN HB3 . . 5.290 4.881 4.526 5.028 . 0 0 "[ . 1 . 2]" 1
1085 1 61 VAL HB 1 62 ASN H . . 4.640 4.237 4.105 4.419 . 0 0 "[ . 1 . 2]" 1
1086 1 61 VAL MG1 1 62 ASN H . . 3.920 3.756 3.316 3.948 0.028 10 0 "[ . 1 . 2]" 1
1087 1 61 VAL MG2 1 62 ASN H . . 3.300 2.289 1.911 2.655 . 0 0 "[ . 1 . 2]" 1
1088 1 61 VAL MG2 1 62 ASN HA . . 5.040 4.267 4.052 4.600 . 0 0 "[ . 1 . 2]" 1
1089 1 61 VAL MG2 1 62 ASN HB3 . . 5.020 4.060 3.756 4.461 . 0 0 "[ . 1 . 2]" 1
1090 1 62 ASN H 1 62 ASN HB2 . . 3.050 2.421 2.248 2.702 . 0 0 "[ . 1 . 2]" 1
1091 1 62 ASN H 1 62 ASN HB3 . . 3.330 2.719 2.395 2.875 . 0 0 "[ . 1 . 2]" 1
1092 1 62 ASN H 1 62 ASN HD21 . . 4.600 4.258 3.952 4.587 . 0 0 "[ . 1 . 2]" 1
1093 1 62 ASN H 1 63 VAL H . . 4.740 4.339 4.151 4.511 . 0 0 "[ . 1 . 2]" 1
1094 1 62 ASN HA 1 62 ASN HD21 . . 4.740 2.517 2.164 3.077 . 0 0 "[ . 1 . 2]" 1
1095 1 62 ASN HA 1 63 VAL H . . 3.230 2.170 2.140 2.251 . 0 0 "[ . 1 . 2]" 1
1096 1 62 ASN HA 1 63 VAL MG1 . . 5.250 3.963 3.782 4.199 . 0 0 "[ . 1 . 2]" 1
1097 1 62 ASN HA 1 63 VAL MG2 . . 4.090 3.781 3.596 3.943 . 0 0 "[ . 1 . 2]" 1
1098 1 62 ASN HA 1 64 LEU H . . 4.170 3.506 3.278 3.766 . 0 0 "[ . 1 . 2]" 1
1099 1 62 ASN HB2 1 62 ASN HD21 . . 3.460 2.394 2.185 2.547 . 0 0 "[ . 1 . 2]" 1
1100 1 62 ASN HB2 1 62 ASN HD22 . . 3.700 3.545 3.460 3.609 . 0 0 "[ . 1 . 2]" 1
1101 1 62 ASN HB2 1 63 VAL H . . 4.890 4.514 4.353 4.605 . 0 0 "[ . 1 . 2]" 1
1102 1 62 ASN HB3 1 63 VAL H . . 5.190 4.250 4.003 4.488 . 0 0 "[ . 1 . 2]" 1
1103 1 62 ASN HB3 1 63 VAL HA . . 5.140 4.674 4.450 4.992 . 0 0 "[ . 1 . 2]" 1
1104 1 62 ASN HB3 1 64 LEU HB2 . . 5.500 4.828 4.314 5.407 . 0 0 "[ . 1 . 2]" 1
1105 1 62 ASN HD21 1 64 LEU HB2 . . 5.500 4.669 3.465 5.248 . 0 0 "[ . 1 . 2]" 1
1106 1 62 ASN HD21 1 64 LEU MD1 . . 4.410 3.609 2.648 4.288 . 0 0 "[ . 1 . 2]" 1
1107 1 62 ASN HD22 1 64 LEU HB2 . . 4.280 3.448 2.031 4.250 . 0 0 "[ . 1 . 2]" 1
1108 1 62 ASN HD22 1 64 LEU MD1 . . 3.790 2.207 1.865 2.926 . 0 0 "[ . 1 . 2]" 1
1109 1 62 ASN HD22 1 64 LEU HG . . 4.760 3.154 2.470 4.014 . 0 0 "[ . 1 . 2]" 1
1110 1 63 VAL H 1 63 VAL MG1 . . 3.800 2.788 2.469 3.097 . 0 0 "[ . 1 . 2]" 1
1111 1 63 VAL H 1 63 VAL MG2 . . 3.300 2.040 1.887 2.297 . 0 0 "[ . 1 . 2]" 1
1112 1 63 VAL H 1 64 LEU H . . 3.260 2.539 2.002 3.048 . 0 0 "[ . 1 . 2]" 1
1113 1 63 VAL H 1 64 LEU HA . . 5.200 4.435 4.220 4.718 . 0 0 "[ . 1 . 2]" 1
1114 1 63 VAL H 1 64 LEU HB2 . . 5.300 4.548 4.054 4.932 . 0 0 "[ . 1 . 2]" 1
1115 1 63 VAL HA 1 63 VAL MG1 . . 3.190 2.274 2.133 2.385 . 0 0 "[ . 1 . 2]" 1
1116 1 63 VAL HA 1 65 ASP H . . 4.360 3.996 3.686 4.323 . 0 0 "[ . 1 . 2]" 1
1117 1 63 VAL HA 1 66 GLU H . . 4.060 3.135 3.019 3.297 . 0 0 "[ . 1 . 2]" 1
1118 1 63 VAL HA 1 66 GLU HB2 . . 4.030 3.009 2.695 3.345 . 0 0 "[ . 1 . 2]" 1
1119 1 63 VAL HA 1 66 GLU HG2 . . 4.100 2.410 2.002 3.790 . 0 0 "[ . 1 . 2]" 1
1120 1 63 VAL HA 1 66 GLU QG . . 3.550 2.132 1.851 2.500 . 0 0 "[ . 1 . 2]" 1
1121 1 63 VAL HA 1 66 GLU HG3 . . 4.100 2.748 2.019 3.905 . 0 0 "[ . 1 . 2]" 1
1122 1 63 VAL HA 1 71 VAL MG1 . . 4.100 3.987 3.741 4.108 0.008 13 0 "[ . 1 . 2]" 1
1123 1 63 VAL HB 1 66 GLU H . . 4.530 4.097 3.749 4.311 . 0 0 "[ . 1 . 2]" 1
1124 1 63 VAL HB 1 66 GLU HB2 . . 3.750 2.233 2.014 2.433 . 0 0 "[ . 1 . 2]" 1
1125 1 63 VAL HB 1 66 GLU HG2 . . 4.880 3.473 2.701 4.454 . 0 0 "[ . 1 . 2]" 1
1126 1 63 VAL HB 1 66 GLU QG . . 4.220 2.734 2.315 3.162 . 0 0 "[ . 1 . 2]" 1
1127 1 63 VAL HB 1 66 GLU HG3 . . 4.880 3.000 2.369 4.356 . 0 0 "[ . 1 . 2]" 1
1128 1 63 VAL HB 1 71 VAL H . . 4.930 4.708 4.514 4.931 0.001 10 0 "[ . 1 . 2]" 1
1129 1 63 VAL HB 1 71 VAL HA . . 4.420 3.569 3.192 3.756 . 0 0 "[ . 1 . 2]" 1
1130 1 63 VAL HB 1 71 VAL HB . . 5.420 4.299 3.776 4.530 . 0 0 "[ . 1 . 2]" 1
1131 1 63 VAL HB 1 71 VAL MG1 . . 3.110 2.005 1.886 2.184 . 0 0 "[ . 1 . 2]" 1
1132 1 63 VAL HB 1 71 VAL MG2 . . 4.910 4.729 4.497 4.872 . 0 0 "[ . 1 . 2]" 1
1133 1 63 VAL MG1 1 64 LEU H . . 4.520 4.317 4.232 4.378 . 0 0 "[ . 1 . 2]" 1
1134 1 63 VAL MG1 1 66 GLU H . . 4.740 4.682 4.535 4.746 0.006 14 0 "[ . 1 . 2]" 1
1135 1 63 VAL MG1 1 66 GLU HG2 . . 4.180 3.349 2.100 4.150 . 0 0 "[ . 1 . 2]" 1
1136 1 63 VAL MG1 1 66 GLU HG3 . . 4.180 2.718 2.152 3.967 . 0 0 "[ . 1 . 2]" 1
1137 1 63 VAL MG1 1 71 VAL HA . . 3.670 3.446 2.963 3.671 0.001 10 0 "[ . 1 . 2]" 1
1138 1 63 VAL MG1 1 74 ARG HB3 . . 4.650 4.221 3.666 4.527 . 0 0 "[ . 1 . 2]" 1
