NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
419646 |
2ed8   |
11103 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ed8
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 2403
_Distance_constraint_stats_list.Viol_count 1629
_Distance_constraint_stats_list.Viol_total 663.059
_Distance_constraint_stats_list.Viol_max 0.190
_Distance_constraint_stats_list.Viol_rms 0.0057
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0007
_Distance_constraint_stats_list.Viol_average_violations_only 0.0204
_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 5 SER 0.067 0.022 14 0 "[ . 1 . 2]"
1 6 SER 0.494 0.172 20 0 "[ . 1 . 2]"
1 7 GLY 0.476 0.172 20 0 "[ . 1 . 2]"
1 8 PRO 0.217 0.038 17 0 "[ . 1 . 2]"
1 9 GLY 0.257 0.055 6 0 "[ . 1 . 2]"
1 10 PRO 0.252 0.085 6 0 "[ . 1 . 2]"
1 11 VAL 0.716 0.067 17 0 "[ . 1 . 2]"
1 12 GLU 0.777 0.058 7 0 "[ . 1 . 2]"
1 13 ASN 0.246 0.050 7 0 "[ . 1 . 2]"
1 14 LEU 0.540 0.039 15 0 "[ . 1 . 2]"
1 15 GLN 0.264 0.042 11 0 "[ . 1 . 2]"
1 16 ALA 1.827 0.190 14 0 "[ . 1 . 2]"
1 17 VAL 1.513 0.190 14 0 "[ . 1 . 2]"
1 18 SER 3.004 0.094 18 0 "[ . 1 . 2]"
1 19 THR 0.443 0.047 12 0 "[ . 1 . 2]"
1 20 SER 1.403 0.137 3 0 "[ . 1 . 2]"
1 21 PRO 3.228 0.126 18 0 "[ . 1 . 2]"
1 22 THR 2.650 0.137 3 0 "[ . 1 . 2]"
1 23 SER 1.874 0.092 20 0 "[ . 1 . 2]"
1 24 ILE 3.124 0.094 18 0 "[ . 1 . 2]"
1 25 LEU 1.386 0.061 10 0 "[ . 1 . 2]"
1 26 ILE 1.278 0.062 12 0 "[ . 1 . 2]"
1 27 THR 0.693 0.084 11 0 "[ . 1 . 2]"
1 28 TRP 0.897 0.084 11 0 "[ . 1 . 2]"
1 29 GLU 0.238 0.057 20 0 "[ . 1 . 2]"
1 30 PRO 0.508 0.090 7 0 "[ . 1 . 2]"
1 31 PRO 0.429 0.067 17 0 "[ . 1 . 2]"
1 32 ALA 0.391 0.051 11 0 "[ . 1 . 2]"
1 33 TYR 0.198 0.050 17 0 "[ . 1 . 2]"
1 34 ALA 0.136 0.025 10 0 "[ . 1 . 2]"
1 35 ASN 0.149 0.041 8 0 "[ . 1 . 2]"
1 36 GLY 0.025 0.011 19 0 "[ . 1 . 2]"
1 37 PRO 0.014 0.005 2 0 "[ . 1 . 2]"
1 38 VAL 0.086 0.031 6 0 "[ . 1 . 2]"
1 39 GLN 0.174 0.031 6 0 "[ . 1 . 2]"
1 40 GLY 0.132 0.015 5 0 "[ . 1 . 2]"
1 41 TYR 0.147 0.025 8 0 "[ . 1 . 2]"
1 42 ARG 0.286 0.058 19 0 "[ . 1 . 2]"
1 43 LEU 0.226 0.019 16 0 "[ . 1 . 2]"
1 44 PHE 0.295 0.045 19 0 "[ . 1 . 2]"
1 45 CYS 0.236 0.031 19 0 "[ . 1 . 2]"
1 46 THR 0.395 0.034 19 0 "[ . 1 . 2]"
1 47 GLU 0.999 0.120 11 0 "[ . 1 . 2]"
1 48 VAL 0.817 0.089 1 0 "[ . 1 . 2]"
1 49 SER 0.115 0.029 1 0 "[ . 1 . 2]"
1 50 THR 1.145 0.101 9 0 "[ . 1 . 2]"
1 51 GLY 0.148 0.029 1 0 "[ . 1 . 2]"
1 52 LYS 1.114 0.101 9 0 "[ . 1 . 2]"
1 53 GLU 0.261 0.054 3 0 "[ . 1 . 2]"
1 54 GLN 0.273 0.031 19 0 "[ . 1 . 2]"
1 55 ASN 0.143 0.018 14 0 "[ . 1 . 2]"
1 56 ILE 1.726 0.089 2 0 "[ . 1 . 2]"
1 57 GLU 1.519 0.089 2 0 "[ . 1 . 2]"
1 58 VAL 0.178 0.019 3 0 "[ . 1 . 2]"
1 59 ASP 0.109 0.015 5 0 "[ . 1 . 2]"
1 60 GLY 0.079 0.079 11 0 "[ . 1 . 2]"
1 61 LEU 0.575 0.090 7 0 "[ . 1 . 2]"
1 62 SER 0.127 0.019 2 0 "[ . 1 . 2]"
1 63 TYR 0.816 0.041 19 0 "[ . 1 . 2]"
1 64 LYS 0.413 0.052 5 0 "[ . 1 . 2]"
1 65 LEU 1.533 0.073 15 0 "[ . 1 . 2]"
1 66 GLU 1.879 0.092 20 0 "[ . 1 . 2]"
1 67 GLY 1.454 0.061 13 0 "[ . 1 . 2]"
1 68 LEU 2.998 0.091 13 0 "[ . 1 . 2]"
1 69 LYS 0.179 0.054 20 0 "[ . 1 . 2]"
1 70 LYS 1.979 0.126 18 0 "[ . 1 . 2]"
1 71 PHE 1.128 0.087 13 0 "[ . 1 . 2]"
1 72 THR 0.322 0.054 20 0 "[ . 1 . 2]"
1 73 GLU 0.074 0.023 20 0 "[ . 1 . 2]"
1 74 TYR 1.428 0.120 11 0 "[ . 1 . 2]"
1 75 SER 0.233 0.035 4 0 "[ . 1 . 2]"
1 76 LEU 0.347 0.045 19 0 "[ . 1 . 2]"
1 77 ARG 0.121 0.033 6 0 "[ . 1 . 2]"
1 78 PHE 0.283 0.045 17 0 "[ . 1 . 2]"
1 79 LEU 0.194 0.028 17 0 "[ . 1 . 2]"
1 80 ALA 0.040 0.019 8 0 "[ . 1 . 2]"
1 81 TYR 0.344 0.058 19 0 "[ . 1 . 2]"
1 82 ASN 0.148 0.038 17 0 "[ . 1 . 2]"
1 83 ARG 0.068 0.022 14 0 "[ . 1 . 2]"
1 84 TYR 0.260 0.022 14 0 "[ . 1 . 2]"
1 85 GLY 0.028 0.021 19 0 "[ . 1 . 2]"
1 86 PRO 0.046 0.008 19 0 "[ . 1 . 2]"
1 87 GLY 0.111 0.020 19 0 "[ . 1 . 2]"
1 88 VAL 0.334 0.085 6 0 "[ . 1 . 2]"
1 89 SER 0.070 0.028 17 0 "[ . 1 . 2]"
1 90 THR 0.156 0.017 16 0 "[ . 1 . 2]"
1 91 ASP 0.102 0.073 9 0 "[ . 1 . 2]"
1 92 ASP 0.165 0.073 9 0 "[ . 1 . 2]"
1 93 ILE 0.119 0.014 3 0 "[ . 1 . 2]"
1 94 THR 0.077 0.013 5 0 "[ . 1 . 2]"
1 95 VAL 0.353 0.043 1 0 "[ . 1 . 2]"
1 96 VAL 1.085 0.060 8 0 "[ . 1 . 2]"
1 97 THR 1.074 0.087 13 0 "[ . 1 . 2]"
1 98 LEU 2.719 0.098 17 0 "[ . 1 . 2]"
1 99 SER 0.822 0.117 13 0 "[ . 1 . 2]"
1 100 ASP 0.578 0.117 13 0 "[ . 1 . 2]"
1 102 GLY 0.057 0.051 6 0 "[ . 1 . 2]"
1 103 PRO 0.057 0.051 6 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 76 LEU H 1 93 ILE H . . 3.580 3.275 3.054 3.474 . 0 0 "[ . 1 . 2]" 1
2 1 75 SER HA 1 76 LEU H . . 2.810 2.146 2.138 2.160 . 0 0 "[ . 1 . 2]" 1
3 1 76 LEU H 1 94 THR HA . . 3.910 3.691 3.483 3.763 . 0 0 "[ . 1 . 2]" 1
4 1 76 LEU H 1 93 ILE HB . . 3.840 3.068 2.843 3.462 . 0 0 "[ . 1 . 2]" 1
5 1 76 LEU H 1 76 LEU HB3 . . 4.030 3.714 3.674 3.750 . 0 0 "[ . 1 . 2]" 1
6 1 76 LEU H 1 93 ILE HG13 . . 5.500 4.989 4.833 5.162 . 0 0 "[ . 1 . 2]" 1
7 1 76 LEU H 1 92 ASP HA . . 4.880 4.606 4.400 4.800 . 0 0 "[ . 1 . 2]" 1
8 1 75 SER QB 1 76 LEU H . . 3.970 3.697 3.345 3.937 . 0 0 "[ . 1 . 2]" 1
9 1 76 LEU H 1 76 LEU HB2 . . 3.560 2.698 2.598 2.798 . 0 0 "[ . 1 . 2]" 1
10 1 81 TYR H 1 81 TYR QD . . 3.550 3.282 3.102 3.419 . 0 0 "[ . 1 . 2]" 1
11 1 41 TYR HB3 1 81 TYR H . . 5.500 5.434 5.253 5.510 0.010 1 0 "[ . 1 . 2]" 1
12 1 81 TYR H 1 86 PRO QB . . 5.500 5.401 5.157 5.507 0.007 2 0 "[ . 1 . 2]" 1
13 1 80 ALA MB 1 81 TYR H . . 3.330 2.897 2.736 3.008 . 0 0 "[ . 1 . 2]" 1
14 1 79 LEU MD1 1 81 TYR H . . 4.420 3.629 3.479 3.793 . 0 0 "[ . 1 . 2]" 1
15 1 38 VAL MG1 1 81 TYR H . . 3.750 2.923 2.650 3.191 . 0 0 "[ . 1 . 2]" 1
16 1 42 ARG H 1 81 TYR H . . 5.080 4.750 4.539 5.088 0.008 11 0 "[ . 1 . 2]" 1
17 1 81 TYR H 1 82 ASN H . . 4.480 4.253 4.179 4.351 . 0 0 "[ . 1 . 2]" 1
18 1 80 ALA H 1 81 TYR H . . 4.850 4.534 4.493 4.578 . 0 0 "[ . 1 . 2]" 1
19 1 81 TYR H 1 86 PRO HA . . 4.930 4.427 4.262 4.531 . 0 0 "[ . 1 . 2]" 1
20 1 38 VAL HA 1 81 TYR H . . 5.140 4.656 4.486 4.778 . 0 0 "[ . 1 . 2]" 1
21 1 81 TYR H 1 81 TYR HB3 . . 4.190 3.194 3.043 3.279 . 0 0 "[ . 1 . 2]" 1
22 1 41 TYR QD 1 81 TYR H . . 4.770 4.451 4.237 4.624 . 0 0 "[ . 1 . 2]" 1
23 1 81 TYR H 1 81 TYR HB2 . . 4.160 3.929 3.871 3.971 . 0 0 "[ . 1 . 2]" 1
24 1 20 SER H 1 23 SER H . . 4.520 4.437 4.277 4.548 0.028 7 0 "[ . 1 . 2]" 1
25 1 22 THR HB 1 23 SER H . . 4.690 3.985 3.961 4.004 . 0 0 "[ . 1 . 2]" 1
26 1 23 SER H 1 97 THR HA . . 5.230 4.212 4.030 4.327 . 0 0 "[ . 1 . 2]" 1
27 1 18 SER HG 1 23 SER H . . 3.890 2.140 2.013 2.274 . 0 0 "[ . 1 . 2]" 1
28 1 18 SER HB3 1 23 SER H . . 5.500 4.641 4.454 4.903 . 0 0 "[ . 1 . 2]" 1
29 1 23 SER H 1 98 LEU HG . . 5.490 4.944 4.771 5.137 . 0 0 "[ . 1 . 2]" 1
30 1 23 SER H 1 97 THR MG . . 3.910 2.196 2.061 2.325 . 0 0 "[ . 1 . 2]" 1
31 1 23 SER H 1 68 LEU HB2 . . 3.780 3.501 3.411 3.575 . 0 0 "[ . 1 . 2]" 1
32 1 23 SER H 1 24 ILE HG13 . . 5.070 3.721 3.642 3.803 . 0 0 "[ . 1 . 2]" 1
33 1 23 SER H 1 68 LEU MD1 . . 4.350 2.741 2.648 2.878 . 0 0 "[ . 1 . 2]" 1
34 1 23 SER H 1 65 LEU HB3 . . 5.500 5.445 5.350 5.533 0.033 16 0 "[ . 1 . 2]" 1
35 1 15 GLN H 1 28 TRP HB2 . . 5.310 5.213 5.006 5.316 0.006 3 0 "[ . 1 . 2]" 1
36 1 15 GLN H 1 15 GLN HB3 . . 4.150 3.827 3.766 3.873 . 0 0 "[ . 1 . 2]" 1
37 1 15 GLN H 1 16 ALA MB . . 4.750 4.553 4.407 4.667 . 0 0 "[ . 1 . 2]" 1
38 1 14 LEU MD2 1 15 GLN H . . 4.620 4.523 4.389 4.628 0.008 17 0 "[ . 1 . 2]" 1
39 1 15 GLN H 1 26 ILE MG . . 4.340 3.729 3.582 3.955 . 0 0 "[ . 1 . 2]" 1
40 1 73 GLU HA 1 96 VAL H . . 4.420 4.254 4.136 4.443 0.023 20 0 "[ . 1 . 2]" 1
41 1 95 VAL HA 1 96 VAL H . . 2.550 2.158 2.143 2.164 . 0 0 "[ . 1 . 2]" 1
42 1 96 VAL H 1 96 VAL HB . . 2.900 2.560 2.529 2.614 . 0 0 "[ . 1 . 2]" 1
43 1 94 THR MG 1 96 VAL H . . 4.690 3.848 3.724 4.058 . 0 0 "[ . 1 . 2]" 1
44 1 96 VAL H 1 96 VAL MG2 . . 3.940 2.302 2.133 2.410 . 0 0 "[ . 1 . 2]" 1
45 1 49 SER H 1 49 SER QB . . 2.960 2.226 2.135 2.389 . 0 0 "[ . 1 . 2]" 1
46 1 48 VAL HB 1 49 SER H . . 3.370 2.814 2.621 3.118 . 0 0 "[ . 1 . 2]" 1
47 1 48 VAL MG1 1 49 SER H . . 4.410 3.636 3.480 3.843 . 0 0 "[ . 1 . 2]" 1
48 1 48 VAL MG2 1 49 SER H . . 4.410 3.867 3.806 3.979 . 0 0 "[ . 1 . 2]" 1
49 1 15 GLN H 1 26 ILE HA . . 4.670 4.470 4.301 4.591 . 0 0 "[ . 1 . 2]" 1
50 1 11 VAL MG2 1 15 GLN H . . 5.500 5.470 5.371 5.542 0.042 11 0 "[ . 1 . 2]" 1
51 1 15 GLN H 1 28 TRP HB3 . . 4.440 4.236 4.006 4.393 . 0 0 "[ . 1 . 2]" 1
52 1 15 GLN H 1 15 GLN HB2 . . 3.520 2.820 2.729 2.894 . 0 0 "[ . 1 . 2]" 1
53 1 14 LEU HB3 1 15 GLN H . . 4.550 4.332 4.264 4.395 . 0 0 "[ . 1 . 2]" 1
54 1 14 LEU HB2 1 15 GLN H . . 4.310 4.148 4.010 4.256 . 0 0 "[ . 1 . 2]" 1
55 1 14 LEU MD1 1 15 GLN H . . 3.550 3.114 2.834 3.388 . 0 0 "[ . 1 . 2]" 1
56 1 15 GLN H 1 15 GLN HG2 . . 4.490 4.059 3.536 4.441 . 0 0 "[ . 1 . 2]" 1
57 1 14 LEU HG 1 15 GLN H . . 3.800 2.996 2.815 3.135 . 0 0 "[ . 1 . 2]" 1
58 1 49 SER H 1 51 GLY HA2 . . 5.500 5.438 5.257 5.505 0.005 2 0 "[ . 1 . 2]" 1
59 1 74 TYR H 1 74 TYR HB3 . . 3.850 3.583 3.545 3.625 . 0 0 "[ . 1 . 2]" 1
60 1 74 TYR H 1 74 TYR HB2 . . 3.520 2.338 2.298 2.397 . 0 0 "[ . 1 . 2]" 1
61 1 74 TYR H 1 96 VAL HA . . 3.600 2.847 2.717 2.958 . 0 0 "[ . 1 . 2]" 1
62 1 73 GLU HA 1 74 TYR H . . 2.800 2.167 2.151 2.190 . 0 0 "[ . 1 . 2]" 1
63 1 6 SER QB 1 35 ASN HD22 . . 5.050 2.712 2.003 3.756 . 0 0 "[ . 1 . 2]" 1
64 1 42 ARG HE 1 57 GLU HG3 . . 4.960 4.142 3.127 4.828 . 0 0 "[ . 1 . 2]" 1
65 1 42 ARG QB 1 42 ARG HE . . 4.440 3.478 2.563 3.945 . 0 0 "[ . 1 . 2]" 1
66 1 56 ILE MD 1 57 GLU H . . 5.270 4.981 4.898 5.142 . 0 0 "[ . 1 . 2]" 1
67 1 95 VAL H 1 96 VAL H . . 4.290 4.034 3.994 4.083 . 0 0 "[ . 1 . 2]" 1
68 1 75 SER HA 1 95 VAL H . . 3.860 3.630 3.445 3.855 . 0 0 "[ . 1 . 2]" 1
69 1 94 THR HA 1 95 VAL H . . 2.650 2.147 2.142 2.157 . 0 0 "[ . 1 . 2]" 1
70 1 95 VAL H 1 96 VAL HA . . 4.960 4.628 4.585 4.677 . 0 0 "[ . 1 . 2]" 1
71 1 94 THR HB 1 95 VAL H . . 4.370 4.242 4.096 4.301 . 0 0 "[ . 1 . 2]" 1
72 1 75 SER QB 1 95 VAL H . . 5.260 5.089 4.858 5.295 0.035 4 0 "[ . 1 . 2]" 1
73 1 74 TYR HB3 1 95 VAL H . . 4.980 4.515 4.148 4.707 . 0 0 "[ . 1 . 2]" 1
74 1 73 GLU HG3 1 95 VAL H . . 4.580 4.431 4.230 4.589 0.009 11 0 "[ . 1 . 2]" 1
75 1 95 VAL H 1 95 VAL HB . . 3.380 2.737 2.687 2.804 . 0 0 "[ . 1 . 2]" 1
76 1 95 VAL H 1 95 VAL QG . . 3.260 2.855 2.744 2.944 . 0 0 "[ . 1 . 2]" 1
77 1 94 THR H 1 95 VAL H . . 4.480 4.377 4.287 4.463 . 0 0 "[ . 1 . 2]" 1
78 1 73 GLU HA 1 95 VAL H . . 4.810 4.707 4.617 4.786 . 0 0 "[ . 1 . 2]" 1
79 1 74 TYR HB2 1 95 VAL H . . 4.480 3.843 3.642 3.982 . 0 0 "[ . 1 . 2]" 1
80 1 56 ILE HA 1 57 GLU H . . 2.640 2.216 2.150 2.269 . 0 0 "[ . 1 . 2]" 1
81 1 57 GLU H 1 57 GLU HB2 . . 3.050 2.364 2.207 2.470 . 0 0 "[ . 1 . 2]" 1
82 1 56 ILE HG12 1 57 GLU H . . 4.390 4.284 4.202 4.386 . 0 0 "[ . 1 . 2]" 1
83 1 39 GLN H 1 81 TYR H . . 5.160 5.155 5.092 5.172 0.012 18 0 "[ . 1 . 2]" 1
84 1 39 GLN H 1 82 ASN HA . . 3.430 2.016 1.900 2.149 . 0 0 "[ . 1 . 2]" 1
85 1 38 VAL HA 1 39 GLN H . . 3.010 2.229 2.219 2.247 . 0 0 "[ . 1 . 2]" 1
86 1 39 GLN H 1 82 ASN HB2 . . 4.320 3.097 2.584 3.721 . 0 0 "[ . 1 . 2]" 1
87 1 39 GLN H 1 39 GLN QG . . 3.710 2.313 2.044 2.584 . 0 0 "[ . 1 . 2]" 1
