NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
626338 |
5oun   |
34173 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5oun
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 2014
_Distance_constraint_stats_list.Viol_count 2785
_Distance_constraint_stats_list.Viol_total 3202.225
_Distance_constraint_stats_list.Viol_max 1.143
_Distance_constraint_stats_list.Viol_rms 0.0240
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0040
_Distance_constraint_stats_list.Viol_average_violations_only 0.0575
_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 2 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 MET 2.174 0.340 4 0 "[ . 1 . 2]"
1 5 GLU 4.293 0.340 4 0 "[ . 1 . 2]"
1 6 THR 4.862 0.223 17 0 "[ . 1 . 2]"
1 7 GLU 4.317 0.292 20 0 "[ . 1 . 2]"
1 8 LEU 4.770 0.175 20 0 "[ . 1 . 2]"
1 9 ILE 5.134 0.266 8 0 "[ . 1 . 2]"
1 10 GLU 3.876 0.202 1 0 "[ . 1 . 2]"
1 11 GLY 0.797 0.082 10 0 "[ . 1 . 2]"
1 12 GLU 2.038 0.571 18 1 "[ . 1 . + 2]"
1 13 VAL 5.482 1.143 14 1 "[ . 1 +. 2]"
1 14 VAL 9.403 0.286 10 0 "[ . 1 . 2]"
1 15 GLU 3.607 0.166 13 0 "[ . 1 . 2]"
1 16 ILE 4.321 0.209 10 0 "[ . 1 . 2]"
1 17 GLN 2.827 0.134 11 0 "[ . 1 . 2]"
1 18 ILE 2.751 0.134 11 0 "[ . 1 . 2]"
1 19 ASP 0.617 0.077 3 0 "[ . 1 . 2]"
1 20 ARG 0.687 0.091 10 0 "[ . 1 . 2]"
1 21 SER 1.177 0.196 8 0 "[ . 1 . 2]"
1 22 ILE 2.881 0.296 4 0 "[ . 1 . 2]"
1 23 THR 1.750 0.296 4 0 "[ . 1 . 2]"
1 24 GLY 0.754 0.235 10 0 "[ . 1 . 2]"
1 25 GLY 0.549 0.098 1 0 "[ . 1 . 2]"
1 26 HIS 1.987 0.168 15 0 "[ . 1 . 2]"
1 27 LYS 4.907 0.145 12 0 "[ . 1 . 2]"
1 28 GLN 2.561 0.150 11 0 "[ . 1 . 2]"
1 29 GLY 0.183 0.058 20 0 "[ . 1 . 2]"
1 30 LYS 3.029 0.155 17 0 "[ . 1 . 2]"
1 31 LEU 8.655 0.246 8 0 "[ . 1 . 2]"
1 32 THR 8.754 0.286 10 0 "[ . 1 . 2]"
1 33 ILE 10.687 0.266 8 0 "[ . 1 . 2]"
1 34 LYS 5.505 0.571 18 1 "[ . 1 . + 2]"
1 35 THR 1.893 0.238 18 0 "[ . 1 . 2]"
1 36 THR 0.423 0.065 18 0 "[ . 1 . 2]"
1 37 ASP 0.056 0.030 7 0 "[ . 1 . 2]"
1 38 MET 0.652 0.078 10 0 "[ . 1 . 2]"
1 39 GLU 0.869 0.066 12 0 "[ . 1 . 2]"
1 40 THR 0.427 0.078 10 0 "[ . 1 . 2]"
1 41 ILE 2.418 0.155 17 0 "[ . 1 . 2]"
1 42 TYR 3.325 0.135 19 0 "[ . 1 . 2]"
1 43 GLU 1.134 0.097 5 0 "[ . 1 . 2]"
1 44 LEU 7.410 0.203 2 0 "[ . 1 . 2]"
1 45 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 ASN 2.138 0.127 13 0 "[ . 1 . 2]"
1 47 LYS 1.587 0.137 12 0 "[ . 1 . 2]"
1 48 MET 3.755 0.162 9 0 "[ . 1 . 2]"
1 49 ILE 10.011 0.164 2 0 "[ . 1 . 2]"
1 50 ASP 2.123 0.117 6 0 "[ . 1 . 2]"
1 51 GLY 1.391 0.117 6 0 "[ . 1 . 2]"
1 52 LEU 5.270 0.166 11 0 "[ . 1 . 2]"
1 53 THR 6.965 0.166 11 0 "[ . 1 . 2]"
1 54 LYS 0.731 0.099 15 0 "[ . 1 . 2]"
1 55 GLU 2.333 0.215 19 0 "[ . 1 . 2]"
1 56 LYS 2.242 0.215 19 0 "[ . 1 . 2]"
1 57 VAL 0.893 0.127 14 0 "[ . 1 . 2]"
1 58 LEU 1.684 0.269 14 0 "[ . 1 . 2]"
1 59 ALA 1.397 0.229 14 0 "[ . 1 . 2]"
1 60 GLY 0.846 0.739 14 1 "[ . 1 +. 2]"
1 61 ASP 1.972 1.143 14 1 "[ . 1 +. 2]"
1 62 VAL 5.030 0.232 2 0 "[ . 1 . 2]"
1 63 ILE 3.032 0.129 14 0 "[ . 1 . 2]"
1 64 SER 2.830 0.167 1 0 "[ . 1 . 2]"
1 65 ILE 7.256 0.157 17 0 "[ . 1 . 2]"
1 66 ASP 1.941 0.097 16 0 "[ . 1 . 2]"
1 67 LYS 2.126 0.107 16 0 "[ . 1 . 2]"
1 68 ALA 2.383 0.115 4 0 "[ . 1 . 2]"
1 69 SER 0.633 0.115 4 0 "[ . 1 . 2]"
1 70 GLY 2.953 0.744 14 3 "[ * 1 +. -]"
1 71 LYS 12.253 1.107 4 5 "[ +* 1 **. -]"
1 72 ILE 4.392 0.162 9 0 "[ . 1 . 2]"
1 73 THR 0.773 0.073 15 0 "[ . 1 . 2]"
1 74 LYS 1.147 0.407 15 0 "[ . 1 . 2]"
1 75 LEU 2.535 0.221 15 0 "[ . 1 . 2]"
1 76 GLY 1.712 0.407 15 0 "[ . 1 . 2]"
1 77 ARG 2.096 0.232 2 0 "[ . 1 . 2]"
1 78 SER 0.908 0.109 15 0 "[ . 1 . 2]"
1 79 PHE 2.636 0.210 19 0 "[ . 1 . 2]"
1 80 ALA 2.940 0.267 15 0 "[ . 1 . 2]"
1 81 ARG 2.789 0.267 15 0 "[ . 1 . 2]"
1 82 SER 1.923 0.328 4 0 "[ . 1 . 2]"
1 83 ARG 3.798 0.328 4 0 "[ . 1 . 2]"
1 84 ASP 2.853 0.293 5 0 "[ . 1 . 2]"
1 85 TYR 4.226 0.293 5 0 "[ . 1 . 2]"
1 86 ASP 3.465 0.566 6 1 "[ .+ 1 . 2]"
1 87 ALA 3.194 0.566 6 1 "[ .+ 1 . 2]"
1 88 MET 2.344 0.179 6 0 "[ . 1 . 2]"
1 89 GLY 0.698 0.156 15 0 "[ . 1 . 2]"
1 90 ALA 0.529 0.189 1 0 "[ . 1 . 2]"
1 91 ASP 1.868 0.329 7 0 "[ . 1 . 2]"
1 92 THR 2.298 0.329 7 0 "[ . 1 . 2]"
1 93 ARG 1.427 0.232 18 0 "[ . 1 . 2]"
1 94 PHE 5.632 0.349 2 0 "[ . 1 . 2]"
1 95 VAL 6.113 0.349 2 0 "[ . 1 . 2]"
1 96 GLN 2.033 0.400 7 0 "[ . 1 . 2]"
1 97 CYS 0.950 0.400 7 0 "[ . 1 . 2]"
1 98 PRO 0.658 0.103 18 0 "[ . 1 . 2]"
1 99 GLU 1.270 0.306 16 0 "[ . 1 . 2]"
1 100 GLY 0.586 0.306 16 0 "[ . 1 . 2]"
1 101 GLU 0.523 0.199 8 0 "[ . 1 . 2]"
1 102 LEU 1.030 0.097 11 0 "[ . 1 . 2]"
1 103 GLN 1.307 0.215 20 0 "[ . 1 . 2]"
1 104 LYS 0.956 0.215 20 0 "[ . 1 . 2]"
1 105 ARG 1.237 0.206 1 0 "[ . 1 . 2]"
1 106 LYS 0.615 0.206 1 0 "[ . 1 . 2]"
1 107 THR 0.166 0.094 12 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 4 MET HA 1 5 GLU H 3.030 . 3.030 2.451 2.103 3.277 0.247 19 0 "[ . 1 . 2]" 1
2 1 4 MET HB3 1 5 GLU H 4.210 . 4.210 3.687 1.973 4.329 0.119 4 0 "[ . 1 . 2]" 1
3 1 4 MET HB2 1 5 GLU H 4.210 . 4.210 3.853 2.412 4.382 0.172 4 0 "[ . 1 . 2]" 1
4 1 6 THR H 1 6 THR MG 3.780 . 3.780 3.785 3.657 3.955 0.175 10 0 "[ . 1 . 2]" 1
5 1 5 GLU HB2 1 6 THR H 4.520 . 4.520 3.655 1.872 4.495 . 0 0 "[ . 1 . 2]" 1
6 1 5 GLU HB3 1 6 THR H 4.520 . 4.520 3.742 1.756 4.567 0.047 9 0 "[ . 1 . 2]" 1
7 1 5 GLU QG 1 6 THR H 4.180 . 4.180 3.525 2.354 4.297 0.117 13 0 "[ . 1 . 2]" 1
8 1 6 THR H 1 6 THR HB 3.530 . 3.530 2.790 2.669 2.977 . 0 0 "[ . 1 . 2]" 1
9 1 5 GLU HA 1 6 THR H 2.730 . 2.730 2.353 2.110 2.876 0.146 12 0 "[ . 1 . 2]" 1
10 1 6 THR H 1 7 GLU H 4.630 . 4.630 4.537 4.313 4.646 0.016 14 0 "[ . 1 . 2]" 1
11 1 6 THR MG 1 7 GLU H 3.830 . 3.830 2.145 1.800 2.574 . 0 0 "[ . 1 . 2]" 1
12 1 7 GLU H 1 7 GLU HB2 3.640 . 3.640 2.760 2.354 3.661 0.021 6 0 "[ . 1 . 2]" 1
13 1 7 GLU H 1 7 GLU HB3 3.640 . 3.640 3.315 2.395 3.656 0.016 3 0 "[ . 1 . 2]" 1
14 1 7 GLU H 1 7 GLU HG2 4.440 . 4.440 3.349 1.920 4.416 . 0 0 "[ . 1 . 2]" 1
15 1 6 THR HB 1 7 GLU H 3.510 . 3.510 3.590 3.336 3.733 0.223 17 0 "[ . 1 . 2]" 1
16 1 6 THR HA 1 7 GLU H 2.700 . 2.700 2.310 2.187 2.488 . 0 0 "[ . 1 . 2]" 1
17 1 8 LEU H 1 8 LEU MD1 4.290 . 4.290 4.122 3.991 4.214 . 0 0 "[ . 1 . 2]" 1
18 1 8 LEU H 1 8 LEU HB2 3.840 . 3.840 2.675 2.603 2.730 . 0 0 "[ . 1 . 2]" 1
19 1 8 LEU H 1 8 LEU HG 3.110 . 3.110 2.897 2.665 3.048 . 0 0 "[ . 1 . 2]" 1
20 1 7 GLU HB3 1 8 LEU H 4.520 . 4.520 3.828 3.547 4.342 . 0 0 "[ . 1 . 2]" 1
21 1 7 GLU HA 1 8 LEU H 2.740 . 2.740 2.109 2.071 2.129 . 0 0 "[ . 1 . 2]" 1
22 1 6 THR HB 1 8 LEU H 4.900 . 4.900 4.916 4.792 4.991 0.091 15 0 "[ . 1 . 2]" 1
23 1 7 GLU H 1 8 LEU H 4.370 . 4.370 4.347 4.283 4.418 0.048 5 0 "[ . 1 . 2]" 1
24 1 8 LEU H 1 9 ILE H 4.550 . 4.550 4.365 4.282 4.437 . 0 0 "[ . 1 . 2]" 1
25 1 9 ILE H 1 9 ILE MG 3.830 . 3.830 2.026 1.943 2.106 . 0 0 "[ . 1 . 2]" 1
26 1 9 ILE H 1 9 ILE HB 3.620 . 3.620 3.174 3.113 3.259 . 0 0 "[ . 1 . 2]" 1
27 1 9 ILE H 1 10 GLU HB3 5.680 . 5.680 4.902 4.810 5.116 . 0 0 "[ . 1 . 2]" 1
28 1 9 ILE H 1 66 ASP HA 4.430 . 4.430 4.143 3.965 4.357 . 0 0 "[ . 1 . 2]" 1
29 1 8 LEU HA 1 9 ILE H 2.940 . 2.940 2.165 2.122 2.232 . 0 0 "[ . 1 . 2]" 1
30 1 9 ILE H 1 64 SER HA 4.970 . 4.970 4.506 4.296 4.782 . 0 0 "[ . 1 . 2]" 1
31 1 9 ILE H 1 65 ILE H 3.690 . 3.690 2.785 2.551 3.133 . 0 0 "[ . 1 . 2]" 1
32 1 9 ILE MD 1 10 GLU H 4.260 . 4.260 2.186 1.935 3.003 . 0 0 "[ . 1 . 2]" 1
33 1 10 GLU H 1 33 ILE MG 4.490 . 4.490 4.094 3.766 4.384 . 0 0 "[ . 1 . 2]" 1
34 1 10 GLU H 1 10 GLU HB2 3.920 . 3.920 3.800 3.749 3.869 . 0 0 "[ . 1 . 2]" 1
35 1 10 GLU H 1 10 GLU HB3 3.740 . 3.740 3.430 3.328 3.534 . 0 0 "[ . 1 . 2]" 1
36 1 10 GLU H 1 10 GLU HG2 3.660 . 3.660 2.450 2.187 2.753 . 0 0 "[ . 1 . 2]" 1
37 1 10 GLU H 1 10 GLU HG3 4.070 . 4.070 2.784 2.376 2.975 . 0 0 "[ . 1 . 2]" 1
38 1 9 ILE HA 1 10 GLU H 2.710 . 2.710 2.131 2.086 2.172 . 0 0 "[ . 1 . 2]" 1
39 1 9 ILE H 1 10 GLU H 4.450 . 4.450 4.323 4.270 4.366 . 0 0 "[ . 1 . 2]" 1
40 1 10 GLU H 1 65 ILE H 4.980 . 4.980 4.667 4.598 4.764 . 0 0 "[ . 1 . 2]" 1
41 1 10 GLU H 1 11 GLY H 4.520 . 4.520 4.355 4.314 4.401 . 0 0 "[ . 1 . 2]" 1
42 1 11 GLY H 1 63 ILE MD 4.170 . 4.170 3.254 3.012 3.529 . 0 0 "[ . 1 . 2]" 1
43 1 11 GLY H 1 13 VAL QG 4.980 . 4.980 4.846 4.714 5.019 0.039 14 0 "[ . 1 . 2]" 1
44 1 11 GLY H 1 63 ILE HG12 4.980 . 4.980 4.522 4.195 4.910 . 0 0 "[ . 1 . 2]" 1
45 1 11 GLY H 1 33 ILE HG12 4.540 . 4.540 3.986 3.711 4.181 . 0 0 "[ . 1 . 2]" 1
46 1 10 GLU HB3 1 11 GLY H 3.960 . 3.960 3.791 3.620 3.923 . 0 0 "[ . 1 . 2]" 1
47 1 10 GLU HB2 1 11 GLY H 3.630 . 3.630 2.779 2.583 2.997 . 0 0 "[ . 1 . 2]" 1
48 1 10 GLU HG3 1 11 GLY H 4.620 . 4.620 4.283 4.015 4.465 . 0 0 "[ . 1 . 2]" 1
49 1 11 GLY H 1 62 VAL HA 4.480 . 4.480 4.034 3.788 4.215 . 0 0 "[ . 1 . 2]" 1
50 1 10 GLU HA 1 11 GLY H 2.890 . 2.890 2.246 2.179 2.289 . 0 0 "[ . 1 . 2]" 1
51 1 11 GLY H 1 63 ILE H 3.570 . 3.570 2.827 2.670 2.961 . 0 0 "[ . 1 . 2]" 1
52 1 12 GLU H 1 33 ILE MD 6.000 . 6.000 5.021 4.734 5.183 . 0 0 "[ . 1 . 2]" 1
53 1 12 GLU H 1 63 ILE MD 6.000 . 6.000 5.430 5.113 5.653 . 0 0 "[ . 1 . 2]" 1
54 1 12 GLU H 1 62 VAL MG2 5.470 . 5.470 3.850 3.260 4.261 . 0 0 "[ . 1 . 2]" 1
55 1 12 GLU H 1 13 VAL QG 5.720 . 5.720 5.102 5.005 5.166 . 0 0 "[ . 1 . 2]" 1
56 1 12 GLU H 1 33 ILE HG12 4.890 . 4.890 4.245 3.794 4.444 . 0 0 "[ . 1 . 2]" 1
57 1 12 GLU H 1 35 THR MG 5.530 . 5.530 4.940 4.356 5.416 . 0 0 "[ . 1 . 2]" 1
58 1 12 GLU H 1 34 LYS HB3 4.560 . 4.560 3.261 2.594 4.407 . 0 0 "[ . 1 . 2]" 1
59 1 12 GLU H 1 34 LYS HB2 4.100 . 4.100 3.698 2.610 4.671 0.571 18 1 "[ . 1 . + 2]" 1
60 1 12 GLU H 1 12 GLU HB2 3.510 . 3.510 2.726 2.655 2.799 . 0 0 "[ . 1 . 2]" 1
61 1 12 GLU H 1 12 GLU HB3 3.760 . 3.760 2.478 2.372 2.569 . 0 0 "[ . 1 . 2]" 1
62 1 12 GLU H 1 12 GLU HG3 4.740 . 4.740 4.557 4.513 4.590 . 0 0 "[ . 1 . 2]" 1
63 1 12 GLU H 1 34 LYS H 4.020 . 4.020 3.109 2.750 3.363 . 0 0 "[ . 1 . 2]" 1
64 1 13 VAL H 1 60 GLY H 4.100 . 4.100 3.497 3.340 3.641 . 0 0 "[ . 1 . 2]" 1
65 1 13 VAL H 1 62 VAL H 5.270 . 5.270 4.848 4.632 5.080 . 0 0 "[ . 1 . 2]" 1
66 1 12 GLU H 1 13 VAL H 4.630 . 4.630 4.485 4.296 4.546 . 0 0 "[ . 1 . 2]" 1
67 1 12 GLU HA 1 13 VAL H 3.240 . 3.240 2.153 2.039 2.215 . 0 0 "[ . 1 . 2]" 1
68 1 13 VAL H 1 62 VAL HA 3.950 . 3.950 3.266 2.984 3.466 . 0 0 "[ . 1 . 2]" 1
69 1 13 VAL H 1 13 VAL HB 3.560 . 3.560 2.550 2.461 3.088 . 0 0 "[ . 1 . 2]" 1
70 1 12 GLU HG3 1 13 VAL H 3.870 . 3.870 3.116 2.787 3.465 . 0 0 "[ . 1 . 2]" 1
71 1 12 GLU HG2 1 13 VAL H 3.870 . 3.870 2.979 2.634 3.405 . 0 0 "[ . 1 . 2]" 1
72 1 13 VAL H 1 33 ILE HG12 4.920 . 4.920 4.160 3.726 4.297 . 0 0 "[ . 1 . 2]" 1
73 1 13 VAL H 1 13 VAL QG 3.100 . 3.100 2.173 1.651 2.319 . 0 0 "[ . 1 . 2]" 1
74 1 13 VAL H 1 33 ILE MG 5.540 . 5.540 5.222 4.840 5.464 . 0 0 "[ . 1 . 2]" 1
75 1 13 VAL H 1 63 ILE MG 6.000 . 6.000 4.839 4.537 5.086 . 0 0 "[ . 1 . 2]" 1
76 1 13 VAL H 1 63 ILE MD 4.330 . 4.330 3.874 3.177 4.097 . 0 0 "[ . 1 . 2]" 1
77 1 14 VAL H 1 14 VAL MG2 3.900 . 3.900 2.933 1.981 3.815 . 0 0 "[ . 1 . 2]" 1
78 1 14 VAL H 1 33 ILE HG13 4.740 . 4.740 4.143 4.023 4.273 . 0 0 "[ . 1 . 2]" 1
79 1 14 VAL H 1 14 VAL HB 3.830 . 3.830 3.340 2.486 3.751 . 0 0 "[ . 1 . 2]" 1
80 1 13 VAL HA 1 14 VAL H 3.210 . 3.210 2.116 2.078 2.146 . 0 0 "[ . 1 . 2]" 1
81 1 14 VAL H 1 32 THR HB 4.310 . 4.310 3.474 3.306 3.701 . 0 0 "[ . 1 . 2]" 1
82 1 14 VAL H 1 15 GLU HA 5.140 . 5.140 4.789 4.659 4.949 . 0 0 "[ . 1 . 2]" 1
83 1 14 VAL H 1 33 ILE HA 3.810 . 3.810 2.745 2.615 2.819 . 0 0 "[ . 1 . 2]" 1
84 1 14 VAL H 1 32 THR H 4.750 . 4.750 4.311 4.118 4.475 . 0 0 "[ . 1 . 2]" 1
85 1 14 VAL H 1 34 LYS H 4.200 . 4.200 3.699 3.478 3.894 . 0 0 "[ . 1 . 2]" 1
86 1 15 GLU H 1 16 ILE MD 6.000 . 6.000 5.231 5.127 5.421 . 0 0 "[ . 1 . 2]" 1
87 1 15 GLU H 1 32 THR MG 3.870 . 3.870 3.584 3.411 3.824 . 0 0 "[ . 1 . 2]" 1
88 1 15 GLU H 1 59 ALA MB 4.790 . 4.790 4.324 3.595 4.593 . 0 0 "[ . 1 . 2]" 1
89 1 15 GLU H 1 15 GLU HB2 3.960 . 3.960 3.065 2.776 3.257 . 0 0 "[ . 1 . 2]" 1
90 1 15 GLU H 1 15 GLU HB3 3.850 . 3.850 3.256 2.985 3.777 . 0 0 "[ . 1 . 2]" 1
91 1 13 VAL HA 1 15 GLU H 3.950 . 3.950 3.635 3.468 3.715 . 0 0 "[ . 1 . 2]" 1
92 1 15 GLU H 1 32 THR HB 3.560 . 3.560 2.284 2.034 2.648 . 0 0 "[ . 1 . 2]" 1
93 1 15 GLU H 1 33 ILE HA 4.620 . 4.620 4.391 4.327 4.488 . 0 0 "[ . 1 . 2]" 1
94 1 15 GLU H 1 32 THR HA 5.280 . 5.280 4.679 4.537 4.929 . 0 0 "[ . 1 . 2]" 1
95 1 15 GLU H 1 16 ILE H 4.430 . 4.430 4.295 4.263 4.337 . 0 0 "[ . 1 . 2]" 1
96 1 14 VAL H 1 15 GLU H 3.280 . 3.280 2.118 1.987 2.322 . 0 0 "[ . 1 . 2]" 1
97 1 13 VAL H 1 15 GLU H 6.000 . 6.000 6.016 5.841 6.065 0.065 13 0 "[ . 1 . 2]" 1
98 1 15 GLU H 1 34 LYS H 6.000 . 6.000 5.706 5.528 5.878 . 0 0 "[ . 1 . 2]" 1
99 1 16 ILE H 1 16 ILE MG 4.000 . 4.000 3.886 3.860 3.910 . 0 0 "[ . 1 . 2]" 1
100 1 16 ILE H 1 16 ILE HB 3.510 . 3.510 2.804 2.750 2.854 . 0 0 "[ . 1 . 2]" 1
101 1 15 GLU HB2 1 16 ILE H 4.320 . 4.320 4.066 3.942 4.190 . 0 0 "[ . 1 . 2]" 1
102 1 15 GLU HB3 1 16 ILE H 3.550 . 3.550 3.365 2.636 3.626 0.076 14 0 "[ . 1 . 2]" 1
103 1 15 GLU HG2 1 16 ILE H 4.100 . 4.100 2.905 1.916 3.816 . 0 0 "[ . 1 . 2]" 1
104 1 15 GLU HG3 1 16 ILE H 4.100 . 4.100 3.407 2.343 4.266 0.166 13 0 "[ . 1 . 2]" 1
105 1 16 ILE H 1 32 THR HB 5.310 . 5.310 5.052 5.007 5.124 . 0 0 "[ . 1 . 2]" 1
106 1 15 GLU HA 1 16 ILE H 2.900 . 2.900 2.223 2.182 2.289 . 0 0 "[ . 1 . 2]" 1
107 1 16 ILE H 1 31 LEU HA 5.740 . 5.740 5.244 5.058 5.499 . 0 0 "[ . 1 . 2]" 1
108 1 17 GLN H 1 31 LEU HA 4.090 . 4.090 3.359 2.984 3.698 . 0 0 "[ . 1 . 2]" 1
109 1 16 ILE HA 1 17 GLN H 2.940 . 2.940 2.156 2.136 2.178 . 0 0 "[ . 1 . 2]" 1
110 1 17 GLN H 1 17 GLN HG3 4.870 . 4.870 4.418 4.294 4.563 . 0 0 "[ . 1 . 2]" 1
111 1 17 GLN H 1 17 GLN HB3 3.550 . 3.550 2.610 2.487 2.860 . 0 0 "[ . 1 . 2]" 1
112 1 17 GLN H 1 17 GLN HB2 3.550 . 3.550 3.000 2.802 3.175 . 0 0 "[ . 1 . 2]" 1
113 1 17 GLN H 1 30 LYS QB 3.810 . 3.810 3.386 3.004 3.882 0.072 16 0 "[ . 1 . 2]" 1
114 1 17 GLN H 1 18 ILE HG12 4.040 . 4.040 4.003 3.869 4.078 0.038 20 0 "[ . 1 . 2]" 1
115 1 17 GLN H 1 18 ILE H 4.330 . 4.330 4.176 4.061 4.305 . 0 0 "[ . 1 . 2]" 1
116 1 17 GLN H 1 30 LYS H 3.600 . 3.600 3.169 2.946 3.440 . 0 0 "[ . 1 . 2]" 1
117 1 18 ILE H 1 18 ILE HG13 4.570 . 4.570 4.235 4.094 4.355 . 0 0 "[ . 1 . 2]" 1
118 1 18 ILE H 1 18 ILE HG12 4.000 . 4.000 2.936 2.718 3.098 . 0 0 "[ . 1 . 2]" 1
119 1 16 ILE HB 1 18 ILE H 6.000 . 6.000 5.473 5.266 5.834 . 0 0 "[ . 1 . 2]" 1
120 1 18 ILE H 1 18 ILE HB 3.420 . 3.420 2.657 2.573 2.768 . 0 0 "[ . 1 . 2]" 1
121 1 17 GLN HB2 1 18 ILE H 4.660 . 4.660 4.401 4.236 4.546 . 0 0 "[ . 1 . 2]" 1
122 1 17 GLN HB3 1 18 ILE H 4.660 . 4.660 4.342 4.246 4.419 . 0 0 "[ . 1 . 2]" 1
123 1 17 GLN HG2 1 18 ILE H 4.820 . 4.820 4.879 4.673 4.954 0.134 11 0 "[ . 1 . 2]" 1
124 1 17 GLN HA 1 18 ILE H 2.890 . 2.890 2.150 2.121 2.174 . 0 0 "[ . 1 . 2]" 1
125 1 18 ILE H 1 30 LYS H 5.330 . 5.330 4.730 4.625 4.795 . 0 0 "[ . 1 . 2]" 1
126 1 19 ASP H 1 30 LYS H 5.190 . 5.190 4.807 4.512 5.227 0.037 10 0 "[ . 1 . 2]" 1
127 1 18 ILE H 1 19 ASP H 4.370 . 4.370 4.254 4.079 4.415 0.045 10 0 "[ . 1 . 2]" 1
128 1 19 ASP H 1 29 GLY H 5.510 . 5.510 5.092 4.866 5.439 . 0 0 "[ . 1 . 2]" 1
129 1 19 ASP H 1 29 GLY HA3 4.000 . 4.000 3.695 3.251 4.039 0.039 17 0 "[ . 1 . 2]" 1
130 1 18 ILE HA 1 19 ASP H 2.960 . 2.960 2.146 2.117 2.273 . 0 0 "[ . 1 . 2]" 1
131 1 19 ASP H 1 29 GLY HA2 4.000 . 4.000 3.050 2.778 3.391 . 0 0 "[ . 1 . 2]" 1
132 1 19 ASP H 1 19 ASP HB3 3.480 . 3.480 2.661 2.190 3.557 0.077 3 0 "[ . 1 . 2]" 1
133 1 19 ASP H 1 19 ASP HB2 3.480 . 3.480 2.575 2.256 3.494 0.014 1 0 "[ . 1 . 2]" 1
134 1 19 ASP H 1 28 GLN QG 4.700 . 4.700 3.867 3.429 4.227 . 0 0 "[ . 1 . 2]" 1
135 1 18 ILE HB 1 19 ASP H 4.480 . 4.480 4.269 3.934 4.387 . 0 0 "[ . 1 . 2]" 1
136 1 18 ILE HG12 1 19 ASP H 5.210 . 5.210 5.088 4.924 5.157 . 0 0 "[ . 1 . 2]" 1
137 1 18 ILE MG 1 19 ASP H 3.290 . 3.290 2.825 2.221 3.053 . 0 0 "[ . 1 . 2]" 1
138 1 18 ILE MD 1 19 ASP H 4.140 . 4.140 3.652 3.475 3.852 . 0 0 "[ . 1 . 2]" 1
139 1 17 GLN HA 1 17 GLN HE21 4.760 . 4.760 3.264 1.626 4.767 0.007 12 0 "[ . 1 . 2]" 1
140 1 17 GLN HA 1 17 GLN HE22 4.760 . 4.760 3.749 3.202 4.569 . 0 0 "[ . 1 . 2]" 1
141 1 20 ARG H 1 20 ARG HG2 4.370 . 4.370 3.107 2.497 4.461 0.091 10 0 "[ . 1 . 2]" 1
142 1 20 ARG H 1 20 ARG QD 4.580 . 4.580 3.433 2.113 4.051 . 0 0 "[ . 1 . 2]" 1
143 1 19 ASP HA 1 20 ARG H 2.930 . 2.930 2.174 2.099 2.291 . 0 0 "[ . 1 . 2]" 1
144 1 20 ARG H 1 21 SER H 3.500 . 3.500 2.570 1.900 2.892 . 0 0 "[ . 1 . 2]" 1
145 1 19 ASP H 1 20 ARG H 4.760 . 4.760 4.511 4.362 4.640 . 0 0 "[ . 1 . 2]" 1
146 1 21 SER H 1 22 ILE H 4.240 . 4.240 2.117 1.760 3.387 . 0 0 "[ . 1 . 2]" 1
147 1 20 ARG HA 1 21 SER H 3.050 . 3.050 2.941 2.847 3.111 0.061 1 0 "[ . 1 . 2]" 1
148 1 21 SER H 1 21 SER HB3 3.580 . 3.580 3.071 2.566 3.776 0.196 8 0 "[ . 1 . 2]" 1
149 1 21 SER H 1 21 SER HB2 3.580 . 3.580 3.009 2.494 3.702 0.122 10 0 "[ . 1 . 2]" 1
150 1 20 ARG QD 1 21 SER H 4.800 . 4.800 4.581 4.391 4.733 . 0 0 "[ . 1 . 2]" 1
151 1 19 ASP HB3 1 21 SER H 5.160 . 5.160 3.616 2.514 4.476 . 0 0 "[ . 1 . 2]" 1
152 1 19 ASP HB2 1 21 SER H 5.160 . 5.160 4.385 2.892 4.644 . 0 0 "[ . 1 . 2]" 1
153 1 21 SER H 1 22 ILE HB 4.910 . 4.910 4.326 4.025 4.921 0.011 14 0 "[ . 1 . 2]" 1
154 1 21 SER H 1 22 ILE MD 4.880 . 4.880 3.880 2.318 4.412 . 0 0 "[ . 1 . 2]" 1
155 1 19 ASP HA 1 21 SER H 4.070 . 4.070 3.713 3.519 3.960 . 0 0 "[ . 1 . 2]" 1
156 1 22 ILE H 1 22 ILE MG 3.930 . 3.930 3.784 3.741 3.905 . 0 0 "[ . 1 . 2]" 1
157 1 22 ILE H 1 22 ILE HG12 3.950 . 3.950 2.374 1.856 3.918 . 0 0 "[ . 1 . 2]" 1
158 1 22 ILE H 1 22 ILE HG13 3.950 . 3.950 3.623 3.269 4.121 0.171 8 0 "[ . 1 . 2]" 1
159 1 22 ILE H 1 22 ILE HB 3.510 . 3.510 2.579 2.459 2.788 . 0 0 "[ . 1 . 2]" 1
160 1 22 ILE MG 1 23 THR H 3.870 . 3.870 2.834 2.009 3.944 0.074 2 0 "[ . 1 . 2]" 1
161 1 22 ILE MD 1 23 THR H 4.720 . 4.720 3.915 3.440 4.786 0.066 13 0 "[ . 1 . 2]" 1
162 1 23 THR H 1 23 THR MG 3.910 . 3.910 3.213 1.961 3.966 0.056 4 0 "[ . 1 . 2]" 1
163 1 22 ILE HB 1 23 THR H 4.300 . 4.300 4.053 2.250 4.414 0.114 20 0 "[ . 1 . 2]" 1
164 1 22 ILE HA 1 23 THR H 3.180 . 3.180 2.271 2.063 3.476 0.296 4 0 "[ . 1 . 2]" 1
165 1 26 HIS H 1 27 LYS H 4.640 . 4.640 3.624 2.824 4.405 . 0 0 "[ . 1 . 2]" 1
166 1 26 HIS H 1 26 HIS HB2 4.110 . 4.110 3.008 2.336 3.962 . 0 0 "[ . 1 . 2]" 1
167 1 26 HIS H 1 26 HIS HB3 4.110 . 4.110 3.347 2.531 4.111 0.001 19 0 "[ . 1 . 2]" 1
168 1 26 HIS H 1 26 HIS HD2 5.960 . 5.960 4.325 1.841 5.839 . 0 0 "[ . 1 . 2]" 1
169 1 27 LYS H 1 46 ASN HD21 5.120 . 5.120 3.073 2.089 4.166 . 0 0 "[ . 1 . 2]" 1
170 1 27 LYS H 1 49 ILE MD 4.640 . 4.640 4.481 4.099 4.755 0.115 3 0 "[ . 1 . 2]" 1
171 1 27 LYS H 1 49 ILE MG 5.130 . 5.130 5.059 4.646 5.259 0.129 10 0 "[ . 1 . 2]" 1
172 1 27 LYS H 1 27 LYS HG2 3.820 . 3.820 3.295 3.069 3.600 . 0 0 "[ . 1 . 2]" 1
173 1 27 LYS H 1 27 LYS HG3 3.610 . 3.610 2.207 1.783 2.674 . 0 0 "[ . 1 . 2]" 1
174 1 27 LYS H 1 27 LYS HB2 3.340 . 3.340 2.588 2.470 2.709 . 0 0 "[ . 1 . 2]" 1
175 1 26 HIS HB2 1 27 LYS H 4.540 . 4.540 4.433 4.106 4.614 0.074 11 0 "[ . 1 . 2]" 1
176 1 26 HIS HB3 1 27 LYS H 4.540 . 4.540 4.293 3.539 4.616 0.076 4 0 "[ . 1 . 2]" 1
177 1 26 HIS HA 1 27 LYS H 2.990 . 2.990 2.322 2.081 2.708 . 0 0 "[ . 1 . 2]" 1
178 1 28 GLN H 1 49 ILE HG12 6.000 . 6.000 3.748 3.182 4.251 . 0 0 "[ . 1 . 2]" 1
179 1 22 ILE MD 1 28 GLN H 5.520 . 5.520 3.509 2.286 5.105 . 0 0 "[ . 1 . 2]" 1
180 1 27 LYS HG2 1 28 GLN H 4.680 . 4.680 4.360 4.081 4.672 . 0 0 "[ . 1 . 2]" 1
181 1 27 LYS HB2 1 28 GLN H 3.700 . 3.700 3.712 3.520 3.807 0.107 3 0 "[ . 1 . 2]" 1
182 1 27 LYS HB3 1 28 GLN H 3.570 . 3.570 2.736 2.447 3.061 . 0 0 "[ . 1 . 2]" 1
183 1 28 GLN H 1 28 GLN HB3 3.940 . 3.940 3.367 3.120 3.503 . 0 0 "[ . 1 . 2]" 1
184 1 28 GLN H 1 28 GLN QG 3.520 . 3.520 2.357 2.139 2.538 . 0 0 "[ . 1 . 2]" 1
185 1 19 ASP HB2 1 28 GLN H 5.100 . 5.100 4.634 3.444 5.168 0.068 2 0 "[ . 1 . 2]" 1
186 1 19 ASP HB3 1 28 GLN H 5.100 . 5.100 3.595 2.876 5.119 0.019 3 0 "[ . 1 . 2]" 1
187 1 27 LYS HA 1 28 GLN H 2.870 . 2.870 2.300 2.192 2.387 . 0 0 "[ . 1 . 2]" 1
188 1 28 GLN H 1 28 GLN HE21 5.110 . 5.110 4.760 4.165 5.151 0.041 7 0 "[ . 1 . 2]" 1
189 1 27 LYS H 1 28 GLN H 4.760 . 4.760 4.583 4.522 4.634 . 0 0 "[ . 1 . 2]" 1
190 1 19 ASP H 1 28 GLN H 4.630 . 4.630 4.235 3.854 4.645 0.015 13 0 "[ . 1 . 2]" 1
191 1 22 ILE MD 1 28 GLN HE22 5.110 . 5.110 4.281 2.582 4.985 . 0 0 "[ . 1 . 2]" 1
192 1 28 GLN HE22 1 28 GLN QG 3.630 . 3.630 3.425 3.292 3.490 . 0 0 "[ . 1 . 2]" 1
193 1 22 ILE MD 1 28 GLN HE21 4.860 . 4.860 4.012 2.095 4.886 0.026 17 0 "[ . 1 . 2]" 1
194 1 28 GLN HE21 1 28 GLN QG 3.250 . 3.250 2.621 2.219 2.811 . 0 0 "[ . 1 . 2]" 1
195 1 28 GLN HA 1 28 GLN HE21 4.750 . 4.750 4.388 4.133 4.900 0.150 11 0 "[ . 1 . 2]" 1
196 1 28 GLN HB2 1 29 GLY H 3.930 . 3.930 2.661 2.383 2.901 . 0 0 "[ . 1 . 2]" 1
197 1 28 GLN HB3 1 29 GLY H 3.930 . 3.930 3.840 3.702 3.988 0.058 20 0 "[ . 1 . 2]" 1
198 1 28 GLN QG 1 29 GLY H 4.120 . 4.120 3.823 3.548 4.082 . 0 0 "[ . 1 . 2]" 1
199 1 28 GLN HA 1 29 GLY H 3.270 . 3.270 2.304 2.225 2.422 . 0 0 "[ . 1 . 2]" 1
200 1 29 GLY H 1 44 LEU H 3.650 . 3.650 2.909 2.665 3.349 . 0 0 "[ . 1 . 2]" 1
201 1 30 LYS H 1 44 LEU H 5.070 . 5.070 4.794 4.453 5.131 0.061 3 0 "[ . 1 . 2]" 1
202 1 29 GLY H 1 30 LYS H 4.450 . 4.450 4.360 4.327 4.378 . 0 0 "[ . 1 . 2]" 1
203 1 17 GLN HA 1 30 LYS H 5.040 . 5.040 4.455 4.264 4.565 . 0 0 "[ . 1 . 2]" 1
204 1 29 GLY HA3 1 30 LYS H 3.560 . 3.560 2.610 2.445 2.840 . 0 0 "[ . 1 . 2]" 1
205 1 18 ILE HA 1 30 LYS H 4.240 . 4.240 3.569 3.247 3.773 . 0 0 "[ . 1 . 2]" 1
206 1 29 GLY HA2 1 30 LYS H 3.560 . 3.560 2.484 2.283 2.663 . 0 0 "[ . 1 . 2]" 1
207 1 16 ILE MG 1 30 LYS H 5.250 . 5.250 4.724 4.499 5.014 . 0 0 "[ . 1 . 2]" 1
208 1 18 ILE HG13 1 30 LYS H 6.000 . 6.000 5.946 5.668 6.093 0.093 1 0 "[ . 1 . 2]" 1