1139 1 63 VAL MG1 1 74 ARG HD2 . . 3.670 2.444 1.984 3.256 . 0 0 "[ . 1 . 2]" 1
1140 1 63 VAL MG1 1 74 ARG QD . . 3.130 2.172 1.970 2.349 . 0 0 "[ . 1 . 2]" 1
1141 1 63 VAL MG1 1 74 ARG HD3 . . 3.670 3.079 2.155 3.674 0.004 14 0 "[ . 1 . 2]" 1
1142 1 63 VAL MG1 1 74 ARG HG2 . . 4.910 4.701 3.669 4.914 0.004 5 0 "[ . 1 . 2]" 1
1143 1 63 VAL MG1 1 74 ARG QG . . 4.030 3.690 2.197 3.933 . 0 0 "[ . 1 . 2]" 1
1144 1 63 VAL MG1 1 74 ARG HG3 . . 4.910 3.867 2.214 4.151 . 0 0 "[ . 1 . 2]" 1
1145 1 63 VAL MG2 1 64 LEU H . . 3.960 3.405 3.092 3.713 . 0 0 "[ . 1 . 2]" 1
1146 1 63 VAL MG2 1 64 LEU HA . . 4.510 3.665 3.409 3.883 . 0 0 "[ . 1 . 2]" 1
1147 1 63 VAL MG2 1 66 GLU HB2 . . 3.880 3.665 3.356 3.884 0.004 14 0 "[ . 1 . 2]" 1
1148 1 63 VAL MG2 1 71 VAL HB . . 4.700 3.224 2.932 3.539 . 0 0 "[ . 1 . 2]" 1
1149 1 63 VAL MG2 1 71 VAL MG1 . . 3.230 2.024 1.860 2.254 . 0 0 "[ . 1 . 2]" 1
1150 1 64 LEU H 1 64 LEU HB2 . . 2.980 2.203 2.151 2.263 . 0 0 "[ . 1 . 2]" 1
1151 1 64 LEU H 1 64 LEU HB3 . . 3.730 3.504 3.465 3.540 . 0 0 "[ . 1 . 2]" 1
1152 1 64 LEU H 1 64 LEU MD1 . . 4.360 3.747 3.289 3.945 . 0 0 "[ . 1 . 2]" 1
1153 1 64 LEU H 1 64 LEU MD2 . . 4.070 3.840 3.624 4.086 0.016 11 0 "[ . 1 . 2]" 1
1154 1 64 LEU H 1 64 LEU HG . . 3.440 2.883 2.738 3.117 . 0 0 "[ . 1 . 2]" 1
1155 1 64 LEU H 1 65 ASP H . . 3.410 2.823 2.556 3.024 . 0 0 "[ . 1 . 2]" 1
1156 1 64 LEU H 1 66 GLU H . . 4.420 3.981 3.650 4.262 . 0 0 "[ . 1 . 2]" 1
1157 1 64 LEU HA 1 64 LEU MD1 . . 3.750 3.801 3.763 3.825 0.075 16 0 "[ . 1 . 2]" 1
1158 1 64 LEU HA 1 64 LEU MD2 . . 3.110 2.064 1.941 2.531 . 0 0 "[ . 1 . 2]" 1
1159 1 64 LEU HA 1 64 LEU HG . . 3.880 2.780 2.485 2.987 . 0 0 "[ . 1 . 2]" 1
1160 1 64 LEU HA 1 66 GLU H . . 4.680 4.467 3.921 4.671 . 0 0 "[ . 1 . 2]" 1
1161 1 64 LEU HB2 1 64 LEU MD1 . . 3.340 2.317 2.017 2.480 . 0 0 "[ . 1 . 2]" 1
1162 1 64 LEU HB2 1 65 ASP H . . 3.720 2.578 2.399 2.765 . 0 0 "[ . 1 . 2]" 1
1163 1 64 LEU HB3 1 64 LEU MD1 . . 3.380 2.352 2.187 2.681 . 0 0 "[ . 1 . 2]" 1
1164 1 64 LEU HB3 1 64 LEU MD2 . . 3.320 2.316 2.045 2.401 . 0 0 "[ . 1 . 2]" 1
1165 1 64 LEU HB3 1 65 ASP H . . 4.150 3.022 2.800 3.244 . 0 0 "[ . 1 . 2]" 1
1166 1 64 LEU MD1 1 65 ASP H . . 5.090 4.387 4.235 4.508 . 0 0 "[ . 1 . 2]" 1
1167 1 64 LEU MD2 1 65 ASP H . . 5.500 4.516 4.388 4.706 . 0 0 "[ . 1 . 2]" 1
1168 1 65 ASP H 1 65 ASP HB2 . . 3.840 2.455 2.190 2.784 . 0 0 "[ . 1 . 2]" 1
1169 1 65 ASP H 1 65 ASP QB . . 3.230 2.360 2.169 2.690 . 0 0 "[ . 1 . 2]" 1
1170 1 65 ASP H 1 65 ASP HB3 . . 3.840 3.283 2.454 3.597 . 0 0 "[ . 1 . 2]" 1
1171 1 65 ASP H 1 66 GLU H . . 3.230 2.600 2.486 2.785 . 0 0 "[ . 1 . 2]" 1
1172 1 65 ASP HB2 1 66 GLU H . . 4.700 3.115 2.495 3.951 . 0 0 "[ . 1 . 2]" 1
1173 1 65 ASP HB3 1 66 GLU H . . 4.700 3.407 2.494 4.130 . 0 0 "[ . 1 . 2]" 1
1174 1 66 GLU H 1 66 GLU HB2 . . 3.080 2.566 2.340 2.715 . 0 0 "[ . 1 . 2]" 1
1175 1 66 GLU H 1 66 GLU HG2 . . 3.980 2.335 1.899 3.536 . 0 0 "[ . 1 . 2]" 1
1176 1 66 GLU H 1 66 GLU QG . . 3.490 2.215 1.890 3.299 . 0 0 "[ . 1 . 2]" 1
1177 1 66 GLU H 1 66 GLU HG3 . . 3.980 3.471 2.113 3.950 . 0 0 "[ . 1 . 2]" 1
1178 1 66 GLU H 1 67 PRO HD2 . . 4.810 4.755 4.730 4.803 . 0 0 "[ . 1 . 2]" 1
1179 1 66 GLU H 1 67 PRO HD3 . . 5.160 4.921 4.851 5.030 . 0 0 "[ . 1 . 2]" 1
1180 1 66 GLU H 1 71 VAL MG1 . . 4.460 4.241 3.969 4.467 0.007 16 0 "[ . 1 . 2]" 1
1181 1 66 GLU HA 1 66 GLU HG2 . . 4.020 3.064 2.430 3.722 . 0 0 "[ . 1 . 2]" 1
1182 1 66 GLU HA 1 66 GLU QG . . 3.420 2.849 2.368 3.060 . 0 0 "[ . 1 . 2]" 1
1183 1 66 GLU HA 1 66 GLU HG3 . . 4.020 3.593 2.778 3.851 . 0 0 "[ . 1 . 2]" 1
1184 1 66 GLU HA 1 67 PRO HD2 . . 3.310 2.290 2.223 2.367 . 0 0 "[ . 1 . 2]" 1
1185 1 66 GLU HA 1 67 PRO HD3 . . 3.150 2.266 2.253 2.286 . 0 0 "[ . 1 . 2]" 1
1186 1 66 GLU HA 1 67 PRO HG2 . . 4.660 4.423 4.370 4.486 . 0 0 "[ . 1 . 2]" 1
1187 1 66 GLU HA 1 67 PRO QG . . 4.050 3.935 3.896 3.981 . 0 0 "[ . 1 . 2]" 1
1188 1 66 GLU HA 1 67 PRO HG3 . . 4.660 4.410 4.377 4.451 . 0 0 "[ . 1 . 2]" 1
1189 1 66 GLU HB2 1 71 VAL MG1 . . 3.530 2.351 2.014 2.545 . 0 0 "[ . 1 . 2]" 1
1190 1 66 GLU HB3 1 67 PRO HD2 . . 3.680 2.259 2.096 2.401 . 0 0 "[ . 1 . 2]" 1
1191 1 66 GLU HB3 1 67 PRO HD3 . . 3.800 3.671 3.524 3.789 . 0 0 "[ . 1 . 2]" 1
1192 1 66 GLU QG 1 67 PRO HD2 . . 4.170 3.761 2.931 4.051 . 0 0 "[ . 1 . 2]" 1
1193 1 66 GLU HG2 1 67 PRO HD2 . . 4.820 4.401 3.474 4.705 . 0 0 "[ . 1 . 2]" 1
