NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
404927 |
1x4m   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x4m
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 1772
_Distance_constraint_stats_list.Viol_count 402
_Distance_constraint_stats_list.Viol_total 104.395
_Distance_constraint_stats_list.Viol_max 0.123
_Distance_constraint_stats_list.Viol_rms 0.0027
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0130
_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 10 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 GLY 0.001 0.001 6 0 "[ . 1 . 2]"
1 14 ASN 0.002 0.002 2 0 "[ . 1 . 2]"
1 15 ALA 0.082 0.022 19 0 "[ . 1 . 2]"
1 16 VAL 0.115 0.015 14 0 "[ . 1 . 2]"
1 17 GLN 0.090 0.035 19 0 "[ . 1 . 2]"
1 18 GLU 1.523 0.086 13 0 "[ . 1 . 2]"
1 19 ILE 1.484 0.086 13 0 "[ . 1 . 2]"
1 20 MET 0.008 0.006 1 0 "[ . 1 . 2]"
1 21 ILE 0.056 0.011 2 0 "[ . 1 . 2]"
1 22 PRO 0.001 0.001 11 0 "[ . 1 . 2]"
1 23 ALA 0.005 0.002 16 0 "[ . 1 . 2]"
1 24 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 LYS 0.005 0.002 4 0 "[ . 1 . 2]"
1 26 ALA 0.011 0.004 4 0 "[ . 1 . 2]"
1 27 GLY 0.011 0.003 1 0 "[ . 1 . 2]"
1 28 LEU 0.023 0.014 6 0 "[ . 1 . 2]"
1 29 VAL 0.017 0.004 1 0 "[ . 1 . 2]"
1 30 ILE 0.005 0.002 18 0 "[ . 1 . 2]"
1 31 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 GLU 0.002 0.002 13 0 "[ . 1 . 2]"
1 36 THR 0.002 0.002 13 0 "[ . 1 . 2]"
1 37 ILE 0.023 0.005 18 0 "[ . 1 . 2]"
1 38 LYS 0.093 0.032 15 0 "[ . 1 . 2]"
1 39 GLN 0.124 0.123 11 0 "[ . 1 . 2]"
1 40 LEU 0.034 0.005 18 0 "[ . 1 . 2]"
1 41 GLN 0.017 0.009 2 0 "[ . 1 . 2]"
1 42 GLU 0.002 0.002 13 0 "[ . 1 . 2]"
1 43 ARG 0.013 0.004 13 0 "[ . 1 . 2]"
1 44 ALA 0.003 0.002 7 0 "[ . 1 . 2]"
1 45 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 VAL 0.024 0.006 2 0 "[ . 1 . 2]"
1 47 LYS 0.130 0.019 14 0 "[ . 1 . 2]"
1 48 MET 0.125 0.019 3 0 "[ . 1 . 2]"
1 49 VAL 0.037 0.018 10 0 "[ . 1 . 2]"
1 50 MET 0.016 0.007 8 0 "[ . 1 . 2]"
1 51 ILE 0.179 0.022 13 0 "[ . 1 . 2]"
1 52 GLN 0.004 0.004 1 0 "[ . 1 . 2]"
1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 PRO 0.034 0.030 15 0 "[ . 1 . 2]"
1 56 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 THR 0.034 0.030 15 0 "[ . 1 . 2]"
1 59 GLY 0.000 0.000 1 0 "[ . 1 . 2]"
1 60 ALA 0.128 0.041 16 0 "[ . 1 . 2]"
1 61 ASP 0.360 0.041 16 0 "[ . 1 . 2]"
1 62 LYS 0.075 0.021 16 0 "[ . 1 . 2]"
1 63 PRO 0.196 0.022 13 0 "[ . 1 . 2]"
1 64 LEU 0.025 0.007 8 0 "[ . 1 . 2]"
1 65 ARG 0.051 0.006 15 0 "[ . 1 . 2]"
1 66 ILE 0.015 0.006 2 0 "[ . 1 . 2]"
1 67 THR 0.179 0.019 14 0 "[ . 1 . 2]"
1 68 GLY 1.307 0.102 12 0 "[ . 1 . 2]"
1 69 ASP 1.305 0.102 12 0 "[ . 1 . 2]"
1 70 PRO 0.332 0.033 2 0 "[ . 1 . 2]"
1 71 TYR 0.379 0.033 2 0 "[ . 1 . 2]"
1 72 LYS 0.148 0.046 8 0 "[ . 1 . 2]"
1 73 VAL 0.214 0.035 19 0 "[ . 1 . 2]"
1 74 GLN 0.072 0.011 19 0 "[ . 1 . 2]"
1 75 GLN 0.055 0.022 19 0 "[ . 1 . 2]"
1 76 ALA 0.005 0.004 18 0 "[ . 1 . 2]"
1 77 LYS 0.128 0.057 16 0 "[ . 1 . 2]"
1 78 GLU 0.099 0.063 5 0 "[ . 1 . 2]"
1 79 MET 0.007 0.005 15 0 "[ . 1 . 2]"
1 80 VAL 0.010 0.006 2 0 "[ . 1 . 2]"
1 81 LEU 0.014 0.007 2 0 "[ . 1 . 2]"
1 82 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 LEU 0.014 0.006 2 0 "[ . 1 . 2]"
1 84 ILE 0.011 0.004 2 0 "[ . 1 . 2]"
1 85 ARG 0.091 0.067 18 0 "[ . 1 . 2]"
1 86 ASP 0.083 0.067 18 0 "[ . 1 . 2]"
1 87 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 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 65 ARG H 1 66 ILE H . . 4.650 4.398 4.296 4.479 . 0 0 "[ . 1 . 2]" 1
2 1 17 GLN H 1 66 ILE H . . 4.040 2.892 2.735 3.192 . 0 0 "[ . 1 . 2]" 1
3 1 65 ARG HA 1 66 ILE H . . 3.230 2.144 2.140 2.155 . 0 0 "[ . 1 . 2]" 1
4 1 66 ILE H 1 66 ILE HB . . 3.420 2.587 2.490 2.662 . 0 0 "[ . 1 . 2]" 1
5 1 65 ARG HG2 1 66 ILE H . . 4.280 3.126 2.795 3.718 . 0 0 "[ . 1 . 2]" 1
6 1 66 ILE H 1 66 ILE MG . . 4.330 3.824 3.778 3.858 . 0 0 "[ . 1 . 2]" 1
7 1 66 ILE H 1 66 ILE HG13 . . 3.960 2.781 2.608 2.892 . 0 0 "[ . 1 . 2]" 1
8 1 51 ILE H 1 51 ILE HB . . 3.490 2.669 2.546 2.759 . 0 0 "[ . 1 . 2]" 1
9 1 51 ILE H 1 64 LEU MD1 . . 5.050 3.798 3.589 4.100 . 0 0 "[ . 1 . 2]" 1
10 1 50 MET QG 1 51 ILE H . . 4.480 4.255 3.588 4.437 . 0 0 "[ . 1 . 2]" 1
11 1 51 ILE H 1 51 ILE HG12 . . 3.620 2.198 2.090 2.363 . 0 0 "[ . 1 . 2]" 1
12 1 22 PRO HA 1 23 ALA H . . 2.500 2.159 2.150 2.189 . 0 0 "[ . 1 . 2]" 1
13 1 23 ALA H 1 62 LYS HB2 . . 5.500 4.954 3.991 5.500 0.000 4 0 "[ . 1 . 2]" 1
14 1 51 ILE H 1 64 LEU HA . . 3.270 2.406 2.266 2.689 . 0 0 "[ . 1 . 2]" 1
15 1 64 LEU HG 1 65 ARG H . . 4.180 3.482 3.225 3.763 . 0 0 "[ . 1 . 2]" 1
16 1 49 VAL H 1 65 ARG H . . 4.240 3.751 3.518 4.033 . 0 0 "[ . 1 . 2]" 1
17 1 49 VAL HB 1 65 ARG H . . 4.780 4.119 3.850 4.489 . 0 0 "[ . 1 . 2]" 1
18 1 51 ILE HB 1 65 ARG H . . 5.260 4.597 4.294 4.865 . 0 0 "[ . 1 . 2]" 1
19 1 65 ARG H 1 65 ARG HB2 . . 3.620 2.629 2.516 2.810 . 0 0 "[ . 1 . 2]" 1
20 1 65 ARG H 1 65 ARG HB3 . . 3.490 2.696 2.604 2.790 . 0 0 "[ . 1 . 2]" 1
21 1 51 ILE HG13 1 65 ARG H . . 4.430 3.797 3.266 4.191 . 0 0 "[ . 1 . 2]" 1
22 1 64 LEU HB2 1 65 ARG H . . 4.820 4.017 3.904 4.174 . 0 0 "[ . 1 . 2]" 1
23 1 37 ILE MD 1 50 MET H . . 4.200 3.437 3.142 3.784 . 0 0 "[ . 1 . 2]" 1
24 1 50 MET H 1 50 MET QG . . 4.180 2.796 2.512 3.620 . 0 0 "[ . 1 . 2]" 1
25 1 50 MET H 1 50 MET HB2 . . 3.700 2.285 2.178 2.427 . 0 0 "[ . 1 . 2]" 1
26 1 50 MET H 1 50 MET HB3 . . 3.700 3.550 3.482 3.602 . 0 0 "[ . 1 . 2]" 1
27 1 49 VAL MG1 1 50 MET H . . 3.720 2.849 2.467 3.028 . 0 0 "[ . 1 . 2]" 1
28 1 21 ILE H 1 61 ASP HA . . 4.800 4.678 4.270 4.805 0.005 9 0 "[ . 1 . 2]" 1
29 1 21 ILE H 1 21 ILE HG12 . . 4.270 2.340 2.210 2.510 . 0 0 "[ . 1 . 2]" 1
30 1 21 ILE HG12 1 64 LEU H . . 4.700 2.755 2.534 2.973 . 0 0 "[ . 1 . 2]" 1
31 1 63 PRO HB2 1 64 LEU H . . 4.140 3.839 3.735 3.920 . 0 0 "[ . 1 . 2]" 1
32 1 63 PRO HA 1 64 LEU H . . 3.130 2.171 2.156 2.189 . 0 0 "[ . 1 . 2]" 1
33 1 64 LEU H 1 64 LEU HB3 . . 3.540 2.235 2.181 2.294 . 0 0 "[ . 1 . 2]" 1
34 1 64 LEU H 1 64 LEU MD2 . . 4.180 4.120 4.055 4.175 . 0 0 "[ . 1 . 2]" 1
35 1 17 GLN H 1 66 ILE HB . . 4.120 3.041 2.887 3.232 . 0 0 "[ . 1 . 2]" 1
36 1 16 VAL MG2 1 17 GLN H . . 3.580 2.451 2.141 3.085 . 0 0 "[ . 1 . 2]" 1
37 1 17 GLN H 1 73 VAL MG1 . . 3.740 2.410 2.060 2.634 . 0 0 "[ . 1 . 2]" 1
38 1 17 GLN H 1 67 THR HA . . 4.540 3.681 3.566 3.797 . 0 0 "[ . 1 . 2]" 1
39 1 17 GLN H 1 17 GLN HB2 . . 4.010 2.603 2.349 2.887 . 0 0 "[ . 1 . 2]" 1
40 1 15 ALA H 1 70 PRO HD3 . . 3.910 3.214 3.038 3.404 . 0 0 "[ . 1 . 2]" 1
41 1 15 ALA H 1 15 ALA MB . . 3.490 2.214 2.113 2.330 . 0 0 "[ . 1 . 2]" 1
42 1 15 ALA H 1 68 GLY H . . 3.970 3.426 3.201 3.659 . 0 0 "[ . 1 . 2]" 1
43 1 14 ASN QB 1 15 ALA H . . 3.800 3.202 2.875 3.660 . 0 0 "[ . 1 . 2]" 1
44 1 69 ASP H 1 69 ASP HB3 . . 3.680 3.477 2.969 3.627 . 0 0 "[ . 1 . 2]" 1
45 1 69 ASP H 1 73 VAL MG2 . . 4.180 2.242 1.874 3.326 . 0 0 "[ . 1 . 2]" 1
46 1 68 GLY HA3 1 69 ASP H . . 3.470 2.198 2.137 2.533 . 0 0 "[ . 1 . 2]" 1
47 1 69 ASP H 1 69 ASP HB2 . . 3.680 2.379 2.168 2.550 . 0 0 "[ . 1 . 2]" 1
48 1 69 ASP H 1 72 LYS HB2 . . 4.430 2.747 2.472 3.642 . 0 0 "[ . 1 . 2]" 1
49 1 46 VAL MG1 1 69 ASP H . . 4.160 2.273 1.961 2.901 . 0 0 "[ . 1 . 2]" 1
50 1 60 ALA H 1 61 ASP H . . 4.830 3.861 2.459 4.401 . 0 0 "[ . 1 . 2]" 1
51 1 35 GLU H 1 38 LYS H . . 5.500 4.476 4.314 4.652 . 0 0 "[ . 1 . 2]" 1
52 1 36 THR HB 1 37 ILE H . . 3.360 2.177 1.984 2.335 . 0 0 "[ . 1 . 2]" 1
53 1 37 ILE H 1 40 LEU MD1 . . 4.520 3.867 3.584 4.123 . 0 0 "[ . 1 . 2]" 1
54 1 26 ALA H 1 27 GLY H . . 5.140 2.737 2.500 2.974 . 0 0 "[ . 1 . 2]" 1
55 1 25 LYS H 1 26 ALA H . . 3.270 2.376 2.185 2.594 . 0 0 "[ . 1 . 2]" 1
56 1 23 ALA HA 1 26 ALA H . . 4.210 3.267 3.086 3.491 . 0 0 "[ . 1 . 2]" 1
57 1 25 LYS HB3 1 26 ALA H . . 4.780 4.278 4.106 4.423 . 0 0 "[ . 1 . 2]" 1
58 1 25 LYS HB2 1 26 ALA H . . 4.110 3.369 3.089 3.736 . 0 0 "[ . 1 . 2]" 1
59 1 21 ILE MG 1 26 ALA H . . 4.060 3.608 3.322 3.932 . 0 0 "[ . 1 . 2]" 1
60 1 19 ILE H 1 20 MET H . . 4.790 4.416 4.297 4.465 . 0 0 "[ . 1 . 2]" 1
61 1 20 MET H 1 21 ILE H . . 5.130 4.447 4.350 4.549 . 0 0 "[ . 1 . 2]" 1
62 1 20 MET H 1 64 LEU H . . 5.500 4.806 4.714 4.895 . 0 0 "[ . 1 . 2]" 1
63 1 20 MET H 1 20 MET HG2 . . 3.890 2.553 1.981 3.770 . 0 0 "[ . 1 . 2]" 1
64 1 20 MET H 1 20 MET HG3 . . 3.890 3.022 2.127 3.887 . 0 0 "[ . 1 . 2]" 1
65 1 20 MET H 1 20 MET HB2 . . 3.810 3.022 2.319 3.683 . 0 0 "[ . 1 . 2]" 1
66 1 19 ILE HB 1 20 MET H . . 3.730 2.672 2.286 3.204 . 0 0 "[ . 1 . 2]" 1
67 1 20 MET H 1 20 MET HB3 . . 3.810 3.275 2.639 3.689 . 0 0 "[ . 1 . 2]" 1
68 1 19 ILE MG 1 20 MET H . . 4.200 3.141 2.979 3.423 . 0 0 "[ . 1 . 2]" 1
69 1 19 ILE MD 1 20 MET H . . 5.090 4.806 4.699 4.949 . 0 0 "[ . 1 . 2]" 1
70 1 85 ARG H 1 86 ASP H . . 4.730 4.336 2.650 4.648 . 0 0 "[ . 1 . 2]" 1
71 1 82 GLU HA 1 85 ARG H . . 3.940 3.168 2.999 3.424 . 0 0 "[ . 1 . 2]" 1
72 1 85 ARG H 1 85 ARG HB2 . . 3.240 2.237 2.189 2.320 . 0 0 "[ . 1 . 2]" 1
73 1 85 ARG H 1 85 ARG HB3 . . 3.650 3.522 3.483 3.564 . 0 0 "[ . 1 . 2]" 1
74 1 84 ILE HG12 1 85 ARG H . . 4.160 3.517 3.170 4.086 . 0 0 "[ . 1 . 2]" 1
75 1 84 ILE HG13 1 85 ARG H . . 4.200 2.290 1.949 2.561 . 0 0 "[ . 1 . 2]" 1
76 1 84 ILE MD 1 85 ARG H . . 5.030 3.585 2.255 4.185 . 0 0 "[ . 1 . 2]" 1
77 1 75 GLN HB3 1 76 ALA H . . 3.460 3.370 3.159 3.464 0.004 18 0 "[ . 1 . 2]" 1
78 1 75 GLN H 1 76 ALA H . . 3.570 2.674 2.473 2.824 . 0 0 "[ . 1 . 2]" 1
79 1 75 GLN HB2 1 76 ALA H . . 3.450 2.410 2.098 2.805 . 0 0 "[ . 1 . 2]" 1
80 1 46 VAL MG1 1 76 ALA H . . 4.670 3.986 3.780 4.245 . 0 0 "[ . 1 . 2]" 1
81 1 17 GLN HA 1 18 GLU H . . 3.140 2.167 2.140 2.256 . 0 0 "[ . 1 . 2]" 1
82 1 18 GLU H 1 18 GLU HG2 . . 4.090 4.015 3.895 4.094 0.004 18 0 "[ . 1 . 2]" 1
83 1 17 GLN HB3 1 18 GLU H . . 3.690 3.423 3.170 3.718 0.028 19 0 "[ . 1 . 2]" 1
84 1 18 GLU H 1 18 GLU HG3 . . 3.520 2.973 2.808 3.214 . 0 0 "[ . 1 . 2]" 1
85 1 18 GLU H 1 18 GLU QB . . 3.550 2.400 2.335 2.484 . 0 0 "[ . 1 . 2]" 1
86 1 17 GLN HB2 1 18 GLU H . . 4.530 4.346 4.138 4.481 . 0 0 "[ . 1 . 2]" 1
87 1 17 GLN HG2 1 18 GLU H . . 5.280 4.575 3.784 5.282 0.002 3 0 "[ . 1 . 2]" 1
88 1 19 ILE H 1 63 PRO HA . . 4.400 4.078 3.935 4.202 . 0 0 "[ . 1 . 2]" 1
89 1 18 GLU HG2 1 19 ILE H . . 4.340 4.087 3.913 4.242 . 0 0 "[ . 1 . 2]" 1
90 1 18 GLU QB 1 19 ILE H . . 3.430 3.033 2.916 3.168 . 0 0 "[ . 1 . 2]" 1
91 1 19 ILE H 1 19 ILE HG13 . . 4.380 3.680 3.612 3.755 . 0 0 "[ . 1 . 2]" 1
92 1 19 ILE H 1 19 ILE MG . . 4.120 3.508 3.461 3.557 . 0 0 "[ . 1 . 2]" 1
93 1 25 LYS HA 1 28 LEU H . . 4.030 3.396 3.181 3.595 . 0 0 "[ . 1 . 2]" 1
94 1 27 GLY H 1 28 LEU H . . 4.650 2.566 2.166 2.808 . 0 0 "[ . 1 . 2]" 1
95 1 28 LEU H 1 29 VAL HA . . 5.210 4.959 4.837 5.171 . 0 0 "[ . 1 . 2]" 1
96 1 28 LEU H 1 28 LEU HB2 . . 3.600 2.296 2.168 2.380 . 0 0 "[ . 1 . 2]" 1
97 1 28 LEU H 1 28 LEU HB3 . . 3.600 3.561 3.482 3.614 0.014 6 0 "[ . 1 . 2]" 1
98 1 28 LEU H 1 28 LEU MD2 . . 4.370 4.281 4.136 4.369 . 0 0 "[ . 1 . 2]" 1
99 1 28 LEU H 1 29 VAL MG1 . . 4.040 3.355 3.096 3.589 . 0 0 "[ . 1 . 2]" 1
100 1 37 ILE HG12 1 48 MET H . . 4.580 4.403 4.166 4.568 . 0 0 "[ . 1 . 2]" 1
101 1 47 LYS HG2 1 48 MET H . . 4.290 3.012 2.713 3.339 . 0 0 "[ . 1 . 2]" 1
102 1 41 GLN QB 1 48 MET H . . 3.980 3.746 3.582 3.896 . 0 0 "[ . 1 . 2]" 1
103 1 41 GLN QE 1 48 MET H . . 5.140 2.684 2.342 3.046 . 0 0 "[ . 1 . 2]" 1
104 1 47 LYS HA 1 48 MET H . . 2.990 2.151 2.141 2.177 . 0 0 "[ . 1 . 2]" 1
105 1 41 GLN HG3 1 48 MET H . . 3.920 3.108 2.973 3.314 . 0 0 "[ . 1 . 2]" 1
106 1 48 MET H 1 48 MET HB3 . . 3.630 3.622 3.573 3.649 0.019 3 0 "[ . 1 . 2]" 1
107 1 48 MET H 1 48 MET HB2 . . 3.680 2.393 2.316 2.446 . 0 0 "[ . 1 . 2]" 1
108 1 48 MET H 1 48 MET HG3 . . 4.020 3.104 2.922 3.252 . 0 0 "[ . 1 . 2]" 1
109 1 23 ALA H 1 62 LYS H . . 4.830 3.899 3.299 4.275 . 0 0 "[ . 1 . 2]" 1
110 1 21 ILE H 1 62 LYS H . . 4.000 2.768 2.400 3.553 . 0 0 "[ . 1 . 2]" 1
111 1 61 ASP H 1 62 LYS H . . 5.140 4.363 3.997 4.650 . 0 0 "[ . 1 . 2]" 1
112 1 61 ASP HA 1 62 LYS H . . 3.060 2.380 2.151 2.506 . 0 0 "[ . 1 . 2]" 1
113 1 23 ALA HA 1 62 LYS H . . 5.240 4.997 4.092 5.229 . 0 0 "[ . 1 . 2]" 1
114 1 62 LYS H 1 63 PRO HD2 . . 5.500 4.686 4.485 4.791 . 0 0 "[ . 1 . 2]" 1
115 1 61 ASP HB2 1 62 LYS H . . 4.070 2.979 2.222 3.907 . 0 0 "[ . 1 . 2]" 1
116 1 61 ASP HB3 1 62 LYS H . . 4.070 3.527 2.268 4.091 0.021 16 0 "[ . 1 . 2]" 1
117 1 62 LYS H 1 62 LYS HB3 . . 3.970 3.836 3.654 3.908 . 0 0 "[ . 1 . 2]" 1
118 1 62 LYS H 1 62 LYS HB2 . . 3.550 2.821 2.668 2.936 . 0 0 "[ . 1 . 2]" 1
119 1 62 LYS H 1 62 LYS QG . . 3.750 2.635 2.050 2.890 . 0 0 "[ . 1 . 2]" 1
120 1 79 MET HB2 1 80 VAL H . . 4.300 2.726 2.500 3.037 . 0 0 "[ . 1 . 2]" 1
121 1 80 VAL H 1 80 VAL HB . . 3.240 2.628 2.523 2.735 . 0 0 "[ . 1 . 2]" 1
122 1 80 VAL H 1 80 VAL MG2 . . 3.290 2.094 1.918 2.362 . 0 0 "[ . 1 . 2]" 1
123 1 80 VAL H 1 80 VAL MG1 . . 3.910 3.774 3.753 3.809 . 0 0 "[ . 1 . 2]" 1
124 1 72 LYS H 1 72 LYS HG3 . . 3.940 2.477 2.136 2.791 . 0 0 "[ . 1 . 2]" 1
125 1 72 LYS H 1 73 VAL MG2 . . 4.840 4.141 4.023 4.233 . 0 0 "[ . 1 . 2]" 1
126 1 72 LYS H 1 73 VAL H . . 3.530 2.432 2.351 2.511 . 0 0 "[ . 1 . 2]" 1
127 1 70 PRO HA 1 72 LYS H . . 4.310 4.300 4.253 4.318 0.008 19 0 "[ . 1 . 2]" 1
128 1 71 TYR HB3 1 72 LYS H . . 4.200 3.056 2.966 3.113 . 0 0 "[ . 1 . 2]" 1
129 1 72 LYS H 1 72 LYS HB3 . . 3.760 3.663 3.647 3.671 . 0 0 "[ . 1 . 2]" 1
130 1 72 LYS H 1 72 LYS HB2 . . 3.290 2.582 2.472 2.701 . 0 0 "[ . 1 . 2]" 1
131 1 39 GLN H 1 40 LEU H . . 3.520 2.473 2.387 2.601 . 0 0 "[ . 1 . 2]" 1
132 1 37 ILE HA 1 40 LEU H . . 3.820 3.192 3.103 3.260 . 0 0 "[ . 1 . 2]" 1
133 1 40 LEU H 1 40 LEU HG . . 3.180 2.642 2.405 2.830 . 0 0 "[ . 1 . 2]" 1
134 1 71 TYR H 1 73 VAL H . . 5.420 4.131 3.940 4.279 . 0 0 "[ . 1 . 2]" 1
135 1 73 VAL H 1 75 GLN H . . 4.430 4.279 4.096 4.394 . 0 0 "[ . 1 . 2]" 1
136 1 40 LEU H 1 40 LEU HB2 . . 3.120 2.297 2.211 2.394 . 0 0 "[ . 1 . 2]" 1
137 1 73 VAL H 1 73 VAL HB . . 3.440 2.515 2.419 2.643 . 0 0 "[ . 1 . 2]" 1
138 1 73 VAL H 1 73 VAL MG2 . . 3.280 2.237 2.074 2.322 . 0 0 "[ . 1 . 2]" 1
139 1 61 ASP H 1 61 ASP HB2 . . 4.020 3.639 2.380 4.051 0.031 3 0 "[ . 1 . 2]" 1
140 1 61 ASP H 1 61 ASP HB3 . . 4.020 3.411 2.567 4.034 0.014 11 0 "[ . 1 . 2]" 1
141 1 78 GLU H 1 80 VAL H . . 5.070 4.175 3.869 4.432 . 0 0 "[ . 1 . 2]" 1
142 1 78 GLU HA 1 80 VAL H . . 4.730 4.343 3.894 4.673 . 0 0 "[ . 1 . 2]" 1
143 1 77 LYS HA 1 80 VAL H . . 3.940 3.745 3.579 3.863 . 0 0 "[ . 1 . 2]" 1
144 1 81 LEU H 1 83 LEU H . . 5.170 4.021 3.843 4.140 . 0 0 "[ . 1 . 2]" 1
145 1 82 GLU HB3 1 83 LEU H . . 4.320 2.969 2.812 3.202 . 0 0 "[ . 1 . 2]" 1
146 1 83 LEU H 1 83 LEU HB2 . . 3.140 2.296 2.194 2.356 . 0 0 "[ . 1 . 2]" 1
147 1 83 LEU H 1 83 LEU HB3 . . 3.140 2.748 2.672 2.865 . 0 0 "[ . 1 . 2]" 1
148 1 83 LEU H 1 83 LEU MD2 . . 3.860 3.789 3.640 3.860 . 0 0 "[ . 1 . 2]" 1
149 1 82 GLU QG 1 83 LEU H . . 4.630 4.083 3.693 4.539 . 0 0 "[ . 1 . 2]" 1
150 1 46 VAL MG1 1 47 LYS H . . 4.000 3.612 3.444 3.754 . 0 0 "[ . 1 . 2]" 1
151 1 79 MET H 1 80 VAL MG2 . . 4.690 4.105 3.985 4.296 . 0 0 "[ . 1 . 2]" 1
152 1 36 THR HA 1 39 GLN H . . 3.950 3.494 3.379 3.667 . 0 0 "[ . 1 . 2]" 1
153 1 39 GLN H 1 39 GLN HB2 . . 3.710 2.343 2.186 3.521 . 0 0 "[ . 1 . 2]" 1
154 1 38 LYS QB 1 39 GLN H . . 3.380 2.612 2.490 2.771 . 0 0 "[ . 1 . 2]" 1
155 1 39 GLN H 1 39 GLN HG3 . . 3.990 3.385 2.627 3.991 0.001 18 0 "[ . 1 . 2]" 1
156 1 42 GLU H 1 42 GLU HG2 . . 3.600 2.741 2.122 3.591 . 0 0 "[ . 1 . 2]" 1
157 1 42 GLU H 1 42 GLU HG3 . . 3.600 3.123 2.444 3.584 . 0 0 "[ . 1 . 2]" 1
158 1 42 GLU H 1 42 GLU HB2 . . 3.770 2.660 2.406 3.677 . 0 0 "[ . 1 . 2]" 1
159 1 42 GLU H 1 42 GLU HB3 . . 3.770 3.480 2.465 3.669 . 0 0 "[ . 1 . 2]" 1
160 1 42 GLU H 1 43 ARG H . . 3.710 2.369 2.165 2.621 . 0 0 "[ . 1 . 2]" 1
161 1 49 VAL H 1 50 MET H . . 4.670 4.154 4.054 4.310 . 0 0 "[ . 1 . 2]" 1
162 1 48 MET HA 1 49 VAL H . . 3.210 2.144 2.141 2.150 . 0 0 "[ . 1 . 2]" 1
163 1 49 VAL H 1 66 ILE HA . . 4.040 3.199 2.963 3.437 . 0 0 "[ . 1 . 2]" 1
164 1 40 LEU MD2 1 43 ARG H . . 4.610 4.573 4.426 4.614 0.004 13 0 "[ . 1 . 2]" 1
165 1 49 VAL H 1 64 LEU MD1 . . 3.850 2.565 2.183 2.908 . 0 0 "[ . 1 . 2]" 1
166 1 48 MET HG2 1 49 VAL H . . 4.460 4.256 4.086 4.434 . 0 0 "[ . 1 . 2]" 1
167 1 48 MET HB3 1 49 VAL H . . 3.740 3.542 3.343 3.663 . 0 0 "[ . 1 . 2]" 1
168 1 43 ARG H 1 43 ARG HG3 . . 4.060 2.962 2.567 3.727 . 0 0 "[ . 1 . 2]" 1
169 1 49 VAL H 1 49 VAL HB . . 3.150 2.698 2.630 2.817 . 0 0 "[ . 1 . 2]" 1
170 1 47 LYS H 1 67 THR HB . . 4.570 4.493 4.427 4.572 0.002 9 0 "[ . 1 . 2]" 1
171 1 47 LYS H 1 47 LYS HG2 . . 4.720 4.578 4.492 4.661 . 0 0 "[ . 1 . 2]" 1
172 1 47 LYS H 1 47 LYS HB2 . . 3.510 2.459 2.392 2.565 . 0 0 "[ . 1 . 2]" 1
173 1 47 LYS H 1 47 LYS HG3 . . 4.720 4.386 4.317 4.470 . 0 0 "[ . 1 . 2]" 1
174 1 24 SER HB2 1 25 LYS H . . 4.320 2.973 2.401 3.935 . 0 0 "[ . 1 . 2]" 1
175 1 24 SER HB3 1 25 LYS H . . 4.320 3.189 2.322 3.957 . 0 0 "[ . 1 . 2]" 1
176 1 25 LYS H 1 26 ALA HA . . 5.090 4.821 4.686 4.920 . 0 0 "[ . 1 . 2]" 1
177 1 25 LYS H 1 25 LYS HB3 . . 4.050 3.642 3.612 3.680 . 0 0 "[ . 1 . 2]" 1
178 1 25 LYS H 1 25 LYS HB2 . . 3.510 2.611 2.526 2.707 . 0 0 "[ . 1 . 2]" 1
179 1 25 LYS H 1 25 LYS HG2 . . 3.690 2.177 1.919 2.340 . 0 0 "[ . 1 . 2]" 1
180 1 21 ILE MG 1 25 LYS H . . 4.530 4.248 4.017 4.428 . 0 0 "[ . 1 . 2]" 1
181 1 77 LYS H 1 79 MET H . . 4.910 4.294 3.776 4.540 . 0 0 "[ . 1 . 2]" 1
182 1 79 MET H 1 80 VAL H . . 3.640 2.765 2.667 2.867 . 0 0 "[ . 1 . 2]" 1
183 1 78 GLU QB 1 79 MET H . . 3.520 2.616 2.391 3.361 . 0 0 "[ . 1 . 2]" 1
184 1 79 MET H 1 79 MET HB3 . . 3.750 3.543 3.514 3.567 . 0 0 "[ . 1 . 2]" 1
185 1 40 LEU HA 1 42 GLU H . . 4.070 3.924 3.712 4.063 . 0 0 "[ . 1 . 2]" 1
186 1 42 GLU HB2 1 43 ARG H . . 4.030 2.789 2.242 4.025 . 0 0 "[ . 1 . 2]" 1
187 1 43 ARG H 1 43 ARG HB3 . . 3.590 3.536 3.508 3.577 . 0 0 "[ . 1 . 2]" 1
188 1 40 LEU HA 1 43 ARG H . . 3.850 3.254 3.106 3.462 . 0 0 "[ . 1 . 2]" 1
189 1 80 VAL HB 1 81 LEU H . . 3.570 2.397 2.239 2.682 . 0 0 "[ . 1 . 2]" 1
190 1 81 LEU H 1 81 LEU HB2 . . 3.190 2.322 2.209 2.403 . 0 0 "[ . 1 . 2]" 1
191 1 81 LEU H 1 81 LEU HG . . 3.180 2.582 2.402 2.842 . 0 0 "[ . 1 . 2]" 1