209 1 30 LYS H 1 30 LYS HG3 5.260 . 5.260 4.637 4.563 4.723 . 0 0 "[ . 1 . 2]" 1
210 1 18 ILE HG12 1 30 LYS H 5.100 . 5.100 4.648 4.396 4.798 . 0 0 "[ . 1 . 2]" 1
211 1 30 LYS H 1 30 LYS HG2 5.620 . 5.620 4.865 4.651 4.994 . 0 0 "[ . 1 . 2]" 1
212 1 30 LYS H 1 30 LYS QB 3.670 . 3.670 2.488 2.293 2.623 . 0 0 "[ . 1 . 2]" 1
213 1 17 GLN HB2 1 30 LYS H 4.270 . 4.270 4.246 3.781 4.367 0.097 19 0 "[ . 1 . 2]" 1
214 1 17 GLN HB3 1 30 LYS H 4.270 . 4.270 2.593 2.066 2.854 . 0 0 "[ . 1 . 2]" 1
215 1 17 GLN HG2 1 30 LYS H 5.130 . 5.130 4.365 3.812 4.793 . 0 0 "[ . 1 . 2]" 1
216 1 17 GLN HG3 1 30 LYS H 5.130 . 5.130 3.637 3.130 4.542 . 0 0 "[ . 1 . 2]" 1
217 1 31 LEU H 1 41 ILE MG 3.770 . 3.770 3.322 3.077 3.546 . 0 0 "[ . 1 . 2]" 1
218 1 31 LEU H 1 31 LEU MD1 5.290 . 5.290 4.240 3.765 4.383 . 0 0 "[ . 1 . 2]" 1
219 1 31 LEU H 1 31 LEU HB2 3.960 . 3.960 2.826 2.573 3.077 . 0 0 "[ . 1 . 2]" 1
220 1 30 LYS QB 1 31 LEU H 4.030 . 4.030 3.765 3.626 3.851 . 0 0 "[ . 1 . 2]" 1
221 1 31 LEU H 1 31 LEU HB3 4.030 . 4.030 2.599 2.352 2.772 . 0 0 "[ . 1 . 2]" 1
222 1 31 LEU H 1 42 TYR HB3 5.930 . 5.930 5.117 4.975 5.352 . 0 0 "[ . 1 . 2]" 1
223 1 31 LEU H 1 42 TYR HB2 5.160 . 5.160 3.954 3.789 4.222 . 0 0 "[ . 1 . 2]" 1
224 1 31 LEU H 1 43 GLU HA 4.270 . 4.270 3.466 3.098 4.091 . 0 0 "[ . 1 . 2]" 1
225 1 31 LEU H 1 42 TYR HA 5.740 . 5.740 4.884 4.718 5.137 . 0 0 "[ . 1 . 2]" 1
226 1 31 LEU H 1 44 LEU HA 6.000 . 6.000 5.578 5.143 5.977 . 0 0 "[ . 1 . 2]" 1
227 1 31 LEU H 1 42 TYR QD 5.560 . 5.560 5.105 4.788 5.399 . 0 0 "[ . 1 . 2]" 1
228 1 31 LEU H 1 42 TYR H 4.330 . 4.330 3.220 3.093 3.498 . 0 0 "[ . 1 . 2]" 1
229 1 13 VAL QG 1 32 THR H 4.300 . 4.300 3.580 3.496 3.734 . 0 0 "[ . 1 . 2]" 1
230 1 31 LEU MD1 1 32 THR H 4.380 . 4.380 2.392 1.921 3.078 . 0 0 "[ . 1 . 2]" 1
231 1 32 THR H 1 32 THR MG 3.990 . 3.990 3.831 3.796 3.865 . 0 0 "[ . 1 . 2]" 1
232 1 31 LEU HB2 1 32 THR H 4.460 . 4.460 4.229 4.049 4.497 0.037 17 0 "[ . 1 . 2]" 1
233 1 31 LEU HG 1 32 THR H 4.940 . 4.940 3.566 2.457 4.900 . 0 0 "[ . 1 . 2]" 1
234 1 30 LYS QB 1 32 THR H 5.470 . 5.470 5.246 4.570 5.525 0.055 13 0 "[ . 1 . 2]" 1
235 1 15 GLU HB2 1 32 THR H 4.690 . 4.690 4.407 3.656 4.728 0.038 18 0 "[ . 1 . 2]" 1
236 1 31 LEU HB3 1 32 THR H 5.120 . 5.120 4.081 3.981 4.307 . 0 0 "[ . 1 . 2]" 1
237 1 15 GLU HB3 1 32 THR H 4.400 . 4.400 3.398 3.064 4.137 . 0 0 "[ . 1 . 2]" 1
238 1 32 THR H 1 32 THR HB 3.680 . 3.680 2.607 2.562 2.682 . 0 0 "[ . 1 . 2]" 1
239 1 16 ILE HA 1 32 THR H 3.990 . 3.990 3.521 3.410 3.607 . 0 0 "[ . 1 . 2]" 1
240 1 31 LEU HA 1 32 THR H 3.130 . 3.130 2.175 2.132 2.201 . 0 0 "[ . 1 . 2]" 1
241 1 15 GLU H 1 32 THR H 3.730 . 3.730 3.139 2.984 3.263 . 0 0 "[ . 1 . 2]" 1
242 1 17 GLN H 1 32 THR H 4.580 . 4.580 4.574 4.307 4.695 0.115 19 0 "[ . 1 . 2]" 1
243 1 31 LEU H 1 32 THR H 5.060 . 5.060 4.432 4.319 4.489 . 0 0 "[ . 1 . 2]" 1
244 1 32 THR H 1 33 ILE H 4.650 . 4.650 4.316 4.257 4.359 . 0 0 "[ . 1 . 2]" 1
245 1 32 THR H 1 42 TYR H 5.400 . 5.400 4.812 4.731 4.873 . 0 0 "[ . 1 . 2]" 1
246 1 32 THR MG 1 33 ILE H 3.490 . 3.490 2.949 2.848 3.099 . 0 0 "[ . 1 . 2]" 1
247 1 33 ILE H 1 41 ILE HG12 5.780 . 5.780 4.598 4.399 4.933 . 0 0 "[ . 1 . 2]" 1
248 1 33 ILE H 1 33 ILE HG12 4.700 . 4.700 4.581 4.503 4.674 . 0 0 "[ . 1 . 2]" 1
249 1 31 LEU HG 1 33 ILE H 5.560 . 5.560 4.813 3.903 5.806 0.246 8 0 "[ . 1 . 2]" 1
250 1 33 ILE H 1 41 ILE HG13 5.780 . 5.780 5.171 4.939 5.514 . 0 0 "[ . 1 . 2]" 1
251 1 33 ILE H 1 33 ILE HB 3.840 . 3.840 2.491 2.454 2.521 . 0 0 "[ . 1 . 2]" 1
252 1 33 ILE H 1 40 THR HB 5.050 . 5.050 4.504 4.254 4.700 . 0 0 "[ . 1 . 2]" 1
253 1 32 THR HB 1 33 ILE H 4.950 . 4.950 4.238 4.172 4.311 . 0 0 "[ . 1 . 2]" 1
254 1 33 ILE H 1 41 ILE HA 4.250 . 4.250 3.313 3.178 3.450 . 0 0 "[ . 1 . 2]" 1
255 1 32 THR HA 1 33 ILE H 3.250 . 3.250 2.169 2.151 2.198 . 0 0 "[ . 1 . 2]" 1
256 1 33 ILE H 1 40 THR H 3.920 . 3.920 3.248 3.088 3.347 . 0 0 "[ . 1 . 2]" 1
257 1 33 ILE H 1 34 LYS H 4.810 . 4.810 4.382 4.351 4.407 . 0 0 "[ . 1 . 2]" 1
258 1 33 ILE H 1 42 TYR H 5.230 . 5.230 4.263 3.983 4.489 . 0 0 "[ . 1 . 2]" 1
259 1 33 ILE HG13 1 34 LYS H 4.370 . 4.370 4.285 4.098 4.411 0.041 16 0 "[ . 1 . 2]" 1
260 1 33 ILE HG12 1 34 LYS H 4.210 . 4.210 3.423 3.242 3.551 . 0 0 "[ . 1 . 2]" 1
261 1 34 LYS H 1 34 LYS QG 4.500 . 4.500 3.532 2.678 4.018 . 0 0 "[ . 1 . 2]" 1
262 1 34 LYS H 1 34 LYS HB3 3.620 . 3.620 3.000 2.397 3.588 . 0 0 "[ . 1 . 2]" 1
263 1 34 LYS H 1 34 LYS HB2 3.740 . 3.740 2.442 2.255 2.932 . 0 0 "[ . 1 . 2]" 1
264 1 12 GLU HB3 1 34 LYS H 4.480 . 4.480 3.438 3.253 3.655 . 0 0 "[ . 1 . 2]" 1
265 1 13 VAL HA 1 34 LYS H 4.720 . 4.720 3.653 3.401 3.861 . 0 0 "[ . 1 . 2]" 1
266 1 33 ILE HA 1 34 LYS H 3.180 . 3.180 2.136 2.095 2.173 . 0 0 "[ . 1 . 2]" 1
267 1 11 GLY H 1 34 LYS H 6.000 . 6.000 5.991 5.826 6.082 0.082 10 0 "[ . 1 . 2]" 1
268 1 34 LYS H 1 35 THR H 4.800 . 4.800 4.383 4.320 4.437 . 0 0 "[ . 1 . 2]" 1
269 1 35 THR H 1 35 THR MG 3.350 . 3.350 2.464 2.361 2.558 . 0 0 "[ . 1 . 2]" 1
270 1 34 LYS HB3 1 35 THR H 4.040 . 4.040 3.904 3.435 4.278 0.238 18 0 "[ . 1 . 2]" 1
271 1 34 LYS HB2 1 35 THR H 4.910 . 4.910 4.425 4.176 4.534 . 0 0 "[ . 1 . 2]" 1
272 1 35 THR H 1 39 GLU HB2 5.410 . 5.410 5.031 4.747 5.231 . 0 0 "[ . 1 . 2]" 1
273 1 35 THR H 1 39 GLU HB3 4.650 . 4.650 4.303 3.899 4.603 . 0 0 "[ . 1 . 2]" 1
274 1 34 LYS HA 1 35 THR H 3.040 . 3.040 2.162 2.107 2.208 . 0 0 "[ . 1 . 2]" 1
275 1 12 GLU H 1 35 THR H 5.800 . 5.800 5.156 4.845 5.480 . 0 0 "[ . 1 . 2]" 1
276 1 36 THR H 1 38 MET H 5.070 . 5.070 4.422 4.332 4.516 . 0 0 "[ . 1 . 2]" 1
277 1 35 THR H 1 36 THR H 4.880 . 4.880 4.416 4.382 4.452 . 0 0 "[ . 1 . 2]" 1
278 1 35 THR HB 1 36 THR H 3.520 . 3.520 1.970 1.851 2.074 . 0 0 "[ . 1 . 2]" 1
279 1 36 THR H 1 36 THR HB 3.820 . 3.820 2.654 2.562 2.753 . 0 0 "[ . 1 . 2]" 1
280 1 36 THR MG 1 37 ASP H 3.920 . 3.920 3.732 3.510 3.937 0.017 11 0 "[ . 1 . 2]" 1
281 1 37 ASP H 1 38 MET HB3 5.770 . 5.770 5.407 4.999 5.664 . 0 0 "[ . 1 . 2]" 1
282 1 37 ASP H 1 38 MET QG 4.850 . 4.850 4.315 3.902 4.781 . 0 0 "[ . 1 . 2]" 1
283 1 37 ASP H 1 37 ASP HB2 4.080 . 4.080 2.832 2.304 3.866 . 0 0 "[ . 1 . 2]" 1
284 1 37 ASP H 1 37 ASP HB3 4.080 . 4.080 3.107 2.365 3.695 . 0 0 "[ . 1 . 2]" 1
285 1 36 THR HB 1 37 ASP H 3.590 . 3.590 2.761 2.551 2.953 . 0 0 "[ . 1 . 2]" 1
286 1 35 THR HB 1 37 ASP H 3.870 . 3.870 3.193 2.962 3.410 . 0 0 "[ . 1 . 2]" 1
287 1 37 ASP H 1 38 MET H 3.190 . 3.190 2.428 2.046 2.767 . 0 0 "[ . 1 . 2]" 1
288 1 35 THR H 1 37 ASP H 4.970 . 4.970 4.444 4.123 4.835 . 0 0 "[ . 1 . 2]" 1
289 1 35 THR H 1 38 MET H 3.860 . 3.860 3.331 3.080 3.531 . 0 0 "[ . 1 . 2]" 1
290 1 38 MET H 1 39 GLU H 4.410 . 4.410 4.400 4.352 4.433 0.023 10 0 "[ . 1 . 2]" 1
291 1 38 MET H 1 39 GLU HA 4.820 . 4.820 4.725 4.636 4.808 . 0 0 "[ . 1 . 2]" 1
292 1 36 THR HB 1 38 MET H 5.480 . 5.480 5.174 4.917 5.303 . 0 0 "[ . 1 . 2]" 1
293 1 36 THR HA 1 38 MET H 5.210 . 5.210 5.215 5.102 5.275 0.065 18 0 "[ . 1 . 2]" 1
294 1 37 ASP HB2 1 38 MET H 4.620 . 4.620 3.250 2.333 4.053 . 0 0 "[ . 1 . 2]" 1
295 1 38 MET H 1 38 MET QG 3.680 . 3.680 2.564 2.466 2.719 . 0 0 "[ . 1 . 2]" 1
296 1 38 MET H 1 38 MET HB2 4.170 . 4.170 3.971 3.926 4.048 . 0 0 "[ . 1 . 2]" 1
297 1 38 MET H 1 38 MET HB3 3.650 . 3.650 3.409 3.283 3.494 . 0 0 "[ . 1 . 2]" 1
298 1 39 GLU H 1 40 THR H 4.770 . 4.770 4.427 4.334 4.496 . 0 0 "[ . 1 . 2]" 1
299 1 38 MET HA 1 39 GLU H 2.900 . 2.900 2.443 2.228 2.508 . 0 0 "[ . 1 . 2]" 1
300 1 38 MET QG 1 39 GLU H 4.120 . 4.120 3.463 3.311 3.985 . 0 0 "[ . 1 . 2]" 1
301 1 38 MET HB2 1 39 GLU H 3.420 . 3.420 2.362 2.240 2.956 . 0 0 "[ . 1 . 2]" 1
302 1 39 GLU H 1 39 GLU HB3 3.470 . 3.470 2.883 2.759 3.053 . 0 0 "[ . 1 . 2]" 1
303 1 39 GLU H 1 39 GLU HB2 3.650 . 3.650 3.649 3.591 3.687 0.037 10 0 "[ . 1 . 2]" 1
304 1 32 THR MG 1 40 THR H 4.380 . 4.380 3.961 3.719 4.283 . 0 0 "[ . 1 . 2]" 1
305 1 35 THR MG 1 40 THR H 4.760 . 4.760 3.377 3.083 3.826 . 0 0 "[ . 1 . 2]" 1
306 1 33 ILE HB 1 40 THR H 4.900 . 4.900 4.352 4.168 4.530 . 0 0 "[ . 1 . 2]" 1
307 1 39 GLU HB2 1 40 THR H 4.120 . 4.120 3.326 3.248 3.413 . 0 0 "[ . 1 . 2]" 1
308 1 39 GLU HB3 1 40 THR H 4.680 . 4.680 4.158 4.092 4.205 . 0 0 "[ . 1 . 2]" 1
309 1 39 GLU HG3 1 40 THR H 5.310 . 5.310 4.839 4.391 5.341 0.031 9 0 "[ . 1 . 2]" 1
310 1 40 THR H 1 40 THR HB 3.810 . 3.810 2.724 2.608 2.799 . 0 0 "[ . 1 . 2]" 1
311 1 38 MET HA 1 40 THR H 6.000 . 6.000 5.973 5.873 6.078 0.078 10 0 "[ . 1 . 2]" 1
312 1 39 GLU HA 1 40 THR H 3.140 . 3.140 2.103 2.068 2.144 . 0 0 "[ . 1 . 2]" 1
313 1 40 THR H 1 42 TYR QE 5.420 . 5.420 3.696 3.352 4.067 . 0 0 "[ . 1 . 2]" 1
314 1 40 THR H 1 41 ILE H 4.780 . 4.780 4.481 4.438 4.505 . 0 0 "[ . 1 . 2]" 1
315 1 35 THR H 1 40 THR H 4.560 . 4.560 3.934 3.716 4.289 . 0 0 "[ . 1 . 2]" 1
316 1 34 LYS H 1 40 THR H 5.390 . 5.390 5.019 4.841 5.185 . 0 0 "[ . 1 . 2]" 1
317 1 32 THR HA 1 40 THR H 5.460 . 5.460 4.778 4.619 4.875 . 0 0 "[ . 1 . 2]" 1
318 1 40 THR MG 1 41 ILE H 3.510 . 3.510 2.052 1.985 2.120 . 0 0 "[ . 1 . 2]" 1
319 1 41 ILE H 1 41 ILE HG12 4.480 . 4.480 3.778 3.676 3.861 . 0 0 "[ . 1 . 2]" 1
320 1 41 ILE H 1 41 ILE HB 3.600 . 3.600 2.540 2.410 2.613 . 0 0 "[ . 1 . 2]" 1
321 1 41 ILE H 1 41 ILE HG13 4.480 . 4.480 2.647 2.500 2.815 . 0 0 "[ . 1 . 2]" 1
322 1 40 THR HA 1 41 ILE H 3.270 . 3.270 2.360 2.307 2.417 . 0 0 "[ . 1 . 2]" 1
323 1 41 ILE H 1 42 TYR H 5.400 . 5.400 4.423 4.331 4.468 . 0 0 "[ . 1 . 2]" 1
324 1 32 THR HA 1 42 TYR H 4.120 . 4.120 3.396 3.241 3.526 . 0 0 "[ . 1 . 2]" 1
325 1 41 ILE HA 1 42 TYR H 3.410 . 3.410 2.136 2.091 2.176 . 0 0 "[ . 1 . 2]" 1
326 1 42 TYR H 1 42 TYR HB3 4.130 . 4.130 3.791 3.727 3.841 . 0 0 "[ . 1 . 2]" 1
327 1 31 LEU HB3 1 42 TYR H 4.280 . 4.280 3.326 2.858 3.639 . 0 0 "[ . 1 . 2]" 1
328 1 43 GLU H 1 43 GLU HB2 3.630 . 3.630 2.449 2.396 2.496 . 0 0 "[ . 1 . 2]" 1
329 1 43 GLU H 1 43 GLU HB3 3.630 . 3.630 3.623 3.580 3.659 0.029 15 0 "[ . 1 . 2]" 1
330 1 43 GLU H 1 43 GLU HG2 3.970 . 3.970 3.620 3.363 3.768 . 0 0 "[ . 1 . 2]" 1
331 1 43 GLU H 1 43 GLU HG3 3.940 . 3.940 2.507 2.336 2.650 . 0 0 "[ . 1 . 2]" 1
332 1 42 TYR HB3 1 43 GLU H 4.330 . 4.330 3.034 2.879 3.233 . 0 0 "[ . 1 . 2]" 1
333 1 42 TYR HB2 1 43 GLU H 4.060 . 4.060 3.958 3.836 4.036 . 0 0 "[ . 1 . 2]" 1
334 1 42 TYR HA 1 43 GLU H 3.160 . 3.160 2.211 2.186 2.255 . 0 0 "[ . 1 . 2]" 1
335 1 43 GLU H 1 44 LEU H 4.710 . 4.710 4.541 4.439 4.585 . 0 0 "[ . 1 . 2]" 1
336 1 42 TYR H 1 43 GLU H 4.670 . 4.670 4.426 4.367 4.495 . 0 0 "[ . 1 . 2]" 1
337 1 44 LEU H 1 49 ILE MD 4.990 . 4.990 4.145 3.673 4.504 . 0 0 "[ . 1 . 2]" 1
338 1 44 LEU H 1 44 LEU MD2 4.220 . 4.220 2.915 1.956 3.894 . 0 0 "[ . 1 . 2]" 1
339 1 44 LEU H 1 44 LEU HB3 3.480 . 3.480 3.568 3.474 3.683 0.203 2 0 "[ . 1 . 2]" 1
340 1 43 GLU HG2 1 44 LEU H 4.170 . 4.170 4.201 4.121 4.267 0.097 5 0 "[ . 1 . 2]" 1
341 1 43 GLU HG3 1 44 LEU H 5.080 . 5.080 5.022 4.895 5.113 0.033 8 0 "[ . 1 . 2]" 1
342 1 43 GLU HA 1 44 LEU H 2.980 . 2.980 2.183 2.123 2.257 . 0 0 "[ . 1 . 2]" 1
343 1 30 LYS HA 1 44 LEU H 3.870 . 3.870 3.402 2.879 3.744 . 0 0 "[ . 1 . 2]" 1
344 1 44 LEU H 1 45 GLY H 4.710 . 4.710 4.405 4.312 4.517 . 0 0 "[ . 1 . 2]" 1
345 1 44 LEU HB3 1 45 GLY H 4.750 . 4.750 3.361 3.009 3.581 . 0 0 "[ . 1 . 2]" 1
346 1 45 GLY H 1 48 MET HB2 4.880 . 4.880 2.092 1.894 2.454 . 0 0 "[ . 1 . 2]" 1
347 1 45 GLY H 1 48 MET HB3 4.880 . 4.880 3.509 3.280 3.934 . 0 0 "[ . 1 . 2]" 1
348 1 44 LEU HA 1 45 GLY H 3.460 . 3.460 2.143 2.105 2.180 . 0 0 "[ . 1 . 2]" 1
349 1 46 ASN H 1 46 ASN QB 3.890 . 3.890 2.245 2.188 2.413 . 0 0 "[ . 1 . 2]" 1
350 1 25 GLY QA 1 46 ASN HD21 5.290 . 5.290 4.018 2.657 5.354 0.064 19 0 "[ . 1 . 2]" 1
351 1 25 GLY QA 1 46 ASN HD22 5.290 . 5.290 3.719 2.238 5.200 . 0 0 "[ . 1 . 2]" 1
352 1 46 ASN HA 1 46 ASN HD22 5.040 . 5.040 4.231 3.720 4.601 . 0 0 "[ . 1 . 2]" 1
353 1 27 LYS H 1 46 ASN HD22 5.120 . 5.120 3.579 1.923 4.452 . 0 0 "[ . 1 . 2]" 1
354 1 47 LYS H 1 48 MET H 4.680 . 4.680 2.605 2.530 2.693 . 0 0 "[ . 1 . 2]" 1
355 1 47 LYS H 1 47 LYS HG3 5.700 . 5.700 3.959 3.413 4.473 . 0 0 "[ . 1 . 2]" 1
356 1 47 LYS H 1 47 LYS HG2 5.700 . 5.700 3.251 1.990 4.630 . 0 0 "[ . 1 . 2]" 1
357 1 48 MET H 1 49 ILE MD 4.870 . 4.870 3.949 3.799 4.129 . 0 0 "[ . 1 . 2]" 1
358 1 48 MET H 1 72 ILE MD 4.520 . 4.520 4.140 3.864 4.432 . 0 0 "[ . 1 . 2]" 1
359 1 26 HIS H 1 27 LYS HG2 5.170 . 5.170 5.006 4.063 5.315 0.145 12 0 "[ . 1 . 2]" 1
360 1 47 LYS HG2 1 48 MET H 4.860 . 4.860 4.478 4.019 4.938 0.078 13 0 "[ . 1 . 2]" 1
361 1 47 LYS HG3 1 48 MET H 4.860 . 4.860 4.527 3.707 4.971 0.111 10 0 "[ . 1 . 2]" 1
362 1 47 LYS QD 1 48 MET H 5.110 . 5.110 4.802 4.419 5.247 0.137 12 0 "[ . 1 . 2]" 1
363 1 48 MET H 1 48 MET HB2 3.640 . 3.640 2.283 2.227 2.425 . 0 0 "[ . 1 . 2]" 1
364 1 47 LYS HB2 1 48 MET H 4.270 . 4.270 3.239 2.597 4.058 . 0 0 "[ . 1 . 2]" 1
365 1 48 MET H 1 48 MET HB3 3.640 . 3.640 3.549 3.519 3.588 . 0 0 "[ . 1 . 2]" 1
366 1 45 GLY H 1 48 MET H 4.610 . 4.610 3.342 3.165 3.540 . 0 0 "[ . 1 . 2]" 1
367 1 48 MET H 1 49 ILE H 3.350 . 3.350 2.746 2.649 2.873 . 0 0 "[ . 1 . 2]" 1
368 1 48 MET H 1 50 ASP H 4.480 . 4.480 4.026 3.918 4.143 . 0 0 "[ . 1 . 2]" 1
369 1 49 ILE H 1 49 ILE HG12 4.290 . 4.290 4.068 4.018 4.117 . 0 0 "[ . 1 . 2]" 1
370 1 49 ILE H 1 52 LEU MD2 4.120 . 4.120 3.686 3.572 3.767 . 0 0 "[ . 1 . 2]" 1
371 1 49 ILE H 1 49 ILE HB 3.260 . 3.260 2.365 2.309 2.406 . 0 0 "[ . 1 . 2]" 1
372 1 49 ILE H 1 52 LEU HG 4.380 . 4.380 4.299 4.217 4.384 0.004 6 0 "[ . 1 . 2]" 1
373 1 48 MET HB3 1 49 ILE H 4.320 . 4.320 3.213 3.020 3.418 . 0 0 "[ . 1 . 2]" 1
374 1 49 ILE H 1 50 ASP HB2 5.070 . 5.070 5.086 4.857 5.165 0.095 2 0 "[ . 1 . 2]" 1
375 1 46 ASN HA 1 49 ILE H 4.030 . 4.030 3.662 3.475 3.883 . 0 0 "[ . 1 . 2]" 1
376 1 45 GLY H 1 49 ILE H 4.960 . 4.960 4.194 3.979 4.501 . 0 0 "[ . 1 . 2]" 1
377 1 49 ILE MD 1 50 ASP H 4.510 . 4.510 4.079 3.982 4.152 . 0 0 "[ . 1 . 2]" 1
378 1 49 ILE HG12 1 50 ASP H 5.750 . 5.750 5.095 5.027 5.154 . 0 0 "[ . 1 . 2]" 1
379 1 50 ASP H 1 52 LEU MD1 6.000 . 6.000 5.225 5.120 5.402 . 0 0 "[ . 1 . 2]" 1
380 1 50 ASP H 1 72 ILE MD 6.000 . 6.000 5.006 4.822 5.262 . 0 0 "[ . 1 . 2]" 1
381 1 49 ILE MG 1 50 ASP H 3.550 . 3.550 2.868 2.733 2.986 . 0 0 "[ . 1 . 2]" 1
382 1 49 ILE HB 1 50 ASP H 3.430 . 3.430 2.665 2.573 2.740 . 0 0 "[ . 1 . 2]" 1
383 1 49 ILE HG13 1 50 ASP H 4.980 . 4.980 4.928 4.873 4.970 . 0 0 "[ . 1 . 2]" 1
384 1 50 ASP H 1 50 ASP HB3 3.260 . 3.260 2.606 2.449 2.808 . 0 0 "[ . 1 . 2]" 1
385 1 50 ASP H 1 50 ASP HB2 3.060 . 3.060 2.424 2.252 2.533 . 0 0 "[ . 1 . 2]" 1
386 1 47 LYS HA 1 50 ASP H 3.730 . 3.730 3.513 3.214 3.751 0.021 19 0 "[ . 1 . 2]" 1
387 1 50 ASP H 1 51 GLY H 3.190 . 3.190 2.765 2.665 2.893 . 0 0 "[ . 1 . 2]" 1
388 1 49 ILE H 1 50 ASP H 3.240 . 3.240 2.803 2.749 2.838 . 0 0 "[ . 1 . 2]" 1
389 1 51 GLY H 1 52 LEU H 3.260 . 3.260 2.821 2.785 2.851 . 0 0 "[ . 1 . 2]" 1
390 1 51 GLY H 1 72 ILE MD 3.990 . 3.990 3.085 2.821 3.321 . 0 0 "[ . 1 . 2]" 1
391 1 51 GLY H 1 52 LEU HB3 5.510 . 5.510 5.396 5.338 5.450 . 0 0 "[ . 1 . 2]" 1
392 1 47 LYS QD 1 51 GLY H 6.000 . 6.000 4.902 3.210 5.917 . 0 0 "[ . 1 . 2]" 1
393 1 51 GLY H 1 72 ILE HG12 6.000 . 6.000 5.118 4.919 5.293 . 0 0 "[ . 1 . 2]" 1
394 1 51 GLY H 1 72 ILE HB 5.210 . 5.210 4.675 4.384 5.142 . 0 0 "[ . 1 . 2]" 1
395 1 51 GLY H 1 52 LEU HG 4.490 . 4.490 4.228 4.179 4.355 . 0 0 "[ . 1 . 2]" 1
396 1 51 GLY H 1 54 LYS QB 5.150 . 5.150 4.739 4.436 5.097 . 0 0 "[ . 1 . 2]" 1
397 1 50 ASP HB3 1 51 GLY H 3.660 . 3.660 2.353 2.245 2.498 . 0 0 "[ . 1 . 2]" 1
398 1 50 ASP HB2 1 51 GLY H 3.610 . 3.610 3.674 3.541 3.727 0.117 6 0 "[ . 1 . 2]" 1
399 1 47 LYS HA 1 51 GLY H 4.570 . 4.570 3.908 3.726 4.135 . 0 0 "[ . 1 . 2]" 1
400 1 48 MET HA 1 51 GLY H 3.610 . 3.610 3.350 3.192 3.464 . 0 0 "[ . 1 . 2]" 1
401 1 52 LEU H 1 72 ILE MD 3.180 . 3.180 3.077 2.954 3.231 0.051 11 0 "[ . 1 . 2]" 1
402 1 52 LEU H 1 52 LEU HB3 3.640 . 3.640 2.684 2.645 2.712 . 0 0 "[ . 1 . 2]" 1
403 1 52 LEU H 1 52 LEU HG 3.270 . 3.270 2.132 2.075 2.221 . 0 0 "[ . 1 . 2]" 1
404 1 52 LEU H 1 52 LEU HB2 3.590 . 3.590 3.620 3.613 3.627 0.037 19 0 "[ . 1 . 2]" 1
405 1 50 ASP HB3 1 52 LEU H 5.330 . 5.330 5.042 4.945 5.153 . 0 0 "[ . 1 . 2]" 1
406 1 49 ILE HA 1 52 LEU H 4.060 . 4.060 3.651 3.580 3.755 . 0 0 "[ . 1 . 2]" 1
407 1 48 MET HA 1 52 LEU H 3.990 . 3.990 3.791 3.656 3.898 . 0 0 "[ . 1 . 2]" 1
408 1 52 LEU H 1 53 THR H 3.180 . 3.180 2.597 2.563 2.635 . 0 0 "[ . 1 . 2]" 1
409 1 53 THR H 1 55 GLU H 4.350 . 4.350 4.106 3.920 4.247 . 0 0 "[ . 1 . 2]" 1
410 1 49 ILE MD 1 53 THR H 6.000 . 6.000 6.079 6.012 6.152 0.152 14 0 "[ . 1 . 2]" 1
411 1 52 LEU MD1 1 53 THR H 3.830 . 3.830 2.272 2.227 2.336 . 0 0 "[ . 1 . 2]" 1
412 1 52 LEU HB3 1 53 THR H 3.960 . 3.960 3.996 3.968 4.029 0.069 15 0 "[ . 1 . 2]" 1
413 1 52 LEU HB2 1 53 THR H 3.590 . 3.590 3.729 3.708 3.756 0.166 11 0 "[ . 1 . 2]" 1
414 1 52 LEU HG 1 53 THR H 4.170 . 4.170 2.346 2.264 2.440 . 0 0 "[ . 1 . 2]" 1
415 1 49 ILE HA 1 53 THR H 4.810 . 4.810 3.805 3.724 3.896 . 0 0 "[ . 1 . 2]" 1
416 1 53 THR H 1 53 THR HB 3.260 . 3.260 2.565 2.511 2.654 . 0 0 "[ . 1 . 2]" 1
417 1 53 THR H 1 54 LYS H 3.400 . 3.400 2.734 2.680 2.823 . 0 0 "[ . 1 . 2]" 1
418 1 54 LYS H 1 55 GLU H 3.300 . 3.300 2.725 2.645 2.806 . 0 0 "[ . 1 . 2]" 1
419 1 52 LEU MD1 1 54 LYS H 4.620 . 4.620 4.503 4.444 4.568 . 0 0 "[ . 1 . 2]" 1
420 1 54 LYS H 1 54 LYS QG 4.050 . 4.050 3.515 2.107 4.047 . 0 0 "[ . 1 . 2]" 1
421 1 54 LYS H 1 54 LYS QD 4.260 . 4.260 3.894 3.303 4.170 . 0 0 "[ . 1 . 2]" 1
422 1 54 LYS H 1 54 LYS QB 2.950 . 2.950 2.240 2.071 2.471 . 0 0 "[ . 1 . 2]" 1
423 1 51 GLY HA2 1 54 LYS H 5.250 . 5.250 3.530 3.393 3.736 . 0 0 "[ . 1 . 2]" 1
424 1 52 LEU HA 1 54 LYS H 4.710 . 4.710 4.464 4.365 4.645 . 0 0 "[ . 1 . 2]" 1
425 1 53 THR HB 1 54 LYS H 3.340 . 3.340 2.481 2.412 2.562 . 0 0 "[ . 1 . 2]" 1
426 1 55 GLU H 1 57 VAL H 4.640 . 4.640 4.068 3.795 4.385 . 0 0 "[ . 1 . 2]" 1
427 1 55 GLU H 1 72 ILE MG 4.640 . 4.640 4.465 3.998 4.670 0.030 11 0 "[ . 1 . 2]" 1
428 1 52 LEU MD1 1 55 GLU H 5.360 . 5.360 5.101 4.941 5.222 . 0 0 "[ . 1 . 2]" 1
429 1 53 THR MG 1 55 GLU H 5.140 . 5.140 4.946 4.802 5.066 . 0 0 "[ . 1 . 2]" 1
430 1 55 GLU H 1 56 LYS QG 4.410 . 4.410 4.482 4.442 4.625 0.215 19 0 "[ . 1 . 2]" 1
431 1 54 LYS QG 1 55 GLU H 4.520 . 4.520 4.033 3.630 4.286 . 0 0 "[ . 1 . 2]" 1
432 1 55 GLU H 1 55 GLU HB2 3.650 . 3.650 2.422 2.295 2.536 . 0 0 "[ . 1 . 2]" 1
433 1 54 LYS QB 1 55 GLU H 3.330 . 3.330 2.662 2.468 2.874 . 0 0 "[ . 1 . 2]" 1
434 1 55 GLU H 1 55 GLU HB3 3.650 . 3.650 3.616 3.564 3.675 0.025 19 0 "[ . 1 . 2]" 1
435 1 55 GLU H 1 55 GLU QG 3.340 . 3.340 2.558 2.320 2.951 . 0 0 "[ . 1 . 2]" 1
436 1 52 LEU HA 1 55 GLU H 3.860 . 3.860 3.388 3.270 3.538 . 0 0 "[ . 1 . 2]" 1
437 1 52 LEU MD1 1 56 LYS H 5.130 . 5.130 4.881 4.766 5.068 . 0 0 "[ . 1 . 2]" 1
438 1 56 LYS H 1 56 LYS QG 3.160 . 3.160 2.765 2.716 2.897 . 0 0 "[ . 1 . 2]" 1
439 1 56 LYS H 1 56 LYS HB2 4.060 . 4.060 3.564 3.488 3.629 . 0 0 "[ . 1 . 2]" 1
440 1 56 LYS H 1 56 LYS HB3 4.060 . 4.060 4.044 4.011 4.073 0.013 10 0 "[ . 1 . 2]" 1
441 1 56 LYS H 1 56 LYS HA 2.840 . 2.840 2.261 2.233 2.269 . 0 0 "[ . 1 . 2]" 1
442 1 53 THR HA 1 56 LYS H 3.610 . 3.610 3.419 3.224 3.599 . 0 0 "[ . 1 . 2]" 1
443 1 54 LYS H 1 56 LYS H 4.390 . 4.390 3.853 3.784 3.954 . 0 0 "[ . 1 . 2]" 1
444 1 54 LYS H 1 57 VAL H 5.840 . 5.840 5.525 5.406 5.620 . 0 0 "[ . 1 . 2]" 1
445 1 56 LYS H 1 57 VAL H 3.340 . 3.340 2.780 2.671 2.966 . 0 0 "[ . 1 . 2]" 1
446 1 55 GLU HA 1 57 VAL H 5.440 . 5.440 5.122 4.900 5.475 0.035 4 0 "[ . 1 . 2]" 1
447 1 53 THR HA 1 57 VAL H 4.180 . 4.180 3.804 3.600 3.946 . 0 0 "[ . 1 . 2]" 1
448 1 56 LYS HA 1 57 VAL H 3.110 . 3.110 2.640 2.491 2.757 . 0 0 "[ . 1 . 2]" 1
449 1 57 VAL H 1 57 VAL HB 3.070 . 3.070 2.554 2.492 2.599 . 0 0 "[ . 1 . 2]" 1
450 1 53 THR MG 1 57 VAL H 5.530 . 5.530 5.453 5.262 5.567 0.037 14 0 "[ . 1 . 2]" 1
451 1 52 LEU MD1 1 57 VAL H 4.060 . 4.060 3.910 3.685 4.074 0.014 15 0 "[ . 1 . 2]" 1
452 1 13 VAL QG 1 58 LEU H 4.820 . 4.820 3.960 3.255 4.204 . 0 0 "[ . 1 . 2]" 1
453 1 16 ILE MD 1 58 LEU H 4.130 . 4.130 3.767 3.580 3.911 . 0 0 "[ . 1 . 2]" 1
454 1 58 LEU H 1 63 ILE MG 4.730 . 4.730 4.501 3.745 4.782 0.052 13 0 "[ . 1 . 2]" 1
455 1 58 LEU H 1 59 ALA MB 5.640 . 5.640 5.610 5.469 5.633 . 0 0 "[ . 1 . 2]" 1
456 1 58 LEU H 1 58 LEU QB 3.450 . 3.450 2.837 2.564 3.175 . 0 0 "[ . 1 . 2]" 1
457 1 58 LEU H 1 58 LEU HG 3.510 . 3.510 2.704 2.129 3.183 . 0 0 "[ . 1 . 2]" 1
458 1 57 VAL HB 1 58 LEU H 4.110 . 4.110 4.121 3.954 4.181 0.071 13 0 "[ . 1 . 2]" 1
459 1 13 VAL HB 1 58 LEU H 5.450 . 5.450 5.102 4.879 5.719 0.269 14 0 "[ . 1 . 2]" 1
460 1 58 LEU H 1 61 ASP HB3 4.430 . 4.430 3.650 3.133 3.884 . 0 0 "[ . 1 . 2]" 1
461 1 58 LEU H 1 61 ASP HB2 3.980 . 3.980 2.584 2.281 2.793 . 0 0 "[ . 1 . 2]" 1
462 1 57 VAL HA 1 58 LEU H 2.960 . 2.960 2.136 2.105 2.161 . 0 0 "[ . 1 . 2]" 1
463 1 58 LEU H 1 61 ASP HA 5.660 . 5.660 5.156 4.843 5.373 . 0 0 "[ . 1 . 2]" 1
464 1 57 VAL H 1 58 LEU H 4.630 . 4.630 4.511 4.402 4.562 . 0 0 "[ . 1 . 2]" 1
465 1 58 LEU H 1 61 ASP H 4.550 . 4.550 3.937 3.631 4.194 . 0 0 "[ . 1 . 2]" 1
466 1 13 VAL QG 1 59 ALA H 4.000 . 4.000 3.675 3.189 3.929 . 0 0 "[ . 1 . 2]" 1
467 1 59 ALA H 1 59 ALA MB 2.780 . 2.780 2.241 2.230 2.267 . 0 0 "[ . 1 . 2]" 1
468 1 58 LEU QB 1 59 ALA H 3.200 . 3.200 2.326 2.124 2.692 . 0 0 "[ . 1 . 2]" 1
469 1 16 ILE HB 1 59 ALA H 4.430 . 4.430 4.447 4.335 4.492 0.062 16 0 "[ . 1 . 2]" 1
470 1 58 LEU HA 1 59 ALA H 2.920 . 2.920 2.449 2.304 2.548 . 0 0 "[ . 1 . 2]" 1
471 1 58 LEU H 1 59 ALA H 4.430 . 4.430 4.433 4.374 4.454 0.024 9 0 "[ . 1 . 2]" 1
472 1 59 ALA H 1 60 GLY H 4.630 . 4.630 4.575 4.527 4.612 . 0 0 "[ . 1 . 2]" 1
473 1 13 VAL QG 1 60 GLY H 3.570 . 3.570 2.968 2.019 3.171 . 0 0 "[ . 1 . 2]" 1