88 1 38 VAL HB 1 39 GLN H . . 4.640 4.474 4.453 4.495 . 0 0 "[ . 1 . 2]" 1
89 1 39 GLN H 1 39 GLN HB2 . . 3.770 2.476 2.347 2.581 . 0 0 "[ . 1 . 2]" 1
90 1 39 GLN H 1 39 GLN HB3 . . 3.770 3.601 3.577 3.615 . 0 0 "[ . 1 . 2]" 1
91 1 39 GLN H 1 82 ASN HB3 . . 4.090 3.056 2.646 3.412 . 0 0 "[ . 1 . 2]" 1
92 1 38 VAL MG2 1 39 GLN H . . 4.220 4.208 4.179 4.251 0.031 6 0 "[ . 1 . 2]" 1
93 1 49 SER H 1 51 GLY H . . 4.370 4.281 3.891 4.399 0.029 1 0 "[ . 1 . 2]" 1
94 1 50 THR HG1 1 51 GLY H . . 4.490 2.590 1.883 3.419 . 0 0 "[ . 1 . 2]" 1
95 1 50 THR HB 1 51 GLY H . . 4.330 3.375 3.128 3.567 . 0 0 "[ . 1 . 2]" 1
96 1 49 SER QB 1 51 GLY H . . 4.830 4.453 4.200 4.638 . 0 0 "[ . 1 . 2]" 1
97 1 51 GLY H 1 51 GLY HA2 . . 2.920 2.448 2.405 2.474 . 0 0 "[ . 1 . 2]" 1
98 1 48 VAL HA 1 51 GLY H . . 4.260 4.217 4.049 4.277 0.017 11 0 "[ . 1 . 2]" 1
99 1 47 GLU HB3 1 51 GLY H . . 4.460 2.654 2.381 2.926 . 0 0 "[ . 1 . 2]" 1
100 1 50 THR MG 1 51 GLY H . . 4.000 3.857 3.775 3.998 . 0 0 "[ . 1 . 2]" 1
101 1 46 THR MG 1 51 GLY H . . 4.000 3.879 3.658 3.988 . 0 0 "[ . 1 . 2]" 1
102 1 44 PHE HB2 1 77 ARG HE . . 4.860 3.961 2.716 4.877 0.017 8 0 "[ . 1 . 2]" 1
103 1 77 ARG HB3 1 77 ARG HE . . 4.590 2.837 2.090 3.933 . 0 0 "[ . 1 . 2]" 1
104 1 73 GLU H 1 97 THR H . . 5.400 5.186 4.979 5.410 0.010 11 0 "[ . 1 . 2]" 1
105 1 73 GLU H 1 96 VAL HA . . 4.690 4.349 4.181 4.579 . 0 0 "[ . 1 . 2]" 1
106 1 73 GLU H 1 74 TYR H . . 4.540 4.337 4.279 4.389 . 0 0 "[ . 1 . 2]" 1
107 1 72 THR HA 1 73 GLU H . . 2.660 2.150 2.142 2.200 . 0 0 "[ . 1 . 2]" 1
108 1 72 THR HB 1 73 GLU H . . 4.350 4.265 4.042 4.361 0.011 10 0 "[ . 1 . 2]" 1
109 1 73 GLU H 1 73 GLU HB2 . . 3.160 2.506 2.313 2.626 . 0 0 "[ . 1 . 2]" 1
110 1 73 GLU H 1 73 GLU HB3 . . 3.160 2.547 2.424 2.757 . 0 0 "[ . 1 . 2]" 1
111 1 72 THR MG 1 73 GLU H . . 3.090 2.586 2.073 2.845 . 0 0 "[ . 1 . 2]" 1
112 1 13 ASN HD21 1 29 GLU HB2 . . 4.580 2.922 2.164 3.287 . 0 0 "[ . 1 . 2]" 1
113 1 13 ASN HA 1 13 ASN HD21 . . 4.740 4.238 3.923 4.474 . 0 0 "[ . 1 . 2]" 1
114 1 13 ASN HD21 1 29 GLU HB3 . . 4.600 3.362 2.723 3.884 . 0 0 "[ . 1 . 2]" 1
115 1 13 ASN HB2 1 13 ASN HD22 . . 4.010 3.450 3.434 3.484 . 0 0 "[ . 1 . 2]" 1
116 1 13 ASN HB3 1 13 ASN HD22 . . 4.010 3.903 3.768 4.015 0.005 18 0 "[ . 1 . 2]" 1
117 1 13 ASN HD22 1 29 GLU HB2 . . 5.070 4.567 3.855 4.908 . 0 0 "[ . 1 . 2]" 1
118 1 61 LEU MD2 1 62 SER H . . 5.080 4.659 4.392 5.092 0.012 11 0 "[ . 1 . 2]" 1
119 1 12 GLU HB2 1 13 ASN HD22 . . 5.100 4.243 3.198 5.048 . 0 0 "[ . 1 . 2]" 1
120 1 55 ASN H 1 55 ASN HD22 . . 4.680 3.458 2.545 4.500 . 0 0 "[ . 1 . 2]" 1
121 1 55 ASN HB3 1 55 ASN HD22 . . 3.980 3.531 3.437 3.732 . 0 0 "[ . 1 . 2]" 1
122 1 78 PHE H 1 78 PHE QD . . 4.780 4.249 4.219 4.324 . 0 0 "[ . 1 . 2]" 1
123 1 78 PHE H 1 90 THR HB . . 4.720 4.415 3.799 4.621 . 0 0 "[ . 1 . 2]" 1
124 1 78 PHE H 1 78 PHE HB3 . . 3.640 2.905 2.874 2.989 . 0 0 "[ . 1 . 2]" 1
125 1 78 PHE H 1 78 PHE HB2 . . 3.620 2.628 2.569 2.773 . 0 0 "[ . 1 . 2]" 1
126 1 77 ARG HB2 1 78 PHE H . . 4.440 4.338 4.220 4.420 . 0 0 "[ . 1 . 2]" 1
127 1 77 ARG HB3 1 78 PHE H . . 4.360 4.262 4.011 4.368 0.008 8 0 "[ . 1 . 2]" 1
128 1 77 ARG HG2 1 78 PHE H . . 4.270 3.493 3.000 4.276 0.006 6 0 "[ . 1 . 2]" 1
129 1 77 ARG HG3 1 78 PHE H . . 4.270 3.291 2.593 3.977 . 0 0 "[ . 1 . 2]" 1
130 1 78 PHE H 1 90 THR MG . . 4.260 3.908 3.339 4.190 . 0 0 "[ . 1 . 2]" 1
131 1 11 VAL MG2 1 78 PHE H . . 5.500 5.471 5.283 5.545 0.045 17 0 "[ . 1 . 2]" 1
132 1 78 PHE H 1 79 LEU MD2 . . 5.500 5.400 5.222 5.513 0.013 6 0 "[ . 1 . 2]" 1
133 1 55 ASN H 1 55 ASN HD21 . . 4.680 3.207 1.884 4.353 . 0 0 "[ . 1 . 2]" 1
134 1 61 LEU H 1 62 SER H . . 3.870 2.282 1.759 2.899 . 0 0 "[ . 1 . 2]" 1
135 1 62 SER H 1 62 SER QB . . 3.660 3.182 2.758 3.373 . 0 0 "[ . 1 . 2]" 1
136 1 61 LEU QB 1 62 SER H . . 4.950 3.454 2.759 3.816 . 0 0 "[ . 1 . 2]" 1
137 1 61 LEU HG 1 62 SER H . . 5.000 4.868 4.718 5.003 0.003 20 0 "[ . 1 . 2]" 1
138 1 27 THR MG 1 62 SER H . . 5.500 5.328 5.054 5.479 . 0 0 "[ . 1 . 2]" 1
139 1 55 ASN HA 1 55 ASN HD22 . . 5.010 4.671 4.090 4.915 . 0 0 "[ . 1 . 2]" 1
140 1 32 ALA H 1 33 TYR H . . 3.430 2.402 2.217 2.758 . 0 0 "[ . 1 . 2]" 1
141 1 31 PRO HA 1 32 ALA H . . 2.870 2.217 2.153 2.312 . 0 0 "[ . 1 . 2]" 1
142 1 11 VAL HA 1 32 ALA H . . 5.450 5.286 5.050 5.454 0.004 4 0 "[ . 1 . 2]" 1
143 1 32 ALA H 1 33 TYR HB3 . . 5.500 5.356 5.140 5.514 0.014 12 0 "[ . 1 . 2]" 1
144 1 12 GLU HG2 1 32 ALA H . . 4.090 3.583 2.750 4.096 0.006 19 0 "[ . 1 . 2]" 1
145 1 12 GLU HG3 1 32 ALA H . . 4.090 3.375 2.828 4.110 0.020 5 0 "[ . 1 . 2]" 1
146 1 31 PRO HB3 1 32 ALA H . . 4.260 3.856 3.580 4.273 0.013 3 0 "[ . 1 . 2]" 1
147 1 31 PRO HB2 1 32 ALA H . . 3.950 3.296 2.851 3.915 . 0 0 "[ . 1 . 2]" 1
148 1 32 ALA H 1 32 ALA MB . . 2.890 2.155 2.028 2.365 . 0 0 "[ . 1 . 2]" 1
149 1 20 SER H 1 22 THR H . . 4.940 4.921 4.695 5.034 0.094 9 0 "[ . 1 . 2]" 1
150 1 22 THR H 1 23 SER HA . . 5.430 5.115 5.103 5.125 . 0 0 "[ . 1 . 2]" 1
151 1 20 SER HB2 1 22 THR H . . 4.260 3.860 2.732 4.333 0.073 13 0 "[ . 1 . 2]" 1
152 1 20 SER HB3 1 22 THR H . . 4.260 3.074 2.706 4.397 0.137 3 0 "[ . 1 . 2]" 1
153 1 21 PRO HD2 1 22 THR H . . 3.930 2.997 2.984 3.004 . 0 0 "[ . 1 . 2]" 1
154 1 21 PRO HG2 1 22 THR H . . 4.660 3.868 3.848 3.913 . 0 0 "[ . 1 . 2]" 1
155 1 21 PRO HB2 1 22 THR H . . 4.050 2.348 2.310 2.425 . 0 0 "[ . 1 . 2]" 1
156 1 22 THR H 1 22 THR MG . . 3.470 2.766 2.650 2.888 . 0 0 "[ . 1 . 2]" 1
157 1 34 ALA H 1 34 ALA MB . . 3.620 2.348 2.143 2.516 . 0 0 "[ . 1 . 2]" 1
158 1 81 TYR HA 1 87 GLY H . . 3.780 2.924 2.647 3.213 . 0 0 "[ . 1 . 2]" 1
159 1 81 TYR HB3 1 87 GLY H . . 4.350 3.852 3.605 4.303 . 0 0 "[ . 1 . 2]" 1
160 1 99 SER H 1 100 ASP HA . . 4.900 4.573 4.052 4.656 . 0 0 "[ . 1 . 2]" 1
161 1 98 LEU HA 1 99 SER H . . 2.670 2.659 2.650 2.671 0.001 18 0 "[ . 1 . 2]" 1
162 1 99 SER H 1 99 SER HB3 . . 3.230 2.673 2.589 2.810 . 0 0 "[ . 1 . 2]" 1
163 1 71 PHE HB2 1 99 SER H . . 4.890 4.821 4.572 4.910 0.020 12 0 "[ . 1 . 2]" 1
164 1 98 LEU HB3 1 99 SER H . . 3.160 2.047 1.991 2.077 . 0 0 "[ . 1 . 2]" 1
165 1 98 LEU HB2 1 99 SER H . . 3.630 2.923 2.870 2.976 . 0 0 "[ . 1 . 2]" 1
166 1 98 LEU MD2 1 99 SER H . . 3.890 3.659 3.572 3.710 . 0 0 "[ . 1 . 2]" 1
167 1 98 LEU MD1 1 99 SER H . . 4.220 3.987 3.924 4.013 . 0 0 "[ . 1 . 2]" 1
168 1 63 TYR QE 1 66 GLU H . . 4.090 4.018 3.815 4.110 0.020 3 0 "[ . 1 . 2]" 1
169 1 65 LEU HA 1 66 GLU H . . 2.670 2.258 2.235 2.289 . 0 0 "[ . 1 . 2]" 1
170 1 66 GLU H 1 66 GLU HG2 . . 4.050 3.752 3.105 3.969 . 0 0 "[ . 1 . 2]" 1
171 1 66 GLU H 1 66 GLU HB3 . . 4.000 3.935 3.898 3.942 . 0 0 "[ . 1 . 2]" 1
172 1 66 GLU H 1 66 GLU HG3 . . 4.050 3.145 2.914 4.119 0.069 13 0 "[ . 1 . 2]" 1
173 1 65 LEU HB3 1 66 GLU H . . 4.220 3.526 3.447 3.578 . 0 0 "[ . 1 . 2]" 1
174 1 66 GLU H 1 66 GLU HB2 . . 3.260 2.952 2.854 2.978 . 0 0 "[ . 1 . 2]" 1
175 1 65 LEU HG 1 66 GLU H . . 4.340 2.313 2.212 2.444 . 0 0 "[ . 1 . 2]" 1
176 1 80 ALA H 1 87 GLY H . . 4.740 4.071 3.787 4.371 . 0 0 "[ . 1 . 2]" 1
177 1 86 PRO HA 1 87 GLY H . . 3.090 2.164 2.155 2.184 . 0 0 "[ . 1 . 2]" 1
178 1 7 GLY HA3 1 87 GLY H . . 4.880 4.261 3.775 4.742 . 0 0 "[ . 1 . 2]" 1
179 1 8 PRO HD2 1 87 GLY H . . 3.890 2.312 2.018 2.685 . 0 0 "[ . 1 . 2]" 1
180 1 81 TYR HB2 1 87 GLY H . . 4.860 4.448 4.175 4.812 . 0 0 "[ . 1 . 2]" 1
181 1 86 PRO QB 1 87 GLY H . . 3.800 3.388 3.154 3.599 . 0 0 "[ . 1 . 2]" 1
182 1 79 LEU HB2 1 87 GLY H . . 4.690 4.327 3.942 4.695 0.005 19 0 "[ . 1 . 2]" 1
183 1 8 PRO HG2 1 87 GLY H . . 4.110 2.547 2.247 2.752 . 0 0 "[ . 1 . 2]" 1
184 1 79 LEU MD1 1 87 GLY H . . 3.550 2.934 2.601 3.162 . 0 0 "[ . 1 . 2]" 1
185 1 53 GLU HG2 1 54 GLN H . . 3.700 2.638 1.960 3.436 . 0 0 "[ . 1 . 2]" 1
186 1 54 GLN H 1 54 GLN QG . . 3.850 2.316 2.067 2.496 . 0 0 "[ . 1 . 2]" 1
187 1 16 ALA H 1 93 ILE MD . . 4.230 4.098 3.923 4.241 0.011 7 0 "[ . 1 . 2]" 1
188 1 15 GLN H 1 16 ALA H . . 4.490 4.267 4.205 4.369 . 0 0 "[ . 1 . 2]" 1
189 1 15 GLN HA 1 16 ALA H . . 2.580 2.209 2.175 2.264 . 0 0 "[ . 1 . 2]" 1
190 1 15 GLN HB2 1 16 ALA H . . 4.380 4.181 4.037 4.299 . 0 0 "[ . 1 . 2]" 1
191 1 16 ALA H 1 16 ALA MB . . 3.150 2.509 2.404 2.591 . 0 0 "[ . 1 . 2]" 1
192 1 39 GLN HE21 1 83 ARG HB2 . . 5.500 4.138 3.019 5.370 . 0 0 "[ . 1 . 2]" 1
193 1 39 GLN HE21 1 83 ARG HA . . 4.890 3.071 2.368 4.140 . 0 0 "[ . 1 . 2]" 1
194 1 39 GLN HE22 1 83 ARG HA . . 4.890 3.774 2.547 4.882 . 0 0 "[ . 1 . 2]" 1
195 1 39 GLN HE22 1 39 GLN QG . . 3.760 3.235 3.216 3.393 . 0 0 "[ . 1 . 2]" 1
196 1 39 GLN HB2 1 39 GLN HE22 . . 5.500 4.985 3.844 5.377 . 0 0 "[ . 1 . 2]" 1
197 1 39 GLN HB3 1 39 GLN HE22 . . 5.500 4.303 3.745 4.759 . 0 0 "[ . 1 . 2]" 1
198 1 39 GLN HE22 1 83 ARG HB2 . . 5.500 4.806 4.025 5.424 . 0 0 "[ . 1 . 2]" 1
199 1 39 GLN HE22 1 83 ARG HB3 . . 5.500 4.370 3.504 5.501 0.001 1 0 "[ . 1 . 2]" 1
200 1 45 CYS H 1 46 THR H . . 4.440 4.383 4.314 4.464 0.024 2 0 "[ . 1 . 2]" 1
201 1 54 GLN H 1 55 ASN H . . 4.350 4.238 4.082 4.359 0.009 13 0 "[ . 1 . 2]" 1
202 1 45 CYS H 1 76 LEU HA . . 5.020 4.841 4.715 5.002 . 0 0 "[ . 1 . 2]" 1
203 1 44 PHE HA 1 45 CYS H . . 2.570 2.145 2.139 2.179 . 0 0 "[ . 1 . 2]" 1
204 1 53 GLU HA 1 54 GLN H . . 2.790 2.227 2.152 2.299 . 0 0 "[ . 1 . 2]" 1
205 1 45 CYS H 1 45 CYS HB2 . . 3.560 3.001 2.902 3.071 . 0 0 "[ . 1 . 2]" 1
206 1 53 GLU HG3 1 54 GLN H . . 3.700 3.036 2.232 3.729 0.029 19 0 "[ . 1 . 2]" 1
207 1 45 CYS H 1 45 CYS HG . . 5.460 4.725 4.589 4.846 . 0 0 "[ . 1 . 2]" 1
208 1 45 CYS HG 1 54 GLN H . . 5.500 4.995 4.558 5.458 . 0 0 "[ . 1 . 2]" 1
209 1 46 THR MG 1 54 GLN H . . 5.020 4.690 4.474 4.926 . 0 0 "[ . 1 . 2]" 1
210 1 43 LEU H 1 56 ILE MG . . 4.750 4.319 4.058 4.672 . 0 0 "[ . 1 . 2]" 1
211 1 42 ARG H 1 43 LEU H . . 4.670 4.410 4.339 4.491 . 0 0 "[ . 1 . 2]" 1
212 1 43 LEU H 1 44 PHE HA . . 5.500 5.004 4.872 5.090 . 0 0 "[ . 1 . 2]" 1
213 1 43 LEU H 1 55 ASN HA . . 5.500 4.950 4.648 5.147 . 0 0 "[ . 1 . 2]" 1
214 1 43 LEU H 1 43 LEU HB3 . . 3.260 2.424 2.345 2.525 . 0 0 "[ . 1 . 2]" 1
215 1 42 ARG QB 1 43 LEU H . . 3.730 3.412 2.958 3.702 . 0 0 "[ . 1 . 2]" 1
216 1 43 LEU H 1 43 LEU HB2 . . 3.480 3.162 2.993 3.248 . 0 0 "[ . 1 . 2]" 1
217 1 42 ARG HG2 1 43 LEU H . . 4.060 3.394 2.714 3.991 . 0 0 "[ . 1 . 2]" 1
218 1 43 LEU H 1 58 VAL MG2 . . 4.530 4.120 3.820 4.383 . 0 0 "[ . 1 . 2]" 1
219 1 43 LEU H 1 58 VAL MG1 . . 4.830 4.400 4.049 4.659 . 0 0 "[ . 1 . 2]" 1
220 1 39 GLN HE21 1 83 ARG HB3 . . 5.500 3.467 2.444 5.045 . 0 0 "[ . 1 . 2]" 1
221 1 43 LEU H 1 44 PHE H . . 4.590 4.459 4.303 4.526 . 0 0 "[ . 1 . 2]" 1
222 1 44 PHE H 1 77 ARG HB2 . . 5.180 4.933 4.619 5.162 . 0 0 "[ . 1 . 2]" 1
223 1 44 PHE H 1 77 ARG HB3 . . 4.790 3.564 3.278 3.831 . 0 0 "[ . 1 . 2]" 1
224 1 43 LEU HB2 1 44 PHE H . . 4.310 3.941 3.800 4.131 . 0 0 "[ . 1 . 2]" 1
225 1 44 PHE QD 1 45 CYS H . . 4.920 4.417 4.237 4.607 . 0 0 "[ . 1 . 2]" 1
226 1 44 PHE QD 1 54 GLN H . . 5.500 5.101 4.372 5.482 . 0 0 "[ . 1 . 2]" 1
227 1 45 CYS H 1 45 CYS HB3 . . 3.190 2.444 2.393 2.492 . 0 0 "[ . 1 . 2]" 1
228 1 43 LEU HG 1 45 CYS H . . 4.550 3.698 3.421 3.864 . 0 0 "[ . 1 . 2]" 1