1194 1 66 GLU HG2 1 71 VAL MG1 . . 4.490 4.270 3.722 4.489 . 0 0 "[ . 1 . 2]" 1
1195 1 66 GLU HG3 1 67 PRO HD2 . . 4.820 4.191 2.987 4.772 . 0 0 "[ . 1 . 2]" 1
1196 1 66 GLU HG3 1 71 VAL MG1 . . 4.490 3.856 3.516 4.459 . 0 0 "[ . 1 . 2]" 1
1197 1 67 PRO HA 1 68 TYR H . . 3.220 2.521 2.273 2.727 . 0 0 "[ . 1 . 2]" 1
1198 1 67 PRO HA 1 68 TYR HA . . 4.580 4.331 4.307 4.370 . 0 0 "[ . 1 . 2]" 1
1199 1 67 PRO HA 1 68 TYR HB3 . . 5.470 4.632 4.492 4.779 . 0 0 "[ . 1 . 2]" 1
1200 1 67 PRO HA 1 69 GLU H . . 4.710 4.315 3.974 4.588 . 0 0 "[ . 1 . 2]" 1
1201 1 67 PRO HB2 1 68 TYR H . . 4.230 2.353 1.893 2.970 . 0 0 "[ . 1 . 2]" 1
1202 1 67 PRO HB2 1 69 GLU H . . 3.870 2.381 2.302 2.518 . 0 0 "[ . 1 . 2]" 1
1203 1 67 PRO HB2 1 70 LYS H . . 3.720 3.144 2.986 3.298 . 0 0 "[ . 1 . 2]" 1
1204 1 67 PRO HB3 1 68 TYR H . . 4.150 3.343 3.144 3.647 . 0 0 "[ . 1 . 2]" 1
1205 1 67 PRO HB3 1 69 GLU H . . 4.500 4.123 4.034 4.271 . 0 0 "[ . 1 . 2]" 1
1206 1 67 PRO HB3 1 69 GLU HB2 . . 5.500 4.829 4.571 5.108 . 0 0 "[ . 1 . 2]" 1
1207 1 67 PRO HB3 1 70 LYS H . . 4.790 4.563 4.434 4.695 . 0 0 "[ . 1 . 2]" 1
1208 1 67 PRO HB3 1 70 LYS QB . . 5.340 4.564 4.243 4.746 . 0 0 "[ . 1 . 2]" 1
1209 1 67 PRO HD2 1 70 LYS QB . . 3.770 2.059 1.969 2.194 . 0 0 "[ . 1 . 2]" 1
1210 1 67 PRO HD2 1 70 LYS HD2 . . 5.030 4.464 3.813 5.013 . 0 0 "[ . 1 . 2]" 1
1211 1 67 PRO HD2 1 70 LYS QD . . 4.300 3.822 3.376 4.324 0.024 11 0 "[ . 1 . 2]" 1
1212 1 67 PRO HD2 1 70 LYS HD3 . . 5.030 4.378 3.458 5.005 . 0 0 "[ . 1 . 2]" 1
1213 1 67 PRO HD2 1 70 LYS HG2 . . 4.780 3.112 2.384 3.665 . 0 0 "[ . 1 . 2]" 1
1214 1 67 PRO HD2 1 70 LYS QG . . 4.210 2.314 2.060 2.800 . 0 0 "[ . 1 . 2]" 1
1215 1 67 PRO HD2 1 70 LYS HG3 . . 4.780 2.911 2.080 4.323 . 0 0 "[ . 1 . 2]" 1
1216 1 67 PRO HD3 1 70 LYS QB . . 4.470 3.585 3.386 3.736 . 0 0 "[ . 1 . 2]" 1
1217 1 67 PRO QG 1 70 LYS QD . . 4.760 3.375 1.927 4.357 . 0 0 "[ . 1 . 2]" 1
1218 1 67 PRO QG 1 70 LYS QE . . 5.180 3.887 2.857 5.005 . 0 0 "[ . 1 . 2]" 1
1219 1 67 PRO HG2 1 70 LYS H . . 4.050 2.230 2.040 2.378 . 0 0 "[ . 1 . 2]" 1
1220 1 67 PRO HG3 1 70 LYS H . . 4.050 3.942 3.745 4.087 0.037 13 0 "[ . 1 . 2]" 1
1221 1 68 TYR H 1 68 TYR HB2 . . 3.700 2.985 2.870 3.143 . 0 0 "[ . 1 . 2]" 1
1222 1 68 TYR H 1 68 TYR HB3 . . 3.630 2.221 2.178 2.302 . 0 0 "[ . 1 . 2]" 1
1223 1 68 TYR H 1 68 TYR QD . . 4.170 3.922 3.822 4.016 . 0 0 "[ . 1 . 2]" 1
1224 1 68 TYR H 1 69 GLU H . . 3.950 2.473 2.206 2.716 . 0 0 "[ . 1 . 2]" 1
1225 1 68 TYR HA 1 68 TYR QD . . 3.520 3.099 2.868 3.357 . 0 0 "[ . 1 . 2]" 1
1226 1 68 TYR HA 1 71 VAL H . . 4.020 3.591 3.511 3.687 . 0 0 "[ . 1 . 2]" 1
1227 1 68 TYR HA 1 71 VAL HB . . 4.680 4.554 4.450 4.687 0.007 19 0 "[ . 1 . 2]" 1
1228 1 68 TYR HA 1 71 VAL MG1 . . 3.750 3.492 3.250 3.710 . 0 0 "[ . 1 . 2]" 1
1229 1 68 TYR HA 1 72 VAL H . . 4.460 3.780 3.529 4.082 . 0 0 "[ . 1 . 2]" 1
1230 1 68 TYR HB2 1 69 GLU H . . 4.240 4.213 4.128 4.258 0.018 17 0 "[ . 1 . 2]" 1
1231 1 68 TYR HB3 1 69 GLU H . . 3.470 3.023 2.876 3.098 . 0 0 "[ . 1 . 2]" 1
1232 1 68 TYR HB3 1 71 VAL MG2 . . 5.010 4.255 4.183 4.361 . 0 0 "[ . 1 . 2]" 1
1233 1 68 TYR QD 1 69 GLU H . . 3.780 3.099 2.554 3.509 . 0 0 "[ . 1 . 2]" 1
1234 1 68 TYR QD 1 69 GLU HA . . 4.080 3.228 2.533 3.699 . 0 0 "[ . 1 . 2]" 1
1235 1 68 TYR QD 1 69 GLU HB3 . . 5.080 4.758 4.275 5.078 . 0 0 "[ . 1 . 2]" 1
1236 1 68 TYR QD 1 69 GLU QG . . 4.250 2.448 2.083 2.803 . 0 0 "[ . 1 . 2]" 1
1237 1 68 TYR QD 1 71 VAL MG2 . . 4.730 3.346 3.032 3.730 . 0 0 "[ . 1 . 2]" 1
1238 1 68 TYR QD 1 72 VAL MG1 . . 4.100 3.728 3.330 3.967 . 0 0 "[ . 1 . 2]" 1
1239 1 68 TYR QE 1 72 VAL MG1 . . 3.630 3.472 3.047 3.643 0.013 12 0 "[ . 1 . 2]" 1
1240 1 68 TYR QE 1 72 VAL MG2 . . 4.600 3.708 3.205 4.347 . 0 0 "[ . 1 . 2]" 1
1241 1 69 GLU H 1 69 GLU HB2 . . 3.200 2.454 2.368 2.578 . 0 0 "[ . 1 . 2]" 1
1242 1 69 GLU H 1 69 GLU HB3 . . 3.680 3.594 3.582 3.608 . 0 0 "[ . 1 . 2]" 1
1243 1 69 GLU H 1 69 GLU HG2 . . 4.130 3.156 2.110 3.771 . 0 0 "[ . 1 . 2]" 1
1244 1 69 GLU H 1 69 GLU QG . . 3.590 2.304 2.022 2.531 . 0 0 "[ . 1 . 2]" 1
1245 1 69 GLU H 1 69 GLU HG3 . . 4.130 2.709 2.036 3.740 . 0 0 "[ . 1 . 2]" 1
1246 1 69 GLU H 1 70 LYS H . . 3.450 2.496 2.417 2.560 . 0 0 "[ . 1 . 2]" 1
1247 1 69 GLU H 1 71 VAL H . . 4.760 4.305 4.147 4.528 . 0 0 "[ . 1 . 2]" 1
1248 1 69 GLU HA 1 69 GLU HG2 . . 4.060 2.662 2.330 3.014 . 0 0 "[ . 1 . 2]" 1
1249 1 69 GLU HA 1 69 GLU QG . . 3.440 2.536 2.283 2.907 . 0 0 "[ . 1 . 2]" 1