192 1 81 LEU H 1 81 LEU HB3 . . 3.900 3.555 3.510 3.578 . 0 0 "[ . 1 . 2]" 1
193 1 81 LEU H 1 81 LEU MD1 . . 3.930 3.521 3.406 3.588 . 0 0 "[ . 1 . 2]" 1
194 1 73 VAL H 1 74 GLN H . . 3.880 2.926 2.845 3.008 . 0 0 "[ . 1 . 2]" 1
195 1 74 GLN H 1 76 ALA H . . 5.050 4.366 3.985 4.650 . 0 0 "[ . 1 . 2]" 1
196 1 74 GLN H 1 74 GLN HG2 . . 4.240 2.413 2.187 3.019 . 0 0 "[ . 1 . 2]" 1
197 1 74 GLN H 1 74 GLN HG3 . . 4.240 3.160 2.237 3.602 . 0 0 "[ . 1 . 2]" 1
198 1 74 GLN H 1 74 GLN QB . . 3.130 2.443 2.319 2.650 . 0 0 "[ . 1 . 2]" 1
199 1 73 VAL HB 1 74 GLN H . . 3.370 2.736 2.525 3.074 . 0 0 "[ . 1 . 2]" 1
200 1 73 VAL MG1 1 74 GLN H . . 3.970 3.282 3.014 3.503 . 0 0 "[ . 1 . 2]" 1
201 1 66 ILE H 1 67 THR H . . 5.500 4.146 4.045 4.224 . 0 0 "[ . 1 . 2]" 1
202 1 47 LYS H 1 67 THR H . . 4.060 3.809 3.703 4.040 . 0 0 "[ . 1 . 2]" 1
203 1 48 MET HA 1 67 THR H . . 4.430 3.686 3.458 3.834 . 0 0 "[ . 1 . 2]" 1
204 1 66 ILE HA 1 67 THR H . . 3.170 2.166 2.145 2.181 . 0 0 "[ . 1 . 2]" 1
205 1 46 VAL HB 1 67 THR H . . 4.400 4.297 4.114 4.403 0.003 3 0 "[ . 1 . 2]" 1
206 1 47 LYS HB3 1 67 THR H . . 4.120 3.248 3.039 3.535 . 0 0 "[ . 1 . 2]" 1
207 1 67 THR H 1 73 VAL MG1 . . 4.910 4.809 4.593 4.919 0.009 19 0 "[ . 1 . 2]" 1
208 1 77 LYS H 1 77 LYS HB3 . . 3.450 2.324 2.172 2.425 . 0 0 "[ . 1 . 2]" 1
209 1 77 LYS H 1 77 LYS HB2 . . 3.580 2.774 2.682 3.021 . 0 0 "[ . 1 . 2]" 1
210 1 66 ILE MD 1 77 LYS H . . 4.300 3.098 2.814 3.552 . 0 0 "[ . 1 . 2]" 1
211 1 71 TYR H 1 72 LYS H . . 3.510 2.226 2.196 2.288 . 0 0 "[ . 1 . 2]" 1
212 1 71 TYR H 1 71 TYR QD . . 4.890 4.198 4.142 4.228 . 0 0 "[ . 1 . 2]" 1
213 1 71 TYR H 1 71 TYR HB2 . . 3.570 2.792 2.663 2.923 . 0 0 "[ . 1 . 2]" 1
214 1 71 TYR H 1 71 TYR HB3 . . 3.570 2.471 2.371 2.541 . 0 0 "[ . 1 . 2]" 1
215 1 36 THR H 1 37 ILE H . . 3.200 2.722 2.460 3.023 . 0 0 "[ . 1 . 2]" 1
216 1 36 THR H 1 38 LYS H . . 4.180 3.827 3.589 4.058 . 0 0 "[ . 1 . 2]" 1
217 1 36 THR H 1 36 THR HB . . 3.380 2.495 2.391 2.606 . 0 0 "[ . 1 . 2]" 1
218 1 36 THR H 1 36 THR MG . . 4.200 3.769 3.741 3.800 . 0 0 "[ . 1 . 2]" 1
219 1 34 GLY H 1 35 GLU H . . 3.390 2.690 2.067 3.074 . 0 0 "[ . 1 . 2]" 1
220 1 35 GLU H 1 35 GLU QB . . 3.370 2.364 2.207 2.922 . 0 0 "[ . 1 . 2]" 1
221 1 16 VAL H 1 17 GLN H . . 5.010 4.280 4.017 4.389 . 0 0 "[ . 1 . 2]" 1
222 1 15 ALA H 1 16 VAL H . . 4.590 4.573 4.538 4.599 0.009 17 0 "[ . 1 . 2]" 1
223 1 15 ALA HA 1 16 VAL H . . 2.970 2.226 2.186 2.296 . 0 0 "[ . 1 . 2]" 1
224 1 16 VAL H 1 16 VAL HB . . 3.660 3.136 3.049 3.222 . 0 0 "[ . 1 . 2]" 1
225 1 15 ALA MB 1 16 VAL H . . 3.750 2.873 2.634 2.993 . 0 0 "[ . 1 . 2]" 1
226 1 16 VAL H 1 16 VAL MG1 . . 3.760 2.264 2.173 2.371 . 0 0 "[ . 1 . 2]" 1
227 1 16 VAL H 1 16 VAL MG2 . . 3.980 3.970 3.946 3.995 0.015 14 0 "[ . 1 . 2]" 1
228 1 81 LEU H 1 82 GLU H . . 3.770 2.795 2.671 2.884 . 0 0 "[ . 1 . 2]" 1
229 1 82 GLU H 1 82 GLU HB2 . . 3.240 2.523 2.342 2.865 . 0 0 "[ . 1 . 2]" 1
230 1 82 GLU H 1 82 GLU HB3 . . 3.240 2.571 2.256 2.758 . 0 0 "[ . 1 . 2]" 1
231 1 81 LEU HB2 1 82 GLU H . . 3.750 2.738 2.542 2.989 . 0 0 "[ . 1 . 2]" 1
232 1 82 GLU H 1 82 GLU QG . . 4.170 3.976 3.934 4.042 . 0 0 "[ . 1 . 2]" 1
233 1 80 VAL H 1 82 GLU H . . 4.130 4.013 3.793 4.130 . 0 0 "[ . 1 . 2]" 1
234 1 81 LEU MD1 1 82 GLU H . . 4.880 4.508 4.335 4.735 . 0 0 "[ . 1 . 2]" 1
235 1 81 LEU MD2 1 82 GLU H . . 5.310 4.721 4.630 4.771 . 0 0 "[ . 1 . 2]" 1
236 1 75 GLN H 1 77 LYS H . . 4.470 4.086 3.796 4.344 . 0 0 "[ . 1 . 2]" 1
237 1 74 GLN HG2 1 75 GLN H . . 5.020 3.821 2.755 4.731 . 0 0 "[ . 1 . 2]" 1
238 1 75 GLN H 1 75 GLN HB2 . . 3.070 2.418 2.245 2.692 . 0 0 "[ . 1 . 2]" 1
239 1 75 GLN H 1 75 GLN HG2 . . 3.900 2.513 2.190 2.867 . 0 0 "[ . 1 . 2]" 1
240 1 43 ARG H 1 44 ALA H . . 3.520 2.748 2.607 3.023 . 0 0 "[ . 1 . 2]" 1
241 1 42 GLU H 1 44 ALA H . . 4.450 3.929 3.686 4.116 . 0 0 "[ . 1 . 2]" 1
242 1 44 ALA H 1 46 VAL H . . 4.810 3.786 3.550 4.055 . 0 0 "[ . 1 . 2]" 1
243 1 40 LEU HA 1 44 ALA H . . 4.410 4.228 3.844 4.409 . 0 0 "[ . 1 . 2]" 1
244 1 41 GLN HA 1 44 ALA H . . 4.130 3.959 3.819 4.066 . 0 0 "[ . 1 . 2]" 1
245 1 43 ARG HB2 1 44 ALA H . . 3.600 2.885 2.577 3.039 . 0 0 "[ . 1 . 2]" 1
246 1 43 ARG HB3 1 44 ALA H . . 3.600 3.478 3.163 3.600 . 0 0 "[ . 1 . 2]" 1
247 1 44 ALA H 1 44 ALA MB . . 3.190 2.313 2.239 2.434 . 0 0 "[ . 1 . 2]" 1
248 1 76 ALA H 1 78 GLU H . . 4.650 4.348 4.099 4.649 . 0 0 "[ . 1 . 2]" 1
249 1 77 LYS H 1 78 GLU H . . 3.710 2.869 2.640 3.061 . 0 0 "[ . 1 . 2]" 1
250 1 78 GLU H 1 78 GLU HG3 . . 3.750 2.818 2.211 3.645 . 0 0 "[ . 1 . 2]" 1
251 1 77 LYS HB3 1 78 GLU H . . 3.340 2.788 2.445 3.119 . 0 0 "[ . 1 . 2]" 1
252 1 40 LEU H 1 41 GLN H . . 3.770 2.599 2.410 2.710 . 0 0 "[ . 1 . 2]" 1
253 1 41 GLN H 1 41 GLN QE . . 4.730 4.288 3.965 4.591 . 0 0 "[ . 1 . 2]" 1
254 1 38 LYS HA 1 41 GLN H . . 4.100 3.797 3.663 3.954 . 0 0 "[ . 1 . 2]" 1
255 1 40 LEU HA 1 41 GLN H . . 3.550 3.423 3.350 3.480 . 0 0 "[ . 1 . 2]" 1
256 1 41 GLN H 1 41 GLN HG2 . . 3.810 3.597 3.396 3.784 . 0 0 "[ . 1 . 2]" 1
257 1 41 GLN H 1 41 GLN HG3 . . 3.280 2.415 2.131 2.660 . 0 0 "[ . 1 . 2]" 1
258 1 41 GLN H 1 41 GLN QB . . 3.210 2.368 2.279 2.497 . 0 0 "[ . 1 . 2]" 1
259 1 40 LEU HB2 1 41 GLN H . . 3.690 3.151 2.997 3.353 . 0 0 "[ . 1 . 2]" 1
260 1 40 LEU HB3 1 41 GLN H . . 4.200 3.845 3.609 4.025 . 0 0 "[ . 1 . 2]" 1
261 1 40 LEU MD1 1 41 GLN H . . 5.410 4.911 4.716 5.104 . 0 0 "[ . 1 . 2]" 1
262 1 29 VAL H 1 31 GLY H . . 4.450 4.117 3.839 4.352 . 0 0 "[ . 1 . 2]" 1
263 1 29 VAL H 1 30 ILE H . . 3.130 2.363 2.221 2.660 . 0 0 "[ . 1 . 2]" 1
264 1 28 LEU H 1 29 VAL H . . 3.070 2.271 2.104 2.508 . 0 0 "[ . 1 . 2]" 1
265 1 26 ALA HA 1 29 VAL H . . 3.910 3.599 3.330 3.913 0.003 15 0 "[ . 1 . 2]" 1
266 1 29 VAL H 1 29 VAL HB . . 3.160 2.834 2.608 3.059 . 0 0 "[ . 1 . 2]" 1
267 1 28 LEU HB2 1 29 VAL H . . 3.820 2.710 2.370 2.956 . 0 0 "[ . 1 . 2]" 1
268 1 28 LEU HB3 1 29 VAL H . . 3.820 3.412 3.121 3.670 . 0 0 "[ . 1 . 2]" 1
269 1 29 VAL H 1 29 VAL MG1 . . 3.190 1.953 1.827 2.140 . 0 0 "[ . 1 . 2]" 1
270 1 29 VAL H 1 29 VAL MG2 . . 3.900 3.754 3.697 3.798 . 0 0 "[ . 1 . 2]" 1
271 1 27 GLY QA 1 30 ILE H . . 3.870 3.549 3.205 3.872 0.002 18 0 "[ . 1 . 2]" 1
272 1 30 ILE H 1 30 ILE HB . . 3.360 2.527 2.441 2.656 . 0 0 "[ . 1 . 2]" 1
273 1 30 ILE H 1 30 ILE HG13 . . 3.780 2.389 2.063 2.578 . 0 0 "[ . 1 . 2]" 1
274 1 30 ILE H 1 30 ILE MG . . 3.870 3.787 3.758 3.821 . 0 0 "[ . 1 . 2]" 1
275 1 30 ILE H 1 30 ILE MD . . 3.890 3.779 3.527 3.881 . 0 0 "[ . 1 . 2]" 1
276 1 29 VAL MG2 1 30 ILE H . . 3.960 3.672 3.347 3.894 . 0 0 "[ . 1 . 2]" 1
277 1 67 THR H 1 68 GLY H . . 5.080 4.563 4.545 4.573 . 0 0 "[ . 1 . 2]" 1
278 1 14 ASN QB 1 68 GLY H . . 4.660 3.355 2.891 4.153 . 0 0 "[ . 1 . 2]" 1
279 1 68 GLY H 1 73 VAL MG2 . . 3.460 2.727 2.535 2.890 . 0 0 "[ . 1 . 2]" 1
280 1 53 ASP QB 1 54 GLY H . . 5.400 3.299 1.953 4.051 . 0 0 "[ . 1 . 2]" 1
281 1 54 GLY H 1 55 PRO QD . . 5.210 3.357 2.026 4.380 . 0 0 "[ . 1 . 2]" 1
282 1 45 GLY QA 1 46 VAL H . . 3.290 2.763 2.589 2.920 . 0 0 "[ . 1 . 2]" 1
283 1 44 ALA MB 1 46 VAL H . . 4.140 3.106 2.363 3.563 . 0 0 "[ . 1 . 2]" 1
284 1 46 VAL H 1 46 VAL MG1 . . 3.690 3.012 2.435 3.354 . 0 0 "[ . 1 . 2]" 1
285 1 46 VAL H 1 46 VAL MG2 . . 3.340 2.278 2.053 2.524 . 0 0 "[ . 1 . 2]" 1
286 1 45 GLY H 1 46 VAL H . . 3.490 2.470 2.241 2.786 . 0 0 "[ . 1 . 2]" 1
287 1 41 GLN QB 1 46 VAL H . . 4.670 3.798 3.245 4.637 . 0 0 "[ . 1 . 2]" 1
288 1 81 LEU HA 1 84 ILE H . . 4.090 3.681 3.513 3.798 . 0 0 "[ . 1 . 2]" 1
289 1 84 ILE H 1 84 ILE HG12 . . 3.450 2.613 2.239 3.360 . 0 0 "[ . 1 . 2]" 1
290 1 84 ILE H 1 84 ILE MG . . 3.450 2.444 2.263 2.674 . 0 0 "[ . 1 . 2]" 1
291 1 84 ILE H 1 84 ILE HB . . 4.080 3.655 3.626 3.689 . 0 0 "[ . 1 . 2]" 1
292 1 83 LEU HB2 1 84 ILE H . . 4.020 3.711 3.537 3.837 . 0 0 "[ . 1 . 2]" 1
293 1 84 ILE H 1 84 ILE HG13 . . 3.410 2.502 1.900 2.832 . 0 0 "[ . 1 . 2]" 1
294 1 43 ARG H 1 45 GLY H . . 5.030 3.836 3.669 4.010 . 0 0 "[ . 1 . 2]" 1
295 1 44 ALA MB 1 45 GLY H . . 4.210 2.947 2.735 3.325 . 0 0 "[ . 1 . 2]" 1
296 1 28 LEU HA 1 31 GLY H . . 4.440 3.924 3.468 4.319 . 0 0 "[ . 1 . 2]" 1
297 1 31 GLY H 1 36 THR HB . . 4.690 4.122 3.751 4.523 . 0 0 "[ . 1 . 2]" 1
298 1 30 ILE HG13 1 31 GLY H . . 4.370 4.137 3.856 4.334 . 0 0 "[ . 1 . 2]" 1
299 1 78 GLU H 1 79 MET H . . 3.560 2.585 2.360 2.745 . 0 0 "[ . 1 . 2]" 1
300 1 82 GLU H 1 83 LEU H . . 3.480 2.497 2.351 2.597 . 0 0 "[ . 1 . 2]" 1
301 1 82 GLU H 1 84 ILE H . . 4.630 4.268 4.040 4.561 . 0 0 "[ . 1 . 2]" 1
302 1 84 ILE H 1 85 ARG H . . 3.240 2.325 2.170 2.495 . 0 0 "[ . 1 . 2]" 1
303 1 38 LYS H 1 39 GLN H . . 3.380 2.730 2.594 2.921 . 0 0 "[ . 1 . 2]" 1
304 1 30 ILE H 1 31 GLY H . . 3.260 2.398 2.177 2.649 . 0 0 "[ . 1 . 2]" 1
305 1 31 GLY H 1 35 GLU H . . 5.290 4.947 4.435 5.282 . 0 0 "[ . 1 . 2]" 1
306 1 31 GLY H 1 36 THR H . . 5.500 4.703 4.166 5.135 . 0 0 "[ . 1 . 2]" 1
307 1 19 ILE H 1 64 LEU H . . 3.860 2.895 2.771 2.980 . 0 0 "[ . 1 . 2]" 1
308 1 44 ALA H 1 45 GLY H . . 3.270 2.047 1.939 2.252 . 0 0 "[ . 1 . 2]" 1
309 1 46 VAL H 1 47 LYS H . . 5.480 4.443 4.364 4.581 . 0 0 "[ . 1 . 2]" 1
310 1 47 LYS H 1 68 GLY HA2 . . 4.440 3.814 3.591 4.239 . 0 0 "[ . 1 . 2]" 1
311 1 41 GLN H 1 43 ARG H . . 5.500 4.106 3.838 4.654 . 0 0 "[ . 1 . 2]" 1
312 1 38 LYS H 1 41 GLN QE . . 5.430 4.431 3.922 4.867 . 0 0 "[ . 1 . 2]" 1
313 1 38 LYS H 1 40 LEU H . . 5.500 4.012 3.891 4.207 . 0 0 "[ . 1 . 2]" 1
314 1 30 ILE HB 1 34 GLY H . . 5.500 4.598 4.155 5.332 . 0 0 "[ . 1 . 2]" 1
315 1 32 LYS QB 1 34 GLY H . . 5.500 5.067 4.193 5.472 . 0 0 "[ . 1 . 2]" 1
316 1 34 GLY H 1 35 GLU QB . . 5.390 4.445 3.827 5.091 . 0 0 "[ . 1 . 2]" 1
317 1 32 LYS H 1 35 GLU H . . 5.500 3.692 3.067 4.029 . 0 0 "[ . 1 . 2]" 1
318 1 30 ILE HG12 1 31 GLY H . . 5.070 4.880 4.660 5.023 . 0 0 "[ . 1 . 2]" 1
319 1 29 VAL H 1 30 ILE HG13 . . 4.800 3.902 3.683 4.108 . 0 0 "[ . 1 . 2]" 1
320 1 28 LEU H 1 31 GLY H . . 4.560 4.258 4.105 4.493 . 0 0 "[ . 1 . 2]" 1
321 1 23 ALA H 1 25 LYS H . . 5.500 4.656 4.422 4.797 . 0 0 "[ . 1 . 2]" 1
322 1 18 GLU H 1 19 ILE MD . . 5.010 3.699 3.461 3.854 . 0 0 "[ . 1 . 2]" 1
323 1 18 GLU H 1 19 ILE H . . 4.500 4.478 4.418 4.523 0.023 10 0 "[ . 1 . 2]" 1
324 1 17 GLN H 1 18 GLU H . . 4.640 4.306 4.185 4.509 . 0 0 "[ . 1 . 2]" 1
325 1 17 GLN H 1 67 THR MG . . 5.220 4.164 4.027 4.424 . 0 0 "[ . 1 . 2]" 1
326 1 15 ALA H 1 70 PRO HG3 . . 5.500 5.258 4.950 5.465 . 0 0 "[ . 1 . 2]" 1
327 1 15 ALA H 1 73 VAL HB . . 5.500 5.401 5.125 5.503 0.003 13 0 "[ . 1 . 2]" 1
328 1 51 ILE H 1 63 PRO HD2 . . 4.840 4.735 4.569 4.825 . 0 0 "[ . 1 . 2]" 1
329 1 54 GLY H 1 55 PRO HA . . 5.500 5.137 4.265 5.482 . 0 0 "[ . 1 . 2]" 1
330 1 69 ASP H 1 72 LYS HB3 . . 5.170 4.322 3.938 5.172 0.002 10 0 "[ . 1 . 2]" 1
331 1 69 ASP H 1 72 LYS HD2 . . 5.500 4.808 3.824 5.399 . 0 0 "[ . 1 . 2]" 1
332 1 68 GLY H 1 69 ASP H . . 4.410 4.007 3.703 4.446 0.036 4 0 "[ . 1 . 2]" 1
333 1 69 ASP H 1 72 LYS H . . 5.120 4.035 3.789 4.721 . 0 0 "[ . 1 . 2]" 1
334 1 40 LEU H 1 43 ARG H . . 5.500 4.981 4.879 5.292 . 0 0 "[ . 1 . 2]" 1
335 1 73 VAL H 1 76 ALA H . . 5.500 4.898 4.684 5.168 . 0 0 "[ . 1 . 2]" 1
336 1 74 GLN H 1 75 GLN H . . 3.530 2.593 2.441 2.752 . 0 0 "[ . 1 . 2]" 1
337 1 72 LYS H 1 74 GLN H . . 4.020 3.791 3.617 3.908 . 0 0 "[ . 1 . 2]" 1
338 1 71 TYR H 1 74 GLN H . . 5.310 4.932 4.836 5.072 . 0 0 "[ . 1 . 2]" 1
339 1 77 LYS H 1 80 VAL H . . 5.220 4.979 4.799 5.121 . 0 0 "[ . 1 . 2]" 1
340 1 76 ALA MB 1 78 GLU H . . 5.500 4.463 4.111 5.070 . 0 0 "[ . 1 . 2]" 1
341 1 78 GLU H 1 81 LEU MD1 . . 5.500 4.158 3.759 4.404 . 0 0 "[ . 1 . 2]" 1
342 1 80 VAL H 1 83 LEU H . . 5.500 4.669 4.590 4.883 . 0 0 "[ . 1 . 2]" 1
343 1 80 VAL HA 1 84 ILE H . . 5.500 4.610 4.396 4.800 . 0 0 "[ . 1 . 2]" 1
344 1 50 MET HB3 1 51 ILE H . . 5.240 3.370 3.125 3.552 . 0 0 "[ . 1 . 2]" 1
345 1 17 GLN H 1 17 GLN HB3 . . 4.050 3.538 2.775 3.760 . 0 0 "[ . 1 . 2]" 1
346 1 16 VAL MG1 1 17 GLN H . . 4.120 3.759 3.494 4.024 . 0 0 "[ . 1 . 2]" 1
347 1 45 GLY H 1 46 VAL MG2 . . 4.940 3.740 3.508 4.079 . 0 0 "[ . 1 . 2]" 1
348 1 43 ARG HG3 1 44 ALA H . . 5.200 4.838 4.561 5.148 . 0 0 "[ . 1 . 2]" 1
349 1 36 THR HB 1 38 LYS H . . 5.180 4.679 4.507 4.897 . 0 0 "[ . 1 . 2]" 1
350 1 37 ILE H 1 37 ILE MD . . 4.550 4.374 4.347 4.418 . 0 0 "[ . 1 . 2]" 1
351 1 72 LYS H 1 72 LYS HG2 . . 3.940 3.253 3.210 3.299 . 0 0 "[ . 1 . 2]" 1
352 1 79 MET H 1 79 MET HB2 . . 3.750 2.282 2.219 2.348 . 0 0 "[ . 1 . 2]" 1
353 1 40 LEU MD2 1 79 MET H . . 5.500 5.450 5.176 5.505 0.005 15 0 "[ . 1 . 2]" 1
354 1 50 MET HA 1 65 ARG H . . 3.240 2.925 2.508 3.080 . 0 0 "[ . 1 . 2]" 1
355 1 51 ILE H 1 51 ILE MG . . 4.160 3.824 3.797 3.868 . 0 0 "[ . 1 . 2]" 1
356 1 48 MET H 1 49 VAL H . . 4.370 4.323 4.239 4.388 0.018 10 0 "[ . 1 . 2]" 1
357 1 50 MET H 1 51 ILE H . . 4.750 4.508 4.423 4.576 . 0 0 "[ . 1 . 2]" 1
358 1 51 ILE H 1 65 ARG H . . 4.920 3.145 2.925 3.370 . 0 0 "[ . 1 . 2]" 1
359 1 80 VAL H 1 81 LEU H . . 2.790 2.603 2.356 2.738 . 0 0 "[ . 1 . 2]" 1
360 1 71 TYR QD 1 72 LYS H . . 4.670 3.857 3.463 4.401 . 0 0 "[ . 1 . 2]" 1
361 1 71 TYR QD 1 72 LYS HA . . 4.950 3.452 2.866 4.605 . 0 0 "[ . 1 . 2]" 1
362 1 71 TYR QD 1 72 LYS HG3 . . 4.890 3.847 3.481 4.723 . 0 0 "[ . 1 . 2]" 1
363 1 71 TYR QD 1 72 LYS HG2 . . 4.890 3.045 2.537 4.291 . 0 0 "[ . 1 . 2]" 1
364 1 16 VAL HA 1 17 GLN H . . 3.070 2.182 2.142 2.231 . 0 0 "[ . 1 . 2]" 1
365 1 16 VAL HA 1 68 GLY H . . 4.730 3.731 3.571 3.854 . 0 0 "[ . 1 . 2]" 1
366 1 16 VAL HA 1 67 THR HA . . 3.590 2.199 2.101 2.314 . 0 0 "[ . 1 . 2]" 1
367 1 15 ALA MB 1 16 VAL HA . . 4.760 3.947 3.854 4.011 . 0 0 "[ . 1 . 2]" 1
368 1 16 VAL HA 1 65 ARG HG2 . . 5.390 4.604 4.268 4.916 . 0 0 "[ . 1 . 2]" 1
369 1 16 VAL HA 1 16 VAL MG1 . . 3.260 3.189 3.181 3.195 . 0 0 "[ . 1 . 2]" 1
370 1 16 VAL HA 1 16 VAL MG2 . . 3.230 2.178 2.115 2.311 . 0 0 "[ . 1 . 2]" 1
371 1 16 VAL HA 1 73 VAL MG2 . . 3.970 3.037 2.733 3.440 . 0 0 "[ . 1 . 2]" 1
372 1 16 VAL HA 1 73 VAL MG1 . . 4.190 2.785 2.383 3.041 . 0 0 "[ . 1 . 2]" 1
373 1 15 ALA HA 1 16 VAL HA . . 5.000 4.436 4.419 4.461 . 0 0 "[ . 1 . 2]" 1
374 1 16 VAL HA 1 17 GLN HA . . 5.360 4.413 4.393 4.440 . 0 0 "[ . 1 . 2]" 1
375 1 48 MET HA 1 66 ILE HA . . 3.730 2.561 2.453 2.706 . 0 0 "[ . 1 . 2]" 1
376 1 66 ILE HA 1 66 ILE HG12 . . 3.660 2.438 2.356 2.491 . 0 0 "[ . 1 . 2]" 1
377 1 66 ILE HA 1 66 ILE HG13 . . 3.550 3.138 3.056 3.201 . 0 0 "[ . 1 . 2]" 1
378 1 47 LYS H 1 66 ILE HA . . 5.500 5.025 4.819 5.327 . 0 0 "[ . 1 . 2]" 1
379 1 48 MET H 1 66 ILE HA . . 5.500 5.036 4.922 5.154 . 0 0 "[ . 1 . 2]" 1
380 1 67 THR HA 1 68 GLY H . . 3.130 2.319 2.255 2.370 . 0 0 "[ . 1 . 2]" 1
381 1 67 THR HA 1 67 THR MG . . 3.470 2.051 1.996 2.120 . 0 0 "[ . 1 . 2]" 1
382 1 66 ILE MG 1 67 THR HA . . 4.220 3.854 3.748 4.008 . 0 0 "[ . 1 . 2]" 1
383 1 16 VAL MG2 1 67 THR HA . . 3.490 2.662 2.300 3.024 . 0 0 "[ . 1 . 2]" 1
384 1 67 THR HA 1 73 VAL MG2 . . 3.590 2.822 2.657 2.915 . 0 0 "[ . 1 . 2]" 1
385 1 18 GLU HG3 1 65 ARG HA . . 3.820 3.447 3.096 3.819 . 0 0 "[ . 1 . 2]" 1
386 1 19 ILE H 1 65 ARG HA . . 4.660 3.919 3.746 3.998 . 0 0 "[ . 1 . 2]" 1
387 1 41 GLN QB 1 47 LYS HA . . 4.090 3.051 2.687 3.273 . 0 0 "[ . 1 . 2]" 1
388 1 41 GLN HG3 1 47 LYS HA . . 4.150 4.070 3.891 4.133 . 0 0 "[ . 1 . 2]" 1
389 1 47 LYS HA 1 47 LYS HG3 . . 4.110 2.503 2.313 2.794 . 0 0 "[ . 1 . 2]" 1
390 1 18 GLU HA 1 66 ILE H . . 4.320 3.276 3.119 3.503 . 0 0 "[ . 1 . 2]" 1
391 1 18 GLU HA 1 64 LEU H . . 5.110 4.552 4.447 4.656 . 0 0 "[ . 1 . 2]" 1
392 1 18 GLU HA 1 65 ARG H . . 5.500 4.733 4.568 4.839 . 0 0 "[ . 1 . 2]" 1
393 1 18 GLU HA 1 19 ILE H . . 3.060 2.182 2.154 2.209 . 0 0 "[ . 1 . 2]" 1
394 1 18 GLU HA 1 65 ARG HA . . 3.480 2.475 2.251 2.617 . 0 0 "[ . 1 . 2]" 1
395 1 18 GLU HA 1 18 GLU HG2 . . 4.050 2.475 2.257 2.619 . 0 0 "[ . 1 . 2]" 1
396 1 18 GLU HA 1 18 GLU HG3 . . 3.350 2.977 2.878 3.167 . 0 0 "[ . 1 . 2]" 1
397 1 48 MET HA 1 48 MET HG3 . . 3.660 2.808 2.757 2.886 . 0 0 "[ . 1 . 2]" 1
398 1 48 MET HA 1 66 ILE HG12 . . 4.190 2.863 2.569 3.076 . 0 0 "[ . 1 . 2]" 1
399 1 48 MET HA 1 64 LEU MD1 . . 3.930 2.947 2.819 3.178 . 0 0 "[ . 1 . 2]" 1
400 1 48 MET HA 1 48 MET HG2 . . 3.730 2.522 2.459 2.605 . 0 0 "[ . 1 . 2]" 1
401 1 48 MET HA 1 49 VAL MG2 . . 4.710 3.799 3.664 3.965 . 0 0 "[ . 1 . 2]" 1
402 1 50 MET HA 1 64 LEU HA . . 2.650 2.142 2.035 2.248 . 0 0 "[ . 1 . 2]" 1
403 1 50 MET HA 1 51 ILE HG12 . . 4.590 3.532 3.359 3.702 . 0 0 "[ . 1 . 2]" 1
404 1 50 MET HA 1 64 LEU HB2 . . 4.790 3.184 3.007 3.441 . 0 0 "[ . 1 . 2]" 1
405 1 49 VAL MG1 1 50 MET HA . . 4.190 4.038 3.922 4.152 . 0 0 "[ . 1 . 2]" 1
406 1 64 LEU HA 1 65 ARG H . . 3.230 2.147 2.140 2.168 . 0 0 "[ . 1 . 2]" 1
407 1 64 LEU HA 1 65 ARG HB2 . . 4.620 4.352 4.277 4.425 . 0 0 "[ . 1 . 2]" 1
408 1 64 LEU HA 1 64 LEU HG . . 3.580 3.386 3.270 3.553 . 0 0 "[ . 1 . 2]" 1
409 1 64 LEU HA 1 64 LEU MD2 . . 4.060 3.997 3.948 4.025 . 0 0 "[ . 1 . 2]" 1
410 1 15 ALA H 1 69 ASP HA . . 4.890 2.870 2.439 3.767 . 0 0 "[ . 1 . 2]" 1
411 1 69 ASP HA 1 70 PRO HD3 . . 3.250 2.320 2.253 2.357 . 0 0 "[ . 1 . 2]" 1
412 1 62 LYS HA 1 62 LYS QG . . 3.910 2.910 2.769 3.080 . 0 0 "[ . 1 . 2]" 1
413 1 44 ALA H 1 45 GLY QA . . 4.630 4.010 3.910 4.192 . 0 0 "[ . 1 . 2]" 1
414 1 45 GLY QA 1 72 LYS HD2 . . 4.560 4.118 3.346 4.558 . 0 0 "[ . 1 . 2]" 1
415 1 27 GLY QA 1 31 GLY H . . 4.700 3.102 2.770 3.448 . 0 0 "[ . 1 . 2]" 1
416 1 84 ILE H 1 84 ILE MD . . 4.200 3.767 3.446 3.894 . 0 0 "[ . 1 . 2]" 1
417 1 21 ILE HA 1 84 ILE MD . . 4.000 3.031 2.440 3.982 . 0 0 "[ . 1 . 2]" 1
418 1 84 ILE HA 1 84 ILE MD . . 4.340 3.945 3.493 4.115 . 0 0 "[ . 1 . 2]" 1
419 1 81 LEU HA 1 84 ILE MD . . 3.880 3.196 2.963 3.655 . 0 0 "[ . 1 . 2]" 1
420 1 22 PRO HD2 1 84 ILE MD . . 4.070 2.385 2.009 3.063 . 0 0 "[ . 1 . 2]" 1
421 1 84 ILE MD 1 85 ARG QG . . 3.390 2.915 1.943 3.374 . 0 0 "[ . 1 . 2]" 1
422 1 19 ILE MD 1 81 LEU H . . 5.500 5.203 4.841 5.500 0.000 11 0 "[ . 1 . 2]" 1
423 1 17 GLN HB3 1 19 ILE MD . . 3.090 2.924 2.694 3.099 0.009 20 0 "[ . 1 . 2]" 1
424 1 19 ILE MD 1 77 LYS QD . . 3.540 3.153 2.900 3.324 . 0 0 "[ . 1 . 2]" 1
425 1 19 ILE MD 1 77 LYS HG2 . . 4.140 3.917 3.701 4.129 . 0 0 "[ . 1 . 2]" 1
426 1 37 ILE MD 1 41 GLN QE . . 4.880 3.298 2.942 3.716 . 0 0 "[ . 1 . 2]" 1