229 1 43 LEU MD2 1 45 CYS H . . 4.730 4.523 4.283 4.677 . 0 0 "[ . 1 . 2]" 1
230 1 44 PHE H 1 78 PHE HA . . 4.060 3.975 3.774 4.074 0.014 6 0 "[ . 1 . 2]" 1
231 1 44 PHE H 1 44 PHE QD . . 3.380 3.014 2.648 3.391 0.011 9 0 "[ . 1 . 2]" 1
232 1 44 PHE H 1 78 PHE QD . . 4.480 4.350 4.121 4.484 0.004 4 0 "[ . 1 . 2]" 1
233 1 44 PHE H 1 44 PHE HB2 . . 3.410 2.748 2.655 2.835 . 0 0 "[ . 1 . 2]" 1
234 1 43 LEU HB3 1 44 PHE H . . 4.450 4.162 4.045 4.375 . 0 0 "[ . 1 . 2]" 1
235 1 43 LEU HG 1 44 PHE H . . 3.930 2.777 2.495 3.236 . 0 0 "[ . 1 . 2]" 1
236 1 43 LEU MD1 1 44 PHE H . . 3.310 2.328 1.969 2.727 . 0 0 "[ . 1 . 2]" 1
237 1 44 PHE H 1 76 LEU MD2 . . 5.250 4.676 4.276 4.903 . 0 0 "[ . 1 . 2]" 1
238 1 7 GLY HA2 1 82 ASN HD22 . . 4.560 3.354 2.756 3.988 . 0 0 "[ . 1 . 2]" 1
239 1 8 PRO HD2 1 82 ASN HD22 . . 5.120 3.861 3.352 4.537 . 0 0 "[ . 1 . 2]" 1
240 1 7 GLY HA2 1 82 ASN HD21 . . 4.560 4.157 3.612 4.554 . 0 0 "[ . 1 . 2]" 1
241 1 8 PRO HG3 1 82 ASN HD22 . . 4.770 3.814 3.452 4.327 . 0 0 "[ . 1 . 2]" 1
242 1 54 GLN HB2 1 54 GLN HE21 . . 4.740 4.357 4.178 4.468 . 0 0 "[ . 1 . 2]" 1
243 1 54 GLN HE21 1 65 LEU MD1 . . 4.570 4.042 3.300 4.568 . 0 0 "[ . 1 . 2]" 1
244 1 54 GLN HE21 1 65 LEU MD2 . . 4.720 3.403 3.035 3.834 . 0 0 "[ . 1 . 2]" 1
245 1 54 GLN HE21 1 68 LEU MD2 . . 4.200 3.979 3.674 4.196 . 0 0 "[ . 1 . 2]" 1
246 1 54 GLN HB2 1 54 GLN HE22 . . 4.980 4.665 4.537 4.748 . 0 0 "[ . 1 . 2]" 1
247 1 54 GLN HB3 1 54 GLN HE22 . . 4.980 4.542 4.420 4.660 . 0 0 "[ . 1 . 2]" 1
248 1 54 GLN HE22 1 65 LEU MD1 . . 4.800 4.451 4.039 4.744 . 0 0 "[ . 1 . 2]" 1
249 1 45 CYS H 1 54 GLN HE21 . . 5.390 4.175 3.957 4.374 . 0 0 "[ . 1 . 2]" 1
250 1 54 GLN H 1 54 GLN HE21 . . 5.500 4.761 4.427 5.069 . 0 0 "[ . 1 . 2]" 1
251 1 54 GLN HB3 1 54 GLN HE21 . . 4.740 4.230 3.821 4.422 . 0 0 "[ . 1 . 2]" 1
252 1 45 CYS HG 1 54 GLN HE21 . . 4.640 3.584 2.213 4.477 . 0 0 "[ . 1 . 2]" 1
253 1 54 GLN HE22 1 65 LEU MD2 . . 4.670 3.588 3.160 3.981 . 0 0 "[ . 1 . 2]" 1
254 1 54 GLN HE22 1 68 LEU MD2 . . 3.880 3.635 3.392 3.862 . 0 0 "[ . 1 . 2]" 1
255 1 55 ASN HA 1 56 ILE H . . 2.740 2.193 2.158 2.238 . 0 0 "[ . 1 . 2]" 1
256 1 55 ASN HB2 1 56 ILE H . . 4.130 3.496 2.955 4.050 . 0 0 "[ . 1 . 2]" 1
257 1 55 ASN HB3 1 56 ILE H . . 4.090 3.473 2.989 3.921 . 0 0 "[ . 1 . 2]" 1
258 1 43 LEU HB3 1 56 ILE H . . 4.050 3.778 3.417 3.914 . 0 0 "[ . 1 . 2]" 1
259 1 56 ILE H 1 56 ILE HB . . 3.250 2.787 2.720 2.877 . 0 0 "[ . 1 . 2]" 1
260 1 56 ILE H 1 56 ILE HG13 . . 3.500 3.029 2.888 3.146 . 0 0 "[ . 1 . 2]" 1
261 1 56 ILE H 1 56 ILE HG12 . . 4.490 4.249 4.109 4.374 . 0 0 "[ . 1 . 2]" 1
262 1 56 ILE H 1 56 ILE MG . . 3.930 3.896 3.866 3.933 0.003 2 0 "[ . 1 . 2]" 1
263 1 44 PHE QD 1 56 ILE H . . 5.230 4.056 3.407 4.892 . 0 0 "[ . 1 . 2]" 1
264 1 78 PHE QD 1 79 LEU H . . 4.220 3.239 3.072 3.413 . 0 0 "[ . 1 . 2]" 1
265 1 78 PHE HA 1 79 LEU H . . 2.810 2.250 2.228 2.273 . 0 0 "[ . 1 . 2]" 1
266 1 79 LEU H 1 79 LEU HG . . 3.330 2.651 2.581 2.710 . 0 0 "[ . 1 . 2]" 1
267 1 79 LEU H 1 79 LEU HB3 . . 4.170 3.322 3.283 3.380 . 0 0 "[ . 1 . 2]" 1
268 1 42 ARG QB 1 79 LEU H . . 4.460 4.284 4.201 4.395 . 0 0 "[ . 1 . 2]" 1
269 1 79 LEU H 1 79 LEU MD2 . . 4.220 3.964 3.880 4.115 . 0 0 "[ . 1 . 2]" 1
270 1 79 LEU H 1 80 ALA H . . 4.720 4.357 4.335 4.373 . 0 0 "[ . 1 . 2]" 1
271 1 78 PHE HB3 1 79 LEU H . . 4.310 3.577 3.500 3.647 . 0 0 "[ . 1 . 2]" 1
272 1 78 PHE HB2 1 79 LEU H . . 4.280 4.205 4.175 4.240 . 0 0 "[ . 1 . 2]" 1
273 1 63 TYR H 1 63 TYR QD . . 4.630 4.336 4.261 4.393 . 0 0 "[ . 1 . 2]" 1
274 1 62 SER H 1 63 TYR H . . 4.560 4.133 3.884 4.439 . 0 0 "[ . 1 . 2]" 1
275 1 28 TRP HH2 1 63 TYR H . . 4.310 3.808 3.661 4.007 . 0 0 "[ . 1 . 2]" 1
276 1 26 ILE HB 1 63 TYR H . . 4.070 3.321 3.150 3.520 . 0 0 "[ . 1 . 2]" 1
277 1 63 TYR H 1 64 LYS H . . 4.390 4.114 4.010 4.217 . 0 0 "[ . 1 . 2]" 1
278 1 28 TRP HZ3 1 63 TYR H . . 3.580 2.342 2.105 2.594 . 0 0 "[ . 1 . 2]" 1
279 1 62 SER QB 1 63 TYR H . . 3.460 3.050 2.515 3.347 . 0 0 "[ . 1 . 2]" 1
280 1 63 TYR H 1 63 TYR HB3 . . 3.890 2.864 2.793 2.920 . 0 0 "[ . 1 . 2]" 1
281 1 26 ILE HG13 1 63 TYR H . . 5.040 4.868 4.732 5.028 . 0 0 "[ . 1 . 2]" 1
282 1 25 LEU HG 1 63 TYR H . . 4.890 4.625 4.196 4.791 . 0 0 "[ . 1 . 2]" 1
283 1 27 THR MG 1 63 TYR H . . 4.120 3.922 3.681 4.118 . 0 0 "[ . 1 . 2]" 1
284 1 79 LEU HB2 1 80 ALA H . . 3.830 2.565 2.410 2.671 . 0 0 "[ . 1 . 2]" 1
285 1 79 LEU MD2 1 80 ALA H . . 4.650 4.597 4.469 4.664 0.014 17 0 "[ . 1 . 2]" 1
286 1 79 LEU MD1 1 80 ALA H . . 4.290 2.746 2.540 2.913 . 0 0 "[ . 1 . 2]" 1
287 1 41 TYR QD 1 80 ALA H . . 5.130 4.933 4.774 5.052 . 0 0 "[ . 1 . 2]" 1
288 1 80 ALA H 1 87 GLY HA3 . . 5.130 4.891 4.728 5.099 . 0 0 "[ . 1 . 2]" 1
289 1 8 PRO HG2 1 80 ALA H . . 4.630 4.062 3.780 4.221 . 0 0 "[ . 1 . 2]" 1
290 1 80 ALA H 1 80 ALA MB . . 3.290 2.236 2.172 2.347 . 0 0 "[ . 1 . 2]" 1
291 1 79 LEU HB2 1 89 SER H . . 4.730 4.467 4.105 4.739 0.009 6 0 "[ . 1 . 2]" 1
292 1 88 VAL H 1 89 SER H . . 4.660 4.593 4.542 4.641 . 0 0 "[ . 1 . 2]" 1
293 1 88 VAL HA 1 89 SER H . . 2.620 2.210 2.149 2.311 . 0 0 "[ . 1 . 2]" 1
294 1 88 VAL HB 1 89 SER H . . 4.180 4.035 3.859 4.180 . 0 0 "[ . 1 . 2]" 1
295 1 88 VAL MG1 1 89 SER H . . 4.170 2.298 1.909 3.137 . 0 0 "[ . 1 . 2]" 1
296 1 79 LEU MD2 1 89 SER H . . 4.830 4.551 4.012 4.858 0.028 17 0 "[ . 1 . 2]" 1
297 1 6 SER HA 1 7 GLY H . . 3.390 2.645 2.165 3.562 0.172 20 0 "[ . 1 . 2]" 1
298 1 6 SER QB 1 7 GLY H . . 3.560 2.786 1.965 3.557 . 0 0 "[ . 1 . 2]" 1
299 1 90 THR HA 1 91 ASP H . . 2.820 2.383 2.241 2.465 . 0 0 "[ . 1 . 2]" 1
300 1 90 THR HB 1 91 ASP H . . 3.110 2.447 2.254 2.837 . 0 0 "[ . 1 . 2]" 1
301 1 91 ASP H 1 91 ASP HB2 . . 3.680 2.822 2.195 3.598 . 0 0 "[ . 1 . 2]" 1
302 1 91 ASP H 1 91 ASP HB3 . . 3.680 3.151 2.161 3.604 . 0 0 "[ . 1 . 2]" 1
303 1 90 THR MG 1 91 ASP H . . 3.880 3.683 3.505 3.897 0.017 16 0 "[ . 1 . 2]" 1
304 1 90 THR HG1 1 91 ASP H . . 4.520 3.878 3.438 4.431 . 0 0 "[ . 1 . 2]" 1
305 1 38 VAL H 1 38 VAL MG1 . . 4.110 3.871 3.848 3.894 . 0 0 "[ . 1 . 2]" 1
306 1 35 ASN H 1 36 GLY H . . 4.480 4.135 3.899 4.290 . 0 0 "[ . 1 . 2]" 1
307 1 36 GLY H 1 37 PRO HD2 . . 5.180 4.806 4.781 4.836 . 0 0 "[ . 1 . 2]" 1
308 1 34 ALA MB 1 36 GLY H . . 4.440 4.179 3.796 4.420 . 0 0 "[ . 1 . 2]" 1
309 1 35 ASN HB2 1 36 GLY H . . 4.820 4.548 3.885 4.670 . 0 0 "[ . 1 . 2]" 1
310 1 37 PRO HA 1 38 VAL H . . 2.860 2.567 2.497 2.626 . 0 0 "[ . 1 . 2]" 1
311 1 37 PRO HB2 1 38 VAL H . . 3.700 2.226 2.100 2.381 . 0 0 "[ . 1 . 2]" 1
312 1 38 VAL H 1 38 VAL HB . . 2.960 2.729 2.689 2.763 . 0 0 "[ . 1 . 2]" 1
313 1 93 ILE MG 1 94 THR H . . 3.690 3.095 2.898 3.257 . 0 0 "[ . 1 . 2]" 1
314 1 84 TYR QD 1 85 GLY H . . 4.340 4.005 3.760 4.264 . 0 0 "[ . 1 . 2]" 1
315 1 55 ASN H 1 56 ILE HG13 . . 4.770 4.370 4.201 4.522 . 0 0 "[ . 1 . 2]" 1
316 1 82 ASN H 1 85 GLY H . . 3.460 2.627 2.441 2.783 . 0 0 "[ . 1 . 2]" 1
317 1 81 TYR QD 1 85 GLY H . . 5.230 5.079 4.754 5.251 0.021 19 0 "[ . 1 . 2]" 1
318 1 81 TYR HA 1 85 GLY H . . 4.640 4.246 3.978 4.588 . 0 0 "[ . 1 . 2]" 1
319 1 8 PRO HD3 1 85 GLY H . . 4.080 3.503 3.321 3.795 . 0 0 "[ . 1 . 2]" 1
320 1 84 TYR HB2 1 85 GLY H . . 3.990 2.263 2.108 2.608 . 0 0 "[ . 1 . 2]" 1
321 1 84 TYR HB3 1 85 GLY H . . 3.990 3.489 3.156 3.792 . 0 0 "[ . 1 . 2]" 1
322 1 85 GLY H 1 86 PRO HD2 . . 5.030 4.797 4.771 4.817 . 0 0 "[ . 1 . 2]" 1
323 1 55 ASN H 1 55 ASN HB2 . . 3.610 3.130 2.562 3.523 . 0 0 "[ . 1 . 2]" 1
324 1 55 ASN H 1 55 ASN HB3 . . 3.690 3.364 3.040 3.678 . 0 0 "[ . 1 . 2]" 1
325 1 37 PRO QG 1 38 VAL H . . 4.030 3.880 3.777 4.001 . 0 0 "[ . 1 . 2]" 1
326 1 76 LEU HA 1 93 ILE H . . 5.210 4.750 4.583 4.870 . 0 0 "[ . 1 . 2]" 1
327 1 90 THR HG1 1 93 ILE H . . 5.500 4.707 4.162 5.490 . 0 0 "[ . 1 . 2]" 1
328 1 92 ASP HA 1 93 ILE H . . 2.840 2.146 2.139 2.174 . 0 0 "[ . 1 . 2]" 1
329 1 92 ASP HB2 1 93 ILE H . . 4.490 4.025 3.520 4.497 0.007 5 0 "[ . 1 . 2]" 1
330 1 93 ILE H 1 93 ILE HB . . 3.280 2.512 2.477 2.604 . 0 0 "[ . 1 . 2]" 1
331 1 76 LEU HB2 1 93 ILE H . . 4.300 3.821 3.590 4.045 . 0 0 "[ . 1 . 2]" 1
332 1 93 ILE H 1 93 ILE HG12 . . 3.820 3.679 3.569 3.804 . 0 0 "[ . 1 . 2]" 1
333 1 93 ILE H 1 93 ILE HG13 . . 3.680 2.318 2.165 2.452 . 0 0 "[ . 1 . 2]" 1
334 1 93 ILE H 1 93 ILE MG . . 3.910 3.781 3.767 3.807 . 0 0 "[ . 1 . 2]" 1
335 1 93 ILE H 1 93 ILE MD . . 4.030 3.532 3.376 3.622 . 0 0 "[ . 1 . 2]" 1
336 1 76 LEU H 1 94 THR H . . 4.870 4.828 4.574 4.883 0.013 5 0 "[ . 1 . 2]" 1
337 1 37 PRO HB3 1 38 VAL H . . 3.700 3.272 3.220 3.340 . 0 0 "[ . 1 . 2]" 1
338 1 75 SER QB 1 93 ILE H . . 5.500 5.025 4.445 5.506 0.006 8 0 "[ . 1 . 2]" 1
339 1 93 ILE HA 1 94 THR H . . 2.560 2.178 2.155 2.195 . 0 0 "[ . 1 . 2]" 1
340 1 94 THR H 1 94 THR MG . . 3.840 3.810 3.793 3.830 . 0 0 "[ . 1 . 2]" 1
341 1 66 GLU H 1 67 GLY H . . 4.510 4.404 4.395 4.409 . 0 0 "[ . 1 . 2]" 1
342 1 23 SER HA 1 67 GLY H . . 4.970 4.540 4.246 4.751 . 0 0 "[ . 1 . 2]" 1
343 1 66 GLU HA 1 67 GLY H . . 3.110 2.368 2.329 2.418 . 0 0 "[ . 1 . 2]" 1
344 1 22 THR HB 1 67 GLY H . . 3.700 3.671 3.492 3.751 0.051 3 0 "[ . 1 . 2]" 1
345 1 66 GLU HB3 1 67 GLY H . . 3.240 2.571 2.458 2.661 . 0 0 "[ . 1 . 2]" 1
346 1 66 GLU HB2 1 67 GLY H . . 3.740 3.532 3.431 3.650 . 0 0 "[ . 1 . 2]" 1
347 1 67 GLY H 1 68 LEU HG . . 4.160 4.086 3.958 4.172 0.012 13 0 "[ . 1 . 2]" 1
348 1 12 GLU H 1 13 ASN H . . 4.530 4.450 4.408 4.480 . 0 0 "[ . 1 . 2]" 1
349 1 12 GLU H 1 31 PRO HA . . 4.120 3.562 3.384 3.799 . 0 0 "[ . 1 . 2]" 1
350 1 11 VAL HA 1 12 GLU H . . 3.020 2.466 2.399 2.607 . 0 0 "[ . 1 . 2]" 1
351 1 11 VAL HB 1 12 GLU H . . 3.340 2.267 1.988 2.411 . 0 0 "[ . 1 . 2]" 1
352 1 12 GLU H 1 12 GLU HG2 . . 3.970 2.965 2.639 3.577 . 0 0 "[ . 1 . 2]" 1
353 1 12 GLU H 1 12 GLU HG3 . . 3.970 2.925 1.880 3.933 . 0 0 "[ . 1 . 2]" 1
354 1 12 GLU H 1 12 GLU HB2 . . 3.750 2.981 2.654 3.641 . 0 0 "[ . 1 . 2]" 1
355 1 12 GLU H 1 29 GLU HB2 . . 4.600 3.673 3.382 3.945 . 0 0 "[ . 1 . 2]" 1
356 1 11 VAL MG2 1 12 GLU H . . 3.940 3.243 3.022 3.406 . 0 0 "[ . 1 . 2]" 1
357 1 22 THR HA 1 67 GLY H . . 5.500 5.489 5.330 5.550 0.050 11 0 "[ . 1 . 2]" 1
358 1 42 ARG H 1 79 LEU H . . 3.580 3.462 3.204 3.588 0.008 16 0 "[ . 1 . 2]" 1
359 1 41 TYR H 1 42 ARG H . . 4.500 4.291 4.213 4.354 . 0 0 "[ . 1 . 2]" 1
360 1 41 TYR HA 1 42 ARG H . . 2.990 2.214 2.172 2.277 . 0 0 "[ . 1 . 2]" 1
361 1 41 TYR HB3 1 42 ARG H . . 3.460 3.000 2.799 3.172 . 0 0 "[ . 1 . 2]" 1
362 1 42 ARG H 1 42 ARG QB . . 3.340 2.397 2.272 2.492 . 0 0 "[ . 1 . 2]" 1
363 1 42 ARG H 1 79 LEU MD1 . . 3.890 3.322 2.942 3.700 . 0 0 "[ . 1 . 2]" 1
364 1 41 TYR QD 1 42 ARG H . . 4.590 4.315 4.134 4.418 . 0 0 "[ . 1 . 2]" 1
365 1 42 ARG H 1 81 TYR QD . . 4.160 2.758 2.548 3.104 . 0 0 "[ . 1 . 2]" 1
366 1 42 ARG H 1 78 PHE HA . . 5.240 4.899 4.556 5.061 . 0 0 "[ . 1 . 2]" 1
367 1 41 TYR HB2 1 42 ARG H . . 4.170 3.874 3.698 4.017 . 0 0 "[ . 1 . 2]" 1
368 1 42 ARG H 1 79 LEU HG . . 4.230 3.506 3.232 3.770 . 0 0 "[ . 1 . 2]" 1
369 1 42 ARG H 1 42 ARG HG3 . . 4.600 4.007 3.390 4.505 . 0 0 "[ . 1 . 2]" 1
370 1 42 ARG H 1 42 ARG HG2 . . 5.060 4.586 4.395 4.698 . 0 0 "[ . 1 . 2]" 1