474 1 12 GLU HG2 1 60 GLY H 4.810 . 4.810 3.796 3.474 4.156 . 0 0 "[ . 1 . 2]" 1
475 1 12 GLU HG3 1 60 GLY H 4.810 . 4.810 4.325 3.697 4.671 . 0 0 "[ . 1 . 2]" 1
476 1 13 VAL HB 1 60 GLY H 3.760 . 3.760 2.451 2.139 4.499 0.739 14 1 "[ . 1 +. 2]" 1
477 1 59 ALA HA 1 60 GLY H 2.980 . 2.980 2.178 2.150 2.205 . 0 0 "[ . 1 . 2]" 1
478 1 14 VAL HA 1 60 GLY H 4.530 . 4.530 3.936 3.731 4.260 . 0 0 "[ . 1 . 2]" 1
479 1 12 GLU HA 1 60 GLY H 5.690 . 5.690 5.274 4.677 5.543 . 0 0 "[ . 1 . 2]" 1
480 1 60 GLY H 1 61 ASP HA 6.000 . 6.000 5.022 4.941 5.111 . 0 0 "[ . 1 . 2]" 1
481 1 16 ILE MD 1 61 ASP H 5.380 . 5.380 4.819 4.662 4.941 . 0 0 "[ . 1 . 2]" 1
482 1 13 VAL QG 1 61 ASP H 4.040 . 4.040 3.273 1.852 3.500 . 0 0 "[ . 1 . 2]" 1
483 1 13 VAL HB 1 61 ASP H 3.610 . 3.610 2.850 2.497 4.753 1.143 14 1 "[ . 1 +. 2]" 1
484 1 61 ASP H 1 61 ASP HB3 3.710 . 3.710 3.440 2.787 3.622 . 0 0 "[ . 1 . 2]" 1
485 1 61 ASP H 1 61 ASP HB2 3.330 . 3.330 2.335 2.188 2.397 . 0 0 "[ . 1 . 2]" 1
486 1 59 ALA HA 1 61 ASP H 3.810 . 3.810 3.363 3.022 3.513 . 0 0 "[ . 1 . 2]" 1
487 1 58 LEU HA 1 61 ASP H 5.690 . 5.690 5.172 4.958 5.317 . 0 0 "[ . 1 . 2]" 1
488 1 61 ASP H 1 62 VAL HA 6.000 . 6.000 5.336 5.147 5.419 . 0 0 "[ . 1 . 2]" 1
489 1 59 ALA H 1 61 ASP H 4.840 . 4.840 4.659 4.566 4.726 . 0 0 "[ . 1 . 2]" 1
490 1 60 GLY H 1 61 ASP H 3.340 . 3.340 2.588 2.408 2.687 . 0 0 "[ . 1 . 2]" 1
491 1 13 VAL H 1 61 ASP H 4.240 . 4.240 3.813 3.533 4.007 . 0 0 "[ . 1 . 2]" 1
492 1 62 VAL H 1 62 VAL MG1 4.250 . 4.250 3.740 1.997 3.863 . 0 0 "[ . 1 . 2]" 1
493 1 62 VAL H 1 63 ILE MG 4.550 . 4.550 3.685 3.594 3.912 . 0 0 "[ . 1 . 2]" 1
494 1 62 VAL H 1 62 VAL MG2 4.250 . 4.250 2.694 2.388 3.850 . 0 0 "[ . 1 . 2]" 1
495 1 62 VAL H 1 75 LEU HB2 6.000 . 6.000 4.908 4.465 5.431 . 0 0 "[ . 1 . 2]" 1
496 1 62 VAL H 1 62 VAL HB 3.400 . 3.400 2.621 2.521 3.040 . 0 0 "[ . 1 . 2]" 1
497 1 61 ASP HB3 1 62 VAL H 3.820 . 3.820 2.724 2.439 3.469 . 0 0 "[ . 1 . 2]" 1
498 1 61 ASP HB2 1 62 VAL H 4.090 . 4.090 3.902 3.721 4.068 . 0 0 "[ . 1 . 2]" 1
499 1 61 ASP HA 1 62 VAL H 3.150 . 3.150 2.315 2.252 2.406 . 0 0 "[ . 1 . 2]" 1
500 1 62 VAL H 1 76 GLY H 4.940 . 4.940 3.258 2.792 5.109 0.169 15 0 "[ . 1 . 2]" 1
501 1 61 ASP H 1 62 VAL H 4.730 . 4.730 4.593 4.568 4.614 . 0 0 "[ . 1 . 2]" 1
502 1 63 ILE H 1 63 ILE MD 3.890 . 3.890 1.946 1.804 2.041 . 0 0 "[ . 1 . 2]" 1
503 1 13 VAL QG 1 63 ILE H 3.520 . 3.520 3.506 3.372 3.649 0.129 14 0 "[ . 1 . 2]" 1
504 1 63 ILE H 1 63 ILE HG12 3.890 . 3.890 3.503 3.416 3.614 . 0 0 "[ . 1 . 2]" 1
505 1 63 ILE H 1 75 LEU HG 6.000 . 6.000 5.995 5.582 6.101 0.101 7 0 "[ . 1 . 2]" 1
506 1 62 VAL HB 1 63 ILE H 4.670 . 4.670 4.132 4.017 4.202 . 0 0 "[ . 1 . 2]" 1
507 1 10 GLU HB2 1 63 ILE H 5.290 . 5.290 4.501 4.238 4.832 . 0 0 "[ . 1 . 2]" 1
508 1 11 GLY HA2 1 63 ILE H 5.340 . 5.340 4.832 4.590 4.989 . 0 0 "[ . 1 . 2]" 1
509 1 62 VAL HA 1 63 ILE H 3.300 . 3.300 2.172 2.085 2.273 . 0 0 "[ . 1 . 2]" 1
510 1 12 GLU HA 1 63 ILE H 4.620 . 4.620 4.209 3.850 4.438 . 0 0 "[ . 1 . 2]" 1
511 1 10 GLU HA 1 63 ILE H 4.730 . 4.730 4.180 4.091 4.280 . 0 0 "[ . 1 . 2]" 1
512 1 13 VAL H 1 63 ILE H 4.760 . 4.760 4.640 4.297 4.757 . 0 0 "[ . 1 . 2]" 1
513 1 63 ILE MD 1 64 SER H 4.300 . 4.300 4.302 4.227 4.372 0.072 14 0 "[ . 1 . 2]" 1
514 1 63 ILE MG 1 64 SER H 4.410 . 4.410 3.828 3.762 3.957 . 0 0 "[ . 1 . 2]" 1
515 1 63 ILE HG12 1 64 SER H 4.690 . 4.690 3.284 3.144 3.413 . 0 0 "[ . 1 . 2]" 1
516 1 64 SER H 1 65 ILE HG12 5.710 . 5.710 5.027 4.796 5.203 . 0 0 "[ . 1 . 2]" 1
517 1 64 SER H 1 75 LEU HB2 6.000 . 6.000 5.499 5.264 5.609 . 0 0 "[ . 1 . 2]" 1
518 1 63 ILE HB 1 64 SER H 3.600 . 3.600 2.439 2.348 2.579 . 0 0 "[ . 1 . 2]" 1
519 1 64 SER H 1 73 THR HB 4.770 . 4.770 3.584 3.184 3.810 . 0 0 "[ . 1 . 2]" 1
520 1 64 SER H 1 73 THR HA 4.950 . 4.950 4.596 4.395 4.727 . 0 0 "[ . 1 . 2]" 1
521 1 64 SER H 1 74 LYS HA 4.440 . 4.440 3.369 3.141 3.624 . 0 0 "[ . 1 . 2]" 1
522 1 64 SER H 1 72 ILE HA 4.950 . 4.950 4.480 4.218 4.748 . 0 0 "[ . 1 . 2]" 1
523 1 63 ILE HA 1 64 SER H 3.400 . 3.400 2.354 2.311 2.389 . 0 0 "[ . 1 . 2]" 1
524 1 64 SER H 1 74 LYS H 5.440 . 5.440 4.679 4.435 4.813 . 0 0 "[ . 1 . 2]" 1
525 1 65 ILE H 1 65 ILE MD 4.070 . 4.070 3.855 3.564 3.947 . 0 0 "[ . 1 . 2]" 1
526 1 9 ILE MG 1 65 ILE H 4.010 . 4.010 2.845 2.614 3.073 . 0 0 "[ . 1 . 2]" 1
527 1 65 ILE H 1 65 ILE HG12 4.310 . 4.310 3.772 3.549 3.889 . 0 0 "[ . 1 . 2]" 1
528 1 65 ILE H 1 65 ILE HB 3.400 . 3.400 2.708 2.596 2.770 . 0 0 "[ . 1 . 2]" 1
529 1 10 GLU HB2 1 65 ILE H 5.750 . 5.750 5.118 4.870 5.347 . 0 0 "[ . 1 . 2]" 1
530 1 10 GLU HG2 1 65 ILE H 6.000 . 6.000 4.909 4.704 5.194 . 0 0 "[ . 1 . 2]" 1
531 1 10 GLU HB3 1 65 ILE H 4.700 . 4.700 3.621 3.383 3.925 . 0 0 "[ . 1 . 2]" 1
532 1 10 GLU HG3 1 65 ILE H 5.970 . 5.970 6.055 6.007 6.127 0.157 17 0 "[ . 1 . 2]" 1
533 1 64 SER HB2 1 65 ILE H 4.190 . 4.190 3.258 2.945 4.118 . 0 0 "[ . 1 . 2]" 1
534 1 64 SER HB3 1 65 ILE H 4.190 . 4.190 4.047 3.827 4.227 0.037 13 0 "[ . 1 . 2]" 1
535 1 9 ILE HA 1 65 ILE H 5.310 . 5.310 4.519 4.409 4.661 . 0 0 "[ . 1 . 2]" 1
536 1 65 ILE H 1 72 ILE HA 5.110 . 5.110 4.875 4.782 4.967 . 0 0 "[ . 1 . 2]" 1
537 1 8 LEU HA 1 65 ILE H 4.660 . 4.660 4.301 4.073 4.668 0.008 17 0 "[ . 1 . 2]" 1
538 1 64 SER HA 1 65 ILE H 3.040 . 3.040 2.189 2.099 2.235 . 0 0 "[ . 1 . 2]" 1
539 1 10 GLU HA 1 65 ILE H 3.870 . 3.870 3.560 3.243 3.726 . 0 0 "[ . 1 . 2]" 1
540 1 65 ILE H 1 66 ASP H 4.540 . 4.540 4.350 4.290 4.473 . 0 0 "[ . 1 . 2]" 1
541 1 64 SER H 1 65 ILE H 4.560 . 4.560 4.354 4.182 4.416 . 0 0 "[ . 1 . 2]" 1
542 1 66 ASP H 1 73 THR H 4.960 . 4.960 4.629 4.395 4.977 0.017 15 0 "[ . 1 . 2]" 1
543 1 24 GLY H 1 25 GLY H 4.820 . 4.820 3.284 1.761 4.500 . 0 0 "[ . 1 . 2]" 1
544 1 66 ASP H 1 72 ILE HA 3.860 . 3.860 3.252 3.071 3.524 . 0 0 "[ . 1 . 2]" 1
545 1 65 ILE HA 1 66 ASP H 3.070 . 3.070 2.132 2.098 2.161 . 0 0 "[ . 1 . 2]" 1
546 1 66 ASP H 1 67 LYS HA 5.220 . 5.220 5.028 4.957 5.208 . 0 0 "[ . 1 . 2]" 1
547 1 66 ASP H 1 66 ASP HB3 3.730 . 3.730 2.609 2.451 3.564 . 0 0 "[ . 1 . 2]" 1
548 1 66 ASP H 1 66 ASP HB2 3.730 . 3.730 2.600 2.309 2.843 . 0 0 "[ . 1 . 2]" 1
549 1 66 ASP H 1 71 LYS HB3 5.190 . 5.190 4.281 3.709 4.710 . 0 0 "[ . 1 . 2]" 1
550 1 65 ILE HB 1 66 ASP H 4.400 . 4.400 4.100 4.064 4.143 . 0 0 "[ . 1 . 2]" 1
551 1 65 ILE HG12 1 66 ASP H 4.640 . 4.640 4.570 4.494 4.644 0.004 1 0 "[ . 1 . 2]" 1
552 1 65 ILE MG 1 66 ASP H 3.380 . 3.380 2.676 2.607 2.762 . 0 0 "[ . 1 . 2]" 1
553 1 67 LYS H 1 67 LYS QG 3.770 . 3.770 2.333 2.105 3.076 . 0 0 "[ . 1 . 2]" 1
554 1 67 LYS H 1 67 LYS QD 4.000 . 4.000 3.346 1.999 3.722 . 0 0 "[ . 1 . 2]" 1
555 1 67 LYS H 1 67 LYS HB2 3.690 . 3.690 2.464 2.366 2.530 . 0 0 "[ . 1 . 2]" 1
556 1 67 LYS H 1 67 LYS HB3 3.690 . 3.690 3.587 3.568 3.632 . 0 0 "[ . 1 . 2]" 1
557 1 48 MET ME 1 67 LYS H 5.960 . 5.960 4.652 4.303 5.096 . 0 0 "[ . 1 . 2]" 1
558 1 66 ASP HB2 1 67 LYS H 4.870 . 4.870 4.494 4.326 4.587 . 0 0 "[ . 1 . 2]" 1
559 1 66 ASP HB3 1 67 LYS H 4.870 . 4.870 4.273 3.696 4.350 . 0 0 "[ . 1 . 2]" 1
560 1 67 LYS H 1 67 LYS QE 5.420 . 5.420 4.611 3.908 5.188 . 0 0 "[ . 1 . 2]" 1
561 1 7 GLU HA 1 67 LYS H 6.000 . 6.000 5.475 5.196 5.946 . 0 0 "[ . 1 . 2]" 1
562 1 65 ILE HA 1 67 LYS H 6.000 . 6.000 5.657 5.590 5.803 . 0 0 "[ . 1 . 2]" 1
563 1 66 ASP HA 1 67 LYS H 2.980 . 2.980 2.191 2.152 2.225 . 0 0 "[ . 1 . 2]" 1
564 1 8 LEU HA 1 67 LYS H 3.800 . 3.800 3.286 3.015 3.490 . 0 0 "[ . 1 . 2]" 1
565 1 8 LEU H 1 67 LYS H 5.950 . 5.950 5.252 4.924 5.654 . 0 0 "[ . 1 . 2]" 1
566 1 66 ASP H 1 67 LYS H 4.560 . 4.560 4.338 4.309 4.383 . 0 0 "[ . 1 . 2]" 1
567 1 65 ILE MG 1 68 ALA H 6.000 . 6.000 5.514 5.391 5.641 . 0 0 "[ . 1 . 2]" 1
568 1 68 ALA H 1 68 ALA MB 2.640 . 2.640 2.242 2.226 2.255 . 0 0 "[ . 1 . 2]" 1
569 1 67 LYS QD 1 68 ALA H 5.190 . 5.190 4.803 3.932 5.075 . 0 0 "[ . 1 . 2]" 1
570 1 67 LYS HB2 1 68 ALA H 4.280 . 4.280 2.928 2.798 3.103 . 0 0 "[ . 1 . 2]" 1
571 1 67 LYS HB3 1 68 ALA H 4.280 . 4.280 3.879 3.800 4.004 . 0 0 "[ . 1 . 2]" 1
572 1 66 ASP HA 1 68 ALA H 3.980 . 3.980 3.644 3.475 3.740 . 0 0 "[ . 1 . 2]" 1
573 1 68 ALA H 1 71 LYS H 5.760 . 5.760 5.379 5.113 5.509 . 0 0 "[ . 1 . 2]" 1
574 1 67 LYS H 1 68 ALA H 3.200 . 3.200 2.540 2.485 2.592 . 0 0 "[ . 1 . 2]" 1
575 1 68 ALA MB 1 69 SER H 3.050 . 3.050 2.313 2.152 2.557 . 0 0 "[ . 1 . 2]" 1
576 1 48 MET ME 1 69 SER H 6.000 . 6.000 5.339 4.979 5.686 . 0 0 "[ . 1 . 2]" 1
577 1 66 ASP HB2 1 69 SER H 4.600 . 4.600 4.423 3.531 4.602 0.002 14 0 "[ . 1 . 2]" 1
578 1 66 ASP HB3 1 69 SER H 4.600 . 4.600 3.191 2.196 3.427 . 0 0 "[ . 1 . 2]" 1
579 1 69 SER H 1 70 GLY HA2 4.640 . 4.640 4.573 4.416 4.681 0.041 13 0 "[ . 1 . 2]" 1
580 1 69 SER H 1 69 SER HB2 3.840 . 3.840 2.897 2.403 3.703 . 0 0 "[ . 1 . 2]" 1
581 1 69 SER H 1 69 SER HB3 3.840 . 3.840 3.027 2.423 3.740 . 0 0 "[ . 1 . 2]" 1
582 1 69 SER H 1 70 GLY HA3 5.140 . 5.140 4.956 4.810 5.049 . 0 0 "[ . 1 . 2]" 1
583 1 66 ASP H 1 69 SER H 5.690 . 5.690 5.464 5.316 5.584 . 0 0 "[ . 1 . 2]" 1
584 1 68 ALA H 1 69 SER H 3.020 . 3.020 2.681 2.651 2.722 . 0 0 "[ . 1 . 2]" 1
585 1 67 LYS H 1 69 SER H 4.790 . 4.790 4.572 4.408 4.689 . 0 0 "[ . 1 . 2]" 1
586 1 66 ASP H 1 70 GLY H 4.590 . 4.590 4.464 4.337 4.603 0.013 5 0 "[ . 1 . 2]" 1
587 1 69 SER H 1 70 GLY H 3.080 . 3.080 2.256 2.098 2.372 . 0 0 "[ . 1 . 2]" 1
588 1 68 ALA HA 1 70 GLY H 5.070 . 5.070 4.612 4.448 4.829 . 0 0 "[ . 1 . 2]" 1
589 1 67 LYS HA 1 70 GLY H 4.400 . 4.400 3.917 3.740 4.207 . 0 0 "[ . 1 . 2]" 1
590 1 69 SER HB2 1 70 GLY H 4.660 . 4.660 3.727 3.006 4.186 . 0 0 "[ . 1 . 2]" 1
591 1 66 ASP HB3 1 70 GLY H 4.790 . 4.790 2.876 2.579 3.219 . 0 0 "[ . 1 . 2]" 1
592 1 66 ASP HB2 1 70 GLY H 4.790 . 4.790 4.487 2.682 4.820 0.030 6 0 "[ . 1 . 2]" 1
593 1 70 GLY H 1 71 LYS HB2 5.440 . 5.440 5.132 4.276 5.467 0.027 18 0 "[ . 1 . 2]" 1
594 1 70 GLY H 1 71 LYS HB3 4.510 . 4.510 4.354 4.081 5.254 0.744 14 3 "[ * 1 +. -]" 1
595 1 68 ALA MB 1 70 GLY H 4.320 . 4.320 4.166 4.044 4.336 0.016 17 0 "[ . 1 . 2]" 1
596 1 65 ILE MG 1 71 LYS H 4.720 . 4.720 4.636 4.514 4.754 0.034 19 0 "[ . 1 . 2]" 1
597 1 71 LYS H 1 71 LYS HG3 4.810 . 4.810 4.602 4.487 4.642 . 0 0 "[ . 1 . 2]" 1
598 1 71 LYS H 1 71 LYS QD 3.340 . 3.340 3.471 3.174 4.447 1.107 4 1 "[ +. 1 . 2]" 1
599 1 71 LYS H 1 71 LYS HB3 3.070 . 3.070 2.277 2.078 3.024 . 0 0 "[ . 1 . 2]" 1
600 1 71 LYS H 1 71 LYS HB2 3.230 . 3.230 2.969 2.210 3.268 0.038 18 0 "[ . 1 . 2]" 1
601 1 66 ASP HB2 1 71 LYS H 3.840 . 3.840 3.586 1.827 3.875 0.035 4 0 "[ . 1 . 2]" 1
602 1 66 ASP HB3 1 71 LYS H 3.840 . 3.840 2.147 1.950 3.015 . 0 0 "[ . 1 . 2]" 1
603 1 69 SER HA 1 71 LYS H 4.790 . 4.790 4.524 4.416 4.685 . 0 0 "[ . 1 . 2]" 1
604 1 66 ASP HA 1 71 LYS H 5.320 . 5.320 4.946 4.755 5.065 . 0 0 "[ . 1 . 2]" 1
605 1 66 ASP H 1 71 LYS H 4.030 . 4.030 3.622 3.437 3.790 . 0 0 "[ . 1 . 2]" 1
606 1 70 GLY H 1 71 LYS H 3.260 . 3.260 2.329 2.273 2.403 . 0 0 "[ . 1 . 2]" 1
607 1 71 LYS HA 1 72 ILE H 2.820 . 2.820 2.161 2.124 2.206 . 0 0 "[ . 1 . 2]" 1
608 1 72 ILE H 1 72 ILE MG 3.790 . 3.790 3.750 3.686 3.780 . 0 0 "[ . 1 . 2]" 1
609 1 72 ILE H 1 72 ILE MD 3.830 . 3.830 2.406 2.315 2.517 . 0 0 "[ . 1 . 2]" 1
610 1 72 ILE H 1 72 ILE HG13 4.160 . 4.160 3.922 3.795 4.046 . 0 0 "[ . 1 . 2]" 1
611 1 71 LYS HG2 1 72 ILE H 4.300 . 4.300 3.155 2.732 4.360 0.060 20 0 "[ . 1 . 2]" 1
612 1 71 LYS HG3 1 72 ILE H 4.300 . 4.300 3.727 2.671 4.388 0.088 12 0 "[ . 1 . 2]" 1
613 1 72 ILE H 1 72 ILE HB 3.070 . 3.070 2.494 2.427 2.549 . 0 0 "[ . 1 . 2]" 1
614 1 72 ILE HB 1 73 THR H 4.400 . 4.400 4.249 4.191 4.356 . 0 0 "[ . 1 . 2]" 1
615 1 65 ILE HG12 1 73 THR H 5.340 . 5.340 4.743 4.503 4.909 . 0 0 "[ . 1 . 2]" 1
616 1 73 THR H 1 73 THR MG 3.970 . 3.970 3.876 3.831 3.919 . 0 0 "[ . 1 . 2]" 1
617 1 72 ILE HG13 1 73 THR H 4.500 . 4.500 4.073 3.957 4.186 . 0 0 "[ . 1 . 2]" 1
618 1 73 THR H 1 75 LEU QD 5.200 . 5.200 4.196 3.956 4.343 . 0 0 "[ . 1 . 2]" 1
619 1 72 ILE MG 1 73 THR H 3.370 . 3.370 2.618 2.516 2.822 . 0 0 "[ . 1 . 2]" 1
620 1 64 SER HB2 1 73 THR H 5.080 . 5.080 4.484 4.326 4.883 . 0 0 "[ . 1 . 2]" 1
621 1 64 SER HB3 1 73 THR H 5.080 . 5.080 4.801 3.345 5.094 0.014 13 0 "[ . 1 . 2]" 1
622 1 73 THR H 1 73 THR HB 3.620 . 3.620 2.685 2.596 2.764 . 0 0 "[ . 1 . 2]" 1
623 1 65 ILE HA 1 73 THR H 4.070 . 4.070 3.557 3.403 3.790 . 0 0 "[ . 1 . 2]" 1
624 1 72 ILE HA 1 73 THR H 3.010 . 3.010 2.161 2.135 2.204 . 0 0 "[ . 1 . 2]" 1
625 1 64 SER HA 1 73 THR H 4.980 . 4.980 4.668 4.516 4.759 . 0 0 "[ . 1 . 2]" 1
626 1 72 ILE H 1 73 THR H 4.480 . 4.480 4.410 4.380 4.455 . 0 0 "[ . 1 . 2]" 1
627 1 65 ILE H 1 73 THR H 5.060 . 5.060 4.872 4.742 5.010 . 0 0 "[ . 1 . 2]" 1
628 1 73 THR H 1 74 LYS H 5.290 . 5.290 4.264 4.147 4.370 . 0 0 "[ . 1 . 2]" 1
629 1 74 LYS H 1 74 LYS HB2 4.070 . 4.070 2.635 2.421 2.761 . 0 0 "[ . 1 . 2]" 1
630 1 63 ILE HB 1 74 LYS H 5.880 . 5.880 4.462 3.969 4.779 . 0 0 "[ . 1 . 2]" 1
631 1 74 LYS H 1 74 LYS QD 6.000 . 6.000 4.583 4.301 4.795 . 0 0 "[ . 1 . 2]" 1
632 1 75 LEU H 1 75 LEU QD 3.470 . 3.470 1.932 1.709 2.626 . 0 0 "[ . 1 . 2]" 1
633 1 73 THR MG 1 75 LEU H 4.920 . 4.920 4.466 4.204 4.745 . 0 0 "[ . 1 . 2]" 1
634 1 75 LEU H 1 75 LEU HB3 3.700 . 3.700 3.704 3.641 3.741 0.041 6 0 "[ . 1 . 2]" 1
635 1 75 LEU H 1 75 LEU HB2 3.940 . 3.940 2.602 2.434 2.715 . 0 0 "[ . 1 . 2]" 1
636 1 74 LYS HB2 1 75 LEU H 4.450 . 4.450 4.246 4.103 4.415 . 0 0 "[ . 1 . 2]" 1
637 1 62 VAL HB 1 75 LEU H 4.890 . 4.890 4.007 3.352 5.102 0.212 1 0 "[ . 1 . 2]" 1
638 1 63 ILE HB 1 75 LEU H 5.070 . 5.070 4.230 3.944 4.612 . 0 0 "[ . 1 . 2]" 1
639 1 74 LYS HB3 1 75 LEU H 4.550 . 4.550 4.144 4.045 4.259 . 0 0 "[ . 1 . 2]" 1
640 1 75 LEU H 1 76 GLY HA3 5.220 . 5.220 4.813 4.465 5.441 0.221 15 0 "[ . 1 . 2]" 1
641 1 75 LEU H 1 76 GLY HA2 5.220 . 5.220 4.425 4.196 4.900 . 0 0 "[ . 1 . 2]" 1
642 1 74 LYS HA 1 75 LEU H 3.260 . 3.260 2.131 2.070 2.188 . 0 0 "[ . 1 . 2]" 1
643 1 63 ILE HA 1 75 LEU H 3.760 . 3.760 2.287 2.199 2.498 . 0 0 "[ . 1 . 2]" 1
644 1 75 LEU H 1 76 GLY H 4.040 . 4.040 2.360 2.065 4.162 0.122 15 0 "[ . 1 . 2]" 1
645 1 75 LEU H 1 77 ARG H 5.700 . 5.700 5.086 4.459 5.746 0.046 13 0 "[ . 1 . 2]" 1
646 1 62 VAL H 1 75 LEU H 5.430 . 5.430 4.515 3.994 4.767 . 0 0 "[ . 1 . 2]" 1
647 1 63 ILE H 1 75 LEU H 5.700 . 5.700 4.427 4.172 4.580 . 0 0 "[ . 1 . 2]" 1
648 1 64 SER H 1 75 LEU H 4.060 . 4.060 4.082 3.903 4.227 0.167 1 0 "[ . 1 . 2]" 1
649 1 74 LYS H 1 75 LEU H 5.390 . 5.390 4.479 4.329 4.566 . 0 0 "[ . 1 . 2]" 1
650 1 62 VAL MG1 1 76 GLY H 5.230 . 5.230 3.358 1.973 5.331 0.101 15 0 "[ . 1 . 2]" 1
651 1 75 LEU QD 1 76 GLY H . . 4.540 3.364 3.127 3.865 . 0 0 "[ . 1 . 2]" 1
652 1 75 LEU HB2 1 76 GLY H 4.500 . 4.500 2.485 2.133 3.954 . 0 0 "[ . 1 . 2]" 1
653 1 62 VAL HB 1 76 GLY H 5.340 . 5.340 2.637 1.737 4.719 . 0 0 "[ . 1 . 2]" 1
654 1 74 LYS HA 1 76 GLY H 5.150 . 5.150 4.124 3.761 5.557 0.407 15 0 "[ . 1 . 2]" 1
655 1 62 VAL HB 1 77 ARG H 4.150 . 4.150 3.095 1.779 4.297 0.147 1 0 "[ . 1 . 2]" 1
656 1 77 ARG H 1 77 ARG QG 4.240 . 4.240 3.316 1.984 4.429 0.189 14 0 "[ . 1 . 2]" 1
657 1 76 GLY H 1 77 ARG H 4.780 . 4.780 3.177 2.140 3.739 . 0 0 "[ . 1 . 2]" 1
658 1 77 ARG H 1 78 SER H 4.770 . 4.770 3.544 1.731 4.596 . 0 0 "[ . 1 . 2]" 1
659 1 78 SER H 1 79 PHE H 5.200 . 5.200 3.898 2.589 4.622 . 0 0 "[ . 1 . 2]" 1
660 1 77 ARG QG 1 78 SER H 4.030 . 4.030 3.171 1.875 4.116 0.086 3 0 "[ . 1 . 2]" 1
661 1 62 VAL HB 1 78 SER H 5.300 . 5.300 4.025 2.572 5.177 . 0 0 "[ . 1 . 2]" 1
662 1 77 ARG HB3 1 78 SER H 4.310 . 4.310 3.291 1.940 4.324 0.014 12 0 "[ . 1 . 2]" 1
663 1 78 SER H 1 78 SER QB 3.560 . 3.560 2.693 2.254 3.335 . 0 0 "[ . 1 . 2]" 1
664 1 79 PHE H 1 79 PHE HB2 3.820 . 3.820 3.105 2.307 3.952 0.132 12 0 "[ . 1 . 2]" 1
665 1 79 PHE H 1 79 PHE HB3 3.820 . 3.820 3.386 2.681 4.030 0.210 19 0 "[ . 1 . 2]" 1
666 1 78 SER QB 1 79 PHE H 3.900 . 3.900 3.342 2.053 4.009 0.109 15 0 "[ . 1 . 2]" 1
667 1 78 SER HA 1 79 PHE H 3.070 . 3.070 2.373 2.110 3.121 0.051 19 0 "[ . 1 . 2]" 1
668 1 79 PHE H 1 79 PHE QD 4.230 . 4.230 2.806 1.898 3.934 . 0 0 "[ . 1 . 2]" 1
669 1 80 ALA H 1 80 ALA MB 2.890 . 2.890 2.503 2.221 2.933 0.043 11 0 "[ . 1 . 2]" 1
670 1 79 PHE HB2 1 80 ALA H 3.870 . 3.870 2.927 1.899 3.945 0.075 7 0 "[ . 1 . 2]" 1
671 1 79 PHE HB3 1 80 ALA H 3.870 . 3.870 2.828 1.699 3.871 0.001 17 0 "[ . 1 . 2]" 1
672 1 80 ALA H 1 81 ARG HA 5.270 . 5.270 4.979 4.187 5.480 0.210 6 0 "[ . 1 . 2]" 1
673 1 79 PHE HA 1 80 ALA H 3.120 . 3.120 2.507 2.165 2.945 . 0 0 "[ . 1 . 2]" 1
674 1 79 PHE QD 1 80 ALA H 4.330 . 4.330 3.349 2.144 3.764 . 0 0 "[ . 1 . 2]" 1
675 1 79 PHE QE 1 80 ALA H 5.870 . 5.870 5.539 4.285 5.936 0.066 3 0 "[ . 1 . 2]" 1
676 1 79 PHE H 1 80 ALA H 4.560 . 4.560 4.444 4.154 4.613 0.053 12 0 "[ . 1 . 2]" 1
677 1 81 ARG H 1 81 ARG HB2 3.880 . 3.880 2.978 2.363 3.742 . 0 0 "[ . 1 . 2]" 1
678 1 81 ARG H 1 81 ARG HB3 3.880 . 3.880 3.450 2.478 4.021 0.141 20 0 "[ . 1 . 2]" 1
679 1 80 ALA HA 1 81 ARG H 3.140 . 3.140 2.503 2.113 3.407 0.267 15 0 "[ . 1 . 2]" 1
680 1 81 ARG QG 1 82 SER H 4.600 . 4.600 4.051 2.993 4.703 0.103 14 0 "[ . 1 . 2]" 1
681 1 81 ARG HB2 1 82 SER H 4.720 . 4.720 3.836 2.498 4.611 . 0 0 "[ . 1 . 2]" 1
682 1 81 ARG HB3 1 82 SER H 4.720 . 4.720 3.553 1.880 4.527 . 0 0 "[ . 1 . 2]" 1
683 1 82 SER H 1 82 SER HB2 3.940 . 3.940 2.896 2.478 3.664 . 0 0 "[ . 1 . 2]" 1
684 1 82 SER H 1 82 SER HB3 3.940 . 3.940 3.410 2.532 4.023 0.083 16 0 "[ . 1 . 2]" 1
685 1 81 ARG HA 1 82 SER H 3.230 . 3.230 2.371 2.107 3.262 0.032 15 0 "[ . 1 . 2]" 1
686 1 81 ARG H 1 82 SER H 4.660 . 4.660 4.070 2.261 4.607 . 0 0 "[ . 1 . 2]" 1
687 1 83 ARG H 1 83 ARG HB2 3.720 . 3.720 2.828 2.200 3.948 0.228 4 0 "[ . 1 . 2]" 1
688 1 83 ARG H 1 83 ARG HB3 3.720 . 3.720 3.487 2.446 3.815 0.095 14 0 "[ . 1 . 2]" 1
689 1 82 SER HB2 1 83 ARG H 4.240 . 4.240 3.846 2.323 4.386 0.146 20 0 "[ . 1 . 2]" 1
690 1 82 SER HB3 1 83 ARG H 4.240 . 4.240 3.622 1.916 4.494 0.254 18 0 "[ . 1 . 2]" 1
691 1 82 SER HA 1 83 ARG H 3.030 . 3.030 2.397 2.082 3.358 0.328 4 0 "[ . 1 . 2]" 1
692 1 83 ARG HB2 1 84 ASP H 4.180 . 4.180 3.658 1.987 4.349 0.169 19 0 "[ . 1 . 2]" 1
693 1 83 ARG HB3 1 84 ASP H 4.180 . 4.180 3.177 2.051 4.142 . 0 0 "[ . 1 . 2]" 1
694 1 84 ASP H 1 84 ASP HB2 3.910 . 3.910 3.367 2.462 3.941 0.031 16 0 "[ . 1 . 2]" 1
695 1 83 ARG HA 1 84 ASP H 3.250 . 3.250 2.276 2.074 2.683 . 0 0 "[ . 1 . 2]" 1
696 1 84 ASP H 1 85 TYR H 3.580 . 3.580 2.424 1.830 3.218 . 0 0 "[ . 1 . 2]" 1
697 1 85 TYR H 1 85 TYR QD 4.450 . 4.450 4.276 3.612 4.552 0.102 14 0 "[ . 1 . 2]" 1
698 1 83 ARG QG 1 85 TYR H 5.210 . 5.210 4.011 2.231 5.328 0.118 20 0 "[ . 1 . 2]" 1
699 1 85 TYR H 1 85 TYR HB2 3.790 . 3.790 2.923 2.356 3.506 . 0 0 "[ . 1 . 2]" 1
700 1 85 TYR H 1 85 TYR HB3 3.790 . 3.790 2.896 2.397 3.773 . 0 0 "[ . 1 . 2]" 1
701 1 83 ARG HA 1 85 TYR H 4.450 . 4.450 3.665 3.106 4.206 . 0 0 "[ . 1 . 2]" 1
702 1 84 ASP HA 1 85 TYR H 3.040 . 3.040 3.040 2.707 3.333 0.293 5 0 "[ . 1 . 2]" 1
703 1 86 ASP H 1 86 ASP QB 3.320 . 3.320 2.963 2.360 3.303 . 0 0 "[ . 1 . 2]" 1
704 1 85 TYR H 1 86 ASP H 4.050 . 4.050 3.009 2.006 4.144 0.094 1 0 "[ . 1 . 2]" 1
705 1 86 ASP H 1 87 ALA H 3.290 . 3.290 2.785 2.072 3.304 0.014 15 0 "[ . 1 . 2]" 1
706 1 86 ASP HA 1 87 ALA H 2.890 . 2.890 2.672 2.195 3.456 0.566 6 1 "[ .+ 1 . 2]" 1
707 1 87 ALA H 1 88 MET HA 4.830 . 4.830 4.635 4.176 5.009 0.179 6 0 "[ . 1 . 2]" 1
708 1 87 ALA HA 1 88 MET H 3.110 . 3.110 2.639 2.250 3.116 0.006 13 0 "[ . 1 . 2]" 1
709 1 88 MET H 1 88 MET HB2 3.790 . 3.790 2.918 2.369 3.814 0.024 13 0 "[ . 1 . 2]" 1
710 1 88 MET H 1 88 MET HB3 3.790 . 3.790 3.439 2.575 3.800 0.010 10 0 "[ . 1 . 2]" 1
711 1 88 MET H 1 88 MET HG2 3.850 . 3.850 2.964 2.005 3.922 0.072 10 0 "[ . 1 . 2]" 1
712 1 88 MET H 1 88 MET HG3 3.850 . 3.850 2.852 2.121 3.955 0.105 7 0 "[ . 1 . 2]" 1
713 1 87 ALA H 1 88 MET H 3.440 . 3.440 2.894 2.116 3.479 0.039 16 0 "[ . 1 . 2]" 1
714 1 87 ALA MB 1 89 GLY H 6.000 . 6.000 4.703 3.465 6.023 0.023 4 0 "[ . 1 . 2]" 1
715 1 89 GLY H 1 90 ALA MB 6.000 . 6.000 4.607 3.218 5.535 . 0 0 "[ . 1 . 2]" 1
716 1 88 MET HB2 1 89 GLY H 4.550 . 4.550 3.745 2.382 4.478 . 0 0 "[ . 1 . 2]" 1
717 1 88 MET HA 1 89 GLY H 3.170 . 3.170 2.625 2.129 3.326 0.156 15 0 "[ . 1 . 2]" 1
718 1 90 ALA H 1 90 ALA MB 2.920 . 2.920 2.446 2.266 2.881 . 0 0 "[ . 1 . 2]" 1
719 1 89 GLY QA 1 90 ALA H 2.990 . 2.990 2.385 2.104 2.793 . 0 0 "[ . 1 . 2]" 1
720 1 90 ALA H 1 91 ASP H 4.190 . 4.190 3.129 2.233 4.189 . 0 0 "[ . 1 . 2]" 1
721 1 91 ASP H 1 92 THR MG 4.600 . 4.600 3.991 2.962 4.700 0.100 10 0 "[ . 1 . 2]" 1
722 1 90 ALA MB 1 91 ASP H 3.680 . 3.680 3.605 3.217 3.715 0.035 2 0 "[ . 1 . 2]" 1
723 1 91 ASP H 1 91 ASP HB2 3.720 . 3.720 2.935 2.414 3.721 0.001 16 0 "[ . 1 . 2]" 1
724 1 91 ASP H 1 91 ASP HB3 3.720 . 3.720 2.969 2.370 3.759 0.039 5 0 "[ . 1 . 2]" 1
725 1 89 GLY QA 1 91 ASP H 5.170 . 5.170 3.767 3.007 5.074 . 0 0 "[ . 1 . 2]" 1
726 1 90 ALA HA 1 91 ASP H 2.960 . 2.960 2.650 2.151 3.149 0.189 1 0 "[ . 1 . 2]" 1
727 1 91 ASP HA 1 92 THR H 3.020 . 3.020 2.797 2.077 3.349 0.329 7 0 "[ . 1 . 2]" 1
728 1 91 ASP HB3 1 92 THR H 4.820 . 4.820 4.277 2.900 4.518 . 0 0 "[ . 1 . 2]" 1
729 1 91 ASP HB2 1 92 THR H 4.820 . 4.820 4.349 3.938 4.633 . 0 0 "[ . 1 . 2]" 1
730 1 90 ALA MB 1 92 THR H 4.760 . 4.760 3.961 3.308 4.877 0.117 10 0 "[ . 1 . 2]" 1
731 1 92 THR H 1 92 THR MG 3.550 . 3.550 2.527 1.812 3.633 0.083 9 0 "[ . 1 . 2]" 1
732 1 92 THR H 1 93 ARG H 3.660 . 3.660 3.141 2.245 3.831 0.171 10 0 "[ . 1 . 2]" 1
733 1 91 ASP H 1 92 THR H 3.910 . 3.910 2.960 2.240 4.078 0.168 10 0 "[ . 1 . 2]" 1
734 1 93 ARG H 1 93 ARG QB 2.970 . 2.970 2.558 2.309 3.202 0.232 18 0 "[ . 1 . 2]" 1
735 1 92 THR HA 1 93 ARG H 2.850 . 2.850 2.643 2.126 2.889 0.039 7 0 "[ . 1 . 2]" 1
736 1 94 PHE H 1 95 VAL H 3.660 . 3.660 3.156 2.350 3.816 0.156 7 0 "[ . 1 . 2]" 1