1250 1 69 GLU HA 1 69 GLU HG3 . . 4.060 3.266 2.834 3.819 . 0 0 "[ . 1 . 2]" 1
1251 1 69 GLU HA 1 71 VAL H . . 5.300 4.891 4.647 5.110 . 0 0 "[ . 1 . 2]" 1
1252 1 69 GLU HA 1 71 VAL MG2 . . 4.740 4.309 4.179 4.474 . 0 0 "[ . 1 . 2]" 1
1253 1 69 GLU HA 1 72 VAL H . . 4.170 3.937 3.743 4.148 . 0 0 "[ . 1 . 2]" 1
1254 1 69 GLU HA 1 72 VAL HB . . 4.050 4.033 3.974 4.087 0.037 12 0 "[ . 1 . 2]" 1
1255 1 69 GLU HA 1 72 VAL MG1 . . 3.710 2.035 1.877 2.291 . 0 0 "[ . 1 . 2]" 1
1256 1 69 GLU HA 1 72 VAL MG2 . . 4.650 4.369 4.219 4.577 . 0 0 "[ . 1 . 2]" 1
1257 1 69 GLU HA 1 73 ASP H . . 4.460 4.030 3.754 4.480 0.020 13 0 "[ . 1 . 2]" 1
1258 1 69 GLU HB2 1 70 LYS H . . 4.580 2.888 2.714 3.035 . 0 0 "[ . 1 . 2]" 1
1259 1 69 GLU HB3 1 70 LYS H . . 5.120 3.850 3.698 4.005 . 0 0 "[ . 1 . 2]" 1
1260 1 69 GLU QG 1 70 LYS H . . 4.240 4.142 4.008 4.241 0.001 9 0 "[ . 1 . 2]" 1
1261 1 70 LYS H 1 70 LYS HB2 . . 3.520 2.283 2.173 3.018 . 0 0 "[ . 1 . 2]" 1
1262 1 70 LYS H 1 70 LYS QB . . 2.830 2.179 2.153 2.229 . 0 0 "[ . 1 . 2]" 1
1263 1 70 LYS H 1 70 LYS HB3 . . 3.520 3.371 2.215 3.538 0.018 13 0 "[ . 1 . 2]" 1
1264 1 70 LYS H 1 70 LYS HG2 . . 4.420 3.469 2.950 4.494 0.074 11 0 "[ . 1 . 2]" 1
1265 1 70 LYS H 1 70 LYS QG . . 3.720 3.231 2.846 3.805 0.085 20 0 "[ . 1 . 2]" 1
1266 1 70 LYS H 1 70 LYS HG3 . . 4.420 3.978 3.685 4.323 . 0 0 "[ . 1 . 2]" 1
1267 1 70 LYS H 1 71 VAL H . . 3.030 2.541 2.465 2.665 . 0 0 "[ . 1 . 2]" 1
1268 1 70 LYS H 1 71 VAL HA . . 5.350 5.154 5.084 5.235 . 0 0 "[ . 1 . 2]" 1
1269 1 70 LYS H 1 71 VAL MG1 . . 4.390 4.228 4.085 4.366 . 0 0 "[ . 1 . 2]" 1
1270 1 70 LYS H 1 72 VAL H . . 4.130 3.945 3.762 4.134 0.004 2 0 "[ . 1 . 2]" 1
1271 1 70 LYS HA 1 70 LYS HD2 . . 4.140 2.946 1.996 4.090 . 0 0 "[ . 1 . 2]" 1
1272 1 70 LYS HA 1 70 LYS HD3 . . 4.140 2.873 2.091 4.168 0.028 20 0 "[ . 1 . 2]" 1
1273 1 70 LYS HA 1 70 LYS HG2 . . 4.120 2.999 2.402 3.953 . 0 0 "[ . 1 . 2]" 1
1274 1 70 LYS HA 1 70 LYS QG . . 3.560 2.565 2.370 3.152 . 0 0 "[ . 1 . 2]" 1
1275 1 70 LYS HA 1 70 LYS HG3 . . 4.120 3.297 2.532 3.662 . 0 0 "[ . 1 . 2]" 1
1276 1 70 LYS HA 1 72 VAL H . . 5.020 4.487 4.268 4.729 . 0 0 "[ . 1 . 2]" 1
1277 1 70 LYS HA 1 73 ASP H . . 3.770 3.659 3.371 3.778 0.008 16 0 "[ . 1 . 2]" 1
1278 1 70 LYS HA 1 73 ASP QB . . 3.230 2.838 2.459 3.048 . 0 0 "[ . 1 . 2]" 1
1279 1 70 LYS HA 1 74 ARG H . . 4.770 4.292 3.969 4.774 0.004 20 0 "[ . 1 . 2]" 1
1280 1 70 LYS QB 1 71 VAL H . . 3.390 2.481 2.351 2.622 . 0 0 "[ . 1 . 2]" 1
1281 1 70 LYS HB2 1 71 VAL MG1 . . 5.370 3.746 3.416 5.059 . 0 0 "[ . 1 . 2]" 1
1282 1 70 LYS HB3 1 71 VAL MG1 . . 5.370 3.762 3.406 3.980 . 0 0 "[ . 1 . 2]" 1
1283 1 70 LYS QD 1 73 ASP QB . . 4.320 3.933 3.416 4.373 0.053 13 0 "[ . 1 . 2]" 1
1284 1 70 LYS QE 1 70 LYS QG . . 3.300 2.208 2.053 2.573 . 0 0 "[ . 1 . 2]" 1
1285 1 70 LYS QG 1 71 VAL H . . 4.700 4.131 2.665 4.441 . 0 0 "[ . 1 . 2]" 1
1286 1 71 VAL H 1 71 VAL HB . . 3.760 3.611 3.604 3.618 . 0 0 "[ . 1 . 2]" 1
1287 1 71 VAL H 1 71 VAL MG1 . . 3.000 2.278 2.091 2.431 . 0 0 "[ . 1 . 2]" 1
1288 1 71 VAL H 1 71 VAL MG2 . . 3.640 1.950 1.876 2.104 . 0 0 "[ . 1 . 2]" 1
1289 1 71 VAL H 1 72 VAL H . . 3.270 2.775 2.658 2.957 . 0 0 "[ . 1 . 2]" 1
1290 1 71 VAL H 1 72 VAL HB . . 5.290 5.179 5.094 5.252 . 0 0 "[ . 1 . 2]" 1
1291 1 71 VAL H 1 72 VAL MG1 . . 4.330 3.855 3.645 4.041 . 0 0 "[ . 1 . 2]" 1
1292 1 71 VAL HA 1 71 VAL MG1 . . 3.220 2.277 2.189 2.396 . 0 0 "[ . 1 . 2]" 1
1293 1 71 VAL HA 1 71 VAL MG2 . . 3.250 3.193 3.180 3.201 . 0 0 "[ . 1 . 2]" 1
1294 1 71 VAL HA 1 74 ARG H . . 3.830 3.668 3.507 3.778 . 0 0 "[ . 1 . 2]" 1
1295 1 71 VAL HA 1 74 ARG HB2 . . 3.790 2.844 2.684 3.144 . 0 0 "[ . 1 . 2]" 1
1296 1 71 VAL HA 1 74 ARG HB3 . . 4.450 4.373 4.150 4.484 0.034 13 0 "[ . 1 . 2]" 1
1297 1 71 VAL HA 1 74 ARG QD . . 4.320 3.623 2.958 4.261 . 0 0 "[ . 1 . 2]" 1
1298 1 71 VAL HA 1 74 ARG QG . . 4.000 3.430 2.256 3.936 . 0 0 "[ . 1 . 2]" 1
1299 1 71 VAL HB 1 72 VAL H . . 3.670 3.562 3.369 3.655 . 0 0 "[ . 1 . 2]" 1
1300 1 71 VAL HB 1 72 VAL MG1 . . 5.210 5.198 5.122 5.232 0.022 13 0 "[ . 1 . 2]" 1
1301 1 71 VAL MG1 1 72 VAL H . . 4.030 3.923 3.817 4.012 . 0 0 "[ . 1 . 2]" 1
1302 1 71 VAL MG2 1 72 VAL H . . 3.350 1.944 1.766 2.066 . 0 0 "[ . 1 . 2]" 1
1303 1 72 VAL H 1 72 VAL HB . . 3.130 2.544 2.421 2.642 . 0 0 "[ . 1 . 2]" 1
1304 1 72 VAL H 1 72 VAL MG1 . . 3.060 2.038 1.876 2.259 . 0 0 "[ . 1 . 2]" 1