371 1 42 ARG H 1 79 LEU MD2 . . 5.460 4.794 4.519 4.972 . 0 0 "[ . 1 . 2]" 1
372 1 52 LYS H 1 53 GLU H . . 4.630 4.508 4.419 4.590 . 0 0 "[ . 1 . 2]" 1
373 1 49 SER H 1 50 THR H . . 3.490 2.883 2.640 3.053 . 0 0 "[ . 1 . 2]" 1
374 1 47 GLU H 1 50 THR H . . 5.340 5.115 5.011 5.238 . 0 0 "[ . 1 . 2]" 1
375 1 50 THR H 1 51 GLY H . . 2.700 2.411 2.297 2.511 . 0 0 "[ . 1 . 2]" 1
376 1 50 THR H 1 52 LYS H . . 4.100 4.062 3.945 4.117 0.017 1 0 "[ . 1 . 2]" 1
377 1 50 THR H 1 50 THR HG1 . . 3.860 3.234 2.572 3.524 . 0 0 "[ . 1 . 2]" 1
378 1 50 THR H 1 50 THR HB . . 4.020 3.651 3.604 3.681 . 0 0 "[ . 1 . 2]" 1
379 1 49 SER QB 1 50 THR H . . 3.800 2.268 2.082 2.510 . 0 0 "[ . 1 . 2]" 1
380 1 50 THR H 1 51 GLY HA2 . . 4.700 4.522 4.427 4.613 . 0 0 "[ . 1 . 2]" 1
381 1 48 VAL HA 1 50 THR H . . 4.810 4.696 4.497 4.816 0.006 9 0 "[ . 1 . 2]" 1
382 1 47 GLU HB3 1 50 THR H . . 4.140 2.951 2.656 3.130 . 0 0 "[ . 1 . 2]" 1
383 1 47 GLU HG2 1 50 THR H . . 4.070 2.241 1.899 2.983 . 0 0 "[ . 1 . 2]" 1
384 1 47 GLU HG3 1 50 THR H . . 4.070 3.723 1.895 4.073 0.003 4 0 "[ . 1 . 2]" 1
385 1 50 THR H 1 50 THR MG . . 3.180 2.692 2.494 2.968 . 0 0 "[ . 1 . 2]" 1
386 1 46 THR MG 1 50 THR H . . 5.500 5.495 5.396 5.534 0.034 19 0 "[ . 1 . 2]" 1
387 1 50 THR H 1 72 THR MG . . 4.790 4.641 4.406 4.796 0.006 13 0 "[ . 1 . 2]" 1
388 1 47 GLU H 1 52 LYS H . . 4.050 3.286 2.906 3.548 . 0 0 "[ . 1 . 2]" 1
389 1 51 GLY H 1 52 LYS H . . 3.180 1.997 1.926 2.155 . 0 0 "[ . 1 . 2]" 1
390 1 50 THR HG1 1 52 LYS H . . 3.380 2.303 1.841 3.027 . 0 0 "[ . 1 . 2]" 1
391 1 46 THR HA 1 52 LYS H . . 5.290 4.762 4.488 4.994 . 0 0 "[ . 1 . 2]" 1
392 1 50 THR HA 1 52 LYS H . . 4.980 4.881 4.637 5.023 0.043 14 0 "[ . 1 . 2]" 1
393 1 47 GLU HB3 1 52 LYS H . . 3.600 2.860 2.610 3.120 . 0 0 "[ . 1 . 2]" 1
394 1 47 GLU HB2 1 52 LYS H . . 4.430 4.296 4.137 4.443 0.013 20 0 "[ . 1 . 2]" 1
395 1 52 LYS H 1 52 LYS HB3 . . 3.650 3.482 2.677 3.654 0.004 7 0 "[ . 1 . 2]" 1
396 1 52 LYS H 1 52 LYS HG3 . . 4.080 2.974 2.385 3.705 . 0 0 "[ . 1 . 2]" 1
397 1 46 THR MG 1 52 LYS H . . 4.010 3.528 3.301 3.775 . 0 0 "[ . 1 . 2]" 1
398 1 100 ASP H 1 100 ASP QB . . 3.850 2.261 2.153 3.007 . 0 0 "[ . 1 . 2]" 1
399 1 23 SER H 1 24 ILE H . . 4.380 4.367 4.365 4.368 . 0 0 "[ . 1 . 2]" 1
400 1 23 SER HA 1 24 ILE H . . 2.810 2.512 2.477 2.561 . 0 0 "[ . 1 . 2]" 1
401 1 18 SER HA 1 24 ILE H . . 4.820 4.104 3.939 4.290 . 0 0 "[ . 1 . 2]" 1
402 1 23 SER HB2 1 24 ILE H . . 3.830 2.585 2.164 3.514 . 0 0 "[ . 1 . 2]" 1
403 1 23 SER HB3 1 24 ILE H . . 3.830 3.454 2.300 3.843 0.013 9 0 "[ . 1 . 2]" 1
404 1 24 ILE H 1 65 LEU HB3 . . 3.800 2.916 2.757 3.092 . 0 0 "[ . 1 . 2]" 1
405 1 24 ILE H 1 24 ILE HB . . 3.350 3.019 3.008 3.039 . 0 0 "[ . 1 . 2]" 1
406 1 24 ILE H 1 64 LYS QG . . 3.990 3.206 2.967 3.461 . 0 0 "[ . 1 . 2]" 1
407 1 24 ILE H 1 24 ILE HG13 . . 4.740 3.444 3.328 3.496 . 0 0 "[ . 1 . 2]" 1
408 1 24 ILE H 1 68 LEU MD1 . . 3.730 3.528 3.391 3.621 . 0 0 "[ . 1 . 2]" 1
409 1 82 ASN H 1 86 PRO HA . . 4.190 3.950 3.606 4.180 . 0 0 "[ . 1 . 2]" 1
410 1 7 GLY HA2 1 82 ASN H . . 5.010 4.617 4.296 5.021 0.011 2 0 "[ . 1 . 2]" 1
411 1 8 PRO HD2 1 82 ASN H . . 4.060 3.648 3.346 3.887 . 0 0 "[ . 1 . 2]" 1
412 1 81 TYR HB2 1 82 ASN H . . 3.360 3.184 2.974 3.340 . 0 0 "[ . 1 . 2]" 1
413 1 99 SER HA 1 100 ASP H . . 3.380 2.213 2.138 3.292 . 0 0 "[ . 1 . 2]" 1
414 1 99 SER HB2 1 100 ASP H . . 4.320 4.316 4.213 4.437 0.117 13 0 "[ . 1 . 2]" 1
415 1 99 SER HB3 1 100 ASP H . . 4.570 4.448 3.521 4.534 . 0 0 "[ . 1 . 2]" 1
416 1 70 LYS QD 1 100 ASP H . . 4.270 2.569 1.955 4.307 0.037 13 0 "[ . 1 . 2]" 1
417 1 24 ILE H 1 25 LEU H . . 4.590 3.725 3.718 3.751 . 0 0 "[ . 1 . 2]" 1
418 1 24 ILE H 1 25 LEU HA . . 4.380 4.358 4.347 4.369 . 0 0 "[ . 1 . 2]" 1
419 1 24 ILE H 1 65 LEU HA . . 4.710 4.530 4.363 4.653 . 0 0 "[ . 1 . 2]" 1
420 1 24 ILE H 1 24 ILE MD . . 4.630 4.630 4.561 4.668 0.038 11 0 "[ . 1 . 2]" 1
421 1 81 TYR QD 1 82 ASN H . . 3.910 3.584 3.413 3.787 . 0 0 "[ . 1 . 2]" 1
422 1 81 TYR HA 1 82 ASN H . . 2.970 2.172 2.148 2.216 . 0 0 "[ . 1 . 2]" 1
423 1 8 PRO HD3 1 82 ASN H . . 3.660 2.942 2.659 3.175 . 0 0 "[ . 1 . 2]" 1
424 1 81 TYR HB3 1 82 ASN H . . 4.520 4.241 4.095 4.335 . 0 0 "[ . 1 . 2]" 1
425 1 8 PRO HG3 1 82 ASN H . . 4.710 2.731 2.473 2.999 . 0 0 "[ . 1 . 2]" 1
426 1 8 PRO HG2 1 82 ASN H . . 4.590 4.087 3.831 4.330 . 0 0 "[ . 1 . 2]" 1
427 1 58 VAL HA 1 59 ASP H . . 3.180 2.400 2.191 2.550 . 0 0 "[ . 1 . 2]" 1
428 1 59 ASP H 1 59 ASP HB3 . . 3.860 3.173 2.662 3.857 . 0 0 "[ . 1 . 2]" 1
429 1 58 VAL MG1 1 59 ASP H . . 4.510 3.734 3.561 3.957 . 0 0 "[ . 1 . 2]" 1
430 1 28 TRP HZ2 1 59 ASP H . . 5.190 4.482 4.020 4.795 . 0 0 "[ . 1 . 2]" 1
431 1 28 TRP HH2 1 59 ASP H . . 5.500 4.501 3.763 4.941 . 0 0 "[ . 1 . 2]" 1
432 1 22 THR HB 1 70 LYS H . . 5.500 4.982 4.695 5.239 . 0 0 "[ . 1 . 2]" 1
433 1 70 LYS H 1 71 PHE HA . . 5.500 5.512 5.489 5.536 0.036 18 0 "[ . 1 . 2]" 1
434 1 69 LYS HA 1 70 LYS H . . 2.610 2.195 2.168 2.215 . 0 0 "[ . 1 . 2]" 1
435 1 21 PRO HB3 1 70 LYS H . . 5.450 5.485 5.153 5.576 0.126 18 0 "[ . 1 . 2]" 1
436 1 70 LYS H 1 70 LYS HB2 . . 3.470 2.235 2.182 2.395 . 0 0 "[ . 1 . 2]" 1
437 1 69 LYS HB3 1 70 LYS H . . 3.160 3.075 2.989 3.191 0.031 1 0 "[ . 1 . 2]" 1
438 1 70 LYS H 1 70 LYS HB3 . . 3.470 3.022 2.754 3.127 . 0 0 "[ . 1 . 2]" 1
439 1 69 LYS HG2 1 70 LYS H . . 4.220 3.967 3.707 4.197 . 0 0 "[ . 1 . 2]" 1
440 1 22 THR MG 1 70 LYS H . . 3.910 2.645 2.552 2.826 . 0 0 "[ . 1 . 2]" 1
441 1 70 LYS H 1 97 THR HG1 . . 4.820 4.555 4.488 4.597 . 0 0 "[ . 1 . 2]" 1
442 1 17 VAL HA 1 18 SER H . . 2.640 2.205 2.176 2.259 . 0 0 "[ . 1 . 2]" 1
443 1 18 SER H 1 18 SER HB3 . . 3.160 2.503 2.480 2.525 . 0 0 "[ . 1 . 2]" 1
444 1 18 SER H 1 18 SER HB2 . . 3.390 2.756 2.674 2.822 . 0 0 "[ . 1 . 2]" 1
445 1 17 VAL HB 1 18 SER H . . 4.090 3.541 2.954 4.072 . 0 0 "[ . 1 . 2]" 1
446 1 18 SER H 1 98 LEU HG . . 5.500 5.104 4.908 5.323 . 0 0 "[ . 1 . 2]" 1
447 1 18 SER H 1 24 ILE MG . . 4.750 4.577 4.426 4.660 . 0 0 "[ . 1 . 2]" 1
448 1 18 SER H 1 24 ILE MD . . 5.500 5.532 5.498 5.574 0.074 6 0 "[ . 1 . 2]" 1
449 1 17 VAL H 1 18 SER H . . 4.390 4.266 4.184 4.343 . 0 0 "[ . 1 . 2]" 1
450 1 39 GLN H 1 40 GLY H . . 3.010 2.973 2.898 3.024 0.014 19 0 "[ . 1 . 2]" 1
451 1 40 GLY H 1 81 TYR H . . 3.980 3.782 3.679 3.934 . 0 0 "[ . 1 . 2]" 1
452 1 40 GLY H 1 82 ASN HA . . 4.300 3.830 3.643 3.978 . 0 0 "[ . 1 . 2]" 1
453 1 39 GLN QG 1 40 GLY H . . 4.490 4.178 4.070 4.301 . 0 0 "[ . 1 . 2]" 1
454 1 39 GLN HB2 1 40 GLY H . . 3.960 2.649 2.540 2.757 . 0 0 "[ . 1 . 2]" 1
455 1 39 GLN HB3 1 40 GLY H . . 3.960 3.458 3.306 3.645 . 0 0 "[ . 1 . 2]" 1
456 1 40 GLY H 1 80 ALA MB . . 5.500 5.323 5.177 5.496 . 0 0 "[ . 1 . 2]" 1
457 1 38 VAL MG2 1 40 GLY H . . 4.840 4.724 4.617 4.837 . 0 0 "[ . 1 . 2]" 1
458 1 38 VAL MG1 1 40 GLY H . . 3.160 2.194 1.969 2.448 . 0 0 "[ . 1 . 2]" 1
459 1 66 GLU HB2 1 68 LEU H . . 5.500 5.551 5.530 5.591 0.091 13 0 "[ . 1 . 2]" 1
460 1 67 GLY H 1 68 LEU H . . 3.260 2.313 2.226 2.365 . 0 0 "[ . 1 . 2]" 1
461 1 66 GLU HA 1 68 LEU H . . 4.000 3.513 3.440 3.588 . 0 0 "[ . 1 . 2]" 1
462 1 22 THR HB 1 68 LEU H . . 3.160 2.010 1.894 2.130 . 0 0 "[ . 1 . 2]" 1
463 1 22 THR HA 1 68 LEU H . . 4.080 4.088 3.943 4.145 0.065 10 0 "[ . 1 . 2]" 1
464 1 68 LEU H 1 68 LEU HB3 . . 3.830 3.682 3.651 3.715 . 0 0 "[ . 1 . 2]" 1
465 1 68 LEU H 1 97 THR MG . . 5.130 4.806 4.650 4.905 . 0 0 "[ . 1 . 2]" 1
466 1 68 LEU H 1 68 LEU HB2 . . 2.950 2.528 2.482 2.591 . 0 0 "[ . 1 . 2]" 1
467 1 68 LEU H 1 68 LEU HG . . 3.170 2.722 2.614 2.823 . 0 0 "[ . 1 . 2]" 1
468 1 68 LEU H 1 68 LEU MD1 . . 3.480 3.287 3.186 3.377 . 0 0 "[ . 1 . 2]" 1
469 1 14 LEU H 1 15 GLN H . . 4.650 4.457 4.392 4.528 . 0 0 "[ . 1 . 2]" 1
470 1 13 ASN H 1 14 LEU H . . 3.360 2.976 2.818 3.059 . 0 0 "[ . 1 . 2]" 1
471 1 12 GLU HA 1 14 LEU H . . 3.920 3.495 3.236 3.612 . 0 0 "[ . 1 . 2]" 1
472 1 13 ASN HA 1 14 LEU H . . 3.030 2.759 2.700 2.906 . 0 0 "[ . 1 . 2]" 1
473 1 13 ASN HB2 1 14 LEU H . . 4.690 4.290 4.176 4.361 . 0 0 "[ . 1 . 2]" 1
474 1 14 LEU H 1 28 TRP HB2 . . 5.500 5.396 5.038 5.508 0.008 12 0 "[ . 1 . 2]" 1
475 1 13 ASN HB3 1 14 LEU H . . 4.690 4.411 4.349 4.465 . 0 0 "[ . 1 . 2]" 1
476 1 12 GLU HB2 1 14 LEU H . . 5.370 5.148 4.564 5.382 0.012 15 0 "[ . 1 . 2]" 1
477 1 14 LEU H 1 14 LEU HB3 . . 2.890 2.319 2.271 2.362 . 0 0 "[ . 1 . 2]" 1
478 1 14 LEU H 1 14 LEU HG . . 4.360 4.311 4.236 4.367 0.007 12 0 "[ . 1 . 2]" 1
479 1 14 LEU H 1 14 LEU HB2 . . 3.040 2.915 2.838 3.001 . 0 0 "[ . 1 . 2]" 1
480 1 11 VAL MG2 1 14 LEU H . . 4.060 4.022 3.838 4.079 0.019 9 0 "[ . 1 . 2]" 1
481 1 14 LEU H 1 14 LEU MD2 . . 4.070 4.022 3.963 4.077 0.007 18 0 "[ . 1 . 2]" 1
482 1 20 SER H 1 23 SER HB3 . . 5.500 4.230 2.580 5.078 . 0 0 "[ . 1 . 2]" 1
483 1 20 SER H 1 98 LEU H . . 4.670 4.295 3.959 4.626 . 0 0 "[ . 1 . 2]" 1
484 1 16 ALA HA 1 17 VAL H . . 2.620 2.178 2.144 2.217 . 0 0 "[ . 1 . 2]" 1
485 1 17 VAL H 1 25 LEU HB3 . . 4.320 3.045 2.987 3.137 . 0 0 "[ . 1 . 2]" 1
486 1 17 VAL H 1 26 ILE HG13 . . 4.840 4.656 4.545 4.834 . 0 0 "[ . 1 . 2]" 1
487 1 17 VAL H 1 24 ILE MG . . 3.470 3.348 3.101 3.504 0.034 5 0 "[ . 1 . 2]" 1
488 1 17 VAL H 1 25 LEU H . . 3.600 2.931 2.718 3.074 . 0 0 "[ . 1 . 2]" 1
489 1 17 VAL H 1 17 VAL HB . . 4.020 3.628 3.343 3.941 . 0 0 "[ . 1 . 2]" 1
490 1 16 ALA MB 1 17 VAL H . . 3.310 3.036 2.875 3.204 . 0 0 "[ . 1 . 2]" 1
491 1 92 ASP H 1 92 ASP HB3 . . 3.780 3.098 2.289 3.604 . 0 0 "[ . 1 . 2]" 1
492 1 77 ARG HB2 1 92 ASP H . . 5.500 5.307 4.886 5.497 . 0 0 "[ . 1 . 2]" 1
493 1 20 SER H 1 21 PRO HD2 . . 4.930 4.891 4.802 4.939 0.009 12 0 "[ . 1 . 2]" 1
494 1 18 SER HA 1 20 SER H . . 3.740 3.690 3.566 3.792 0.052 14 0 "[ . 1 . 2]" 1
495 1 19 THR HA 1 20 SER H . . 3.410 3.121 2.932 3.348 . 0 0 "[ . 1 . 2]" 1
496 1 18 SER HG 1 20 SER H . . 3.220 3.070 2.939 3.184 . 0 0 "[ . 1 . 2]" 1
497 1 20 SER H 1 23 SER HB2 . . 5.500 4.406 2.860 5.201 . 0 0 "[ . 1 . 2]" 1
498 1 20 SER H 1 98 LEU HG . . 3.890 2.763 2.355 3.197 . 0 0 "[ . 1 . 2]" 1
499 1 19 THR MG 1 20 SER H . . 4.270 4.058 3.867 4.257 . 0 0 "[ . 1 . 2]" 1
500 1 20 SER H 1 98 LEU MD2 . . 4.520 3.865 3.487 4.255 . 0 0 "[ . 1 . 2]" 1
501 1 20 SER H 1 98 LEU MD1 . . 3.550 2.457 2.087 2.821 . 0 0 "[ . 1 . 2]" 1
502 1 82 ASN H 1 84 TYR H . . 4.270 4.101 3.850 4.290 0.020 12 0 "[ . 1 . 2]" 1
503 1 84 TYR H 1 84 TYR QE . . 4.810 4.280 4.018 4.722 . 0 0 "[ . 1 . 2]" 1
504 1 83 ARG HB2 1 84 TYR H . . 4.530 3.805 3.609 4.124 . 0 0 "[ . 1 . 2]" 1
505 1 68 LEU H 1 69 LYS H . . 4.580 4.441 4.415 4.466 . 0 0 "[ . 1 . 2]" 1
506 1 69 LYS H 1 74 TYR QE . . 3.740 2.070 1.933 2.230 . 0 0 "[ . 1 . 2]" 1
507 1 68 LEU HA 1 69 LYS H . . 3.170 2.642 2.599 2.692 . 0 0 "[ . 1 . 2]" 1
508 1 69 LYS H 1 72 THR HB . . 4.480 3.791 3.678 3.885 . 0 0 "[ . 1 . 2]" 1
509 1 69 LYS H 1 69 LYS HB3 . . 3.750 3.578 3.512 3.614 . 0 0 "[ . 1 . 2]" 1
510 1 68 LEU HB3 1 69 LYS H . . 3.120 1.982 1.918 2.070 . 0 0 "[ . 1 . 2]" 1
511 1 69 LYS H 1 97 THR MG . . 4.410 3.478 3.268 3.593 . 0 0 "[ . 1 . 2]" 1
512 1 68 LEU HB2 1 69 LYS H . . 3.410 3.102 2.996 3.192 . 0 0 "[ . 1 . 2]" 1