427 1 37 ILE MD 1 50 MET QG . . 3.860 2.735 2.378 3.845 . 0 0 "[ . 1 . 2]" 1
428 1 37 ILE MD 1 50 MET ME . . 3.790 2.999 2.281 3.468 . 0 0 "[ . 1 . 2]" 1
429 1 37 ILE MD 1 48 MET HB3 . . 3.430 1.987 1.831 2.106 . 0 0 "[ . 1 . 2]" 1
430 1 30 ILE HG12 1 37 ILE MD . . 3.300 2.791 2.383 3.262 . 0 0 "[ . 1 . 2]" 1
431 1 37 ILE MD 1 48 MET HB2 . . 3.650 2.667 2.268 2.903 . 0 0 "[ . 1 . 2]" 1
432 1 37 ILE MD 1 37 ILE MG . . 2.920 2.015 1.885 2.188 . 0 0 "[ . 1 . 2]" 1
433 1 30 ILE MG 1 34 GLY HA2 . . 3.570 2.094 1.905 2.361 . 0 0 "[ . 1 . 2]" 1
434 1 34 GLY HA2 1 37 ILE MG . . 4.100 2.156 1.925 2.399 . 0 0 "[ . 1 . 2]" 1
435 1 34 GLY HA3 1 37 ILE MG . . 4.100 2.972 2.732 3.177 . 0 0 "[ . 1 . 2]" 1
436 1 66 ILE H 1 66 ILE MD . . 4.580 4.099 3.988 4.202 . 0 0 "[ . 1 . 2]" 1
437 1 66 ILE HA 1 66 ILE MD . . 4.090 3.758 3.701 3.796 . 0 0 "[ . 1 . 2]" 1
438 1 66 ILE MD 1 77 LYS HB3 . . 4.170 3.903 3.649 4.100 . 0 0 "[ . 1 . 2]" 1
439 1 66 ILE MD 1 80 VAL HB . . 4.370 3.242 3.087 3.606 . 0 0 "[ . 1 . 2]" 1
440 1 66 ILE MD 1 77 LYS HB2 . . 3.060 2.749 2.530 3.039 . 0 0 "[ . 1 . 2]" 1
441 1 64 LEU HG 1 66 ILE MD . . 3.400 3.185 3.021 3.360 . 0 0 "[ . 1 . 2]" 1
442 1 66 ILE MD 1 80 VAL MG2 . . 3.250 2.222 2.037 2.486 . 0 0 "[ . 1 . 2]" 1
443 1 19 ILE HG13 1 66 ILE MD . . 3.420 3.173 2.873 3.391 . 0 0 "[ . 1 . 2]" 1
444 1 66 ILE MD 1 76 ALA MB . . 3.350 2.471 2.171 2.814 . 0 0 "[ . 1 . 2]" 1
445 1 46 VAL MG2 1 66 ILE MD . . 3.560 3.397 3.051 3.566 0.006 2 0 "[ . 1 . 2]" 1
446 1 59 GLY HA2 1 60 ALA MB . . 4.600 4.026 3.767 4.571 . 0 0 "[ . 1 . 2]" 1
447 1 59 GLY HA3 1 60 ALA MB . . 4.600 4.269 3.749 4.600 0.000 1 0 "[ . 1 . 2]" 1
448 1 47 LYS H 1 68 GLY HA3 . . 4.440 3.319 3.148 3.507 . 0 0 "[ . 1 . 2]" 1
449 1 68 GLY HA3 1 73 VAL MG2 . . 3.650 2.516 2.320 2.642 . 0 0 "[ . 1 . 2]" 1
450 1 46 VAL MG1 1 68 GLY HA3 . . 3.660 2.152 1.956 2.380 . 0 0 "[ . 1 . 2]" 1
451 1 11 GLY QA 1 12 PRO QG . . 4.390 3.714 3.647 3.868 . 0 0 "[ . 1 . 2]" 1
452 1 46 VAL MG1 1 68 GLY HA2 . . 3.840 3.607 3.339 3.837 . 0 0 "[ . 1 . 2]" 1
453 1 68 GLY HA2 1 69 ASP H . . 3.530 3.228 2.593 3.423 . 0 0 "[ . 1 . 2]" 1
454 1 64 LEU HB3 1 64 LEU HG . . 2.900 2.510 2.432 2.572 . 0 0 "[ . 1 . 2]" 1
455 1 64 LEU HB3 1 64 LEU MD2 . . 3.320 2.178 2.087 2.305 . 0 0 "[ . 1 . 2]" 1
456 1 64 LEU HB3 1 64 LEU MD1 . . 3.390 3.184 3.172 3.192 . 0 0 "[ . 1 . 2]" 1
457 1 64 LEU H 1 64 LEU HB2 . . 3.900 3.106 3.050 3.197 . 0 0 "[ . 1 . 2]" 1
458 1 21 ILE HG12 1 64 LEU HB2 . . 3.700 3.125 2.854 3.460 . 0 0 "[ . 1 . 2]" 1
459 1 21 ILE HG13 1 64 LEU HB2 . . 3.700 2.296 2.001 2.491 . 0 0 "[ . 1 . 2]" 1
460 1 27 GLY QA 1 30 ILE MD . . 3.980 3.603 3.275 3.830 . 0 0 "[ . 1 . 2]" 1
461 1 26 ALA HA 1 30 ILE MD . . 4.190 3.425 2.971 3.847 . 0 0 "[ . 1 . 2]" 1
462 1 30 ILE MD 1 37 ILE HB . . 4.970 4.780 4.350 4.935 . 0 0 "[ . 1 . 2]" 1
463 1 30 ILE MD 1 50 MET HB2 . . 3.740 3.155 2.433 3.448 . 0 0 "[ . 1 . 2]" 1
464 1 30 ILE HB 1 30 ILE MD . . 3.490 2.399 2.295 2.517 . 0 0 "[ . 1 . 2]" 1
465 1 30 ILE MD 1 50 MET ME . . 3.870 2.422 2.037 3.154 . 0 0 "[ . 1 . 2]" 1
466 1 30 ILE MD 1 50 MET HB3 . . 3.740 3.437 3.168 3.650 . 0 0 "[ . 1 . 2]" 1
467 1 26 ALA MB 1 30 ILE MD . . 3.940 2.371 2.054 2.770 . 0 0 "[ . 1 . 2]" 1
468 1 30 ILE MD 1 30 ILE MG . . 3.020 2.009 1.923 2.178 . 0 0 "[ . 1 . 2]" 1
469 1 30 ILE MD 1 31 GLY H . . 4.760 4.496 4.185 4.710 . 0 0 "[ . 1 . 2]" 1
470 1 43 ARG HA 1 43 ARG QD . . 4.170 3.582 2.191 4.089 . 0 0 "[ . 1 . 2]" 1
471 1 40 LEU MD2 1 43 ARG QD . . 4.430 2.833 2.075 4.325 . 0 0 "[ . 1 . 2]" 1
472 1 85 ARG H 1 85 ARG QD . . 4.960 4.046 3.589 4.362 . 0 0 "[ . 1 . 2]" 1
473 1 85 ARG HA 1 85 ARG QD . . 4.250 3.970 3.704 4.152 . 0 0 "[ . 1 . 2]" 1
474 1 82 GLU HA 1 85 ARG QD . . 3.680 2.694 1.976 3.431 . 0 0 "[ . 1 . 2]" 1
475 1 85 ARG HB2 1 85 ARG QD . . 3.300 2.443 2.220 2.677 . 0 0 "[ . 1 . 2]" 1
476 1 65 ARG HB2 1 65 ARG HD2 . . 3.650 2.547 2.175 2.771 . 0 0 "[ . 1 . 2]" 1
477 1 65 ARG HB3 1 65 ARG HD2 . . 3.720 2.840 2.406 3.496 . 0 0 "[ . 1 . 2]" 1
478 1 16 VAL MG2 1 65 ARG HD2 . . 3.820 3.632 3.136 3.823 0.003 8 0 "[ . 1 . 2]" 1
479 1 51 ILE MD 1 65 ARG HD2 . . 3.980 2.663 2.314 3.365 . 0 0 "[ . 1 . 2]" 1
480 1 65 ARG HB2 1 65 ARG HD3 . . 3.650 3.226 2.553 3.607 . 0 0 "[ . 1 . 2]" 1
481 1 65 ARG HB3 1 65 ARG HD3 . . 3.720 2.594 2.287 2.913 . 0 0 "[ . 1 . 2]" 1
482 1 16 VAL MG2 1 65 ARG HD3 . . 3.820 3.109 2.430 3.782 . 0 0 "[ . 1 . 2]" 1
483 1 51 ILE MD 1 65 ARG HD3 . . 3.980 3.223 2.158 3.868 . 0 0 "[ . 1 . 2]" 1
484 1 51 ILE HB 1 51 ILE MD . . 3.710 3.219 3.185 3.230 . 0 0 "[ . 1 . 2]" 1
485 1 51 ILE MD 1 65 ARG HG3 . . 4.210 4.164 3.851 4.215 0.005 15 0 "[ . 1 . 2]" 1
486 1 51 ILE H 1 51 ILE MD . . 4.380 3.299 2.959 3.604 . 0 0 "[ . 1 . 2]" 1
487 1 51 ILE MD 1 63 PRO HG2 . . 4.950 4.828 4.755 4.866 . 0 0 "[ . 1 . 2]" 1
488 1 51 ILE MD 1 65 ARG HB3 . . 3.620 2.636 2.287 3.128 . 0 0 "[ . 1 . 2]" 1
489 1 80 VAL HA 1 83 LEU HB2 . . 4.010 2.629 2.535 2.727 . 0 0 "[ . 1 . 2]" 1
490 1 83 LEU HB2 1 83 LEU MD2 . . 3.350 2.303 2.207 2.416 . 0 0 "[ . 1 . 2]" 1
491 1 83 LEU HB3 1 84 ILE H . . 4.020 2.663 2.247 2.934 . 0 0 "[ . 1 . 2]" 1
492 1 83 LEU HB3 1 83 LEU MD2 . . 3.350 3.186 3.179 3.195 . 0 0 "[ . 1 . 2]" 1
493 1 80 VAL MG1 1 83 LEU HB3 . . 3.990 3.194 2.896 3.377 . 0 0 "[ . 1 . 2]" 1
494 1 69 ASP HB2 1 70 PRO HD2 . . 4.580 3.690 3.572 3.883 . 0 0 "[ . 1 . 2]" 1
495 1 40 LEU HB2 1 40 LEU HG . . 2.710 2.508 2.456 2.540 . 0 0 "[ . 1 . 2]" 1
496 1 40 LEU HB2 1 48 MET ME . . 4.420 3.170 2.980 3.489 . 0 0 "[ . 1 . 2]" 1
497 1 40 LEU HB2 1 80 VAL MG2 . . 4.320 4.220 4.110 4.321 0.001 13 0 "[ . 1 . 2]" 1
498 1 40 LEU HB2 1 40 LEU MD1 . . 3.340 2.249 2.097 2.340 . 0 0 "[ . 1 . 2]" 1
499 1 40 LEU H 1 40 LEU HB3 . . 4.090 3.548 3.511 3.585 . 0 0 "[ . 1 . 2]" 1
500 1 37 ILE HA 1 40 LEU HB3 . . 4.110 3.979 3.736 4.106 . 0 0 "[ . 1 . 2]" 1
501 1 40 LEU HB3 1 40 LEU MD1 . . 3.500 2.436 2.364 2.537 . 0 0 "[ . 1 . 2]" 1
502 1 72 LYS HA 1 72 LYS QE . . 4.380 3.884 3.451 4.426 0.046 8 0 "[ . 1 . 2]" 1
503 1 45 GLY QA 1 72 LYS QE . . 4.050 2.789 1.985 3.896 . 0 0 "[ . 1 . 2]" 1
504 1 69 ASP HB3 1 72 LYS QE . . 5.500 5.113 4.424 5.499 . 0 0 "[ . 1 . 2]" 1
505 1 72 LYS QE 1 72 LYS HG2 . . 3.550 2.254 2.113 2.528 . 0 0 "[ . 1 . 2]" 1
506 1 72 LYS QE 1 72 LYS HG3 . . 3.550 3.164 2.561 3.445 . 0 0 "[ . 1 . 2]" 1
507 1 46 VAL MG1 1 72 LYS QE . . 5.050 3.860 2.813 4.634 . 0 0 "[ . 1 . 2]" 1
508 1 69 ASP HB2 1 72 LYS HB2 . . 3.670 2.411 1.993 3.395 . 0 0 "[ . 1 . 2]" 1
509 1 69 ASP HB2 1 72 LYS HG2 . . 5.470 3.805 3.532 4.722 . 0 0 "[ . 1 . 2]" 1
510 1 69 ASP HB2 1 72 LYS HB3 . . 5.130 3.875 3.467 4.870 . 0 0 "[ . 1 . 2]" 1
511 1 69 ASP HB3 1 72 LYS HB3 . . 5.130 4.732 3.891 5.108 . 0 0 "[ . 1 . 2]" 1
512 1 69 ASP HB3 1 72 LYS HB2 . . 3.670 3.271 2.321 3.655 . 0 0 "[ . 1 . 2]" 1
513 1 69 ASP HB3 1 72 LYS HG3 . . 5.470 2.375 1.997 2.735 . 0 0 "[ . 1 . 2]" 1
514 1 47 LYS QE 1 47 LYS HG2 . . 3.820 2.391 2.079 3.480 . 0 0 "[ . 1 . 2]" 1
515 1 28 LEU HB2 1 28 LEU MD2 . . 3.390 2.637 2.588 2.710 . 0 0 "[ . 1 . 2]" 1
516 1 28 LEU HB3 1 28 LEU MD1 . . 3.560 3.139 3.123 3.156 . 0 0 "[ . 1 . 2]" 1
517 1 28 LEU HB3 1 28 LEU MD2 . . 3.390 2.127 2.012 2.194 . 0 0 "[ . 1 . 2]" 1
518 1 38 LYS QB 1 38 LYS QE . . 4.250 3.012 2.229 3.625 . 0 0 "[ . 1 . 2]" 1
519 1 38 LYS HA 1 38 LYS QE . . 4.580 4.371 3.600 4.586 0.006 18 0 "[ . 1 . 2]" 1
520 1 47 LYS QE 1 47 LYS HG3 . . 3.820 2.823 2.330 3.389 . 0 0 "[ . 1 . 2]" 1
521 1 47 LYS QE 1 49 VAL MG2 . . 3.850 2.582 1.710 3.836 . 0 0 "[ . 1 . 2]" 1
522 1 21 ILE H 1 21 ILE MD . . 4.460 3.450 3.285 3.665 . 0 0 "[ . 1 . 2]" 1
523 1 21 ILE MD 1 64 LEU H . . 5.010 3.728 3.354 4.096 . 0 0 "[ . 1 . 2]" 1
524 1 21 ILE HA 1 21 ILE MD . . 3.420 2.190 1.989 2.297 . 0 0 "[ . 1 . 2]" 1
525 1 21 ILE MD 1 64 LEU HB3 . . 3.530 2.615 2.335 2.862 . 0 0 "[ . 1 . 2]" 1
526 1 19 ILE HG13 1 21 ILE MD . . 3.640 2.570 2.393 2.725 . 0 0 "[ . 1 . 2]" 1
527 1 21 ILE MD 1 64 LEU HB2 . . 3.810 3.522 3.229 3.750 . 0 0 "[ . 1 . 2]" 1
528 1 21 ILE MD 1 21 ILE MG . . 2.570 2.002 1.882 2.191 . 0 0 "[ . 1 . 2]" 1
529 1 21 ILE MD 1 64 LEU MD2 . . 2.970 2.269 2.002 2.549 . 0 0 "[ . 1 . 2]" 1
530 1 77 LYS HB3 1 77 LYS HE2 . . 4.630 3.206 2.011 4.527 . 0 0 "[ . 1 . 2]" 1
531 1 77 LYS HE3 1 81 LEU MD1 . . 4.100 3.319 2.133 4.037 . 0 0 "[ . 1 . 2]" 1
532 1 77 LYS HB3 1 77 LYS HE3 . . 4.630 3.327 2.149 4.631 0.001 20 0 "[ . 1 . 2]" 1
533 1 51 ILE MG 1 53 ASP QB . . 4.400 3.330 2.162 4.305 . 0 0 "[ . 1 . 2]" 1
534 1 19 ILE H 1 19 ILE HB . . 4.100 3.655 3.624 3.689 . 0 0 "[ . 1 . 2]" 1
535 1 19 ILE HB 1 19 ILE MD . . 3.300 3.185 3.175 3.196 . 0 0 "[ . 1 . 2]" 1
536 1 19 ILE HB 1 77 LYS HG3 . . 4.600 4.400 4.237 4.594 . 0 0 "[ . 1 . 2]" 1
537 1 19 ILE HB 1 21 ILE MD . . 4.210 2.539 2.322 2.772 . 0 0 "[ . 1 . 2]" 1
538 1 78 GLU HA 1 81 LEU HB2 . . 3.550 2.421 2.239 2.582 . 0 0 "[ . 1 . 2]" 1
539 1 81 LEU HB3 1 82 GLU H . . 4.420 3.451 3.253 3.578 . 0 0 "[ . 1 . 2]" 1
540 1 81 LEU HB3 1 81 LEU MD1 . . 3.450 2.528 2.464 2.593 . 0 0 "[ . 1 . 2]" 1
541 1 67 THR H 1 67 THR HB . . 3.810 3.546 3.524 3.572 . 0 0 "[ . 1 . 2]" 1
542 1 67 THR HB 1 68 GLY H . . 3.840 2.696 2.538 2.901 . 0 0 "[ . 1 . 2]" 1
543 1 47 LYS HB3 1 67 THR HB . . 3.970 3.823 3.630 3.985 0.015 13 0 "[ . 1 . 2]" 1
544 1 17 GLN HB3 1 66 ILE HB . . 4.490 3.737 2.866 4.126 . 0 0 "[ . 1 . 2]" 1
545 1 17 GLN HB2 1 66 ILE HB . . 4.290 3.076 2.664 4.171 . 0 0 "[ . 1 . 2]" 1
546 1 30 ILE HB 1 31 GLY H . . 3.670 2.482 2.181 2.692 . 0 0 "[ . 1 . 2]" 1
547 1 27 GLY QA 1 30 ILE HB . . 3.780 2.830 2.374 3.074 . 0 0 "[ . 1 . 2]" 1
548 1 84 ILE HB 1 85 ARG H . . 4.850 4.030 3.843 4.176 . 0 0 "[ . 1 . 2]" 1
549 1 84 ILE HB 1 84 ILE MD . . 3.440 2.170 2.097 2.268 . 0 0 "[ . 1 . 2]" 1
550 1 71 TYR HB2 1 72 LYS H . . 4.200 4.131 4.050 4.203 0.003 5 0 "[ . 1 . 2]" 1
551 1 37 ILE H 1 37 ILE HB . . 3.510 2.606 2.542 2.654 . 0 0 "[ . 1 . 2]" 1
552 1 37 ILE HB 1 38 LYS H . . 4.160 4.031 3.846 4.143 . 0 0 "[ . 1 . 2]" 1
553 1 30 ILE HA 1 37 ILE HB . . 3.240 2.306 2.070 2.518 . 0 0 "[ . 1 . 2]" 1
554 1 37 ILE HB 1 40 LEU MD1 . . 3.410 3.408 3.391 3.415 0.005 18 0 "[ . 1 . 2]" 1
555 1 37 ILE HB 1 37 ILE MD . . 3.460 2.421 2.284 2.573 . 0 0 "[ . 1 . 2]" 1
556 1 18 GLU HG2 1 65 ARG HA . . 4.520 2.449 2.143 2.933 . 0 0 "[ . 1 . 2]" 1
557 1 18 GLU HG2 1 65 ARG HG3 . . 4.350 2.420 2.002 3.009 . 0 0 "[ . 1 . 2]" 1
558 1 16 VAL MG2 1 18 GLU HG2 . . 4.580 3.918 3.704 4.110 . 0 0 "[ . 1 . 2]" 1
559 1 18 GLU QB 1 18 GLU HG3 . . 2.490 2.337 2.234 2.395 . 0 0 "[ . 1 . 2]" 1
560 1 21 ILE H 1 21 ILE HB . . 3.650 2.862 2.781 2.949 . 0 0 "[ . 1 . 2]" 1
561 1 21 ILE HB 1 62 LYS H . . 4.590 3.671 3.476 3.885 . 0 0 "[ . 1 . 2]" 1
562 1 37 ILE HG12 1 48 MET HB3 . . 3.280 3.153 2.858 3.276 . 0 0 "[ . 1 . 2]" 1
563 1 41 GLN HG3 1 48 MET HB2 . . 3.910 2.816 2.622 3.016 . 0 0 "[ . 1 . 2]" 1
564 1 37 ILE HG12 1 48 MET HB2 . . 2.890 2.522 2.245 2.674 . 0 0 "[ . 1 . 2]" 1
565 1 41 GLN HG2 1 48 MET HB2 . . 4.340 2.737 2.560 3.033 . 0 0 "[ . 1 . 2]" 1
566 1 41 GLN HG2 1 48 MET H . . 4.750 1.922 1.895 2.033 . 0 0 "[ . 1 . 2]" 1
567 1 41 GLN HG3 1 48 MET ME . . 5.500 4.383 3.905 4.625 . 0 0 "[ . 1 . 2]" 1
568 1 78 GLU HG2 1 79 MET H . . 4.870 4.490 3.238 4.864 . 0 0 "[ . 1 . 2]" 1
569 1 78 GLU H 1 78 GLU HG2 . . 3.750 2.717 1.896 3.360 . 0 0 "[ . 1 . 2]" 1
570 1 42 GLU HA 1 42 GLU HG2 . . 3.980 2.865 2.375 3.932 . 0 0 "[ . 1 . 2]" 1
571 1 42 GLU HA 1 42 GLU HG3 . . 3.980 3.591 3.123 3.854 . 0 0 "[ . 1 . 2]" 1
572 1 78 GLU HA 1 78 GLU HG3 . . 3.980 3.547 3.283 3.788 . 0 0 "[ . 1 . 2]" 1
573 1 78 GLU HG3 1 79 MET H . . 4.870 4.236 2.119 4.802 . 0 0 "[ . 1 . 2]" 1
574 1 82 GLU HA 1 82 GLU QG . . 3.320 2.464 2.201 2.875 . 0 0 "[ . 1 . 2]" 1
575 1 49 VAL HB 1 50 MET H . . 4.460 4.338 4.244 4.391 . 0 0 "[ . 1 . 2]" 1
576 1 49 VAL HB 1 51 ILE MD . . 4.770 3.408 3.182 3.746 . 0 0 "[ . 1 . 2]" 1
577 1 49 VAL HB 1 64 LEU MD1 . . 5.430 4.291 4.063 4.650 . 0 0 "[ . 1 . 2]" 1
578 1 35 GLU H 1 35 GLU QG . . 4.020 3.023 1.891 4.020 . 0 0 "[ . 1 . 2]" 1
579 1 80 VAL HA 1 83 LEU H . . 4.020 3.257 3.080 3.428 . 0 0 "[ . 1 . 2]" 1
580 1 80 VAL HA 1 83 LEU HB3 . . 4.010 3.068 2.907 3.299 . 0 0 "[ . 1 . 2]" 1
581 1 80 VAL HA 1 83 LEU HG . . 4.110 4.026 3.894 4.116 0.006 2 0 "[ . 1 . 2]" 1
582 1 80 VAL HA 1 80 VAL MG2 . . 2.970 2.467 2.339 2.541 . 0 0 "[ . 1 . 2]" 1
583 1 80 VAL HA 1 80 VAL MG1 . . 2.960 2.285 2.172 2.407 . 0 0 "[ . 1 . 2]" 1
584 1 17 GLN HA 1 17 GLN HG2 . . 4.040 2.854 2.266 3.614 . 0 0 "[ . 1 . 2]" 1
585 1 73 VAL HA 1 76 ALA H . . 4.350 3.668 3.370 3.911 . 0 0 "[ . 1 . 2]" 1
586 1 73 VAL HA 1 76 ALA MB . . 3.510 2.891 2.670 3.161 . 0 0 "[ . 1 . 2]" 1
587 1 66 ILE MG 1 73 VAL HA . . 3.530 2.512 2.241 2.717 . 0 0 "[ . 1 . 2]" 1
588 1 73 VAL HA 1 73 VAL MG2 . . 3.020 2.294 2.242 2.343 . 0 0 "[ . 1 . 2]" 1
589 1 73 VAL HA 1 73 VAL MG1 . . 3.360 2.477 2.409 2.565 . 0 0 "[ . 1 . 2]" 1
590 1 46 VAL MG2 1 73 VAL HA . . 4.350 2.949 2.760 3.177 . 0 0 "[ . 1 . 2]" 1
591 1 46 VAL HB 1 47 LYS H . . 3.280 2.378 2.131 2.601 . 0 0 "[ . 1 . 2]" 1
592 1 46 VAL HB 1 76 ALA MB . . 4.290 3.908 3.653 4.201 . 0 0 "[ . 1 . 2]" 1
593 1 16 VAL HB 1 17 GLN H . . 4.760 4.236 4.100 4.454 . 0 0 "[ . 1 . 2]" 1
594 1 62 LYS HB3 1 63 PRO HD2 . . 4.120 3.142 2.767 3.594 . 0 0 "[ . 1 . 2]" 1
595 1 21 ILE HB 1 62 LYS HB3 . . 5.010 4.546 4.000 5.021 0.011 2 0 "[ . 1 . 2]" 1
596 1 21 ILE HB 1 62 LYS HB2 . . 4.020 2.925 2.529 3.317 . 0 0 "[ . 1 . 2]" 1
597 1 70 PRO HA 1 73 VAL H . . 4.380 4.235 4.047 4.376 . 0 0 "[ . 1 . 2]" 1
598 1 70 PRO HA 1 73 VAL HB . . 3.470 3.196 2.937 3.327 . 0 0 "[ . 1 . 2]" 1
599 1 15 ALA MB 1 70 PRO HA . . 3.380 2.016 1.863 2.176 . 0 0 "[ . 1 . 2]" 1
600 1 70 PRO HA 1 73 VAL MG2 . . 4.120 3.784 3.458 3.995 . 0 0 "[ . 1 . 2]" 1
601 1 39 GLN H 1 39 GLN HG2 . . 3.990 3.100 2.469 3.834 . 0 0 "[ . 1 . 2]" 1
602 1 39 GLN HA 1 39 GLN HG2 . . 3.910 2.584 2.195 3.747 . 0 0 "[ . 1 . 2]" 1
603 1 72 LYS HA 1 75 GLN HG2 . . 4.220 3.455 2.896 4.028 . 0 0 "[ . 1 . 2]" 1
604 1 48 MET HG3 1 49 VAL H . . 5.490 4.902 4.819 4.971 . 0 0 "[ . 1 . 2]" 1
605 1 72 LYS HA 1 75 GLN HG3 . . 4.220 3.106 2.011 3.881 . 0 0 "[ . 1 . 2]" 1
606 1 75 GLN H 1 75 GLN HG3 . . 3.900 3.460 2.196 3.902 0.002 18 0 "[ . 1 . 2]" 1
607 1 75 GLN HA 1 75 GLN HG3 . . 3.820 3.694 3.475 3.801 . 0 0 "[ . 1 . 2]" 1
608 1 47 LYS H 1 47 LYS HB3 . . 3.560 2.835 2.782 2.874 . 0 0 "[ . 1 . 2]" 1
609 1 47 LYS HB2 1 67 THR HB . . 4.700 4.505 4.361 4.579 . 0 0 "[ . 1 . 2]" 1
610 1 87 GLN H 1 87 GLN QG . . 5.020 3.396 1.920 4.458 . 0 0 "[ . 1 . 2]" 1
611 1 48 MET H 1 48 MET HG2 . . 4.780 4.194 4.105 4.278 . 0 0 "[ . 1 . 2]" 1
612 1 48 MET HG2 1 80 VAL MG2 . . 4.300 3.286 3.069 3.626 . 0 0 "[ . 1 . 2]" 1
613 1 48 MET HG2 1 66 ILE MD . . 3.500 2.555 2.282 2.793 . 0 0 "[ . 1 . 2]" 1
614 1 48 MET HG2 1 66 ILE HA . . 4.160 3.715 3.518 3.907 . 0 0 "[ . 1 . 2]" 1
615 1 48 MET HG3 1 66 ILE HA . . 4.360 4.281 4.136 4.360 0.000 16 0 "[ . 1 . 2]" 1
616 1 48 MET HG3 1 66 ILE MG . . 3.910 3.005 2.712 3.486 . 0 0 "[ . 1 . 2]" 1
617 1 48 MET HG3 1 66 ILE MD . . 3.960 3.557 3.169 3.866 . 0 0 "[ . 1 . 2]" 1
618 1 46 VAL MG2 1 48 MET HG3 . . 3.770 2.853 2.576 3.127 . 0 0 "[ . 1 . 2]" 1
619 1 25 LYS HB3 1 25 LYS HD3 . . 3.010 2.614 2.416 2.728 . 0 0 "[ . 1 . 2]" 1
620 1 25 LYS HB3 1 84 ILE MG . . 3.520 2.312 2.071 2.575 . 0 0 "[ . 1 . 2]" 1
621 1 25 LYS HB2 1 84 ILE MG . . 3.610 2.021 1.929 2.195 . 0 0 "[ . 1 . 2]" 1
622 1 41 GLN HG2 1 48 MET HG3 . . 4.850 2.975 2.657 3.397 . 0 0 "[ . 1 . 2]" 1
623 1 17 GLN HB3 1 73 VAL MG1 . . 4.050 3.063 2.210 3.328 . 0 0 "[ . 1 . 2]" 1
624 1 40 LEU MD2 1 79 MET HB2 . . 4.160 3.577 3.319 3.703 . 0 0 "[ . 1 . 2]" 1
625 1 79 MET HB2 1 80 VAL MG2 . . 4.340 3.172 3.019 3.351 . 0 0 "[ . 1 . 2]" 1
626 1 79 MET HB3 1 80 VAL MG2 . . 4.340 3.501 3.338 3.665 . 0 0 "[ . 1 . 2]" 1
627 1 79 MET HB3 1 80 VAL H . . 4.300 3.368 3.191 3.590 . 0 0 "[ . 1 . 2]" 1
628 1 36 THR HB 1 37 ILE HA . . 5.190 4.197 4.062 4.306 . 0 0 "[ . 1 . 2]" 1
629 1 37 ILE HA 1 40 LEU HB2 . . 3.390 2.434 2.182 2.627 . 0 0 "[ . 1 . 2]" 1
630 1 37 ILE HA 1 40 LEU HG . . 3.470 3.142 2.866 3.336 . 0 0 "[ . 1 . 2]" 1
631 1 37 ILE HA 1 37 ILE HG12 . . 3.420 3.173 3.045 3.336 . 0 0 "[ . 1 . 2]" 1
632 1 37 ILE HA 1 37 ILE HG13 . . 3.290 2.571 2.452 2.669 . 0 0 "[ . 1 . 2]" 1
633 1 37 ILE HA 1 37 ILE MG . . 3.370 3.185 3.174 3.200 . 0 0 "[ . 1 . 2]" 1
634 1 37 ILE HA 1 40 LEU MD1 . . 3.300 1.985 1.969 2.032 . 0 0 "[ . 1 . 2]" 1
635 1 37 ILE HA 1 37 ILE MD . . 3.980 3.829 3.743 3.896 . 0 0 "[ . 1 . 2]" 1
636 1 18 GLU QB 1 63 PRO HA . . 4.560 4.457 4.348 4.556 . 0 0 "[ . 1 . 2]" 1
637 1 18 GLU QB 1 65 ARG HA . . 4.820 3.947 3.593 4.265 . 0 0 "[ . 1 . 2]" 1
638 1 18 GLU QB 1 63 PRO HB3 . . 4.250 4.229 4.153 4.256 0.006 2 0 "[ . 1 . 2]" 1
639 1 18 GLU QB 1 19 ILE MD . . 4.200 4.076 3.995 4.157 . 0 0 "[ . 1 . 2]" 1
640 1 38 LYS H 1 38 LYS QB . . 3.120 2.183 2.118 2.249 . 0 0 "[ . 1 . 2]" 1
641 1 29 VAL HA 1 29 VAL MG1 . . 3.240 3.191 3.167 3.203 . 0 0 "[ . 1 . 2]" 1
642 1 29 VAL HA 1 29 VAL MG2 . . 2.910 2.366 2.250 2.495 . 0 0 "[ . 1 . 2]" 1
643 1 49 VAL MG1 1 65 ARG HB2 . . 5.500 4.526 4.094 4.960 . 0 0 "[ . 1 . 2]" 1
644 1 51 ILE MG 1 65 ARG HB2 . . 5.500 4.340 4.135 4.625 . 0 0 "[ . 1 . 2]" 1
645 1 51 ILE MD 1 65 ARG HB2 . . 3.600 2.528 2.148 2.915 . 0 0 "[ . 1 . 2]" 1
646 1 49 VAL HB 1 65 ARG HB3 . . 3.710 2.853 2.533 3.213 . 0 0 "[ . 1 . 2]" 1
647 1 49 VAL MG1 1 65 ARG HB3 . . 4.110 3.657 3.313 3.955 . 0 0 "[ . 1 . 2]" 1
648 1 22 PRO HB2 1 23 ALA H . . 4.460 3.713 3.517 3.919 . 0 0 "[ . 1 . 2]" 1
649 1 22 PRO HB2 1 25 LYS H . . 4.550 2.669 2.546 2.765 . 0 0 "[ . 1 . 2]" 1
650 1 22 PRO HB3 1 23 ALA H . . 4.460 4.126 3.990 4.276 . 0 0 "[ . 1 . 2]" 1
651 1 79 MET H 1 79 MET HG2 . . 4.210 3.719 3.318 4.050 . 0 0 "[ . 1 . 2]" 1
652 1 79 MET HA 1 79 MET HG2 . . 3.820 2.468 2.170 2.788 . 0 0 "[ . 1 . 2]" 1
653 1 79 MET ME 1 79 MET HG2 . . 3.900 2.983 2.483 3.388 . 0 0 "[ . 1 . 2]" 1
654 1 79 MET H 1 79 MET HG3 . . 4.210 2.722 2.559 2.900 . 0 0 "[ . 1 . 2]" 1
655 1 72 LYS HB2 1 73 VAL H . . 4.550 2.263 2.137 2.391 . 0 0 "[ . 1 . 2]" 1
656 1 22 PRO HB3 1 25 LYS H . . 4.550 4.301 4.177 4.389 . 0 0 "[ . 1 . 2]" 1