1305 1 72 VAL H 1 73 ASP H . . 3.450 2.757 2.617 2.899 . 0 0 "[ . 1 . 2]" 1
1306 1 72 VAL H 1 73 ASP QB . . 4.890 4.442 4.331 4.617 . 0 0 "[ . 1 . 2]" 1
1307 1 72 VAL HA 1 72 VAL MG1 . . 3.260 3.200 3.192 3.204 . 0 0 "[ . 1 . 2]" 1
1308 1 72 VAL HA 1 72 VAL MG2 . . 3.220 2.372 2.215 2.450 . 0 0 "[ . 1 . 2]" 1
1309 1 72 VAL HA 1 75 ILE H . . 4.070 3.414 3.238 3.536 . 0 0 "[ . 1 . 2]" 1
1310 1 72 VAL HA 1 75 ILE HB . . 3.690 2.966 2.759 3.412 . 0 0 "[ . 1 . 2]" 1
1311 1 72 VAL HA 1 75 ILE MD . . 3.850 2.627 2.112 3.301 . 0 0 "[ . 1 . 2]" 1
1312 1 72 VAL HA 1 75 ILE MG . . 4.730 4.328 4.116 4.724 . 0 0 "[ . 1 . 2]" 1
1313 1 72 VAL HA 1 76 GLN H . . 4.480 4.060 3.772 4.316 . 0 0 "[ . 1 . 2]" 1
1314 1 72 VAL HA 1 76 GLN HB2 . . 5.500 5.306 4.889 5.502 0.002 16 0 "[ . 1 . 2]" 1
1315 1 72 VAL HB 1 73 ASP H . . 3.930 3.756 3.702 3.838 . 0 0 "[ . 1 . 2]" 1
1316 1 72 VAL HB 1 73 ASP HA . . 5.500 5.554 5.539 5.577 0.077 12 0 "[ . 1 . 2]" 1
1317 1 72 VAL MG1 1 73 ASP H . . 4.100 1.778 1.743 1.945 . 0 0 "[ . 1 . 2]" 1
1318 1 72 VAL MG2 1 73 ASP H . . 3.680 3.422 3.250 3.630 . 0 0 "[ . 1 . 2]" 1
1319 1 72 VAL MG2 1 73 ASP HA . . 3.930 3.605 3.396 3.778 . 0 0 "[ . 1 . 2]" 1
1320 1 72 VAL MG2 1 76 GLN H . . 3.720 3.653 3.570 3.723 0.003 16 0 "[ . 1 . 2]" 1
1321 1 72 VAL MG2 1 76 GLN HB2 . . 4.200 3.656 3.302 3.874 . 0 0 "[ . 1 . 2]" 1
1322 1 72 VAL MG2 1 76 GLN QE . . 3.980 3.381 1.956 3.951 . 0 0 "[ . 1 . 2]" 1
1323 1 72 VAL MG2 1 76 GLN HG2 . . 3.760 2.921 2.238 3.398 . 0 0 "[ . 1 . 2]" 1
1324 1 72 VAL MG2 1 76 GLN HG3 . . 3.760 2.553 1.972 3.150 . 0 0 "[ . 1 . 2]" 1
1325 1 72 VAL MG2 1 77 SER H . . 5.500 5.431 5.281 5.505 0.005 14 0 "[ . 1 . 2]" 1
1326 1 73 ASP H 1 73 ASP QB . . 2.930 2.173 2.127 2.267 . 0 0 "[ . 1 . 2]" 1
1327 1 73 ASP H 1 74 ARG H . . 3.370 2.771 2.707 2.826 . 0 0 "[ . 1 . 2]" 1
1328 1 73 ASP H 1 75 ILE H . . 4.780 4.344 4.117 4.586 . 0 0 "[ . 1 . 2]" 1
1329 1 73 ASP H 1 76 GLN HB2 . . 5.290 4.989 4.637 5.276 . 0 0 "[ . 1 . 2]" 1
1330 1 73 ASP HA 1 76 GLN H . . 3.820 3.579 3.411 3.820 . 0 0 "[ . 1 . 2]" 1
1331 1 73 ASP HA 1 76 GLN HB2 . . 3.530 2.720 2.449 2.980 . 0 0 "[ . 1 . 2]" 1
1332 1 73 ASP HA 1 76 GLN HG2 . . 4.900 4.688 4.214 4.911 0.011 7 0 "[ . 1 . 2]" 1
1333 1 73 ASP HA 1 76 GLN QG . . 4.210 3.711 3.224 4.132 . 0 0 "[ . 1 . 2]" 1
1334 1 73 ASP HA 1 76 GLN HG3 . . 4.900 3.930 3.272 4.488 . 0 0 "[ . 1 . 2]" 1
1335 1 73 ASP QB 1 74 ARG H . . 3.200 2.711 2.575 2.845 . 0 0 "[ . 1 . 2]" 1
1336 1 73 ASP QB 1 75 ILE H . . 5.340 4.841 4.706 5.024 . 0 0 "[ . 1 . 2]" 1
1337 1 73 ASP HB2 1 74 ARG HA . . 5.500 5.303 4.623 5.551 0.051 6 0 "[ . 1 . 2]" 1
1338 1 73 ASP HB3 1 74 ARG HA . . 5.500 4.152 3.949 4.747 . 0 0 "[ . 1 . 2]" 1
1339 1 74 ARG H 1 74 ARG HB2 . . 3.190 2.273 2.192 2.511 . 0 0 "[ . 1 . 2]" 1
1340 1 74 ARG H 1 74 ARG HB3 . . 3.660 3.535 3.497 3.589 . 0 0 "[ . 1 . 2]" 1
1341 1 74 ARG H 1 74 ARG QD . . 5.030 4.273 3.998 4.385 . 0 0 "[ . 1 . 2]" 1
1342 1 74 ARG H 1 74 ARG HG2 . . 3.630 3.466 2.200 3.630 0.000 16 0 "[ . 1 . 2]" 1
1343 1 74 ARG H 1 74 ARG QG . . 3.060 2.690 2.168 2.859 . 0 0 "[ . 1 . 2]" 1
1344 1 74 ARG H 1 74 ARG HG3 . . 3.630 2.849 2.460 3.269 . 0 0 "[ . 1 . 2]" 1
1345 1 74 ARG H 1 75 ILE H . . 3.420 2.651 2.539 2.733 . 0 0 "[ . 1 . 2]" 1
1346 1 74 ARG H 1 75 ILE HG13 . . 4.430 4.297 4.112 4.417 . 0 0 "[ . 1 . 2]" 1
1347 1 74 ARG H 1 76 GLN H . . 4.700 4.131 3.722 4.459 . 0 0 "[ . 1 . 2]" 1
1348 1 74 ARG HA 1 74 ARG QD . . 4.570 3.758 2.472 4.046 . 0 0 "[ . 1 . 2]" 1
1349 1 74 ARG HA 1 74 ARG HG2 . . 3.780 2.258 2.167 2.739 . 0 0 "[ . 1 . 2]" 1
1350 1 74 ARG HA 1 74 ARG QG . . 3.240 2.215 2.131 2.679 . 0 0 "[ . 1 . 2]" 1
1351 1 74 ARG HA 1 74 ARG HG3 . . 3.780 3.209 3.055 3.793 0.013 14 0 "[ . 1 . 2]" 1
1352 1 74 ARG HA 1 77 SER H . . 3.820 3.687 3.483 3.825 0.005 5 0 "[ . 1 . 2]" 1
1353 1 74 ARG HB2 1 74 ARG HD2 . . 4.080 3.121 2.607 3.827 . 0 0 "[ . 1 . 2]" 1
1354 1 74 ARG HB2 1 74 ARG HD3 . . 4.080 3.166 2.673 3.631 . 0 0 "[ . 1 . 2]" 1
1355 1 74 ARG HB2 1 75 ILE H . . 4.260 2.687 2.379 2.852 . 0 0 "[ . 1 . 2]" 1
1356 1 74 ARG HB3 1 74 ARG QD . . 3.640 2.275 2.080 2.518 . 0 0 "[ . 1 . 2]" 1
1357 1 74 ARG HB3 1 75 ILE H . . 4.000 3.363 3.177 3.726 . 0 0 "[ . 1 . 2]" 1
1358 1 74 ARG HB3 1 75 ILE HG13 . . 4.960 3.990 3.706 4.379 . 0 0 "[ . 1 . 2]" 1
1359 1 74 ARG QD 1 75 ILE H . . 5.340 4.937 4.743 5.159 . 0 0 "[ . 1 . 2]" 1