737 1 94 PHE H 1 94 PHE QD 4.190 . 4.190 2.928 1.890 3.662 . 0 0 "[ . 1 . 2]" 1
738 1 93 ARG QG 1 94 PHE H 4.740 . 4.740 4.504 3.837 4.835 0.095 19 0 "[ . 1 . 2]" 1
739 1 93 ARG HA 1 94 PHE H 2.950 . 2.950 2.617 2.182 3.062 0.112 3 0 "[ . 1 . 2]" 1
740 1 94 PHE HB2 1 95 VAL H 4.600 . 4.600 4.277 3.854 4.539 . 0 0 "[ . 1 . 2]" 1
741 1 93 ARG HA 1 95 VAL H 5.370 . 5.370 3.916 2.980 5.166 . 0 0 "[ . 1 . 2]" 1
742 1 95 VAL H 1 96 GLN HA 5.010 . 5.010 4.815 4.399 5.151 0.141 20 0 "[ . 1 . 2]" 1
743 1 94 PHE HA 1 95 VAL H 2.930 . 2.930 2.553 2.057 3.020 0.090 14 0 "[ . 1 . 2]" 1
744 1 94 PHE QD 1 95 VAL H 4.760 . 4.760 4.709 4.262 4.875 0.115 20 0 "[ . 1 . 2]" 1
745 1 96 GLN H 1 96 GLN HB2 3.840 . 3.840 2.706 2.354 3.639 . 0 0 "[ . 1 . 2]" 1
746 1 96 GLN H 1 96 GLN HB3 3.840 . 3.840 3.154 2.418 3.815 . 0 0 "[ . 1 . 2]" 1
747 1 96 GLN H 1 96 GLN QG 4.060 . 4.060 3.233 1.852 4.137 0.077 7 0 "[ . 1 . 2]" 1
748 1 95 VAL HA 1 96 GLN H 2.740 . 2.740 2.411 2.131 2.831 0.091 4 0 "[ . 1 . 2]" 1
749 1 96 GLN HA 1 97 CYS H 3.010 . 3.010 2.344 2.100 3.410 0.400 7 0 "[ . 1 . 2]" 1
750 1 99 GLU H 1 99 GLU HB2 3.690 . 3.690 2.852 2.425 3.753 0.063 19 0 "[ . 1 . 2]" 1
751 1 99 GLU H 1 99 GLU HB3 3.690 . 3.690 3.071 2.460 3.700 0.010 5 0 "[ . 1 . 2]" 1
752 1 99 GLU H 1 99 GLU QG 4.960 . 4.960 3.193 1.942 4.152 . 0 0 "[ . 1 . 2]" 1
753 1 98 PRO QD 1 99 GLU H 4.870 . 4.870 4.600 3.758 4.973 0.103 18 0 "[ . 1 . 2]" 1
754 1 98 PRO HA 1 99 GLU H 2.760 . 2.760 2.334 2.124 2.720 . 0 0 "[ . 1 . 2]" 1
755 1 99 GLU H 1 100 GLY H 4.090 . 4.090 3.502 2.405 4.141 0.051 13 0 "[ . 1 . 2]" 1
756 1 100 GLY H 1 101 GLU H 4.050 . 4.050 2.915 1.754 4.068 0.018 11 0 "[ . 1 . 2]" 1
757 1 99 GLU QG 1 100 GLY H 4.470 . 4.470 3.971 2.915 4.503 0.033 6 0 "[ . 1 . 2]" 1
758 1 99 GLU HA 1 100 GLY H 3.160 . 3.160 2.529 2.151 3.466 0.306 16 0 "[ . 1 . 2]" 1
759 1 100 GLY QA 1 101 GLU H 3.140 . 3.140 2.519 2.103 2.902 . 0 0 "[ . 1 . 2]" 1
760 1 101 GLU H 1 101 GLU HB3 3.660 . 3.660 3.154 2.491 3.661 0.001 6 0 "[ . 1 . 2]" 1
761 1 101 GLU H 1 101 GLU HB2 3.660 . 3.660 2.846 2.387 3.615 . 0 0 "[ . 1 . 2]" 1
762 1 101 GLU H 1 101 GLU QG 4.210 . 4.210 3.100 1.739 4.409 0.199 8 0 "[ . 1 . 2]" 1
763 1 102 LEU H 1 102 LEU HG 4.330 . 4.330 3.341 1.918 4.426 0.096 1 0 "[ . 1 . 2]" 1
764 1 101 GLU HA 1 102 LEU H 2.850 . 2.850 2.458 2.130 2.923 0.073 16 0 "[ . 1 . 2]" 1
765 1 102 LEU MD1 1 103 GLN H 5.570 . 5.570 4.571 2.787 5.615 0.045 12 0 "[ . 1 . 2]" 1
766 1 102 LEU HG 1 103 GLN H 5.250 . 5.250 4.617 3.404 5.321 0.071 4 0 "[ . 1 . 2]" 1
767 1 103 GLN H 1 103 GLN HB2 3.770 . 3.770 2.742 2.279 3.753 . 0 0 "[ . 1 . 2]" 1
768 1 103 GLN H 1 103 GLN HB3 3.770 . 3.770 3.288 2.459 3.703 . 0 0 "[ . 1 . 2]" 1
769 1 103 GLN H 1 103 GLN QG 4.070 . 4.070 3.307 1.853 4.187 0.117 1 0 "[ . 1 . 2]" 1
770 1 102 LEU HA 1 103 GLN H 2.960 . 2.960 2.441 2.098 3.057 0.097 11 0 "[ . 1 . 2]" 1
771 1 103 GLN HA 1 104 LYS H 3.160 . 3.160 2.557 2.134 3.375 0.215 20 0 "[ . 1 . 2]" 1
772 1 104 LYS H 1 104 LYS QG 4.220 . 4.220 3.091 1.804 4.220 . 0 0 "[ . 1 . 2]" 1
773 1 105 ARG H 1 105 ARG QG 4.160 . 4.160 2.802 1.759 4.196 0.036 6 0 "[ . 1 . 2]" 1
774 1 105 ARG H 1 105 ARG HB2 3.930 . 3.930 3.103 2.425 3.903 . 0 0 "[ . 1 . 2]" 1
775 1 105 ARG H 1 105 ARG HB3 3.930 . 3.930 3.365 2.493 4.022 0.092 7 0 "[ . 1 . 2]" 1
776 1 104 LYS HA 1 105 ARG H 3.050 . 3.050 2.532 2.134 3.141 0.091 11 0 "[ . 1 . 2]" 1
777 1 104 LYS H 1 105 ARG H 3.800 . 3.800 3.373 2.496 3.911 0.111 14 0 "[ . 1 . 2]" 1
778 1 105 ARG HB2 1 106 LYS H 4.900 . 4.900 3.955 2.806 4.646 . 0 0 "[ . 1 . 2]" 1
779 1 105 ARG HB3 1 106 LYS H 4.900 . 4.900 3.988 1.795 4.626 . 0 0 "[ . 1 . 2]" 1
780 1 105 ARG HA 1 106 LYS H 3.310 . 3.310 2.722 2.158 3.516 0.206 1 0 "[ . 1 . 2]" 1
781 1 106 LYS HA 1 107 THR H 3.130 . 3.130 2.388 2.126 3.224 0.094 12 0 "[ . 1 . 2]" 1
782 1 106 LYS HB3 1 107 THR H 5.110 . 5.110 3.949 2.320 4.474 . 0 0 "[ . 1 . 2]" 1
783 1 106 LYS HB2 1 107 THR H 5.110 . 5.110 4.125 2.459 4.623 . 0 0 "[ . 1 . 2]" 1
784 1 10 GLU HA 1 33 ILE MD 4.230 . 4.230 3.051 2.579 3.386 . 0 0 "[ . 1 . 2]" 1
785 1 10 GLU HA 1 63 ILE MD 4.520 . 4.520 3.912 3.677 4.247 . 0 0 "[ . 1 . 2]" 1
786 1 10 GLU HA 1 33 ILE MG 4.470 . 4.470 3.855 3.539 4.056 . 0 0 "[ . 1 . 2]" 1
787 1 10 GLU HA 1 33 ILE HG12 5.100 . 5.100 5.045 4.676 5.139 0.039 3 0 "[ . 1 . 2]" 1
788 1 10 GLU HA 1 65 ILE HB 5.770 . 5.770 5.375 5.136 5.604 . 0 0 "[ . 1 . 2]" 1
789 1 10 GLU HA 1 10 GLU HG2 4.000 . 4.000 3.687 3.573 3.794 . 0 0 "[ . 1 . 2]" 1
790 1 10 GLU HA 1 10 GLU HG3 4.030 . 4.030 3.747 3.589 3.834 . 0 0 "[ . 1 . 2]" 1
791 1 10 GLU HA 1 11 GLY HA2 4.820 . 4.820 4.514 4.457 4.557 . 0 0 "[ . 1 . 2]" 1
792 1 10 GLU HA 1 11 GLY HA3 4.400 . 4.400 4.295 4.262 4.330 . 0 0 "[ . 1 . 2]" 1
793 1 10 GLU HA 1 64 SER HA 3.280 . 3.280 2.334 2.101 2.487 . 0 0 "[ . 1 . 2]" 1
794 1 11 GLY H 1 64 SER HA 4.210 . 4.210 4.038 3.862 4.175 . 0 0 "[ . 1 . 2]" 1
795 1 10 GLU H 1 64 SER HA 4.920 . 4.920 4.416 4.310 4.559 . 0 0 "[ . 1 . 2]" 1
796 1 64 SER HA 1 65 ILE MD 4.730 . 4.730 4.764 4.731 4.819 0.089 20 0 "[ . 1 . 2]" 1
797 1 64 SER HA 1 75 LEU QD 4.150 . 4.150 3.379 3.042 3.504 . 0 0 "[ . 1 . 2]" 1
798 1 64 SER HA 1 65 ILE HG12 4.990 . 4.990 4.739 4.580 4.898 . 0 0 "[ . 1 . 2]" 1
799 1 10 GLU HB2 1 64 SER HA 4.060 . 4.060 3.290 3.047 3.477 . 0 0 "[ . 1 . 2]" 1
800 1 10 GLU HG3 1 64 SER HA 4.910 . 4.910 4.910 4.814 4.953 0.043 14 0 "[ . 1 . 2]" 1
801 1 64 SER HA 1 72 ILE HA 5.930 . 5.930 5.520 5.347 5.698 . 0 0 "[ . 1 . 2]" 1
802 1 63 ILE HA 1 74 LYS HG2 4.530 . 4.530 4.539 4.268 4.607 0.077 7 0 "[ . 1 . 2]" 1
803 1 63 ILE HA 1 74 LYS H 5.220 . 5.220 4.751 4.313 4.964 . 0 0 "[ . 1 . 2]" 1
804 1 14 VAL MG1 1 32 THR HA 6.000 . 6.000 4.492 3.664 5.854 . 0 0 "[ . 1 . 2]" 1
805 1 14 VAL MG2 1 32 THR HA 6.000 . 6.000 4.611 3.722 5.992 . 0 0 "[ . 1 . 2]" 1
806 1 31 LEU MD1 1 32 THR HA 6.000 . 6.000 4.015 2.735 4.950 . 0 0 "[ . 1 . 2]" 1
807 1 32 THR HA 1 41 ILE HG12 4.530 . 4.530 2.913 2.663 3.275 . 0 0 "[ . 1 . 2]" 1
808 1 30 LYS HG3 1 32 THR HA 5.540 . 5.540 5.365 5.040 5.630 0.090 11 0 "[ . 1 . 2]" 1
809 1 32 THR HA 1 41 ILE HG13 4.530 . 4.530 4.085 3.819 4.468 . 0 0 "[ . 1 . 2]" 1
810 1 32 THR HA 1 33 ILE HB 4.450 . 4.450 4.269 4.181 4.333 . 0 0 "[ . 1 . 2]" 1
811 1 32 THR HA 1 41 ILE HA 4.100 . 4.100 2.259 2.123 2.339 . 0 0 "[ . 1 . 2]" 1
812 1 33 ILE HA 1 34 LYS HB2 4.350 . 4.350 4.330 4.069 4.484 0.134 18 0 "[ . 1 . 2]" 1
813 1 13 VAL HA 1 33 ILE HA 3.930 . 3.930 2.555 2.118 2.712 . 0 0 "[ . 1 . 2]" 1
814 1 11 GLY HA3 1 33 ILE HA 4.870 . 4.870 4.812 4.674 4.913 0.043 11 0 "[ . 1 . 2]" 1
815 1 12 GLU H 1 33 ILE HA 4.870 . 4.870 4.688 4.379 4.901 0.031 1 0 "[ . 1 . 2]" 1
816 1 31 LEU HA 1 44 LEU MD1 5.300 . 5.300 4.283 3.904 5.025 . 0 0 "[ . 1 . 2]" 1
817 1 16 ILE MG 1 31 LEU HA 4.770 . 4.770 4.123 3.950 4.406 . 0 0 "[ . 1 . 2]" 1
818 1 31 LEU HA 1 44 LEU MD2 5.300 . 5.300 3.244 3.088 3.410 . 0 0 "[ . 1 . 2]" 1
819 1 31 LEU HA 1 31 LEU MD1 4.230 . 4.230 2.415 2.124 3.398 . 0 0 "[ . 1 . 2]" 1
820 1 31 LEU HA 1 31 LEU HG 3.740 . 3.740 3.327 2.852 3.827 0.087 4 0 "[ . 1 . 2]" 1
821 1 30 LYS QB 1 31 LEU HA 4.400 . 4.400 4.336 4.151 4.430 0.030 18 0 "[ . 1 . 2]" 1
822 1 16 ILE HA 1 31 LEU HA 3.760 . 3.760 2.814 2.628 3.013 . 0 0 "[ . 1 . 2]" 1
823 1 8 LEU HA 1 9 ILE MG 4.230 . 4.230 3.580 3.374 3.732 . 0 0 "[ . 1 . 2]" 1
824 1 8 LEU HA 1 8 LEU MD1 3.820 . 3.820 3.822 3.765 3.841 0.021 20 0 "[ . 1 . 2]" 1
825 1 8 LEU HA 1 9 ILE HA 4.440 . 4.440 4.373 4.345 4.403 . 0 0 "[ . 1 . 2]" 1
826 1 7 GLU HA 1 8 LEU HA 4.450 . 4.450 4.373 4.357 4.391 . 0 0 "[ . 1 . 2]" 1
827 1 8 LEU HA 1 66 ASP HA 3.930 . 3.930 2.942 2.717 3.322 . 0 0 "[ . 1 . 2]" 1
828 1 34 LYS HA 1 34 LYS QE 4.630 . 4.630 4.395 3.961 4.743 0.113 9 0 "[ . 1 . 2]" 1
829 1 34 LYS HA 1 34 LYS QG 3.530 . 3.530 2.379 2.254 2.518 . 0 0 "[ . 1 . 2]" 1
830 1 30 LYS HA 1 31 LEU H 3.340 . 3.340 2.175 2.138 2.206 . 0 0 "[ . 1 . 2]" 1
831 1 30 LYS HA 1 41 ILE MG 4.200 . 4.200 3.587 3.165 3.816 . 0 0 "[ . 1 . 2]" 1
832 1 30 LYS HA 1 44 LEU MD2 4.620 . 4.620 3.033 2.721 3.373 . 0 0 "[ . 1 . 2]" 1
833 1 30 LYS HA 1 30 LYS HG2 3.820 . 3.820 3.657 3.604 3.725 . 0 0 "[ . 1 . 2]" 1
834 1 30 LYS HA 1 30 LYS QE 4.720 . 4.720 3.787 3.380 4.156 . 0 0 "[ . 1 . 2]" 1
835 1 77 ARG HA 1 77 ARG QG 3.520 . 3.520 2.785 2.227 3.432 . 0 0 "[ . 1 . 2]" 1
836 1 65 ILE HA 1 72 ILE HA 3.960 . 3.960 2.388 2.316 2.472 . 0 0 "[ . 1 . 2]" 1
837 1 65 ILE HA 1 65 ILE HG13 4.120 . 4.120 3.102 3.047 3.180 . 0 0 "[ . 1 . 2]" 1
838 1 65 ILE HA 1 65 ILE MD 4.120 . 4.120 3.888 3.856 3.903 . 0 0 "[ . 1 . 2]" 1
839 1 63 ILE HA 1 74 LYS HA 3.740 . 3.740 2.168 1.894 2.521 . 0 0 "[ . 1 . 2]" 1
840 1 74 LYS HA 1 74 LYS HG2 3.920 . 3.920 3.039 2.560 3.192 . 0 0 "[ . 1 . 2]" 1
841 1 74 LYS HA 1 74 LYS HG3 3.920 . 3.920 2.568 2.431 2.842 . 0 0 "[ . 1 . 2]" 1
842 1 63 ILE HB 1 74 LYS HA 4.040 . 4.040 2.765 2.511 3.052 . 0 0 "[ . 1 . 2]" 1
843 1 63 ILE MG 1 74 LYS HA 3.400 . 3.400 2.200 1.991 2.581 . 0 0 "[ . 1 . 2]" 1
844 1 68 ALA MB 1 69 SER HA 4.080 . 4.080 3.833 3.705 3.940 . 0 0 "[ . 1 . 2]" 1
845 1 12 GLU HA 1 62 VAL HA 3.720 . 3.720 2.584 2.124 2.829 . 0 0 "[ . 1 . 2]" 1
846 1 67 LYS HA 1 68 ALA HA 4.930 . 4.930 4.731 4.678 4.777 . 0 0 "[ . 1 . 2]" 1
847 1 46 ASN HA 1 49 ILE MD 3.700 . 3.700 3.007 2.502 3.289 . 0 0 "[ . 1 . 2]" 1
848 1 46 ASN HA 1 49 ILE HG12 4.930 . 4.930 4.545 4.206 4.834 . 0 0 "[ . 1 . 2]" 1
849 1 46 ASN HA 1 49 ILE HB 3.560 . 3.560 2.862 2.722 3.060 . 0 0 "[ . 1 . 2]" 1
850 1 27 LYS H 1 46 ASN HA 4.290 . 4.290 3.098 2.370 3.577 . 0 0 "[ . 1 . 2]" 1
851 1 53 THR H 1 54 LYS HA 5.610 . 5.610 5.321 5.283 5.394 . 0 0 "[ . 1 . 2]" 1
852 1 53 THR MG 1 54 LYS HA 3.870 . 3.870 3.442 3.258 3.662 . 0 0 "[ . 1 . 2]" 1
853 1 54 LYS HA 1 54 LYS QG 3.500 . 3.500 2.825 2.538 2.998 . 0 0 "[ . 1 . 2]" 1
854 1 54 LYS HA 1 54 LYS QD 3.710 . 3.710 2.027 1.919 2.144 . 0 0 "[ . 1 . 2]" 1
855 1 47 LYS HA 1 50 ASP HB2 3.510 . 3.510 3.202 2.693 3.566 0.056 14 0 "[ . 1 . 2]" 1
856 1 47 LYS HA 1 50 ASP HB3 3.830 . 3.830 2.619 2.254 3.079 . 0 0 "[ . 1 . 2]" 1
857 1 47 LYS HA 1 47 LYS QD 3.750 . 3.750 2.186 1.910 3.838 0.088 18 0 "[ . 1 . 2]" 1
858 1 47 LYS HA 1 47 LYS HG3 3.740 . 3.740 3.416 2.394 3.805 0.065 8 0 "[ . 1 . 2]" 1
859 1 47 LYS HA 1 47 LYS HG2 3.740 . 3.740 3.341 2.863 3.779 0.039 4 0 "[ . 1 . 2]" 1
860 1 9 ILE HA 1 9 ILE MD 3.860 . 3.860 2.200 1.995 3.429 . 0 0 "[ . 1 . 2]" 1
861 1 9 ILE HA 1 9 ILE HG12 3.800 . 3.800 3.645 2.590 3.796 . 0 0 "[ . 1 . 2]" 1
862 1 9 ILE HA 1 9 ILE HG13 3.800 . 3.800 3.192 3.033 3.706 . 0 0 "[ . 1 . 2]" 1
863 1 9 ILE HA 1 10 GLU HA 4.930 . 4.930 4.390 4.367 4.421 . 0 0 "[ . 1 . 2]" 1
864 1 22 ILE HA 1 22 ILE MD 3.310 . 3.310 2.165 1.965 3.090 . 0 0 "[ . 1 . 2]" 1
865 1 22 ILE HA 1 22 ILE MG 3.170 . 3.170 2.406 2.338 2.545 . 0 0 "[ . 1 . 2]" 1
866 1 22 ILE HA 1 22 ILE HG12 3.870 . 3.870 3.120 2.975 3.595 . 0 0 "[ . 1 . 2]" 1
867 1 22 ILE HA 1 22 ILE HG13 3.870 . 3.870 3.608 2.271 3.817 . 0 0 "[ . 1 . 2]" 1
868 1 92 THR HA 1 92 THR MG 3.200 . 3.200 2.680 2.158 3.222 0.022 8 0 "[ . 1 . 2]" 1
869 1 14 VAL HA 1 59 ALA MB 4.180 . 4.180 3.747 3.135 4.144 . 0 0 "[ . 1 . 2]" 1
870 1 14 VAL HA 1 34 LYS HB2 6.000 . 6.000 5.212 4.399 6.004 0.004 5 0 "[ . 1 . 2]" 1
871 1 13 VAL HA 1 14 VAL HA 5.100 . 5.100 4.363 4.324 4.391 . 0 0 "[ . 1 . 2]" 1
872 1 14 VAL HA 1 59 ALA HA 5.410 . 5.410 4.568 4.324 5.026 . 0 0 "[ . 1 . 2]" 1
873 1 95 VAL HA 1 95 VAL MG1 3.720 . 3.720 2.477 2.246 3.219 . 0 0 "[ . 1 . 2]" 1
874 1 95 VAL HA 1 95 VAL MG2 3.720 . 3.720 2.829 2.136 3.229 . 0 0 "[ . 1 . 2]" 1
875 1 49 ILE MG 1 53 THR HA 5.150 . 5.150 5.109 4.930 5.207 0.057 10 0 "[ . 1 . 2]" 1
876 1 52 LEU HB2 1 53 THR HA 4.720 . 4.720 4.584 4.539 4.641 . 0 0 "[ . 1 . 2]" 1
877 1 53 THR HA 1 56 LYS HA 3.990 . 3.990 3.418 3.017 3.751 . 0 0 "[ . 1 . 2]" 1
878 1 67 LYS HA 1 67 LYS QG 3.480 . 3.480 2.802 2.319 2.968 . 0 0 "[ . 1 . 2]" 1
879 1 67 LYS HA 1 67 LYS QD 3.920 . 3.920 2.309 1.984 3.650 . 0 0 "[ . 1 . 2]" 1
880 1 67 LYS HA 1 67 LYS QE 4.720 . 4.720 3.823 2.900 4.783 0.063 18 0 "[ . 1 . 2]" 1
881 1 52 LEU HA 1 52 LEU HG 3.910 . 3.910 3.706 3.698 3.718 . 0 0 "[ . 1 . 2]" 1
882 1 52 LEU HA 1 55 GLU QG 4.870 . 4.870 3.760 3.553 4.063 . 0 0 "[ . 1 . 2]" 1
883 1 52 LEU HA 1 57 VAL H 4.530 . 4.530 3.664 3.537 3.923 . 0 0 "[ . 1 . 2]" 1
884 1 56 LYS HA 1 56 LYS QG 3.280 . 3.280 2.870 2.305 2.984 . 0 0 "[ . 1 . 2]" 1
885 1 56 LYS HA 1 56 LYS HD2 4.070 . 4.070 2.887 2.031 3.469 . 0 0 "[ . 1 . 2]" 1
886 1 56 LYS HA 1 56 LYS HD3 4.070 . 4.070 2.596 1.995 4.249 0.179 19 0 "[ . 1 . 2]" 1
887 1 13 VAL QG 1 59 ALA HA 3.360 . 3.360 2.049 1.624 2.246 . 0 0 "[ . 1 . 2]" 1
888 1 13 VAL HB 1 59 ALA HA 3.850 . 3.850 2.575 2.275 3.834 . 0 0 "[ . 1 . 2]" 1
889 1 13 VAL H 1 59 ALA HA 4.980 . 4.980 4.750 4.291 4.983 0.003 12 0 "[ . 1 . 2]" 1
890 1 97 CYS HB2 1 98 PRO QD 4.340 . 4.340 3.426 1.838 4.326 . 0 0 "[ . 1 . 2]" 1
891 1 18 ILE HA 1 18 ILE HG12 4.040 . 4.040 3.043 2.975 3.130 . 0 0 "[ . 1 . 2]" 1
892 1 16 ILE HA 1 16 ILE HG13 4.080 . 4.080 3.029 2.939 3.095 . 0 0 "[ . 1 . 2]" 1
893 1 53 THR HB 1 55 GLU H 4.940 . 4.940 4.936 4.768 5.005 0.065 7 0 "[ . 1 . 2]" 1
894 1 15 GLU HB2 1 32 THR HB 4.200 . 4.200 2.474 1.844 2.843 . 0 0 "[ . 1 . 2]" 1
895 1 15 GLU HB3 1 32 THR HB 4.310 . 4.310 2.353 1.957 3.389 . 0 0 "[ . 1 . 2]" 1
896 1 73 THR HB 1 74 LYS H 5.120 . 5.120 4.236 4.109 4.387 . 0 0 "[ . 1 . 2]" 1
897 1 40 THR HB 1 41 ILE H 4.880 . 4.880 3.694 3.600 3.811 . 0 0 "[ . 1 . 2]" 1
898 1 39 GLU HA 1 40 THR HB 4.960 . 4.960 4.621 4.451 4.724 . 0 0 "[ . 1 . 2]" 1
899 1 33 ILE HB 1 40 THR HB 5.040 . 5.040 4.810 4.379 5.081 0.041 15 0 "[ . 1 . 2]" 1
900 1 49 ILE HA 1 52 LEU MD1 3.520 . 3.520 2.672 2.543 2.824 . 0 0 "[ . 1 . 2]" 1
901 1 49 ILE HA 1 52 LEU MD2 3.330 . 3.330 2.090 2.038 2.145 . 0 0 "[ . 1 . 2]" 1
902 1 49 ILE HA 1 52 LEU HB3 4.830 . 4.830 4.378 4.268 4.528 . 0 0 "[ . 1 . 2]" 1
903 1 49 ILE HA 1 49 ILE HG13 4.090 . 4.090 2.229 2.201 2.257 . 0 0 "[ . 1 . 2]" 1
904 1 48 MET HA 1 49 ILE HA 5.600 . 5.600 4.826 4.798 4.851 . 0 0 "[ . 1 . 2]" 1
905 1 49 ILE HA 1 50 ASP HA 6.000 . 6.000 4.827 4.782 4.888 . 0 0 "[ . 1 . 2]" 1
906 1 49 ILE HA 1 53 THR HB 6.000 . 6.000 5.277 5.113 5.420 . 0 0 "[ . 1 . 2]" 1
907 1 49 ILE HA 1 51 GLY H 4.620 . 4.620 4.584 4.466 4.642 0.022 10 0 "[ . 1 . 2]" 1
908 1 10 GLU HB2 1 64 SER HB2 4.990 . 4.990 4.185 3.032 4.608 . 0 0 "[ . 1 . 2]" 1
909 1 10 GLU HA 1 64 SER HB3 5.010 . 5.010 4.049 3.605 5.056 0.046 7 0 "[ . 1 . 2]" 1
910 1 10 GLU HB2 1 64 SER HB3 4.990 . 4.990 3.193 2.787 4.877 . 0 0 "[ . 1 . 2]" 1
911 1 73 THR MG 1 75 LEU HA 4.330 . 4.330 3.958 3.349 4.337 0.007 15 0 "[ . 1 . 2]" 1
912 1 31 LEU HB2 1 42 TYR HB2 5.200 . 5.200 4.273 3.633 4.765 . 0 0 "[ . 1 . 2]" 1
913 1 35 THR HB 1 36 THR HB 4.880 . 4.880 4.078 3.945 4.224 . 0 0 "[ . 1 . 2]" 1
914 1 36 THR HB 1 37 ASP HA 5.220 . 5.220 4.312 4.106 4.560 . 0 0 "[ . 1 . 2]" 1
915 1 71 LYS HA 1 72 ILE MG 5.500 . 5.500 5.453 5.399 5.474 . 0 0 "[ . 1 . 2]" 1
916 1 71 LYS HA 1 71 LYS HG2 3.970 . 3.970 3.157 2.894 3.597 . 0 0 "[ . 1 . 2]" 1
917 1 71 LYS HA 1 71 LYS HG3 3.970 . 3.970 3.386 2.529 3.745 . 0 0 "[ . 1 . 2]" 1
918 1 85 TYR HA 1 86 ASP H 3.500 . 3.500 3.040 2.094 3.556 0.056 15 0 "[ . 1 . 2]" 1
919 1 85 TYR HA 1 85 TYR QD 3.320 . 3.320 2.632 2.004 3.091 . 0 0 "[ . 1 . 2]" 1
920 1 51 GLY HA3 1 54 LYS H 5.250 . 5.250 4.662 4.540 4.853 . 0 0 "[ . 1 . 2]" 1
921 1 11 GLY HA3 1 13 VAL QG 5.540 . 5.540 5.419 5.327 5.573 0.033 14 0 "[ . 1 . 2]" 1
922 1 11 GLY HA3 1 12 GLU HB2 5.540 . 5.540 5.048 4.911 5.196 . 0 0 "[ . 1 . 2]" 1
923 1 11 GLY HA2 1 33 ILE MD 5.610 . 5.610 4.720 4.558 4.923 . 0 0 "[ . 1 . 2]" 1
924 1 11 GLY HA2 1 63 ILE MD 6.000 . 6.000 5.270 4.953 5.461 . 0 0 "[ . 1 . 2]" 1
925 1 11 GLY HA2 1 33 ILE HG12 5.110 . 5.110 4.970 4.540 5.163 0.053 9 0 "[ . 1 . 2]" 1
926 1 11 GLY HA2 1 12 GLU HB2 5.110 . 5.110 4.579 4.447 4.705 . 0 0 "[ . 1 . 2]" 1
927 1 11 GLY HA2 1 12 GLU HB3 5.580 . 5.580 5.005 4.870 5.108 . 0 0 "[ . 1 . 2]" 1
928 1 97 CYS HB3 1 98 PRO QD 4.340 . 4.340 3.513 1.864 4.388 0.048 9 0 "[ . 1 . 2]" 1
929 1 22 ILE MG 1 26 HIS HB3 4.910 . 4.910 4.199 3.427 4.957 0.047 19 0 "[ . 1 . 2]" 1
930 1 8 LEU H 1 8 LEU HB3 3.840 . 3.840 3.773 3.728 3.805 . 0 0 "[ . 1 . 2]" 1
931 1 57 VAL MG1 1 63 ILE HB 4.590 . 4.590 4.129 3.774 4.316 . 0 0 "[ . 1 . 2]" 1
932 1 57 VAL MG2 1 63 ILE HB 4.590 . 4.590 3.409 3.127 3.600 . 0 0 "[ . 1 . 2]" 1
933 1 49 ILE HA 1 52 LEU HB2 4.910 . 4.910 4.833 4.743 4.931 0.021 18 0 "[ . 1 . 2]" 1
934 1 52 LEU HB3 1 72 ILE HG12 4.410 . 4.410 3.263 2.905 3.607 . 0 0 "[ . 1 . 2]" 1
935 1 75 LEU HB3 1 75 LEU QD . . 3.180 2.435 2.090 2.493 . 0 0 "[ . 1 . 2]" 1
936 1 102 LEU H 1 102 LEU HB2 4.130 . 4.130 2.832 2.304 3.958 . 0 0 "[ . 1 . 2]" 1
937 1 33 ILE HB 1 34 LYS H 4.320 . 4.320 4.302 4.261 4.347 0.027 15 0 "[ . 1 . 2]" 1
938 1 14 VAL H 1 33 ILE HB 5.550 . 5.550 5.436 5.277 5.561 0.011 10 0 "[ . 1 . 2]" 1
939 1 55 GLU QG 1 72 ILE HB 4.300 . 4.300 3.300 3.069 3.470 . 0 0 "[ . 1 . 2]" 1
940 1 72 ILE HB 1 72 ILE MD 2.870 . 2.870 2.364 2.321 2.400 . 0 0 "[ . 1 . 2]" 1
941 1 71 LYS HA 1 72 ILE HB 4.520 . 4.520 4.483 4.372 4.551 0.031 6 0 "[ . 1 . 2]" 1
942 1 9 ILE HB 1 65 ILE H 5.440 . 5.440 5.110 4.929 5.300 . 0 0 "[ . 1 . 2]" 1
943 1 9 ILE HB 1 10 GLU H 4.460 . 4.460 4.158 4.051 4.195 . 0 0 "[ . 1 . 2]" 1
944 1 8 LEU HA 1 9 ILE HB 4.770 . 4.770 4.684 4.576 4.785 0.015 1 0 "[ . 1 . 2]" 1
945 1 40 THR HA 1 41 ILE HB 4.820 . 4.820 4.672 4.544 4.772 . 0 0 "[ . 1 . 2]" 1
946 1 41 ILE HB 1 42 TYR H 5.090 . 5.090 4.099 4.016 4.213 . 0 0 "[ . 1 . 2]" 1
947 1 17 GLN HB3 1 30 LYS QB 4.240 . 4.240 2.078 1.900 2.339 . 0 0 "[ . 1 . 2]" 1
948 1 30 LYS QB 1 41 ILE MG 3.810 . 3.810 3.452 2.999 3.672 . 0 0 "[ . 1 . 2]" 1
949 1 30 LYS QB 1 41 ILE MD 4.730 . 4.730 4.522 4.043 4.750 0.020 9 0 "[ . 1 . 2]" 1
950 1 17 GLN HB2 1 30 LYS QB 4.240 . 4.240 3.201 2.687 3.538 . 0 0 "[ . 1 . 2]" 1
951 1 27 LYS HB2 1 49 ILE HB 3.980 . 3.980 2.746 2.354 3.017 . 0 0 "[ . 1 . 2]" 1
952 1 49 ILE HB 1 50 ASP HB2 4.710 . 4.710 4.491 4.327 4.652 . 0 0 "[ . 1 . 2]" 1
953 1 49 ILE HB 1 50 ASP HA 5.160 . 5.160 4.578 4.493 4.626 . 0 0 "[ . 1 . 2]" 1
954 1 48 MET H 1 49 ILE HB 4.930 . 4.930 4.661 4.586 4.793 . 0 0 "[ . 1 . 2]" 1
955 1 39 GLU HG2 1 40 THR H 5.310 . 5.310 4.869 4.360 5.186 . 0 0 "[ . 1 . 2]" 1
956 1 38 MET HB3 1 39 GLU H 4.370 . 4.370 3.739 3.645 4.039 . 0 0 "[ . 1 . 2]" 1
957 1 9 ILE MG 1 65 ILE MD 2.870 . 2.870 2.201 2.033 2.372 . 0 0 "[ . 1 . 2]" 1
958 1 65 ILE HB 1 65 ILE MD 3.200 . 3.200 2.402 2.381 2.426 . 0 0 "[ . 1 . 2]" 1
959 1 65 ILE MD 1 72 ILE HG12 3.880 . 3.880 3.711 3.485 3.886 0.006 13 0 "[ . 1 . 2]" 1
960 1 42 TYR HB2 1 65 ILE MD 5.190 . 5.190 3.743 3.449 4.037 . 0 0 "[ . 1 . 2]" 1
961 1 65 ILE MD 1 67 LYS QE 5.870 . 5.870 4.931 3.984 5.894 0.024 3 0 "[ . 1 . 2]" 1
962 1 9 ILE HA 1 65 ILE MD 6.000 . 6.000 5.608 5.403 5.795 . 0 0 "[ . 1 . 2]" 1
963 1 48 MET HA 1 65 ILE MD 5.240 . 5.240 5.057 4.619 5.287 0.047 8 0 "[ . 1 . 2]" 1
964 1 65 ILE MD 1 72 ILE HA 5.280 . 5.280 5.078 4.877 5.252 . 0 0 "[ . 1 . 2]" 1
965 1 10 GLU HA 1 65 ILE MD 4.930 . 4.930 4.777 4.497 4.959 0.029 11 0 "[ . 1 . 2]" 1
966 1 65 ILE MD 1 66 ASP H 5.130 . 5.130 5.178 5.145 5.225 0.095 20 0 "[ . 1 . 2]" 1
967 1 10 GLU H 1 65 ILE MD 6.000 . 6.000 5.858 5.671 6.011 0.011 11 0 "[ . 1 . 2]" 1
968 1 64 SER H 1 65 ILE MD 5.970 . 5.970 5.669 5.509 5.813 . 0 0 "[ . 1 . 2]" 1
969 1 65 ILE MD 1 73 THR H 6.000 . 6.000 5.932 5.753 6.038 0.038 17 0 "[ . 1 . 2]" 1
970 1 9 ILE HB 1 9 ILE MD 3.100 . 3.100 2.484 2.376 3.202 0.102 8 0 "[ . 1 . 2]" 1
971 1 9 ILE MD 1 10 GLU HG3 4.490 . 4.490 4.469 4.270 4.692 0.202 1 0 "[ . 1 . 2]" 1
972 1 9 ILE MD 1 42 TYR HB3 5.740 . 5.740 5.686 4.410 5.850 0.110 12 0 "[ . 1 . 2]" 1
973 1 8 LEU HA 1 9 ILE MD 5.990 . 5.990 5.718 5.655 5.782 . 0 0 "[ . 1 . 2]" 1
974 1 9 ILE MD 1 42 TYR QD 4.200 . 4.200 4.073 3.183 4.239 0.039 7 0 "[ . 1 . 2]" 1
975 1 9 ILE MD 1 65 ILE H 5.580 . 5.580 5.053 3.339 5.409 . 0 0 "[ . 1 . 2]" 1
976 1 30 LYS H 1 49 ILE MD 5.380 . 5.380 5.170 4.923 5.393 0.013 8 0 "[ . 1 . 2]" 1
977 1 19 ASP H 1 49 ILE MD 5.030 . 5.030 4.763 4.267 5.046 0.016 17 0 "[ . 1 . 2]" 1
978 1 28 GLN H 1 49 ILE MD 3.890 . 3.890 3.373 3.109 3.608 . 0 0 "[ . 1 . 2]" 1
979 1 29 GLY H 1 49 ILE MD 3.890 . 3.890 2.917 2.567 3.228 . 0 0 "[ . 1 . 2]" 1
980 1 49 ILE H 1 49 ILE MD 3.660 . 3.660 2.003 1.918 2.088 . 0 0 "[ . 1 . 2]" 1
981 1 45 GLY H 1 49 ILE MD 4.970 . 4.970 3.764 3.574 3.987 . 0 0 "[ . 1 . 2]" 1
982 1 28 GLN HA 1 49 ILE MD 3.800 . 3.800 2.524 2.025 2.910 . 0 0 "[ . 1 . 2]" 1
983 1 27 LYS HA 1 49 ILE MD 4.400 . 4.400 4.316 4.071 4.444 0.044 1 0 "[ . 1 . 2]" 1
984 1 49 ILE HA 1 49 ILE MD 3.690 . 3.690 2.851 2.760 2.984 . 0 0 "[ . 1 . 2]" 1
985 1 27 LYS QE 1 49 ILE MD 5.550 . 5.550 5.385 4.084 5.683 0.133 12 0 "[ . 1 . 2]" 1
986 1 46 ASN QB 1 49 ILE MD 4.720 . 4.720 4.592 4.241 4.803 0.083 17 0 "[ . 1 . 2]" 1
987 1 28 GLN QG 1 49 ILE MD 4.670 . 4.670 4.447 4.241 4.680 0.010 19 0 "[ . 1 . 2]" 1
988 1 27 LYS HB2 1 49 ILE MD 3.300 . 3.300 2.760 2.502 3.218 . 0 0 "[ . 1 . 2]" 1
989 1 33 ILE MD 1 63 ILE HG12 3.690 . 3.690 3.066 2.733 3.272 . 0 0 "[ . 1 . 2]" 1
990 1 31 LEU HG 1 33 ILE MD 3.620 . 3.620 3.260 2.654 3.625 0.005 16 0 "[ . 1 . 2]" 1
991 1 33 ILE HB 1 33 ILE MD 3.390 . 3.390 2.367 2.302 2.403 . 0 0 "[ . 1 . 2]" 1
992 1 31 LEU HB3 1 33 ILE MD 4.610 . 4.610 4.150 3.552 4.661 0.051 18 0 "[ . 1 . 2]" 1
993 1 13 VAL HB 1 33 ILE MD 5.730 . 5.730 5.603 3.645 5.841 0.111 9 0 "[ . 1 . 2]" 1
994 1 33 ILE MD 1 42 TYR HB3 5.690 . 5.690 5.251 4.964 5.589 . 0 0 "[ . 1 . 2]" 1
995 1 33 ILE MD 1 42 TYR HB2 5.030 . 5.030 4.216 3.900 4.572 . 0 0 "[ . 1 . 2]" 1