657 1 50 MET QG 1 64 LEU HA . . 3.890 3.679 2.898 3.897 0.007 8 0 "[ . 1 . 2]" 1
658 1 30 ILE HG12 1 50 MET QG . . 3.710 2.823 2.275 3.702 . 0 0 "[ . 1 . 2]" 1
659 1 50 MET HA 1 50 MET QG . . 3.790 2.444 2.147 2.533 . 0 0 "[ . 1 . 2]" 1
660 1 30 ILE MD 1 50 MET QG . . 3.740 2.113 1.816 3.159 . 0 0 "[ . 1 . 2]" 1
661 1 74 GLN HA 1 77 LYS HB3 . . 3.990 2.880 2.588 3.013 . 0 0 "[ . 1 . 2]" 1
662 1 77 LYS HB2 1 78 GLU H . . 4.270 4.068 3.836 4.268 . 0 0 "[ . 1 . 2]" 1
663 1 17 GLN HB3 1 77 LYS HB2 . . 3.790 3.434 2.926 3.751 . 0 0 "[ . 1 . 2]" 1
664 1 30 ILE HA 1 37 ILE HA . . 4.610 4.240 4.011 4.462 . 0 0 "[ . 1 . 2]" 1
665 1 30 ILE HA 1 37 ILE H . . 3.700 2.633 2.302 2.851 . 0 0 "[ . 1 . 2]" 1
666 1 30 ILE HA 1 30 ILE HG13 . . 3.380 3.084 2.893 3.328 . 0 0 "[ . 1 . 2]" 1
667 1 30 ILE HA 1 30 ILE MD . . 3.890 3.809 3.764 3.870 . 0 0 "[ . 1 . 2]" 1
668 1 30 ILE HA 1 37 ILE MD . . 3.870 3.458 3.270 3.762 . 0 0 "[ . 1 . 2]" 1
669 1 63 PRO HB3 1 64 LEU H . . 4.360 4.217 4.141 4.277 . 0 0 "[ . 1 . 2]" 1
670 1 51 ILE HB 1 63 PRO HB2 . . 3.460 3.034 2.945 3.300 . 0 0 "[ . 1 . 2]" 1
671 1 51 ILE MD 1 63 PRO HB2 . . 5.400 5.166 5.087 5.234 . 0 0 "[ . 1 . 2]" 1
672 1 51 ILE HG13 1 63 PRO HB2 . . 3.970 3.892 3.734 3.966 . 0 0 "[ . 1 . 2]" 1
673 1 77 LYS HA 1 80 VAL HB . . 3.640 3.389 3.192 3.625 . 0 0 "[ . 1 . 2]" 1
674 1 43 ARG H 1 43 ARG HB2 . . 3.590 2.268 2.209 2.375 . 0 0 "[ . 1 . 2]" 1
675 1 41 GLN QB 1 42 GLU H . . 4.070 2.843 2.732 3.033 . 0 0 "[ . 1 . 2]" 1
676 1 58 THR HA 1 58 THR MG . . 3.470 3.026 2.274 3.207 . 0 0 "[ . 1 . 2]" 1
677 1 84 ILE HA 1 84 ILE HG13 . . 4.110 3.576 3.558 3.608 . 0 0 "[ . 1 . 2]" 1
678 1 84 ILE HA 1 84 ILE MG . . 3.060 2.313 2.215 2.483 . 0 0 "[ . 1 . 2]" 1
679 1 25 LYS HD3 1 84 ILE HA . . 3.940 3.668 3.317 3.942 0.002 4 0 "[ . 1 . 2]" 1
680 1 25 LYS HD2 1 84 ILE HA . . 3.690 2.413 2.109 2.745 . 0 0 "[ . 1 . 2]" 1
681 1 37 ILE H 1 37 ILE HG12 . . 4.750 4.456 4.406 4.530 . 0 0 "[ . 1 . 2]" 1
682 1 37 ILE HG12 1 41 GLN QE . . 4.580 2.610 2.386 2.873 . 0 0 "[ . 1 . 2]" 1
683 1 37 ILE HG12 1 38 LYS HA . . 4.030 3.480 3.203 3.755 . 0 0 "[ . 1 . 2]" 1
684 1 37 ILE HG13 1 41 GLN QE . . 4.350 4.029 3.765 4.278 . 0 0 "[ . 1 . 2]" 1
685 1 37 ILE HG13 1 48 MET HB3 . . 4.500 2.695 2.463 2.896 . 0 0 "[ . 1 . 2]" 1
686 1 35 GLU QB 1 36 THR H . . 3.910 2.745 2.304 3.446 . 0 0 "[ . 1 . 2]" 1
687 1 74 GLN HA 1 77 LYS QD . . 4.370 3.468 2.871 3.759 . 0 0 "[ . 1 . 2]" 1
688 1 77 LYS HA 1 77 LYS QD . . 4.750 4.149 4.052 4.207 . 0 0 "[ . 1 . 2]" 1
689 1 77 LYS HB3 1 77 LYS QD . . 3.470 2.529 2.215 2.690 . 0 0 "[ . 1 . 2]" 1
690 1 17 GLN HB3 1 77 LYS QD . . 3.670 3.179 2.665 3.669 . 0 0 "[ . 1 . 2]" 1
691 1 19 ILE MG 1 77 LYS QD . . 3.760 2.587 2.432 2.829 . 0 0 "[ . 1 . 2]" 1
692 1 66 ILE MD 1 77 LYS QD . . 5.040 4.506 4.335 4.766 . 0 0 "[ . 1 . 2]" 1
693 1 73 VAL MG1 1 77 LYS QD . . 5.480 4.249 3.922 4.540 . 0 0 "[ . 1 . 2]" 1
694 1 37 ILE HG13 1 48 MET HB2 . . 2.980 2.758 2.601 2.943 . 0 0 "[ . 1 . 2]" 1
695 1 42 GLU HB3 1 43 ARG H . . 4.030 3.689 3.298 3.983 . 0 0 "[ . 1 . 2]" 1
696 1 38 LYS QB 1 38 LYS QD . . 3.480 2.129 2.070 2.200 . 0 0 "[ . 1 . 2]" 1
697 1 82 GLU HB2 1 83 LEU H . . 4.320 4.010 3.784 4.253 . 0 0 "[ . 1 . 2]" 1
698 1 38 LYS HA 1 38 LYS QD . . 4.020 3.997 3.896 4.052 0.032 15 0 "[ . 1 . 2]" 1
699 1 71 TYR HA 1 74 GLN QB . . 4.070 3.845 3.356 4.077 0.007 14 0 "[ . 1 . 2]" 1
700 1 25 LYS HA 1 25 LYS HD2 . . 4.130 3.665 3.495 3.926 . 0 0 "[ . 1 . 2]" 1
701 1 25 LYS HD2 1 84 ILE HB . . 4.070 3.645 3.369 4.065 . 0 0 "[ . 1 . 2]" 1
702 1 25 LYS HB3 1 25 LYS HD2 . . 3.820 2.529 2.346 2.735 . 0 0 "[ . 1 . 2]" 1
703 1 25 LYS HD2 1 84 ILE MG . . 4.690 4.009 3.700 4.296 . 0 0 "[ . 1 . 2]" 1
704 1 25 LYS HD2 1 84 ILE MD . . 5.310 4.961 4.169 5.310 . 0 0 "[ . 1 . 2]" 1
705 1 71 TYR HA 1 74 GLN H . . 4.350 4.241 4.135 4.341 . 0 0 "[ . 1 . 2]" 1
706 1 71 TYR HA 1 71 TYR QD . . 3.830 2.930 2.056 3.223 . 0 0 "[ . 1 . 2]" 1
707 1 78 GLU H 1 78 GLU QB . . 3.370 2.467 2.353 2.766 . 0 0 "[ . 1 . 2]" 1
708 1 46 VAL MG1 1 72 LYS HD2 . . 4.910 4.034 3.041 4.544 . 0 0 "[ . 1 . 2]" 1
709 1 62 LYS QD 1 63 PRO HD3 . . 4.570 4.328 4.076 4.572 0.002 16 0 "[ . 1 . 2]" 1
710 1 62 LYS H 1 62 LYS QD . . 4.760 4.105 3.587 4.366 . 0 0 "[ . 1 . 2]" 1
711 1 62 LYS HA 1 62 LYS QD . . 3.620 2.503 2.216 2.737 . 0 0 "[ . 1 . 2]" 1
712 1 23 ALA HA 1 62 LYS QD . . 5.100 4.737 3.901 5.099 . 0 0 "[ . 1 . 2]" 1
713 1 47 LYS H 1 47 LYS QD . . 4.910 4.522 4.411 4.712 . 0 0 "[ . 1 . 2]" 1
714 1 61 ASP H 1 62 LYS QD . . 5.340 4.605 3.794 5.154 . 0 0 "[ . 1 . 2]" 1
715 1 49 VAL HA 1 50 MET H . . 3.030 2.146 2.141 2.155 . 0 0 "[ . 1 . 2]" 1
716 1 48 MET HB3 1 49 VAL HA . . 4.950 4.418 4.287 4.527 . 0 0 "[ . 1 . 2]" 1
717 1 49 VAL HA 1 49 VAL MG1 . . 3.650 2.411 2.334 2.470 . 0 0 "[ . 1 . 2]" 1
718 1 37 ILE MD 1 49 VAL HA . . 4.270 3.434 2.928 3.664 . 0 0 "[ . 1 . 2]" 1
719 1 49 VAL HA 1 64 LEU MD1 . . 4.640 3.761 3.537 4.025 . 0 0 "[ . 1 . 2]" 1
720 1 39 GLN HB2 1 40 LEU H . . 4.270 3.025 2.779 4.124 . 0 0 "[ . 1 . 2]" 1
721 1 39 GLN HB3 1 40 LEU H . . 4.270 3.681 3.443 3.860 . 0 0 "[ . 1 . 2]" 1
722 1 39 GLN H 1 39 GLN HB3 . . 3.710 3.483 2.228 3.578 . 0 0 "[ . 1 . 2]" 1
723 1 75 GLN H 1 75 GLN HB3 . . 3.730 3.579 3.531 3.603 . 0 0 "[ . 1 . 2]" 1
724 1 72 LYS HA 1 75 GLN HB2 . . 3.740 2.797 2.461 3.280 . 0 0 "[ . 1 . 2]" 1
725 1 38 LYS HA 1 41 GLN QE . . 3.590 2.564 2.142 2.897 . 0 0 "[ . 1 . 2]" 1
726 1 38 LYS HA 1 41 GLN HG3 . . 3.850 2.991 2.830 3.108 . 0 0 "[ . 1 . 2]" 1
727 1 38 LYS HA 1 41 GLN QB . . 3.910 3.638 3.438 3.911 0.001 3 0 "[ . 1 . 2]" 1
728 1 38 LYS HA 1 38 LYS HG3 . . 3.920 2.468 2.218 2.694 . 0 0 "[ . 1 . 2]" 1
729 1 38 LYS HA 1 38 LYS HG2 . . 3.920 2.940 2.510 3.149 . 0 0 "[ . 1 . 2]" 1
730 1 51 ILE HA 1 51 ILE MG . . 3.440 2.212 2.121 2.305 . 0 0 "[ . 1 . 2]" 1
731 1 51 ILE HA 1 51 ILE MD . . 3.570 2.256 1.990 2.441 . 0 0 "[ . 1 . 2]" 1
732 1 51 ILE HA 1 52 GLN H . . 3.400 2.178 2.141 2.298 . 0 0 "[ . 1 . 2]" 1
733 1 77 LYS HA 1 81 LEU H . . 4.240 4.018 3.808 4.186 . 0 0 "[ . 1 . 2]" 1
734 1 77 LYS HA 1 77 LYS HG3 . . 3.760 2.876 2.815 2.954 . 0 0 "[ . 1 . 2]" 1
735 1 77 LYS HA 1 77 LYS HG2 . . 4.130 3.315 3.196 3.475 . 0 0 "[ . 1 . 2]" 1
736 1 77 LYS HA 1 80 VAL MG2 . . 3.450 3.171 2.827 3.435 . 0 0 "[ . 1 . 2]" 1
737 1 19 ILE MD 1 77 LYS HA . . 3.320 2.915 2.723 3.141 . 0 0 "[ . 1 . 2]" 1
738 1 66 ILE MD 1 77 LYS HA . . 3.470 2.154 1.929 2.299 . 0 0 "[ . 1 . 2]" 1
739 1 30 ILE H 1 30 ILE HG12 . . 3.740 3.541 2.990 3.736 . 0 0 "[ . 1 . 2]" 1
740 1 30 ILE HA 1 30 ILE HG12 . . 4.010 2.515 2.433 2.633 . 0 0 "[ . 1 . 2]" 1
741 1 30 ILE HG12 1 50 MET ME . . 4.120 2.561 2.117 3.050 . 0 0 "[ . 1 . 2]" 1
742 1 65 ARG HG3 1 67 THR MG . . 4.520 4.143 3.823 4.392 . 0 0 "[ . 1 . 2]" 1
743 1 65 ARG HG3 1 66 ILE H . . 4.640 3.664 3.113 4.195 . 0 0 "[ . 1 . 2]" 1
744 1 65 ARG HA 1 65 ARG HG3 . . 3.930 2.557 2.227 2.787 . 0 0 "[ . 1 . 2]" 1
745 1 16 VAL MG1 1 65 ARG HG3 . . 4.380 4.017 3.827 4.272 . 0 0 "[ . 1 . 2]" 1
746 1 16 VAL MG2 1 65 ARG HG3 . . 3.600 2.430 2.126 2.827 . 0 0 "[ . 1 . 2]" 1
747 1 18 GLU HG3 1 65 ARG HG3 . . 3.730 2.719 2.265 3.308 . 0 0 "[ . 1 . 2]" 1
748 1 65 ARG HA 1 65 ARG HG2 . . 3.960 2.845 2.556 3.233 . 0 0 "[ . 1 . 2]" 1
749 1 65 ARG HG2 1 67 THR MG . . 4.490 2.890 2.621 3.157 . 0 0 "[ . 1 . 2]" 1
750 1 16 VAL MG1 1 65 ARG HG2 . . 4.470 4.219 3.949 4.473 0.003 3 0 "[ . 1 . 2]" 1
751 1 26 ALA HA 1 30 ILE HG13 . . 4.270 3.270 3.024 3.568 . 0 0 "[ . 1 . 2]" 1
752 1 30 ILE HG13 1 50 MET ME . . 4.010 2.543 2.062 3.202 . 0 0 "[ . 1 . 2]" 1
753 1 41 GLN HA 1 48 MET HG3 . . 3.680 3.608 3.384 3.684 0.004 2 0 "[ . 1 . 2]" 1
754 1 41 GLN HA 1 44 ALA MB . . 4.040 3.801 3.582 4.019 . 0 0 "[ . 1 . 2]" 1
755 1 41 GLN HA 1 46 VAL MG2 . . 3.690 2.868 2.547 3.157 . 0 0 "[ . 1 . 2]" 1
756 1 41 GLN HA 1 46 VAL H . . 4.080 2.960 2.620 3.769 . 0 0 "[ . 1 . 2]" 1
757 1 41 GLN HA 1 41 GLN HG2 . . 3.990 2.510 2.438 2.640 . 0 0 "[ . 1 . 2]" 1
758 1 41 GLN HA 1 41 GLN HG3 . . 3.100 3.005 2.849 3.102 0.002 3 0 "[ . 1 . 2]" 1
759 1 22 PRO HG2 1 25 LYS HG3 . . 4.810 2.398 2.084 2.688 . 0 0 "[ . 1 . 2]" 1
760 1 22 PRO HG3 1 25 LYS HG3 . . 4.810 2.784 2.471 2.961 . 0 0 "[ . 1 . 2]" 1
761 1 64 LEU H 1 64 LEU HG . . 5.260 4.082 3.996 4.193 . 0 0 "[ . 1 . 2]" 1
762 1 64 LEU HG 1 66 ILE HG13 . . 3.340 2.300 2.185 2.428 . 0 0 "[ . 1 . 2]" 1
763 1 64 LEU HG 1 66 ILE HG12 . . 3.270 3.065 2.847 3.209 . 0 0 "[ . 1 . 2]" 1
764 1 48 MET HG2 1 64 LEU MD2 . . 4.520 3.319 3.096 3.491 . 0 0 "[ . 1 . 2]" 1
765 1 64 LEU MD2 1 66 ILE HG12 . . 3.360 2.946 2.673 3.148 . 0 0 "[ . 1 . 2]" 1
766 1 19 ILE HG12 1 64 LEU MD2 . . 4.240 2.852 2.408 3.133 . 0 0 "[ . 1 . 2]" 1
767 1 50 MET QG 1 64 LEU MD2 . . 4.400 3.575 3.108 3.810 . 0 0 "[ . 1 . 2]" 1
768 1 19 ILE HG13 1 64 LEU MD2 . . 3.560 2.668 2.247 3.084 . 0 0 "[ . 1 . 2]" 1
769 1 64 LEU HB2 1 64 LEU MD2 . . 2.780 2.484 2.366 2.568 . 0 0 "[ . 1 . 2]" 1
770 1 64 LEU MD2 1 66 ILE MD . . 2.940 2.172 1.988 2.454 . 0 0 "[ . 1 . 2]" 1
771 1 15 ALA MB 1 70 PRO HG2 . . 4.220 4.131 3.955 4.221 0.001 15 0 "[ . 1 . 2]" 1
772 1 62 LYS HA 1 63 PRO HG2 . . 4.520 4.169 4.117 4.247 . 0 0 "[ . 1 . 2]" 1
773 1 72 LYS HA 1 76 ALA H . . 4.850 4.101 3.810 4.420 . 0 0 "[ . 1 . 2]" 1
774 1 72 LYS HA 1 75 GLN H . . 3.490 3.198 3.049 3.456 . 0 0 "[ . 1 . 2]" 1
775 1 72 LYS HA 1 72 LYS HG3 . . 3.500 3.410 3.335 3.459 . 0 0 "[ . 1 . 2]" 1
776 1 78 GLU HA 1 81 LEU H . . 4.340 3.501 3.226 3.736 . 0 0 "[ . 1 . 2]" 1
777 1 78 GLU HA 1 78 GLU HG2 . . 3.980 2.696 2.336 3.687 . 0 0 "[ . 1 . 2]" 1
778 1 78 GLU HA 1 81 LEU HB3 . . 4.130 3.970 3.782 4.127 . 0 0 "[ . 1 . 2]" 1
779 1 78 GLU HA 1 81 LEU MD1 . . 3.700 2.554 2.124 2.886 . 0 0 "[ . 1 . 2]" 1
780 1 79 MET HA 1 79 MET HG3 . . 3.820 2.850 2.468 3.233 . 0 0 "[ . 1 . 2]" 1
781 1 72 LYS HA 1 72 LYS HB3 . . 2.570 2.417 2.359 2.478 . 0 0 "[ . 1 . 2]" 1
782 1 72 LYS HA 1 72 LYS HG2 . . 3.500 2.532 2.388 2.725 . 0 0 "[ . 1 . 2]" 1
783 1 74 GLN QB 1 75 GLN H . . 3.750 3.014 2.559 3.546 . 0 0 "[ . 1 . 2]" 1
784 1 43 ARG H 1 43 ARG HG2 . . 4.060 3.559 2.485 4.035 . 0 0 "[ . 1 . 2]" 1
785 1 21 ILE H 1 21 ILE HG13 . . 4.270 3.823 3.745 4.011 . 0 0 "[ . 1 . 2]" 1
786 1 21 ILE HG13 1 64 LEU H . . 4.700 3.727 3.495 4.010 . 0 0 "[ . 1 . 2]" 1
787 1 21 ILE HG13 1 21 ILE MG . . 3.540 2.450 2.288 2.555 . 0 0 "[ . 1 . 2]" 1
788 1 19 ILE HA 1 20 MET H . . 3.090 2.337 2.176 2.480 . 0 0 "[ . 1 . 2]" 1
789 1 19 ILE HA 1 19 ILE MG . . 3.660 2.146 2.030 2.189 . 0 0 "[ . 1 . 2]" 1
790 1 35 GLU HA 1 35 GLU QG . . 3.510 2.573 2.159 3.423 . 0 0 "[ . 1 . 2]" 1
791 1 66 ILE H 1 66 ILE HG12 . . 4.040 3.761 3.609 3.875 . 0 0 "[ . 1 . 2]" 1
792 1 64 LEU MD1 1 66 ILE HG12 . . 3.100 2.683 2.371 3.101 0.001 10 0 "[ . 1 . 2]" 1
793 1 82 GLU HA 1 85 ARG QG . . 3.830 3.307 2.712 3.737 . 0 0 "[ . 1 . 2]" 1
794 1 85 ARG HB2 1 85 ARG QG . . 2.430 2.312 2.214 2.436 0.006 6 0 "[ . 1 . 2]" 1
795 1 48 MET HG2 1 66 ILE HG13 . . 4.090 3.795 3.560 3.945 . 0 0 "[ . 1 . 2]" 1
796 1 19 ILE MD 1 66 ILE HG13 . . 3.630 2.180 1.980 2.420 . 0 0 "[ . 1 . 2]" 1
797 1 64 LEU MD2 1 66 ILE HG13 . . 4.160 2.895 2.645 3.180 . 0 0 "[ . 1 . 2]" 1
798 1 39 GLN HA 1 39 GLN HG3 . . 3.910 3.459 2.845 3.730 . 0 0 "[ . 1 . 2]" 1
799 1 39 GLN HA 1 43 ARG H . . 5.000 4.670 4.443 4.995 . 0 0 "[ . 1 . 2]" 1
800 1 38 LYS QB 1 39 GLN HA . . 4.240 4.009 3.854 4.176 . 0 0 "[ . 1 . 2]" 1
801 1 82 GLU HA 1 85 ARG HB2 . . 3.270 2.108 2.030 2.228 . 0 0 "[ . 1 . 2]" 1
802 1 82 GLU HA 1 85 ARG HB3 . . 3.810 3.640 3.407 3.792 . 0 0 "[ . 1 . 2]" 1
803 1 81 LEU HA 1 81 LEU HG . . 4.000 2.774 2.662 2.872 . 0 0 "[ . 1 . 2]" 1
804 1 77 LYS HG3 1 81 LEU HG . . 4.560 3.139 2.950 3.323 . 0 0 "[ . 1 . 2]" 1
805 1 28 LEU H 1 28 LEU HG . . 4.020 3.810 3.548 3.985 . 0 0 "[ . 1 . 2]" 1
806 1 25 LYS HA 1 28 LEU HG . . 4.750 4.544 4.377 4.674 . 0 0 "[ . 1 . 2]" 1
807 1 28 LEU HA 1 28 LEU HG . . 3.620 2.324 2.251 2.409 . 0 0 "[ . 1 . 2]" 1
808 1 85 ARG H 1 85 ARG QG . . 3.480 2.798 2.564 3.033 . 0 0 "[ . 1 . 2]" 1
809 1 51 ILE HG13 1 65 ARG HB3 . . 4.650 3.719 3.355 4.012 . 0 0 "[ . 1 . 2]" 1
810 1 51 ILE H 1 51 ILE HG13 . . 4.080 3.657 3.399 3.807 . 0 0 "[ . 1 . 2]" 1
811 1 51 ILE HG13 1 65 ARG HB2 . . 3.840 2.368 2.107 2.736 . 0 0 "[ . 1 . 2]" 1
812 1 51 ILE HG12 1 51 ILE MG . . 3.660 3.187 3.164 3.199 . 0 0 "[ . 1 . 2]" 1
813 1 51 ILE HG12 1 65 ARG HB3 . . 3.930 3.294 3.078 3.511 . 0 0 "[ . 1 . 2]" 1
814 1 42 GLU HA 1 44 ALA H . . 4.800 4.087 3.883 4.486 . 0 0 "[ . 1 . 2]" 1
815 1 43 ARG HA 1 43 ARG HG2 . . 3.690 2.500 2.171 3.642 . 0 0 "[ . 1 . 2]" 1
816 1 43 ARG HA 1 43 ARG HG3 . . 3.690 2.992 2.439 3.693 0.003 16 0 "[ . 1 . 2]" 1
817 1 74 GLN HA 1 77 LYS H . . 4.200 3.813 3.553 4.059 . 0 0 "[ . 1 . 2]" 1
818 1 74 GLN HA 1 74 GLN HG2 . . 3.950 3.258 2.437 3.945 . 0 0 "[ . 1 . 2]" 1
819 1 74 GLN HA 1 74 GLN HG3 . . 3.950 3.675 3.474 3.789 . 0 0 "[ . 1 . 2]" 1
820 1 74 GLN HA 1 77 LYS HB2 . . 4.380 3.768 3.565 4.016 . 0 0 "[ . 1 . 2]" 1
821 1 39 GLN H 1 40 LEU HG . . 5.020 4.508 4.132 4.780 . 0 0 "[ . 1 . 2]" 1
822 1 40 LEU HG 1 41 GLN H . . 5.450 4.762 4.619 4.901 . 0 0 "[ . 1 . 2]" 1
823 1 40 LEU HA 1 40 LEU HG . . 4.220 2.849 2.719 3.000 . 0 0 "[ . 1 . 2]" 1
824 1 19 ILE HG13 1 19 ILE MG . . 3.130 2.564 2.489 2.640 . 0 0 "[ . 1 . 2]" 1
825 1 19 ILE HG12 1 64 LEU HB3 . . 4.370 2.398 2.203 2.566 . 0 0 "[ . 1 . 2]" 1
826 1 19 ILE HG12 1 66 ILE HG13 . . 4.250 3.768 3.529 3.932 . 0 0 "[ . 1 . 2]" 1
827 1 19 ILE HG12 1 66 ILE MD . . 4.490 3.802 3.488 4.084 . 0 0 "[ . 1 . 2]" 1
828 1 19 ILE H 1 19 ILE HG12 . . 4.210 2.072 1.998 2.143 . 0 0 "[ . 1 . 2]" 1
829 1 75 GLN HA 1 75 GLN HG2 . . 3.820 2.812 2.463 3.050 . 0 0 "[ . 1 . 2]" 1
830 1 75 GLN HA 1 75 GLN HB3 . . 2.780 2.511 2.371 2.617 . 0 0 "[ . 1 . 2]" 1
831 1 40 LEU HA 1 43 ARG QD . . 4.920 3.323 2.245 4.921 0.001 6 0 "[ . 1 . 2]" 1
832 1 40 LEU HA 1 79 MET ME . . 3.650 3.035 2.502 3.496 . 0 0 "[ . 1 . 2]" 1
833 1 40 LEU HA 1 40 LEU MD2 . . 3.080 1.997 1.971 2.070 . 0 0 "[ . 1 . 2]" 1
834 1 69 ASP HB3 1 72 LYS HG2 . . 5.470 4.039 3.590 4.330 . 0 0 "[ . 1 . 2]" 1
835 1 32 LYS HA 1 32 LYS HG3 . . 4.190 3.019 2.222 3.908 . 0 0 "[ . 1 . 2]" 1
836 1 40 LEU H 1 40 LEU MD1 . . 5.030 3.598 3.488 3.671 . 0 0 "[ . 1 . 2]" 1
837 1 32 LYS HA 1 32 LYS HG2 . . 4.190 2.785 2.190 3.632 . 0 0 "[ . 1 . 2]" 1
838 1 80 VAL HB 1 81 LEU HA . . 4.290 4.057 3.970 4.202 . 0 0 "[ . 1 . 2]" 1
839 1 81 LEU HA 1 84 ILE HG12 . . 3.140 2.560 2.201 3.131 . 0 0 "[ . 1 . 2]" 1
840 1 81 LEU HA 1 84 ILE HG13 . . 3.630 3.316 2.633 3.634 0.004 2 0 "[ . 1 . 2]" 1
841 1 81 LEU HA 1 81 LEU MD2 . . 2.880 2.066 1.985 2.356 . 0 0 "[ . 1 . 2]" 1
842 1 84 ILE HG12 1 84 ILE MG . . 3.370 2.101 2.038 2.202 . 0 0 "[ . 1 . 2]" 1
843 1 40 LEU HA 1 40 LEU MD1 . . 4.050 3.852 3.830 3.882 . 0 0 "[ . 1 . 2]" 1
844 1 40 LEU MD1 1 48 MET ME . . 4.010 2.888 2.620 3.239 . 0 0 "[ . 1 . 2]" 1
845 1 29 VAL HA 1 40 LEU MD1 . . 4.580 3.602 3.295 3.895 . 0 0 "[ . 1 . 2]" 1
846 1 83 LEU HA 1 83 LEU MD1 . . 3.250 2.767 2.443 3.002 . 0 0 "[ . 1 . 2]" 1
847 1 83 LEU HA 1 83 LEU MD2 . . 3.230 2.088 1.948 2.224 . 0 0 "[ . 1 . 2]" 1
848 1 77 LYS HE2 1 81 LEU MD1 . . 4.100 3.662 2.233 4.107 0.007 2 0 "[ . 1 . 2]" 1
849 1 77 LYS HB3 1 81 LEU MD1 . . 4.660 4.106 3.979 4.234 . 0 0 "[ . 1 . 2]" 1
850 1 78 GLU QB 1 81 LEU MD1 . . 5.070 4.214 3.440 4.560 . 0 0 "[ . 1 . 2]" 1
851 1 81 LEU HB2 1 81 LEU MD1 . . 3.200 2.132 2.054 2.211 . 0 0 "[ . 1 . 2]" 1
852 1 77 LYS QD 1 81 LEU MD1 . . 4.030 2.707 2.385 3.383 . 0 0 "[ . 1 . 2]" 1
853 1 77 LYS HG3 1 81 LEU MD1 . . 3.480 2.169 1.992 2.369 . 0 0 "[ . 1 . 2]" 1
854 1 85 ARG HA 1 85 ARG QG . . 3.600 2.259 2.156 2.350 . 0 0 "[ . 1 . 2]" 1
855 1 38 LYS H 1 38 LYS HG3 . . 4.800 4.254 4.078 4.452 . 0 0 "[ . 1 . 2]" 1
856 1 29 VAL HA 1 83 LEU MD2 . . 3.880 3.790 3.550 3.882 0.002 16 0 "[ . 1 . 2]" 1
857 1 80 VAL HA 1 83 LEU MD2 . . 4.830 4.380 3.954 4.614 . 0 0 "[ . 1 . 2]" 1
858 1 29 VAL HB 1 83 LEU MD2 . . 4.540 4.099 3.708 4.441 . 0 0 "[ . 1 . 2]" 1
859 1 36 THR MG 1 83 LEU MD2 . . 3.920 3.613 3.260 3.837 . 0 0 "[ . 1 . 2]" 1
860 1 84 ILE MD 1 85 ARG HA . . 4.180 3.616 2.180 4.182 0.002 4 0 "[ . 1 . 2]" 1
861 1 23 ALA HA 1 62 LYS QG . . 4.020 2.851 1.980 3.112 . 0 0 "[ . 1 . 2]" 1
862 1 47 LYS HA 1 47 LYS HG2 . . 4.110 2.719 2.423 2.925 . 0 0 "[ . 1 . 2]" 1
863 1 47 LYS HG3 1 48 MET H . . 4.290 3.749 3.381 4.291 0.001 16 0 "[ . 1 . 2]" 1
864 1 28 LEU H 1 28 LEU MD1 . . 4.610 2.260 1.936 2.761 . 0 0 "[ . 1 . 2]" 1
865 1 25 LYS HA 1 28 LEU MD1 . . 4.640 1.946 1.824 2.066 . 0 0 "[ . 1 . 2]" 1
866 1 25 LYS HB3 1 28 LEU MD1 . . 4.060 3.608 3.108 3.918 . 0 0 "[ . 1 . 2]" 1
867 1 28 LEU HB2 1 28 LEU MD1 . . 3.560 2.166 2.074 2.253 . 0 0 "[ . 1 . 2]" 1
868 1 25 LYS HD3 1 28 LEU MD1 . . 3.280 2.689 2.297 3.032 . 0 0 "[ . 1 . 2]" 1
869 1 25 LYS HD2 1 28 LEU MD1 . . 4.350 4.100 3.658 4.329 . 0 0 "[ . 1 . 2]" 1
870 1 28 LEU H 1 83 LEU MD1 . . 5.010 4.440 4.049 4.920 . 0 0 "[ . 1 . 2]" 1
871 1 83 LEU H 1 83 LEU MD1 . . 5.270 4.210 4.171 4.244 . 0 0 "[ . 1 . 2]" 1
872 1 29 VAL HA 1 83 LEU MD1 . . 4.240 2.546 2.100 3.006 . 0 0 "[ . 1 . 2]" 1
873 1 80 VAL HA 1 83 LEU MD1 . . 5.040 4.742 4.567 4.966 . 0 0 "[ . 1 . 2]" 1
874 1 83 LEU HB2 1 83 LEU MD1 . . 3.420 3.179 3.163 3.189 . 0 0 "[ . 1 . 2]" 1
875 1 83 LEU HB3 1 83 LEU MD1 . . 3.420 2.243 2.145 2.372 . 0 0 "[ . 1 . 2]" 1
876 1 36 THR MG 1 83 LEU MD1 . . 4.170 3.973 3.736 4.170 . 0 0 "[ . 1 . 2]" 1
877 1 28 LEU HA 1 28 LEU MD1 . . 3.510 3.125 2.987 3.264 . 0 0 "[ . 1 . 2]" 1
878 1 25 LYS HD3 1 25 LYS HG2 . . 2.830 2.541 2.447 2.650 . 0 0 "[ . 1 . 2]" 1
879 1 66 ILE MD 1 77 LYS HG3 . . 4.300 3.875 3.625 4.142 . 0 0 "[ . 1 . 2]" 1
880 1 66 ILE MD 1 77 LYS HG2 . . 4.900 4.693 4.448 4.897 . 0 0 "[ . 1 . 2]" 1
881 1 77 LYS HG2 1 81 LEU HG . . 4.300 3.489 3.173 3.866 . 0 0 "[ . 1 . 2]" 1
882 1 77 LYS HG2 1 81 LEU MD1 . . 3.520 2.015 1.880 2.234 . 0 0 "[ . 1 . 2]" 1
883 1 25 LYS HG3 1 84 ILE HA . . 4.840 2.892 2.606 3.202 . 0 0 "[ . 1 . 2]" 1
884 1 25 LYS H 1 25 LYS HG3 . . 4.770 3.433 3.309 3.603 . 0 0 "[ . 1 . 2]" 1
885 1 21 ILE MG 1 26 ALA HA . . 3.120 2.743 2.524 2.979 . 0 0 "[ . 1 . 2]" 1
886 1 28 LEU HA 1 28 LEU MD2 . . 3.610 3.580 3.524 3.615 0.005 13 0 "[ . 1 . 2]" 1