1360 1 75 ILE H 1 75 ILE HB . . 2.950 2.521 2.494 2.574 . 0 0 "[ . 1 . 2]" 1
1361 1 75 ILE H 1 75 ILE MD . . 3.830 3.473 3.310 3.649 . 0 0 "[ . 1 . 2]" 1
1362 1 75 ILE H 1 75 ILE HG12 . . 3.550 3.489 3.186 3.556 0.006 10 0 "[ . 1 . 2]" 1
1363 1 75 ILE H 1 75 ILE HG13 . . 3.120 2.144 2.064 2.193 . 0 0 "[ . 1 . 2]" 1
1364 1 75 ILE H 1 75 ILE MG . . 4.060 3.765 3.758 3.781 . 0 0 "[ . 1 . 2]" 1
1365 1 75 ILE H 1 76 GLN H . . 3.280 2.640 2.422 2.793 . 0 0 "[ . 1 . 2]" 1
1366 1 75 ILE H 1 76 GLN HB2 . . 4.850 4.693 4.479 4.847 . 0 0 "[ . 1 . 2]" 1
1367 1 75 ILE H 1 77 SER H . . 4.670 4.102 3.907 4.287 . 0 0 "[ . 1 . 2]" 1
1368 1 75 ILE HA 1 75 ILE MD . . 3.940 3.853 3.783 3.903 . 0 0 "[ . 1 . 2]" 1
1369 1 75 ILE HA 1 75 ILE HG12 . . 3.620 2.600 2.468 2.709 . 0 0 "[ . 1 . 2]" 1
1370 1 75 ILE HA 1 75 ILE HG13 . . 3.910 2.924 2.815 3.112 . 0 0 "[ . 1 . 2]" 1
1371 1 75 ILE HA 1 75 ILE MG . . 3.090 2.387 2.264 2.463 . 0 0 "[ . 1 . 2]" 1
1372 1 75 ILE HA 1 77 SER H . . 4.750 4.606 4.254 4.750 . 0 0 "[ . 1 . 2]" 1
1373 1 75 ILE HA 1 78 SER H . . 4.140 3.657 3.405 3.855 . 0 0 "[ . 1 . 2]" 1
1374 1 75 ILE HA 1 78 SER HB2 . . 4.390 3.534 2.562 4.384 . 0 0 "[ . 1 . 2]" 1
1375 1 75 ILE HA 1 78 SER QB . . 3.840 2.782 2.536 3.692 . 0 0 "[ . 1 . 2]" 1
1376 1 75 ILE HA 1 78 SER HB3 . . 4.390 3.429 2.587 4.390 . 18 0 "[ . 1 . 2]" 1
1377 1 75 ILE HA 1 82 VAL MG2 . . 3.470 2.432 1.978 3.190 . 0 0 "[ . 1 . 2]" 1
1378 1 75 ILE HB 1 75 ILE MD . . 3.390 2.365 2.203 2.492 . 0 0 "[ . 1 . 2]" 1
1379 1 75 ILE HB 1 76 GLN H . . 3.280 2.590 2.298 3.178 . 0 0 "[ . 1 . 2]" 1
1380 1 75 ILE MD 1 76 GLN H . . 4.780 4.482 4.276 4.781 0.001 17 0 "[ . 1 . 2]" 1
1381 1 75 ILE HG12 1 82 VAL MG2 . . 4.190 3.010 2.252 3.573 . 0 0 "[ . 1 . 2]" 1
1382 1 75 ILE MG 1 76 GLN H . . 4.030 3.451 3.168 3.939 . 0 0 "[ . 1 . 2]" 1
1383 1 75 ILE MG 1 76 GLN HA . . 3.950 3.530 3.273 3.912 . 0 0 "[ . 1 . 2]" 1
1384 1 75 ILE MG 1 78 SER H . . 4.780 4.683 4.488 4.783 0.003 15 0 "[ . 1 . 2]" 1
1385 1 75 ILE MG 1 82 VAL MG1 . . 3.330 2.291 1.713 2.773 . 0 0 "[ . 1 . 2]" 1
1386 1 76 GLN H 1 76 GLN HB2 . . 3.000 2.348 2.258 2.465 . 0 0 "[ . 1 . 2]" 1
1387 1 76 GLN H 1 76 GLN HG2 . . 3.800 2.780 2.399 3.537 . 0 0 "[ . 1 . 2]" 1
1388 1 76 GLN H 1 76 GLN HG3 . . 3.800 3.367 2.402 3.796 . 0 0 "[ . 1 . 2]" 1
1389 1 76 GLN H 1 77 SER H . . 3.300 2.587 2.212 2.735 . 0 0 "[ . 1 . 2]" 1
1390 1 76 GLN H 1 77 SER HB2 . . 5.500 4.924 4.123 5.293 . 0 0 "[ . 1 . 2]" 1
1391 1 76 GLN H 1 77 SER HB3 . . 5.500 4.899 4.606 5.621 0.121 17 0 "[ . 1 . 2]" 1
1392 1 76 GLN H 1 78 SER H . . 4.520 3.954 3.602 4.241 . 0 0 "[ . 1 . 2]" 1
1393 1 76 GLN HA 1 76 GLN HG2 . . 3.950 2.609 2.326 2.899 . 0 0 "[ . 1 . 2]" 1
1394 1 76 GLN HA 1 76 GLN QG . . 3.450 2.549 2.286 2.802 . 0 0 "[ . 1 . 2]" 1
1395 1 76 GLN HA 1 76 GLN HG3 . . 3.950 3.606 3.053 3.739 . 0 0 "[ . 1 . 2]" 1
1396 1 76 GLN HA 1 78 SER H . . 4.780 4.198 3.757 4.483 . 0 0 "[ . 1 . 2]" 1
1397 1 76 GLN HB2 1 77 SER H . . 3.480 2.644 2.504 2.974 . 0 0 "[ . 1 . 2]" 1
1398 1 77 SER H 1 77 SER HB2 . . 3.580 2.498 2.201 2.752 . 0 0 "[ . 1 . 2]" 1
1399 1 77 SER H 1 77 SER QB . . 3.060 2.246 2.178 2.294 . 0 0 "[ . 1 . 2]" 1
1400 1 77 SER H 1 77 SER HB3 . . 3.580 2.622 2.339 3.471 . 0 0 "[ . 1 . 2]" 1
1401 1 77 SER H 1 78 SER H . . 3.240 2.611 2.268 2.790 . 0 0 "[ . 1 . 2]" 1
1402 1 77 SER QB 1 78 SER H . . 3.180 2.772 2.495 3.075 . 0 0 "[ . 1 . 2]" 1
1403 1 78 SER H 1 78 SER HB2 . . 3.480 2.859 2.191 3.525 0.045 7 0 "[ . 1 . 2]" 1
1404 1 78 SER H 1 78 SER QB . . 2.870 2.224 2.148 2.882 0.012 13 0 "[ . 1 . 2]" 1
1405 1 78 SER H 1 78 SER HB3 . . 3.480 2.740 2.190 3.530 0.050 18 0 "[ . 1 . 2]" 1
1406 1 78 SER H 1 79 GLY H . . 3.640 3.102 2.705 3.598 . 0 0 "[ . 1 . 2]" 1
1407 1 78 SER H 1 82 VAL MG2 . . 4.790 4.337 3.886 4.714 . 0 0 "[ . 1 . 2]" 1
1408 1 78 SER HA 1 82 VAL MG2 . . 4.780 4.370 4.063 4.770 . 0 0 "[ . 1 . 2]" 1
1409 1 78 SER QB 1 79 GLY H . . 4.060 2.928 1.946 4.008 . 0 0 "[ . 1 . 2]" 1
1410 1 78 SER QB 1 82 VAL HA . . 4.630 3.415 2.964 3.900 . 0 0 "[ . 1 . 2]" 1
1411 1 78 SER QB 1 82 VAL HB . . 3.630 2.306 1.899 3.002 . 0 0 "[ . 1 . 2]" 1
1412 1 78 SER HB2 1 79 GLY H . . 4.690 3.592 2.406 4.658 . 0 0 "[ . 1 . 2]" 1
1413 1 78 SER HB2 1 82 VAL HB . . 4.310 2.721 1.995 3.537 . 0 0 "[ . 1 . 2]" 1
1414 1 78 SER HB2 1 82 VAL MG2 . . 4.060 2.555 2.099 2.952 . 0 0 "[ . 1 . 2]" 1
1415 1 78 SER HB3 1 79 GLY H . . 4.690 3.257 1.958 4.371 . 0 0 "[ . 1 . 2]" 1