996 1 13 VAL HA 1 33 ILE MD 4.210 . 4.210 4.133 3.965 4.217 0.007 13 0 "[ . 1 . 2]" 1
997 1 11 GLY HA3 1 33 ILE MD 4.230 . 4.230 3.638 3.495 3.830 . 0 0 "[ . 1 . 2]" 1
998 1 33 ILE HA 1 33 ILE MD 3.870 . 3.870 3.704 3.678 3.724 . 0 0 "[ . 1 . 2]" 1
999 1 33 ILE MD 1 64 SER HA 4.860 . 4.860 4.364 4.064 4.610 . 0 0 "[ . 1 . 2]" 1
1000 1 10 GLU H 1 33 ILE MD 4.970 . 4.970 4.396 4.075 4.781 . 0 0 "[ . 1 . 2]" 1
1001 1 11 GLY H 1 33 ILE MD 3.910 . 3.910 3.117 2.935 3.378 . 0 0 "[ . 1 . 2]" 1
1002 1 33 ILE MD 1 63 ILE H 4.530 . 4.530 3.854 3.479 4.101 . 0 0 "[ . 1 . 2]" 1
1003 1 33 ILE MD 1 64 SER H 5.980 . 5.980 5.515 5.220 5.815 . 0 0 "[ . 1 . 2]" 1
1004 1 32 THR H 1 33 ILE MD 5.470 . 5.470 5.535 5.508 5.566 0.096 11 0 "[ . 1 . 2]" 1
1005 1 33 ILE H 1 33 ILE MD 4.550 . 4.550 4.302 4.178 4.339 . 0 0 "[ . 1 . 2]" 1
1006 1 33 ILE MD 1 42 TYR H 5.890 . 5.890 5.415 5.044 5.815 . 0 0 "[ . 1 . 2]" 1
1007 1 65 ILE HG13 1 65 ILE MG 3.310 . 3.310 3.202 3.198 3.206 . 0 0 "[ . 1 . 2]" 1
1008 1 65 ILE MG 1 72 ILE HG13 3.810 . 3.810 2.138 2.011 2.326 . 0 0 "[ . 1 . 2]" 1
1009 1 65 ILE HG12 1 65 ILE MG 3.380 . 3.380 2.360 2.333 2.384 . 0 0 "[ . 1 . 2]" 1
1010 1 48 MET HG2 1 65 ILE MG 4.870 . 4.870 3.349 2.978 4.533 . 0 0 "[ . 1 . 2]" 1
1011 1 48 MET HG3 1 65 ILE MG 4.870 . 4.870 2.656 2.370 4.083 . 0 0 "[ . 1 . 2]" 1
1012 1 65 ILE MG 1 70 GLY HA2 4.190 . 4.190 3.751 3.550 3.830 . 0 0 "[ . 1 . 2]" 1
1013 1 65 ILE MG 1 70 GLY HA3 5.160 . 5.160 5.096 4.903 5.181 0.021 18 0 "[ . 1 . 2]" 1
1014 1 65 ILE HA 1 65 ILE MG 3.460 . 3.460 2.313 2.278 2.349 . 0 0 "[ . 1 . 2]" 1
1015 1 65 ILE MG 1 72 ILE HA 4.230 . 4.230 3.525 3.339 3.630 . 0 0 "[ . 1 . 2]" 1
1016 1 8 LEU HA 1 65 ILE MG 5.720 . 5.720 4.967 4.809 5.164 . 0 0 "[ . 1 . 2]" 1
1017 1 64 SER HA 1 65 ILE MG 5.460 . 5.460 5.397 5.362 5.417 . 0 0 "[ . 1 . 2]" 1
1018 1 42 TYR QD 1 65 ILE MG 6.000 . 6.000 5.835 5.487 6.016 0.016 5 0 "[ . 1 . 2]" 1
1019 1 9 ILE H 1 65 ILE MG 4.930 . 4.930 4.275 4.111 4.464 . 0 0 "[ . 1 . 2]" 1
1020 1 65 ILE MG 1 73 THR H 5.090 . 5.090 5.081 4.906 5.163 0.073 15 0 "[ . 1 . 2]" 1
1021 1 58 LEU H 1 63 ILE MD 5.670 . 5.670 5.548 4.727 5.704 0.034 3 0 "[ . 1 . 2]" 1
1022 1 14 VAL H 1 63 ILE MD 6.000 . 6.000 5.643 5.326 5.878 . 0 0 "[ . 1 . 2]" 1
1023 1 63 ILE MD 1 65 ILE H 6.000 . 6.000 5.309 4.872 5.612 . 0 0 "[ . 1 . 2]" 1
1024 1 63 ILE HA 1 63 ILE MD 4.180 . 4.180 3.589 3.571 3.620 . 0 0 "[ . 1 . 2]" 1
1025 1 63 ILE MD 1 64 SER HA 4.740 . 4.740 4.406 4.199 4.587 . 0 0 "[ . 1 . 2]" 1
1026 1 63 ILE MD 1 74 LYS HA 5.150 . 5.150 4.789 4.632 4.942 . 0 0 "[ . 1 . 2]" 1
1027 1 13 VAL HA 1 63 ILE MD 4.550 . 4.550 3.966 3.610 4.185 . 0 0 "[ . 1 . 2]" 1
1028 1 61 ASP HB2 1 63 ILE MD 5.170 . 5.170 4.419 3.946 5.202 0.032 10 0 "[ . 1 . 2]" 1
1029 1 13 VAL HB 1 63 ILE MD 4.780 . 4.780 4.044 2.344 4.188 . 0 0 "[ . 1 . 2]" 1
1030 1 63 ILE HB 1 63 ILE MD 3.410 . 3.410 3.236 3.224 3.244 . 0 0 "[ . 1 . 2]" 1
1031 1 31 LEU HG 1 63 ILE MD 4.430 . 4.430 3.998 3.145 4.467 0.037 13 0 "[ . 1 . 2]" 1
1032 1 13 VAL QG 1 63 ILE MD 2.710 . 2.710 1.887 1.804 1.986 . 0 0 "[ . 1 . 2]" 1
1033 1 63 ILE MD 1 63 ILE MG 2.580 . 2.580 1.947 1.913 1.981 . 0 0 "[ . 1 . 2]" 1
1034 1 63 ILE MD 1 65 ILE MD 3.770 . 3.770 3.356 2.811 3.804 0.034 14 0 "[ . 1 . 2]" 1
1035 1 18 ILE H 1 18 ILE MD 4.070 . 4.070 3.753 3.614 3.894 . 0 0 "[ . 1 . 2]" 1
1036 1 18 ILE MD 1 28 GLN H 5.060 . 5.060 5.090 4.995 5.149 0.089 20 0 "[ . 1 . 2]" 1
1037 1 18 ILE MD 1 29 GLY H 4.930 . 4.930 4.278 4.088 4.459 . 0 0 "[ . 1 . 2]" 1
1038 1 18 ILE MD 1 49 ILE H 5.130 . 5.130 4.899 4.706 5.158 0.028 13 0 "[ . 1 . 2]" 1
1039 1 18 ILE MD 1 29 GLY HA3 4.490 . 4.490 2.072 1.880 2.224 . 0 0 "[ . 1 . 2]" 1
1040 1 18 ILE HA 1 18 ILE MD 3.680 . 3.680 2.049 1.999 2.150 . 0 0 "[ . 1 . 2]" 1
1041 1 18 ILE MD 1 29 GLY HA2 4.490 . 4.490 3.219 2.687 3.588 . 0 0 "[ . 1 . 2]" 1
1042 1 18 ILE MD 1 49 ILE HA 4.290 . 4.290 3.416 3.217 3.651 . 0 0 "[ . 1 . 2]" 1
1043 1 18 ILE HB 1 18 ILE MD 3.390 . 3.390 3.236 3.231 3.242 . 0 0 "[ . 1 . 2]" 1
1044 1 18 ILE MD 1 49 ILE HG13 3.640 . 3.640 2.054 1.872 2.276 . 0 0 "[ . 1 . 2]" 1
1045 1 18 ILE MD 1 49 ILE MD 3.150 . 3.150 2.844 2.469 3.039 . 0 0 "[ . 1 . 2]" 1
1046 1 55 GLU QG 1 72 ILE MD 4.890 . 4.890 4.787 4.496 4.930 0.040 3 0 "[ . 1 . 2]" 1
1047 1 48 MET HG2 1 72 ILE MD 4.130 . 4.130 3.783 3.621 4.032 . 0 0 "[ . 1 . 2]" 1
1048 1 71 LYS QE 1 72 ILE MD 4.900 . 4.900 4.828 3.802 4.973 0.073 4 0 "[ . 1 . 2]" 1
1049 1 70 GLY HA2 1 72 ILE MD 4.740 . 4.740 3.806 3.509 4.167 . 0 0 "[ . 1 . 2]" 1
1050 1 52 LEU HA 1 72 ILE MD 4.370 . 4.370 4.417 4.385 4.473 0.103 10 0 "[ . 1 . 2]" 1
1051 1 51 GLY HA2 1 72 ILE MD 3.920 . 3.920 3.607 3.462 3.701 . 0 0 "[ . 1 . 2]" 1
1052 1 51 GLY HA3 1 72 ILE MD 3.920 . 3.920 2.027 1.918 2.124 . 0 0 "[ . 1 . 2]" 1
1053 1 71 LYS HA 1 72 ILE MD 4.210 . 4.210 2.996 2.869 3.163 . 0 0 "[ . 1 . 2]" 1
1054 1 65 ILE HA 1 72 ILE MD 4.360 . 4.360 3.612 3.408 3.773 . 0 0 "[ . 1 . 2]" 1
1055 1 72 ILE HA 1 72 ILE MD 4.030 . 4.030 2.970 2.795 3.075 . 0 0 "[ . 1 . 2]" 1
1056 1 55 GLU H 1 72 ILE MD 6.000 . 6.000 5.992 5.877 6.092 0.092 19 0 "[ . 1 . 2]" 1
1057 1 66 ASP H 1 72 ILE MD 4.670 . 4.670 3.779 3.541 4.030 . 0 0 "[ . 1 . 2]" 1
1058 1 72 ILE MD 1 73 THR H 5.110 . 5.110 4.759 4.634 4.831 . 0 0 "[ . 1 . 2]" 1
1059 1 65 ILE H 1 72 ILE MD 6.000 . 6.000 5.925 5.762 6.064 0.064 6 0 "[ . 1 . 2]" 1
1060 1 16 ILE MD 1 60 GLY H 5.020 . 5.020 4.955 4.792 5.058 0.038 15 0 "[ . 1 . 2]" 1
1061 1 16 ILE H 1 16 ILE MD 4.530 . 4.530 4.363 4.289 4.446 . 0 0 "[ . 1 . 2]" 1
1062 1 16 ILE HA 1 16 ILE MD 4.040 . 4.040 3.806 3.783 3.825 . 0 0 "[ . 1 . 2]" 1
1063 1 16 ILE MD 1 59 ALA HA 4.260 . 4.260 3.299 3.078 3.444 . 0 0 "[ . 1 . 2]" 1
1064 1 16 ILE HB 1 16 ILE MD 3.170 . 3.170 2.449 2.433 2.464 . 0 0 "[ . 1 . 2]" 1
1065 1 41 ILE HB 1 41 ILE MD 2.930 . 2.930 2.446 2.402 2.489 . 0 0 "[ . 1 . 2]" 1
1066 1 30 LYS QE 1 41 ILE MD 4.310 . 4.310 4.007 3.443 4.461 0.151 3 0 "[ . 1 . 2]" 1
1067 1 41 ILE HA 1 41 ILE MD 4.180 . 4.180 3.813 3.751 3.857 . 0 0 "[ . 1 . 2]" 1
1068 1 30 LYS HA 1 41 ILE MD 6.000 . 6.000 5.819 5.127 6.047 0.047 10 0 "[ . 1 . 2]" 1
1069 1 40 THR HA 1 41 ILE MD 5.130 . 5.130 4.924 4.778 5.146 0.016 3 0 "[ . 1 . 2]" 1
1070 1 41 ILE H 1 41 ILE MD 4.000 . 4.000 3.914 3.813 4.004 0.004 3 0 "[ . 1 . 2]" 1
1071 1 41 ILE MD 1 42 TYR H 5.160 . 5.160 4.960 4.733 5.128 . 0 0 "[ . 1 . 2]" 1
1072 1 22 ILE HB 1 22 ILE MD 3.400 . 3.400 3.143 2.294 3.240 . 0 0 "[ . 1 . 2]" 1
1073 1 9 ILE HG13 1 9 ILE MG 3.220 . 3.220 2.428 2.385 2.549 . 0 0 "[ . 1 . 2]" 1
1074 1 9 ILE MG 1 65 ILE HB 3.490 . 3.490 1.802 1.722 1.873 . 0 0 "[ . 1 . 2]" 1
1075 1 9 ILE MG 1 67 LYS QE 4.770 . 4.770 3.180 1.958 4.667 . 0 0 "[ . 1 . 2]" 1
1076 1 9 ILE HA 1 9 ILE MG 3.260 . 3.260 3.208 3.189 3.218 . 0 0 "[ . 1 . 2]" 1
1077 1 9 ILE MG 1 64 SER HA 4.550 . 4.550 4.250 4.038 4.480 . 0 0 "[ . 1 . 2]" 1
1078 1 9 ILE MG 1 10 GLU HA 4.430 . 4.430 4.120 3.914 4.259 . 0 0 "[ . 1 . 2]" 1
1079 1 9 ILE MG 1 42 TYR QE 4.450 . 4.450 4.175 3.766 4.364 . 0 0 "[ . 1 . 2]" 1
1080 1 9 ILE MG 1 42 TYR QD 4.380 . 4.380 3.862 3.612 4.108 . 0 0 "[ . 1 . 2]" 1
1081 1 9 ILE MG 1 10 GLU H 4.230 . 4.230 4.109 3.997 4.194 . 0 0 "[ . 1 . 2]" 1
1082 1 72 ILE MG 1 74 LYS H 4.440 . 4.440 3.735 3.460 3.998 . 0 0 "[ . 1 . 2]" 1
1083 1 52 LEU H 1 72 ILE MG 4.690 . 4.690 3.951 3.736 4.220 . 0 0 "[ . 1 . 2]" 1
1084 1 63 ILE HA 1 72 ILE MG 5.120 . 5.120 4.266 4.061 4.604 . 0 0 "[ . 1 . 2]" 1
1085 1 64 SER HA 1 72 ILE MG 5.580 . 5.580 4.868 4.687 5.134 . 0 0 "[ . 1 . 2]" 1
1086 1 72 ILE HA 1 72 ILE MG 3.590 . 3.590 2.543 2.507 2.594 . 0 0 "[ . 1 . 2]" 1
1087 1 65 ILE HA 1 72 ILE MG 4.330 . 4.330 3.643 3.409 3.900 . 0 0 "[ . 1 . 2]" 1
1088 1 72 ILE MG 1 74 LYS HA 4.840 . 4.840 3.970 3.734 4.187 . 0 0 "[ . 1 . 2]" 1
1089 1 72 ILE MG 1 73 THR HA 4.170 . 4.170 3.427 3.279 3.594 . 0 0 "[ . 1 . 2]" 1
1090 1 48 MET HA 1 72 ILE MG 5.850 . 5.850 5.199 4.966 5.400 . 0 0 "[ . 1 . 2]" 1
1091 1 55 GLU HA 1 72 ILE MG 6.000 . 6.000 5.283 4.974 5.499 . 0 0 "[ . 1 . 2]" 1
1092 1 52 LEU HA 1 72 ILE MG 4.140 . 4.140 2.616 2.219 2.946 . 0 0 "[ . 1 . 2]" 1
1093 1 71 LYS QE 1 72 ILE MG 5.660 . 5.660 4.999 4.412 5.774 0.114 14 0 "[ . 1 . 2]" 1
1094 1 65 ILE HG12 1 72 ILE MG 3.860 . 3.860 3.016 2.778 3.203 . 0 0 "[ . 1 . 2]" 1
1095 1 63 ILE HG12 1 72 ILE MG 3.880 . 3.880 3.166 2.843 3.743 . 0 0 "[ . 1 . 2]" 1
1096 1 41 ILE H 1 41 ILE MG 3.980 . 3.980 3.797 3.719 3.828 . 0 0 "[ . 1 . 2]" 1
1097 1 41 ILE MG 1 43 GLU H 4.480 . 4.480 4.390 4.199 4.545 0.065 16 0 "[ . 1 . 2]" 1
1098 1 32 THR H 1 41 ILE MG 4.910 . 4.910 4.392 4.068 4.631 . 0 0 "[ . 1 . 2]" 1
1099 1 33 ILE H 1 41 ILE MG 5.000 . 5.000 4.958 4.819 5.051 0.051 3 0 "[ . 1 . 2]" 1
1100 1 41 ILE MG 1 42 TYR H 3.610 . 3.610 2.519 2.378 2.726 . 0 0 "[ . 1 . 2]" 1
1101 1 41 ILE MG 1 42 TYR QD 5.180 . 5.180 4.693 4.534 4.842 . 0 0 "[ . 1 . 2]" 1
1102 1 32 THR HA 1 41 ILE MG 4.210 . 4.210 3.368 3.159 3.582 . 0 0 "[ . 1 . 2]" 1
1103 1 41 ILE HA 1 41 ILE MG 3.590 . 3.590 2.396 2.332 2.469 . 0 0 "[ . 1 . 2]" 1
1104 1 41 ILE MG 1 42 TYR HA 4.340 . 4.340 3.593 3.422 3.709 . 0 0 "[ . 1 . 2]" 1
1105 1 41 ILE MG 1 43 GLU HA 4.330 . 4.330 4.175 3.924 4.341 0.011 19 0 "[ . 1 . 2]" 1
1106 1 41 ILE MG 1 42 TYR HB2 4.620 . 4.620 4.620 4.464 4.686 0.066 15 0 "[ . 1 . 2]" 1
1107 1 41 ILE MG 1 42 TYR HB3 5.290 . 5.290 5.210 5.043 5.297 0.007 15 0 "[ . 1 . 2]" 1
1108 1 41 ILE MG 1 43 GLU HG3 4.570 . 4.570 4.113 3.477 4.584 0.014 6 0 "[ . 1 . 2]" 1
1109 1 41 ILE MG 1 43 GLU HG2 4.930 . 4.930 4.171 3.475 4.934 0.004 16 0 "[ . 1 . 2]" 1
1110 1 31 LEU HB3 1 41 ILE MG 4.800 . 4.800 4.626 4.372 4.797 . 0 0 "[ . 1 . 2]" 1
1111 1 41 ILE HG12 1 41 ILE MG 3.390 . 3.390 2.399 2.367 2.460 . 0 0 "[ . 1 . 2]" 1
1112 1 33 ILE MD 1 33 ILE MG 2.770 . 2.770 1.935 1.847 2.019 . 0 0 "[ . 1 . 2]" 1
1113 1 33 ILE HG13 1 33 ILE MG 3.250 . 3.250 3.190 3.171 3.201 . 0 0 "[ . 1 . 2]" 1
1114 1 33 ILE HG12 1 33 ILE MG 3.180 . 3.180 2.332 2.269 2.378 . 0 0 "[ . 1 . 2]" 1
1115 1 33 ILE MG 1 40 THR HB 4.520 . 4.520 4.219 3.804 4.524 0.004 14 0 "[ . 1 . 2]" 1
1116 1 11 GLY HA2 1 33 ILE MG 3.830 . 3.830 3.543 3.388 3.821 . 0 0 "[ . 1 . 2]" 1
1117 1 11 GLY HA3 1 33 ILE MG 3.610 . 3.610 2.021 1.865 2.270 . 0 0 "[ . 1 . 2]" 1
1118 1 33 ILE MG 1 42 TYR QD 4.690 . 4.690 3.842 3.583 4.015 . 0 0 "[ . 1 . 2]" 1
1119 1 12 GLU H 1 33 ILE MG 3.700 . 3.700 3.163 2.915 3.540 . 0 0 "[ . 1 . 2]" 1
1120 1 11 GLY H 1 33 ILE MG 4.240 . 4.240 3.477 3.328 3.733 . 0 0 "[ . 1 . 2]" 1
1121 1 33 ILE MG 1 40 THR H 4.180 . 4.180 3.544 3.281 3.673 . 0 0 "[ . 1 . 2]" 1
1122 1 14 VAL H 1 33 ILE MG 5.190 . 5.190 5.038 4.925 5.174 . 0 0 "[ . 1 . 2]" 1
1123 1 33 ILE H 1 33 ILE MG 3.750 . 3.750 3.475 3.368 3.555 . 0 0 "[ . 1 . 2]" 1
1124 1 33 ILE MG 1 34 LYS H 3.590 . 3.590 2.599 2.525 2.680 . 0 0 "[ . 1 . 2]" 1
1125 1 63 ILE H 1 63 ILE MG 3.760 . 3.760 2.905 2.804 2.993 . 0 0 "[ . 1 . 2]" 1
1126 1 63 ILE MG 1 75 LEU H 3.850 . 3.850 3.284 2.919 3.660 . 0 0 "[ . 1 . 2]" 1
1127 1 63 ILE MG 1 74 LYS H 5.050 . 5.050 4.281 3.641 4.802 . 0 0 "[ . 1 . 2]" 1
1128 1 61 ASP H 1 63 ILE MG 5.440 . 5.440 5.054 4.603 5.360 . 0 0 "[ . 1 . 2]" 1
1129 1 57 VAL H 1 63 ILE MG 5.050 . 5.050 4.774 4.600 4.982 . 0 0 "[ . 1 . 2]" 1
1130 1 63 ILE HA 1 63 ILE MG 3.360 . 3.360 2.493 2.448 2.546 . 0 0 "[ . 1 . 2]" 1
1131 1 61 ASP HB2 1 63 ILE MG 3.800 . 3.800 3.571 3.236 3.923 0.123 18 0 "[ . 1 . 2]" 1
1132 1 61 ASP HB3 1 63 ILE MG 3.820 . 3.820 2.823 2.289 3.457 . 0 0 "[ . 1 . 2]" 1
1133 1 63 ILE HG12 1 63 ILE MG 3.500 . 3.500 3.202 3.194 3.210 . 0 0 "[ . 1 . 2]" 1
1134 1 63 ILE MG 1 74 LYS HG2 3.560 . 3.560 3.423 2.591 3.615 0.055 15 0 "[ . 1 . 2]" 1
1135 1 63 ILE MG 1 74 LYS HG3 3.560 . 3.560 2.040 1.858 2.489 . 0 0 "[ . 1 . 2]" 1
1136 1 57 VAL MG1 1 63 ILE MG 2.710 . 2.710 2.037 1.930 2.189 . 0 0 "[ . 1 . 2]" 1
1137 1 22 ILE HG12 1 22 ILE MG 3.350 . 3.350 3.103 2.163 3.215 . 0 0 "[ . 1 . 2]" 1
1138 1 22 ILE HG13 1 22 ILE MG 3.350 . 3.350 2.401 2.321 2.584 . 0 0 "[ . 1 . 2]" 1
1139 1 22 ILE MG 1 27 LYS HB3 4.980 . 4.980 3.936 3.275 4.878 . 0 0 "[ . 1 . 2]" 1
1140 1 22 ILE MG 1 28 GLN QG 4.580 . 4.580 3.899 2.027 4.625 0.045 9 0 "[ . 1 . 2]" 1
1141 1 22 ILE MG 1 26 HIS HB2 4.910 . 4.910 4.268 2.597 5.078 0.168 15 0 "[ . 1 . 2]" 1
1142 1 22 ILE MG 1 25 GLY QA 4.470 . 4.470 4.014 2.745 4.568 0.098 1 0 "[ . 1 . 2]" 1
1143 1 49 ILE H 1 49 ILE MG 3.710 . 3.710 3.728 3.696 3.748 0.038 3 0 "[ . 1 . 2]" 1
1144 1 49 ILE MD 1 49 ILE MG 3.140 . 3.140 3.179 3.152 3.197 0.057 1 0 "[ . 1 . 2]" 1
1145 1 49 ILE HA 1 49 ILE MG 3.340 . 3.340 2.633 2.585 2.687 . 0 0 "[ . 1 . 2]" 1
1146 1 27 LYS QE 1 49 ILE MG 3.920 . 3.920 3.153 2.002 3.691 . 0 0 "[ . 1 . 2]" 1
1147 1 46 ASN HA 1 49 ILE MG 4.010 . 4.010 4.060 3.984 4.137 0.127 13 0 "[ . 1 . 2]" 1
1148 1 18 ILE H 1 18 ILE MG 3.960 . 3.960 3.852 3.818 3.894 . 0 0 "[ . 1 . 2]" 1
1149 1 18 ILE MG 1 28 GLN H 4.700 . 4.700 4.379 3.902 4.717 0.017 18 0 "[ . 1 . 2]" 1
1150 1 18 ILE HA 1 18 ILE MG 3.380 . 3.380 2.430 2.345 2.467 . 0 0 "[ . 1 . 2]" 1
1151 1 18 ILE MG 1 19 ASP HA 4.270 . 4.270 4.031 3.800 4.228 . 0 0 "[ . 1 . 2]" 1
1152 1 18 ILE HG12 1 18 ILE MG 3.270 . 3.270 3.203 3.199 3.207 . 0 0 "[ . 1 . 2]" 1
1153 1 58 LEU HA 1 59 ALA MB 4.200 . 4.200 4.191 4.065 4.244 0.044 12 0 "[ . 1 . 2]" 1
1154 1 59 ALA MB 1 61 ASP H 4.680 . 4.680 4.439 4.296 4.512 . 0 0 "[ . 1 . 2]" 1
1155 1 59 ALA MB 1 60 GLY H 3.350 . 3.350 3.026 2.889 3.144 . 0 0 "[ . 1 . 2]" 1
1156 1 79 PHE HA 1 80 ALA MB 4.590 . 4.590 4.075 3.788 4.538 . 0 0 "[ . 1 . 2]" 1
1157 1 13 VAL QG 1 16 ILE HG12 3.560 . 3.560 2.494 2.372 2.662 . 0 0 "[ . 1 . 2]" 1
1158 1 13 VAL QG 1 16 ILE MD 3.140 . 3.140 1.957 1.877 2.135 . 0 0 "[ . 1 . 2]" 1
1159 1 13 VAL QG 1 59 ALA MB 3.280 . 3.280 2.896 2.174 3.172 . 0 0 "[ . 1 . 2]" 1
1160 1 13 VAL QG 1 16 ILE HG13 3.560 . 3.560 2.107 1.883 2.227 . 0 0 "[ . 1 . 2]" 1
1161 1 13 VAL QG 1 16 ILE HB 4.150 . 4.150 4.017 3.719 4.140 . 0 0 "[ . 1 . 2]" 1
1162 1 13 VAL QG 1 15 GLU HB2 4.980 . 4.980 4.907 4.677 5.009 0.029 10 0 "[ . 1 . 2]" 1
1163 1 13 VAL QG 1 15 GLU HB3 6.000 . 6.000 4.814 4.639 5.175 . 0 0 "[ . 1 . 2]" 1
1164 1 13 VAL QG 1 61 ASP HB2 . . 3.850 3.179 2.764 3.734 . 0 0 "[ . 1 . 2]" 1
1165 1 13 VAL HA 1 13 VAL QG . . 3.260 2.146 2.114 2.551 . 0 0 "[ . 1 . 2]" 1
1166 1 13 VAL QG 1 14 VAL HA 4.330 . 4.330 3.745 3.485 3.956 . 0 0 "[ . 1 . 2]" 1
1167 1 13 VAL QG 1 16 ILE HA 4.630 . 4.630 3.905 3.708 4.065 . 0 0 "[ . 1 . 2]" 1
1168 1 13 VAL QG 1 58 LEU HA 4.650 . 4.650 3.891 3.656 4.113 . 0 0 "[ . 1 . 2]" 1
1169 1 12 GLU HA 1 13 VAL QG . . 3.980 3.538 3.170 3.653 . 0 0 "[ . 1 . 2]" 1
1170 1 13 VAL QG 1 31 LEU HA 4.770 . 4.770 4.218 4.001 4.455 . 0 0 "[ . 1 . 2]" 1
1171 1 13 VAL QG 1 33 ILE HA . . 4.400 3.663 3.555 3.948 . 0 0 "[ . 1 . 2]" 1
1172 1 13 VAL QG 1 15 GLU H 3.720 . 3.720 2.623 2.498 2.864 . 0 0 "[ . 1 . 2]" 1
1173 1 13 VAL QG 1 16 ILE H 4.570 . 4.570 4.222 4.064 4.412 . 0 0 "[ . 1 . 2]" 1
1174 1 13 VAL QG 1 14 VAL H 3.420 . 3.420 2.796 2.667 2.995 . 0 0 "[ . 1 . 2]" 1
1175 1 13 VAL H 1 62 VAL MG1 5.000 . 5.000 4.855 4.651 5.181 0.181 1 0 "[ . 1 . 2]" 1
1176 1 12 GLU H 1 62 VAL MG1 5.470 . 5.470 4.156 3.760 5.597 0.127 1 0 "[ . 1 . 2]" 1
1177 1 62 VAL MG1 1 77 ARG H 5.360 . 5.360 3.820 1.897 4.794 . 0 0 "[ . 1 . 2]" 1
1178 1 12 GLU HA 1 62 VAL MG1 3.950 . 3.950 3.465 3.099 4.135 0.185 1 0 "[ . 1 . 2]" 1
1179 1 62 VAL HA 1 62 VAL MG1 3.530 . 3.530 2.448 2.347 3.188 . 0 0 "[ . 1 . 2]" 1
1180 1 31 LEU HB3 1 44 LEU MD1 3.790 . 3.790 2.532 2.152 2.849 . 0 0 "[ . 1 . 2]" 1
1181 1 30 LYS HA 1 44 LEU MD1 4.620 . 4.620 3.987 3.163 4.643 0.023 5 0 "[ . 1 . 2]" 1
1182 1 44 LEU MD1 1 45 GLY H 5.280 . 5.280 3.709 3.550 3.857 . 0 0 "[ . 1 . 2]" 1
1183 1 29 GLY H 1 44 LEU MD1 5.480 . 5.480 4.952 4.594 5.259 . 0 0 "[ . 1 . 2]" 1
1184 1 31 LEU H 1 44 LEU MD1 4.570 . 4.570 3.024 2.368 3.766 . 0 0 "[ . 1 . 2]" 1
1185 1 86 ASP QB 1 87 ALA MB 4.890 . 4.890 4.473 3.914 4.879 . 0 0 "[ . 1 . 2]" 1
1186 1 86 ASP H 1 87 ALA MB 4.460 . 4.460 4.254 3.614 4.609 0.149 9 0 "[ . 1 . 2]" 1
1187 1 35 THR MG 1 42 TYR QE 4.920 . 4.920 3.299 2.904 3.907 . 0 0 "[ . 1 . 2]" 1
1188 1 35 THR MG 1 38 MET H 4.680 . 4.680 3.945 3.759 4.152 . 0 0 "[ . 1 . 2]" 1
1189 1 35 THR MG 1 37 ASP H 4.460 . 4.460 4.292 4.094 4.469 0.009 19 0 "[ . 1 . 2]" 1
1190 1 35 THR MG 1 39 GLU H 5.530 . 5.530 5.529 5.456 5.596 0.066 12 0 "[ . 1 . 2]" 1
1191 1 33 ILE MG 1 35 THR MG 3.230 . 3.230 2.168 1.971 2.548 . 0 0 "[ . 1 . 2]" 1
1192 1 35 THR MG 1 38 MET QG 4.690 . 4.690 4.112 3.634 4.573 . 0 0 "[ . 1 . 2]" 1
1193 1 35 THR MG 1 40 THR HB 4.560 . 4.560 3.538 3.083 4.296 . 0 0 "[ . 1 . 2]" 1
1194 1 11 GLY HA2 1 35 THR MG 5.110 . 5.110 4.525 3.916 5.110 . 11 0 "[ . 1 . 2]" 1
1195 1 11 GLY HA3 1 35 THR MG 3.870 . 3.870 3.449 2.989 3.902 0.032 5 0 "[ . 1 . 2]" 1
1196 1 34 LYS HA 1 35 THR MG 4.410 . 4.410 3.714 3.578 3.817 . 0 0 "[ . 1 . 2]" 1
1197 1 35 THR MG 1 39 GLU HA 4.680 . 4.680 3.649 3.528 3.755 . 0 0 "[ . 1 . 2]" 1
1198 1 53 THR MG 1 56 LYS H 4.350 . 4.350 4.357 4.231 4.449 0.099 4 0 "[ . 1 . 2]" 1
1199 1 53 THR MG 1 54 LYS H 3.600 . 3.600 3.377 3.198 3.528 . 0 0 "[ . 1 . 2]" 1
1200 1 53 THR MG 1 54 LYS QB 4.540 . 4.540 4.399 4.042 4.639 0.099 15 0 "[ . 1 . 2]" 1
1201 1 53 THR MG 1 54 LYS QD 4.440 . 4.440 4.142 3.216 4.489 0.049 1 0 "[ . 1 . 2]" 1
1202 1 52 LEU MD1 1 53 THR MG 4.020 . 4.020 3.833 3.697 3.951 . 0 0 "[ . 1 . 2]" 1
1203 1 73 THR MG 1 75 LEU QD 2.950 . 2.950 2.401 2.240 2.700 . 0 0 "[ . 1 . 2]" 1
1204 1 73 THR HA 1 73 THR MG 3.020 . 3.020 2.380 2.313 2.447 . 0 0 "[ . 1 . 2]" 1
1205 1 73 THR MG 1 74 LYS H 3.570 . 3.570 2.845 2.577 3.071 . 0 0 "[ . 1 . 2]" 1
1206 1 14 VAL H 1 32 THR MG 4.020 . 4.020 3.637 3.387 3.977 . 0 0 "[ . 1 . 2]" 1
1207 1 32 THR MG 1 34 LYS H 4.840 . 4.840 4.659 4.469 4.850 0.010 19 0 "[ . 1 . 2]" 1
1208 1 32 THR MG 1 41 ILE H 4.950 . 4.950 4.500 4.191 4.786 . 0 0 "[ . 1 . 2]" 1
1209 1 16 ILE H 1 32 THR MG 6.000 . 6.000 6.126 6.053 6.209 0.209 10 0 "[ . 1 . 2]" 1
1210 1 32 THR HA 1 32 THR MG 3.450 . 3.450 2.335 2.298 2.400 . 0 0 "[ . 1 . 2]" 1
1211 1 32 THR MG 1 34 LYS HA 5.130 . 5.130 4.772 4.579 4.959 . 0 0 "[ . 1 . 2]" 1
1212 1 32 THR MG 1 39 GLU HA 5.460 . 5.460 4.256 3.949 4.528 . 0 0 "[ . 1 . 2]" 1
1213 1 15 GLU HB2 1 32 THR MG 3.320 . 3.320 3.133 2.770 3.361 0.041 15 0 "[ . 1 . 2]" 1
1214 1 32 THR MG 1 39 GLU HB2 3.520 . 3.520 2.592 2.344 2.830 . 0 0 "[ . 1 . 2]" 1
1215 1 48 MET HG3 1 72 ILE MD 4.130 . 4.130 2.357 1.989 4.180 0.050 9 0 "[ . 1 . 2]" 1
1216 1 14 VAL MG1 1 34 LYS QE 4.970 . 4.970 3.266 2.017 4.863 . 0 0 "[ . 1 . 2]" 1
1217 1 14 VAL HA 1 14 VAL MG1 3.130 . 3.130 2.766 2.307 3.184 0.054 10 0 "[ . 1 . 2]" 1
1218 1 14 VAL MG1 1 15 GLU HA 5.810 . 5.810 4.885 3.871 5.650 . 0 0 "[ . 1 . 2]" 1
1219 1 14 VAL MG1 1 32 THR H 5.820 . 5.820 4.836 3.940 6.038 0.218 7 0 "[ . 1 . 2]" 1
1220 1 14 VAL H 1 14 VAL MG1 3.900 . 3.900 2.366 1.787 3.816 . 0 0 "[ . 1 . 2]" 1
1221 1 14 VAL MG2 1 32 THR H 5.820 . 5.820 4.743 3.949 5.829 0.009 10 0 "[ . 1 . 2]" 1
1222 1 14 VAL MG2 1 15 GLU H 4.070 . 4.070 2.977 2.379 3.856 . 0 0 "[ . 1 . 2]" 1
1223 1 14 VAL HA 1 14 VAL MG2 3.130 . 3.130 2.839 2.376 3.194 0.064 7 0 "[ . 1 . 2]" 1
1224 1 14 VAL MG2 1 15 GLU HA 5.810 . 5.810 4.123 3.577 5.609 . 0 0 "[ . 1 . 2]" 1
1225 1 62 VAL HA 1 62 VAL MG2 3.530 . 3.530 2.395 2.288 2.497 . 0 0 "[ . 1 . 2]" 1
1226 1 12 GLU HA 1 62 VAL MG2 3.950 . 3.950 2.278 2.029 2.765 . 0 0 "[ . 1 . 2]" 1
1227 1 39 GLU HA 1 40 THR MG 5.700 . 5.700 5.395 5.331 5.421 . 0 0 "[ . 1 . 2]" 1
1228 1 40 THR H 1 40 THR MG 4.020 . 4.020 3.895 3.854 3.927 . 0 0 "[ . 1 . 2]" 1
1229 1 74 LYS H 1 75 LEU QD . . 4.760 4.021 3.831 4.376 . 0 0 "[ . 1 . 2]" 1
1230 1 64 SER H 1 75 LEU QD . . 3.830 2.495 2.344 2.597 . 0 0 "[ . 1 . 2]" 1
1231 1 63 ILE HA 1 75 LEU QD . . 3.700 1.967 1.893 2.080 . 0 0 "[ . 1 . 2]" 1
1232 1 75 LEU HA 1 75 LEU QD 2.930 . 2.930 2.116 1.892 2.693 . 0 0 "[ . 1 . 2]" 1
1233 1 64 SER HB2 1 75 LEU QD . . 3.590 3.181 1.938 3.396 . 0 0 "[ . 1 . 2]" 1
1234 1 64 SER HB3 1 75 LEU QD . . 3.590 2.045 1.845 2.683 . 0 0 "[ . 1 . 2]" 1
1235 1 52 LEU HB3 1 52 LEU MD1 3.190 . 3.190 3.147 3.139 3.152 . 0 0 "[ . 1 . 2]" 1
1236 1 52 LEU MD1 1 57 VAL HB 3.730 . 3.730 3.418 3.261 3.515 . 0 0 "[ . 1 . 2]" 1
1237 1 52 LEU H 1 52 LEU MD1 3.840 . 3.840 3.578 3.511 3.663 . 0 0 "[ . 1 . 2]" 1
1238 1 44 LEU MD2 1 45 GLY H 5.280 . 5.280 5.112 4.984 5.206 . 0 0 "[ . 1 . 2]" 1
1239 1 44 LEU MD2 1 49 ILE H 5.050 . 5.050 4.983 4.583 5.214 0.164 2 0 "[ . 1 . 2]" 1
1240 1 29 GLY H 1 44 LEU MD2 5.480 . 5.480 3.820 3.342 4.438 . 0 0 "[ . 1 . 2]" 1
1241 1 31 LEU HB3 1 44 LEU MD2 3.790 . 3.790 3.091 2.287 3.452 . 0 0 "[ . 1 . 2]" 1
1242 1 8 LEU MD1 1 65 ILE H 6.000 . 6.000 5.193 4.762 5.626 . 0 0 "[ . 1 . 2]" 1
1243 1 8 LEU HA 1 8 LEU MD2 3.820 . 3.820 2.090 2.013 2.134 . 0 0 "[ . 1 . 2]" 1
1244 1 8 LEU H 1 8 LEU MD2 4.290 . 4.290 3.475 3.210 3.578 . 0 0 "[ . 1 . 2]" 1
1245 1 8 LEU MD2 1 9 ILE H 4.770 . 4.770 3.691 3.591 3.774 . 0 0 "[ . 1 . 2]" 1
1246 1 63 ILE H 1 75 LEU QD 4.570 . 4.570 3.363 3.158 3.588 . 0 0 "[ . 1 . 2]" 1
1247 1 11 GLY H 1 75 LEU QD 4.760 . 4.760 3.990 3.187 4.265 . 0 0 "[ . 1 . 2]" 1
1248 1 10 GLU HA 1 75 LEU QD 4.330 . 4.330 4.164 3.417 4.298 . 0 0 "[ . 1 . 2]" 1
1249 1 10 GLU HB2 1 75 LEU QD 3.670 . 3.670 3.027 2.249 3.217 . 0 0 "[ . 1 . 2]" 1
1250 1 62 VAL HB 1 75 LEU QD 4.360 . 4.360 3.770 3.407 4.359 . 0 0 "[ . 1 . 2]" 1
1251 1 63 ILE HB 1 75 LEU QD 4.590 . 4.590 3.698 3.541 3.784 . 0 0 "[ . 1 . 2]" 1
1252 1 74 LYS QE 1 75 LEU QD 5.810 . 5.810 5.381 5.211 5.629 . 0 0 "[ . 1 . 2]" 1
1253 1 73 THR HB 1 75 LEU QD . . 3.910 3.153 2.898 3.375 . 0 0 "[ . 1 . 2]" 1
1254 1 57 VAL MG2 1 63 ILE MG 2.710 . 2.710 1.857 1.770 1.939 . 0 0 "[ . 1 . 2]" 1