887 1 25 LYS HB3 1 28 LEU MD2 . . 4.480 3.886 3.477 4.291 . 0 0 "[ . 1 . 2]" 1
888 1 25 LYS HD3 1 28 LEU MD2 . . 3.240 2.867 2.525 3.233 . 0 0 "[ . 1 . 2]" 1
889 1 25 LYS HD2 1 28 LEU MD2 . . 4.330 3.627 3.151 4.141 . 0 0 "[ . 1 . 2]" 1
890 1 64 LEU MD1 1 65 ARG H . . 3.790 2.340 1.975 2.632 . 0 0 "[ . 1 . 2]" 1
891 1 50 MET H 1 64 LEU MD1 . . 4.150 3.360 3.087 3.632 . 0 0 "[ . 1 . 2]" 1
892 1 50 MET HA 1 64 LEU MD1 . . 3.280 2.285 1.978 2.609 . 0 0 "[ . 1 . 2]" 1
893 1 64 LEU HA 1 64 LEU MD1 . . 3.270 2.289 2.165 2.428 . 0 0 "[ . 1 . 2]" 1
894 1 50 MET QG 1 64 LEU MD1 . . 3.630 2.227 1.902 3.096 . 0 0 "[ . 1 . 2]" 1
895 1 50 MET ME 1 64 LEU MD1 . . 3.200 2.842 2.474 3.182 . 0 0 "[ . 1 . 2]" 1
896 1 48 MET HB3 1 64 LEU MD1 . . 3.250 2.649 2.449 2.864 . 0 0 "[ . 1 . 2]" 1
897 1 64 LEU HB2 1 64 LEU MD1 . . 3.100 2.352 2.294 2.429 . 0 0 "[ . 1 . 2]" 1
898 1 22 PRO HA 1 23 ALA HA . . 4.690 4.414 4.377 4.469 . 0 0 "[ . 1 . 2]" 1
899 1 23 ALA HA 1 26 ALA MB . . 3.290 2.008 1.889 2.254 . 0 0 "[ . 1 . 2]" 1
900 1 56 GLN HA 1 56 GLN QG . . 3.910 2.676 2.190 3.339 . 0 0 "[ . 1 . 2]" 1
901 1 17 GLN H 1 73 VAL MG2 . . 3.820 3.669 3.280 3.818 . 0 0 "[ . 1 . 2]" 1
902 1 73 VAL MG2 1 74 GLN H . . 4.630 3.999 3.869 4.127 . 0 0 "[ . 1 . 2]" 1
903 1 68 GLY HA2 1 73 VAL MG2 . . 3.820 3.675 3.399 3.825 0.005 20 0 "[ . 1 . 2]" 1
904 1 46 VAL HB 1 73 VAL MG2 . . 3.920 2.978 2.781 3.309 . 0 0 "[ . 1 . 2]" 1
905 1 72 LYS HB2 1 73 VAL MG2 . . 3.510 3.347 3.161 3.515 0.005 9 0 "[ . 1 . 2]" 1
906 1 17 GLN HB2 1 73 VAL MG2 . . 4.240 4.099 3.999 4.241 0.001 10 0 "[ . 1 . 2]" 1
907 1 15 ALA MB 1 73 VAL MG2 . . 3.390 2.111 1.947 2.394 . 0 0 "[ . 1 . 2]" 1
908 1 67 THR MG 1 73 VAL MG2 . . 4.200 4.168 4.068 4.207 0.007 10 0 "[ . 1 . 2]" 1
909 1 46 VAL MG2 1 73 VAL MG2 . . 4.630 3.540 3.334 3.810 . 0 0 "[ . 1 . 2]" 1
910 1 52 GLN HA 1 62 LYS QD . . 4.460 3.138 2.547 3.534 . 0 0 "[ . 1 . 2]" 1
911 1 51 ILE MG 1 52 GLN HA . . 4.300 4.030 3.627 4.270 . 0 0 "[ . 1 . 2]" 1
912 1 80 VAL MG2 1 81 LEU H . . 3.850 3.639 3.536 3.837 . 0 0 "[ . 1 . 2]" 1
913 1 37 ILE HA 1 80 VAL MG2 . . 5.270 4.807 4.556 5.125 . 0 0 "[ . 1 . 2]" 1
914 1 79 MET HA 1 80 VAL MG2 . . 5.500 4.727 4.563 4.837 . 0 0 "[ . 1 . 2]" 1
915 1 19 ILE HG13 1 80 VAL MG2 . . 4.600 4.454 4.208 4.600 0.000 20 0 "[ . 1 . 2]" 1
916 1 76 ALA MB 1 80 VAL MG2 . . 4.040 3.297 3.066 3.493 . 0 0 "[ . 1 . 2]" 1
917 1 40 LEU HB3 1 80 VAL MG2 . . 4.060 3.530 3.392 3.720 . 0 0 "[ . 1 . 2]" 1
918 1 37 ILE HG13 1 80 VAL MG2 . . 4.270 4.092 3.868 4.245 . 0 0 "[ . 1 . 2]" 1
919 1 21 ILE HA 1 22 PRO HG2 . . 5.140 4.236 4.180 4.308 . 0 0 "[ . 1 . 2]" 1
920 1 21 ILE HA 1 22 PRO HG3 . . 5.140 4.324 4.315 4.346 . 0 0 "[ . 1 . 2]" 1
921 1 21 ILE HA 1 21 ILE MG . . 3.300 2.246 2.158 2.296 . 0 0 "[ . 1 . 2]" 1
922 1 40 LEU H 1 40 LEU MD2 . . 4.530 3.742 3.500 3.888 . 0 0 "[ . 1 . 2]" 1
923 1 40 LEU MD2 1 41 GLN H . . 5.000 4.800 4.742 4.858 . 0 0 "[ . 1 . 2]" 1
924 1 40 LEU MD2 1 79 MET HG3 . . 5.030 4.765 4.340 5.023 . 0 0 "[ . 1 . 2]" 1
925 1 40 LEU MD2 1 79 MET HB3 . . 4.160 2.519 2.199 2.825 . 0 0 "[ . 1 . 2]" 1
926 1 40 LEU MD2 1 79 MET ME . . 3.040 2.136 1.867 2.299 . 0 0 "[ . 1 . 2]" 1
927 1 40 LEU MD2 1 48 MET ME . . 3.860 3.057 2.713 3.282 . 0 0 "[ . 1 . 2]" 1
928 1 40 LEU HB3 1 40 LEU MD2 . . 3.400 2.338 2.306 2.356 . 0 0 "[ . 1 . 2]" 1
929 1 29 VAL MG1 1 30 ILE H . . 4.240 2.260 1.983 2.618 . 0 0 "[ . 1 . 2]" 1
930 1 26 ALA HA 1 29 VAL MG1 . . 4.150 2.300 1.915 2.704 . 0 0 "[ . 1 . 2]" 1
931 1 25 LYS HB2 1 29 VAL MG1 . . 4.570 4.136 3.571 4.560 . 0 0 "[ . 1 . 2]" 1
932 1 29 VAL MG1 1 83 LEU HG . . 5.070 4.182 3.745 4.607 . 0 0 "[ . 1 . 2]" 1
933 1 26 ALA MB 1 29 VAL MG1 . . 4.140 3.530 3.211 3.903 . 0 0 "[ . 1 . 2]" 1
934 1 21 ILE MD 1 29 VAL MG1 . . 4.020 3.849 3.459 4.024 0.004 1 0 "[ . 1 . 2]" 1
935 1 29 VAL MG1 1 50 MET ME . . 3.220 2.222 1.759 2.457 . 0 0 "[ . 1 . 2]" 1
936 1 29 VAL MG1 1 30 ILE MG . . 5.340 4.358 4.065 4.552 . 0 0 "[ . 1 . 2]" 1
937 1 17 GLN HA 1 17 GLN HG3 . . 4.040 3.452 2.713 3.677 . 0 0 "[ . 1 . 2]" 1
938 1 17 GLN HA 1 19 ILE MD . . 5.270 4.394 4.225 4.581 . 0 0 "[ . 1 . 2]" 1
939 1 61 ASP HA 1 62 LYS HB2 . . 5.500 4.735 4.606 4.852 . 0 0 "[ . 1 . 2]" 1
940 1 61 ASP HA 1 62 LYS QD . . 5.420 4.716 3.936 5.145 . 0 0 "[ . 1 . 2]" 1
941 1 23 ALA MB 1 61 ASP HA . . 4.540 3.886 3.491 4.163 . 0 0 "[ . 1 . 2]" 1
942 1 60 ALA MB 1 61 ASP HA . . 4.960 4.119 3.713 4.402 . 0 0 "[ . 1 . 2]" 1
943 1 23 ALA H 1 61 ASP HA . . 4.030 2.773 2.282 3.146 . 0 0 "[ . 1 . 2]" 1
944 1 76 ALA HA 1 79 MET HG2 . . 5.000 4.608 4.346 4.907 . 0 0 "[ . 1 . 2]" 1
945 1 76 ALA HA 1 79 MET HG3 . . 5.000 3.390 2.720 4.022 . 0 0 "[ . 1 . 2]" 1
946 1 76 ALA HA 1 79 MET HB2 . . 4.320 2.471 2.206 2.651 . 0 0 "[ . 1 . 2]" 1
947 1 76 ALA HA 1 79 MET HB3 . . 4.320 4.078 3.687 4.278 . 0 0 "[ . 1 . 2]" 1
948 1 44 ALA MB 1 76 ALA HA . . 3.210 2.530 2.185 2.848 . 0 0 "[ . 1 . 2]" 1
949 1 76 ALA HA 1 80 VAL MG2 . . 4.420 4.067 3.780 4.294 . 0 0 "[ . 1 . 2]" 1
950 1 46 VAL MG1 1 73 VAL H . . 4.420 2.627 2.420 2.841 . 0 0 "[ . 1 . 2]" 1
951 1 46 VAL MG1 1 72 LYS H . . 5.080 4.105 3.861 4.294 . 0 0 "[ . 1 . 2]" 1
952 1 46 VAL HA 1 46 VAL MG1 . . 3.480 2.304 2.186 2.366 . 0 0 "[ . 1 . 2]" 1
953 1 46 VAL MG1 1 72 LYS HA . . 4.150 3.904 3.547 4.153 0.003 4 0 "[ . 1 . 2]" 1
954 1 45 GLY QA 1 46 VAL MG1 . . 3.970 3.561 3.351 3.843 . 0 0 "[ . 1 . 2]" 1
955 1 46 VAL MG1 1 73 VAL HA . . 3.660 2.196 1.998 2.506 . 0 0 "[ . 1 . 2]" 1
956 1 46 VAL MG1 1 72 LYS HB3 . . 3.320 2.260 1.940 2.598 . 0 0 "[ . 1 . 2]" 1
957 1 46 VAL MG1 1 73 VAL HB . . 4.160 4.013 3.742 4.162 0.002 19 0 "[ . 1 . 2]" 1
958 1 46 VAL MG1 1 72 LYS HB2 . . 3.400 2.239 1.996 2.450 . 0 0 "[ . 1 . 2]" 1
959 1 44 ALA MB 1 46 VAL MG1 . . 3.360 2.974 2.709 3.307 . 0 0 "[ . 1 . 2]" 1
960 1 46 VAL MG1 1 76 ALA MB . . 3.400 2.950 2.757 3.173 . 0 0 "[ . 1 . 2]" 1
961 1 46 VAL MG1 1 66 ILE MG . . 3.480 3.182 3.028 3.351 . 0 0 "[ . 1 . 2]" 1
962 1 25 LYS HA 1 25 LYS HD3 . . 3.430 2.371 2.156 2.552 . 0 0 "[ . 1 . 2]" 1
963 1 25 LYS HA 1 25 LYS HG2 . . 3.900 2.973 2.866 3.123 . 0 0 "[ . 1 . 2]" 1
964 1 25 LYS HA 1 84 ILE MG . . 4.220 4.113 3.913 4.221 0.001 10 0 "[ . 1 . 2]" 1
965 1 36 THR MG 1 40 LEU H . . 5.020 4.013 3.752 4.376 . 0 0 "[ . 1 . 2]" 1
966 1 36 THR MG 1 37 ILE H . . 4.070 3.016 2.700 3.258 . 0 0 "[ . 1 . 2]" 1
967 1 36 THR HA 1 36 THR MG . . 3.330 2.438 2.303 2.501 . 0 0 "[ . 1 . 2]" 1
968 1 29 VAL HA 1 36 THR MG . . 3.510 2.683 2.227 2.988 . 0 0 "[ . 1 . 2]" 1
969 1 29 VAL HB 1 36 THR MG . . 5.130 4.591 4.024 4.965 . 0 0 "[ . 1 . 2]" 1
970 1 36 THR MG 1 40 LEU HB2 . . 5.360 4.387 4.070 4.723 . 0 0 "[ . 1 . 2]" 1
971 1 36 THR MG 1 40 LEU HG . . 3.570 2.839 2.660 3.159 . 0 0 "[ . 1 . 2]" 1
972 1 36 THR MG 1 40 LEU MD1 . . 3.080 2.656 2.271 2.944 . 0 0 "[ . 1 . 2]" 1
973 1 81 LEU H 1 81 LEU MD2 . . 4.230 3.767 3.613 3.955 . 0 0 "[ . 1 . 2]" 1
974 1 80 VAL HB 1 81 LEU MD2 . . 4.980 4.635 4.412 4.920 . 0 0 "[ . 1 . 2]" 1
975 1 81 LEU MD2 1 84 ILE HG12 . . 3.470 3.377 3.301 3.462 . 0 0 "[ . 1 . 2]" 1
976 1 81 LEU HB3 1 81 LEU MD2 . . 3.260 2.318 2.148 2.352 . 0 0 "[ . 1 . 2]" 1
977 1 77 LYS HG2 1 81 LEU MD2 . . 4.570 4.413 4.178 4.568 . 0 0 "[ . 1 . 2]" 1
978 1 80 VAL MG1 1 81 LEU HA . . 3.970 3.748 3.614 3.935 . 0 0 "[ . 1 . 2]" 1
979 1 80 VAL MG1 1 83 LEU HB2 . . 3.990 3.848 3.646 3.982 . 0 0 "[ . 1 . 2]" 1
980 1 80 VAL MG1 1 84 ILE HG12 . . 4.200 4.127 3.959 4.200 . 0 0 "[ . 1 . 2]" 1
981 1 37 ILE HG13 1 80 VAL MG1 . . 4.640 4.568 4.352 4.641 0.001 10 0 "[ . 1 . 2]" 1
982 1 80 VAL MG1 1 81 LEU H . . 4.490 3.510 3.325 3.652 . 0 0 "[ . 1 . 2]" 1
983 1 55 PRO QG 1 58 THR MG . . 4.330 3.339 1.956 4.360 0.030 15 0 "[ . 1 . 2]" 1
984 1 67 THR H 1 67 THR MG . . 4.240 3.168 3.101 3.256 . 0 0 "[ . 1 . 2]" 1
985 1 67 THR MG 1 68 GLY H . . 3.920 3.245 3.161 3.364 . 0 0 "[ . 1 . 2]" 1
986 1 16 VAL HA 1 67 THR MG . . 4.030 2.812 2.605 3.018 . 0 0 "[ . 1 . 2]" 1
987 1 14 ASN QB 1 67 THR MG . . 4.260 3.695 3.404 3.920 . 0 0 "[ . 1 . 2]" 1
988 1 16 VAL HB 1 67 THR MG . . 3.810 1.977 1.965 2.027 . 0 0 "[ . 1 . 2]" 1
989 1 47 LYS QD 1 67 THR MG . . 5.030 4.776 4.405 5.045 0.015 10 0 "[ . 1 . 2]" 1
990 1 65 ARG HB3 1 67 THR MG . . 5.250 4.352 4.079 4.564 . 0 0 "[ . 1 . 2]" 1
991 1 16 VAL MG1 1 67 THR MG . . 3.400 3.356 3.309 3.412 0.012 9 0 "[ . 1 . 2]" 1
992 1 16 VAL MG2 1 67 THR MG . . 3.350 1.782 1.672 1.939 . 0 0 "[ . 1 . 2]" 1
993 1 29 VAL MG2 1 37 ILE HA . . 4.780 3.125 2.838 3.482 . 0 0 "[ . 1 . 2]" 1
994 1 29 VAL MG2 1 30 ILE HA . . 4.250 3.602 3.285 3.827 . 0 0 "[ . 1 . 2]" 1
995 1 29 VAL MG2 1 37 ILE HB . . 4.320 2.666 2.300 3.042 . 0 0 "[ . 1 . 2]" 1
996 1 29 VAL MG2 1 30 ILE HG12 . . 4.050 3.820 3.473 4.048 . 0 0 "[ . 1 . 2]" 1
997 1 29 VAL MG2 1 37 ILE HG12 . . 5.070 4.718 4.458 5.024 . 0 0 "[ . 1 . 2]" 1
998 1 73 VAL H 1 73 VAL MG1 . . 4.090 3.768 3.745 3.781 . 0 0 "[ . 1 . 2]" 1
999 1 73 VAL MG1 1 74 GLN HA . . 4.030 3.262 3.004 3.485 . 0 0 "[ . 1 . 2]" 1
1000 1 17 GLN HG2 1 73 VAL MG1 . . 3.810 2.556 2.041 3.795 . 0 0 "[ . 1 . 2]" 1
1001 1 17 GLN HG3 1 73 VAL MG1 . . 3.810 2.645 2.144 3.845 0.035 19 0 "[ . 1 . 2]" 1
1002 1 66 ILE HB 1 73 VAL MG1 . . 3.480 2.540 2.183 2.876 . 0 0 "[ . 1 . 2]" 1
1003 1 17 GLN HB2 1 73 VAL MG1 . . 3.290 1.878 1.784 1.992 . 0 0 "[ . 1 . 2]" 1
1004 1 73 VAL MG1 1 76 ALA MB . . 4.310 3.944 3.708 4.163 . 0 0 "[ . 1 . 2]" 1
1005 1 68 GLY H 1 73 VAL MG1 . . 5.040 4.534 4.233 4.823 . 0 0 "[ . 1 . 2]" 1
1006 1 67 THR HA 1 73 VAL MG1 . . 4.920 3.738 3.446 3.968 . 0 0 "[ . 1 . 2]" 1
1007 1 70 PRO HA 1 73 VAL MG1 . . 4.490 4.334 4.079 4.488 . 0 0 "[ . 1 . 2]" 1
1008 1 15 ALA MB 1 68 GLY H . . 4.900 3.889 3.723 4.088 . 0 0 "[ . 1 . 2]" 1
1009 1 15 ALA MB 1 71 TYR H . . 5.500 4.207 4.096 4.352 . 0 0 "[ . 1 . 2]" 1
1010 1 15 ALA MB 1 70 PRO HD3 . . 3.980 2.381 2.013 2.849 . 0 0 "[ . 1 . 2]" 1
1011 1 15 ALA MB 1 73 VAL HB . . 3.370 2.682 2.556 2.819 . 0 0 "[ . 1 . 2]" 1
1012 1 48 MET H 1 49 VAL MG2 . . 4.860 3.850 3.655 4.021 . 0 0 "[ . 1 . 2]" 1
1013 1 16 VAL MG1 1 67 THR HA . . 4.780 4.525 4.393 4.619 . 0 0 "[ . 1 . 2]" 1
1014 1 16 VAL MG1 1 17 GLN HA . . 5.500 3.730 3.506 3.902 . 0 0 "[ . 1 . 2]" 1
1015 1 49 VAL H 1 49 VAL MG2 . . 4.040 2.913 2.725 3.091 . 0 0 "[ . 1 . 2]" 1
1016 1 49 VAL MG1 1 65 ARG H . . 4.450 4.212 4.043 4.412 . 0 0 "[ . 1 . 2]" 1
1017 1 49 VAL MG1 1 51 ILE HA . . 4.920 3.839 3.674 3.952 . 0 0 "[ . 1 . 2]" 1
1018 1 47 LYS QD 1 49 VAL MG2 . . 3.960 3.143 2.331 3.653 . 0 0 "[ . 1 . 2]" 1
1019 1 44 ALA MB 1 76 ALA H . . 4.360 2.978 2.668 3.380 . 0 0 "[ . 1 . 2]" 1
1020 1 44 ALA MB 1 46 VAL HB . . 5.240 4.611 4.454 4.841 . 0 0 "[ . 1 . 2]" 1
1021 1 44 ALA MB 1 48 MET HG3 . . 5.500 4.945 4.521 5.282 . 0 0 "[ . 1 . 2]" 1
1022 1 44 ALA MB 1 72 LYS HB3 . . 4.320 3.510 2.956 4.134 . 0 0 "[ . 1 . 2]" 1
1023 1 44 ALA MB 1 48 MET ME . . 4.040 2.993 2.660 3.318 . 0 0 "[ . 1 . 2]" 1
1024 1 44 ALA HA 1 45 GLY QA . . 4.610 4.257 4.233 4.273 . 0 0 "[ . 1 . 2]" 1
1025 1 44 ALA HA 1 46 VAL MG2 . . 5.110 4.440 4.045 4.836 . 0 0 "[ . 1 . 2]" 1
1026 1 16 VAL MG2 1 65 ARG HB3 . . 4.150 4.020 3.886 4.138 . 0 0 "[ . 1 . 2]" 1
1027 1 16 VAL MG2 1 66 ILE H . . 5.500 3.083 2.744 3.409 . 0 0 "[ . 1 . 2]" 1
1028 1 16 VAL MG2 1 17 GLN HA . . 4.400 3.885 3.695 4.164 . 0 0 "[ . 1 . 2]" 1
1029 1 16 VAL MG2 1 65 ARG HG2 . . 3.580 2.061 1.930 2.252 . 0 0 "[ . 1 . 2]" 1
1030 1 60 ALA HA 1 61 ASP H . . 3.190 2.390 2.155 2.877 . 0 0 "[ . 1 . 2]" 1
1031 1 60 ALA MB 1 61 ASP H . . 3.650 3.276 2.019 3.661 0.011 16 0 "[ . 1 . 2]" 1
1032 1 76 ALA H 1 76 ALA MB . . 3.150 2.090 2.026 2.231 . 0 0 "[ . 1 . 2]" 1
1033 1 76 ALA MB 1 77 LYS H . . 3.340 2.581 2.260 3.098 . 0 0 "[ . 1 . 2]" 1
1034 1 75 GLN H 1 76 ALA MB . . 4.810 4.223 4.069 4.393 . 0 0 "[ . 1 . 2]" 1
1035 1 76 ALA MB 1 77 LYS HA . . 5.180 3.703 3.592 3.926 . 0 0 "[ . 1 . 2]" 1
1036 1 48 MET HG3 1 76 ALA MB . . 4.900 3.804 3.477 4.026 . 0 0 "[ . 1 . 2]" 1
1037 1 46 VAL MG2 1 76 ALA MB . . 3.330 1.849 1.706 2.054 . 0 0 "[ . 1 . 2]" 1
1038 1 66 ILE MG 1 67 THR H . . 3.700 3.057 2.847 3.224 . 0 0 "[ . 1 . 2]" 1
1039 1 49 VAL H 1 66 ILE MG . . 5.320 4.791 4.522 4.975 . 0 0 "[ . 1 . 2]" 1
1040 1 66 ILE MG 1 76 ALA H . . 5.500 4.423 4.191 4.643 . 0 0 "[ . 1 . 2]" 1
1041 1 47 LYS H 1 66 ILE MG . . 4.430 3.863 3.642 4.308 . 0 0 "[ . 1 . 2]" 1
1042 1 46 VAL HB 1 66 ILE MG . . 3.560 2.636 2.455 2.809 . 0 0 "[ . 1 . 2]" 1
1043 1 66 ILE HG12 1 66 ILE MG . . 3.480 2.433 2.345 2.535 . 0 0 "[ . 1 . 2]" 1
1044 1 66 ILE MD 1 66 ILE MG . . 2.780 1.984 1.904 2.093 . 0 0 "[ . 1 . 2]" 1
1045 1 66 ILE MG 1 73 VAL MG1 . . 3.040 2.232 1.909 2.521 . 0 0 "[ . 1 . 2]" 1
1046 1 48 MET HA 1 66 ILE MG . . 4.900 3.396 3.101 3.656 . 0 0 "[ . 1 . 2]" 1
1047 1 66 ILE HA 1 66 ILE MG . . 3.510 2.415 2.303 2.476 . 0 0 "[ . 1 . 2]" 1
1048 1 48 MET HG2 1 66 ILE MG . . 3.620 2.880 2.536 3.291 . 0 0 "[ . 1 . 2]" 1
1049 1 66 ILE MG 1 76 ALA MB . . 3.240 2.365 2.156 2.510 . 0 0 "[ . 1 . 2]" 1
1050 1 21 ILE HA 1 22 PRO HD3 . . 3.070 2.280 2.254 2.317 . 0 0 "[ . 1 . 2]" 1
1051 1 22 PRO HD3 1 84 ILE MD . . 3.490 2.278 1.920 2.810 . 0 0 "[ . 1 . 2]" 1
1052 1 21 ILE MD 1 22 PRO HD3 . . 4.430 3.941 3.782 4.082 . 0 0 "[ . 1 . 2]" 1
1053 1 21 ILE HA 1 22 PRO HD2 . . 3.240 2.053 1.983 2.143 . 0 0 "[ . 1 . 2]" 1
1054 1 22 PRO HD2 1 25 LYS HB2 . . 3.600 3.072 2.798 3.302 . 0 0 "[ . 1 . 2]" 1
1055 1 22 PRO HD2 1 25 LYS HG3 . . 4.370 4.018 3.619 4.371 0.001 11 0 "[ . 1 . 2]" 1
1056 1 21 ILE MG 1 22 PRO HD2 . . 3.480 2.045 1.802 2.276 . 0 0 "[ . 1 . 2]" 1
1057 1 21 ILE MD 1 22 PRO HD2 . . 4.690 3.382 3.262 3.552 . 0 0 "[ . 1 . 2]" 1
1058 1 46 VAL MG2 1 47 LYS H . . 4.010 3.477 3.265 3.657 . 0 0 "[ . 1 . 2]" 1
1059 1 45 GLY QA 1 46 VAL MG2 . . 4.280 4.156 3.914 4.277 . 0 0 "[ . 1 . 2]" 1
1060 1 46 VAL MG2 1 48 MET HG2 . . 3.990 3.801 3.556 3.990 . 0 0 "[ . 1 . 2]" 1
1061 1 44 ALA MB 1 46 VAL MG2 . . 2.980 2.062 1.902 2.395 . 0 0 "[ . 1 . 2]" 1
1062 1 46 VAL MG2 1 66 ILE MG . . 3.270 2.033 1.832 2.237 . 0 0 "[ . 1 . 2]" 1
1063 1 51 ILE HB 1 63 PRO HD2 . . 3.850 3.858 3.843 3.872 0.022 13 0 "[ . 1 . 2]" 1
1064 1 62 LYS HA 1 63 PRO HD3 . . 2.930 2.347 2.273 2.491 . 0 0 "[ . 1 . 2]" 1
1065 1 69 ASP HA 1 70 PRO HD2 . . 2.840 2.440 2.217 2.531 . 0 0 "[ . 1 . 2]" 1
1066 1 15 ALA MB 1 70 PRO HD2 . . 4.080 3.569 3.273 4.017 . 0 0 "[ . 1 . 2]" 1
1067 1 41 GLN H 1 48 MET ME . . 4.970 4.274 3.806 4.566 . 0 0 "[ . 1 . 2]" 1
1068 1 37 ILE HA 1 48 MET ME . . 4.870 4.764 4.606 4.868 . 0 0 "[ . 1 . 2]" 1
1069 1 40 LEU HA 1 48 MET ME . . 4.180 3.948 3.785 4.133 . 0 0 "[ . 1 . 2]" 1
1070 1 41 GLN HA 1 48 MET ME . . 4.040 3.249 2.829 3.556 . 0 0 "[ . 1 . 2]" 1
1071 1 48 MET ME 1 76 ALA MB . . 3.140 2.002 1.799 2.125 . 0 0 "[ . 1 . 2]" 1
1072 1 40 LEU HB3 1 48 MET ME . . 3.630 2.038 1.950 2.194 . 0 0 "[ . 1 . 2]" 1
1073 1 48 MET ME 1 80 VAL MG2 . . 2.750 1.967 1.805 2.306 . 0 0 "[ . 1 . 2]" 1
1074 1 46 VAL MG2 1 48 MET ME . . 3.350 2.642 2.377 2.816 . 0 0 "[ . 1 . 2]" 1
1075 1 23 ALA H 1 23 ALA MB . . 3.300 2.210 2.135 2.261 . 0 0 "[ . 1 . 2]" 1
1076 1 26 ALA MB 1 27 GLY H . . 4.650 2.616 2.087 3.267 . 0 0 "[ . 1 . 2]" 1
1077 1 25 LYS H 1 26 ALA MB . . 4.600 3.999 3.828 4.101 . 0 0 "[ . 1 . 2]" 1
1078 1 26 ALA H 1 26 ALA MB . . 3.210 2.203 2.027 2.238 . 0 0 "[ . 1 . 2]" 1
1079 1 23 ALA MB 1 24 SER HA . . 4.310 3.869 3.770 3.969 . 0 0 "[ . 1 . 2]" 1
1080 1 23 ALA MB 1 62 LYS HE2 . . 4.190 3.375 2.163 4.140 . 0 0 "[ . 1 . 2]" 1
1081 1 23 ALA MB 1 62 LYS HE3 . . 4.190 2.961 2.154 4.192 0.002 1 0 "[ . 1 . 2]" 1
1082 1 21 ILE HB 1 26 ALA MB . . 4.280 3.552 3.293 3.793 . 0 0 "[ . 1 . 2]" 1
1083 1 19 ILE MG 1 21 ILE MD . . 3.910 3.778 3.656 3.892 . 0 0 "[ . 1 . 2]" 1
1084 1 30 ILE MG 1 34 GLY H . . 3.680 2.308 1.869 3.133 . 0 0 "[ . 1 . 2]" 1
1085 1 30 ILE MG 1 31 GLY H . . 3.660 3.382 3.075 3.618 . 0 0 "[ . 1 . 2]" 1
1086 1 30 ILE MG 1 34 GLY HA3 . . 3.570 3.129 2.683 3.499 . 0 0 "[ . 1 . 2]" 1
1087 1 30 ILE HA 1 30 ILE MG . . 3.510 2.382 2.231 2.472 . 0 0 "[ . 1 . 2]" 1
1088 1 30 ILE MG 1 37 ILE HB . . 4.560 3.831 3.497 4.144 . 0 0 "[ . 1 . 2]" 1
1089 1 30 ILE HG12 1 30 ILE MG . . 3.720 2.389 2.281 2.479 . 0 0 "[ . 1 . 2]" 1
1090 1 84 ILE MG 1 85 ARG H . . 4.590 3.991 3.801 4.062 . 0 0 "[ . 1 . 2]" 1
1091 1 81 LEU HA 1 84 ILE MG . . 4.660 3.677 3.475 3.934 . 0 0 "[ . 1 . 2]" 1
1092 1 11 GLY QA 1 12 PRO QD . . 2.830 1.973 1.874 2.115 . 0 0 "[ . 1 . 2]" 1
1093 1 90 GLY QA 1 91 PRO QD . . 3.060 1.989 1.905 2.281 . 0 0 "[ . 1 . 2]" 1
1094 1 44 ALA H 1 79 MET ME . . 4.820 2.888 2.348 3.233 . 0 0 "[ . 1 . 2]" 1
1095 1 44 ALA HA 1 79 MET ME . . 3.980 3.472 2.663 3.915 . 0 0 "[ . 1 . 2]" 1
1096 1 76 ALA HA 1 79 MET ME . . 3.710 2.732 1.975 3.406 . 0 0 "[ . 1 . 2]" 1
1097 1 43 ARG QD 1 79 MET ME . . 4.500 3.186 2.430 3.967 . 0 0 "[ . 1 . 2]" 1
1098 1 79 MET ME 1 79 MET HG3 . . 3.900 2.989 2.459 3.401 . 0 0 "[ . 1 . 2]" 1
1099 1 44 ALA MB 1 79 MET ME . . 3.580 2.107 1.806 2.533 . 0 0 "[ . 1 . 2]" 1
1100 1 76 ALA MB 1 79 MET ME . . 3.640 3.098 2.753 3.595 . 0 0 "[ . 1 . 2]" 1
1101 1 40 LEU HB3 1 79 MET ME . . 5.500 3.008 2.510 3.495 . 0 0 "[ . 1 . 2]" 1
1102 1 79 MET ME 1 80 VAL MG2 . . 3.840 3.704 3.478 3.816 . 0 0 "[ . 1 . 2]" 1
1103 1 51 ILE MG 1 52 GLN H . . 4.140 2.525 2.042 3.043 . 0 0 "[ . 1 . 2]" 1
1104 1 51 ILE MG 1 63 PRO HD2 . . 4.610 4.343 4.101 4.596 . 0 0 "[ . 1 . 2]" 1
1105 1 51 ILE MG 1 63 PRO HG2 . . 4.130 2.884 2.551 3.188 . 0 0 "[ . 1 . 2]" 1
1106 1 51 ILE HG13 1 51 ILE MG . . 3.320 2.363 2.210 2.581 . 0 0 "[ . 1 . 2]" 1
1107 1 50 MET HA 1 50 MET ME . . 4.290 4.175 4.017 4.247 . 0 0 "[ . 1 . 2]" 1
1108 1 50 MET ME 1 50 MET QG . . 3.160 2.172 2.121 2.232 . 0 0 "[ . 1 . 2]" 1
1109 1 21 ILE MG 1 50 MET ME . . 3.050 2.155 1.882 2.932 . 0 0 "[ . 1 . 2]" 1
1110 1 50 MET ME 1 64 LEU MD2 . . 3.380 2.435 2.071 2.701 . 0 0 "[ . 1 . 2]" 1
1111 1 21 ILE MD 1 50 MET ME . . 3.740 3.165 2.720 3.686 . 0 0 "[ . 1 . 2]" 1
1112 1 20 MET ME 1 21 ILE H . . 5.090 4.205 2.507 4.820 . 0 0 "[ . 1 . 2]" 1
1113 1 50 MET H 1 50 MET ME . . 5.500 4.882 4.514 5.135 . 0 0 "[ . 1 . 2]" 1
1114 1 20 MET ME 1 62 LYS H . . 5.500 4.527 2.939 5.484 . 0 0 "[ . 1 . 2]" 1
1115 1 20 MET H 1 20 MET ME . . 4.780 4.490 3.889 4.782 0.002 9 0 "[ . 1 . 2]" 1