513 1 69 LYS H 1 72 THR MG . . 4.780 4.713 4.564 4.806 0.026 1 0 "[ . 1 . 2]" 1
514 1 68 LEU MD2 1 69 LYS H . . 3.600 3.342 3.197 3.512 . 0 0 "[ . 1 . 2]" 1
515 1 83 ARG H 1 84 TYR H . . 4.400 2.985 2.830 3.128 . 0 0 "[ . 1 . 2]" 1
516 1 84 TYR H 1 84 TYR QD . . 3.500 2.988 2.585 3.225 . 0 0 "[ . 1 . 2]" 1
517 1 82 ASN HB2 1 84 TYR H . . 4.320 3.459 2.871 4.143 . 0 0 "[ . 1 . 2]" 1
518 1 84 TYR H 1 84 TYR HB2 . . 3.780 2.626 2.380 2.745 . 0 0 "[ . 1 . 2]" 1
519 1 84 TYR H 1 84 TYR HB3 . . 3.780 3.588 3.575 3.599 . 0 0 "[ . 1 . 2]" 1
520 1 83 ARG HB3 1 84 TYR H . . 4.530 3.723 2.725 3.989 . 0 0 "[ . 1 . 2]" 1
521 1 83 ARG HG2 1 84 TYR H . . 4.070 2.741 2.051 4.030 . 0 0 "[ . 1 . 2]" 1
522 1 83 ARG HG3 1 84 TYR H . . 4.070 2.490 1.943 4.073 0.003 1 0 "[ . 1 . 2]" 1
523 1 9 GLY H 1 33 TYR QD . . 5.110 4.295 3.582 5.110 0.000 10 0 "[ . 1 . 2]" 1
524 1 8 PRO HA 1 9 GLY H . . 3.020 2.376 2.157 2.611 . 0 0 "[ . 1 . 2]" 1
525 1 9 GLY H 1 10 PRO HD3 . . 5.130 5.100 4.968 5.127 . 0 0 "[ . 1 . 2]" 1
526 1 9 GLY H 1 35 ASN HB2 . . 5.500 4.887 3.861 5.541 0.041 8 0 "[ . 1 . 2]" 1
527 1 9 GLY H 1 35 ASN HB3 . . 5.500 5.247 4.723 5.525 0.025 11 0 "[ . 1 . 2]" 1
528 1 8 PRO HB2 1 9 GLY H . . 3.810 2.757 2.142 3.555 . 0 0 "[ . 1 . 2]" 1
529 1 8 PRO HB3 1 9 GLY H . . 4.080 3.552 3.239 4.017 . 0 0 "[ . 1 . 2]" 1
530 1 9 GLY H 1 31 PRO HB2 . . 4.630 4.132 3.689 4.649 0.019 17 0 "[ . 1 . 2]" 1
531 1 9 GLY H 1 80 ALA MB . . 4.990 4.265 3.740 4.814 . 0 0 "[ . 1 . 2]" 1
532 1 77 ARG H 1 77 ARG HB2 . . 3.680 3.287 3.148 3.414 . 0 0 "[ . 1 . 2]" 1
533 1 57 GLU HG2 1 58 VAL H . . 4.950 4.060 3.883 4.184 . 0 0 "[ . 1 . 2]" 1
534 1 57 GLU HB2 1 58 VAL H . . 4.730 4.563 4.495 4.594 . 0 0 "[ . 1 . 2]" 1
535 1 57 GLU HB3 1 58 VAL H . . 4.380 3.806 3.602 3.935 . 0 0 "[ . 1 . 2]" 1
536 1 76 LEU H 1 77 ARG H . . 4.830 4.523 4.487 4.561 . 0 0 "[ . 1 . 2]" 1
537 1 77 ARG H 1 78 PHE H . . 4.550 4.072 3.972 4.247 . 0 0 "[ . 1 . 2]" 1
538 1 76 LEU HA 1 77 ARG H . . 2.720 2.445 2.339 2.514 . 0 0 "[ . 1 . 2]" 1
539 1 45 CYS HA 1 77 ARG H . . 4.260 4.049 3.851 4.259 . 0 0 "[ . 1 . 2]" 1
540 1 44 PHE HB2 1 77 ARG H . . 3.640 3.289 2.989 3.534 . 0 0 "[ . 1 . 2]" 1
541 1 76 LEU HB2 1 77 ARG H . . 3.870 3.301 3.087 3.564 . 0 0 "[ . 1 . 2]" 1
542 1 77 ARG H 1 77 ARG HB3 . . 4.010 2.886 2.716 3.003 . 0 0 "[ . 1 . 2]" 1
543 1 77 ARG H 1 77 ARG HG2 . . 5.090 4.576 4.419 5.001 . 0 0 "[ . 1 . 2]" 1
544 1 76 LEU HB3 1 77 ARG H . . 3.520 2.422 2.253 2.653 . 0 0 "[ . 1 . 2]" 1
545 1 43 LEU MD1 1 77 ARG H . . 3.910 2.709 2.344 3.030 . 0 0 "[ . 1 . 2]" 1
546 1 31 PRO HA 1 33 TYR H . . 4.370 4.054 3.632 4.371 0.001 1 0 "[ . 1 . 2]" 1
547 1 33 TYR H 1 33 TYR HB3 . . 3.410 3.085 2.865 3.244 . 0 0 "[ . 1 . 2]" 1
548 1 31 PRO HB2 1 33 TYR H . . 4.280 3.477 3.294 3.695 . 0 0 "[ . 1 . 2]" 1
549 1 32 ALA MB 1 33 TYR H . . 3.480 2.642 2.348 2.865 . 0 0 "[ . 1 . 2]" 1
550 1 11 VAL MG2 1 90 THR H . . 5.340 4.901 4.489 5.279 . 0 0 "[ . 1 . 2]" 1
551 1 89 SER QB 1 90 THR H . . 3.510 2.771 2.239 3.461 . 0 0 "[ . 1 . 2]" 1
552 1 78 PHE HB3 1 90 THR H . . 4.500 4.404 3.986 4.507 0.007 14 0 "[ . 1 . 2]" 1
553 1 79 LEU HB2 1 90 THR H . . 4.360 4.219 4.036 4.369 0.009 12 0 "[ . 1 . 2]" 1
554 1 90 THR H 1 90 THR MG . . 3.330 2.351 2.045 2.636 . 0 0 "[ . 1 . 2]" 1
555 1 28 TRP H 1 29 GLU H . . 4.850 4.484 4.440 4.528 . 0 0 "[ . 1 . 2]" 1
556 1 74 TYR H 1 97 THR H . . 4.340 3.829 3.685 3.965 . 0 0 "[ . 1 . 2]" 1
557 1 96 VAL H 1 97 THR H . . 4.480 4.424 4.353 4.474 . 0 0 "[ . 1 . 2]" 1
558 1 74 TYR QD 1 97 THR H . . 4.270 3.228 3.007 3.384 . 0 0 "[ . 1 . 2]" 1
559 1 74 TYR QE 1 97 THR H . . 4.660 4.622 4.388 4.702 0.042 19 0 "[ . 1 . 2]" 1
560 1 97 THR H 1 97 THR HG1 . . 3.800 3.421 3.374 3.476 . 0 0 "[ . 1 . 2]" 1
561 1 96 VAL HA 1 97 THR H . . 2.770 2.142 2.139 2.153 . 0 0 "[ . 1 . 2]" 1
562 1 71 PHE HA 1 97 THR H . . 3.950 3.820 3.706 3.963 0.013 6 0 "[ . 1 . 2]" 1
563 1 72 THR HB 1 97 THR H . . 4.800 4.793 4.707 4.821 0.021 16 0 "[ . 1 . 2]" 1
564 1 97 THR H 1 97 THR MG . . 3.180 2.417 2.350 2.482 . 0 0 "[ . 1 . 2]" 1
565 1 96 VAL MG1 1 97 THR H . . 4.420 2.820 2.654 3.069 . 0 0 "[ . 1 . 2]" 1
566 1 24 ILE MD 1 97 THR H . . 5.100 4.921 4.798 5.071 . 0 0 "[ . 1 . 2]" 1
567 1 28 TRP H 1 62 SER QB . . 4.790 4.570 3.944 4.795 0.005 7 0 "[ . 1 . 2]" 1
568 1 28 TRP H 1 28 TRP HE3 . . 3.800 2.039 1.896 2.153 . 0 0 "[ . 1 . 2]" 1
569 1 28 TRP H 1 61 LEU QB . . 4.460 3.928 3.515 4.385 . 0 0 "[ . 1 . 2]" 1
570 1 26 ILE MG 1 28 TRP H . . 4.520 3.664 3.569 3.809 . 0 0 "[ . 1 . 2]" 1
571 1 87 GLY H 1 88 VAL H . . 4.210 4.081 3.985 4.175 . 0 0 "[ . 1 . 2]" 1
572 1 87 GLY HA2 1 88 VAL H . . 3.140 3.040 2.953 3.099 . 0 0 "[ . 1 . 2]" 1
573 1 9 GLY HA2 1 88 VAL H . . 4.240 3.561 3.307 3.948 . 0 0 "[ . 1 . 2]" 1
574 1 87 GLY HA3 1 88 VAL H . . 3.170 2.196 2.170 2.242 . 0 0 "[ . 1 . 2]" 1
575 1 10 PRO HD3 1 88 VAL H . . 4.630 3.964 3.682 4.435 . 0 0 "[ . 1 . 2]" 1
576 1 8 PRO HD2 1 88 VAL H . . 5.000 4.667 4.460 4.878 . 0 0 "[ . 1 . 2]" 1
577 1 10 PRO QB 1 88 VAL H . . 5.310 4.994 4.724 5.330 0.020 17 0 "[ . 1 . 2]" 1
578 1 88 VAL H 1 88 VAL HB . . 3.070 2.491 2.199 2.603 . 0 0 "[ . 1 . 2]" 1
579 1 88 VAL H 1 88 VAL MG2 . . 3.940 2.409 2.022 3.613 . 0 0 "[ . 1 . 2]" 1
580 1 10 PRO HA 1 88 VAL H . . 5.020 4.868 4.473 5.022 0.002 19 0 "[ . 1 . 2]" 1
581 1 12 GLU H 1 29 GLU H . . 3.880 3.294 3.000 3.487 . 0 0 "[ . 1 . 2]" 1
582 1 28 TRP HD1 1 29 GLU H . . 4.100 3.336 3.062 3.885 . 0 0 "[ . 1 . 2]" 1
583 1 28 TRP HB2 1 29 GLU H . . 3.270 2.274 2.074 2.679 . 0 0 "[ . 1 . 2]" 1
584 1 11 VAL HB 1 29 GLU H . . 4.240 2.858 2.637 3.157 . 0 0 "[ . 1 . 2]" 1
585 1 29 GLU H 1 29 GLU HG2 . . 4.600 4.317 3.673 4.657 0.057 20 0 "[ . 1 . 2]" 1
586 1 29 GLU H 1 29 GLU HB3 . . 4.010 3.687 3.590 3.734 . 0 0 "[ . 1 . 2]" 1
587 1 29 GLU H 1 29 GLU HG3 . . 4.600 4.092 3.742 4.538 . 0 0 "[ . 1 . 2]" 1
588 1 12 GLU HB2 1 29 GLU H . . 5.500 4.963 4.415 5.512 0.012 7 0 "[ . 1 . 2]" 1
589 1 29 GLU H 1 29 GLU HB2 . . 3.440 2.652 2.455 2.776 . 0 0 "[ . 1 . 2]" 1
590 1 11 VAL MG1 1 29 GLU H . . 4.520 4.048 3.879 4.395 . 0 0 "[ . 1 . 2]" 1
591 1 14 LEU HB2 1 29 GLU H . . 4.750 3.957 3.773 4.138 . 0 0 "[ . 1 . 2]" 1
592 1 11 VAL MG2 1 29 GLU H . . 4.730 3.377 3.237 3.639 . 0 0 "[ . 1 . 2]" 1
593 1 19 THR H 1 19 THR MG . . 4.120 2.276 2.139 2.425 . 0 0 "[ . 1 . 2]" 1
594 1 18 SER HA 1 19 THR H . . 3.550 2.172 2.144 2.235 . 0 0 "[ . 1 . 2]" 1
595 1 8 PRO HA 1 35 ASN H . . 3.750 1.997 1.897 2.284 . 0 0 "[ . 1 . 2]" 1
596 1 18 SER HG 1 19 THR H . . 4.240 3.362 3.120 3.552 . 0 0 "[ . 1 . 2]" 1
597 1 19 THR H 1 98 LEU MD1 . . 4.520 3.918 3.758 4.289 . 0 0 "[ . 1 . 2]" 1
598 1 71 PHE H 1 97 THR HG1 . . 3.600 3.496 3.398 3.574 . 0 0 "[ . 1 . 2]" 1
599 1 71 PHE H 1 71 PHE QD . . 4.360 4.291 4.274 4.364 0.004 13 0 "[ . 1 . 2]" 1
600 1 71 PHE H 1 99 SER HA . . 4.860 4.712 4.116 4.856 . 0 0 "[ . 1 . 2]" 1
601 1 71 PHE H 1 71 PHE HB3 . . 3.710 2.763 2.747 2.838 . 0 0 "[ . 1 . 2]" 1
602 1 71 PHE H 1 71 PHE HB2 . . 3.560 3.084 2.889 3.120 . 0 0 "[ . 1 . 2]" 1
603 1 70 LYS HB2 1 71 PHE H . . 3.780 3.301 3.222 3.451 . 0 0 "[ . 1 . 2]" 1
604 1 70 LYS HB3 1 71 PHE H . . 3.780 1.866 1.833 1.888 . 0 0 "[ . 1 . 2]" 1
605 1 70 LYS HG3 1 71 PHE H . . 4.610 4.146 3.563 4.402 . 0 0 "[ . 1 . 2]" 1
606 1 70 LYS HG2 1 71 PHE H . . 4.610 3.608 2.949 4.051 . 0 0 "[ . 1 . 2]" 1
607 1 13 ASN H 1 13 ASN HD21 . . 5.470 3.995 3.282 4.547 . 0 0 "[ . 1 . 2]" 1
608 1 12 GLU HA 1 13 ASN H . . 2.770 2.547 2.487 2.616 . 0 0 "[ . 1 . 2]" 1
609 1 13 ASN H 1 13 ASN HA . . 2.710 2.300 2.281 2.317 . 0 0 "[ . 1 . 2]" 1
610 1 13 ASN H 1 13 ASN HB3 . . 4.140 3.982 3.923 4.049 . 0 0 "[ . 1 . 2]" 1
611 1 12 GLU HG3 1 13 ASN H . . 5.140 4.672 4.258 4.930 . 0 0 "[ . 1 . 2]" 1
612 1 12 GLU HB2 1 13 ASN H . . 3.520 2.888 2.149 3.199 . 0 0 "[ . 1 . 2]" 1
613 1 12 GLU HB3 1 13 ASN H . . 3.840 2.511 2.060 3.306 . 0 0 "[ . 1 . 2]" 1
614 1 71 PHE H 1 72 THR HB . . 5.040 4.939 4.840 5.033 . 0 0 "[ . 1 . 2]" 1
615 1 48 VAL H 1 49 SER H . . 3.510 2.740 2.535 2.960 . 0 0 "[ . 1 . 2]" 1
616 1 48 VAL H 1 74 TYR QD . . 4.550 3.698 3.474 3.971 . 0 0 "[ . 1 . 2]" 1
617 1 48 VAL H 1 74 TYR QE . . 4.990 4.727 4.457 4.980 . 0 0 "[ . 1 . 2]" 1
618 1 48 VAL H 1 75 SER QB . . 5.000 4.363 3.859 4.947 . 0 0 "[ . 1 . 2]" 1
619 1 47 GLU HB3 1 48 VAL H . . 4.630 4.337 4.165 4.461 . 0 0 "[ . 1 . 2]" 1
620 1 47 GLU H 1 48 VAL H . . 4.520 4.274 3.983 4.460 . 0 0 "[ . 1 . 2]" 1
621 1 48 VAL H 1 74 TYR HA . . 3.400 2.907 2.768 2.983 . 0 0 "[ . 1 . 2]" 1
622 1 47 GLU HA 1 48 VAL H . . 2.880 2.182 2.138 2.251 . 0 0 "[ . 1 . 2]" 1
623 1 48 VAL H 1 49 SER QB . . 5.060 4.491 4.279 4.849 . 0 0 "[ . 1 . 2]" 1
624 1 48 VAL H 1 74 TYR HB3 . . 5.500 5.164 4.980 5.347 . 0 0 "[ . 1 . 2]" 1
625 1 48 VAL H 1 48 VAL HB . . 3.080 2.611 2.522 2.699 . 0 0 "[ . 1 . 2]" 1
626 1 48 VAL H 1 48 VAL MG1 . . 4.030 3.768 3.763 3.773 . 0 0 "[ . 1 . 2]" 1
627 1 13 ASN H 1 14 LEU HB2 . . 5.500 5.297 5.197 5.421 . 0 0 "[ . 1 . 2]" 1
628 1 71 PHE HB3 1 72 THR H . . 4.580 4.393 4.327 4.407 . 0 0 "[ . 1 . 2]" 1
629 1 71 PHE HB2 1 72 THR H . . 4.750 4.516 4.498 4.577 . 0 0 "[ . 1 . 2]" 1
630 1 72 THR H 1 73 GLU H . . 4.560 4.113 4.018 4.294 . 0 0 "[ . 1 . 2]" 1
631 1 71 PHE H 1 72 THR H . . 4.140 3.944 3.918 3.969 . 0 0 "[ . 1 . 2]" 1
632 1 72 THR H 1 74 TYR QE . . 4.040 3.873 3.553 4.014 . 0 0 "[ . 1 . 2]" 1
633 1 72 THR H 1 97 THR HG1 . . 2.980 2.251 2.170 2.327 . 0 0 "[ . 1 . 2]" 1
634 1 72 THR H 1 96 VAL HA . . 4.100 3.955 3.877 4.017 . 0 0 "[ . 1 . 2]" 1
635 1 71 PHE HA 1 72 THR H . . 3.160 2.183 2.175 2.191 . 0 0 "[ . 1 . 2]" 1
636 1 72 THR H 1 72 THR HG1 . . 3.680 3.363 3.182 3.643 . 0 0 "[ . 1 . 2]" 1
637 1 72 THR H 1 72 THR HB . . 3.190 2.890 2.834 2.916 . 0 0 "[ . 1 . 2]" 1
638 1 69 LYS HB2 1 72 THR H . . 4.430 4.305 4.170 4.484 0.054 20 0 "[ . 1 . 2]" 1
639 1 72 THR H 1 97 THR MG . . 3.800 3.587 3.501 3.647 . 0 0 "[ . 1 . 2]" 1
640 1 27 THR H 1 28 TRP H . . 4.510 4.079 4.013 4.146 . 0 0 "[ . 1 . 2]" 1
641 1 27 THR H 1 28 TRP HE3 . . 4.120 3.898 3.717 3.991 . 0 0 "[ . 1 . 2]" 1
642 1 14 LEU MD1 1 27 THR H . . 4.710 4.469 4.171 4.675 . 0 0 "[ . 1 . 2]" 1
643 1 17 VAL H 1 27 THR H . . 4.990 4.868 4.740 4.995 0.005 1 0 "[ . 1 . 2]" 1
644 1 16 ALA HA 1 27 THR H . . 3.720 3.258 3.172 3.410 . 0 0 "[ . 1 . 2]" 1
645 1 26 ILE HA 1 27 THR H . . 2.710 2.148 2.141 2.154 . 0 0 "[ . 1 . 2]" 1
646 1 27 THR H 1 27 THR HB . . 4.200 3.742 3.720 3.783 . 0 0 "[ . 1 . 2]" 1
647 1 15 GLN HB3 1 27 THR H . . 4.790 4.704 4.459 4.797 0.007 18 0 "[ . 1 . 2]" 1
648 1 15 GLN HB2 1 27 THR H . . 4.220 4.156 3.754 4.237 0.017 13 0 "[ . 1 . 2]" 1
649 1 27 THR H 1 27 THR MG . . 3.440 2.825 2.740 2.924 . 0 0 "[ . 1 . 2]" 1
650 1 26 ILE MG 1 27 THR H . . 3.230 3.018 2.864 3.097 . 0 0 "[ . 1 . 2]" 1
651 1 35 ASN H 1 84 TYR QD . . 5.500 5.414 5.229 5.508 0.008 15 0 "[ . 1 . 2]" 1
652 1 18 SER HB2 1 19 THR H . . 5.060 4.170 4.031 4.250 . 0 0 "[ . 1 . 2]" 1
653 1 47 GLU H 1 54 GLN H . . 5.380 5.237 4.973 5.408 0.028 20 0 "[ . 1 . 2]" 1
654 1 47 GLU H 1 74 TYR QD . . 4.590 4.180 4.051 4.443 . 0 0 "[ . 1 . 2]" 1
655 1 47 GLU H 1 74 TYR QE . . 4.790 4.273 3.870 4.597 . 0 0 "[ . 1 . 2]" 1