1255 1 57 VAL HA 1 57 VAL MG1 3.540 . 3.540 2.367 2.349 2.404 . 0 0 "[ . 1 . 2]" 1
1256 1 57 VAL HA 1 57 VAL MG2 3.540 . 3.540 2.418 2.371 2.455 . 0 0 "[ . 1 . 2]" 1
1257 1 57 VAL MG1 1 63 ILE HA 6.000 . 6.000 5.117 5.012 5.204 . 0 0 "[ . 1 . 2]" 1
1258 1 57 VAL MG2 1 63 ILE HA 6.000 . 6.000 4.845 4.745 4.984 . 0 0 "[ . 1 . 2]" 1
1259 1 33 ILE H 1 33 ILE HG13 4.920 . 4.920 3.719 3.588 3.856 . 0 0 "[ . 1 . 2]" 1
1260 1 12 GLU H 1 33 ILE HG13 6.000 . 6.000 5.864 5.410 6.042 0.042 14 0 "[ . 1 . 2]" 1
1261 1 33 ILE HG13 1 42 TYR QD 4.850 . 4.850 4.011 3.605 4.304 . 0 0 "[ . 1 . 2]" 1
1262 1 48 MET ME 1 70 GLY H 4.250 . 4.250 3.661 3.337 4.035 . 0 0 "[ . 1 . 2]" 1
1263 1 48 MET H 1 48 MET ME 4.250 . 4.250 4.183 3.830 4.303 0.053 4 0 "[ . 1 . 2]" 1
1264 1 48 MET ME 1 65 ILE MG 2.770 . 2.770 2.105 2.030 2.200 . 0 0 "[ . 1 . 2]" 1
1265 1 48 MET ME 1 72 ILE MD 2.830 . 2.830 2.917 2.883 2.992 0.162 9 0 "[ . 1 . 2]" 1
1266 1 48 MET ME 1 48 MET HG2 3.560 . 3.560 2.574 2.345 2.698 . 0 0 "[ . 1 . 2]" 1
1267 1 48 MET ME 1 48 MET HG3 3.560 . 3.560 2.410 2.320 2.710 . 0 0 "[ . 1 . 2]" 1
1268 1 48 MET ME 1 67 LYS HA 3.500 . 3.500 2.757 2.293 3.247 . 0 0 "[ . 1 . 2]" 1
1269 1 48 MET ME 1 70 GLY HA2 3.700 . 3.700 2.102 1.912 2.394 . 0 0 "[ . 1 . 2]" 1
1270 1 37 ASP HB3 1 38 MET H 4.620 . 4.620 3.240 2.288 4.080 . 0 0 "[ . 1 . 2]" 1
1271 1 87 ALA MB 1 88 MET HG3 5.750 . 5.750 5.244 4.296 5.861 0.111 4 0 "[ . 1 . 2]" 1
1272 1 88 MET ME 1 88 MET HG3 3.810 . 3.810 2.864 2.476 3.410 . 0 0 "[ . 1 . 2]" 1
1273 1 87 ALA MB 1 88 MET HG2 5.750 . 5.750 4.982 3.815 5.798 0.048 17 0 "[ . 1 . 2]" 1
1274 1 88 MET ME 1 88 MET HG2 3.810 . 3.810 2.763 2.445 3.406 . 0 0 "[ . 1 . 2]" 1
1275 1 17 GLN H 1 17 GLN HG2 4.870 . 4.870 4.811 4.667 4.896 0.026 19 0 "[ . 1 . 2]" 1
1276 1 17 GLN HG3 1 18 ILE H 4.820 . 4.820 3.489 3.291 3.699 . 0 0 "[ . 1 . 2]" 1
1277 1 63 ILE MG 1 74 LYS HB2 4.420 . 4.420 2.771 2.448 3.396 . 0 0 "[ . 1 . 2]" 1
1278 1 74 LYS HB2 1 74 LYS QD 3.470 . 3.470 2.480 2.294 2.923 . 0 0 "[ . 1 . 2]" 1
1279 1 14 VAL H 1 31 LEU MD2 5.120 . 5.120 5.085 3.877 5.295 0.175 20 0 "[ . 1 . 2]" 1
1280 1 31 LEU H 1 31 LEU MD2 5.290 . 5.290 4.283 4.089 4.419 . 0 0 "[ . 1 . 2]" 1
1281 1 31 LEU MD2 1 65 ILE MD 4.420 . 4.420 2.960 2.049 4.080 . 0 0 "[ . 1 . 2]" 1
1282 1 58 LEU H 1 58 LEU MD2 4.320 . 4.320 3.830 3.690 3.930 . 0 0 "[ . 1 . 2]" 1
1283 1 58 LEU HA 1 58 LEU MD2 4.230 . 4.230 2.949 2.017 4.090 . 0 0 "[ . 1 . 2]" 1
1284 1 58 LEU QB 1 58 LEU MD2 2.970 . 2.970 2.199 2.074 2.326 . 0 0 "[ . 1 . 2]" 1
1285 1 30 LYS HA 1 30 LYS HD3 4.340 . 4.340 2.755 2.034 3.282 . 0 0 "[ . 1 . 2]" 1
1286 1 71 LYS HB3 1 71 LYS QD 2.400 . 2.400 2.234 1.855 3.299 0.899 20 4 "[ * 1 -*. +]" 1
1287 1 6 THR HA 1 6 THR MG 2.880 . 2.880 2.261 2.186 2.325 . 0 0 "[ . 1 . 2]" 1
1288 1 23 THR HA 1 23 THR MG 3.370 . 3.370 2.387 2.198 3.234 . 0 0 "[ . 1 . 2]" 1
1289 1 7 GLU HB2 1 8 LEU H 4.520 . 4.520 4.143 3.311 4.400 . 0 0 "[ . 1 . 2]" 1
1290 1 9 ILE H 1 9 ILE HG12 5.020 . 5.020 4.855 4.578 4.924 . 0 0 "[ . 1 . 2]" 1
1291 1 9 ILE H 1 9 ILE HG13 5.020 . 5.020 4.414 4.290 4.936 . 0 0 "[ . 1 . 2]" 1
1292 1 11 GLY HA3 1 33 ILE HG12 4.630 . 4.630 3.678 3.250 3.873 . 0 0 "[ . 1 . 2]" 1
1293 1 10 GLU HB3 1 64 SER HA 4.650 . 4.650 2.100 1.911 2.370 . 0 0 "[ . 1 . 2]" 1
1294 1 12 GLU H 1 12 GLU HG2 4.740 . 4.740 4.407 4.320 4.475 . 0 0 "[ . 1 . 2]" 1
1295 1 13 VAL HA 1 33 ILE MG 4.320 . 4.320 4.351 4.018 4.443 0.123 15 0 "[ . 1 . 2]" 1
1296 1 13 VAL HA 1 14 VAL HB 5.480 . 5.480 5.197 4.558 5.632 0.152 19 0 "[ . 1 . 2]" 1
1297 1 13 VAL HA 1 33 ILE HB 5.790 . 5.790 4.907 4.515 5.071 . 0 0 "[ . 1 . 2]" 1
1298 1 13 VAL HB 1 16 ILE MD 4.360 . 4.360 3.858 3.725 4.057 . 0 0 "[ . 1 . 2]" 1
1299 1 13 VAL HB 1 59 ALA MB 4.490 . 4.490 4.126 3.890 4.719 0.229 14 0 "[ . 1 . 2]" 1
1300 1 15 GLU HA 1 15 GLU HG2 3.500 . 3.500 2.773 2.324 3.626 0.126 3 0 "[ . 1 . 2]" 1
1301 1 15 GLU HA 1 15 GLU HG3 3.500 . 3.500 2.815 2.393 3.602 0.102 2 0 "[ . 1 . 2]" 1
1302 1 13 VAL QG 1 15 GLU HA 4.140 . 4.140 3.647 3.441 3.857 . 0 0 "[ . 1 . 2]" 1
1303 1 15 GLU HA 1 59 ALA MB 3.530 . 3.530 3.245 2.880 3.545 0.015 12 0 "[ . 1 . 2]" 1
1304 1 27 LYS HA 1 49 ILE MG 5.170 . 5.170 4.896 4.359 5.220 0.050 12 0 "[ . 1 . 2]" 1
1305 1 20 ARG HA 1 20 ARG HG3 4.130 . 4.130 3.495 2.366 3.845 . 0 0 "[ . 1 . 2]" 1
1306 1 20 ARG H 1 20 ARG HG3 4.370 . 4.370 4.007 3.520 4.397 0.027 1 0 "[ . 1 . 2]" 1
1307 1 18 ILE MG 1 20 ARG QD 4.010 . 4.010 2.575 2.052 3.314 . 0 0 "[ . 1 . 2]" 1
1308 1 20 ARG HB3 1 20 ARG QD 3.440 . 3.440 2.778 2.362 3.471 0.031 16 0 "[ . 1 . 2]" 1
1309 1 20 ARG HB2 1 20 ARG QD 3.440 . 3.440 3.166 2.200 3.492 0.052 2 0 "[ . 1 . 2]" 1
1310 1 20 ARG HA 1 20 ARG QD 3.770 . 3.770 2.320 1.949 3.426 . 0 0 "[ . 1 . 2]" 1
1311 1 57 VAL HA 1 63 ILE MG 4.320 . 4.320 3.569 3.189 3.774 . 0 0 "[ . 1 . 2]" 1
1312 1 57 VAL HA 1 58 LEU HG 4.080 . 4.080 3.887 3.647 4.100 0.020 1 0 "[ . 1 . 2]" 1
1313 1 57 VAL HA 1 61 ASP HB2 4.230 . 4.230 3.555 3.065 4.164 . 0 0 "[ . 1 . 2]" 1
1314 1 63 ILE HA 1 75 LEU HG 4.970 . 4.970 4.750 3.021 4.996 0.026 1 0 "[ . 1 . 2]" 1
1315 1 64 SER H 1 75 LEU HG 5.510 . 5.510 5.208 3.599 5.474 . 0 0 "[ . 1 . 2]" 1
1316 1 75 LEU H 1 75 LEU HG 4.180 . 4.180 4.038 2.378 4.212 0.032 8 0 "[ . 1 . 2]" 1
1317 1 27 LYS HA 1 27 LYS HG2 3.480 . 3.480 2.613 2.449 2.778 . 0 0 "[ . 1 . 2]" 1
1318 1 27 LYS HB2 1 27 LYS QE 4.500 . 4.500 3.818 2.155 4.269 . 0 0 "[ . 1 . 2]" 1
1319 1 27 LYS HB3 1 27 LYS QE 4.330 . 4.330 3.817 2.059 4.242 . 0 0 "[ . 1 . 2]" 1
1320 1 28 GLN H 1 28 GLN HB2 3.940 . 3.940 3.869 3.773 3.943 0.003 18 0 "[ . 1 . 2]" 1
1321 1 22 ILE MD 1 28 GLN QG 4.170 . 4.170 2.325 1.849 3.442 . 0 0 "[ . 1 . 2]" 1
1322 1 30 LYS QE 1 41 ILE MG 3.650 . 3.650 2.733 1.903 3.648 . 0 0 "[ . 1 . 2]" 1
1323 1 14 VAL MG2 1 34 LYS QE 4.970 . 4.970 3.803 2.058 5.018 0.048 18 0 "[ . 1 . 2]" 1
1324 1 14 VAL H 1 31 LEU MD1 5.120 . 5.120 4.094 3.510 4.801 . 0 0 "[ . 1 . 2]" 1
1325 1 34 LYS QG 1 35 THR H 4.550 . 4.550 3.481 2.886 4.216 . 0 0 "[ . 1 . 2]" 1
1326 1 30 LYS QE 1 30 LYS HG2 3.870 . 3.870 2.465 2.170 2.897 . 0 0 "[ . 1 . 2]" 1
1327 1 32 THR MG 1 39 GLU HB3 4.390 . 4.390 3.887 3.634 4.164 . 0 0 "[ . 1 . 2]" 1
1328 1 41 ILE HG13 1 41 ILE MG 3.390 . 3.390 3.201 3.193 3.209 . 0 0 "[ . 1 . 2]" 1
1329 1 30 LYS HA 1 43 GLU HA 3.610 . 3.610 2.809 2.429 3.611 0.001 3 0 "[ . 1 . 2]" 1
1330 1 27 LYS HA 1 28 GLN QG 4.320 . 4.320 3.470 3.144 3.952 . 0 0 "[ . 1 . 2]" 1
1331 1 43 GLU HA 1 43 GLU HG2 3.370 . 3.370 2.499 2.410 2.602 . 0 0 "[ . 1 . 2]" 1
1332 1 43 GLU HA 1 43 GLU HG3 3.970 . 3.970 3.084 2.931 3.274 . 0 0 "[ . 1 . 2]" 1
1333 1 44 LEU HA 1 44 LEU MD1 4.200 . 4.200 2.005 1.869 2.167 . 0 0 "[ . 1 . 2]" 1
1334 1 44 LEU H 1 44 LEU HG 4.730 . 4.730 4.369 4.042 4.629 . 0 0 "[ . 1 . 2]" 1
1335 1 47 LYS HB3 1 48 MET H 4.270 . 4.270 3.291 2.614 3.837 . 0 0 "[ . 1 . 2]" 1
1336 1 47 LYS QE 1 47 LYS HG3 3.900 . 3.900 2.734 2.331 3.502 . 0 0 "[ . 1 . 2]" 1
1337 1 47 LYS QE 1 47 LYS HG2 3.900 . 3.900 2.726 2.393 3.522 . 0 0 "[ . 1 . 2]" 1
1338 1 48 MET HA 1 48 MET ME 3.900 . 3.900 3.768 3.645 3.837 . 0 0 "[ . 1 . 2]" 1
1339 1 48 MET HA 1 48 MET HG2 3.820 . 3.820 3.559 2.979 3.635 . 0 0 "[ . 1 . 2]" 1
1340 1 48 MET HA 1 48 MET HG3 3.820 . 3.820 2.535 2.385 3.691 . 0 0 "[ . 1 . 2]" 1
1341 1 48 MET HA 1 72 ILE MD 3.570 . 3.570 1.936 1.808 2.177 . 0 0 "[ . 1 . 2]" 1
1342 1 48 MET HB3 1 52 LEU MD2 5.030 . 5.030 2.886 2.730 3.171 . 0 0 "[ . 1 . 2]" 1
1343 1 48 MET HB2 1 52 LEU MD2 5.030 . 5.030 4.101 3.832 4.275 . 0 0 "[ . 1 . 2]" 1
1344 1 27 LYS HG2 1 49 ILE HG12 5.770 . 5.770 4.879 4.536 5.190 . 0 0 "[ . 1 . 2]" 1
1345 1 49 ILE H 1 49 ILE HG13 3.660 . 3.660 3.578 3.450 3.648 . 0 0 "[ . 1 . 2]" 1
1346 1 49 ILE MG 1 50 ASP HA 3.890 . 3.890 2.972 2.880 3.059 . 0 0 "[ . 1 . 2]" 1
1347 1 52 LEU HB3 1 52 LEU MD2 3.390 . 3.390 2.172 2.162 2.177 . 0 0 "[ . 1 . 2]" 1
1348 1 52 LEU HA 1 52 LEU MD2 4.280 . 4.280 4.050 4.040 4.058 . 0 0 "[ . 1 . 2]" 1
1349 1 54 LYS HA 1 54 LYS QE 4.690 . 4.690 3.659 2.769 4.172 . 0 0 "[ . 1 . 2]" 1
1350 1 55 GLU HA 1 55 GLU QG 3.460 . 3.460 2.881 2.691 3.043 . 0 0 "[ . 1 . 2]" 1
1351 1 5 GLU HA 1 5 GLU QG 3.650 . 3.650 2.818 2.242 3.482 . 0 0 "[ . 1 . 2]" 1
1352 1 58 LEU HA 1 58 LEU MD1 4.230 . 4.230 3.775 3.609 3.877 . 0 0 "[ . 1 . 2]" 1
1353 1 58 LEU QB 1 58 LEU MD1 2.970 . 2.970 2.152 2.086 2.292 . 0 0 "[ . 1 . 2]" 1
1354 1 58 LEU H 1 58 LEU MD1 4.320 . 4.320 3.599 2.636 4.177 . 0 0 "[ . 1 . 2]" 1
1355 1 13 VAL QG 1 61 ASP HB3 4.940 . 4.940 3.586 2.581 4.144 . 0 0 "[ . 1 . 2]" 1
1356 1 12 GLU HA 1 62 VAL HB 5.110 . 5.110 4.697 2.659 5.144 0.034 14 0 "[ . 1 . 2]" 1
1357 1 61 ASP HA 1 62 VAL HB 5.830 . 5.830 4.672 4.504 4.798 . 0 0 "[ . 1 . 2]" 1
1358 1 63 ILE HG12 1 64 SER HA 5.490 . 5.490 3.590 3.407 3.731 . 0 0 "[ . 1 . 2]" 1
1359 1 65 ILE MG 1 72 ILE MD 3.070 . 3.070 2.287 2.073 2.441 . 0 0 "[ . 1 . 2]" 1
1360 1 66 ASP HB2 1 71 LYS HB2 4.980 . 4.980 4.801 3.137 5.077 0.097 16 0 "[ . 1 . 2]" 1
1361 1 71 LYS QE 1 72 ILE H 4.390 . 4.390 4.074 2.748 4.460 0.070 4 0 "[ . 1 . 2]" 1
1362 1 67 LYS HB2 1 67 LYS QE 4.610 . 4.610 3.965 3.378 4.533 . 0 0 "[ . 1 . 2]" 1
1363 1 67 LYS HB3 1 67 LYS QE 4.610 . 4.610 3.233 1.932 4.491 . 0 0 "[ . 1 . 2]" 1
1364 1 65 ILE MG 1 67 LYS QG 4.170 . 4.170 3.720 3.156 4.053 . 0 0 "[ . 1 . 2]" 1
1365 1 65 ILE MG 1 67 LYS QD 3.970 . 3.970 3.158 2.836 4.016 0.046 19 0 "[ . 1 . 2]" 1
1366 1 65 ILE MG 1 67 LYS QE 5.280 . 5.280 4.219 3.453 4.714 . 0 0 "[ . 1 . 2]" 1
1367 1 66 ASP HB3 1 71 LYS HB2 4.980 . 4.980 4.149 3.256 4.533 . 0 0 "[ . 1 . 2]" 1
1368 1 71 LYS HB2 1 71 LYS QE 5.130 . 5.130 4.084 3.342 4.251 . 0 0 "[ . 1 . 2]" 1
1369 1 71 LYS HB3 1 72 ILE H 4.630 . 4.630 4.249 3.565 4.474 . 0 0 "[ . 1 . 2]" 1
1370 1 71 LYS HB2 1 72 ILE H 4.370 . 4.370 3.907 3.655 4.348 . 0 0 "[ . 1 . 2]" 1
1371 1 71 LYS HA 1 71 LYS QD 4.430 . 4.430 3.717 1.814 4.257 . 0 0 "[ . 1 . 2]" 1
1372 1 71 LYS HA 1 71 LYS QE 4.410 . 4.410 4.169 1.889 4.576 0.166 8 0 "[ . 1 . 2]" 1
1373 1 65 ILE MD 1 72 ILE HG13 4.480 . 4.480 3.495 3.323 3.692 . 0 0 "[ . 1 . 2]" 1
1374 1 73 THR HA 1 74 LYS H 3.240 . 3.240 2.165 2.128 2.211 . 0 0 "[ . 1 . 2]" 1
1375 1 73 THR HA 1 75 LEU QD 4.870 . 4.870 4.429 4.254 4.563 . 0 0 "[ . 1 . 2]" 1
1376 1 74 LYS HB2 1 74 LYS QE 4.940 . 4.940 3.393 2.000 4.283 . 0 0 "[ . 1 . 2]" 1
1377 1 31 LEU H 1 44 LEU H 4.290 . 4.290 4.145 3.797 4.315 0.025 16 0 "[ . 1 . 2]" 1
1378 1 16 ILE H 1 32 THR H 5.340 . 5.340 4.808 4.709 4.945 . 0 0 "[ . 1 . 2]" 1
1379 1 42 TYR QD 1 43 GLU H 4.320 . 4.320 4.071 3.798 4.271 . 0 0 "[ . 1 . 2]" 1
1380 1 42 TYR H 1 42 TYR QD 4.040 . 4.040 3.007 2.860 3.256 . 0 0 "[ . 1 . 2]" 1
1381 1 33 ILE H 1 42 TYR QD 5.110 . 5.110 3.403 3.071 3.768 . 0 0 "[ . 1 . 2]" 1
1382 1 33 ILE H 1 42 TYR QE 5.010 . 5.010 3.284 2.738 3.634 . 0 0 "[ . 1 . 2]" 1
1383 1 42 TYR H 1 42 TYR QE 5.010 . 5.010 4.728 4.599 4.866 . 0 0 "[ . 1 . 2]" 1
1384 1 23 THR H 1 24 GLY H 5.060 . 5.060 3.500 2.366 4.609 . 0 0 "[ . 1 . 2]" 1
1385 1 66 ASP H 1 72 ILE H 5.750 . 5.750 4.776 4.709 4.839 . 0 0 "[ . 1 . 2]" 1
1386 1 71 LYS H 1 72 ILE H 4.600 . 4.600 4.528 4.492 4.553 . 0 0 "[ . 1 . 2]" 1
1387 1 85 TYR QD 1 86 ASP H 4.480 . 4.480 3.682 2.688 4.523 0.043 13 0 "[ . 1 . 2]" 1
1388 1 11 GLY H 1 63 ILE HA 5.470 . 5.470 4.942 4.667 5.121 . 0 0 "[ . 1 . 2]" 1
1389 1 63 ILE H 1 64 SER H 5.680 . 5.680 4.393 4.364 4.412 . 0 0 "[ . 1 . 2]" 1
1390 1 36 THR H 1 37 ASP H 4.020 . 4.020 2.728 2.656 2.900 . 0 0 "[ . 1 . 2]" 1
1391 1 5 GLU H 1 6 THR H 4.490 . 4.490 4.167 2.551 4.602 0.112 18 0 "[ . 1 . 2]" 1
1392 1 11 GLY H 1 12 GLU H 5.110 . 5.110 4.360 4.336 4.381 . 0 0 "[ . 1 . 2]" 1
1393 1 95 VAL H 1 96 GLN H 4.320 . 4.320 3.647 2.423 4.428 0.108 17 0 "[ . 1 . 2]" 1
1394 1 93 ARG H 1 94 PHE QD 4.730 . 4.730 3.610 2.687 4.701 . 0 0 "[ . 1 . 2]" 1
1395 1 69 SER H 1 71 LYS H 4.070 . 4.070 3.621 3.400 3.827 . 0 0 "[ . 1 . 2]" 1
1396 1 34 LYS HA 1 40 THR H 3.850 . 3.850 3.601 3.435 3.754 . 0 0 "[ . 1 . 2]" 1
1397 1 35 THR H 1 39 GLU HA 3.970 . 3.970 2.742 2.602 2.883 . 0 0 "[ . 1 . 2]" 1
1398 1 12 GLU H 1 35 THR HA 4.970 . 4.970 4.089 3.628 4.560 . 0 0 "[ . 1 . 2]" 1
1399 1 35 THR HA 1 37 ASP H 5.450 . 5.450 4.500 4.304 4.732 . 0 0 "[ . 1 . 2]" 1
1400 1 15 GLU H 1 31 LEU HA 5.430 . 5.430 5.002 4.877 5.110 . 0 0 "[ . 1 . 2]" 1
1401 1 32 THR HA 1 42 TYR QD 5.260 . 5.260 4.144 3.663 4.627 . 0 0 "[ . 1 . 2]" 1
1402 1 67 LYS H 1 68 ALA HA 5.060 . 5.060 5.126 5.062 5.167 0.107 16 0 "[ . 1 . 2]" 1
1403 1 67 LYS HA 1 68 ALA H 3.510 . 3.510 3.455 3.421 3.471 . 0 0 "[ . 1 . 2]" 1
1404 1 21 SER HB2 1 22 ILE H 4.600 . 4.600 4.008 3.156 4.638 0.038 14 0 "[ . 1 . 2]" 1
1405 1 69 SER HB3 1 70 GLY H 4.660 . 4.660 3.725 2.899 4.298 . 0 0 "[ . 1 . 2]" 1
1406 1 21 SER HB3 1 22 ILE H 4.600 . 4.600 3.901 3.070 4.490 . 0 0 "[ . 1 . 2]" 1
1407 1 54 LYS HA 1 56 LYS H 4.560 . 4.560 3.857 3.717 3.991 . 0 0 "[ . 1 . 2]" 1
1408 1 21 SER HA 1 22 ILE H 3.510 . 3.510 3.205 2.418 3.449 . 0 0 "[ . 1 . 2]" 1
1409 1 20 ARG HA 1 22 ILE H 4.320 . 4.320 3.602 3.166 4.220 . 0 0 "[ . 1 . 2]" 1
1410 1 50 ASP HA 1 53 THR H 4.630 . 4.630 3.929 3.802 4.106 . 0 0 "[ . 1 . 2]" 1
1411 1 90 ALA H 1 91 ASP HA 5.610 . 5.610 4.794 4.314 5.307 . 0 0 "[ . 1 . 2]" 1
1412 1 91 ASP HA 1 93 ARG H 5.890 . 5.890 4.099 3.279 5.303 . 0 0 "[ . 1 . 2]" 1
1413 1 23 THR HB 1 24 GLY H 3.490 . 3.490 2.883 2.156 3.725 0.235 10 0 "[ . 1 . 2]" 1
1414 1 40 THR HB 1 42 TYR QD 4.720 . 4.720 4.353 4.256 4.552 . 0 0 "[ . 1 . 2]" 1
1415 1 40 THR HB 1 42 TYR QE 3.770 . 3.770 2.936 2.723 3.157 . 0 0 "[ . 1 . 2]" 1
1416 1 42 TYR HA 1 42 TYR QE 4.940 . 4.940 4.608 4.501 4.702 . 0 0 "[ . 1 . 2]" 1
1417 1 85 TYR HA 1 85 TYR QE 4.670 . 4.670 4.528 4.338 4.666 . 0 0 "[ . 1 . 2]" 1
1418 1 42 TYR HA 1 42 TYR QD 3.740 . 3.740 2.685 2.534 2.876 . 0 0 "[ . 1 . 2]" 1
1419 1 85 TYR QD 1 86 ASP HA 6.000 . 6.000 4.599 3.704 5.600 . 0 0 "[ . 1 . 2]" 1
1420 1 85 TYR QD 1 87 ALA HA 5.110 . 5.110 4.460 2.739 5.190 0.080 2 0 "[ . 1 . 2]" 1
1421 1 79 PHE QD 1 80 ALA HA 5.760 . 5.760 4.952 3.329 5.932 0.172 5 0 "[ . 1 . 2]" 1
1422 1 93 ARG HA 1 94 PHE QD 6.000 . 6.000 4.701 3.451 5.448 . 0 0 "[ . 1 . 2]" 1
1423 1 92 THR HA 1 94 PHE QD 4.930 . 4.930 3.196 2.410 4.835 . 0 0 "[ . 1 . 2]" 1
1424 1 78 SER HA 1 79 PHE QD 4.870 . 4.870 3.973 2.967 4.884 0.014 1 0 "[ . 1 . 2]" 1
1425 1 79 PHE HA 1 79 PHE QD 3.800 . 3.800 3.202 2.293 3.759 . 0 0 "[ . 1 . 2]" 1
1426 1 79 PHE HA 1 79 PHE QE 5.720 . 5.720 5.029 4.365 5.696 . 0 0 "[ . 1 . 2]" 1
1427 1 94 PHE HA 1 94 PHE QD 3.620 . 3.620 2.732 2.269 3.196 . 0 0 "[ . 1 . 2]" 1
1428 1 94 PHE HA 1 94 PHE QE 4.810 . 4.810 4.544 4.384 4.794 . 0 0 "[ . 1 . 2]" 1
1429 1 41 ILE HA 1 42 TYR QD 4.710 . 4.710 3.837 3.562 4.152 . 0 0 "[ . 1 . 2]" 1
1430 1 10 GLU HA 1 64 SER HB2 5.010 . 5.010 4.452 3.863 4.746 . 0 0 "[ . 1 . 2]" 1
1431 1 42 TYR QE 1 65 ILE MD 5.000 . 5.000 5.017 4.512 5.135 0.135 19 0 "[ . 1 . 2]" 1
1432 1 9 ILE MD 1 42 TYR QE 3.870 . 3.870 2.761 2.377 2.960 . 0 0 "[ . 1 . 2]" 1
1433 1 33 ILE MD 1 42 TYR QE 3.520 . 3.520 3.409 3.002 3.557 0.037 18 0 "[ . 1 . 2]" 1
1434 1 33 ILE MG 1 42 TYR QE 3.430 . 3.430 2.388 2.096 2.660 . 0 0 "[ . 1 . 2]" 1
1435 1 40 THR MG 1 42 TYR QE 3.480 . 3.480 2.987 2.675 3.247 . 0 0 "[ . 1 . 2]" 1
1436 1 33 ILE HG13 1 42 TYR QE 4.600 . 4.600 4.506 4.216 4.654 0.054 11 0 "[ . 1 . 2]" 1
1437 1 31 LEU HG 1 42 TYR QE 6.000 . 6.000 5.747 5.197 6.058 0.058 4 0 "[ . 1 . 2]" 1
1438 1 9 ILE HB 1 42 TYR QE 5.020 . 5.020 4.401 3.784 4.902 . 0 0 "[ . 1 . 2]" 1
1439 1 33 ILE HB 1 42 TYR QE 3.610 . 3.610 2.067 1.893 2.253 . 0 0 "[ . 1 . 2]" 1
1440 1 31 LEU HB2 1 42 TYR QD 5.420 . 5.420 5.129 4.594 5.433 0.013 20 0 "[ . 1 . 2]" 1
1441 1 31 LEU HG 1 42 TYR QD 4.580 . 4.580 4.050 3.559 4.404 . 0 0 "[ . 1 . 2]" 1
1442 1 33 ILE HB 1 42 TYR QD 4.270 . 4.270 2.518 2.304 2.705 . 0 0 "[ . 1 . 2]" 1
1443 1 31 LEU HB3 1 42 TYR QD 4.610 . 4.610 3.514 2.894 3.905 . 0 0 "[ . 1 . 2]" 1
1444 1 85 TYR QE 1 87 ALA MB 4.390 . 4.390 2.929 1.979 4.378 . 0 0 "[ . 1 . 2]" 1
1445 1 42 TYR QD 1 65 ILE MD 4.660 . 4.660 3.983 3.818 4.168 . 0 0 "[ . 1 . 2]" 1
1446 1 33 ILE MD 1 42 TYR QD 3.930 . 3.930 3.005 2.458 3.358 . 0 0 "[ . 1 . 2]" 1
1447 1 40 THR MG 1 42 TYR QD 3.920 . 3.920 3.818 3.665 3.931 0.011 13 0 "[ . 1 . 2]" 1
1448 1 85 TYR QD 1 87 ALA MB 4.690 . 4.690 2.963 1.992 4.217 . 0 0 "[ . 1 . 2]" 1
1449 1 62 VAL MG1 1 79 PHE QD 5.510 . 5.510 3.917 2.397 5.519 0.009 10 0 "[ . 1 . 2]" 1
1450 1 62 VAL MG2 1 79 PHE QD 5.510 . 5.510 4.232 2.122 5.601 0.091 1 0 "[ . 1 . 2]" 1
1451 1 94 PHE QD 1 95 VAL MG1 6.000 . 6.000 5.489 4.584 6.133 0.133 13 0 "[ . 1 . 2]" 1
1452 1 94 PHE QD 1 95 VAL MG2 6.000 . 6.000 5.104 3.583 6.262 0.262 2 0 "[ . 1 . 2]" 1
1453 1 79 PHE QD 1 80 ALA MB 4.930 . 4.930 4.387 2.171 5.039 0.109 2 0 "[ . 1 . 2]" 1
1454 1 93 ARG QB 1 94 PHE QD 5.000 . 5.000 4.672 3.741 5.085 0.085 18 0 "[ . 1 . 2]" 1
1455 1 93 ARG QB 1 94 PHE QE 5.690 . 5.690 5.082 3.746 5.755 0.065 8 0 "[ . 1 . 2]" 1
1456 1 14 VAL MG1 1 15 GLU H 4.070 . 4.070 3.151 2.429 4.014 . 0 0 "[ . 1 . 2]" 1
1457 1 14 VAL HB 1 15 GLU H 4.280 . 4.280 3.943 2.695 4.344 0.064 5 0 "[ . 1 . 2]" 1
1458 1 56 LYS QG 1 57 VAL H 4.780 . 4.780 4.716 4.570 4.797 0.017 4 0 "[ . 1 . 2]" 1
1459 1 16 ILE MD 1 57 VAL H 5.380 . 5.380 4.981 4.763 5.233 . 0 0 "[ . 1 . 2]" 1
1460 1 85 TYR QD 1 86 ASP QB 5.700 . 5.700 5.058 4.360 5.756 0.056 18 0 "[ . 1 . 2]" 1
1461 1 44 LEU HB2 1 45 GLY H 4.750 . 4.750 4.275 3.989 4.469 . 0 0 "[ . 1 . 2]" 1
1462 1 71 LYS H 1 71 LYS HG2 4.810 . 4.810 4.198 3.991 4.596 . 0 0 "[ . 1 . 2]" 1
1463 1 94 PHE HB3 1 95 VAL H 4.600 . 4.600 4.260 3.741 4.469 . 0 0 "[ . 1 . 2]" 1
1464 1 81 ARG H 1 81 ARG QD 4.450 . 4.450 3.759 1.901 4.603 0.153 4 0 "[ . 1 . 2]" 1
1465 1 83 ARG H 1 83 ARG QD 4.670 . 4.670 3.798 1.674 4.858 0.188 7 0 "[ . 1 . 2]" 1
1466 1 46 ASN QB 1 47 LYS H 4.320 . 4.320 2.524 2.448 2.625 . 0 0 "[ . 1 . 2]" 1
1467 1 27 LYS H 1 46 ASN QB 4.390 . 4.390 2.932 1.857 4.020 . 0 0 "[ . 1 . 2]" 1
1468 1 48 MET H 1 48 MET HG3 4.160 . 4.160 3.874 3.651 3.976 . 0 0 "[ . 1 . 2]" 1
1469 1 84 ASP HB3 1 85 TYR H 4.830 . 4.830 4.333 3.591 4.603 . 0 0 "[ . 1 . 2]" 1
1470 1 85 TYR H 1 86 ASP QB 5.300 . 5.300 4.490 3.388 5.328 0.028 18 0 "[ . 1 . 2]" 1
1471 1 86 ASP QB 1 87 ALA H 4.150 . 4.150 3.778 2.200 4.039 . 0 0 "[ . 1 . 2]" 1
1472 1 48 MET H 1 48 MET HG2 4.160 . 4.160 3.828 2.322 4.023 . 0 0 "[ . 1 . 2]" 1
1473 1 84 ASP HB2 1 85 TYR H 4.830 . 4.830 4.255 3.687 4.472 . 0 0 "[ . 1 . 2]" 1
1474 1 101 GLU QG 1 102 LEU H 5.270 . 5.270 4.168 2.454 4.856 . 0 0 "[ . 1 . 2]" 1
1475 1 96 GLN QG 1 97 CYS H 4.550 . 4.550 4.024 2.723 4.702 0.152 17 0 "[ . 1 . 2]" 1
1476 1 7 GLU H 1 7 GLU HG3 4.440 . 4.440 2.872 2.288 4.505 0.065 13 0 "[ . 1 . 2]" 1
1477 1 5 GLU H 1 5 GLU QG 4.230 . 4.230 3.047 1.935 4.204 . 0 0 "[ . 1 . 2]" 1
1478 1 12 GLU HB2 1 13 VAL H 4.730 . 4.730 4.189 4.062 4.256 . 0 0 "[ . 1 . 2]" 1
1479 1 33 ILE MD 1 34 LYS H 4.930 . 4.930 4.669 4.564 4.749 . 0 0 "[ . 1 . 2]" 1
1480 1 8 LEU MD2 1 65 ILE H 6.000 . 6.000 4.467 4.163 4.894 . 0 0 "[ . 1 . 2]" 1
1481 1 18 ILE MD 1 30 LYS H 4.570 . 4.570 3.100 2.786 3.335 . 0 0 "[ . 1 . 2]" 1
1482 1 65 ILE H 1 65 ILE HG13 3.840 . 3.840 2.554 2.214 2.683 . 0 0 "[ . 1 . 2]" 1
1483 1 65 ILE H 1 65 ILE MG 4.130 . 4.130 3.875 3.807 3.899 . 0 0 "[ . 1 . 2]" 1
1484 1 65 ILE MG 1 67 LYS H 4.460 . 4.460 4.004 3.842 4.186 . 0 0 "[ . 1 . 2]" 1
1485 1 64 SER H 1 73 THR MG 4.730 . 4.730 4.304 4.039 4.466 . 0 0 "[ . 1 . 2]" 1
1486 1 31 LEU MD2 1 32 THR H 4.380 . 4.380 3.625 1.840 4.348 . 0 0 "[ . 1 . 2]" 1
1487 1 63 ILE HG13 1 64 SER H 5.200 . 5.200 4.291 4.143 4.395 . 0 0 "[ . 1 . 2]" 1
1488 1 22 ILE MG 1 24 GLY H 4.920 . 4.920 3.444 2.298 4.771 . 0 0 "[ . 1 . 2]" 1
1489 1 16 ILE MD 1 59 ALA H 3.610 . 3.610 2.634 2.407 3.068 . 0 0 "[ . 1 . 2]" 1
1490 1 52 LEU MD2 1 53 THR H 4.510 . 4.510 3.978 3.924 4.044 . 0 0 "[ . 1 . 2]" 1
1491 1 95 VAL H 1 95 VAL HB 3.810 . 3.810 3.628 2.837 3.953 0.143 20 0 "[ . 1 . 2]" 1
1492 1 87 ALA H 1 87 ALA MB 2.960 . 2.960 2.581 2.278 2.950 . 0 0 "[ . 1 . 2]" 1
1493 1 92 THR MG 1 93 ARG H 4.380 . 4.380 4.137 3.677 4.416 0.036 7 0 "[ . 1 . 2]" 1
1494 1 44 LEU HG 1 49 ILE H 4.580 . 4.580 4.286 3.966 4.545 . 0 0 "[ . 1 . 2]" 1
1495 1 6 THR MG 1 8 LEU H 5.150 . 5.150 4.759 4.523 5.161 0.011 18 0 "[ . 1 . 2]" 1
1496 1 80 ALA MB 1 81 ARG H 3.620 . 3.620 3.234 1.754 3.697 0.077 17 0 "[ . 1 . 2]" 1
1497 1 87 ALA MB 1 88 MET H 3.740 . 3.740 3.634 3.429 3.716 . 0 0 "[ . 1 . 2]" 1
1498 1 93 ARG H 1 93 ARG QG 3.680 . 3.680 2.554 2.068 3.251 . 0 0 "[ . 1 . 2]" 1
1499 1 81 ARG H 1 81 ARG QG 3.630 . 3.630 2.610 1.863 3.770 0.140 20 0 "[ . 1 . 2]" 1
1500 1 48 MET HB2 1 49 ILE H 4.320 . 4.320 2.615 2.450 2.713 . 0 0 "[ . 1 . 2]" 1
1501 1 88 MET HB3 1 89 GLY H 4.550 . 4.550 4.020 2.482 4.569 0.019 5 0 "[ . 1 . 2]" 1
1502 1 102 LEU H 1 102 LEU HB3 4.130 . 4.130 3.291 2.405 3.796 . 0 0 "[ . 1 . 2]" 1
1503 1 83 ARG QG 1 84 ASP H 4.150 . 4.150 3.829 2.704 4.215 0.065 6 0 "[ . 1 . 2]" 1
1504 1 30 LYS HG3 1 31 LEU H 3.660 . 3.660 3.308 3.082 3.656 . 0 0 "[ . 1 . 2]" 1
1505 1 5 GLU H 1 5 GLU HB3 3.850 . 3.850 3.125 2.501 3.996 0.146 3 0 "[ . 1 . 2]" 1
1506 1 5 GLU H 1 5 GLU HB2 3.850 . 3.850 3.212 2.352 3.960 0.110 2 0 "[ . 1 . 2]" 1
1507 1 44 LEU H 1 44 LEU HB2 3.480 . 3.480 2.405 2.236 2.585 . 0 0 "[ . 1 . 2]" 1
1508 1 8 LEU MD1 1 9 ILE H 4.770 . 4.770 4.864 4.730 4.914 0.144 15 0 "[ . 1 . 2]" 1
1509 1 22 ILE H 1 22 ILE MD 4.600 . 4.600 3.117 1.691 3.927 . 0 0 "[ . 1 . 2]" 1
1510 1 49 ILE MG 1 53 THR H 4.820 . 4.820 3.991 3.887 4.110 . 0 0 "[ . 1 . 2]" 1
1511 1 62 VAL MG2 1 76 GLY H 5.230 . 5.230 4.038 3.482 5.257 0.027 15 0 "[ . 1 . 2]" 1
1512 1 22 ILE MG 1 25 GLY H 4.970 . 4.970 3.576 1.927 4.651 . 0 0 "[ . 1 . 2]" 1
1513 1 102 LEU MD2 1 103 GLN H 5.570 . 5.570 4.366 3.041 5.611 0.041 10 0 "[ . 1 . 2]" 1