1116 1 50 MET ME 1 64 LEU HA . . 4.690 4.439 4.008 4.660 . 0 0 "[ . 1 . 2]" 1
1117 1 20 MET ME 1 20 MET HG2 . . 3.860 2.982 2.148 3.395 . 0 0 "[ . 1 . 2]" 1
1118 1 35 GLU H 1 37 ILE MG . . 5.160 3.566 3.370 3.868 . 0 0 "[ . 1 . 2]" 1
1119 1 36 THR H 1 37 ILE MG . . 5.500 3.382 3.143 3.761 . 0 0 "[ . 1 . 2]" 1
1120 1 37 ILE H 1 37 ILE MG . . 3.140 1.969 1.876 2.244 . 0 0 "[ . 1 . 2]" 1
1121 1 37 ILE MG 1 38 LYS H . . 3.210 2.115 1.863 2.355 . 0 0 "[ . 1 . 2]" 1
1122 1 37 ILE MG 1 41 GLN QE . . 4.300 3.571 3.232 3.878 . 0 0 "[ . 1 . 2]" 1
1123 1 37 ILE MG 1 38 LYS HA . . 4.050 3.416 3.189 3.593 . 0 0 "[ . 1 . 2]" 1
1124 1 30 ILE HA 1 37 ILE MG . . 3.600 2.022 1.887 2.342 . 0 0 "[ . 1 . 2]" 1
1125 1 37 ILE MG 1 38 LYS QB . . 4.060 3.160 2.968 3.300 . 0 0 "[ . 1 . 2]" 1
1126 1 30 ILE HG12 1 37 ILE MG . . 3.770 2.878 2.373 3.256 . 0 0 "[ . 1 . 2]" 1
1127 1 37 ILE HG12 1 37 ILE MG . . 3.740 2.335 2.219 2.483 . 0 0 "[ . 1 . 2]" 1
1128 1 30 ILE MD 1 37 ILE MG . . 4.040 3.846 3.492 4.035 . 0 0 "[ . 1 . 2]" 1
1129 1 21 ILE H 1 21 ILE MG . . 4.630 3.910 3.871 3.939 . 0 0 "[ . 1 . 2]" 1
1130 1 21 ILE MG 1 22 PRO HD3 . . 4.180 3.368 3.134 3.562 . 0 0 "[ . 1 . 2]" 1
1131 1 21 ILE HG12 1 21 ILE MG . . 3.540 3.195 3.180 3.202 . 0 0 "[ . 1 . 2]" 1
1132 1 21 ILE MG 1 26 ALA MB . . 3.540 2.976 2.592 3.191 . 0 0 "[ . 1 . 2]" 1
1133 1 48 MET HG2 1 66 ILE HG12 . . 3.490 2.130 2.000 2.261 . 0 0 "[ . 1 . 2]" 1
1134 1 66 ILE MG 1 73 VAL MG2 . . 2.980 2.501 2.126 2.857 . 0 0 "[ . 1 . 2]" 1
1135 1 71 TYR QE 1 75 GLN HG3 . . 4.880 3.768 3.197 4.270 . 0 0 "[ . 1 . 2]" 1
1136 1 71 TYR QE 1 75 GLN HG2 . . 4.880 4.341 3.679 4.808 . 0 0 "[ . 1 . 2]" 1
1137 1 50 MET HA 1 51 ILE H . . 3.210 2.152 2.141 2.184 . 0 0 "[ . 1 . 2]" 1
1138 1 50 MET HB2 1 51 ILE H . . 5.240 4.345 4.143 4.438 . 0 0 "[ . 1 . 2]" 1
1139 1 65 ARG HB2 1 66 ILE H . . 5.310 4.409 4.331 4.496 . 0 0 "[ . 1 . 2]" 1
1140 1 65 ARG HB3 1 66 ILE H . . 4.880 4.131 3.992 4.273 . 0 0 "[ . 1 . 2]" 1
1141 1 51 ILE H 1 65 ARG HB2 . . 5.340 4.449 4.304 4.684 . 0 0 "[ . 1 . 2]" 1
1142 1 49 VAL HA 1 50 MET QG . . 5.420 4.304 4.058 5.226 . 0 0 "[ . 1 . 2]" 1
1143 1 48 MET HA 1 49 VAL HA . . 5.370 4.396 4.392 4.408 . 0 0 "[ . 1 . 2]" 1
1144 1 49 VAL HA 1 50 MET HA . . 4.640 4.402 4.381 4.418 . 0 0 "[ . 1 . 2]" 1
1145 1 48 MET HA 1 49 VAL HB . . 5.500 4.615 4.535 4.687 . 0 0 "[ . 1 . 2]" 1
1146 1 48 MET HB3 1 66 ILE MG . . 5.140 4.786 4.405 5.140 . 0 0 "[ . 1 . 2]" 1
1147 1 48 MET HB3 1 80 VAL MG2 . . 5.370 4.287 4.121 4.698 . 0 0 "[ . 1 . 2]" 1
1148 1 41 GLN HG2 1 48 MET HB3 . . 5.370 4.379 4.238 4.671 . 0 0 "[ . 1 . 2]" 1
1149 1 41 GLN QE 1 48 MET HB3 . . 5.500 3.998 3.628 4.274 . 0 0 "[ . 1 . 2]" 1
1150 1 41 GLN QE 1 48 MET HB2 . . 5.500 2.653 2.274 3.027 . 0 0 "[ . 1 . 2]" 1
1151 1 48 MET HB2 1 49 VAL H . . 5.070 4.422 4.338 4.473 . 0 0 "[ . 1 . 2]" 1
1152 1 47 LYS HA 1 48 MET HB2 . . 4.890 4.387 4.328 4.457 . 0 0 "[ . 1 . 2]" 1
1153 1 41 GLN HG3 1 48 MET HB3 . . 4.810 4.540 4.343 4.737 . 0 0 "[ . 1 . 2]" 1
1154 1 48 MET HB2 1 49 VAL MG2 . . 5.500 4.887 4.724 4.977 . 0 0 "[ . 1 . 2]" 1
1155 1 48 MET HB2 1 66 ILE MG . . 5.500 4.954 4.682 5.331 . 0 0 "[ . 1 . 2]" 1
1156 1 48 MET HB2 1 80 VAL MG2 . . 5.500 4.921 4.719 5.194 . 0 0 "[ . 1 . 2]" 1
1157 1 46 VAL MG2 1 48 MET HB2 . . 5.500 4.814 4.597 5.115 . 0 0 "[ . 1 . 2]" 1
1158 1 48 MET HG2 1 67 THR H . . 5.490 5.393 5.184 5.491 0.001 19 0 "[ . 1 . 2]" 1
1159 1 48 MET HG3 1 67 THR H . . 5.500 5.345 5.163 5.468 . 0 0 "[ . 1 . 2]" 1
1160 1 47 LYS HA 1 48 MET HG3 . . 4.470 4.221 4.086 4.386 . 0 0 "[ . 1 . 2]" 1
1161 1 47 LYS HB2 1 67 THR H . . 4.920 4.657 4.501 4.924 0.004 8 0 "[ . 1 . 2]" 1
1162 1 47 LYS HB3 1 67 THR MG . . 4.980 4.449 4.268 4.581 . 0 0 "[ . 1 . 2]" 1
1163 1 47 LYS HB2 1 67 THR MG . . 5.500 5.454 5.318 5.519 0.019 14 0 "[ . 1 . 2]" 1
1164 1 47 LYS HB3 1 49 VAL MG2 . . 5.100 3.507 3.314 3.818 . 0 0 "[ . 1 . 2]" 1
1165 1 46 VAL HB 1 68 GLY HA2 . . 4.940 4.300 3.990 4.555 . 0 0 "[ . 1 . 2]" 1
1166 1 45 GLY H 1 46 VAL MG1 . . 5.500 4.312 3.942 4.598 . 0 0 "[ . 1 . 2]" 1
1167 1 41 GLN HG2 1 46 VAL MG2 . . 5.420 3.792 3.444 4.222 . 0 0 "[ . 1 . 2]" 1
1168 1 46 VAL MG2 1 68 GLY HA3 . . 5.500 4.303 4.077 4.430 . 0 0 "[ . 1 . 2]" 1
1169 1 46 VAL MG2 1 48 MET HA . . 5.500 4.496 4.261 4.626 . 0 0 "[ . 1 . 2]" 1
1170 1 41 GLN H 1 46 VAL MG2 . . 5.500 5.246 4.962 5.472 . 0 0 "[ . 1 . 2]" 1
1171 1 46 VAL MG2 1 76 ALA H . . 5.400 3.699 3.323 3.945 . 0 0 "[ . 1 . 2]" 1
1172 1 46 VAL MG2 1 67 THR H . . 5.460 4.782 4.542 4.961 . 0 0 "[ . 1 . 2]" 1
1173 1 44 ALA MB 1 45 GLY QA . . 5.000 3.965 3.867 4.156 . 0 0 "[ . 1 . 2]" 1
1174 1 44 ALA HA 1 46 VAL H . . 5.500 4.937 4.267 5.405 . 0 0 "[ . 1 . 2]" 1
1175 1 42 GLU HA 1 44 ALA MB . . 5.500 5.397 5.289 5.500 0.000 5 0 "[ . 1 . 2]" 1
1176 1 43 ARG HA 1 44 ALA MB . . 5.500 4.901 4.853 4.970 . 0 0 "[ . 1 . 2]" 1
1177 1 82 GLU H 1 85 ARG HB2 . . 5.280 4.706 4.406 4.900 . 0 0 "[ . 1 . 2]" 1
1178 1 43 ARG HG2 1 44 ALA H . . 5.200 5.016 4.610 5.202 0.002 7 0 "[ . 1 . 2]" 1
1179 1 43 ARG H 1 43 ARG QD . . 5.300 3.892 1.868 4.456 . 0 0 "[ . 1 . 2]" 1
1180 1 43 ARG QD 1 44 ALA H . . 5.500 4.937 4.126 5.209 . 0 0 "[ . 1 . 2]" 1
1181 1 41 GLN HA 1 41 GLN QE . . 5.500 4.808 4.742 4.909 . 0 0 "[ . 1 . 2]" 1
1182 1 41 GLN HA 1 45 GLY H . . 5.100 3.839 3.506 4.633 . 0 0 "[ . 1 . 2]" 1
1183 1 41 GLN HA 1 48 MET H . . 5.100 4.282 4.073 4.448 . 0 0 "[ . 1 . 2]" 1
1184 1 41 GLN HA 1 43 ARG H . . 5.500 4.669 4.441 5.007 . 0 0 "[ . 1 . 2]" 1
1185 1 41 GLN HA 1 47 LYS HA . . 5.390 4.138 3.731 4.349 . 0 0 "[ . 1 . 2]" 1
1186 1 40 LEU HB2 1 41 GLN HA . . 4.960 4.575 4.441 4.711 . 0 0 "[ . 1 . 2]" 1
1187 1 41 GLN HA 1 79 MET ME . . 5.490 4.891 4.499 5.397 . 0 0 "[ . 1 . 2]" 1
1188 1 41 GLN HA 1 46 VAL MG1 . . 5.500 5.125 4.915 5.340 . 0 0 "[ . 1 . 2]" 1
1189 1 41 GLN QB 1 46 VAL MG2 . . 4.920 4.183 3.933 4.508 . 0 0 "[ . 1 . 2]" 1
1190 1 41 GLN QB 1 48 MET HB2 . . 4.700 4.579 4.500 4.709 0.009 2 0 "[ . 1 . 2]" 1
1191 1 41 GLN QB 1 47 LYS HB2 . . 5.500 5.016 4.699 5.240 . 0 0 "[ . 1 . 2]" 1
1192 1 41 GLN QB 1 48 MET ME . . 5.500 4.825 4.451 5.017 . 0 0 "[ . 1 . 2]" 1
1193 1 37 ILE HG13 1 41 GLN HG2 . . 5.270 5.002 4.714 5.259 . 0 0 "[ . 1 . 2]" 1
1194 1 40 LEU HB2 1 41 GLN HG2 . . 5.500 5.015 4.775 5.261 . 0 0 "[ . 1 . 2]" 1
1195 1 38 LYS HA 1 41 GLN HG2 . . 4.610 4.548 4.413 4.608 . 0 0 "[ . 1 . 2]" 1
1196 1 41 GLN HG2 1 47 LYS HA . . 4.680 2.493 2.197 2.686 . 0 0 "[ . 1 . 2]" 1
1197 1 41 GLN HG3 1 46 VAL MG2 . . 5.500 4.916 4.654 5.305 . 0 0 "[ . 1 . 2]" 1
1198 1 38 LYS HG2 1 41 GLN HG3 . . 5.500 5.265 4.696 5.494 . 0 0 "[ . 1 . 2]" 1
1199 1 39 GLN H 1 40 LEU MD1 . . 5.500 5.061 4.876 5.275 . 0 0 "[ . 1 . 2]" 1
1200 1 40 LEU MD2 1 80 VAL H . . 5.290 4.606 4.353 4.907 . 0 0 "[ . 1 . 2]" 1
1201 1 39 GLN HB2 1 40 LEU MD2 . . 5.500 4.873 4.490 5.251 . 0 0 "[ . 1 . 2]" 1
1202 1 39 GLN HB3 1 40 LEU MD2 . . 5.500 4.927 4.474 5.446 . 0 0 "[ . 1 . 2]" 1
1203 1 36 THR MG 1 39 GLN HB3 . . 5.200 4.899 4.247 5.163 . 0 0 "[ . 1 . 2]" 1
1204 1 39 GLN HG2 1 40 LEU H . . 5.500 4.692 2.241 5.137 . 0 0 "[ . 1 . 2]" 1
1205 1 39 GLN HG3 1 40 LEU H . . 5.500 4.890 3.120 5.307 . 0 0 "[ . 1 . 2]" 1
1206 1 35 GLU H 1 38 LYS QB . . 5.500 4.522 4.421 4.726 . 0 0 "[ . 1 . 2]" 1
1207 1 36 THR H 1 38 LYS QB . . 5.500 4.537 4.411 4.677 . 0 0 "[ . 1 . 2]" 1
1208 1 38 LYS QB 1 40 LEU H . . 4.970 4.583 4.507 4.685 . 0 0 "[ . 1 . 2]" 1
1209 1 38 LYS H 1 38 LYS HG2 . . 4.800 4.529 4.435 4.619 . 0 0 "[ . 1 . 2]" 1
1210 1 38 LYS HG2 1 39 GLN H . . 5.230 4.219 3.734 4.564 . 0 0 "[ . 1 . 2]" 1
1211 1 38 LYS HG3 1 39 GLN H . . 5.230 4.939 4.711 5.209 . 0 0 "[ . 1 . 2]" 1
1212 1 38 LYS HG3 1 41 GLN HG3 . . 5.500 4.986 4.638 5.453 . 0 0 "[ . 1 . 2]" 1
1213 1 38 LYS QD 1 41 GLN QE . . 5.500 5.021 4.665 5.364 . 0 0 "[ . 1 . 2]" 1
1214 1 38 LYS H 1 38 LYS QD . . 5.100 4.408 4.268 4.700 . 0 0 "[ . 1 . 2]" 1
1215 1 38 LYS QD 1 39 GLN H . . 5.160 4.785 4.474 5.119 . 0 0 "[ . 1 . 2]" 1
1216 1 37 ILE HA 1 48 MET HB3 . . 5.500 5.215 4.921 5.353 . 0 0 "[ . 1 . 2]" 1
1217 1 37 ILE HA 1 41 GLN QE . . 5.500 5.190 4.875 5.439 . 0 0 "[ . 1 . 2]" 1
1218 1 36 THR H 1 37 ILE HB . . 5.500 5.197 4.914 5.478 . 0 0 "[ . 1 . 2]" 1
1219 1 37 ILE HB 1 50 MET ME . . 4.410 4.091 3.057 4.391 . 0 0 "[ . 1 . 2]" 1
1220 1 37 ILE HG13 1 41 GLN HG3 . . 5.240 4.185 3.990 4.462 . 0 0 "[ . 1 . 2]" 1
1221 1 30 ILE HA 1 37 ILE HG13 . . 5.460 4.706 4.487 4.975 . 0 0 "[ . 1 . 2]" 1
1222 1 37 ILE H 1 37 ILE HG13 . . 4.760 4.476 4.427 4.517 . 0 0 "[ . 1 . 2]" 1
1223 1 37 ILE HG13 1 41 GLN H . . 5.460 5.212 4.966 5.451 . 0 0 "[ . 1 . 2]" 1
1224 1 37 ILE HG13 1 38 LYS H . . 5.120 4.650 4.359 4.827 . 0 0 "[ . 1 . 2]" 1
1225 1 37 ILE HG12 1 39 GLN H . . 5.500 5.303 4.973 5.492 . 0 0 "[ . 1 . 2]" 1
1226 1 37 ILE HG12 1 41 GLN H . . 5.500 4.797 4.452 5.198 . 0 0 "[ . 1 . 2]" 1
1227 1 37 ILE HG12 1 38 LYS H . . 4.830 3.645 3.188 3.995 . 0 0 "[ . 1 . 2]" 1
1228 1 37 ILE HG12 1 41 GLN QB . . 5.500 5.233 4.923 5.466 . 0 0 "[ . 1 . 2]" 1
1229 1 37 ILE HG12 1 48 MET HG2 . . 5.500 5.031 4.723 5.156 . 0 0 "[ . 1 . 2]" 1
1230 1 37 ILE MD 1 41 GLN HG2 . . 5.500 4.873 4.359 5.125 . 0 0 "[ . 1 . 2]" 1
1231 1 37 ILE MD 1 48 MET HA . . 5.500 3.943 3.726 4.108 . 0 0 "[ . 1 . 2]" 1
1232 1 37 ILE MD 1 49 VAL H . . 5.500 4.070 3.683 4.328 . 0 0 "[ . 1 . 2]" 1
1233 1 37 ILE MD 1 48 MET H . . 5.500 4.221 3.732 4.477 . 0 0 "[ . 1 . 2]" 1
1234 1 37 ILE MD 1 38 LYS H . . 4.850 4.496 3.946 4.851 0.001 13 0 "[ . 1 . 2]" 1
1235 1 36 THR HA 1 40 LEU MD1 . . 5.500 5.067 4.691 5.388 . 0 0 "[ . 1 . 2]" 1
1236 1 36 THR HA 1 38 LYS QB . . 5.070 4.631 4.516 4.850 . 0 0 "[ . 1 . 2]" 1
1237 1 36 THR HA 1 40 LEU HG . . 4.990 4.866 4.650 4.991 0.001 18 0 "[ . 1 . 2]" 1
1238 1 36 THR HA 1 40 LEU H . . 5.380 4.703 4.494 5.055 . 0 0 "[ . 1 . 2]" 1
1239 1 36 THR HA 1 38 LYS H . . 4.730 4.174 3.901 4.681 . 0 0 "[ . 1 . 2]" 1
1240 1 36 THR HB 1 40 LEU MD1 . . 4.810 4.302 3.927 4.548 . 0 0 "[ . 1 . 2]" 1
1241 1 35 GLU QB 1 36 THR HB . . 5.500 4.735 4.427 5.502 0.002 13 0 "[ . 1 . 2]" 1
1242 1 36 THR HB 1 37 ILE HB . . 5.500 4.293 4.116 4.405 . 0 0 "[ . 1 . 2]" 1
1243 1 35 GLU QB 1 36 THR MG . . 5.500 5.111 4.884 5.500 . 0 0 "[ . 1 . 2]" 1
1244 1 36 THR MG 1 37 ILE HB . . 5.500 4.323 3.991 4.526 . 0 0 "[ . 1 . 2]" 1
1245 1 36 THR MG 1 39 GLN HB2 . . 5.200 3.809 3.383 5.186 . 0 0 "[ . 1 . 2]" 1
1246 1 29 VAL H 1 36 THR MG . . 5.500 5.030 4.655 5.361 . 0 0 "[ . 1 . 2]" 1
1247 1 33 GLY QA 1 35 GLU QG . . 5.500 4.464 3.585 5.355 . 0 0 "[ . 1 . 2]" 1
1248 1 33 GLY QA 1 35 GLU H . . 4.610 4.388 4.215 4.579 . 0 0 "[ . 1 . 2]" 1
1249 1 32 LYS HA 1 34 GLY H . . 5.000 4.384 4.013 4.917 . 0 0 "[ . 1 . 2]" 1
1250 1 32 LYS QB 1 35 GLU QG . . 5.000 3.629 2.136 4.930 . 0 0 "[ . 1 . 2]" 1
1251 1 32 LYS QB 1 33 GLY QA . . 4.790 4.043 3.530 4.417 . 0 0 "[ . 1 . 2]" 1
1252 1 32 LYS QB 1 35 GLU H . . 5.450 4.899 4.665 5.398 . 0 0 "[ . 1 . 2]" 1
1253 1 30 ILE MG 1 31 GLY HA2 . . 5.440 4.611 4.393 4.779 . 0 0 "[ . 1 . 2]" 1
1254 1 31 GLY HA2 1 36 THR MG . . 5.500 5.285 4.932 5.451 . 0 0 "[ . 1 . 2]" 1
1255 1 30 ILE HB 1 31 GLY HA2 . . 5.500 4.620 4.436 4.797 . 0 0 "[ . 1 . 2]" 1
1256 1 31 GLY HA2 1 32 LYS QB . . 5.500 4.608 4.243 4.931 . 0 0 "[ . 1 . 2]" 1
1257 1 30 ILE MG 1 31 GLY HA3 . . 5.440 4.060 3.871 4.442 . 0 0 "[ . 1 . 2]" 1
1258 1 31 GLY HA3 1 36 THR MG . . 5.500 4.823 4.550 5.135 . 0 0 "[ . 1 . 2]" 1
1259 1 30 ILE HB 1 31 GLY HA3 . . 5.500 4.759 4.585 4.897 . 0 0 "[ . 1 . 2]" 1
1260 1 31 GLY HA3 1 32 LYS QB . . 5.500 4.454 4.235 4.617 . 0 0 "[ . 1 . 2]" 1
1261 1 29 VAL H 1 30 ILE HB . . 5.340 4.653 4.477 5.077 . 0 0 "[ . 1 . 2]" 1
1262 1 29 VAL H 1 30 ILE HG12 . . 5.500 5.366 4.991 5.501 0.001 1 0 "[ . 1 . 2]" 1
1263 1 30 ILE HG12 1 37 ILE H . . 5.500 4.959 4.544 5.257 . 0 0 "[ . 1 . 2]" 1
1264 1 30 ILE HG13 1 50 MET QG . . 4.730 3.681 3.181 4.380 . 0 0 "[ . 1 . 2]" 1
1265 1 30 ILE HG13 1 37 ILE HB . . 5.050 4.236 3.875 4.684 . 0 0 "[ . 1 . 2]" 1
1266 1 30 ILE MG 1 50 MET QG . . 5.010 3.806 3.292 4.677 . 0 0 "[ . 1 . 2]" 1
1267 1 30 ILE MG 1 35 GLU H . . 5.410 3.642 3.121 3.893 . 0 0 "[ . 1 . 2]" 1
1268 1 29 VAL H 1 30 ILE MD . . 5.500 5.049 4.700 5.423 . 0 0 "[ . 1 . 2]" 1
1269 1 27 GLY H 1 30 ILE MD . . 5.500 4.597 4.208 4.997 . 0 0 "[ . 1 . 2]" 1
1270 1 30 ILE MD 1 50 MET H . . 5.500 4.694 3.790 5.090 . 0 0 "[ . 1 . 2]" 1
1271 1 29 VAL HA 1 83 LEU HG . . 4.520 2.770 2.453 3.021 . 0 0 "[ . 1 . 2]" 1
1272 1 28 LEU HA 1 29 VAL HA . . 4.850 4.677 4.635 4.755 . 0 0 "[ . 1 . 2]" 1
1273 1 28 LEU HA 1 29 VAL MG1 . . 5.150 4.940 4.790 5.081 . 0 0 "[ . 1 . 2]" 1
1274 1 29 VAL MG2 1 50 MET QG . . 5.200 4.700 4.275 5.059 . 0 0 "[ . 1 . 2]" 1
1275 1 29 VAL MG2 1 37 ILE H . . 4.680 3.882 3.421 4.183 . 0 0 "[ . 1 . 2]" 1
1276 1 25 LYS QE 1 28 LEU MD1 . . 5.320 4.167 3.554 4.753 . 0 0 "[ . 1 . 2]" 1
1277 1 25 LYS HA 1 28 LEU MD2 . . 5.500 3.373 3.056 3.699 . 0 0 "[ . 1 . 2]" 1
1278 1 28 LEU MD2 1 29 VAL H . . 5.500 4.781 4.531 4.965 . 0 0 "[ . 1 . 2]" 1
1279 1 27 GLY QA 1 30 ILE MG . . 4.860 4.060 3.707 4.323 . 0 0 "[ . 1 . 2]" 1
1280 1 27 GLY QA 1 30 ILE HG13 . . 4.870 4.118 3.692 4.380 . 0 0 "[ . 1 . 2]" 1
1281 1 26 ALA MB 1 27 GLY QA . . 5.020 3.545 3.399 3.766 . 0 0 "[ . 1 . 2]" 1
1282 1 27 GLY QA 1 28 LEU HG . . 5.420 4.901 4.652 5.184 . 0 0 "[ . 1 . 2]" 1
1283 1 27 GLY QA 1 30 ILE HG12 . . 5.500 5.336 4.929 5.459 . 0 0 "[ . 1 . 2]" 1
1284 1 27 GLY QA 1 29 VAL H . . 5.020 4.259 4.005 4.572 . 0 0 "[ . 1 . 2]" 1
1285 1 25 LYS HB2 1 26 ALA HA . . 4.700 4.274 4.145 4.442 . 0 0 "[ . 1 . 2]" 1
1286 1 26 ALA HA 1 30 ILE H . . 5.140 4.080 3.638 4.344 . 0 0 "[ . 1 . 2]" 1
1287 1 23 ALA MB 1 62 LYS QD . . 4.020 3.707 2.560 3.969 . 0 0 "[ . 1 . 2]" 1
1288 1 22 PRO HD2 1 25 LYS HB3 . . 4.910 4.626 4.278 4.868 . 0 0 "[ . 1 . 2]" 1
1289 1 22 PRO HD3 1 25 LYS HB2 . . 4.850 4.446 4.266 4.597 . 0 0 "[ . 1 . 2]" 1
1290 1 25 LYS HD3 1 84 ILE MG . . 4.750 4.541 4.349 4.749 . 0 0 "[ . 1 . 2]" 1
1291 1 25 LYS H 1 25 LYS HD3 . . 5.450 4.005 3.682 4.171 . 0 0 "[ . 1 . 2]" 1
1292 1 24 SER HA 1 26 ALA H . . 4.880 4.041 3.748 4.327 . 0 0 "[ . 1 . 2]" 1
1293 1 24 SER HB2 1 25 LYS HG2 . . 5.170 3.406 2.637 4.428 . 0 0 "[ . 1 . 2]" 1
1294 1 24 SER HB3 1 25 LYS HG2 . . 5.170 3.386 2.524 4.539 . 0 0 "[ . 1 . 2]" 1
1295 1 21 ILE MG 1 23 ALA HA . . 5.460 4.614 4.416 4.812 . 0 0 "[ . 1 . 2]" 1
1296 1 23 ALA HA 1 25 LYS H . . 5.040 4.544 4.206 4.774 . 0 0 "[ . 1 . 2]" 1
1297 1 23 ALA HA 1 27 GLY H . . 5.500 4.627 3.974 5.492 . 0 0 "[ . 1 . 2]" 1
1298 1 26 ALA MB 1 29 VAL H . . 5.500 4.794 4.489 5.127 . 0 0 "[ . 1 . 2]" 1
1299 1 23 ALA MB 1 61 ASP H . . 5.500 4.730 3.895 5.301 . 0 0 "[ . 1 . 2]" 1
1300 1 21 ILE MG 1 22 PRO HA . . 5.270 4.423 4.311 4.554 . 0 0 "[ . 1 . 2]" 1
1301 1 22 PRO HA 1 62 LYS H . . 5.220 3.792 3.466 4.045 . 0 0 "[ . 1 . 2]" 1
1302 1 22 PRO HD2 1 25 LYS H . . 5.500 4.428 4.236 4.603 . 0 0 "[ . 1 . 2]" 1
1303 1 21 ILE H 1 22 PRO HD2 . . 5.500 4.794 4.731 4.837 . 0 0 "[ . 1 . 2]" 1
1304 1 21 ILE HA 1 84 ILE HG12 . . 5.500 4.342 3.130 5.087 . 0 0 "[ . 1 . 2]" 1
1305 1 21 ILE HB 1 22 PRO HD2 . . 5.500 3.970 3.750 4.138 . 0 0 "[ . 1 . 2]" 1
1306 1 21 ILE HB 1 26 ALA HA . . 5.280 4.380 4.084 4.695 . 0 0 "[ . 1 . 2]" 1
1307 1 20 MET HA 1 21 ILE HB . . 5.180 4.893 4.837 4.942 . 0 0 "[ . 1 . 2]" 1
1308 1 21 ILE MG 1 27 GLY H . . 5.500 5.360 5.082 5.503 0.003 1 0 "[ . 1 . 2]" 1
1309 1 21 ILE MG 1 62 LYS H . . 5.500 4.682 4.555 4.839 . 0 0 "[ . 1 . 2]" 1
1310 1 21 ILE MD 1 64 LEU HA . . 5.290 5.088 4.834 5.295 0.005 1 0 "[ . 1 . 2]" 1
1311 1 21 ILE MD 1 26 ALA HA . . 5.410 5.319 5.123 5.414 0.004 4 0 "[ . 1 . 2]" 1
1312 1 20 MET HB2 1 21 ILE H . . 5.150 3.862 3.221 4.359 . 0 0 "[ . 1 . 2]" 1
1313 1 20 MET HB3 1 21 ILE H . . 5.150 3.778 3.276 4.378 . 0 0 "[ . 1 . 2]" 1
1314 1 19 ILE HB 1 64 LEU H . . 5.230 4.550 4.391 4.743 . 0 0 "[ . 1 . 2]" 1
1315 1 18 GLU HA 1 19 ILE HB . . 5.500 5.569 5.559 5.586 0.086 13 0 "[ . 1 . 2]" 1
1316 1 19 ILE HG13 1 64 LEU H . . 5.260 4.777 4.534 5.096 . 0 0 "[ . 1 . 2]" 1
1317 1 19 ILE HG13 1 20 MET H . . 5.500 4.898 4.555 5.333 . 0 0 "[ . 1 . 2]" 1
1318 1 18 GLU HA 1 19 ILE HG12 . . 5.480 3.733 3.675 3.865 . 0 0 "[ . 1 . 2]" 1
1319 1 19 ILE HG12 1 20 MET H . . 5.260 4.516 4.296 4.762 . 0 0 "[ . 1 . 2]" 1
1320 1 19 ILE HG12 1 64 LEU H . . 5.500 3.249 3.059 3.540 . 0 0 "[ . 1 . 2]" 1
1321 1 19 ILE MG 1 64 LEU H . . 5.500 5.292 5.181 5.412 . 0 0 "[ . 1 . 2]" 1
1322 1 18 GLU HA 1 19 ILE MG . . 5.500 4.355 4.303 4.436 . 0 0 "[ . 1 . 2]" 1
1323 1 19 ILE MG 1 77 LYS HG3 . . 3.430 1.986 1.925 2.049 . 0 0 "[ . 1 . 2]" 1
1324 1 18 GLU HA 1 19 ILE MD . . 4.440 2.749 2.587 2.876 . 0 0 "[ . 1 . 2]" 1
1325 1 18 GLU HA 1 65 ARG HG3 . . 4.550 4.079 3.786 4.469 . 0 0 "[ . 1 . 2]" 1
1326 1 18 GLU HA 1 19 ILE HA . . 4.620 4.415 4.401 4.428 . 0 0 "[ . 1 . 2]" 1
1327 1 17 GLN HA 1 18 GLU HA . . 4.460 4.385 4.379 4.401 . 0 0 "[ . 1 . 2]" 1
1328 1 17 GLN HA 1 18 GLU QB . . 4.630 4.290 4.222 4.336 . 0 0 "[ . 1 . 2]" 1
1329 1 18 GLU QB 1 64 LEU H . . 5.060 4.550 4.421 4.690 . 0 0 "[ . 1 . 2]" 1
1330 1 18 GLU QB 1 66 ILE H . . 5.500 5.063 4.856 5.354 . 0 0 "[ . 1 . 2]" 1
1331 1 18 GLU HG2 1 64 LEU H . . 5.500 5.402 5.209 5.502 0.002 20 0 "[ . 1 . 2]" 1
1332 1 18 GLU HG2 1 65 ARG H . . 5.500 4.456 4.133 4.895 . 0 0 "[ . 1 . 2]" 1
1333 1 18 GLU HG3 1 19 ILE H . . 5.250 4.953 4.857 5.055 . 0 0 "[ . 1 . 2]" 1
1334 1 18 GLU HG3 1 66 ILE H . . 5.500 4.378 3.951 4.847 . 0 0 "[ . 1 . 2]" 1
1335 1 16 VAL MG2 1 18 GLU HG3 . . 4.900 3.192 2.787 3.539 . 0 0 "[ . 1 . 2]" 1
1336 1 17 GLN HB2 1 66 ILE MG . . 4.780 3.870 3.381 4.783 0.003 18 0 "[ . 1 . 2]" 1
1337 1 17 GLN HG3 1 18 GLU H . . 5.280 4.744 2.735 5.281 0.001 15 0 "[ . 1 . 2]" 1
1338 1 16 VAL HA 1 67 THR HB . . 4.940 4.662 4.560 4.786 . 0 0 "[ . 1 . 2]" 1
1339 1 16 VAL HA 1 17 GLN HB2 . . 4.510 4.254 4.160 4.394 . 0 0 "[ . 1 . 2]" 1
1340 1 15 ALA HA 1 16 VAL HB . . 4.740 4.323 4.269 4.369 . 0 0 "[ . 1 . 2]" 1
1341 1 15 ALA HA 1 73 VAL MG1 . . 5.500 5.000 4.780 5.122 . 0 0 "[ . 1 . 2]" 1
1342 1 15 ALA HA 1 16 VAL MG1 . . 5.290 3.888 3.802 4.016 . 0 0 "[ . 1 . 2]" 1
1343 1 15 ALA HA 1 73 VAL HB . . 5.500 5.472 5.315 5.522 0.022 19 0 "[ . 1 . 2]" 1