656 1 47 GLU H 1 50 THR HG1 . . 4.710 4.498 3.914 4.713 0.003 13 0 "[ . 1 . 2]" 1
657 1 46 THR HA 1 47 GLU H . . 2.730 2.166 2.143 2.206 . 0 0 "[ . 1 . 2]" 1
658 1 47 GLU H 1 47 GLU HB3 . . 3.220 2.570 2.475 2.650 . 0 0 "[ . 1 . 2]" 1
659 1 47 GLU H 1 47 GLU HB2 . . 3.160 2.618 2.435 2.843 . 0 0 "[ . 1 . 2]" 1
660 1 45 CYS HG 1 47 GLU H . . 5.450 4.261 3.432 4.823 . 0 0 "[ . 1 . 2]" 1
661 1 82 ASN HB3 1 83 ARG H . . 4.850 3.531 3.280 3.703 . 0 0 "[ . 1 . 2]" 1
662 1 82 ASN HB2 1 83 ARG H . . 4.640 2.120 1.950 2.311 . 0 0 "[ . 1 . 2]" 1
663 1 26 ILE H 1 28 TRP HZ3 . . 4.870 4.149 4.047 4.244 . 0 0 "[ . 1 . 2]" 1
664 1 26 ILE H 1 63 TYR QD . . 5.020 4.395 4.198 4.534 . 0 0 "[ . 1 . 2]" 1
665 1 26 ILE H 1 63 TYR H . . 3.790 3.086 2.965 3.213 . 0 0 "[ . 1 . 2]" 1
666 1 26 ILE H 1 27 THR H . . 4.840 4.305 4.265 4.358 . 0 0 "[ . 1 . 2]" 1
667 1 25 LEU HA 1 26 ILE H . . 2.890 2.178 2.164 2.200 . 0 0 "[ . 1 . 2]" 1
668 1 26 ILE H 1 26 ILE HB . . 3.410 2.671 2.623 2.703 . 0 0 "[ . 1 . 2]" 1
669 1 26 ILE H 1 26 ILE HG13 . . 3.930 2.232 2.132 2.339 . 0 0 "[ . 1 . 2]" 1
670 1 25 LEU HG 1 26 ILE H . . 3.890 3.755 3.640 3.892 0.002 13 0 "[ . 1 . 2]" 1
671 1 26 ILE H 1 26 ILE HG12 . . 3.840 3.730 3.651 3.818 . 0 0 "[ . 1 . 2]" 1
672 1 65 LEU H 1 66 GLU H . . 4.840 4.605 4.585 4.620 . 0 0 "[ . 1 . 2]" 1
673 1 26 ILE H 1 65 LEU H . . 4.430 4.135 3.997 4.286 . 0 0 "[ . 1 . 2]" 1
674 1 24 ILE H 1 65 LEU H . . 3.620 2.638 2.420 2.740 . 0 0 "[ . 1 . 2]" 1
675 1 63 TYR QD 1 65 LEU H . . 4.260 3.509 3.314 3.742 . 0 0 "[ . 1 . 2]" 1
676 1 23 SER HA 1 65 LEU H . . 4.650 4.518 4.378 4.660 0.010 16 0 "[ . 1 . 2]" 1
677 1 25 LEU HA 1 65 LEU H . . 3.710 3.571 3.298 3.723 0.013 9 0 "[ . 1 . 2]" 1
678 1 65 LEU H 1 65 LEU HB3 . . 3.250 2.869 2.823 2.902 . 0 0 "[ . 1 . 2]" 1
679 1 65 LEU H 1 65 LEU HG . . 4.510 4.491 4.463 4.530 0.020 17 0 "[ . 1 . 2]" 1
680 1 65 LEU H 1 65 LEU HB2 . . 3.280 2.267 2.217 2.358 . 0 0 "[ . 1 . 2]" 1
681 1 64 LYS QG 1 65 LEU H . . 3.680 3.147 2.831 3.594 . 0 0 "[ . 1 . 2]" 1
682 1 65 LEU H 1 65 LEU MD1 . . 4.160 3.713 3.595 3.859 . 0 0 "[ . 1 . 2]" 1
683 1 65 LEU H 1 68 LEU MD1 . . 4.840 4.684 4.514 4.806 . 0 0 "[ . 1 . 2]" 1
684 1 11 VAL H 1 12 GLU H . . 4.940 4.626 4.547 4.647 . 0 0 "[ . 1 . 2]" 1
685 1 10 PRO HA 1 11 VAL H . . 3.090 2.161 2.151 2.217 . 0 0 "[ . 1 . 2]" 1
686 1 11 VAL H 1 11 VAL HB . . 3.670 3.617 3.609 3.628 . 0 0 "[ . 1 . 2]" 1
687 1 10 PRO QB 1 11 VAL H . . 3.640 3.298 3.011 3.434 . 0 0 "[ . 1 . 2]" 1
688 1 11 VAL H 1 31 PRO HB2 . . 5.500 5.508 5.457 5.567 0.067 17 0 "[ . 1 . 2]" 1
689 1 11 VAL H 1 90 THR MG . . 4.300 3.523 3.188 3.838 . 0 0 "[ . 1 . 2]" 1
690 1 11 VAL H 1 11 VAL MG1 . . 3.440 2.066 1.868 2.325 . 0 0 "[ . 1 . 2]" 1
691 1 11 VAL H 1 11 VAL MG2 . . 3.180 2.258 2.048 2.444 . 0 0 "[ . 1 . 2]" 1
692 1 74 TYR QD 1 75 SER H . . 4.630 3.216 3.068 3.399 . 0 0 "[ . 1 . 2]" 1
693 1 46 THR H 1 75 SER H . . 3.570 3.471 3.190 3.581 0.011 17 0 "[ . 1 . 2]" 1
694 1 48 VAL H 1 75 SER H . . 4.180 3.505 3.206 3.771 . 0 0 "[ . 1 . 2]" 1
695 1 74 TYR HA 1 75 SER H . . 2.790 2.248 2.175 2.327 . 0 0 "[ . 1 . 2]" 1
696 1 75 SER H 1 75 SER QB . . 3.250 2.683 2.406 3.110 . 0 0 "[ . 1 . 2]" 1
697 1 74 TYR HB3 1 75 SER H . . 3.630 2.897 2.653 3.185 . 0 0 "[ . 1 . 2]" 1
698 1 74 TYR HB2 1 75 SER H . . 4.260 4.105 3.955 4.279 0.019 11 0 "[ . 1 . 2]" 1
699 1 75 SER H 1 76 LEU HG . . 4.990 4.532 4.317 4.742 . 0 0 "[ . 1 . 2]" 1
700 1 75 SER H 1 76 LEU H . . 4.550 4.164 4.076 4.280 . 0 0 "[ . 1 . 2]" 1
701 1 97 THR H 1 98 LEU H . . 5.040 4.644 4.639 4.647 . 0 0 "[ . 1 . 2]" 1
702 1 98 LEU H 1 99 SER H . . 4.640 4.538 4.524 4.550 . 0 0 "[ . 1 . 2]" 1
703 1 97 THR HG1 1 98 LEU H . . 4.720 4.561 4.428 4.654 . 0 0 "[ . 1 . 2]" 1
704 1 18 SER HA 1 98 LEU H . . 5.500 5.530 5.475 5.571 0.071 2 0 "[ . 1 . 2]" 1
705 1 97 THR HA 1 98 LEU H . . 2.980 2.300 2.267 2.350 . 0 0 "[ . 1 . 2]" 1
706 1 18 SER HB3 1 98 LEU H . . 3.850 3.053 2.955 3.191 . 0 0 "[ . 1 . 2]" 1
707 1 98 LEU H 1 98 LEU HG . . 3.010 2.036 1.992 2.110 . 0 0 "[ . 1 . 2]" 1
708 1 97 THR MG 1 98 LEU H . . 3.780 3.476 3.409 3.529 . 0 0 "[ . 1 . 2]" 1
709 1 98 LEU H 1 98 LEU HB2 . . 3.370 2.689 2.643 2.727 . 0 0 "[ . 1 . 2]" 1
710 1 98 LEU H 1 98 LEU MD1 . . 3.760 3.662 3.633 3.714 . 0 0 "[ . 1 . 2]" 1
711 1 19 THR H 1 25 LEU H . . 4.480 4.053 3.838 4.275 . 0 0 "[ . 1 . 2]" 1
712 1 16 ALA HA 1 25 LEU H . . 4.880 4.595 4.459 4.681 . 0 0 "[ . 1 . 2]" 1
713 1 18 SER HA 1 25 LEU H . . 3.590 2.799 2.662 2.939 . 0 0 "[ . 1 . 2]" 1
714 1 24 ILE HA 1 25 LEU H . . 2.890 2.167 2.163 2.168 . 0 0 "[ . 1 . 2]" 1
715 1 18 SER HG 1 25 LEU H . . 5.230 5.058 4.893 5.165 . 0 0 "[ . 1 . 2]" 1
716 1 18 SER HB2 1 25 LEU H . . 5.250 4.569 4.390 4.777 . 0 0 "[ . 1 . 2]" 1
717 1 25 LEU H 1 25 LEU HB3 . . 3.220 2.613 2.569 2.675 . 0 0 "[ . 1 . 2]" 1
718 1 25 LEU H 1 25 LEU HB2 . . 3.450 2.539 2.485 2.588 . 0 0 "[ . 1 . 2]" 1
719 1 19 THR MG 1 25 LEU H . . 3.760 3.716 3.563 3.807 0.047 12 0 "[ . 1 . 2]" 1
720 1 16 ALA MB 1 25 LEU H . . 5.310 4.528 4.352 4.734 . 0 0 "[ . 1 . 2]" 1
721 1 25 LEU H 1 64 LYS QG . . 5.500 4.483 4.171 5.080 . 0 0 "[ . 1 . 2]" 1
722 1 24 ILE MG 1 25 LEU H . . 3.220 3.130 3.059 3.166 . 0 0 "[ . 1 . 2]" 1
723 1 64 LYS H 1 65 LEU H . . 4.530 4.343 4.234 4.465 . 0 0 "[ . 1 . 2]" 1
724 1 63 TYR QD 1 64 LYS H . . 3.820 3.663 3.546 3.778 . 0 0 "[ . 1 . 2]" 1
725 1 63 TYR HA 1 64 LYS H . . 2.680 2.141 2.137 2.153 . 0 0 "[ . 1 . 2]" 1
726 1 63 TYR HB2 1 64 LYS H . . 4.330 4.303 4.228 4.371 0.041 19 0 "[ . 1 . 2]" 1
727 1 63 TYR HB3 1 64 LYS H . . 4.530 4.252 4.151 4.352 . 0 0 "[ . 1 . 2]" 1
728 1 64 LYS H 1 64 LYS HB2 . . 3.280 2.555 2.412 2.826 . 0 0 "[ . 1 . 2]" 1
729 1 64 LYS H 1 64 LYS HB3 . . 3.280 2.691 2.416 2.787 . 0 0 "[ . 1 . 2]" 1
730 1 64 LYS H 1 64 LYS QG . . 4.200 4.002 3.957 4.109 . 0 0 "[ . 1 . 2]" 1
731 1 41 TYR H 1 81 TYR QE . . 4.020 3.098 2.587 3.433 . 0 0 "[ . 1 . 2]" 1
732 1 41 TYR H 1 59 ASP HA . . 4.580 4.356 4.117 4.575 . 0 0 "[ . 1 . 2]" 1
733 1 41 TYR H 1 41 TYR HB3 . . 4.190 3.957 3.916 3.978 . 0 0 "[ . 1 . 2]" 1
734 1 41 TYR H 1 42 ARG QB . . 5.500 5.266 4.987 5.525 0.025 8 0 "[ . 1 . 2]" 1
735 1 41 TYR H 1 41 TYR QD . . 3.650 2.949 2.837 3.190 . 0 0 "[ . 1 . 2]" 1
736 1 40 GLY HA3 1 41 TYR H . . 3.080 2.207 2.169 2.268 . 0 0 "[ . 1 . 2]" 1
737 1 40 GLY HA2 1 41 TYR H . . 3.090 3.019 2.914 3.100 0.010 2 0 "[ . 1 . 2]" 1
738 1 41 TYR H 1 41 TYR HB2 . . 3.640 2.992 2.907 3.054 . 0 0 "[ . 1 . 2]" 1
739 1 41 TYR H 1 58 VAL H . . 4.700 4.601 4.223 4.707 0.007 7 0 "[ . 1 . 2]" 1
740 1 40 GLY H 1 41 TYR H . . 4.380 4.193 4.116 4.274 . 0 0 "[ . 1 . 2]" 1
741 1 52 LYS HA 1 53 GLU H . . 2.590 2.179 2.143 2.265 . 0 0 "[ . 1 . 2]" 1
742 1 53 GLU H 1 53 GLU HG2 . . 4.740 4.398 4.285 4.535 . 0 0 "[ . 1 . 2]" 1
743 1 53 GLU H 1 53 GLU HB3 . . 3.290 2.487 2.394 2.590 . 0 0 "[ . 1 . 2]" 1
744 1 53 GLU H 1 53 GLU HB2 . . 3.290 2.997 2.834 3.162 . 0 0 "[ . 1 . 2]" 1
745 1 52 LYS HB2 1 53 GLU H . . 4.320 4.043 2.803 4.327 0.007 13 0 "[ . 1 . 2]" 1
746 1 46 THR MG 1 53 GLU H . . 4.720 3.620 3.171 3.920 . 0 0 "[ . 1 . 2]" 1
747 1 46 THR H 1 47 GLU H . . 4.620 4.343 4.109 4.457 . 0 0 "[ . 1 . 2]" 1
748 1 46 THR H 1 74 TYR QD . . 5.010 4.258 3.952 4.610 . 0 0 "[ . 1 . 2]" 1
749 1 46 THR H 1 76 LEU HA . . 3.990 3.146 2.907 3.364 . 0 0 "[ . 1 . 2]" 1
750 1 45 CYS HA 1 46 THR H . . 2.770 2.142 2.137 2.157 . 0 0 "[ . 1 . 2]" 1
751 1 46 THR H 1 46 THR HB . . 3.200 2.727 2.630 2.791 . 0 0 "[ . 1 . 2]" 1
752 1 46 THR H 1 74 TYR HB3 . . 4.910 4.610 4.461 4.921 0.011 4 0 "[ . 1 . 2]" 1
753 1 45 CYS HG 1 46 THR H . . 4.270 2.979 2.455 3.923 . 0 0 "[ . 1 . 2]" 1
754 1 46 THR H 1 76 LEU MD2 . . 3.900 2.797 2.372 3.190 . 0 0 "[ . 1 . 2]" 1
755 1 46 THR H 1 77 ARG H . . 5.320 5.227 4.864 5.335 0.015 19 0 "[ . 1 . 2]" 1
756 1 45 CYS HB2 1 46 THR H . . 4.400 4.222 4.145 4.318 . 0 0 "[ . 1 . 2]" 1
757 1 46 THR H 1 46 THR MG . . 4.010 3.892 3.851 3.915 . 0 0 "[ . 1 . 2]" 1
758 1 92 ASP H 1 93 ILE H . . 4.500 4.418 4.309 4.507 0.007 16 0 "[ . 1 . 2]" 1
759 1 78 PHE H 1 90 THR H . . 3.910 3.755 3.516 3.927 0.017 6 0 "[ . 1 . 2]" 1
760 1 43 LEU H 1 56 ILE H . . 3.650 3.211 2.932 3.438 . 0 0 "[ . 1 . 2]" 1
761 1 56 ILE H 1 57 GLU H . . 4.410 4.359 4.244 4.426 0.016 1 0 "[ . 1 . 2]" 1
762 1 55 ASN H 1 56 ILE H . . 4.580 4.555 4.497 4.594 0.014 16 0 "[ . 1 . 2]" 1
763 1 82 ASN H 1 87 GLY H . . 4.960 4.599 4.341 4.956 . 0 0 "[ . 1 . 2]" 1
764 1 44 PHE H 1 77 ARG H . . 3.630 2.646 2.521 2.800 . 0 0 "[ . 1 . 2]" 1
765 1 15 GLN H 1 27 THR H . . 3.460 3.162 2.927 3.319 . 0 0 "[ . 1 . 2]" 1
766 1 93 ILE H 1 94 THR H . . 4.480 4.257 4.175 4.364 . 0 0 "[ . 1 . 2]" 1
767 1 72 THR H 1 97 THR H . . 3.120 2.807 2.709 2.918 . 0 0 "[ . 1 . 2]" 1
768 1 74 TYR H 1 95 VAL H . . 3.660 3.436 3.341 3.574 . 0 0 "[ . 1 . 2]" 1
769 1 76 LEU H 1 95 VAL H . . 4.660 4.358 4.207 4.505 . 0 0 "[ . 1 . 2]" 1
770 1 19 THR H 1 20 SER H . . 3.140 2.377 2.007 2.733 . 0 0 "[ . 1 . 2]" 1
771 1 99 SER H 1 100 ASP H . . 4.210 3.865 1.817 4.128 . 0 0 "[ . 1 . 2]" 1
772 1 33 TYR QD 1 34 ALA H . . 4.680 4.427 3.903 4.690 0.010 3 0 "[ . 1 . 2]" 1
773 1 33 TYR H 1 34 ALA H . . 4.490 3.343 2.989 3.623 . 0 0 "[ . 1 . 2]" 1
774 1 41 TYR HA 1 41 TYR QD . . 4.510 3.042 2.890 3.123 . 0 0 "[ . 1 . 2]" 1
775 1 33 TYR H 1 33 TYR QD . . 3.930 2.694 2.103 2.870 . 0 0 "[ . 1 . 2]" 1
776 1 5 SER HA 1 84 TYR QD . . 4.220 3.146 2.430 3.849 . 0 0 "[ . 1 . 2]" 1
777 1 9 GLY HA3 1 33 TYR QD . . 5.100 2.663 2.157 3.262 . 0 0 "[ . 1 . 2]" 1
778 1 10 PRO HD2 1 33 TYR QD . . 5.440 3.274 2.912 4.122 . 0 0 "[ . 1 . 2]" 1
779 1 32 ALA MB 1 33 TYR QD . . 3.710 3.293 2.862 3.715 0.005 17 0 "[ . 1 . 2]" 1
780 1 40 GLY HA3 1 81 TYR QD . . 5.240 5.011 4.725 5.223 . 0 0 "[ . 1 . 2]" 1
781 1 84 TYR HA 1 84 TYR QD . . 3.200 2.227 2.071 2.393 . 0 0 "[ . 1 . 2]" 1
782 1 31 PRO HB2 1 33 TYR QD . . 5.280 4.051 3.483 4.743 . 0 0 "[ . 1 . 2]" 1
783 1 83 ARG HG2 1 84 TYR QD . . 4.750 3.640 2.122 4.539 . 0 0 "[ . 1 . 2]" 1
784 1 7 GLY H 1 84 TYR QD . . 5.370 4.851 2.758 5.381 0.011 17 0 "[ . 1 . 2]" 1
785 1 41 TYR HA 1 81 TYR QD . . 3.890 3.111 2.760 3.436 . 0 0 "[ . 1 . 2]" 1
786 1 81 TYR HA 1 81 TYR QD . . 4.430 3.665 3.621 3.713 . 0 0 "[ . 1 . 2]" 1
787 1 81 TYR QD 1 82 ASN HA . . 4.390 3.194 2.991 3.470 . 0 0 "[ . 1 . 2]" 1
788 1 39 GLN HB2 1 81 TYR QD . . 4.290 2.643 2.231 2.917 . 0 0 "[ . 1 . 2]" 1
789 1 39 GLN HB3 1 81 TYR QD . . 4.290 3.859 3.291 4.186 . 0 0 "[ . 1 . 2]" 1
790 1 81 TYR QD 1 86 PRO HA . . 4.540 4.174 4.010 4.510 . 0 0 "[ . 1 . 2]" 1
791 1 42 ARG QB 1 81 TYR QD . . 3.960 2.424 2.053 2.841 . 0 0 "[ . 1 . 2]" 1
792 1 42 ARG HG3 1 81 TYR QD . . 4.510 3.813 2.672 4.526 0.016 10 0 "[ . 1 . 2]" 1
793 1 83 ARG HG3 1 84 TYR QD . . 4.750 2.934 2.186 3.834 . 0 0 "[ . 1 . 2]" 1
794 1 59 ASP H 1 63 TYR QD . . 4.750 3.806 3.260 4.240 . 0 0 "[ . 1 . 2]" 1
795 1 58 VAL HB 1 63 TYR QD . . 4.110 2.526 2.223 2.953 . 0 0 "[ . 1 . 2]" 1
796 1 63 TYR HA 1 63 TYR QD . . 3.310 3.048 2.815 3.153 . 0 0 "[ . 1 . 2]" 1
797 1 63 TYR QD 1 65 LEU HA . . 4.120 3.510 3.336 3.643 . 0 0 "[ . 1 . 2]" 1