1514 1 65 ILE HG13 1 66 ASP H 5.430 . 5.430 5.089 5.028 5.139 . 0 0 "[ . 1 . 2]" 1
1515 1 66 ASP H 1 72 ILE MG 5.880 . 5.880 5.082 4.849 5.325 . 0 0 "[ . 1 . 2]" 1
1516 1 62 VAL MG2 1 77 ARG H 5.360 . 5.360 3.518 2.133 4.419 . 0 0 "[ . 1 . 2]" 1
1517 1 33 ILE MG 1 35 THR H 4.550 . 4.550 3.540 3.350 3.738 . 0 0 "[ . 1 . 2]" 1
1518 1 6 THR MG 1 67 LYS H 4.820 . 4.820 3.733 3.132 4.483 . 0 0 "[ . 1 . 2]" 1
1519 1 36 THR H 1 36 THR MG 3.800 . 3.800 3.740 3.692 3.767 . 0 0 "[ . 1 . 2]" 1
1520 1 35 THR MG 1 36 THR H 3.750 . 3.750 3.605 3.537 3.681 . 0 0 "[ . 1 . 2]" 1
1521 1 67 LYS H 1 68 ALA MB 4.190 . 4.190 4.215 4.154 4.257 0.067 16 0 "[ . 1 . 2]" 1
1522 1 9 ILE H 1 65 ILE HB 4.090 . 4.090 3.142 2.921 3.341 . 0 0 "[ . 1 . 2]" 1
1523 1 31 LEU H 1 44 LEU HG 5.050 . 5.050 5.126 5.069 5.172 0.122 15 0 "[ . 1 . 2]" 1
1524 1 65 ILE MD 1 65 ILE MG 2.870 . 2.870 1.940 1.890 1.980 . 0 0 "[ . 1 . 2]" 1
1525 1 31 LEU MD1 1 65 ILE MD 4.420 . 4.420 3.947 2.709 4.465 0.045 20 0 "[ . 1 . 2]" 1
1526 1 63 ILE HG13 1 65 ILE MD 4.620 . 4.620 3.686 3.281 4.064 . 0 0 "[ . 1 . 2]" 1
1527 1 48 MET ME 1 65 ILE MD 3.820 . 3.820 3.840 3.646 3.902 0.082 15 0 "[ . 1 . 2]" 1
1528 1 44 LEU H 1 44 LEU MD1 4.220 . 4.220 2.936 2.825 3.083 . 0 0 "[ . 1 . 2]" 1
1529 1 44 LEU MD1 1 49 ILE H 5.050 . 5.050 4.979 4.709 5.191 0.141 1 0 "[ . 1 . 2]" 1
1530 1 65 ILE MG 1 70 GLY H 4.680 . 4.680 4.671 4.515 4.714 0.034 2 0 "[ . 1 . 2]" 1
1531 1 9 ILE H 1 65 ILE MD 5.020 . 5.020 4.712 4.499 4.871 . 0 0 "[ . 1 . 2]" 1
1532 1 9 ILE H 1 9 ILE MD 4.330 . 4.330 4.288 3.842 4.363 0.033 15 0 "[ . 1 . 2]" 1
1533 1 65 ILE MG 1 72 ILE H 5.330 . 5.330 4.837 4.671 4.992 . 0 0 "[ . 1 . 2]" 1
1534 1 32 THR MG 1 42 TYR H 5.760 . 5.760 4.987 4.770 5.200 . 0 0 "[ . 1 . 2]" 1
1535 1 14 VAL H 1 33 ILE MD 5.350 . 5.350 5.414 5.353 5.472 0.122 8 0 "[ . 1 . 2]" 1
1536 1 31 LEU H 1 44 LEU MD2 4.570 . 4.570 2.653 2.393 2.967 . 0 0 "[ . 1 . 2]" 1
1537 1 16 ILE MG 1 17 GLN H 3.160 . 3.160 3.028 2.904 3.153 . 0 0 "[ . 1 . 2]" 1
1538 1 13 VAL H 1 62 VAL MG2 5.000 . 5.000 3.794 3.558 4.509 . 0 0 "[ . 1 . 2]" 1
1539 1 52 LEU H 1 52 LEU MD2 3.870 . 3.870 3.195 3.141 3.227 . 0 0 "[ . 1 . 2]" 1
1540 1 95 VAL MG1 1 96 GLN H 4.700 . 4.700 3.843 3.062 4.353 . 0 0 "[ . 1 . 2]" 1
1541 1 95 VAL MG2 1 96 GLN H 4.700 . 4.700 3.774 2.387 4.375 . 0 0 "[ . 1 . 2]" 1
1542 1 53 THR H 1 53 THR MG 3.810 . 3.810 3.770 3.764 3.775 . 0 0 "[ . 1 . 2]" 1
1543 1 16 ILE H 1 59 ALA MB 4.320 . 4.320 3.936 3.635 4.173 . 0 0 "[ . 1 . 2]" 1
1544 1 9 ILE H 1 67 LYS QG 4.510 . 4.510 3.839 3.455 4.401 . 0 0 "[ . 1 . 2]" 1
1545 1 9 ILE MD 1 64 SER HA 5.860 . 5.860 5.340 3.463 5.825 . 0 0 "[ . 1 . 2]" 1
1546 1 64 SER HA 1 65 ILE HG13 4.360 . 4.360 3.390 3.332 3.497 . 0 0 "[ . 1 . 2]" 1
1547 1 13 VAL QG 1 63 ILE HA 5.410 . 5.410 5.178 5.052 5.314 . 0 0 "[ . 1 . 2]" 1
1548 1 63 ILE HA 1 73 THR MG 5.140 . 5.140 4.931 4.600 5.151 0.011 5 0 "[ . 1 . 2]" 1
1549 1 63 ILE HA 1 75 LEU HB3 5.480 . 5.480 5.343 4.953 5.538 0.058 1 0 "[ . 1 . 2]" 1
1550 1 63 ILE HA 1 74 LYS HG3 4.530 . 4.530 3.820 3.516 4.535 0.005 11 0 "[ . 1 . 2]" 1
1551 1 63 ILE HA 1 75 LEU HB2 4.900 . 4.900 3.959 3.635 4.234 . 0 0 "[ . 1 . 2]" 1
1552 1 64 SER HA 1 65 ILE HB 4.760 . 4.760 4.675 4.593 4.745 . 0 0 "[ . 1 . 2]" 1
1553 1 10 GLU HG2 1 64 SER HA 4.330 . 4.330 4.215 3.999 4.355 0.025 8 0 "[ . 1 . 2]" 1
1554 1 65 ILE MG 1 66 ASP HA 4.800 . 4.800 3.978 3.892 4.069 . 0 0 "[ . 1 . 2]" 1
1555 1 31 LEU HA 1 31 LEU MD2 4.230 . 4.230 3.108 2.075 3.918 . 0 0 "[ . 1 . 2]" 1
1556 1 33 ILE HA 1 33 ILE HG13 4.180 . 4.180 2.454 2.312 2.553 . 0 0 "[ . 1 . 2]" 1
1557 1 31 LEU MD1 1 33 ILE HA 5.220 . 5.220 3.975 3.016 4.967 . 0 0 "[ . 1 . 2]" 1
1558 1 33 ILE HA 1 33 ILE MG 3.540 . 3.540 2.798 2.742 2.864 . 0 0 "[ . 1 . 2]" 1
1559 1 31 LEU MD2 1 33 ILE HA 5.220 . 5.220 4.632 3.675 5.349 0.129 17 0 "[ . 1 . 2]" 1
1560 1 31 LEU MD2 1 32 THR HA 6.000 . 6.000 4.904 3.682 5.458 . 0 0 "[ . 1 . 2]" 1
1561 1 32 THR HA 1 41 ILE MD 4.820 . 4.820 4.450 4.252 4.760 . 0 0 "[ . 1 . 2]" 1
1562 1 18 ILE HA 1 49 ILE MD 4.620 . 4.620 4.440 4.082 4.668 0.048 17 0 "[ . 1 . 2]" 1
1563 1 44 LEU HA 1 44 LEU MD2 4.200 . 4.200 3.627 3.406 3.804 . 0 0 "[ . 1 . 2]" 1
1564 1 16 ILE MD 1 58 LEU HA 3.400 . 3.400 2.129 1.980 2.394 . 0 0 "[ . 1 . 2]" 1
1565 1 16 ILE HA 1 16 ILE MG 3.280 . 3.280 2.448 2.405 2.498 . 0 0 "[ . 1 . 2]" 1
1566 1 16 ILE HA 1 16 ILE HG12 4.080 . 4.080 2.484 2.438 2.523 . 0 0 "[ . 1 . 2]" 1
1567 1 74 LYS HA 1 75 LEU QD 4.170 . 4.170 2.800 2.608 3.516 . 0 0 "[ . 1 . 2]" 1
1568 1 40 THR MG 1 42 TYR HA 5.150 . 5.150 4.439 4.250 4.681 . 0 0 "[ . 1 . 2]" 1
1569 1 94 PHE HA 1 95 VAL MG1 5.030 . 5.030 4.679 3.651 5.295 0.265 7 0 "[ . 1 . 2]" 1
1570 1 94 PHE HA 1 95 VAL MG2 5.030 . 5.030 4.200 2.725 5.379 0.349 2 0 "[ . 1 . 2]" 1
1571 1 22 ILE MG 1 27 LYS HA 4.110 . 4.110 2.237 1.779 2.905 . 0 0 "[ . 1 . 2]" 1
1572 1 22 ILE MG 1 23 THR HA 4.140 . 4.140 3.889 2.988 4.234 0.094 2 0 "[ . 1 . 2]" 1
1573 1 40 THR HA 1 40 THR MG 3.420 . 3.420 2.348 2.304 2.445 . 0 0 "[ . 1 . 2]" 1
1574 1 52 LEU HA 1 52 LEU MD1 3.780 . 3.780 3.688 3.674 3.704 . 0 0 "[ . 1 . 2]" 1
1575 1 52 LEU MD1 1 53 THR HA 4.100 . 4.100 2.625 2.529 2.700 . 0 0 "[ . 1 . 2]" 1
1576 1 15 GLU HB3 1 32 THR MG 4.320 . 4.320 3.491 3.182 4.292 . 0 0 "[ . 1 . 2]" 1
1577 1 14 VAL HB 1 32 THR MG 3.730 . 3.730 3.507 1.978 4.016 0.286 10 0 "[ . 1 . 2]" 1
1578 1 32 THR MG 1 41 ILE HA 4.410 . 4.410 3.383 3.090 3.684 . 0 0 "[ . 1 . 2]" 1
1579 1 49 ILE MD 1 52 LEU MD2 3.370 . 3.370 3.149 2.966 3.360 . 0 0 "[ . 1 . 2]" 1
1580 1 55 GLU QG 1 72 ILE MG 4.010 . 4.010 2.237 1.925 2.733 . 0 0 "[ . 1 . 2]" 1
1581 1 65 ILE MG 1 72 ILE HG12 4.020 . 4.020 3.309 3.086 3.575 . 0 0 "[ . 1 . 2]" 1
1582 1 27 LYS HB3 1 49 ILE MD 3.970 . 3.970 3.196 2.794 3.531 . 0 0 "[ . 1 . 2]" 1
1583 1 49 ILE HB 1 49 ILE MD 3.700 . 3.700 2.308 2.277 2.345 . 0 0 "[ . 1 . 2]" 1
1584 1 63 ILE HB 1 72 ILE MG 3.670 . 3.670 2.425 2.167 2.815 . 0 0 "[ . 1 . 2]" 1
1585 1 72 ILE HG12 1 72 ILE MG 3.520 . 3.520 2.215 2.185 2.251 . 0 0 "[ . 1 . 2]" 1
1586 1 27 LYS HB3 1 49 ILE HG12 3.940 . 3.940 2.565 2.364 2.913 . 0 0 "[ . 1 . 2]" 1
1587 1 52 LEU HB2 1 52 LEU MD1 3.120 . 3.120 2.214 2.203 2.222 . 0 0 "[ . 1 . 2]" 1
1588 1 52 LEU HB2 1 52 LEU MD2 3.150 . 3.150 2.610 2.594 2.632 . 0 0 "[ . 1 . 2]" 1
1589 1 52 LEU HB2 1 72 ILE MG 4.570 . 4.570 4.107 3.785 4.536 . 0 0 "[ . 1 . 2]" 1
1590 1 72 ILE HG13 1 72 ILE MG 3.750 . 3.750 2.546 2.499 2.605 . 0 0 "[ . 1 . 2]" 1
1591 1 8 LEU HA 1 8 LEU HG 4.000 . 4.000 3.306 3.265 3.379 . 0 0 "[ . 1 . 2]" 1
1592 1 30 LYS HA 1 30 LYS HD2 4.340 . 4.340 2.652 1.945 3.749 . 0 0 "[ . 1 . 2]" 1
1593 1 84 ASP H 1 84 ASP HB3 3.910 . 3.910 3.117 2.552 4.028 0.118 20 0 "[ . 1 . 2]" 1
1594 1 81 ARG HA 1 81 ARG QD 4.400 . 4.400 3.782 1.985 4.507 0.107 12 0 "[ . 1 . 2]" 1
1595 1 105 ARG HA 1 105 ARG QD 4.700 . 4.700 4.011 1.892 4.559 . 0 0 "[ . 1 . 2]" 1
1596 1 83 ARG HA 1 83 ARG QD 4.280 . 4.280 3.698 1.930 4.401 0.121 6 0 "[ . 1 . 2]" 1
1597 1 26 HIS HA 1 46 ASN QB 4.320 . 4.320 2.953 1.830 4.409 0.089 10 0 "[ . 1 . 2]" 1
1598 1 9 ILE HG12 1 9 ILE MG 3.220 . 3.220 2.416 2.302 3.183 . 0 0 "[ . 1 . 2]" 1
1599 1 10 GLU HG3 1 75 LEU QD 5.000 . 5.000 4.833 4.262 4.959 . 0 0 "[ . 1 . 2]" 1
1600 1 65 ILE HG12 1 72 ILE HG13 3.950 . 3.950 2.072 1.977 2.207 . 0 0 "[ . 1 . 2]" 1
1601 1 65 ILE MG 1 67 LYS HA 3.990 . 3.990 3.443 3.241 3.707 . 0 0 "[ . 1 . 2]" 1
1602 1 36 THR HA 1 36 THR MG 3.050 . 3.050 2.338 2.273 2.380 . 0 0 "[ . 1 . 2]" 1
1603 1 13 VAL HA 1 33 ILE HG12 3.990 . 3.990 2.932 2.573 3.158 . 0 0 "[ . 1 . 2]" 1
1604 1 27 LYS HB3 1 28 GLN QG 4.910 . 4.910 4.732 4.447 4.952 0.042 3 0 "[ . 1 . 2]" 1
1605 1 53 THR HA 1 53 THR MG 2.910 . 2.910 2.395 2.345 2.433 . 0 0 "[ . 1 . 2]" 1
1606 1 54 LYS HA 1 56 LYS QG 4.310 . 4.310 4.153 3.944 4.376 0.066 19 0 "[ . 1 . 2]" 1
1607 1 65 ILE HA 1 65 ILE HG12 3.980 . 3.980 2.663 2.595 2.696 . 0 0 "[ . 1 . 2]" 1
1608 1 35 THR HA 1 35 THR MG 3.310 . 3.310 2.402 2.379 2.425 . 0 0 "[ . 1 . 2]" 1
1609 1 27 LYS HA 1 27 LYS HG3 4.110 . 4.110 3.247 3.089 3.357 . 0 0 "[ . 1 . 2]" 1
1610 1 58 LEU HA 1 58 LEU HG 3.780 . 3.780 3.351 3.048 3.700 . 0 0 "[ . 1 . 2]" 1
1611 1 20 ARG HA 1 20 ARG HG2 4.130 . 4.130 3.224 3.006 3.643 . 0 0 "[ . 1 . 2]" 1
1612 1 83 ARG HA 1 83 ARG QG 3.850 . 3.850 2.696 2.250 3.494 . 0 0 "[ . 1 . 2]" 1
1613 1 27 LYS HB2 1 46 ASN HA 3.830 . 3.830 2.438 1.880 2.847 . 0 0 "[ . 1 . 2]" 1
1614 1 92 THR HA 1 93 ARG QB 5.310 . 5.310 4.828 4.010 5.061 . 0 0 "[ . 1 . 2]" 1
1615 1 104 LYS HA 1 105 ARG QG 5.820 . 5.820 4.574 3.320 5.922 0.102 2 0 "[ . 1 . 2]" 1
1616 1 104 LYS HA 1 104 LYS QD 4.410 . 4.410 3.120 1.965 4.479 0.069 18 0 "[ . 1 . 2]" 1
1617 1 14 VAL HB 1 32 THR HB 4.800 . 4.800 4.358 2.482 4.910 0.110 10 0 "[ . 1 . 2]" 1
1618 1 27 LYS H 1 27 LYS HB3 3.980 . 3.980 3.618 3.557 3.671 . 0 0 "[ . 1 . 2]" 1
1619 1 77 ARG HB2 1 78 SER H 4.310 . 4.310 3.517 1.957 4.339 0.029 11 0 "[ . 1 . 2]" 1
1620 1 83 ARG H 1 83 ARG QG 3.660 . 3.660 2.808 2.008 3.946 0.286 7 0 "[ . 1 . 2]" 1
1621 1 22 ILE MG 1 28 GLN H 4.440 . 4.440 3.915 2.960 4.521 0.081 9 0 "[ . 1 . 2]" 1
1622 1 2 PRO QB 1 3 HIS H 4.050 . 4.050 3.206 1.897 3.999 . 0 0 "[ . 1 . 2]" 1
1623 1 4 MET H 1 4 MET QB 3.580 . 3.580 2.655 2.261 3.361 . 0 0 "[ . 1 . 2]" 1
1624 1 4 MET QB 1 5 GLU H 3.540 . 3.540 3.229 1.955 3.880 0.340 4 0 "[ . 1 . 2]" 1
1625 1 4 MET QG 1 5 GLU H 4.760 . 4.760 3.760 2.391 4.810 0.050 12 0 "[ . 1 . 2]" 1
1626 1 5 GLU H 1 5 GLU QB 3.290 . 3.290 2.685 2.308 3.324 0.034 3 0 "[ . 1 . 2]" 1
1627 1 5 GLU QB 1 6 THR H 3.770 . 3.770 3.147 1.730 3.967 0.197 9 0 "[ . 1 . 2]" 1
1628 1 6 THR MG 1 8 LEU QD 3.600 . 3.600 2.610 2.265 3.116 . 0 0 "[ . 1 . 2]" 1
1629 1 7 GLU H 1 7 GLU QB 2.990 . 2.990 2.481 2.247 2.828 . 0 0 "[ . 1 . 2]" 1
1630 1 7 GLU H 1 7 GLU QG 3.640 . 3.640 2.557 1.897 3.932 0.292 20 0 "[ . 1 . 2]" 1
1631 1 7 GLU H 1 8 LEU QD 4.450 . 4.450 3.918 3.651 4.075 . 0 0 "[ . 1 . 2]" 1
1632 1 7 GLU HA 1 7 GLU QG 3.540 . 3.540 2.646 2.345 3.428 . 0 0 "[ . 1 . 2]" 1
1633 1 7 GLU HA 1 8 LEU QD 4.110 . 4.110 4.066 3.833 4.152 0.042 18 0 "[ . 1 . 2]" 1
1634 1 7 GLU QB 1 8 LEU H 3.670 . 3.670 3.454 3.188 3.845 0.175 20 0 "[ . 1 . 2]" 1
1635 1 7 GLU QB 1 8 LEU QD 4.250 . 4.250 4.231 4.055 4.411 0.161 5 0 "[ . 1 . 2]" 1
1636 1 7 GLU QB 1 67 LYS H 5.430 . 5.430 4.015 3.387 5.312 . 0 0 "[ . 1 . 2]" 1
1637 1 7 GLU QG 1 8 LEU H 4.250 . 4.250 4.115 3.045 4.366 0.116 2 0 "[ . 1 . 2]" 1
1638 1 8 LEU H 1 8 LEU QB 3.180 . 3.180 2.622 2.557 2.672 . 0 0 "[ . 1 . 2]" 1
1639 1 8 LEU H 1 8 LEU QD 3.350 . 3.350 3.301 3.090 3.388 0.038 1 0 "[ . 1 . 2]" 1
1640 1 8 LEU HA 1 8 LEU QD 3.020 . 3.020 2.081 2.006 2.124 . 0 0 "[ . 1 . 2]" 1
1641 1 8 LEU QB 1 8 LEU QD 2.720 . 2.720 1.949 1.941 1.956 . 0 0 "[ . 1 . 2]" 1
1642 1 8 LEU QB 1 9 ILE H 3.230 . 3.230 3.012 2.829 3.152 . 0 0 "[ . 1 . 2]" 1
1643 1 8 LEU QB 1 64 SER QB 4.560 . 4.560 3.276 2.765 4.007 . 0 0 "[ . 1 . 2]" 1
1644 1 8 LEU QD 1 9 ILE H 3.610 . 3.610 3.584 3.504 3.645 0.035 11 0 "[ . 1 . 2]" 1
1645 1 8 LEU QD 1 10 GLU HG2 5.000 . 5.000 4.670 4.318 5.001 0.001 8 0 "[ . 1 . 2]" 1
1646 1 8 LEU QD 1 64 SER QB 3.870 . 3.870 3.261 2.714 3.872 0.002 7 0 "[ . 1 . 2]" 1
1647 1 8 LEU QD 1 65 ILE H 4.640 . 4.640 4.217 3.936 4.553 . 0 0 "[ . 1 . 2]" 1
1648 1 8 LEU QD 1 66 ASP H 4.060 . 4.060 3.765 3.537 4.067 0.007 6 0 "[ . 1 . 2]" 1
1649 1 8 LEU QD 1 66 ASP HA 3.250 . 3.250 1.928 1.827 1.998 . 0 0 "[ . 1 . 2]" 1
1650 1 8 LEU QD 1 66 ASP QB 3.400 . 3.400 2.693 2.443 3.096 . 0 0 "[ . 1 . 2]" 1
1651 1 8 LEU QD 1 67 LYS H 3.440 . 3.440 2.934 2.600 3.272 . 0 0 "[ . 1 . 2]" 1
1652 1 8 LEU QD 1 68 ALA H 4.440 . 4.440 3.946 3.641 4.225 . 0 0 "[ . 1 . 2]" 1
1653 1 8 LEU QD 1 69 SER H 5.440 . 5.440 4.844 4.503 5.078 . 0 0 "[ . 1 . 2]" 1
1654 1 9 ILE H 1 9 ILE QG 4.300 . 4.300 4.085 4.023 4.227 . 0 0 "[ . 1 . 2]" 1
1655 1 9 ILE H 1 64 SER QB 4.860 . 4.860 4.593 4.214 5.011 0.151 11 0 "[ . 1 . 2]" 1
1656 1 9 ILE HA 1 9 ILE QG 3.300 . 3.300 2.943 2.542 3.052 . 0 0 "[ . 1 . 2]" 1
1657 1 9 ILE QG 1 9 ILE MG 2.710 . 2.710 2.145 2.106 2.450 . 0 0 "[ . 1 . 2]" 1
1658 1 9 ILE QG 1 10 GLU H 3.690 . 3.690 3.019 2.577 3.272 . 0 0 "[ . 1 . 2]" 1
1659 1 9 ILE QG 1 33 ILE MD 3.120 . 3.120 2.760 2.382 3.386 0.266 8 0 "[ . 1 . 2]" 1
1660 1 9 ILE QG 1 42 TYR QD 4.230 . 4.230 3.378 3.207 4.041 . 0 0 "[ . 1 . 2]" 1
1661 1 9 ILE QG 1 42 TYR QE 4.000 . 4.000 2.845 2.712 2.948 . 0 0 "[ . 1 . 2]" 1
1662 1 9 ILE QG 1 64 SER HA 5.110 . 5.110 4.966 4.651 5.197 0.087 8 0 "[ . 1 . 2]" 1
1663 1 9 ILE QG 1 65 ILE H 5.660 . 5.660 4.434 4.192 4.836 . 0 0 "[ . 1 . 2]" 1
1664 1 9 ILE QG 1 65 ILE MD 3.770 . 3.770 3.437 3.128 3.855 0.085 8 0 "[ . 1 . 2]" 1
1665 1 10 GLU HA 1 62 VAL QG 4.340 . 4.340 4.379 4.245 4.497 0.157 2 0 "[ . 1 . 2]" 1
1666 1 10 GLU HA 1 64 SER QB 4.340 . 4.340 3.712 3.401 3.963 . 0 0 "[ . 1 . 2]" 1
1667 1 10 GLU HB2 1 62 VAL QG 3.740 . 3.740 3.397 3.171 3.708 . 0 0 "[ . 1 . 2]" 1
1668 1 10 GLU HB2 1 64 SER QB 4.320 . 4.320 2.969 2.742 3.185 . 0 0 "[ . 1 . 2]" 1
1669 1 10 GLU HG2 1 64 SER QB 4.010 . 4.010 3.745 3.494 4.028 0.018 4 0 "[ . 1 . 2]" 1
1670 1 10 GLU HG3 1 64 SER QB 5.810 . 5.810 4.453 4.178 4.736 . 0 0 "[ . 1 . 2]" 1
1671 1 11 GLY H 1 62 VAL QG 3.370 . 3.370 2.876 2.703 3.108 . 0 0 "[ . 1 . 2]" 1
1672 1 11 GLY H 1 64 SER QB 5.810 . 5.810 4.822 4.603 4.983 . 0 0 "[ . 1 . 2]" 1
1673 1 11 GLY HA2 1 62 VAL QG 4.020 . 4.020 2.948 2.732 3.307 . 0 0 "[ . 1 . 2]" 1
1674 1 11 GLY HA3 1 62 VAL QG 4.400 . 4.400 3.943 3.769 4.213 . 0 0 "[ . 1 . 2]" 1
1675 1 12 GLU H 1 12 GLU QG 4.130 . 4.130 3.989 3.949 4.024 . 0 0 "[ . 1 . 2]" 1
1676 1 12 GLU H 1 14 VAL QG 5.920 . 5.920 4.746 4.261 5.466 . 0 0 "[ . 1 . 2]" 1
1677 1 12 GLU H 1 62 VAL QG 4.510 . 4.510 3.510 3.238 3.795 . 0 0 "[ . 1 . 2]" 1
1678 1 12 GLU HA 1 62 VAL QG 3.470 . 3.470 2.245 2.011 2.726 . 0 0 "[ . 1 . 2]" 1
1679 1 12 GLU HB2 1 62 VAL QG 3.440 . 3.440 2.800 2.358 3.478 0.038 1 0 "[ . 1 . 2]" 1
1680 1 12 GLU QG 1 13 VAL QG 5.560 . 5.560 3.980 3.417 4.123 . 0 0 "[ . 1 . 2]" 1
1681 1 12 GLU QG 1 14 VAL HA 4.500 . 4.500 3.996 3.561 4.371 . 0 0 "[ . 1 . 2]" 1
1682 1 12 GLU QG 1 14 VAL QG 4.030 . 4.030 3.722 3.041 4.071 0.041 10 0 "[ . 1 . 2]" 1
1683 1 12 GLU QG 1 59 ALA HA 5.810 . 5.810 5.326 4.986 5.653 . 0 0 "[ . 1 . 2]" 1
1684 1 13 VAL H 1 62 VAL QG 4.310 . 4.310 3.663 3.461 4.246 . 0 0 "[ . 1 . 2]" 1
1685 1 13 VAL HA 1 14 VAL QG 3.890 . 3.890 3.330 3.163 3.656 . 0 0 "[ . 1 . 2]" 1
1686 1 13 VAL HA 1 31 LEU QD 4.180 . 4.180 3.188 2.769 3.493 . 0 0 "[ . 1 . 2]" 1
1687 1 13 VAL HB 1 31 LEU QD 4.960 . 4.960 4.060 2.447 4.418 . 0 0 "[ . 1 . 2]" 1
1688 1 13 VAL QG 1 16 ILE QG 2.890 . 2.890 1.996 1.846 2.105 . 0 0 "[ . 1 . 2]" 1
1689 1 14 VAL H 1 14 VAL QG 3.050 . 3.050 1.970 1.778 2.404 . 0 0 "[ . 1 . 2]" 1
1690 1 14 VAL H 1 31 LEU QD 4.470 . 4.470 3.864 3.459 4.313 . 0 0 "[ . 1 . 2]" 1
1691 1 14 VAL QG 1 15 GLU H 3.470 . 3.470 2.638 2.362 3.294 . 0 0 "[ . 1 . 2]" 1
1692 1 14 VAL QG 1 15 GLU HA 4.300 . 4.300 3.706 3.510 4.030 . 0 0 "[ . 1 . 2]" 1
1693 1 14 VAL QG 1 15 GLU HB2 3.550 . 3.550 2.356 2.032 3.395 . 0 0 "[ . 1 . 2]" 1
1694 1 14 VAL QG 1 15 GLU HB3 4.510 . 4.510 3.423 2.890 4.520 0.010 13 0 "[ . 1 . 2]" 1
1695 1 14 VAL QG 1 15 GLU QG 3.830 . 3.830 3.600 2.390 3.932 0.102 10 0 "[ . 1 . 2]" 1
1696 1 14 VAL QG 1 16 ILE H 5.790 . 5.790 5.224 5.014 5.692 . 0 0 "[ . 1 . 2]" 1
1697 1 14 VAL QG 1 32 THR H 5.070 . 5.070 4.156 3.869 5.045 . 0 0 "[ . 1 . 2]" 1
1698 1 14 VAL QG 1 32 THR HA 5.130 . 5.130 3.882 3.570 4.824 . 0 0 "[ . 1 . 2]" 1
1699 1 14 VAL QG 1 32 THR HB 3.710 . 3.710 2.377 1.959 3.424 . 0 0 "[ . 1 . 2]" 1
1700 1 14 VAL QG 1 33 ILE H 4.480 . 4.480 3.598 3.264 4.414 . 0 0 "[ . 1 . 2]" 1
1701 1 14 VAL QG 1 33 ILE HA 3.600 . 3.600 2.693 2.473 3.116 . 0 0 "[ . 1 . 2]" 1
1702 1 14 VAL QG 1 34 LYS H 3.580 . 3.580 2.506 2.401 2.889 . 0 0 "[ . 1 . 2]" 1
1703 1 14 VAL QG 1 34 LYS HA 4.130 . 4.130 3.360 3.113 3.743 . 0 0 "[ . 1 . 2]" 1
1704 1 14 VAL QG 1 34 LYS HB2 3.380 . 3.380 2.519 1.848 3.505 0.125 10 0 "[ . 1 . 2]" 1
1705 1 14 VAL QG 1 34 LYS HB3 4.100 . 4.100 3.569 2.907 4.177 0.077 10 0 "[ . 1 . 2]" 1
1706 1 14 VAL QG 1 34 LYS QE 3.500 . 3.500 2.879 2.007 3.723 0.223 9 0 "[ . 1 . 2]" 1
1707 1 14 VAL QG 1 35 THR H 5.380 . 5.380 5.035 4.852 5.430 0.050 10 0 "[ . 1 . 2]" 1
1708 1 14 VAL QG 1 39 GLU QG 4.200 . 4.200 3.455 2.831 4.162 . 0 0 "[ . 1 . 2]" 1
1709 1 14 VAL QG 1 40 THR H 5.310 . 5.310 4.459 4.100 4.919 . 0 0 "[ . 1 . 2]" 1
1710 1 15 GLU H 1 15 GLU QG 4.840 . 4.840 4.155 3.616 4.359 . 0 0 "[ . 1 . 2]" 1
1711 1 15 GLU H 1 16 ILE QG 5.410 . 5.410 3.827 3.735 3.991 . 0 0 "[ . 1 . 2]" 1
1712 1 15 GLU H 1 31 LEU QD 5.920 . 5.920 3.594 3.347 3.880 . 0 0 "[ . 1 . 2]" 1
1713 1 15 GLU HA 1 15 GLU QG 3.070 . 3.070 2.382 2.244 2.913 . 0 0 "[ . 1 . 2]" 1
1714 1 15 GLU HA 1 16 ILE QG 4.960 . 4.960 3.620 3.527 3.734 . 0 0 "[ . 1 . 2]" 1
1715 1 15 GLU QG 1 16 ILE H 3.410 . 3.410 2.653 1.896 3.482 0.072 19 0 "[ . 1 . 2]" 1
1716 1 15 GLU QG 1 32 THR H 5.810 . 5.810 4.905 4.372 5.466 . 0 0 "[ . 1 . 2]" 1
1717 1 16 ILE H 1 16 ILE QG 3.760 . 3.760 3.136 3.016 3.253 . 0 0 "[ . 1 . 2]" 1
1718 1 16 ILE H 1 31 LEU QD 5.920 . 5.920 4.628 4.378 4.910 . 0 0 "[ . 1 . 2]" 1
1719 1 16 ILE HA 1 16 ILE QG 3.360 . 3.360 2.377 2.339 2.413 . 0 0 "[ . 1 . 2]" 1
1720 1 16 ILE HA 1 31 LEU QD 3.860 . 3.860 2.764 2.232 3.278 . 0 0 "[ . 1 . 2]" 1
1721 1 16 ILE HA 1 44 LEU QD 4.600 . 4.600 4.279 3.952 4.651 0.051 5 0 "[ . 1 . 2]" 1
1722 1 16 ILE QG 1 17 GLN H 5.030 . 5.030 4.207 4.109 4.293 . 0 0 "[ . 1 . 2]" 1
1723 1 16 ILE QG 1 31 LEU HA 5.160 . 5.160 3.720 3.433 4.196 . 0 0 "[ . 1 . 2]" 1
1724 1 17 GLN H 1 17 GLN QG 4.250 . 4.250 4.085 3.968 4.195 . 0 0 "[ . 1 . 2]" 1
1725 1 17 GLN H 1 29 GLY QA 5.220 . 5.220 4.663 4.443 4.900 . 0 0 "[ . 1 . 2]" 1
1726 1 17 GLN H 1 31 LEU QD 4.660 . 4.660 4.074 3.538 4.554 . 0 0 "[ . 1 . 2]" 1
1727 1 17 GLN H 1 44 LEU QD 4.360 . 4.360 4.003 3.687 4.322 . 0 0 "[ . 1 . 2]" 1
1728 1 17 GLN HA 1 17 GLN QE 4.110 . 4.110 2.980 1.622 4.152 0.042 12 0 "[ . 1 . 2]" 1
1729 1 17 GLN QB 1 30 LYS H 3.750 . 3.750 2.571 2.057 2.819 . 0 0 "[ . 1 . 2]" 1
1730 1 17 GLN QB 1 30 LYS QB 3.690 . 3.690 2.052 1.879 2.308 . 0 0 "[ . 1 . 2]" 1
1731 1 17 GLN QG 1 18 ILE H 4.030 . 4.030 3.415 3.243 3.602 . 0 0 "[ . 1 . 2]" 1
1732 1 17 GLN QG 1 19 ASP H 4.990 . 4.990 4.227 3.718 4.858 . 0 0 "[ . 1 . 2]" 1
1733 1 17 GLN QG 1 30 LYS H 4.510 . 4.510 3.450 3.052 4.148 . 0 0 "[ . 1 . 2]" 1
1734 1 18 ILE H 1 20 ARG QG 5.810 . 5.810 5.094 4.621 5.889 0.079 9 0 "[ . 1 . 2]" 1
1735 1 18 ILE HA 1 44 LEU QD 4.810 . 4.810 4.253 3.923 4.767 . 0 0 "[ . 1 . 2]" 1
1736 1 18 ILE MG 1 19 ASP QB 5.330 . 5.330 3.957 3.690 4.108 . 0 0 "[ . 1 . 2]" 1
1737 1 18 ILE MD 1 29 GLY QA 3.910 . 3.910 2.046 1.852 2.198 . 0 0 "[ . 1 . 2]" 1
1738 1 19 ASP H 1 20 ARG QG 5.390 . 5.390 5.018 4.757 5.273 . 0 0 "[ . 1 . 2]" 1
1739 1 19 ASP H 1 28 GLN QB 5.810 . 5.810 5.262 4.815 5.599 . 0 0 "[ . 1 . 2]" 1
1740 1 19 ASP H 1 29 GLY QA 3.500 . 3.500 2.900 2.708 3.216 . 0 0 "[ . 1 . 2]" 1
1741 1 19 ASP QB 1 20 ARG H 3.860 . 3.860 3.646 2.905 3.887 0.027 4 0 "[ . 1 . 2]" 1
1742 1 19 ASP QB 1 21 SER H 4.480 . 4.480 3.399 2.487 3.631 . 0 0 "[ . 1 . 2]" 1
1743 1 19 ASP QB 1 22 ILE MD 4.260 . 4.260 2.925 1.926 4.241 . 0 0 "[ . 1 . 2]" 1
1744 1 19 ASP QB 1 28 GLN H 4.440 . 4.440 3.376 2.805 3.736 . 0 0 "[ . 1 . 2]" 1
1745 1 20 ARG H 1 20 ARG QB 3.380 . 3.380 2.537 2.430 2.703 . 0 0 "[ . 1 . 2]" 1
1746 1 20 ARG H 1 20 ARG QG 3.620 . 3.620 2.896 2.469 3.650 0.030 10 0 "[ . 1 . 2]" 1
1747 1 20 ARG HA 1 20 ARG QG 3.540 . 3.540 2.863 2.333 3.217 . 0 0 "[ . 1 . 2]" 1
1748 1 20 ARG QB 1 21 SER H 4.380 . 4.380 3.754 3.556 3.832 . 0 0 "[ . 1 . 2]" 1
1749 1 20 ARG QG 1 21 SER H 4.970 . 4.970 4.660 4.506 4.804 . 0 0 "[ . 1 . 2]" 1
1750 1 21 SER H 1 22 ILE QG 5.230 . 5.230 3.150 2.454 4.558 . 0 0 "[ . 1 . 2]" 1
1751 1 22 ILE H 1 22 ILE QG 3.460 . 3.460 2.279 1.849 3.130 . 0 0 "[ . 1 . 2]" 1
1752 1 22 ILE QG 1 22 ILE MG 2.860 . 2.860 2.296 2.059 2.411 . 0 0 "[ . 1 . 2]" 1
1753 1 22 ILE MG 1 24 GLY QA 4.900 . 4.900 3.671 2.614 5.049 0.149 2 0 "[ . 1 . 2]" 1
1754 1 22 ILE MG 1 26 HIS QB 4.160 . 4.160 3.635 2.544 4.165 0.005 1 0 "[ . 1 . 2]" 1
1755 1 22 ILE QG 1 23 THR H 5.280 . 5.280 4.537 3.814 4.826 . 0 0 "[ . 1 . 2]" 1
1756 1 22 ILE QG 1 27 LYS HA 4.130 . 4.130 2.413 1.826 4.243 0.113 2 0 "[ . 1 . 2]" 1
1757 1 22 ILE QG 1 28 GLN H 4.640 . 4.640 2.735 2.215 3.813 . 0 0 "[ . 1 . 2]" 1
1758 1 25 GLY H 1 46 ASN QD 5.280 . 5.280 5.027 4.173 5.351 0.071 20 0 "[ . 1 . 2]" 1
1759 1 25 GLY QA 1 46 ASN QD 4.590 . 4.590 3.371 2.127 4.595 0.005 15 0 "[ . 1 . 2]" 1
1760 1 26 HIS H 1 46 ASN QD 5.810 . 5.810 3.905 2.252 4.776 . 0 0 "[ . 1 . 2]" 1
1761 1 26 HIS HA 1 46 ASN QD 3.760 . 3.760 2.885 1.708 3.739 . 0 0 "[ . 1 . 2]" 1
1762 1 26 HIS QB 1 27 LYS H 3.990 . 3.990 3.866 3.387 4.019 0.029 11 0 "[ . 1 . 2]" 1
1763 1 27 LYS H 1 46 ASN QD 4.350 . 4.350 2.695 1.903 3.409 . 0 0 "[ . 1 . 2]" 1
1764 1 27 LYS HA 1 27 LYS QD 4.070 . 4.070 4.010 3.856 4.183 0.113 16 0 "[ . 1 . 2]" 1
1765 1 27 LYS HA 1 46 ASN QD 5.810 . 5.810 5.110 4.221 5.876 0.066 4 0 "[ . 1 . 2]" 1
1766 1 27 LYS HB2 1 27 LYS QD 3.060 . 3.060 2.461 2.267 2.929 . 0 0 "[ . 1 . 2]" 1
1767 1 27 LYS HB3 1 27 LYS QD 2.680 . 2.680 2.391 2.237 2.742 0.062 16 0 "[ . 1 . 2]" 1
1768 1 27 LYS HB3 1 46 ASN QD 5.810 . 5.810 5.205 4.167 5.917 0.107 9 0 "[ . 1 . 2]" 1
1769 1 27 LYS HG3 1 46 ASN QD 3.740 . 3.740 2.926 1.921 3.772 0.032 1 0 "[ . 1 . 2]" 1
1770 1 27 LYS QD 1 46 ASN QD 4.950 . 4.950 3.941 2.967 4.959 0.009 4 0 "[ . 1 . 2]" 1
1771 1 28 GLN HA 1 44 LEU QD 5.690 . 5.690 4.902 4.468 5.299 . 0 0 "[ . 1 . 2]" 1
1772 1 28 GLN QB 1 28 GLN HE21 4.120 . 4.120 2.057 1.713 2.752 . 0 0 "[ . 1 . 2]" 1