1344 1 15 ALA HA 1 70 PRO HA . . 5.070 4.498 4.352 4.647 . 0 0 "[ . 1 . 2]" 1
1345 1 15 ALA HA 1 70 PRO HD3 . . 5.500 4.689 4.362 5.125 . 0 0 "[ . 1 . 2]" 1
1346 1 14 ASN QB 1 15 ALA MB . . 5.010 4.573 4.328 4.892 . 0 0 "[ . 1 . 2]" 1
1347 1 15 ALA MB 1 69 ASP HA . . 4.390 2.917 2.385 3.803 . 0 0 "[ . 1 . 2]" 1
1348 1 14 ASN QB 1 16 VAL MG1 . . 5.320 5.203 5.065 5.322 0.002 2 0 "[ . 1 . 2]" 1
1349 1 14 ASN QB 1 67 THR HB . . 4.690 3.911 3.611 4.424 . 0 0 "[ . 1 . 2]" 1
1350 1 14 ASN QB 1 16 VAL H . . 5.500 5.413 5.274 5.498 . 0 0 "[ . 1 . 2]" 1
1351 1 12 PRO QG 1 13 GLY QA . . 5.270 4.217 3.590 4.921 . 0 0 "[ . 1 . 2]" 1
1352 1 13 GLY QA 1 14 ASN QB . . 5.110 4.057 3.712 4.542 . 0 0 "[ . 1 . 2]" 1
1353 1 13 GLY QA 1 15 ALA H . . 5.500 5.321 4.935 5.501 0.001 6 0 "[ . 1 . 2]" 1
1354 1 10 ASP HB3 1 11 GLY QA . . 5.500 4.367 3.781 5.402 . 0 0 "[ . 1 . 2]" 1
1355 1 85 ARG HA 1 86 ASP HB3 . . 5.500 5.009 4.046 5.501 0.001 4 0 "[ . 1 . 2]" 1
1356 1 10 ASP HB2 1 11 GLY QA . . 5.500 4.485 3.723 5.163 . 0 0 "[ . 1 . 2]" 1
1357 1 85 ARG HA 1 86 ASP HB2 . . 5.500 4.761 3.969 5.567 0.067 18 0 "[ . 1 . 2]" 1
1358 1 51 ILE HB 1 64 LEU HA . . 4.910 4.318 4.176 4.799 . 0 0 "[ . 1 . 2]" 1
1359 1 50 MET HA 1 51 ILE HB . . 4.850 4.791 4.668 4.853 0.003 2 0 "[ . 1 . 2]" 1
1360 1 50 MET HA 1 51 ILE HG13 . . 5.480 5.250 5.066 5.419 . 0 0 "[ . 1 . 2]" 1
1361 1 51 ILE HG12 1 65 ARG H . . 5.190 2.508 2.318 2.747 . 0 0 "[ . 1 . 2]" 1
1362 1 51 ILE HG12 1 63 PRO HG2 . . 4.560 4.283 4.019 4.511 . 0 0 "[ . 1 . 2]" 1
1363 1 50 MET HA 1 51 ILE MD . . 4.940 4.134 3.648 4.655 . 0 0 "[ . 1 . 2]" 1
1364 1 51 ILE MD 1 64 LEU HA . . 5.310 4.551 3.986 4.939 . 0 0 "[ . 1 . 2]" 1
1365 1 51 ILE MD 1 65 ARG HA . . 5.500 4.692 4.331 5.066 . 0 0 "[ . 1 . 2]" 1
1366 1 51 ILE MD 1 65 ARG H . . 5.330 3.497 2.989 3.948 . 0 0 "[ . 1 . 2]" 1
1367 1 51 ILE MD 1 51 ILE MG . . 2.960 1.958 1.872 2.130 . 0 0 "[ . 1 . 2]" 1
1368 1 52 GLN HA 1 62 LYS QG . . 5.500 5.086 4.484 5.504 0.004 1 0 "[ . 1 . 2]" 1
1369 1 55 PRO HA 1 58 THR MG . . 5.500 4.450 1.805 5.462 . 0 0 "[ . 1 . 2]" 1
1370 1 23 ALA HA 1 61 ASP HA . . 5.340 4.943 4.417 5.326 . 0 0 "[ . 1 . 2]" 1
1371 1 60 ALA MB 1 61 ASP HB2 . . 5.500 5.219 4.005 5.541 0.041 16 0 "[ . 1 . 2]" 1
1372 1 21 ILE H 1 61 ASP HB2 . . 5.490 4.007 3.276 5.271 . 0 0 "[ . 1 . 2]" 1
1373 1 21 ILE H 1 61 ASP HB3 . . 5.490 4.749 3.248 5.428 . 0 0 "[ . 1 . 2]" 1
1374 1 60 ALA MB 1 61 ASP HB3 . . 5.500 4.628 3.661 5.505 0.005 14 0 "[ . 1 . 2]" 1
1375 1 62 LYS HA 1 63 PRO HB3 . . 5.500 4.896 4.847 4.985 . 0 0 "[ . 1 . 2]" 1
1376 1 61 ASP HA 1 62 LYS HA . . 5.170 4.445 4.358 4.495 . 0 0 "[ . 1 . 2]" 1
1377 1 21 ILE H 1 62 LYS HB2 . . 5.500 3.890 3.570 4.171 . 0 0 "[ . 1 . 2]" 1
1378 1 62 LYS HB2 1 63 PRO HD2 . . 4.580 4.289 4.046 4.585 0.005 1 0 "[ . 1 . 2]" 1
1379 1 21 ILE HB 1 62 LYS QG . . 4.330 4.202 3.961 4.334 0.004 20 0 "[ . 1 . 2]" 1
1380 1 51 ILE MG 1 63 PRO HB3 . . 5.500 5.102 4.816 5.419 . 0 0 "[ . 1 . 2]" 1
1381 1 51 ILE H 1 63 PRO HG2 . . 5.410 3.911 3.712 3.971 . 0 0 "[ . 1 . 2]" 1
1382 1 70 PRO HG2 1 71 TYR H . . 4.990 2.471 2.350 2.773 . 0 0 "[ . 1 . 2]" 1
1383 1 21 ILE HB 1 64 LEU HB3 . . 5.500 4.425 4.196 4.649 . 0 0 "[ . 1 . 2]" 1
1384 1 50 MET QG 1 64 LEU HB3 . . 5.500 4.630 3.680 4.922 . 0 0 "[ . 1 . 2]" 1
1385 1 19 ILE H 1 64 LEU HB3 . . 4.940 3.441 3.321 3.559 . 0 0 "[ . 1 . 2]" 1
1386 1 19 ILE H 1 64 LEU HB2 . . 5.500 4.949 4.872 5.043 . 0 0 "[ . 1 . 2]" 1
1387 1 50 MET QG 1 64 LEU HB2 . . 4.940 3.049 1.992 3.420 . 0 0 "[ . 1 . 2]" 1
1388 1 19 ILE H 1 64 LEU MD2 . . 5.500 4.419 4.054 4.626 . 0 0 "[ . 1 . 2]" 1
1389 1 49 VAL H 1 64 LEU MD2 . . 5.500 4.847 4.467 5.244 . 0 0 "[ . 1 . 2]" 1
1390 1 48 MET HA 1 64 LEU MD2 . . 5.500 4.554 4.338 4.827 . 0 0 "[ . 1 . 2]" 1
1391 1 16 VAL MG1 1 65 ARG HA . . 5.500 5.483 5.376 5.506 0.006 15 0 "[ . 1 . 2]" 1
1392 1 65 ARG HA 1 66 ILE MG . . 5.500 5.468 5.454 5.485 . 0 0 "[ . 1 . 2]" 1
1393 1 16 VAL MG2 1 65 ARG HA . . 4.510 3.627 3.507 3.778 . 0 0 "[ . 1 . 2]" 1
1394 1 19 ILE MD 1 65 ARG HA . . 5.180 3.877 3.740 4.057 . 0 0 "[ . 1 . 2]" 1
1395 1 49 VAL H 1 65 ARG HB3 . . 5.240 3.776 3.539 3.934 . 0 0 "[ . 1 . 2]" 1
1396 1 65 ARG H 1 65 ARG HG3 . . 4.920 4.527 4.432 4.663 . 0 0 "[ . 1 . 2]" 1
1397 1 18 GLU HA 1 65 ARG HG2 . . 5.420 4.870 4.412 5.304 . 0 0 "[ . 1 . 2]" 1
1398 1 65 ARG H 1 65 ARG HD3 . . 5.500 5.179 4.787 5.386 . 0 0 "[ . 1 . 2]" 1
1399 1 65 ARG H 1 65 ARG HD2 . . 5.500 4.969 4.716 5.440 . 0 0 "[ . 1 . 2]" 1
1400 1 66 ILE HA 1 67 THR MG . . 5.500 4.526 4.454 4.593 . 0 0 "[ . 1 . 2]" 1
1401 1 48 MET HA 1 66 ILE HG13 . . 5.150 4.353 4.121 4.553 . 0 0 "[ . 1 . 2]" 1
1402 1 66 ILE HG13 1 67 THR H . . 5.250 5.212 5.154 5.241 . 0 0 "[ . 1 . 2]" 1
1403 1 66 ILE MG 1 67 THR HB . . 5.500 5.361 5.250 5.445 . 0 0 "[ . 1 . 2]" 1
1404 1 46 VAL H 1 66 ILE MG . . 5.500 5.109 4.853 5.474 . 0 0 "[ . 1 . 2]" 1
1405 1 66 ILE MG 1 74 GLN H . . 5.500 5.198 5.009 5.376 . 0 0 "[ . 1 . 2]" 1
1406 1 66 ILE MD 1 67 THR H . . 5.490 5.309 5.219 5.383 . 0 0 "[ . 1 . 2]" 1
1407 1 48 MET HA 1 66 ILE MD . . 5.130 4.217 3.947 4.400 . 0 0 "[ . 1 . 2]" 1
1408 1 66 ILE MD 1 73 VAL HA . . 5.500 4.313 4.014 4.487 . 0 0 "[ . 1 . 2]" 1
1409 1 15 ALA MB 1 67 THR HA . . 5.380 4.646 4.429 4.870 . 0 0 "[ . 1 . 2]" 1
1410 1 65 ARG HG2 1 67 THR HA . . 5.500 4.651 4.485 4.832 . 0 0 "[ . 1 . 2]" 1
1411 1 47 LYS HB3 1 67 THR HA . . 5.500 5.150 4.934 5.328 . 0 0 "[ . 1 . 2]" 1
1412 1 66 ILE HB 1 67 THR HA . . 5.500 4.929 4.858 4.985 . 0 0 "[ . 1 . 2]" 1
1413 1 16 VAL HB 1 67 THR HA . . 4.940 3.260 3.067 3.380 . 0 0 "[ . 1 . 2]" 1
1414 1 67 THR HA 1 68 GLY HA3 . . 5.190 4.341 4.331 4.369 . 0 0 "[ . 1 . 2]" 1
1415 1 66 ILE HA 1 67 THR HA . . 5.080 4.415 4.402 4.424 . 0 0 "[ . 1 . 2]" 1
1416 1 67 THR HB 1 73 VAL MG2 . . 4.780 4.509 4.373 4.593 . 0 0 "[ . 1 . 2]" 1
1417 1 66 ILE H 1 67 THR MG . . 5.500 4.604 4.497 4.728 . 0 0 "[ . 1 . 2]" 1
1418 1 67 THR MG 1 68 GLY HA3 . . 5.500 5.367 5.307 5.424 . 0 0 "[ . 1 . 2]" 1
1419 1 46 VAL HB 1 68 GLY HA3 . . 5.360 2.852 2.631 2.983 . 0 0 "[ . 1 . 2]" 1
1420 1 68 GLY HA3 1 69 ASP HB3 . . 5.500 5.484 4.974 5.602 0.102 12 0 "[ . 1 . 2]" 1
1421 1 68 GLY HA3 1 69 ASP HB2 . . 5.500 4.283 4.171 4.601 . 0 0 "[ . 1 . 2]" 1
1422 1 46 VAL HA 1 68 GLY HA3 . . 4.240 2.966 2.882 3.121 . 0 0 "[ . 1 . 2]" 1
1423 1 67 THR MG 1 68 GLY HA2 . . 5.360 5.033 4.974 5.093 . 0 0 "[ . 1 . 2]" 1
1424 1 14 ASN QB 1 68 GLY HA2 . . 5.300 4.298 3.495 5.061 . 0 0 "[ . 1 . 2]" 1
1425 1 67 THR HA 1 68 GLY HA2 . . 5.500 4.579 4.526 4.619 . 0 0 "[ . 1 . 2]" 1
1426 1 69 ASP HB2 1 72 LYS QE . . 5.500 4.437 3.865 5.425 . 0 0 "[ . 1 . 2]" 1
1427 1 69 ASP HB3 1 70 PRO HD2 . . 4.580 2.335 1.999 3.568 . 0 0 "[ . 1 . 2]" 1
1428 1 70 PRO HA 1 71 TYR HA . . 5.240 4.642 4.629 4.662 . 0 0 "[ . 1 . 2]" 1
1429 1 70 PRO HA 1 74 GLN H . . 5.240 4.313 3.949 4.932 . 0 0 "[ . 1 . 2]" 1
1430 1 70 PRO HD2 1 71 TYR H . . 5.140 2.660 2.646 2.723 . 0 0 "[ . 1 . 2]" 1
1431 1 15 ALA H 1 70 PRO HD2 . . 5.250 4.578 4.367 4.883 . 0 0 "[ . 1 . 2]" 1
1432 1 69 ASP H 1 70 PRO HD2 . . 5.500 4.783 4.743 4.804 . 0 0 "[ . 1 . 2]" 1
1433 1 70 PRO HD3 1 71 TYR H . . 5.440 3.846 3.836 3.883 . 0 0 "[ . 1 . 2]" 1
1434 1 51 ILE MG 1 63 PRO HD3 . . 5.470 5.251 4.944 5.472 0.002 10 0 "[ . 1 . 2]" 1
1435 1 71 TYR HA 1 74 GLN HG2 . . 4.780 3.629 2.299 4.791 0.011 19 0 "[ . 1 . 2]" 1
1436 1 71 TYR HA 1 74 GLN HG3 . . 4.780 3.817 2.973 4.416 . 0 0 "[ . 1 . 2]" 1
1437 1 70 PRO HD2 1 71 TYR HA . . 5.500 5.512 5.480 5.533 0.033 2 0 "[ . 1 . 2]" 1
1438 1 71 TYR HA 1 71 TYR QE . . 5.500 4.694 4.399 4.817 . 0 0 "[ . 1 . 2]" 1
1439 1 71 TYR HA 1 75 GLN H . . 5.290 5.050 4.850 5.297 0.007 19 0 "[ . 1 . 2]" 1
1440 1 71 TYR HA 1 73 VAL H . . 5.500 5.126 4.966 5.291 . 0 0 "[ . 1 . 2]" 1
1441 1 71 TYR HB2 1 72 LYS HG2 . . 5.500 5.483 5.433 5.512 0.012 8 0 "[ . 1 . 2]" 1
1442 1 70 PRO HG2 1 71 TYR HB2 . . 5.230 3.552 3.445 3.689 . 0 0 "[ . 1 . 2]" 1
1443 1 70 PRO HG2 1 71 TYR HB3 . . 5.230 4.059 3.901 4.353 . 0 0 "[ . 1 . 2]" 1
1444 1 71 TYR HB3 1 72 LYS HG2 . . 5.500 3.805 3.736 3.911 . 0 0 "[ . 1 . 2]" 1
1445 1 71 TYR HB3 1 72 LYS HG3 . . 5.500 3.465 3.251 3.690 . 0 0 "[ . 1 . 2]" 1
1446 1 71 TYR HB2 1 72 LYS HG3 . . 5.500 5.131 4.889 5.353 . 0 0 "[ . 1 . 2]" 1
1447 1 72 LYS HA 1 74 GLN H . . 4.920 4.095 3.648 4.477 . 0 0 "[ . 1 . 2]" 1
1448 1 72 LYS HB3 1 73 VAL H . . 4.860 3.486 3.377 3.572 . 0 0 "[ . 1 . 2]" 1
1449 1 72 LYS HB2 1 72 LYS QE . . 4.890 3.798 3.261 4.274 . 0 0 "[ . 1 . 2]" 1
1450 1 69 ASP HB2 1 72 LYS HG3 . . 5.470 2.154 1.991 2.983 . 0 0 "[ . 1 . 2]" 1
1451 1 46 VAL MG1 1 72 LYS HD3 . . 4.910 2.916 2.634 3.146 . 0 0 "[ . 1 . 2]" 1
1452 1 45 GLY QA 1 72 LYS HD3 . . 4.560 3.144 2.453 3.866 . 0 0 "[ . 1 . 2]" 1
1453 1 69 ASP H 1 72 LYS HD3 . . 5.500 4.321 3.470 5.193 . 0 0 "[ . 1 . 2]" 1
1454 1 71 TYR QE 1 72 LYS QE . . 5.500 5.263 4.512 5.503 0.003 19 0 "[ . 1 . 2]" 1
1455 1 71 TYR QD 1 72 LYS QE . . 5.490 4.388 3.937 4.597 . 0 0 "[ . 1 . 2]" 1
1456 1 72 LYS H 1 72 LYS QE . . 5.500 4.936 4.723 5.362 . 0 0 "[ . 1 . 2]" 1
1457 1 66 ILE HB 1 73 VAL HA . . 5.100 4.441 4.124 4.713 . 0 0 "[ . 1 . 2]" 1
1458 1 72 LYS HB2 1 73 VAL HA . . 5.360 4.041 3.923 4.188 . 0 0 "[ . 1 . 2]" 1
1459 1 46 VAL HB 1 73 VAL HA . . 5.080 3.613 3.439 3.753 . 0 0 "[ . 1 . 2]" 1
1460 1 73 VAL HA 1 75 GLN H . . 5.190 4.303 4.058 4.476 . 0 0 "[ . 1 . 2]" 1
1461 1 73 VAL HA 1 77 LYS H . . 4.460 4.042 3.800 4.379 . 0 0 "[ . 1 . 2]" 1
1462 1 72 LYS H 1 73 VAL HB . . 5.500 4.301 4.202 4.407 . 0 0 "[ . 1 . 2]" 1
1463 1 73 VAL MG2 1 75 GLN H . . 5.500 5.406 5.209 5.522 0.022 19 0 "[ . 1 . 2]" 1
1464 1 16 VAL H 1 73 VAL MG2 . . 5.500 4.173 3.912 4.535 . 0 0 "[ . 1 . 2]" 1
1465 1 15 ALA HA 1 73 VAL MG2 . . 5.060 4.256 4.064 4.549 . 0 0 "[ . 1 . 2]" 1
1466 1 17 GLN HA 1 73 VAL MG1 . . 5.030 3.744 3.567 3.934 . 0 0 "[ . 1 . 2]" 1
1467 1 66 ILE HA 1 73 VAL MG1 . . 5.500 4.532 4.404 4.711 . 0 0 "[ . 1 . 2]" 1
1468 1 73 VAL MG1 1 77 LYS H . . 5.010 3.983 3.628 4.394 . 0 0 "[ . 1 . 2]" 1
1469 1 66 ILE H 1 73 VAL MG1 . . 5.500 4.175 3.910 4.369 . 0 0 "[ . 1 . 2]" 1
1470 1 74 GLN HA 1 77 LYS HG2 . . 5.500 5.031 4.626 5.304 . 0 0 "[ . 1 . 2]" 1
1471 1 74 GLN HA 1 76 ALA MB . . 5.500 5.264 5.100 5.443 . 0 0 "[ . 1 . 2]" 1
1472 1 74 GLN HA 1 77 LYS HG3 . . 5.500 5.460 5.240 5.506 0.006 10 0 "[ . 1 . 2]" 1
1473 1 74 GLN HG3 1 75 GLN H . . 5.020 3.556 1.925 4.986 . 0 0 "[ . 1 . 2]" 1
1474 1 73 VAL MG1 1 74 GLN HG2 . . 5.500 4.203 3.233 5.190 . 0 0 "[ . 1 . 2]" 1
1475 1 73 VAL MG1 1 74 GLN HG3 . . 5.500 5.152 4.355 5.510 0.010 10 0 "[ . 1 . 2]" 1
1476 1 75 GLN HB3 1 76 ALA MB . . 5.360 4.643 4.485 4.829 . 0 0 "[ . 1 . 2]" 1
1477 1 46 VAL MG2 1 76 ALA HA . . 5.110 3.999 3.670 4.290 . 0 0 "[ . 1 . 2]" 1
1478 1 66 ILE MD 1 76 ALA HA . . 4.730 4.503 4.304 4.730 0.000 9 0 "[ . 1 . 2]" 1
1479 1 75 GLN H 1 76 ALA HA . . 5.380 5.263 5.112 5.377 . 0 0 "[ . 1 . 2]" 1
1480 1 76 ALA HA 1 80 VAL H . . 4.990 4.267 4.029 4.539 . 0 0 "[ . 1 . 2]" 1
1481 1 48 MET ME 1 76 ALA HA . . 5.140 3.384 2.953 3.596 . 0 0 "[ . 1 . 2]" 1
1482 1 48 MET HG2 1 76 ALA MB . . 4.450 3.983 3.616 4.225 . 0 0 "[ . 1 . 2]" 1
1483 1 46 VAL H 1 76 ALA MB . . 5.500 4.158 3.666 4.626 . 0 0 "[ . 1 . 2]" 1
1484 1 74 GLN H 1 76 ALA MB . . 5.500 4.982 4.746 5.124 . 0 0 "[ . 1 . 2]" 1
1485 1 45 GLY H 1 76 ALA MB . . 5.500 4.779 4.451 5.154 . 0 0 "[ . 1 . 2]" 1
1486 1 76 ALA MB 1 79 MET H . . 5.500 4.390 4.156 4.731 . 0 0 "[ . 1 . 2]" 1
1487 1 73 VAL H 1 76 ALA MB . . 5.500 4.715 4.461 4.996 . 0 0 "[ . 1 . 2]" 1
1488 1 77 LYS HA 1 78 GLU HA . . 4.930 4.745 4.672 4.797 . 0 0 "[ . 1 . 2]" 1
1489 1 77 LYS HA 1 81 LEU HG . . 4.380 4.124 3.963 4.304 . 0 0 "[ . 1 . 2]" 1
1490 1 77 LYS HA 1 79 MET H . . 5.500 4.541 4.245 4.827 . 0 0 "[ . 1 . 2]" 1
1491 1 77 LYS H 1 77 LYS HG3 . . 4.780 4.564 4.539 4.588 . 0 0 "[ . 1 . 2]" 1
1492 1 77 LYS HG3 1 78 GLU H . . 5.440 4.435 3.900 4.720 . 0 0 "[ . 1 . 2]" 1
1493 1 77 LYS HG2 1 78 GLU H . . 5.020 3.191 2.577 3.527 . 0 0 "[ . 1 . 2]" 1
1494 1 77 LYS H 1 77 LYS HG2 . . 4.900 4.279 4.025 4.377 . 0 0 "[ . 1 . 2]" 1
1495 1 77 LYS HG2 1 81 LEU H . . 5.040 4.480 4.177 4.930 . 0 0 "[ . 1 . 2]" 1
1496 1 77 LYS HG2 1 78 GLU HA . . 4.740 3.165 2.930 3.384 . 0 0 "[ . 1 . 2]" 1
1497 1 77 LYS HG3 1 78 GLU HA . . 4.940 4.587 4.085 4.898 . 0 0 "[ . 1 . 2]" 1
1498 1 77 LYS QD 1 78 GLU H . . 5.290 4.679 4.301 4.981 . 0 0 "[ . 1 . 2]" 1
1499 1 40 LEU MD2 1 79 MET HG2 . . 5.030 4.135 3.571 4.822 . 0 0 "[ . 1 . 2]" 1
1500 1 79 MET HG2 1 80 VAL H . . 5.500 5.025 4.840 5.280 . 0 0 "[ . 1 . 2]" 1
1501 1 79 MET HG3 1 80 VAL H . . 5.500 4.670 4.525 4.872 . 0 0 "[ . 1 . 2]" 1
1502 1 79 MET HA 1 80 VAL HA . . 4.780 4.723 4.650 4.765 . 0 0 "[ . 1 . 2]" 1
1503 1 80 VAL HA 1 83 LEU HA . . 5.220 5.053 4.916 5.158 . 0 0 "[ . 1 . 2]" 1
1504 1 80 VAL HA 1 82 GLU H . . 5.410 4.266 3.966 4.596 . 0 0 "[ . 1 . 2]" 1
1505 1 79 MET H 1 80 VAL HA . . 5.500 5.363 5.290 5.439 . 0 0 "[ . 1 . 2]" 1
1506 1 80 VAL MG1 1 84 ILE H . . 4.810 4.144 3.711 4.526 . 0 0 "[ . 1 . 2]" 1
1507 1 81 LEU HA 1 85 ARG H . . 5.230 4.526 4.071 4.846 . 0 0 "[ . 1 . 2]" 1
1508 1 81 LEU HG 1 82 GLU H . . 5.370 4.666 4.530 4.817 . 0 0 "[ . 1 . 2]" 1
1509 1 81 LEU MD2 1 84 ILE H . . 5.150 5.081 4.966 5.137 . 0 0 "[ . 1 . 2]" 1
1510 1 82 GLU QG 1 83 LEU HA . . 5.120 4.153 3.512 5.113 . 0 0 "[ . 1 . 2]" 1
1511 1 82 GLU H 1 83 LEU HB2 . . 5.250 4.507 4.319 4.626 . 0 0 "[ . 1 . 2]" 1
1512 1 82 GLU H 1 83 LEU HB3 . . 5.250 5.043 4.826 5.215 . 0 0 "[ . 1 . 2]" 1
1513 1 29 VAL H 1 83 LEU MD2 . . 5.500 5.419 5.163 5.503 0.003 2 0 "[ . 1 . 2]" 1
1514 1 25 LYS QE 1 84 ILE HA . . 5.410 4.163 3.727 4.673 . 0 0 "[ . 1 . 2]" 1
1515 1 22 PRO HD2 1 84 ILE MG . . 5.500 2.224 1.978 2.706 . 0 0 "[ . 1 . 2]" 1
1516 1 80 VAL HA 1 84 ILE MG . . 5.500 4.551 4.263 4.849 . 0 0 "[ . 1 . 2]" 1
1517 1 25 LYS H 1 84 ILE MG . . 5.500 4.175 3.942 4.358 . 0 0 "[ . 1 . 2]" 1
1518 1 19 ILE H 1 19 ILE MD . . 5.190 2.488 2.268 2.596 . 0 0 "[ . 1 . 2]" 1
1519 1 19 ILE MD 1 64 LEU H . . 5.500 4.503 4.336 4.705 . 0 0 "[ . 1 . 2]" 1
1520 1 19 ILE MD 1 65 ARG H . . 5.500 5.165 5.024 5.351 . 0 0 "[ . 1 . 2]" 1
1521 1 84 ILE HG13 1 85 ARG HA . . 4.810 3.549 3.197 4.186 . 0 0 "[ . 1 . 2]" 1
1522 1 40 LEU MD2 1 43 ARG HB2 . . 5.190 3.029 2.805 3.243 . 0 0 "[ . 1 . 2]" 1
1523 1 84 ILE MD 1 85 ARG HB2 . . 5.500 4.626 3.471 5.182 . 0 0 "[ . 1 . 2]" 1
1524 1 40 LEU MD2 1 43 ARG HB3 . . 5.190 3.824 3.628 4.202 . 0 0 "[ . 1 . 2]" 1
1525 1 43 ARG H 1 79 MET ME . . 5.500 3.977 3.511 4.514 . 0 0 "[ . 1 . 2]" 1
1526 1 45 GLY H 1 79 MET ME . . 5.500 4.547 4.170 4.812 . 0 0 "[ . 1 . 2]" 1
1527 1 79 MET H 1 79 MET ME . . 5.500 4.117 3.830 4.481 . 0 0 "[ . 1 . 2]" 1
1528 1 77 LYS HB2 1 81 LEU MD1 . . 4.250 4.192 4.064 4.251 0.001 8 0 "[ . 1 . 2]" 1
1529 1 19 ILE MD 1 77 LYS HB3 . . 4.110 4.077 3.930 4.114 0.004 18 0 "[ . 1 . 2]" 1
1530 1 77 LYS H 1 77 LYS QD . . 5.210 4.505 4.274 4.644 . 0 0 "[ . 1 . 2]" 1
1531 1 76 ALA HA 1 79 MET H . . 4.140 3.186 2.953 3.569 . 0 0 "[ . 1 . 2]" 1
1532 1 48 MET ME 1 48 MET HG3 . . 3.370 2.412 2.241 2.540 . 0 0 "[ . 1 . 2]" 1
1533 1 48 MET ME 1 48 MET HG2 . . 3.340 2.581 2.409 2.730 . 0 0 "[ . 1 . 2]" 1
1534 1 41 GLN HG2 1 48 MET ME . . 4.900 4.141 3.806 4.478 . 0 0 "[ . 1 . 2]" 1
1535 1 48 MET ME 1 66 ILE HA . . 5.380 5.202 5.038 5.361 . 0 0 "[ . 1 . 2]" 1
1536 1 48 MET HA 1 48 MET ME . . 5.040 4.529 4.478 4.553 . 0 0 "[ . 1 . 2]" 1
1537 1 46 VAL H 1 48 MET ME . . 5.500 4.552 4.183 4.781 . 0 0 "[ . 1 . 2]" 1
1538 1 48 MET ME 1 76 ALA H . . 5.020 4.842 4.517 4.990 . 0 0 "[ . 1 . 2]" 1
1539 1 48 MET H 1 48 MET ME . . 5.010 4.889 4.676 4.993 . 0 0 "[ . 1 . 2]" 1
1540 1 48 MET ME 1 80 VAL H . . 4.710 3.746 3.424 4.056 . 0 0 "[ . 1 . 2]" 1
1541 1 40 LEU H 1 48 MET ME . . 5.500 4.857 4.645 5.042 . 0 0 "[ . 1 . 2]" 1
1542 1 48 MET ME 1 77 LYS H . . 5.100 4.517 4.264 4.865 . 0 0 "[ . 1 . 2]" 1
1543 1 44 ALA H 1 48 MET ME . . 5.300 4.362 4.062 4.682 . 0 0 "[ . 1 . 2]" 1
1544 1 26 ALA MB 1 50 MET ME . . 3.500 3.008 2.480 3.502 0.002 7 0 "[ . 1 . 2]" 1
1545 1 20 MET ME 1 61 ASP HA . . 4.920 4.691 3.990 4.920 . 10 0 "[ . 1 . 2]" 1
1546 1 20 MET HA 1 20 MET ME . . 4.460 3.525 1.839 4.375 . 0 0 "[ . 1 . 2]" 1
1547 1 26 ALA H 1 50 MET ME . . 5.500 5.084 4.521 5.502 0.002 7 0 "[ . 1 . 2]" 1
1548 1 51 ILE HB 1 63 PRO HG2 . . 3.760 1.995 1.983 2.000 . 0 0 "[ . 1 . 2]" 1
1549 1 23 ALA HA 1 62 LYS HB2 . . 5.030 4.426 3.635 4.791 . 0 0 "[ . 1 . 2]" 1
1550 1 42 GLU HA 1 45 GLY H . . 3.710 3.105 2.965 3.411 . 0 0 "[ . 1 . 2]" 1
1551 1 37 ILE HA 1 39 GLN H . . 4.350 4.192 3.966 4.344 . 0 0 "[ . 1 . 2]" 1
1552 1 30 ILE HA 1 37 ILE HG12 . . 4.950 4.878 4.789 4.952 0.002 2 0 "[ . 1 . 2]" 1
1553 1 37 ILE HG12 1 40 LEU HB2 . . 4.510 3.971 3.660 4.234 . 0 0 "[ . 1 . 2]" 1
1554 1 32 LYS QB 1 35 GLU QB . . 4.440 3.928 3.231 4.422 . 0 0 "[ . 1 . 2]" 1
1555 1 25 LYS HG3 1 84 ILE MG . . 4.710 3.315 2.929 3.622 . 0 0 "[ . 1 . 2]" 1
1556 1 25 LYS HG3 1 84 ILE MD . . 5.070 3.505 2.944 3.891 . 0 0 "[ . 1 . 2]" 1
1557 1 25 LYS H 1 25 LYS HD2 . . 5.500 4.821 4.602 4.953 . 0 0 "[ . 1 . 2]" 1
1558 1 22 PRO HD2 1 25 LYS HG2 . . 5.500 4.755 4.217 5.171 . 0 0 "[ . 1 . 2]" 1
1559 1 25 LYS HG2 1 84 ILE MG . . 4.820 4.137 3.896 4.388 . 0 0 "[ . 1 . 2]" 1
1560 1 25 LYS HG2 1 84 ILE MD . . 5.410 4.783 4.272 5.134 . 0 0 "[ . 1 . 2]" 1
1561 1 22 PRO HA 1 23 ALA MB . . 4.390 3.979 3.915 4.017 . 0 0 "[ . 1 . 2]" 1
1562 1 22 PRO HD3 1 25 LYS HG3 . . 4.940 4.658 4.361 4.939 . 0 0 "[ . 1 . 2]" 1
1563 1 21 ILE HB 1 22 PRO HD3 . . 5.480 4.863 4.741 4.950 . 0 0 "[ . 1 . 2]" 1
1564 1 21 ILE H 1 22 PRO HD3 . . 5.470 4.644 4.458 4.828 . 0 0 "[ . 1 . 2]" 1
1565 1 20 MET ME 1 20 MET HG3 . . 3.860 2.794 2.295 3.388 . 0 0 "[ . 1 . 2]" 1
1566 1 51 ILE MG 1 63 PRO HB2 . . 4.470 4.052 3.833 4.432 . 0 0 "[ . 1 . 2]" 1
1567 1 51 ILE HG13 1 63 PRO HG2 . . 4.310 4.096 3.985 4.179 . 0 0 "[ . 1 . 2]" 1
1568 1 19 ILE HB 1 64 LEU HB3 . . 4.250 4.163 3.918 4.254 0.004 1 0 "[ . 1 . 2]" 1
1569 1 66 ILE MG 1 73 VAL HB . . 4.510 4.299 3.996 4.497 . 0 0 "[ . 1 . 2]" 1
1570 1 78 GLU QB 1 81 LEU HB2 . . 4.710 4.277 3.925 4.517 . 0 0 "[ . 1 . 2]" 1
1571 1 29 VAL HB 1 30 ILE H . . 4.280 4.171 3.906 4.266 . 0 0 "[ . 1 . 2]" 1