798 1 63 TYR QD 1 65 LEU HG . . 5.010 4.953 4.874 5.042 0.032 17 0 "[ . 1 . 2]" 1
799 1 63 TYR QD 1 65 LEU HB2 . . 3.820 3.377 3.242 3.550 . 0 0 "[ . 1 . 2]" 1
800 1 43 LEU MD2 1 63 TYR QD . . 3.680 3.581 3.402 3.691 0.011 9 0 "[ . 1 . 2]" 1
801 1 58 VAL MG1 1 63 TYR QD . . 3.890 2.559 2.377 2.778 . 0 0 "[ . 1 . 2]" 1
802 1 44 PHE HA 1 44 PHE QD . . 4.010 2.746 2.419 3.030 . 0 0 "[ . 1 . 2]" 1
803 1 44 PHE QD 1 55 ASN HA . . 4.320 2.507 2.027 3.418 . 0 0 "[ . 1 . 2]" 1
804 1 44 PHE QD 1 55 ASN HB3 . . 3.970 2.690 2.401 3.185 . 0 0 "[ . 1 . 2]" 1
805 1 44 PHE QD 1 77 ARG HB2 . . 4.650 4.135 3.707 4.641 . 0 0 "[ . 1 . 2]" 1
806 1 42 ARG QB 1 44 PHE QD . . 4.770 4.229 3.974 4.627 . 0 0 "[ . 1 . 2]" 1
807 1 44 PHE QD 1 79 LEU MD2 . . 3.960 3.376 2.948 3.779 . 0 0 "[ . 1 . 2]" 1
808 1 44 PHE QD 1 77 ARG H . . 4.790 4.149 3.796 4.508 . 0 0 "[ . 1 . 2]" 1
809 1 43 LEU H 1 44 PHE QD . . 5.500 4.988 4.818 5.153 . 0 0 "[ . 1 . 2]" 1
810 1 44 PHE QD 1 78 PHE H . . 5.500 5.083 4.607 5.378 . 0 0 "[ . 1 . 2]" 1
811 1 44 PHE QD 1 78 PHE HA . . 4.640 4.176 3.693 4.610 . 0 0 "[ . 1 . 2]" 1
812 1 44 PHE QD 1 53 GLU HG2 . . 4.610 3.814 2.996 4.496 . 0 0 "[ . 1 . 2]" 1
813 1 44 PHE QD 1 77 ARG HB3 . . 3.970 2.456 1.997 2.946 . 0 0 "[ . 1 . 2]" 1
814 1 71 PHE QD 1 97 THR H . . 5.500 5.231 5.120 5.320 . 0 0 "[ . 1 . 2]" 1
815 1 71 PHE QD 1 99 SER HA . . 4.190 3.484 2.754 3.819 . 0 0 "[ . 1 . 2]" 1
816 1 71 PHE QD 1 96 VAL HB . . 5.500 5.183 4.927 5.287 . 0 0 "[ . 1 . 2]" 1
817 1 71 PHE QD 1 98 LEU MD2 . . 5.330 5.048 4.712 5.159 . 0 0 "[ . 1 . 2]" 1
818 1 71 PHE QD 1 72 THR H . . 4.400 3.821 3.740 4.119 . 0 0 "[ . 1 . 2]" 1
819 1 71 PHE QD 1 99 SER H . . 3.940 3.880 3.281 3.964 0.024 16 0 "[ . 1 . 2]" 1
820 1 71 PHE QD 1 96 VAL HA . . 5.500 5.503 5.470 5.522 0.022 16 0 "[ . 1 . 2]" 1
821 1 71 PHE HA 1 71 PHE QD . . 3.270 3.130 2.907 3.153 . 0 0 "[ . 1 . 2]" 1
822 1 71 PHE QD 1 98 LEU HA . . 4.450 3.592 3.201 3.726 . 0 0 "[ . 1 . 2]" 1
823 1 71 PHE QD 1 99 SER HB3 . . 3.710 3.145 2.992 3.604 . 0 0 "[ . 1 . 2]" 1
824 1 44 PHE H 1 44 PHE QE . . 5.080 4.770 4.527 5.005 . 0 0 "[ . 1 . 2]" 1
825 1 44 PHE HA 1 44 PHE QE . . 5.470 4.661 4.572 4.806 . 0 0 "[ . 1 . 2]" 1
826 1 44 PHE QE 1 55 ASN HA . . 5.500 3.860 3.510 4.560 . 0 0 "[ . 1 . 2]" 1
827 1 42 ARG HD2 1 44 PHE QE . . 4.770 3.853 2.642 4.785 0.015 19 0 "[ . 1 . 2]" 1
828 1 42 ARG HD3 1 44 PHE QE . . 4.770 3.225 1.997 4.136 . 0 0 "[ . 1 . 2]" 1
829 1 44 PHE QE 1 55 ASN HB2 . . 4.530 3.835 3.126 4.512 . 0 0 "[ . 1 . 2]" 1
830 1 44 PHE QE 1 55 ASN HB3 . . 4.320 2.488 2.005 3.104 . 0 0 "[ . 1 . 2]" 1
831 1 44 PHE QE 1 79 LEU HG . . 3.760 2.878 2.199 3.362 . 0 0 "[ . 1 . 2]" 1
832 1 44 PHE QE 1 79 LEU HB3 . . 4.930 4.178 3.765 4.857 . 0 0 "[ . 1 . 2]" 1
833 1 42 ARG QB 1 44 PHE QE . . 3.950 2.904 2.425 3.385 . 0 0 "[ . 1 . 2]" 1
834 1 41 TYR QD 1 78 PHE QD . . 4.840 3.889 3.708 4.145 . 0 0 "[ . 1 . 2]" 1
835 1 43 LEU HB3 1 78 PHE QD . . 4.520 4.245 3.947 4.522 0.002 17 0 "[ . 1 . 2]" 1
836 1 78 PHE QD 1 90 THR MG . . 4.490 3.702 3.186 4.024 . 0 0 "[ . 1 . 2]" 1
837 1 78 PHE QD 1 79 LEU HG . . 5.500 5.412 5.298 5.484 . 0 0 "[ . 1 . 2]" 1
838 1 43 LEU HG 1 78 PHE QD . . 4.990 4.585 4.349 4.811 . 0 0 "[ . 1 . 2]" 1
839 1 43 LEU HB2 1 78 PHE QD . . 3.820 2.533 2.231 2.836 . 0 0 "[ . 1 . 2]" 1
840 1 11 VAL MG2 1 78 PHE QD . . 3.290 2.036 1.957 2.358 . 0 0 "[ . 1 . 2]" 1
841 1 14 LEU MD2 1 78 PHE QD . . 4.140 3.817 3.402 4.053 . 0 0 "[ . 1 . 2]" 1
842 1 44 PHE HZ 1 55 ASN HB3 . . 5.120 4.726 3.966 5.009 . 0 0 "[ . 1 . 2]" 1
843 1 42 ARG HG2 1 44 PHE HZ . . 4.430 3.708 3.053 4.284 . 0 0 "[ . 1 . 2]" 1
844 1 44 PHE HZ 1 79 LEU MD2 . . 4.630 3.036 2.532 3.864 . 0 0 "[ . 1 . 2]" 1
845 1 42 ARG HD3 1 44 PHE HZ . . 4.240 2.642 1.997 3.237 . 0 0 "[ . 1 . 2]" 1
846 1 41 TYR QD 1 78 PHE QE . . 4.050 2.399 2.101 2.710 . 0 0 "[ . 1 . 2]" 1
847 1 43 LEU HB2 1 78 PHE QE . . 4.150 2.479 2.223 2.789 . 0 0 "[ . 1 . 2]" 1
848 1 11 VAL MG2 1 78 PHE QE . . 3.980 3.232 2.919 3.570 . 0 0 "[ . 1 . 2]" 1
849 1 45 CYS HG 1 46 THR HA . . 5.500 3.773 3.475 4.194 . 0 0 "[ . 1 . 2]" 1
850 1 46 THR HA 1 53 GLU HG3 . . 5.280 4.146 3.446 5.118 . 0 0 "[ . 1 . 2]" 1
851 1 74 TYR H 1 94 THR HA . . 4.720 4.664 4.560 4.726 0.006 20 0 "[ . 1 . 2]" 1
852 1 94 THR HA 1 95 VAL HA . . 4.650 4.392 4.390 4.402 . 0 0 "[ . 1 . 2]" 1
853 1 75 SER QB 1 94 THR HA . . 4.510 3.759 3.509 3.990 . 0 0 "[ . 1 . 2]" 1
854 1 93 ILE HB 1 94 THR HA . . 5.390 4.984 4.937 5.024 . 0 0 "[ . 1 . 2]" 1
855 1 94 THR HA 1 95 VAL QG . . 3.950 3.742 3.660 3.874 . 0 0 "[ . 1 . 2]" 1
856 1 46 THR HA 1 54 GLN H . . 4.100 3.503 3.341 3.770 . 0 0 "[ . 1 . 2]" 1
857 1 46 THR HA 1 53 GLU HG2 . . 5.280 4.659 3.732 5.258 . 0 0 "[ . 1 . 2]" 1
858 1 46 THR HA 1 54 GLN QG . . 5.440 4.246 4.054 4.437 . 0 0 "[ . 1 . 2]" 1
859 1 28 TRP H 1 28 TRP HD1 . . 4.840 4.653 4.574 4.728 . 0 0 "[ . 1 . 2]" 1
860 1 28 TRP HD1 1 41 TYR QD . . 3.750 3.543 3.355 3.762 0.012 19 0 "[ . 1 . 2]" 1
861 1 28 TRP HD1 1 78 PHE QD . . 4.610 4.406 4.204 4.572 . 0 0 "[ . 1 . 2]" 1
862 1 28 TRP HD1 1 78 PHE QE . . 4.860 2.616 2.393 2.911 . 0 0 "[ . 1 . 2]" 1
863 1 28 TRP HD1 1 30 PRO HA . . 4.550 4.439 4.307 4.523 . 0 0 "[ . 1 . 2]" 1
864 1 11 VAL HB 1 28 TRP HD1 . . 4.020 3.478 3.259 3.668 . 0 0 "[ . 1 . 2]" 1
865 1 11 VAL MG2 1 28 TRP HD1 . . 4.620 3.792 3.524 4.006 . 0 0 "[ . 1 . 2]" 1
866 1 26 ILE HA 1 28 TRP HE3 . . 5.370 4.280 4.196 4.349 . 0 0 "[ . 1 . 2]" 1
867 1 26 ILE HA 1 28 TRP HZ3 . . 5.500 4.863 4.662 5.006 . 0 0 "[ . 1 . 2]" 1
868 1 17 VAL H 1 26 ILE HA . . 3.950 3.859 3.783 3.960 0.010 5 0 "[ . 1 . 2]" 1
869 1 26 ILE HA 1 26 ILE HG13 . . 3.850 2.872 2.817 2.917 . 0 0 "[ . 1 . 2]" 1
870 1 16 ALA MB 1 26 ILE HA . . 3.620 2.626 2.380 2.789 . 0 0 "[ . 1 . 2]" 1
871 1 26 ILE HA 1 26 ILE HG12 . . 4.070 2.918 2.894 2.948 . 0 0 "[ . 1 . 2]" 1
872 1 26 ILE HA 1 26 ILE MD . . 4.090 3.951 3.932 3.964 . 0 0 "[ . 1 . 2]" 1
873 1 24 ILE MG 1 26 ILE HA . . 4.380 3.885 3.827 3.928 . 0 0 "[ . 1 . 2]" 1
874 1 28 TRP HH2 1 59 ASP HA . . 5.430 5.184 4.392 5.431 0.001 14 0 "[ . 1 . 2]" 1
875 1 28 TRP HH2 1 63 TYR HA . . 4.920 4.212 3.976 4.465 . 0 0 "[ . 1 . 2]" 1
876 1 28 TRP HH2 1 58 VAL MG2 . . 3.840 2.209 1.984 2.808 . 0 0 "[ . 1 . 2]" 1
877 1 28 TRP HH2 1 62 SER H . . 4.270 3.290 2.678 4.011 . 0 0 "[ . 1 . 2]" 1
878 1 28 TRP HH2 1 78 PHE HZ . . 4.900 4.435 3.935 4.863 . 0 0 "[ . 1 . 2]" 1
879 1 28 TRP HH2 1 63 TYR HB2 . . 3.630 2.211 2.024 2.405 . 0 0 "[ . 1 . 2]" 1
880 1 26 ILE MG 1 28 TRP HH2 . . 5.270 5.007 4.753 5.186 . 0 0 "[ . 1 . 2]" 1
881 1 26 ILE HB 1 28 TRP HE3 . . 4.720 3.182 3.086 3.315 . 0 0 "[ . 1 . 2]" 1
882 1 27 THR MG 1 28 TRP HE3 . . 4.720 4.638 4.568 4.723 0.003 5 0 "[ . 1 . 2]" 1
883 1 74 TYR HA 1 74 TYR QD . . 4.090 2.598 2.448 2.745 . 0 0 "[ . 1 . 2]" 1
884 1 47 GLU HB2 1 74 TYR HA . . 5.500 5.481 5.345 5.620 0.120 11 0 "[ . 1 . 2]" 1
885 1 18 SER HA 1 25 LEU HB2 . . 5.280 4.296 4.109 4.590 . 0 0 "[ . 1 . 2]" 1
886 1 18 SER HA 1 97 THR MG . . 5.500 4.944 4.712 5.134 . 0 0 "[ . 1 . 2]" 1
887 1 18 SER HA 1 24 ILE HA . . 3.200 2.460 2.381 2.532 . 0 0 "[ . 1 . 2]" 1
888 1 18 SER HA 1 18 SER HG . . 3.660 2.713 2.582 2.830 . 0 0 "[ . 1 . 2]" 1
889 1 18 SER HA 1 24 ILE HG12 . . 4.370 3.980 3.829 4.080 . 0 0 "[ . 1 . 2]" 1
890 1 18 SER HA 1 24 ILE MG . . 4.250 4.264 4.172 4.344 0.094 18 0 "[ . 1 . 2]" 1
891 1 18 SER HA 1 24 ILE MD . . 5.370 5.334 5.213 5.404 0.034 17 0 "[ . 1 . 2]" 1
892 1 78 PHE HA 1 78 PHE QD . . 3.750 2.666 2.493 2.810 . 0 0 "[ . 1 . 2]" 1
893 1 78 PHE HA 1 79 LEU HG . . 4.310 4.030 3.878 4.148 . 0 0 "[ . 1 . 2]" 1
894 1 23 SER HA 1 68 LEU H . . 4.870 4.530 4.245 4.768 . 0 0 "[ . 1 . 2]" 1
895 1 23 SER HA 1 66 GLU H . . 5.160 4.548 4.375 4.695 . 0 0 "[ . 1 . 2]" 1
896 1 23 SER HA 1 66 GLU HA . . 3.580 2.706 2.459 2.885 . 0 0 "[ . 1 . 2]" 1
897 1 22 THR HA 1 23 SER HA . . 5.050 4.327 4.324 4.330 . 0 0 "[ . 1 . 2]" 1
898 1 23 SER HA 1 24 ILE HA . . 5.500 4.579 4.566 4.595 . 0 0 "[ . 1 . 2]" 1
899 1 23 SER HA 1 65 LEU HB3 . . 4.880 3.374 3.315 3.454 . 0 0 "[ . 1 . 2]" 1
900 1 23 SER HA 1 24 ILE HG12 . . 5.010 4.760 4.709 4.797 . 0 0 "[ . 1 . 2]" 1
901 1 23 SER HA 1 24 ILE HB . . 4.470 4.389 4.360 4.450 . 0 0 "[ . 1 . 2]" 1
902 1 23 SER HA 1 64 LYS QG . . 5.070 4.404 4.167 4.721 . 0 0 "[ . 1 . 2]" 1
903 1 23 SER HA 1 68 LEU HB2 . . 5.500 4.208 4.071 4.382 . 0 0 "[ . 1 . 2]" 1
904 1 23 SER HA 1 24 ILE HG13 . . 5.030 3.535 3.432 3.584 . 0 0 "[ . 1 . 2]" 1
905 1 23 SER HA 1 68 LEU MD1 . . 3.640 2.180 1.958 2.399 . 0 0 "[ . 1 . 2]" 1
906 1 23 SER HA 1 65 LEU HB2 . . 4.870 4.914 4.879 4.943 0.073 15 0 "[ . 1 . 2]" 1
907 1 45 CYS HA 1 76 LEU HB3 . . 4.800 3.588 3.307 3.985 . 0 0 "[ . 1 . 2]" 1
908 1 45 CYS HA 1 45 CYS HG . . 4.050 3.133 2.775 3.780 . 0 0 "[ . 1 . 2]" 1
909 1 26 ILE MG 1 28 TRP HZ3 . . 3.870 3.237 2.960 3.406 . 0 0 "[ . 1 . 2]" 1
910 1 75 SER HA 1 93 ILE H . . 4.580 4.490 4.396 4.585 0.005 9 0 "[ . 1 . 2]" 1
911 1 75 SER HA 1 94 THR HA . . 3.180 2.483 2.163 2.682 . 0 0 "[ . 1 . 2]" 1
912 1 74 TYR HB2 1 75 SER HA . . 5.500 5.041 4.970 5.133 . 0 0 "[ . 1 . 2]" 1
913 1 75 SER HA 1 76 LEU HG . . 4.130 3.750 3.573 3.907 . 0 0 "[ . 1 . 2]" 1
914 1 75 SER HA 1 76 LEU MD2 . . 4.430 4.258 3.955 4.439 0.009 8 0 "[ . 1 . 2]" 1
915 1 44 PHE HA 1 55 ASN HB2 . . 5.500 5.293 4.819 5.518 0.018 14 0 "[ . 1 . 2]" 1
916 1 43 LEU HG 1 44 PHE HA . . 4.830 3.526 3.373 3.720 . 0 0 "[ . 1 . 2]" 1
917 1 47 GLU H 1 53 GLU HA . . 3.930 3.714 3.517 3.886 . 0 0 "[ . 1 . 2]" 1
918 1 63 TYR QE 1 65 LEU H . . 4.570 4.265 4.010 4.424 . 0 0 "[ . 1 . 2]" 1
919 1 63 TYR QE 1 64 LYS H . . 4.930 4.682 4.512 4.840 . 0 0 "[ . 1 . 2]" 1
920 1 58 VAL HA 1 63 TYR QE . . 4.790 4.143 3.860 4.537 . 0 0 "[ . 1 . 2]" 1
921 1 63 TYR HA 1 63 TYR QE . . 5.380 4.712 4.634 4.782 . 0 0 "[ . 1 . 2]" 1
922 1 63 TYR QE 1 65 LEU HA . . 3.080 2.347 2.106 2.468 . 0 0 "[ . 1 . 2]" 1
923 1 63 TYR QE 1 65 LEU HB2 . . 3.690 3.631 3.333 3.711 0.021 5 0 "[ . 1 . 2]" 1
924 1 63 TYR QE 1 65 LEU MD1 . . 3.100 1.934 1.785 1.977 . 0 0 "[ . 1 . 2]" 1
925 1 58 VAL MG2 1 63 TYR QE . . 5.080 4.769 4.503 5.012 . 0 0 "[ . 1 . 2]" 1
926 1 58 VAL MG1 1 63 TYR QE . . 3.860 2.598 2.298 2.988 . 0 0 "[ . 1 . 2]" 1
927 1 28 TRP HZ2 1 41 TYR QE . . 4.740 4.413 3.930 4.731 . 0 0 "[ . 1 . 2]" 1
928 1 31 PRO HG3 1 41 TYR QE . . 4.660 4.264 3.998 4.631 . 0 0 "[ . 1 . 2]" 1
929 1 36 GLY HA3 1 84 TYR QE . . 4.850 3.243 2.702 3.490 . 0 0 "[ . 1 . 2]" 1
930 1 35 ASN HB3 1 84 TYR QE . . 4.890 3.381 2.821 4.157 . 0 0 "[ . 1 . 2]" 1
931 1 36 GLY H 1 84 TYR QE . . 4.910 4.670 4.322 4.921 0.011 19 0 "[ . 1 . 2]" 1
932 1 84 TYR HA 1 84 TYR QE . . 4.680 4.491 4.308 4.614 . 0 0 "[ . 1 . 2]" 1
933 1 10 PRO HD3 1 33 TYR QE . . 4.760 3.856 3.598 4.304 . 0 0 "[ . 1 . 2]" 1
934 1 35 ASN HB2 1 84 TYR QE . . 4.890 4.540 2.407 4.880 . 0 0 "[ . 1 . 2]" 1
935 1 83 ARG HG2 1 84 TYR QE . . 4.530 3.774 2.756 4.465 . 0 0 "[ . 1 . 2]" 1
936 1 83 ARG HG3 1 84 TYR QE . . 4.530 3.440 2.754 4.521 . 0 0 "[ . 1 . 2]" 1
937 1 47 GLU HB2 1 74 TYR QE . . 3.660 2.200 1.995 2.459 . 0 0 "[ . 1 . 2]" 1
938 1 47 GLU HG3 1 74 TYR QE . . 4.190 2.403 2.005 4.196 0.006 18 0 "[ . 1 . 2]" 1