1773 1 28 GLN QB 1 28 GLN HE22 4.570 . 4.570 3.296 3.176 3.558 . 0 0 "[ . 1 . 2]" 1
1774 1 28 GLN QB 1 49 ILE MD 4.720 . 4.720 3.953 3.546 4.263 . 0 0 "[ . 1 . 2]" 1
1775 1 29 GLY H 1 44 LEU QB 3.420 . 3.420 2.794 2.386 3.130 . 0 0 "[ . 1 . 2]" 1
1776 1 29 GLY H 1 44 LEU QD 4.410 . 4.410 3.673 3.293 4.141 . 0 0 "[ . 1 . 2]" 1
1777 1 29 GLY QA 1 44 LEU QB 4.180 . 4.180 2.824 2.431 3.629 . 0 0 "[ . 1 . 2]" 1
1778 1 29 GLY QA 1 44 LEU QD 4.150 . 4.150 2.588 2.169 2.929 . 0 0 "[ . 1 . 2]" 1
1779 1 29 GLY QA 1 49 ILE MD 3.850 . 3.850 2.865 2.548 3.323 . 0 0 "[ . 1 . 2]" 1
1780 1 30 LYS H 1 30 LYS QD 5.290 . 5.290 4.149 3.500 4.577 . 0 0 "[ . 1 . 2]" 1
1781 1 30 LYS H 1 44 LEU QB 5.430 . 5.430 4.324 3.564 5.118 . 0 0 "[ . 1 . 2]" 1
1782 1 30 LYS H 1 44 LEU QD 4.090 . 4.090 3.082 2.853 3.299 . 0 0 "[ . 1 . 2]" 1
1783 1 30 LYS HA 1 44 LEU QD 4.000 . 4.000 2.878 2.701 3.058 . 0 0 "[ . 1 . 2]" 1
1784 1 30 LYS QD 1 31 LEU H 4.210 . 4.210 3.632 3.196 3.979 . 0 0 "[ . 1 . 2]" 1
1785 1 30 LYS QD 1 41 ILE MG 2.970 . 2.970 2.684 1.852 3.125 0.155 17 0 "[ . 1 . 2]" 1
1786 1 30 LYS QD 1 43 GLU H 5.010 . 5.010 4.533 4.057 5.047 0.037 3 0 "[ . 1 . 2]" 1
1787 1 30 LYS QD 1 43 GLU HA 4.900 . 4.900 2.668 2.001 3.235 . 0 0 "[ . 1 . 2]" 1
1788 1 31 LEU H 1 31 LEU QD 4.390 . 4.390 3.791 3.534 3.919 . 0 0 "[ . 1 . 2]" 1
1789 1 31 LEU H 1 44 LEU QD 3.710 . 3.710 2.381 2.278 2.468 . 0 0 "[ . 1 . 2]" 1
1790 1 31 LEU HA 1 31 LEU QD 3.280 . 3.280 2.119 1.972 2.252 . 0 0 "[ . 1 . 2]" 1
1791 1 31 LEU HA 1 44 LEU QD 4.050 . 4.050 3.145 3.015 3.347 . 0 0 "[ . 1 . 2]" 1
1792 1 31 LEU HB2 1 44 LEU QD 4.380 . 4.380 1.766 1.693 1.873 . 0 0 "[ . 1 . 2]" 1
1793 1 31 LEU HB3 1 31 LEU QD 3.140 . 3.140 2.271 2.180 2.413 . 0 0 "[ . 1 . 2]" 1
1794 1 31 LEU HB3 1 44 LEU QD 2.880 . 2.880 2.389 2.114 2.683 . 0 0 "[ . 1 . 2]" 1
1795 1 31 LEU QD 1 32 THR H 3.250 . 3.250 2.249 1.826 2.667 . 0 0 "[ . 1 . 2]" 1
1796 1 31 LEU QD 1 32 THR HA 4.530 . 4.530 3.752 2.665 4.372 . 0 0 "[ . 1 . 2]" 1
1797 1 31 LEU QD 1 33 ILE H 4.180 . 4.180 3.758 2.722 4.365 0.185 16 0 "[ . 1 . 2]" 1
1798 1 31 LEU QD 1 33 ILE HA 4.300 . 4.300 3.584 3.000 4.087 . 0 0 "[ . 1 . 2]" 1
1799 1 31 LEU QD 1 33 ILE HG12 4.420 . 4.420 3.150 3.003 3.298 . 0 0 "[ . 1 . 2]" 1
1800 1 31 LEU QD 1 33 ILE HG13 3.590 . 3.590 1.979 1.685 2.224 . 0 0 "[ . 1 . 2]" 1
1801 1 31 LEU QD 1 33 ILE MD 2.760 . 2.760 2.056 1.828 2.387 . 0 0 "[ . 1 . 2]" 1
1802 1 31 LEU QD 1 42 TYR H 5.180 . 5.180 4.038 2.758 4.458 . 0 0 "[ . 1 . 2]" 1
1803 1 31 LEU QD 1 42 TYR HB2 4.420 . 4.420 3.364 2.158 3.917 . 0 0 "[ . 1 . 2]" 1
1804 1 31 LEU QD 1 42 TYR HB3 5.210 . 5.210 4.678 3.680 5.246 0.036 15 0 "[ . 1 . 2]" 1
1805 1 31 LEU QD 1 42 TYR QD 3.390 . 3.390 2.931 1.790 3.393 0.003 16 0 "[ . 1 . 2]" 1
1806 1 31 LEU QD 1 44 LEU QD 3.190 . 3.190 2.402 1.962 2.924 . 0 0 "[ . 1 . 2]" 1
1807 1 31 LEU QD 1 65 ILE HG12 5.050 . 5.050 4.545 3.893 5.131 0.081 8 0 "[ . 1 . 2]" 1
1808 1 31 LEU QD 1 65 ILE MD 3.290 . 3.290 2.688 2.044 3.385 0.095 8 0 "[ . 1 . 2]" 1
1809 1 32 THR MG 1 39 GLU QG 3.810 . 3.810 3.484 3.067 3.829 0.019 10 0 "[ . 1 . 2]" 1
1810 1 32 THR MG 1 41 ILE QG 3.600 . 3.600 2.336 2.103 2.509 . 0 0 "[ . 1 . 2]" 1
1811 1 33 ILE H 1 41 ILE QG 5.040 . 5.040 4.300 4.112 4.577 . 0 0 "[ . 1 . 2]" 1
1812 1 34 LYS QG 1 39 GLU QG 4.440 . 4.440 3.989 3.343 4.486 0.046 16 0 "[ . 1 . 2]" 1
1813 1 36 THR MG 1 37 ASP QB 4.820 . 4.820 4.290 3.473 4.850 0.030 7 0 "[ . 1 . 2]" 1
1814 1 37 ASP H 1 37 ASP QB 3.380 . 3.380 2.467 2.224 2.920 . 0 0 "[ . 1 . 2]" 1
1815 1 37 ASP QB 1 38 MET H 4.030 . 4.030 2.691 2.268 3.577 . 0 0 "[ . 1 . 2]" 1
1816 1 39 GLU H 1 39 GLU QG 3.360 . 3.360 2.249 1.813 2.904 . 0 0 "[ . 1 . 2]" 1
1817 1 39 GLU HA 1 39 GLU QG 3.680 . 3.680 3.404 3.332 3.509 . 0 0 "[ . 1 . 2]" 1
1818 1 39 GLU QG 1 40 THR H 4.460 . 4.460 4.245 4.145 4.343 . 0 0 "[ . 1 . 2]" 1
1819 1 41 ILE H 1 41 ILE QG 3.690 . 3.690 2.598 2.463 2.749 . 0 0 "[ . 1 . 2]" 1
1820 1 41 ILE QG 1 41 ILE MG 2.780 . 2.780 2.335 2.308 2.384 . 0 0 "[ . 1 . 2]" 1
1821 1 41 ILE QG 1 42 TYR H 5.110 . 5.110 4.053 3.848 4.171 . 0 0 "[ . 1 . 2]" 1
1822 1 42 TYR HB2 1 44 LEU QD 4.020 . 4.020 3.231 3.018 3.363 . 0 0 "[ . 1 . 2]" 1
1823 1 42 TYR HB3 1 44 LEU QD 5.450 . 5.450 3.710 3.304 3.968 . 0 0 "[ . 1 . 2]" 1
1824 1 42 TYR QD 1 44 LEU QD 4.480 . 4.480 4.439 4.230 4.549 0.069 3 0 "[ . 1 . 2]" 1
1825 1 43 GLU H 1 43 GLU QB 3.170 . 3.170 2.412 2.362 2.455 . 0 0 "[ . 1 . 2]" 1
1826 1 43 GLU H 1 44 LEU QD 5.010 . 5.010 4.041 3.788 4.217 . 0 0 "[ . 1 . 2]" 1
1827 1 43 GLU HA 1 44 LEU QD 4.570 . 4.570 3.044 2.649 3.560 . 0 0 "[ . 1 . 2]" 1
1828 1 43 GLU QB 1 44 LEU H 3.690 . 3.690 2.947 2.803 3.171 . 0 0 "[ . 1 . 2]" 1
1829 1 44 LEU H 1 44 LEU QB 3.020 . 3.020 2.368 2.211 2.537 . 0 0 "[ . 1 . 2]" 1
1830 1 44 LEU H 1 44 LEU QD 3.500 . 3.500 2.450 1.929 2.910 . 0 0 "[ . 1 . 2]" 1
1831 1 44 LEU HA 1 44 LEU QD 3.140 . 3.140 1.994 1.865 2.148 . 0 0 "[ . 1 . 2]" 1
1832 1 44 LEU QB 1 44 LEU QD 2.790 . 2.790 1.989 1.963 2.029 . 0 0 "[ . 1 . 2]" 1
1833 1 44 LEU QB 1 45 GLY H 4.080 . 4.080 3.244 2.926 3.444 . 0 0 "[ . 1 . 2]" 1
1834 1 44 LEU QB 1 49 ILE H 5.140 . 5.140 3.201 2.742 3.682 . 0 0 "[ . 1 . 2]" 1
1835 1 44 LEU QB 1 49 ILE HG12 5.810 . 5.810 4.228 4.083 4.447 . 0 0 "[ . 1 . 2]" 1
1836 1 44 LEU QB 1 49 ILE MD 3.210 . 3.210 1.832 1.719 1.957 . 0 0 "[ . 1 . 2]" 1
1837 1 44 LEU QB 1 52 LEU MD2 4.570 . 4.570 3.127 2.801 3.527 . 0 0 "[ . 1 . 2]" 1
1838 1 44 LEU QD 1 45 GLY H 3.910 . 3.910 3.625 3.493 3.745 . 0 0 "[ . 1 . 2]" 1
1839 1 44 LEU QD 1 48 MET H 5.600 . 5.600 5.024 4.815 5.280 . 0 0 "[ . 1 . 2]" 1
1840 1 44 LEU QD 1 48 MET HA 5.010 . 5.010 4.424 4.118 4.787 . 0 0 "[ . 1 . 2]" 1
1841 1 44 LEU QD 1 48 MET QB 3.350 . 3.350 2.396 2.020 2.746 . 0 0 "[ . 1 . 2]" 1
1842 1 44 LEU QD 1 48 MET QG 3.460 . 3.460 2.405 2.148 2.745 . 0 0 "[ . 1 . 2]" 1
1843 1 44 LEU QD 1 49 ILE HA 4.350 . 4.350 4.138 3.754 4.413 0.063 19 0 "[ . 1 . 2]" 1
1844 1 44 LEU QD 1 49 ILE HG13 3.870 . 3.870 3.699 3.186 3.922 0.052 8 0 "[ . 1 . 2]" 1
1845 1 44 LEU QD 1 52 LEU HB2 5.050 . 5.050 4.849 4.590 5.090 0.040 20 0 "[ . 1 . 2]" 1
1846 1 44 LEU QD 1 52 LEU HG 4.900 . 4.900 4.542 4.290 4.793 . 0 0 "[ . 1 . 2]" 1
1847 1 44 LEU QD 1 52 LEU MD2 3.140 . 3.140 2.374 2.086 2.644 . 0 0 "[ . 1 . 2]" 1
1848 1 44 LEU QD 1 65 ILE MD 3.410 . 3.410 2.839 2.510 3.155 . 0 0 "[ . 1 . 2]" 1
1849 1 45 GLY H 1 48 MET QB 4.260 . 4.260 2.077 1.883 2.431 . 0 0 "[ . 1 . 2]" 1
1850 1 45 GLY QA 1 48 MET H 4.340 . 4.340 3.515 3.361 3.659 . 0 0 "[ . 1 . 2]" 1
1851 1 45 GLY QA 1 49 ILE MD 4.870 . 4.870 3.354 3.156 3.565 . 0 0 "[ . 1 . 2]" 1
1852 1 46 ASN HA 1 46 ASN QD 4.360 . 4.360 3.380 2.802 4.017 . 0 0 "[ . 1 . 2]" 1
1853 1 47 LYS H 1 47 LYS QG 4.950 . 4.950 2.983 1.979 4.051 . 0 0 "[ . 1 . 2]" 1
1854 1 47 LYS QB 1 48 MET H 3.430 . 3.430 2.655 2.547 2.860 . 0 0 "[ . 1 . 2]" 1
1855 1 47 LYS QG 1 48 MET H 4.230 . 4.230 3.912 3.595 4.166 . 0 0 "[ . 1 . 2]" 1
1856 1 48 MET H 1 48 MET QB 3.080 . 3.080 2.257 2.204 2.389 . 0 0 "[ . 1 . 2]" 1
1857 1 48 MET H 1 48 MET QG 3.520 . 3.520 3.391 2.299 3.549 0.029 4 0 "[ . 1 . 2]" 1
1858 1 48 MET QB 1 49 ILE HA 4.870 . 4.870 3.910 3.860 3.996 . 0 0 "[ . 1 . 2]" 1
1859 1 48 MET QB 1 49 ILE MD 3.850 . 3.850 2.836 2.714 2.936 . 0 0 "[ . 1 . 2]" 1
1860 1 48 MET QB 1 52 LEU MD2 4.300 . 4.300 2.830 2.687 3.072 . 0 0 "[ . 1 . 2]" 1
1861 1 48 MET QB 1 72 ILE MD 4.260 . 4.260 3.321 3.221 3.436 . 0 0 "[ . 1 . 2]" 1
1862 1 48 MET QG 1 49 ILE H 5.110 . 5.110 4.397 4.026 4.491 . 0 0 "[ . 1 . 2]" 1
1863 1 48 MET QG 1 65 ILE MG 4.120 . 4.120 2.554 2.301 3.784 . 0 0 "[ . 1 . 2]" 1
1864 1 48 MET QG 1 65 ILE MD 4.680 . 4.680 3.250 2.895 4.362 . 0 0 "[ . 1 . 2]" 1
1865 1 48 MET QG 1 70 GLY HA2 5.110 . 5.110 4.373 3.988 4.714 . 0 0 "[ . 1 . 2]" 1
1866 1 50 ASP H 1 51 GLY QA 4.880 . 4.880 4.605 4.527 4.703 . 0 0 "[ . 1 . 2]" 1
1867 1 51 GLY QA 1 54 LYS QB 4.340 . 4.340 2.666 2.475 2.839 . 0 0 "[ . 1 . 2]" 1
1868 1 51 GLY QA 1 72 ILE MG 4.310 . 4.310 3.730 3.446 3.954 . 0 0 "[ . 1 . 2]" 1
1869 1 51 GLY QA 1 72 ILE MD 3.440 . 3.440 2.017 1.909 2.111 . 0 0 "[ . 1 . 2]" 1
1870 1 52 LEU H 1 57 VAL QG 4.540 . 4.540 4.387 4.256 4.519 . 0 0 "[ . 1 . 2]" 1
1871 1 52 LEU HA 1 55 GLU QB 3.770 . 3.770 2.816 2.671 2.996 . 0 0 "[ . 1 . 2]" 1
1872 1 52 LEU HA 1 57 VAL QG 3.160 . 3.160 2.142 2.015 2.273 . 0 0 "[ . 1 . 2]" 1
1873 1 52 LEU HB2 1 57 VAL QG 3.600 . 3.600 2.673 2.517 2.815 . 0 0 "[ . 1 . 2]" 1
1874 1 52 LEU HB3 1 57 VAL QG 4.330 . 4.330 3.099 2.920 3.250 . 0 0 "[ . 1 . 2]" 1
1875 1 53 THR H 1 57 VAL QG 4.760 . 4.760 4.568 4.471 4.718 . 0 0 "[ . 1 . 2]" 1
1876 1 53 THR HA 1 57 VAL QG 4.770 . 4.770 4.647 4.551 4.782 0.012 14 0 "[ . 1 . 2]" 1
1877 1 53 THR MG 1 56 LYS QD 4.590 . 4.590 3.604 3.310 4.633 0.043 19 0 "[ . 1 . 2]" 1
1878 1 54 LYS H 1 57 VAL QG 5.410 . 5.410 5.148 5.064 5.249 . 0 0 "[ . 1 . 2]" 1
1879 1 55 GLU H 1 55 GLU QB 3.040 . 3.040 2.387 2.269 2.490 . 0 0 "[ . 1 . 2]" 1
1880 1 55 GLU H 1 57 VAL QG 4.160 . 4.160 3.519 3.389 3.673 . 0 0 "[ . 1 . 2]" 1
1881 1 55 GLU HA 1 57 VAL QG 4.600 . 4.600 4.299 4.157 4.465 . 0 0 "[ . 1 . 2]" 1
1882 1 55 GLU QB 1 56 LYS H 3.520 . 3.520 3.265 3.160 3.368 . 0 0 "[ . 1 . 2]" 1
1883 1 55 GLU QB 1 57 VAL H 4.700 . 4.700 3.484 3.203 3.993 . 0 0 "[ . 1 . 2]" 1
1884 1 55 GLU QB 1 57 VAL QG 3.230 . 3.230 2.078 1.945 2.360 . 0 0 "[ . 1 . 2]" 1
1885 1 56 LYS H 1 56 LYS QB 3.440 . 3.440 3.342 3.299 3.380 . 0 0 "[ . 1 . 2]" 1
1886 1 56 LYS H 1 56 LYS QD 3.840 . 3.840 3.086 2.410 3.424 . 0 0 "[ . 1 . 2]" 1
1887 1 56 LYS H 1 57 VAL QG 3.960 . 3.960 3.495 3.370 3.620 . 0 0 "[ . 1 . 2]" 1
1888 1 56 LYS HA 1 56 LYS QD 3.500 . 3.500 2.126 1.973 3.323 . 0 0 "[ . 1 . 2]" 1
1889 1 56 LYS HA 1 57 VAL QG 4.490 . 4.490 4.141 4.006 4.268 . 0 0 "[ . 1 . 2]" 1
1890 1 56 LYS QB 1 57 VAL H 4.260 . 4.260 3.895 3.871 3.926 . 0 0 "[ . 1 . 2]" 1
1891 1 57 VAL H 1 57 VAL QG 2.840 . 2.840 2.063 1.898 2.269 . 0 0 "[ . 1 . 2]" 1
1892 1 57 VAL HA 1 57 VAL QG 2.980 . 2.980 2.130 2.104 2.142 . 0 0 "[ . 1 . 2]" 1
1893 1 57 VAL QG 1 58 LEU H 2.990 . 2.990 2.616 2.265 2.784 . 0 0 "[ . 1 . 2]" 1
1894 1 57 VAL QG 1 58 LEU HA 4.040 . 4.040 3.442 3.310 3.612 . 0 0 "[ . 1 . 2]" 1
1895 1 57 VAL QG 1 61 ASP H 4.640 . 4.640 4.052 3.872 4.339 . 0 0 "[ . 1 . 2]" 1
1896 1 57 VAL QG 1 61 ASP HB2 3.340 . 3.340 2.665 2.206 3.467 0.127 14 0 "[ . 1 . 2]" 1
1897 1 57 VAL QG 1 61 ASP HB3 5.220 . 5.220 2.881 2.473 3.638 . 0 0 "[ . 1 . 2]" 1
1898 1 57 VAL QG 1 63 ILE H 4.700 . 4.700 4.542 4.388 4.628 . 0 0 "[ . 1 . 2]" 1
1899 1 57 VAL QG 1 63 ILE HA 5.190 . 5.190 4.425 4.335 4.506 . 0 0 "[ . 1 . 2]" 1
1900 1 57 VAL QG 1 63 ILE HB 4.020 . 4.020 3.255 2.984 3.411 . 0 0 "[ . 1 . 2]" 1
1901 1 57 VAL QG 1 64 SER H 5.540 . 5.540 5.063 4.762 5.240 . 0 0 "[ . 1 . 2]" 1
1902 1 57 VAL QG 1 74 LYS HB2 4.210 . 4.210 3.140 2.783 3.543 . 0 0 "[ . 1 . 2]" 1
1903 1 58 LEU H 1 58 LEU QD 3.700 . 3.700 3.232 2.594 3.574 . 0 0 "[ . 1 . 2]" 1
1904 1 58 LEU HA 1 58 LEU QD 3.470 . 3.470 2.652 2.011 3.416 . 0 0 "[ . 1 . 2]" 1
1905 1 58 LEU QD 1 59 ALA H 3.230 . 3.230 3.219 3.061 3.285 0.055 14 0 "[ . 1 . 2]" 1
1906 1 59 ALA HA 1 60 GLY QA 4.600 . 4.600 3.937 3.905 3.957 . 0 0 "[ . 1 . 2]" 1
1907 1 59 ALA MB 1 60 GLY QA 4.700 . 4.700 3.746 3.693 3.795 . 0 0 "[ . 1 . 2]" 1
1908 1 61 ASP HA 1 62 VAL QG 4.210 . 4.210 3.471 3.160 3.657 . 0 0 "[ . 1 . 2]" 1
1909 1 61 ASP HB2 1 62 VAL QG 5.400 . 5.400 5.127 4.963 5.372 . 0 0 "[ . 1 . 2]" 1
1910 1 61 ASP HB3 1 62 VAL QG 4.600 . 4.600 4.464 4.099 4.720 0.120 5 0 "[ . 1 . 2]" 1
1911 1 62 VAL H 1 62 VAL QG 3.190 . 3.190 2.557 1.991 2.788 . 0 0 "[ . 1 . 2]" 1
1912 1 62 VAL H 1 74 LYS QG 5.300 . 5.300 3.751 3.051 4.393 . 0 0 "[ . 1 . 2]" 1
1913 1 62 VAL QG 1 63 ILE H 3.250 . 3.250 2.560 2.422 2.704 . 0 0 "[ . 1 . 2]" 1
1914 1 62 VAL QG 1 63 ILE HA 4.130 . 4.130 3.422 3.140 3.570 . 0 0 "[ . 1 . 2]" 1
1915 1 62 VAL QG 1 75 LEU H 4.330 . 4.330 3.468 2.296 3.758 . 0 0 "[ . 1 . 2]" 1
1916 1 62 VAL QG 1 75 LEU HA 5.420 . 5.420 4.800 4.032 5.085 . 0 0 "[ . 1 . 2]" 1
1917 1 62 VAL QG 1 75 LEU HB2 3.620 . 3.620 2.425 2.183 2.669 . 0 0 "[ . 1 . 2]" 1
1918 1 62 VAL QG 1 75 LEU HG 3.900 . 3.900 3.529 3.225 4.016 0.116 11 0 "[ . 1 . 2]" 1
1919 1 62 VAL QG 1 76 GLY H 4.570 . 4.570 3.176 1.966 4.716 0.146 15 0 "[ . 1 . 2]" 1
1920 1 62 VAL QG 1 76 GLY QA 3.890 . 3.890 3.590 2.372 4.031 0.141 18 0 "[ . 1 . 2]" 1
1921 1 62 VAL QG 1 77 ARG H 4.250 . 4.250 3.160 1.890 4.063 . 0 0 "[ . 1 . 2]" 1
1922 1 62 VAL QG 1 77 ARG HA 3.830 . 3.830 2.903 1.812 3.985 0.155 15 0 "[ . 1 . 2]" 1
1923 1 62 VAL QG 1 77 ARG QD 5.110 . 5.110 4.535 1.963 5.342 0.232 2 0 "[ . 1 . 2]" 1
1924 1 62 VAL QG 1 78 SER H 4.190 . 4.190 2.538 1.557 4.058 . 0 0 "[ . 1 . 2]" 1
1925 1 62 VAL QG 1 78 SER HA 3.830 . 3.830 3.012 1.813 3.936 0.106 17 0 "[ . 1 . 2]" 1
1926 1 62 VAL QG 1 78 SER QB 4.700 . 4.700 3.141 1.782 4.639 . 0 0 "[ . 1 . 2]" 1
1927 1 62 VAL QG 1 79 PHE H 4.680 . 4.680 3.756 2.386 4.627 . 0 0 "[ . 1 . 2]" 1
1928 1 62 VAL QG 1 79 PHE QD 4.670 . 4.670 3.360 2.083 4.658 . 0 0 "[ . 1 . 2]" 1
1929 1 63 ILE HA 1 74 LYS QG 3.920 . 3.920 3.615 3.403 3.924 0.004 5 0 "[ . 1 . 2]" 1
1930 1 64 SER H 1 74 LYS QG 5.810 . 5.810 5.272 5.098 5.565 . 0 0 "[ . 1 . 2]" 1
1931 1 64 SER QB 1 65 ILE H 3.630 . 3.630 3.106 2.872 3.528 . 0 0 "[ . 1 . 2]" 1
1932 1 64 SER QB 1 73 THR H 4.450 . 4.450 4.065 3.285 4.279 . 0 0 "[ . 1 . 2]" 1
1933 1 64 SER QB 1 73 THR HB 4.180 . 4.180 3.612 2.350 3.947 . 0 0 "[ . 1 . 2]" 1
1934 1 64 SER QB 1 73 THR MG 4.630 . 4.630 4.480 3.641 4.661 0.031 16 0 "[ . 1 . 2]" 1
1935 1 64 SER QB 1 75 LEU HG 4.740 . 4.740 3.860 3.477 4.068 . 0 0 "[ . 1 . 2]" 1
1936 1 64 SER QB 1 75 LEU QD 3.660 . 3.660 1.968 1.833 2.094 . 0 0 "[ . 1 . 2]" 1
1937 1 65 ILE MG 1 66 ASP QB 4.470 . 4.470 4.024 3.942 4.088 . 0 0 "[ . 1 . 2]" 1
1938 1 65 ILE MG 1 67 LYS QB 5.760 . 5.760 4.754 4.593 4.957 . 0 0 "[ . 1 . 2]" 1
1939 1 66 ASP H 1 66 ASP QB 3.230 . 3.230 2.296 2.259 2.326 . 0 0 "[ . 1 . 2]" 1
1940 1 66 ASP QB 1 67 LYS H 4.090 . 4.090 3.893 3.528 3.937 . 0 0 "[ . 1 . 2]" 1
1941 1 66 ASP QB 1 68 ALA H 4.630 . 4.630 3.976 2.992 4.183 . 0 0 "[ . 1 . 2]" 1
1942 1 66 ASP QB 1 69 SER H 3.940 . 3.940 3.120 2.175 3.332 . 0 0 "[ . 1 . 2]" 1
1943 1 66 ASP QB 1 70 GLY H 4.060 . 4.060 2.835 2.344 3.174 . 0 0 "[ . 1 . 2]" 1
1944 1 66 ASP QB 1 71 LYS HB3 4.860 . 4.860 2.649 2.200 2.983 . 0 0 "[ . 1 . 2]" 1
1945 1 66 ASP QB 1 71 LYS HB2 4.170 . 4.170 3.882 3.055 4.222 0.052 1 0 "[ . 1 . 2]" 1
1946 1 66 ASP QB 1 71 LYS QD 5.470 . 5.470 2.817 1.791 4.835 . 0 0 "[ . 1 . 2]" 1
1947 1 67 LYS H 1 67 LYS QB 3.160 . 3.160 2.423 2.334 2.482 . 0 0 "[ . 1 . 2]" 1
1948 1 67 LYS QB 1 68 ALA H 3.450 . 3.450 2.846 2.731 3.003 . 0 0 "[ . 1 . 2]" 1
1949 1 67 LYS QB 1 69 SER H 5.650 . 5.650 5.109 4.972 5.239 . 0 0 "[ . 1 . 2]" 1
1950 1 68 ALA MB 1 69 SER QB 3.780 . 3.780 3.584 3.287 3.895 0.115 4 0 "[ . 1 . 2]" 1
1951 1 69 SER H 1 69 SER QB 3.330 . 3.330 2.523 2.275 2.902 . 0 0 "[ . 1 . 2]" 1
1952 1 69 SER QB 1 70 GLY H 4.080 . 4.080 3.159 2.841 3.684 . 0 0 "[ . 1 . 2]" 1
1953 1 69 SER QB 1 71 LYS H 4.280 . 4.280 2.815 2.386 3.540 . 0 0 "[ . 1 . 2]" 1
1954 1 69 SER QB 1 71 LYS HB2 5.080 . 5.080 3.522 2.668 4.184 . 0 0 "[ . 1 . 2]" 1
1955 1 71 LYS H 1 71 LYS QG 4.220 . 4.220 3.880 3.765 4.068 . 0 0 "[ . 1 . 2]" 1
1956 1 71 LYS HA 1 71 LYS QG 3.360 . 3.360 2.813 2.481 2.971 . 0 0 "[ . 1 . 2]" 1
1957 1 71 LYS QE 1 71 LYS QG 3.220 . 3.220 2.130 2.089 2.308 . 0 0 "[ . 1 . 2]" 1
1958 1 71 LYS QG 1 72 ILE H 3.620 . 3.620 2.770 2.648 2.950 . 0 0 "[ . 1 . 2]" 1
1959 1 74 LYS H 1 74 LYS QG 4.440 . 4.440 3.993 3.959 4.029 . 0 0 "[ . 1 . 2]" 1
1960 1 74 LYS HA 1 74 LYS QG 3.390 . 3.390 2.428 2.330 2.565 . 0 0 "[ . 1 . 2]" 1
1961 1 74 LYS QG 1 75 LEU H 3.320 . 3.320 2.777 2.583 3.107 . 0 0 "[ . 1 . 2]" 1
1962 1 74 LYS QG 1 76 GLY H 4.650 . 4.650 3.050 2.655 3.680 . 0 0 "[ . 1 . 2]" 1
1963 1 74 LYS QG 1 76 GLY QA 3.840 . 3.840 3.161 2.713 3.729 . 0 0 "[ . 1 . 2]" 1
1964 1 76 GLY QA 1 77 ARG H 3.000 . 3.000 2.496 2.175 2.972 . 0 0 "[ . 1 . 2]" 1
1965 1 77 ARG H 1 77 ARG QB 3.620 . 3.620 2.740 2.202 3.393 . 0 0 "[ . 1 . 2]" 1
1966 1 77 ARG H 1 77 ARG QD 5.190 . 5.190 4.300 2.236 4.877 . 0 0 "[ . 1 . 2]" 1
1967 1 77 ARG QB 1 78 SER H 3.780 . 3.780 2.822 1.931 3.858 0.078 11 0 "[ . 1 . 2]" 1
1968 1 77 ARG QD 1 78 SER H 5.180 . 5.180 4.235 1.649 5.267 0.087 8 0 "[ . 1 . 2]" 1
1969 1 79 PHE H 1 79 PHE QB 3.240 . 3.240 2.700 2.280 3.311 0.071 3 0 "[ . 1 . 2]" 1
1970 1 79 PHE QB 1 80 ALA MB 4.270 . 4.270 3.863 3.227 4.361 0.091 15 0 "[ . 1 . 2]" 1
1971 1 79 PHE QB 1 81 ARG H 5.300 . 5.300 4.495 2.548 5.400 0.100 6 0 "[ . 1 . 2]" 1
1972 1 81 ARG H 1 81 ARG QB 3.160 . 3.160 2.642 2.332 3.274 0.114 4 0 "[ . 1 . 2]" 1
1973 1 81 ARG QB 1 82 SER H 4.050 . 4.050 3.129 1.852 3.902 . 0 0 "[ . 1 . 2]" 1
1974 1 83 ARG H 1 83 ARG QB 3.240 . 3.240 2.575 2.178 3.247 0.007 4 0 "[ . 1 . 2]" 1
1975 1 83 ARG QB 1 84 ASP H 3.610 . 3.610 2.799 1.976 3.622 0.012 7 0 "[ . 1 . 2]" 1
1976 1 83 ARG QB 1 85 TYR H 4.610 . 4.610 2.906 2.211 4.567 . 0 0 "[ . 1 . 2]" 1
1977 1 84 ASP H 1 84 ASP QB 3.130 . 3.130 2.706 2.309 3.202 0.072 20 0 "[ . 1 . 2]" 1
1978 1 84 ASP H 1 85 TYR QB 4.880 . 4.880 4.041 3.245 4.986 0.106 3 0 "[ . 1 . 2]" 1
1979 1 84 ASP QB 1 85 TYR H 4.040 . 4.040 3.812 3.419 4.040 . 0 0 "[ . 1 . 2]" 1
1980 1 85 TYR H 1 85 TYR QB 2.920 . 2.920 2.557 2.208 3.024 0.104 13 0 "[ . 1 . 2]" 1
1981 1 85 TYR QB 1 86 ASP H 3.610 . 3.610 2.871 1.696 3.856 0.246 1 0 "[ . 1 . 2]" 1
1982 1 87 ALA H 1 88 MET QG 4.510 . 4.510 3.382 2.485 4.102 . 0 0 "[ . 1 . 2]" 1
1983 1 87 ALA MB 1 88 MET QG 4.990 . 4.990 4.442 3.733 4.909 . 0 0 "[ . 1 . 2]" 1
1984 1 88 MET H 1 88 MET QB 3.020 . 3.020 2.614 2.337 3.083 0.063 5 0 "[ . 1 . 2]" 1
1985 1 88 MET H 1 88 MET QG 3.360 . 3.360 2.341 1.968 2.898 . 0 0 "[ . 1 . 2]" 1
1986 1 88 MET QB 1 89 GLY H 3.840 . 3.840 3.338 2.354 3.995 0.155 5 0 "[ . 1 . 2]" 1
1987 1 88 MET ME 1 88 MET QG 3.300 . 3.300 2.373 2.205 2.463 . 0 0 "[ . 1 . 2]" 1
1988 1 88 MET QG 1 89 GLY H 4.790 . 4.790 4.141 3.222 4.535 . 0 0 "[ . 1 . 2]" 1
1989 1 91 ASP H 1 91 ASP QB 3.110 . 3.110 2.480 2.214 2.762 . 0 0 "[ . 1 . 2]" 1
1990 1 91 ASP QB 1 92 THR H 4.160 . 4.160 3.819 2.838 4.042 . 0 0 "[ . 1 . 2]" 1
1991 1 94 PHE H 1 94 PHE QB 3.140 . 3.140 2.522 2.290 2.692 . 0 0 "[ . 1 . 2]" 1
1992 1 94 PHE HA 1 95 VAL QG 4.380 . 4.380 3.755 2.716 4.469 0.089 10 0 "[ . 1 . 2]" 1
1993 1 94 PHE QB 1 95 VAL H 4.030 . 4.030 3.776 3.555 3.898 . 0 0 "[ . 1 . 2]" 1
1994 1 95 VAL H 1 95 VAL QG 3.230 . 3.230 2.327 1.756 3.042 . 0 0 "[ . 1 . 2]" 1
1995 1 95 VAL HA 1 95 VAL QG 3.070 . 3.070 2.197 2.104 2.304 . 0 0 "[ . 1 . 2]" 1
1996 1 95 VAL QG 1 96 GLN H 3.960 . 3.960 3.352 2.308 3.761 . 0 0 "[ . 1 . 2]" 1
1997 1 96 GLN H 1 96 GLN QB 2.990 . 2.990 2.446 2.238 2.969 . 0 0 "[ . 1 . 2]" 1
1998 1 97 CYS H 1 97 CYS QB 3.400 . 3.400 2.679 2.240 3.258 . 0 0 "[ . 1 . 2]" 1
1999 1 98 PRO QB 1 99 GLU H 3.990 . 3.990 3.518 2.498 3.992 0.002 10 0 "[ . 1 . 2]" 1
2000 1 98 PRO QB 1 100 GLY H 5.480 . 5.480 3.996 2.232 5.502 0.022 3 0 "[ . 1 . 2]" 1
2001 1 99 GLU H 1 99 GLU QB 2.990 . 2.990 2.520 2.241 3.091 0.101 19 0 "[ . 1 . 2]" 1
2002 1 99 GLU QB 1 100 GLY H 4.340 . 4.340 3.841 2.322 4.042 . 0 0 "[ . 1 . 2]" 1
2003 1 100 GLY H 1 101 GLU QB 5.810 . 5.810 4.647 3.468 5.476 . 0 0 "[ . 1 . 2]" 1
2004 1 101 GLU H 1 101 GLU QB 3.070 . 3.070 2.547 2.247 2.974 . 0 0 "[ . 1 . 2]" 1
2005 1 102 LEU H 1 102 LEU QB 3.430 . 3.430 2.510 2.208 3.104 . 0 0 "[ . 1 . 2]" 1
2006 1 102 LEU HA 1 102 LEU QD 3.740 . 3.740 2.494 1.881 3.393 . 0 0 "[ . 1 . 2]" 1
2007 1 102 LEU QB 1 103 GLN H 3.930 . 3.930 3.662 2.789 4.004 0.074 16 0 "[ . 1 . 2]" 1
2008 1 102 LEU QD 1 103 GLN H 4.720 . 4.720 3.628 2.769 4.503 . 0 0 "[ . 1 . 2]" 1
2009 1 103 GLN H 1 103 GLN QB 3.210 . 3.210 2.538 2.248 3.164 . 0 0 "[ . 1 . 2]" 1
2010 1 104 LYS H 1 104 LYS QB 3.560 . 3.560 2.689 2.287 3.404 . 0 0 "[ . 1 . 2]" 1
2011 1 105 ARG H 1 105 ARG QB 3.300 . 3.300 2.738 2.212 3.352 0.052 5 0 "[ . 1 . 2]" 1
2012 1 105 ARG QB 1 105 ARG QD 3.470 . 3.470 2.273 2.096 2.393 . 0 0 "[ . 1 . 2]" 1
2013 1 105 ARG QB 1 106 LYS H 4.220 . 4.220 3.436 1.775 4.044 . 0 0 "[ . 1 . 2]" 1
2014 1 106 LYS QB 1 107 THR H 4.380 . 4.380 3.509 2.292 4.048 . 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 12
_Distance_constraint_stats_list.Viol_count 0
_Distance_constraint_stats_list.Viol_total 0.000
_Distance_constraint_stats_list.Viol_max 0.000
_Distance_constraint_stats_list.Viol_rms 0.0000
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0000
_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 9 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 ILE 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 14 VAL H 1 32 THR O 2.400 . 4.000 1.839 1.710 1.993 . 0 0 "[ . 1 . 2]" 2
2 1 15 GLU H 1 32 THR O 2.400 . 4.000 2.358 2.278 2.428 . 0 0 "[ . 1 . 2]" 2
3 1 11 GLY O 1 63 ILE H 2.400 . 4.000 2.435 2.207 2.647 . 0 0 "[ . 1 . 2]" 2
4 1 52 LEU O 1 57 VAL H 2.400 . 4.000 1.905 1.790 2.003 . 0 0 "[ . 1 . 2]" 2
5 1 9 ILE H 1 65 ILE O 2.400 . 4.000 2.066 1.921 2.314 . 0 0 "[ . 1 . 2]" 2
6 1 13 VAL H 1 61 ASP O 2.400 . 4.000 1.819 1.706 2.001 . 0 0 "[ . 1 . 2]" 2
7 1 14 VAL N 1 32 THR O 3.300 . 5.800 2.790 2.641 2.961 . 0 0 "[ . 1 . 2]" 2
8 1 15 GLU N 1 32 THR O 3.300 . 5.800 3.298 3.218 3.375 . 0 0 "[ . 1 . 2]" 2
9 1 11 GLY O 1 63 ILE N 3.300 . 5.800 3.342 3.133 3.582 . 0 0 "[ . 1 . 2]" 2
10 1 52 LEU O 1 57 VAL N 3.300 . 5.800 2.872 2.755 2.964 . 0 0 "[ . 1 . 2]" 2
11 1 9 ILE N 1 65 ILE O 3.300 . 5.800 3.016 2.878 3.246 . 0 0 "[ . 1 . 2]" 2
12 1 13 VAL N 1 61 ASP O 3.300 . 5.800 2.775 2.629 2.969 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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