1572 1 51 ILE H 1 63 PRO HB2 . . 5.120 4.522 4.398 4.572 . 0 0 "[ . 1 . 2]" 1
1573 1 26 ALA HA 1 50 MET ME . . 3.500 2.844 2.276 3.206 . 0 0 "[ . 1 . 2]" 1
1574 1 16 VAL MG1 1 66 ILE H . . 5.500 5.189 5.042 5.410 . 0 0 "[ . 1 . 2]" 1
1575 1 48 MET ME 1 66 ILE MD . . 3.060 2.336 1.955 2.634 . 0 0 "[ . 1 . 2]" 1
1576 1 47 LYS HA 1 47 LYS QD . . 4.060 3.977 3.884 4.063 0.003 10 0 "[ . 1 . 2]" 1
1577 1 46 VAL MG2 1 47 LYS HA . . 5.500 4.128 3.915 4.309 . 0 0 "[ . 1 . 2]" 1
1578 1 40 LEU MD1 1 80 VAL HA . . 5.500 3.239 3.018 3.426 . 0 0 "[ . 1 . 2]" 1
1579 1 40 LEU MD2 1 80 VAL HA . . 5.500 4.156 3.889 4.435 . 0 0 "[ . 1 . 2]" 1
1580 1 12 PRO QB 1 13 GLY QA . . 5.340 3.789 3.385 4.183 . 0 0 "[ . 1 . 2]" 1
1581 1 15 ALA MB 1 70 PRO QB . . 3.670 2.357 2.078 2.565 . 0 0 "[ . 1 . 2]" 1
1582 1 16 VAL MG2 1 65 ARG QD . . 3.310 2.900 2.389 3.248 . 0 0 "[ . 1 . 2]" 1
1583 1 17 GLN H 1 17 GLN QG . . 4.370 3.609 3.277 4.277 . 0 0 "[ . 1 . 2]" 1
1584 1 17 GLN QG 1 18 GLU H . . 4.520 4.051 2.695 4.488 . 0 0 "[ . 1 . 2]" 1
1585 1 17 GLN QG 1 73 VAL MG1 . . 3.190 2.235 1.866 3.000 . 0 0 "[ . 1 . 2]" 1
1586 1 17 GLN QG 1 77 LYS QD . . 5.340 3.199 2.229 4.014 . 0 0 "[ . 1 . 2]" 1
1587 1 17 GLN QE 1 73 VAL MG1 . . 4.540 3.871 3.370 4.198 . 0 0 "[ . 1 . 2]" 1
1588 1 19 ILE HA 1 20 MET QB . . 4.700 4.459 4.184 4.699 . 0 0 "[ . 1 . 2]" 1
1589 1 19 ILE HA 1 20 MET QG . . 4.600 3.736 3.340 4.340 . 0 0 "[ . 1 . 2]" 1
1590 1 19 ILE MG 1 77 LYS QE . . 5.010 3.933 2.751 4.350 . 0 0 "[ . 1 . 2]" 1
1591 1 20 MET H 1 20 MET QB . . 3.220 2.597 2.292 2.906 . 0 0 "[ . 1 . 2]" 1
1592 1 20 MET QB 1 20 MET ME . . 3.770 2.177 1.841 3.072 . 0 0 "[ . 1 . 2]" 1
1593 1 20 MET QB 1 21 ILE H . . 4.460 3.275 3.107 3.432 . 0 0 "[ . 1 . 2]" 1
1594 1 20 MET QB 1 21 ILE HA . . 5.290 4.313 4.131 4.580 . 0 0 "[ . 1 . 2]" 1
1595 1 20 MET QB 1 61 ASP QB . . 3.440 2.834 2.388 3.446 0.006 1 0 "[ . 1 . 2]" 1
1596 1 20 MET ME 1 20 MET QG . . 3.250 2.354 2.123 2.628 . 0 0 "[ . 1 . 2]" 1
1597 1 20 MET QG 1 21 ILE H . . 5.340 4.454 4.048 4.861 . 0 0 "[ . 1 . 2]" 1
1598 1 20 MET ME 1 61 ASP QB . . 3.150 2.602 2.265 3.016 . 0 0 "[ . 1 . 2]" 1
1599 1 21 ILE H 1 21 ILE QG . . 3.750 2.320 2.194 2.485 . 0 0 "[ . 1 . 2]" 1
1600 1 21 ILE H 1 61 ASP QB . . 4.720 3.579 3.183 4.647 . 0 0 "[ . 1 . 2]" 1
1601 1 21 ILE HA 1 22 PRO QB . . 5.230 4.540 4.534 4.551 . 0 0 "[ . 1 . 2]" 1
1602 1 21 ILE HA 1 22 PRO QG . . 4.390 3.811 3.781 3.855 . 0 0 "[ . 1 . 2]" 1
1603 1 21 ILE QG 1 21 ILE MG . . 3.100 2.375 2.240 2.456 . 0 0 "[ . 1 . 2]" 1
1604 1 21 ILE MG 1 22 PRO QG . . 3.640 3.199 2.968 3.411 . 0 0 "[ . 1 . 2]" 1
1605 1 21 ILE QG 1 29 VAL MG1 . . 4.860 4.106 3.876 4.364 . 0 0 "[ . 1 . 2]" 1
1606 1 21 ILE QG 1 50 MET ME . . 3.110 2.258 1.974 2.925 . 0 0 "[ . 1 . 2]" 1
1607 1 21 ILE QG 1 62 LYS H . . 5.340 4.475 4.176 4.919 . 0 0 "[ . 1 . 2]" 1
1608 1 21 ILE QG 1 64 LEU HA . . 5.010 3.973 3.739 4.146 . 0 0 "[ . 1 . 2]" 1
1609 1 21 ILE QG 1 64 LEU HB2 . . 3.190 2.238 1.969 2.438 . 0 0 "[ . 1 . 2]" 1
1610 1 21 ILE QG 1 64 LEU HB3 . . 3.530 2.177 1.990 2.328 . 0 0 "[ . 1 . 2]" 1
1611 1 21 ILE QG 1 64 LEU MD2 . . 3.460 2.520 2.257 2.779 . 0 0 "[ . 1 . 2]" 1
1612 1 22 PRO HA 1 61 ASP QB . . 4.580 3.561 3.142 4.340 . 0 0 "[ . 1 . 2]" 1
1613 1 22 PRO QB 1 25 LYS H . . 3.950 2.645 2.525 2.736 . 0 0 "[ . 1 . 2]" 1
1614 1 22 PRO QB 1 25 LYS HG2 . . 4.040 3.178 2.863 3.460 . 0 0 "[ . 1 . 2]" 1
1615 1 22 PRO QB 1 25 LYS HG3 . . 4.130 3.750 3.403 3.990 . 0 0 "[ . 1 . 2]" 1
1616 1 22 PRO QG 1 23 ALA H . . 5.020 4.711 4.653 4.751 . 0 0 "[ . 1 . 2]" 1
1617 1 22 PRO QG 1 25 LYS H . . 5.350 2.464 2.327 2.662 . 0 0 "[ . 1 . 2]" 1
1618 1 22 PRO QG 1 25 LYS HG2 . . 4.000 2.501 2.020 2.868 . 0 0 "[ . 1 . 2]" 1
1619 1 22 PRO QG 1 25 LYS HG3 . . 3.960 2.262 2.006 2.468 . 0 0 "[ . 1 . 2]" 1
1620 1 22 PRO QG 1 84 ILE MD . . 3.380 2.468 2.039 2.795 . 0 0 "[ . 1 . 2]" 1
1621 1 23 ALA H 1 61 ASP QB . . 5.340 4.448 4.017 4.935 . 0 0 "[ . 1 . 2]" 1
1622 1 23 ALA HA 1 62 LYS QE . . 4.380 3.904 3.073 4.382 0.002 16 0 "[ . 1 . 2]" 1
1623 1 24 SER QB 1 25 LYS H . . 3.790 2.557 2.298 3.450 . 0 0 "[ . 1 . 2]" 1
1624 1 24 SER QB 1 25 LYS HG2 . . 4.540 2.831 2.506 3.678 . 0 0 "[ . 1 . 2]" 1
1625 1 28 LEU H 1 28 LEU QB . . 3.120 2.270 2.148 2.349 . 0 0 "[ . 1 . 2]" 1
1626 1 28 LEU QB 1 29 VAL H . . 3.070 2.608 2.312 2.811 . 0 0 "[ . 1 . 2]" 1
1627 1 28 LEU QB 1 29 VAL HA . . 5.060 3.902 3.809 3.981 . 0 0 "[ . 1 . 2]" 1
1628 1 29 VAL HA 1 83 LEU QB . . 5.340 4.232 3.951 4.555 . 0 0 "[ . 1 . 2]" 1
1629 1 30 ILE MG 1 34 GLY QA . . 3.040 2.063 1.871 2.326 . 0 0 "[ . 1 . 2]" 1
1630 1 30 ILE MD 1 50 MET QB . . 3.160 2.908 2.372 3.093 . 0 0 "[ . 1 . 2]" 1
1631 1 31 GLY QA 1 35 GLU H . . 3.730 2.881 2.417 3.367 . 0 0 "[ . 1 . 2]" 1
1632 1 31 GLY QA 1 35 GLU QB . . 5.170 3.164 2.008 4.604 . 0 0 "[ . 1 . 2]" 1
1633 1 31 GLY QA 1 35 GLU QG . . 5.270 4.053 1.949 5.148 . 0 0 "[ . 1 . 2]" 1
1634 1 31 GLY QA 1 36 THR H . . 3.930 2.695 2.351 2.960 . 0 0 "[ . 1 . 2]" 1
1635 1 31 GLY QA 1 36 THR HB . . 3.660 3.383 3.186 3.630 . 0 0 "[ . 1 . 2]" 1
1636 1 31 GLY QA 1 36 THR MG . . 4.700 4.466 4.220 4.673 . 0 0 "[ . 1 . 2]" 1
1637 1 31 GLY QA 1 37 ILE H . . 4.730 4.325 4.167 4.531 . 0 0 "[ . 1 . 2]" 1
1638 1 31 GLY QA 1 37 ILE MG . . 5.340 4.499 4.307 4.839 . 0 0 "[ . 1 . 2]" 1
1639 1 32 LYS QE 1 32 LYS QG . . 3.310 2.231 2.086 2.629 . 0 0 "[ . 1 . 2]" 1
1640 1 34 GLY QA 1 35 GLU QB . . 5.340 4.451 4.243 4.661 . 0 0 "[ . 1 . 2]" 1
1641 1 34 GLY QA 1 37 ILE MG . . 3.500 2.104 1.899 2.306 . 0 0 "[ . 1 . 2]" 1
1642 1 36 THR HA 1 39 GLN QB . . 3.430 3.153 3.016 3.408 . 0 0 "[ . 1 . 2]" 1
1643 1 36 THR HA 1 39 GLN QG . . 3.920 3.634 3.322 3.886 . 0 0 "[ . 1 . 2]" 1
1644 1 36 THR MG 1 39 GLN QB . . 4.500 3.651 3.306 4.065 . 0 0 "[ . 1 . 2]" 1
1645 1 38 LYS H 1 38 LYS QG . . 4.140 3.895 3.769 3.971 . 0 0 "[ . 1 . 2]" 1
1646 1 38 LYS H 1 39 GLN QB . . 5.260 4.625 4.505 4.838 . 0 0 "[ . 1 . 2]" 1
1647 1 38 LYS HA 1 38 LYS QG . . 3.330 2.326 2.171 2.460 . 0 0 "[ . 1 . 2]" 1
1648 1 38 LYS QB 1 39 GLN QB . . 4.300 4.222 3.730 4.299 . 0 0 "[ . 1 . 2]" 1
1649 1 38 LYS QB 1 39 GLN QG . . 4.920 3.421 3.109 4.803 . 0 0 "[ . 1 . 2]" 1
1650 1 38 LYS QD 1 38 LYS QG . . 2.420 2.058 2.026 2.092 . 0 0 "[ . 1 . 2]" 1
1651 1 38 LYS QE 1 38 LYS QG . . 3.220 2.177 2.060 2.444 . 0 0 "[ . 1 . 2]" 1
1652 1 38 LYS QG 1 39 GLN H . . 4.540 3.989 3.599 4.289 . 0 0 "[ . 1 . 2]" 1
1653 1 38 LYS QG 1 39 GLN HA . . 5.340 4.140 3.608 4.552 . 0 0 "[ . 1 . 2]" 1
1654 1 38 LYS QG 1 41 GLN HG3 . . 4.720 4.534 4.344 4.669 . 0 0 "[ . 1 . 2]" 1
1655 1 38 LYS QG 1 41 GLN QE . . 5.340 3.355 2.905 3.780 . 0 0 "[ . 1 . 2]" 1
1656 1 39 GLN H 1 39 GLN QB . . 2.950 2.253 2.165 2.334 . 0 0 "[ . 1 . 2]" 1
1657 1 39 GLN H 1 39 GLN QG . . 3.490 2.704 2.428 2.867 . 0 0 "[ . 1 . 2]" 1
1658 1 39 GLN HA 1 39 GLN QG . . 3.140 2.498 2.156 3.263 0.123 11 0 "[ . 1 . 2]" 1
1659 1 39 GLN QB 1 39 GLN QG . . 2.360 2.036 1.973 2.085 . 0 0 "[ . 1 . 2]" 1
1660 1 40 LEU HA 1 43 ARG QB . . 3.220 2.421 2.242 2.909 . 0 0 "[ . 1 . 2]" 1
1661 1 40 LEU MD1 1 79 MET QB . . 5.030 3.722 3.388 4.025 . 0 0 "[ . 1 . 2]" 1
1662 1 40 LEU MD1 1 83 LEU QB . . 4.210 3.606 3.461 3.769 . 0 0 "[ . 1 . 2]" 1
1663 1 40 LEU MD2 1 79 MET QB . . 3.540 2.469 2.169 2.720 . 0 0 "[ . 1 . 2]" 1
1664 1 40 LEU MD2 1 79 MET QG . . 4.320 3.870 3.468 4.319 . 0 0 "[ . 1 . 2]" 1
1665 1 41 GLN H 1 43 ARG QB . . 5.340 4.866 4.591 5.291 . 0 0 "[ . 1 . 2]" 1
1666 1 41 GLN HG3 1 47 LYS QG . . 5.340 4.972 4.682 5.138 . 0 0 "[ . 1 . 2]" 1
1667 1 41 GLN QE 1 47 LYS QG . . 5.340 3.377 2.913 3.777 . 0 0 "[ . 1 . 2]" 1
1668 1 42 GLU H 1 42 GLU QB . . 2.950 2.466 2.372 2.718 . 0 0 "[ . 1 . 2]" 1
1669 1 42 GLU H 1 42 GLU QG . . 2.880 2.376 2.100 2.529 . 0 0 "[ . 1 . 2]" 1
1670 1 42 GLU H 1 43 ARG QB . . 4.290 4.142 4.013 4.249 . 0 0 "[ . 1 . 2]" 1
1671 1 42 GLU HA 1 42 GLU QB . . 2.590 2.332 2.167 2.392 . 0 0 "[ . 1 . 2]" 1
1672 1 42 GLU HA 1 42 GLU QG . . 3.380 2.723 2.320 3.339 . 0 0 "[ . 1 . 2]" 1
1673 1 42 GLU QG 1 43 ARG H . . 4.050 3.699 2.030 4.052 0.002 13 0 "[ . 1 . 2]" 1
1674 1 43 ARG H 1 43 ARG QB . . 2.980 2.243 2.187 2.342 . 0 0 "[ . 1 . 2]" 1
1675 1 43 ARG H 1 43 ARG QG . . 3.360 2.694 2.433 3.355 . 0 0 "[ . 1 . 2]" 1
1676 1 43 ARG HA 1 43 ARG QB . . 2.630 2.472 2.429 2.488 . 0 0 "[ . 1 . 2]" 1
1677 1 43 ARG QB 1 43 ARG QD . . 2.950 2.157 2.053 2.368 . 0 0 "[ . 1 . 2]" 1
1678 1 43 ARG QB 1 44 ALA H . . 3.130 2.751 2.469 2.875 . 0 0 "[ . 1 . 2]" 1
1679 1 43 ARG QB 1 45 GLY H . . 5.340 4.462 4.335 4.585 . 0 0 "[ . 1 . 2]" 1
1680 1 43 ARG QG 1 44 ALA H . . 4.440 4.371 4.234 4.436 . 0 0 "[ . 1 . 2]" 1
1681 1 44 ALA MB 1 79 MET QB . . 4.320 3.787 3.371 4.075 . 0 0 "[ . 1 . 2]" 1
1682 1 44 ALA MB 1 79 MET QG . . 5.340 3.981 3.488 4.465 . 0 0 "[ . 1 . 2]" 1
1683 1 45 GLY QA 1 72 LYS QD . . 3.980 3.047 2.394 3.661 . 0 0 "[ . 1 . 2]" 1
1684 1 46 VAL MG1 1 69 ASP QB . . 4.580 3.305 3.159 3.446 . 0 0 "[ . 1 . 2]" 1
1685 1 46 VAL MG1 1 72 LYS QG . . 5.110 3.652 3.349 3.868 . 0 0 "[ . 1 . 2]" 1
1686 1 46 VAL MG1 1 72 LYS QD . . 4.300 2.832 2.544 3.077 . 0 0 "[ . 1 . 2]" 1
1687 1 47 LYS HA 1 47 LYS QG . . 3.520 2.291 2.230 2.339 . 0 0 "[ . 1 . 2]" 1
1688 1 47 LYS QE 1 47 LYS QG . . 3.310 2.209 2.055 2.529 . 0 0 "[ . 1 . 2]" 1
1689 1 47 LYS QG 1 49 VAL MG2 . . 3.460 2.670 2.426 2.881 . 0 0 "[ . 1 . 2]" 1
1690 1 48 MET ME 1 79 MET QB . . 3.850 3.187 2.942 3.626 . 0 0 "[ . 1 . 2]" 1
1691 1 49 VAL HA 1 50 MET QB . . 5.080 4.257 4.156 4.386 . 0 0 "[ . 1 . 2]" 1
1692 1 49 VAL MG1 1 50 MET QB . . 5.060 4.096 3.953 4.271 . 0 0 "[ . 1 . 2]" 1
1693 1 49 VAL MG1 1 65 ARG QD . . 4.890 4.104 3.772 4.448 . 0 0 "[ . 1 . 2]" 1
1694 1 50 MET QB 1 51 ILE H . . 4.420 3.261 3.046 3.415 . 0 0 "[ . 1 . 2]" 1
1695 1 52 GLN H 1 52 GLN QG . . 4.350 3.583 1.843 4.219 . 0 0 "[ . 1 . 2]" 1
1696 1 52 GLN HA 1 52 GLN QG . . 3.540 2.631 2.243 3.444 . 0 0 "[ . 1 . 2]" 1
1697 1 52 GLN HA 1 62 LYS QE . . 5.340 4.686 3.831 5.289 . 0 0 "[ . 1 . 2]" 1
1698 1 52 GLN QB 1 52 GLN QG . . 2.100 2.043 1.969 2.086 . 0 0 "[ . 1 . 2]" 1
1699 1 52 GLN QG 1 62 LYS QD . . 4.390 3.558 1.974 4.380 . 0 0 "[ . 1 . 2]" 1
1700 1 54 GLY QA 1 55 PRO QG . . 4.630 3.762 3.650 4.063 . 0 0 "[ . 1 . 2]" 1
1701 1 54 GLY QA 1 55 PRO QD . . 2.670 1.998 1.877 2.283 . 0 0 "[ . 1 . 2]" 1
1702 1 55 PRO QB 1 58 THR MG . . 3.950 2.958 2.078 3.952 0.002 16 0 "[ . 1 . 2]" 1
1703 1 59 GLY QA 1 60 ALA HA . . 4.910 3.990 3.931 4.337 . 0 0 "[ . 1 . 2]" 1
1704 1 59 GLY QA 1 60 ALA MB . . 3.890 3.658 3.459 3.888 . 0 0 "[ . 1 . 2]" 1
1705 1 60 ALA HA 1 61 ASP QB . . 5.150 4.529 3.984 5.147 . 0 0 "[ . 1 . 2]" 1
1706 1 60 ALA MB 1 61 ASP QB . . 4.830 4.251 3.391 4.840 0.010 11 0 "[ . 1 . 2]" 1
1707 1 61 ASP H 1 61 ASP QB . . 3.370 3.046 2.238 3.398 0.028 16 0 "[ . 1 . 2]" 1
1708 1 61 ASP QB 1 62 LYS H . . 3.370 2.650 2.203 3.325 . 0 0 "[ . 1 . 2]" 1
1709 1 62 LYS QE 1 62 LYS QG . . 3.310 2.190 2.036 2.483 . 0 0 "[ . 1 . 2]" 1
1710 1 65 ARG QD 1 67 THR MG . . 4.670 3.048 2.366 4.075 . 0 0 "[ . 1 . 2]" 1
1711 1 68 GLY HA3 1 69 ASP QB . . 4.720 4.128 4.057 4.251 . 0 0 "[ . 1 . 2]" 1
1712 1 69 ASP H 1 72 LYS QD . . 4.750 3.919 3.389 4.407 . 0 0 "[ . 1 . 2]" 1
1713 1 69 ASP QB 1 70 PRO HD2 . . 4.010 2.285 1.989 3.296 . 0 0 "[ . 1 . 2]" 1
1714 1 69 ASP QB 1 70 PRO HD3 . . 4.490 3.559 3.359 4.178 . 0 0 "[ . 1 . 2]" 1
1715 1 69 ASP QB 1 71 TYR H . . 5.340 2.483 2.346 2.899 . 0 0 "[ . 1 . 2]" 1
1716 1 69 ASP QB 1 72 LYS H . . 4.150 2.352 2.144 2.478 . 0 0 "[ . 1 . 2]" 1
1717 1 69 ASP QB 1 72 LYS HA . . 5.060 4.317 4.168 4.449 . 0 0 "[ . 1 . 2]" 1
1718 1 69 ASP QB 1 72 LYS HB3 . . 4.380 3.623 3.372 3.797 . 0 0 "[ . 1 . 2]" 1
1719 1 69 ASP QB 1 72 LYS QG . . 3.730 1.916 1.844 2.025 . 0 0 "[ . 1 . 2]" 1
1720 1 69 ASP QB 1 72 LYS QD . . 3.510 2.613 2.065 3.091 . 0 0 "[ . 1 . 2]" 1
1721 1 69 ASP QB 1 73 VAL H . . 5.340 3.250 3.131 3.367 . 0 0 "[ . 1 . 2]" 1
1722 1 70 PRO QB 1 71 TYR H . . 4.110 3.267 3.189 3.449 . 0 0 "[ . 1 . 2]" 1
1723 1 70 PRO QB 1 71 TYR QB . . 5.180 4.083 3.985 4.249 . 0 0 "[ . 1 . 2]" 1
1724 1 71 TYR HA 1 74 GLN QG . . 4.050 3.068 2.270 3.911 . 0 0 "[ . 1 . 2]" 1
1725 1 71 TYR QB 1 72 LYS H . . 3.510 2.979 2.898 3.031 . 0 0 "[ . 1 . 2]" 1
1726 1 71 TYR QB 1 72 LYS QG . . 4.270 3.161 3.032 3.285 . 0 0 "[ . 1 . 2]" 1
1727 1 71 TYR QD 1 72 LYS QG . . 4.220 2.925 2.485 3.983 . 0 0 "[ . 1 . 2]" 1
1728 1 71 TYR QD 1 75 GLN QG . . 4.120 3.628 3.212 3.951 . 0 0 "[ . 1 . 2]" 1
1729 1 72 LYS H 1 72 LYS QG . . 3.260 2.401 2.108 2.649 . 0 0 "[ . 1 . 2]" 1
1730 1 72 LYS H 1 72 LYS QD . . 5.040 4.141 3.844 4.355 . 0 0 "[ . 1 . 2]" 1
1731 1 72 LYS HA 1 72 LYS QG . . 3.000 2.466 2.347 2.609 . 0 0 "[ . 1 . 2]" 1
1732 1 72 LYS HA 1 72 LYS QD . . 4.350 4.049 3.704 4.278 . 0 0 "[ . 1 . 2]" 1
1733 1 72 LYS HA 1 75 GLN QG . . 3.700 2.818 2.004 3.451 . 0 0 "[ . 1 . 2]" 1
1734 1 72 LYS HB2 1 72 LYS QG . . 2.610 2.256 2.201 2.334 . 0 0 "[ . 1 . 2]" 1
1735 1 72 LYS QE 1 72 LYS QG . . 3.000 2.202 2.046 2.466 . 0 0 "[ . 1 . 2]" 1
1736 1 74 GLN H 1 74 GLN QG . . 3.630 2.301 2.073 2.509 . 0 0 "[ . 1 . 2]" 1
1737 1 74 GLN HA 1 74 GLN QG . . 3.470 2.968 2.392 3.340 . 0 0 "[ . 1 . 2]" 1
1738 1 74 GLN HA 1 77 LYS QE . . 4.820 3.553 2.663 4.789 . 0 0 "[ . 1 . 2]" 1
1739 1 74 GLN QG 1 75 GLN H . . 4.300 3.159 1.913 4.204 . 0 0 "[ . 1 . 2]" 1
1740 1 75 GLN H 1 75 GLN QG . . 3.210 2.394 2.100 2.725 . 0 0 "[ . 1 . 2]" 1
1741 1 75 GLN H 1 75 GLN QE . . 5.340 4.611 3.218 5.215 . 0 0 "[ . 1 . 2]" 1
1742 1 75 GLN HA 1 75 GLN QG . . 3.280 2.727 2.414 2.911 . 0 0 "[ . 1 . 2]" 1
1743 1 75 GLN HB2 1 75 GLN QG . . 2.310 2.166 2.141 2.223 . 0 0 "[ . 1 . 2]" 1
1744 1 75 GLN QG 1 76 ALA H . . 4.590 3.997 3.571 4.326 . 0 0 "[ . 1 . 2]" 1
1745 1 76 ALA HA 1 79 MET QB . . 3.500 2.451 2.190 2.627 . 0 0 "[ . 1 . 2]" 1
1746 1 76 ALA HA 1 79 MET QG . . 4.260 3.292 2.695 3.848 . 0 0 "[ . 1 . 2]" 1
1747 1 76 ALA MB 1 79 MET QB . . 3.860 3.550 3.394 3.794 . 0 0 "[ . 1 . 2]" 1
1748 1 77 LYS HB3 1 77 LYS QE . . 3.950 2.687 1.985 4.007 0.057 16 0 "[ . 1 . 2]" 1
1749 1 77 LYS QE 1 77 LYS HG2 . . 3.710 2.320 2.097 2.677 . 0 0 "[ . 1 . 2]" 1
1750 1 77 LYS QE 1 77 LYS HG3 . . 3.680 3.212 2.535 3.466 . 0 0 "[ . 1 . 2]" 1
1751 1 77 LYS QD 1 78 GLU QG . . 5.340 4.428 3.989 5.159 . 0 0 "[ . 1 . 2]" 1
1752 1 77 LYS QE 1 81 LEU MD1 . . 3.420 2.926 2.107 3.415 . 0 0 "[ . 1 . 2]" 1
1753 1 78 GLU HA 1 78 GLU QG . . 3.240 2.601 2.289 3.303 0.063 5 0 "[ . 1 . 2]" 1
1754 1 78 GLU QG 1 79 MET H . . 4.050 3.815 2.092 4.051 0.001 16 0 "[ . 1 . 2]" 1
1755 1 78 GLU QG 1 81 LEU MD1 . . 4.610 3.635 2.968 4.514 . 0 0 "[ . 1 . 2]" 1
1756 1 79 MET H 1 79 MET QB . . 3.260 2.256 2.196 2.318 . 0 0 "[ . 1 . 2]" 1
1757 1 79 MET H 1 79 MET QG . . 3.480 2.649 2.528 2.778 . 0 0 "[ . 1 . 2]" 1
1758 1 79 MET HA 1 79 MET QG . . 3.180 2.248 2.133 2.345 . 0 0 "[ . 1 . 2]" 1
1759 1 79 MET QB 1 80 VAL H . . 3.690 2.615 2.416 2.881 . 0 0 "[ . 1 . 2]" 1
1760 1 79 MET QB 1 80 VAL HA . . 5.340 3.875 3.816 3.970 . 0 0 "[ . 1 . 2]" 1
1761 1 79 MET QB 1 80 VAL MG2 . . 3.810 2.945 2.823 3.093 . 0 0 "[ . 1 . 2]" 1
1762 1 79 MET QG 1 80 VAL H . . 4.780 4.296 4.155 4.455 . 0 0 "[ . 1 . 2]" 1
1763 1 79 MET QG 1 80 VAL MG2 . . 5.340 4.777 4.669 4.912 . 0 0 "[ . 1 . 2]" 1
1764 1 80 VAL HA 1 83 LEU QB . . 3.200 2.483 2.405 2.580 . 0 0 "[ . 1 . 2]" 1
1765 1 80 VAL MG1 1 83 LEU QB . . 3.400 3.045 2.798 3.182 . 0 0 "[ . 1 . 2]" 1
1766 1 81 LEU HB2 1 82 GLU QB . . 4.990 4.133 4.009 4.262 . 0 0 "[ . 1 . 2]" 1
1767 1 82 GLU H 1 83 LEU QB . . 4.610 4.206 4.072 4.311 . 0 0 "[ . 1 . 2]" 1
1768 1 82 GLU QB 1 83 LEU H . . 3.490 2.893 2.754 3.083 . 0 0 "[ . 1 . 2]" 1
1769 1 83 LEU QB 1 83 LEU HG . . 2.420 2.167 2.164 2.168 . 0 0 "[ . 1 . 2]" 1
1770 1 83 LEU QB 1 83 LEU MD1 . . 2.960 2.200 2.112 2.310 . 0 0 "[ . 1 . 2]" 1
1771 1 83 LEU QB 1 83 LEU MD2 . . 2.910 2.252 2.168 2.347 . 0 0 "[ . 1 . 2]" 1
1772 1 83 LEU QB 1 84 ILE H . . 3.260 2.605 2.223 2.842 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 15
_Distance_constraint_stats_list.Viol_count 294
_Distance_constraint_stats_list.Viol_total 945.623
_Distance_constraint_stats_list.Viol_max 0.285
_Distance_constraint_stats_list.Viol_rms 0.0701
_Distance_constraint_stats_list.Viol_average_all_restraints 0.1576
_Distance_constraint_stats_list.Viol_average_violations_only 0.1608
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 15 ALA 5.365 0.209 19 0 "[ . 1 . 2]"
1 17 GLN 5.961 0.261 18 0 "[ . 1 . 2]"
1 19 ILE 8.784 0.258 13 0 "[ . 1 . 2]"
1 21 ILE 7.699 0.216 6 0 "[ . 1 . 2]"
1 23 ALA 4.167 0.285 8 0 "[ . 1 . 2]"
1 47 LYS 2.565 0.242 10 0 "[ . 1 . 2]"
1 49 VAL 5.702 0.280 7 0 "[ . 1 . 2]"
1 51 ILE 7.038 0.222 17 0 "[ . 1 . 2]"
1 62 LYS 7.699 0.216 6 0 "[ . 1 . 2]"
1 63 PRO 7.038 0.222 17 0 "[ . 1 . 2]"
1 64 LEU 8.784 0.258 13 0 "[ . 1 . 2]"
1 65 ARG 5.702 0.280 7 0 "[ . 1 . 2]"
1 66 ILE 5.961 0.261 18 0 "[ . 1 . 2]"
1 67 THR 2.565 0.242 10 0 "[ . 1 . 2]"
1 68 GLY 5.365 0.209 19 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 15 ALA O 1 68 GLY H . . 1.800 1.999 1.975 2.009 0.209 19 0 "[ . 1 . 2]" 2
2 1 15 ALA O 1 68 GLY N . . 2.700 2.769 2.709 2.868 0.168 7 0 "[ . 1 . 2]" 2
3 1 17 GLN H 1 66 ILE O . . 1.800 1.936 1.798 2.003 0.203 19 0 "[ . 1 . 2]" 2
4 1 17 GLN N 1 66 ILE O . . 2.700 2.862 2.754 2.961 0.261 18 0 "[ . 1 . 2]" 2
5 1 19 ILE H 1 64 LEU O . . 1.800 2.007 1.968 2.028 0.228 19 0 "[ . 1 . 2]" 2
6 1 19 ILE N 1 64 LEU O . . 2.700 2.932 2.898 2.958 0.258 13 0 "[ . 1 . 2]" 2
7 1 21 ILE H 1 62 LYS O . . 1.800 2.004 1.978 2.015 0.215 15 0 "[ . 1 . 2]" 2
8 1 21 ILE N 1 62 LYS O . . 2.700 2.881 2.819 2.916 0.216 6 0 "[ . 1 . 2]" 2
9 1 51 ILE H 1 63 PRO O . . 1.800 2.006 1.991 2.021 0.221 13 0 "[ . 1 . 2]" 2
10 1 51 ILE N 1 63 PRO O . . 2.700 2.846 2.807 2.922 0.222 17 0 "[ . 1 . 2]" 2
11 1 49 VAL H 1 65 ARG O . . 1.800 1.919 1.809 2.005 0.205 7 0 "[ . 1 . 2]" 2
12 1 49 VAL N 1 65 ARG O . . 2.700 2.866 2.761 2.980 0.280 7 0 "[ . 1 . 2]" 2
13 1 47 LYS H 1 67 THR O . . 1.800 1.878 1.798 2.010 0.210 10 0 "[ . 1 . 2]" 2
14 1 47 LYS N 1 67 THR O . . 2.700 2.750 2.698 2.942 0.242 10 0 "[ . 1 . 2]" 2
15 1 23 ALA H 1 23 ALA HA . . 2.500 2.708 2.666 2.785 0.285 8 0 "[ . 1 . 2]" 2
stop_
save_
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