1416 1 78 SER HB3 1 82 VAL HB . . 4.310 2.661 2.009 3.399 . 0 0 "[ . 1 . 2]" 1
1417 1 78 SER HB3 1 82 VAL MG2 . . 4.060 2.745 2.155 3.767 . 0 0 "[ . 1 . 2]" 1
1418 1 79 GLY QA 1 81 ASN H . . 4.560 3.908 3.200 4.413 . 0 0 "[ . 1 . 2]" 1
1419 1 80 LYS H 1 81 ASN HA . . 5.170 5.015 4.843 5.205 0.035 9 0 "[ . 1 . 2]" 1
1420 1 80 LYS H 1 81 ASN QB . . 5.270 4.798 4.204 5.239 . 0 0 "[ . 1 . 2]" 1
1421 1 80 LYS HA 1 80 LYS HD2 . . 5.500 4.310 2.439 5.520 0.020 4 0 "[ . 1 . 2]" 1
1422 1 80 LYS HA 1 80 LYS HD3 . . 5.500 4.491 3.214 5.473 . 0 0 "[ . 1 . 2]" 1
1423 1 80 LYS HA 1 80 LYS QE . . 5.340 4.536 3.893 5.340 0.000 11 0 "[ . 1 . 2]" 1
1424 1 80 LYS HA 1 80 LYS QG . . 3.710 2.844 2.198 3.432 . 0 0 "[ . 1 . 2]" 1
1425 1 80 LYS HB2 1 81 ASN H . . 4.330 3.255 2.203 4.101 . 0 0 "[ . 1 . 2]" 1
1426 1 80 LYS HB3 1 81 ASN H . . 4.330 3.445 1.953 4.322 . 0 0 "[ . 1 . 2]" 1
1427 1 80 LYS QE 1 80 LYS QG . . 3.230 2.233 2.039 2.577 . 0 0 "[ . 1 . 2]" 1
1428 1 81 ASN H 1 81 ASN HB2 . . 4.070 3.238 2.404 3.698 . 0 0 "[ . 1 . 2]" 1
1429 1 81 ASN H 1 81 ASN QB . . 3.510 2.738 2.306 3.132 . 0 0 "[ . 1 . 2]" 1
1430 1 81 ASN H 1 81 ASN HB3 . . 4.070 3.143 2.444 3.832 . 0 0 "[ . 1 . 2]" 1
1431 1 81 ASN H 1 82 VAL H . . 4.780 4.455 4.075 4.573 . 0 0 "[ . 1 . 2]" 1
1432 1 81 ASN HA 1 82 VAL H . . 3.330 2.193 2.140 2.250 . 0 0 "[ . 1 . 2]" 1
1433 1 81 ASN HA 1 82 VAL MG1 . . 4.830 3.720 3.431 3.965 . 0 0 "[ . 1 . 2]" 1
1434 1 81 ASN HB2 1 82 VAL H . . 4.140 3.591 2.850 4.141 0.001 9 0 "[ . 1 . 2]" 1
1435 1 81 ASN HB3 1 82 VAL H . . 4.140 3.790 2.957 4.141 0.001 14 0 "[ . 1 . 2]" 1
1436 1 82 VAL H 1 82 VAL MG1 . . 3.680 2.365 2.131 2.594 . 0 0 "[ . 1 . 2]" 1
1437 1 82 VAL H 1 82 VAL MG2 . . 4.650 3.971 3.907 4.014 . 0 0 "[ . 1 . 2]" 1
1438 1 82 VAL H 1 83 THR H . . 4.870 4.270 4.057 4.450 . 0 0 "[ . 1 . 2]" 1
1439 1 82 VAL HA 1 82 VAL MG2 . . 3.310 2.334 2.213 2.443 . 0 0 "[ . 1 . 2]" 1
1440 1 82 VAL HA 1 83 THR H . . 3.020 2.215 2.141 2.304 . 0 0 "[ . 1 . 2]" 1
1441 1 82 VAL HA 1 83 THR HB . . 4.870 4.718 4.583 4.870 0.000 11 0 "[ . 1 . 2]" 1
1442 1 82 VAL HB 1 83 THR H . . 4.260 4.081 3.940 4.260 . 12 0 "[ . 1 . 2]" 1
1443 1 82 VAL MG1 1 83 THR H . . 4.390 3.780 3.461 4.127 . 0 0 "[ . 1 . 2]" 1
1444 1 82 VAL MG1 1 84 LEU MD1 . . 3.920 2.855 1.799 3.921 0.001 2 0 "[ . 1 . 2]" 1
1445 1 82 VAL MG1 1 84 LEU QD . . 3.400 2.358 1.765 2.954 . 0 0 "[ . 1 . 2]" 1
1446 1 82 VAL MG1 1 84 LEU MD2 . . 3.920 2.890 1.767 3.622 . 0 0 "[ . 1 . 2]" 1
1447 1 82 VAL MG1 1 84 LEU HG . . 4.320 3.264 2.286 4.324 0.004 16 0 "[ . 1 . 2]" 1
1448 1 82 VAL MG2 1 83 THR H . . 3.230 2.154 1.883 2.688 . 0 0 "[ . 1 . 2]" 1
1449 1 82 VAL MG2 1 84 LEU MD1 . . 4.310 3.096 1.848 4.027 . 0 0 "[ . 1 . 2]" 1
1450 1 82 VAL MG2 1 84 LEU QD . . 3.030 2.079 1.699 2.541 . 0 0 "[ . 1 . 2]" 1
1451 1 82 VAL MG2 1 84 LEU MD2 . . 4.310 2.487 1.707 3.993 . 0 0 "[ . 1 . 2]" 1
1452 1 82 VAL MG2 1 84 LEU HG . . 4.040 3.311 2.362 4.007 . 0 0 "[ . 1 . 2]" 1
1453 1 83 THR H 1 83 THR HB . . 3.390 2.633 2.495 2.832 . 0 0 "[ . 1 . 2]" 1
1454 1 83 THR H 1 83 THR MG . . 4.160 3.836 3.781 3.902 . 0 0 "[ . 1 . 2]" 1
1455 1 83 THR H 1 84 LEU QD . . 4.410 3.717 3.296 4.123 . 0 0 "[ . 1 . 2]" 1
1456 1 83 THR HA 1 83 THR MG . . 3.390 2.329 2.223 2.450 . 0 0 "[ . 1 . 2]" 1
1457 1 83 THR HA 1 84 LEU H . . 3.100 2.167 2.141 2.243 . 0 0 "[ . 1 . 2]" 1
1458 1 83 THR HA 1 84 LEU QD . . 4.110 3.747 2.914 4.110 . 3 0 "[ . 1 . 2]" 1
1459 1 83 THR HB 1 84 LEU H . . 4.930 4.121 3.827 4.360 . 0 0 "[ . 1 . 2]" 1
1460 1 83 THR MG 1 84 LEU H . . 3.540 2.554 2.003 2.967 . 0 0 "[ . 1 . 2]" 1
1461 1 84 LEU H 1 84 LEU QB . . 3.600 2.596 2.322 2.836 . 0 0 "[ . 1 . 2]" 1
1462 1 84 LEU H 1 84 LEU MD1 . . 4.590 3.762 2.433 4.295 . 0 0 "[ . 1 . 2]" 1
1463 1 84 LEU H 1 84 LEU QD . . 3.970 3.099 2.303 3.626 . 0 0 "[ . 1 . 2]" 1
1464 1 84 LEU H 1 84 LEU MD2 . . 4.590 3.616 2.316 4.532 . 0 0 "[ . 1 . 2]" 1
1465 1 84 LEU H 1 84 LEU HG . . 4.540 3.409 2.392 4.547 0.007 8 0 "[ . 1 . 2]" 1
1466 1 84 LEU H 1 85 LEU H . . 4.570 4.412 4.238 4.543 . 0 0 "[ . 1 . 2]" 1
1467 1 84 LEU HA 1 84 LEU QD . . 3.270 2.290 1.951 2.709 . 0 0 "[ . 1 . 2]" 1
1468 1 84 LEU HA 1 84 LEU HG . . 4.230 3.153 2.421 3.722 . 0 0 "[ . 1 . 2]" 1
1469 1 84 LEU HA 1 85 LEU H . . 3.130 2.219 2.143 2.321 . 0 0 "[ . 1 . 2]" 1
1470 1 84 LEU HA 1 86 VAL MG1 . . 4.940 4.872 4.643 4.944 0.004 10 0 "[ . 1 . 2]" 1
1471 1 84 LEU QB 1 85 LEU H . . 4.020 2.903 2.608 3.329 . 0 0 "[ . 1 . 2]" 1
1472 1 84 LEU QB 1 86 VAL MG1 . . 3.300 2.982 2.792 3.171 . 0 0 "[ . 1 . 2]" 1
1473 1 84 LEU HB2 1 86 VAL MG1 . . 4.140 3.573 3.040 4.136 . 0 0 "[ . 1 . 2]" 1
1474 1 84 LEU HB3 1 86 VAL MG1 . . 4.140 3.281 2.934 3.515 . 0 0 "[ . 1 . 2]" 1
1475 1 84 LEU QD 1 85 LEU H . . 4.250 3.563 2.942 4.037 . 0 0 "[ . 1 . 2]" 1
1476 1 84 LEU QD 1 86 VAL MG1 . . 3.950 3.669 3.460 3.950 . 2 0 "[ . 1 . 2]" 1
1477 1 85 LEU H 1 85 LEU HB2 . . 3.810 2.780 2.585 3.013 . 0 0 "[ . 1 . 2]" 1
1478 1 85 LEU H 1 85 LEU HB3 . . 3.900 2.614 2.516 2.759 . 0 0 "[ . 1 . 2]" 1
1479 1 85 LEU H 1 85 LEU MD1 . . 4.860 4.403 4.274 4.547 . 0 0 "[ . 1 . 2]" 1
1480 1 85 LEU H 1 85 LEU MD2 . . 4.940 4.090 3.965 4.217 . 0 0 "[ . 1 . 2]" 1
1481 1 85 LEU H 1 86 VAL MG1 . . 4.610 4.045 3.752 4.288 . 0 0 "[ . 1 . 2]" 1
1482 1 85 LEU HA 1 85 LEU MD1 . . 4.410 3.590 3.529 3.793 . 0 0 "[ . 1 . 2]" 1
1483 1 85 LEU HA 1 85 LEU MD2 . . 3.970 3.246 2.975 3.437 . 0 0 "[ . 1 . 2]" 1
1484 1 85 LEU HA 1 85 LEU HG . . 4.120 2.434 2.341 2.559 . 0 0 "[ . 1 . 2]" 1
1485 1 85 LEU HA 1 86 VAL H . . 3.300 2.153 2.140 2.191 . 0 0 "[ . 1 . 2]" 1
1486 1 85 LEU HA 1 86 VAL MG1 . . 4.450 3.811 3.549 3.959 . 0 0 "[ . 1 . 2]" 1
1487 1 85 LEU HA 1 86 VAL MG2 . . 4.600 3.848 3.736 4.025 . 0 0 "[ . 1 . 2]" 1
1488 1 85 LEU HB2 1 85 LEU MD2 . . 3.340 3.134 3.104 3.179 . 0 0 "[ . 1 . 2]" 1
1489 1 85 LEU HB3 1 85 LEU MD2 . . 3.610 2.145 1.999 2.234 . 0 0 "[ . 1 . 2]" 1
1490 1 85 LEU HB3 1 86 VAL MG1 . . 5.500 5.015 4.825 5.121 . 0 0 "[ . 1 . 2]" 1
1491 1 85 LEU MD1 1 86 VAL H . . 5.180 4.810 4.549 5.015 . 0 0 "[ . 1 . 2]" 1
1492 1 85 LEU MD2 1 86 VAL H . . 3.700 3.297 2.800 3.627 . 0 0 "[ . 1 . 2]" 1
1493 1 85 LEU HG 1 86 VAL H . . 4.290 3.409 3.034 3.682 . 0 0 "[ . 1 . 2]" 1
1494 1 86 VAL H 1 86 VAL MG1 . . 3.860 2.679 2.465 2.971 . 0 0 "[ . 1 . 2]" 1
1495 1 86 VAL H 1 86 VAL MG2 . . 3.510 2.066 1.878 2.295 . 0 0 "[ . 1 . 2]" 1
1496 1 86 VAL HA 1 86 VAL MG1 . . 3.570 2.386 2.222 2.452 . 0 0 "[ . 1 . 2]" 1
1497 1 86 VAL HA 1 87 CYS H . . 3.430 2.272 2.182 2.446 . 0 0 "[ . 1 . 2]" 1
1498 1 86 VAL HB 1 87 CYS H . . 3.460 2.754 2.291 3.063 . 0 0 "[ . 1 . 2]" 1
1499 1 86 VAL MG1 1 87 CYS H . . 4.010 3.840 3.632 3.955 . 0 0 "[ . 1 . 2]" 1
1500 1 86 VAL MG2 1 87 CYS H . . 4.300 3.630 3.348 3.903 . 0 0 "[ . 1 . 2]" 1
1501 1 87 CYS QB 1 88 GLY H . . 3.780 3.473 2.506 3.737 . 0 0 "[ . 1 . 2]" 1
1502 1 87 CYS HB2 1 88 GLY H . . 4.510 3.971 2.541 4.402 . 0 0 "[ . 1 . 2]" 1
1503 1 87 CYS HB3 1 88 GLY H . . 4.510 3.944 3.492 4.308 . 0 0 "[ . 1 . 2]" 1
1504 1 88 GLY H 1 89 LYS H . . 4.760 4.443 3.568 4.644 . 0 0 "[ . 1 . 2]" 1
1505 1 88 GLY QA 1 89 LYS H . . 2.920 2.153 2.109 2.257 . 0 0 "[ . 1 . 2]" 1
1506 1 88 GLY HA2 1 89 LYS H . . 3.380 2.414 2.137 3.304 . 0 0 "[ . 1 . 2]" 1
1507 1 88 GLY HA3 1 89 LYS H . . 3.380 2.888 2.138 3.353 . 0 0 "[ . 1 . 2]" 1
1508 1 89 LYS H 1 89 LYS HB2 . . 4.150 2.726 2.226 3.593 . 0 0 "[ . 1 . 2]" 1
1509 1 89 LYS H 1 89 LYS QB . . 3.560 2.388 2.176 2.932 . 0 0 "[ . 1 . 2]" 1
1510 1 89 LYS H 1 89 LYS HB3 . . 4.150 2.934 2.432 3.860 . 0 0 "[ . 1 . 2]" 1
1511 1 89 LYS H 1 89 LYS HG2 . . 5.270 4.067 2.215 4.717 . 0 0 "[ . 1 . 2]" 1
1512 1 89 LYS H 1 89 LYS QG . . 4.500 3.515 2.196 4.294 . 0 0 "[ . 1 . 2]" 1
1513 1 89 LYS H 1 89 LYS HG3 . . 5.270 4.013 2.358 5.090 . 0 0 "[ . 1 . 2]" 1
1514 1 89 LYS HA 1 90 LYS H . . 3.260 2.239 2.141 2.735 . 0 0 "[ . 1 . 2]" 1
1515 1 89 LYS QB 1 90 LYS H . . 4.030 3.488 2.274 4.009 . 0 0 "[ . 1 . 2]" 1
1516 1 89 LYS QE 1 89 LYS QG . . 3.290 2.235 2.043 2.557 . 0 0 "[ . 1 . 2]" 1
1517 1 89 LYS QG 1 90 LYS H . . 5.190 3.368 2.167 4.502 . 0 0 "[ . 1 . 2]" 1
1518 1 90 LYS H 1 90 LYS QB . . 3.480 2.460 2.207 3.033 . 0 0 "[ . 1 . 2]" 1
1519 1 90 LYS HA 1 90 LYS HD2 . . 5.500 4.015 2.176 5.494 . 0 0 "[ . 1 . 2]" 1
1520 1 90 LYS HA 1 90 LYS HD3 . . 5.500 4.142 2.100 5.020 . 0 0 "[ . 1 . 2]" 1
1521 1 90 LYS HA 1 90 LYS QG . . 3.740 2.607 2.174 3.419 . 0 0 "[ . 1 . 2]" 1
1522 1 91 SER HB2 1 92 GLY H . . 5.200 3.843 2.278 4.610 . 0 0 "[ . 1 . 2]" 1
1523 1 91 SER HB3 1 92 GLY H . . 5.200 3.522 2.148 4.491 . 0 0 "[ . 1 . 2]" 1
1524 1 92 GLY H 1 93 PRO QD . . 4.710 3.898 2.357 4.374 . 0 0 "[ . 1 . 2]" 1
1525 1 92 GLY QA 1 93 PRO QD . . 2.630 1.974 1.891 2.028 . 0 0 "[ . 1 . 2]" 1
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