939 1 68 LEU HB3 1 74 TYR QE . . 3.770 2.429 2.231 2.720 . 0 0 "[ . 1 . 2]" 1
940 1 28 TRP HD1 1 41 TYR QE . . 4.420 3.139 2.901 3.383 . 0 0 "[ . 1 . 2]" 1
941 1 41 TYR QE 1 78 PHE QE . . 4.770 3.771 3.509 3.939 . 0 0 "[ . 1 . 2]" 1
942 1 30 PRO HA 1 41 TYR QE . . 3.990 3.130 2.938 3.401 . 0 0 "[ . 1 . 2]" 1
943 1 31 PRO HD2 1 41 TYR QE . . 3.720 3.356 3.150 3.593 . 0 0 "[ . 1 . 2]" 1
944 1 11 VAL HB 1 41 TYR QE . . 4.720 4.057 3.753 4.257 . 0 0 "[ . 1 . 2]" 1
945 1 11 VAL MG1 1 41 TYR QE . . 3.180 2.187 1.952 2.462 . 0 0 "[ . 1 . 2]" 1
946 1 11 VAL MG2 1 41 TYR QE . . 4.650 4.579 4.271 4.662 0.012 4 0 "[ . 1 . 2]" 1
947 1 41 TYR QE 1 59 ASP HA . . 4.760 4.494 3.607 4.742 . 0 0 "[ . 1 . 2]" 1
948 1 33 TYR H 1 33 TYR QE . . 4.950 3.835 3.632 3.946 . 0 0 "[ . 1 . 2]" 1
949 1 10 PRO HD2 1 33 TYR QE . . 4.290 2.182 1.996 2.588 . 0 0 "[ . 1 . 2]" 1
950 1 32 ALA MB 1 33 TYR QE . . 4.690 4.151 3.878 4.548 . 0 0 "[ . 1 . 2]" 1
951 1 36 GLY HA2 1 84 TYR QE . . 4.850 4.688 4.305 4.859 0.009 20 0 "[ . 1 . 2]" 1
952 1 10 PRO QB 1 33 TYR QE . . 5.500 4.226 3.680 4.864 . 0 0 "[ . 1 . 2]" 1
953 1 31 PRO HB3 1 33 TYR QE . . 5.500 4.318 3.695 4.927 . 0 0 "[ . 1 . 2]" 1
954 1 37 PRO QG 1 84 TYR QE . . 5.500 5.252 4.656 5.505 0.005 2 0 "[ . 1 . 2]" 1
955 1 49 SER H 1 74 TYR QE . . 5.500 5.181 4.845 5.430 . 0 0 "[ . 1 . 2]" 1
956 1 74 TYR H 1 74 TYR QE . . 5.500 5.188 5.088 5.254 . 0 0 "[ . 1 . 2]" 1
957 1 74 TYR QE 1 97 THR HG1 . . 4.430 3.662 3.325 3.835 . 0 0 "[ . 1 . 2]" 1
958 1 74 TYR HA 1 74 TYR QE . . 4.980 4.410 4.362 4.457 . 0 0 "[ . 1 . 2]" 1
959 1 43 LEU H 1 81 TYR QE . . 5.500 5.239 4.921 5.504 0.004 3 0 "[ . 1 . 2]" 1
960 1 42 ARG HE 1 81 TYR QE . . 5.200 3.986 2.855 5.258 0.058 19 0 "[ . 1 . 2]" 1
961 1 40 GLY HA3 1 81 TYR QE . . 4.150 3.639 3.247 3.932 . 0 0 "[ . 1 . 2]" 1
962 1 39 GLN QG 1 81 TYR QE . . 4.200 3.824 3.306 4.209 0.009 1 0 "[ . 1 . 2]" 1
963 1 39 GLN HB3 1 81 TYR QE . . 3.880 2.501 2.019 2.956 . 0 0 "[ . 1 . 2]" 1
964 1 42 ARG QB 1 81 TYR QE . . 3.760 2.712 1.999 3.598 . 0 0 "[ . 1 . 2]" 1
965 1 42 ARG HG3 1 81 TYR QE . . 4.160 2.682 1.975 3.364 . 0 0 "[ . 1 . 2]" 1
966 1 42 ARG HG2 1 81 TYR QE . . 4.510 4.123 3.647 4.522 0.012 7 0 "[ . 1 . 2]" 1
967 1 41 TYR HA 1 81 TYR QE . . 4.620 3.039 2.735 3.262 . 0 0 "[ . 1 . 2]" 1
968 1 44 PHE H 1 76 LEU HA . . 4.710 4.480 4.353 4.663 . 0 0 "[ . 1 . 2]" 1
969 1 76 LEU HA 1 76 LEU HG . . 3.950 3.293 3.199 3.423 . 0 0 "[ . 1 . 2]" 1
970 1 45 CYS HA 1 76 LEU HA . . 3.510 2.505 2.262 2.812 . 0 0 "[ . 1 . 2]" 1
971 1 44 PHE HB2 1 76 LEU HA . . 4.710 4.478 4.202 4.711 0.001 18 0 "[ . 1 . 2]" 1
972 1 42 ARG H 1 81 TYR QE . . 4.940 2.974 2.719 3.413 . 0 0 "[ . 1 . 2]" 1
973 1 39 GLN HB2 1 81 TYR QE . . 3.880 2.510 2.269 2.916 . 0 0 "[ . 1 . 2]" 1
974 1 41 TYR QD 1 59 ASP HA . . 3.480 3.282 2.675 3.476 . 0 0 "[ . 1 . 2]" 1
975 1 28 TRP HZ2 1 59 ASP HA . . 3.910 3.637 2.817 3.894 . 0 0 "[ . 1 . 2]" 1
976 1 58 VAL HB 1 59 ASP HA . . 4.910 4.478 4.308 4.728 . 0 0 "[ . 1 . 2]" 1
977 1 58 VAL MG2 1 59 ASP HA . . 4.540 3.687 3.417 4.023 . 0 0 "[ . 1 . 2]" 1
978 1 45 CYS H 1 55 ASN HA . . 4.000 3.754 3.419 3.999 . 0 0 "[ . 1 . 2]" 1
979 1 55 ASN HA 1 56 ILE HB . . 4.740 4.545 4.480 4.594 . 0 0 "[ . 1 . 2]" 1
980 1 55 ASN HA 1 56 ILE HG12 . . 5.470 5.220 5.071 5.429 . 0 0 "[ . 1 . 2]" 1
981 1 16 ALA HA 1 26 ILE H . . 5.130 4.531 4.439 4.624 . 0 0 "[ . 1 . 2]" 1
982 1 16 ALA HA 1 26 ILE HA . . 3.210 2.310 2.241 2.367 . 0 0 "[ . 1 . 2]" 1
983 1 15 GLN HA 1 16 ALA HA . . 4.940 4.418 4.402 4.455 . 0 0 "[ . 1 . 2]" 1
984 1 16 ALA HA 1 17 VAL HA . . 4.500 4.434 4.404 4.461 . 0 0 "[ . 1 . 2]" 1
985 1 16 ALA HA 1 17 VAL HB . . 5.490 5.097 4.520 5.680 0.190 14 0 "[ . 1 . 2]" 1
986 1 15 GLN H 1 16 ALA HA . . 5.280 4.709 4.639 4.834 . 0 0 "[ . 1 . 2]" 1
987 1 16 ALA HA 1 26 ILE MG . . 3.810 3.584 3.475 3.715 . 0 0 "[ . 1 . 2]" 1
988 1 28 TRP HZ2 1 63 TYR HB3 . . 5.500 5.461 5.316 5.527 0.027 2 0 "[ . 1 . 2]" 1
989 1 28 TRP HZ2 1 58 VAL MG1 . . 5.170 5.100 4.901 5.178 0.008 19 0 "[ . 1 . 2]" 1
990 1 28 TRP HZ2 1 41 TYR QD . . 3.740 3.362 2.933 3.605 . 0 0 "[ . 1 . 2]" 1
991 1 28 TRP HZ2 1 78 PHE HZ . . 4.820 3.338 2.930 3.675 . 0 0 "[ . 1 . 2]" 1
992 1 28 TRP HZ2 1 63 TYR HB2 . . 4.940 4.535 4.370 4.712 . 0 0 "[ . 1 . 2]" 1
993 1 78 PHE HB2 1 90 THR MG . . 4.390 4.263 3.595 4.403 0.013 11 0 "[ . 1 . 2]" 1
994 1 55 ASN HA 1 56 ILE MD . . 4.960 4.678 4.330 4.924 . 0 0 "[ . 1 . 2]" 1
995 1 45 CYS HB3 1 56 ILE MD . . 4.500 3.115 2.810 3.442 . 0 0 "[ . 1 . 2]" 1
996 1 56 ILE MD 1 58 VAL MG1 . . 4.240 3.966 3.882 4.109 . 0 0 "[ . 1 . 2]" 1
997 1 56 ILE MD 1 63 TYR QE . . 3.990 3.897 3.704 3.999 0.009 18 0 "[ . 1 . 2]" 1
998 1 54 GLN HE22 1 56 ILE MD . . 4.540 3.410 3.114 3.687 . 0 0 "[ . 1 . 2]" 1
999 1 45 CYS H 1 56 ILE MD . . 4.830 3.754 3.193 4.248 . 0 0 "[ . 1 . 2]" 1
1000 1 56 ILE H 1 56 ILE MD . . 4.240 4.018 3.733 4.151 . 0 0 "[ . 1 . 2]" 1
1001 1 54 GLN HE21 1 56 ILE MD . . 4.810 2.884 2.141 3.589 . 0 0 "[ . 1 . 2]" 1
1002 1 56 ILE MD 1 63 TYR QD . . 5.310 5.065 4.882 5.284 . 0 0 "[ . 1 . 2]" 1
1003 1 54 GLN QG 1 56 ILE MD . . 3.970 2.461 2.214 2.695 . 0 0 "[ . 1 . 2]" 1
1004 1 24 ILE MD 1 74 TYR H . . 5.020 4.709 4.510 4.867 . 0 0 "[ . 1 . 2]" 1
1005 1 24 ILE MD 1 95 VAL H . . 4.820 4.437 4.152 4.613 . 0 0 "[ . 1 . 2]" 1
1006 1 24 ILE MD 1 74 TYR QD . . 4.010 3.434 3.242 3.593 . 0 0 "[ . 1 . 2]" 1
1007 1 24 ILE MD 1 74 TYR QE . . 4.780 4.725 4.503 4.804 0.024 15 0 "[ . 1 . 2]" 1
1008 1 24 ILE MD 1 74 TYR HA . . 5.500 5.223 5.017 5.369 . 0 0 "[ . 1 . 2]" 1
1009 1 24 ILE HA 1 24 ILE MD . . 4.050 3.716 3.684 3.769 . 0 0 "[ . 1 . 2]" 1
1010 1 24 ILE MD 1 95 VAL HA . . 5.500 5.434 5.161 5.543 0.043 1 0 "[ . 1 . 2]" 1
1011 1 18 SER HG 1 24 ILE MD . . 5.020 4.985 4.853 5.056 0.036 2 0 "[ . 1 . 2]" 1
1012 1 18 SER HB2 1 24 ILE MD . . 4.330 4.194 4.145 4.321 . 0 0 "[ . 1 . 2]" 1
1013 1 24 ILE MD 1 74 TYR HB3 . . 4.080 3.215 2.962 3.410 . 0 0 "[ . 1 . 2]" 1
1014 1 24 ILE MD 1 74 TYR HB2 . . 3.770 2.922 2.723 3.066 . 0 0 "[ . 1 . 2]" 1
1015 1 24 ILE MD 1 95 VAL HB . . 3.150 2.853 2.592 2.985 . 0 0 "[ . 1 . 2]" 1
1016 1 24 ILE MD 1 76 LEU HG . . 4.300 3.205 3.067 3.401 . 0 0 "[ . 1 . 2]" 1
1017 1 16 ALA MB 1 24 ILE MD . . 4.130 3.959 3.781 4.082 . 0 0 "[ . 1 . 2]" 1
1018 1 24 ILE MD 1 76 LEU MD2 . . 2.680 2.554 2.261 2.713 0.033 20 0 "[ . 1 . 2]" 1
1019 1 24 ILE MD 1 24 ILE MG . . 2.710 1.868 1.834 1.928 . 0 0 "[ . 1 . 2]" 1
1020 1 24 ILE MD 1 68 LEU MD1 . . 2.980 2.363 2.067 2.528 . 0 0 "[ . 1 . 2]" 1
1021 1 66 GLU HB3 1 67 GLY HA3 . . 5.030 4.495 4.346 4.550 . 0 0 "[ . 1 . 2]" 1
1022 1 67 GLY HA3 1 68 LEU HG . . 5.170 4.369 4.265 4.480 . 0 0 "[ . 1 . 2]" 1
1023 1 66 GLU HA 1 67 GLY HA3 . . 4.910 4.498 4.477 4.520 . 0 0 "[ . 1 . 2]" 1
1024 1 66 GLU HB3 1 67 GLY HA2 . . 4.750 4.373 4.233 4.436 . 0 0 "[ . 1 . 2]" 1
1025 1 22 THR HB 1 67 GLY HA2 . . 4.780 4.425 4.331 4.516 . 0 0 "[ . 1 . 2]" 1
1026 1 22 THR MG 1 67 GLY HA2 . . 5.200 4.759 4.636 4.861 . 0 0 "[ . 1 . 2]" 1
1027 1 67 GLY HA2 1 68 LEU HG . . 5.500 4.854 4.729 4.956 . 0 0 "[ . 1 . 2]" 1
1028 1 78 PHE H 1 93 ILE MD . . 4.710 3.104 2.824 3.527 . 0 0 "[ . 1 . 2]" 1
1029 1 90 THR HG1 1 93 ILE MD . . 5.040 2.915 2.315 3.895 . 0 0 "[ . 1 . 2]" 1
1030 1 15 GLN HA 1 93 ILE MD . . 4.170 4.069 3.832 4.184 0.014 3 0 "[ . 1 . 2]" 1
1031 1 93 ILE HA 1 93 ILE MD . . 3.990 3.874 3.854 3.912 . 0 0 "[ . 1 . 2]" 1
1032 1 78 PHE HB3 1 93 ILE MD . . 4.720 3.467 3.204 3.700 . 0 0 "[ . 1 . 2]" 1
1033 1 78 PHE HB2 1 93 ILE MD . . 4.460 2.887 2.607 3.102 . 0 0 "[ . 1 . 2]" 1
1034 1 93 ILE HB 1 93 ILE MD . . 3.210 2.265 2.184 2.387 . 0 0 "[ . 1 . 2]" 1
1035 1 14 LEU MD1 1 93 ILE MD . . 3.900 2.561 2.164 2.797 . 0 0 "[ . 1 . 2]" 1
1036 1 60 GLY HA3 1 61 LEU HG . . 4.870 4.517 4.176 4.949 0.079 11 0 "[ . 1 . 2]" 1
1037 1 50 THR H 1 51 GLY HA3 . . 5.050 4.935 4.857 5.025 . 0 0 "[ . 1 . 2]" 1
1038 1 60 GLY HA2 1 61 LEU HG . . 4.870 3.670 3.311 4.235 . 0 0 "[ . 1 . 2]" 1
1039 1 43 LEU HB3 1 78 PHE QE . . 4.910 3.874 3.556 4.278 . 0 0 "[ . 1 . 2]" 1
1040 1 43 LEU HB3 1 43 LEU MD2 . . 3.360 2.109 2.004 2.284 . 0 0 "[ . 1 . 2]" 1
1041 1 43 LEU HB2 1 56 ILE H . . 5.360 5.269 4.959 5.365 0.005 15 0 "[ . 1 . 2]" 1
1042 1 43 LEU HB2 1 56 ILE MG . . 5.090 4.788 4.451 5.092 0.002 6 0 "[ . 1 . 2]" 1
1043 1 79 LEU HB3 1 80 ALA H . . 4.160 3.909 3.795 3.968 . 0 0 "[ . 1 . 2]" 1
1044 1 9 GLY HA2 1 33 TYR QE . . 5.020 4.311 3.690 4.864 . 0 0 "[ . 1 . 2]" 1
1045 1 85 GLY HA3 1 86 PRO HG3 . . 5.500 4.837 4.748 4.911 . 0 0 "[ . 1 . 2]" 1
1046 1 85 GLY HA3 1 86 PRO HD2 . . 3.510 2.241 2.156 2.313 . 0 0 "[ . 1 . 2]" 1
1047 1 85 GLY HA3 1 86 PRO HG2 . . 5.500 4.322 4.262 4.374 . 0 0 "[ . 1 . 2]" 1
1048 1 9 GLY HA3 1 33 TYR QE . . 5.120 3.286 2.711 3.795 . 0 0 "[ . 1 . 2]" 1
1049 1 75 SER HA 1 76 LEU HB2 . . 4.880 4.818 4.736 4.907 0.027 2 0 "[ . 1 . 2]" 1
1050 1 76 LEU HB3 1 76 LEU MD1 . . 3.540 2.385 2.246 2.554 . 0 0 "[ . 1 . 2]" 1
1051 1 9 GLY HA2 1 10 PRO HD2 . . 3.510 2.602 2.433 2.808 . 0 0 "[ . 1 . 2]" 1
1052 1 9 GLY HA2 1 10 PRO QG . . 4.230 4.135 4.022 4.285 0.055 6 0 "[ . 1 . 2]" 1
1053 1 9 GLY HA3 1 10 PRO QG . . 4.290 4.173 4.034 4.298 0.008 8 0 "[ . 1 . 2]" 1
1054 1 9 GLY HA3 1 31 PRO HB2 . . 4.530 3.950 3.685 4.299 . 0 0 "[ . 1 . 2]" 1
1055 1 25 LEU HB3 1 26 ILE H . . 4.620 4.332 4.303 4.361 . 0 0 "[ . 1 . 2]" 1
1056 1 24 ILE HA 1 25 LEU HB3 . . 4.990 4.767 4.724 4.832 . 0 0 "[ . 1 . 2]" 1
1057 1 25 LEU HB2 1 26 ILE H . . 4.530 4.525 4.504 4.551 0.021 13 0 "[ . 1 . 2]" 1
1058 1 25 LEU HB2 1 64 LYS QG . . 4.260 3.427 2.866 4.175 . 0 0 "[ . 1 . 2]" 1
1059 1 25 LEU HB2 1 25 LEU MD1 . . 3.370 2.336 2.269 2.366 . 0 0 "[ . 1 . 2]" 1
1060 1 25 LEU HB2 1 25 LEU MD2 . . 3.610 2.326 2.261 2.490 . 0 0 "[ . 1 . 2]" 1
1061 1 24 ILE HA 1 25 LEU HB2 . . 4.840 4.513 4.464 4.553 . 0 0 "[ . 1 . 2]" 1
1062 1 7 GLY HA2 1 8 PRO HB3 . . 5.350 4.835 4.826 4.909 . 0 0 "[ . 1 . 2]" 1
1063 1 86 PRO QB 1 87 GLY HA2 . . 5.500 4.522 4.324 4.676 . 0 0 "[ . 1 . 2]" 1
1064 1 8 PRO HB3 1 87 GLY HA3 . . 5.500 5.101 4.883 5.376 . 0 0 "[ . 1 . 2]" 1
1065 1 40 GLY HA3 1 59 ASP HA . . 5.050 4.884 4.591 5.045 . 0 0 "[ . 1 . 2]" 1
1066 1 40 GLY HA3 1 41 TYR QD . . 4.560 3.885 3.702 4.123 . 0 0 "[ . 1 . 2]" 1
1067 1 38 VAL MG1 1 40 GLY HA3 . . 4.680 4.022 3.950 4.104 . 0 0 "[ . 1 . 2]" 1
1068 1 40 GLY HA2 1 41 TYR QD . . 4.460 3.175 2.981 3.401 . 0 0 "[ . 1 . 2]" 1
1069 1 40 GLY HA2 1 41 TYR QE . . 4.950 3.472 3.295 3.723 . 0 0 "[ . 1 . 2]" 1
1070 1 40 GLY HA2 1 81 TYR QE . . 5.310 4.824 4.441 5.132 . 0 0 "[ . 1 . 2]" 1
1071 1 40 GLY HA2 1 59 ASP HA . . 4.770 4.717 4.553 4.785 0.015 5 0 "[ . 1 . 2]" 1
1072 1 38 VAL MG1 1 40 GLY HA2 . . 4.470 3.079 2.951 3.195 . 0 0 "[ . 1 . 2]" 1
1073 1 36 GLY HA3 1 37 PRO QG . . 4.620 3.878 3.841 3.949 . 0 0 "[ . 1 . 2]" 1
1074 1 24 ILE HB 1 24 ILE MD . . 3.380 2.497 2.429 2.527 . 0 0 "[ . 1 . 2]" 1
1075 1 24 ILE HB 1 25 LEU H . . 4.730 4.418 4.391 4.432 . 0 0 "[ . 1 . 2]" 1
1076 1 24 ILE HB 1 65 LEU H . . 4.660 3.254 3.017 3.437 . 0 0 "[ . 1 . 2]" 1
1077 1 24 ILE HB 1 68 LEU MD1 . . 3.880 3.060 2.952 3.149 . 0 0 "[ . 1 . 2]" 1
1078 1 18 SER HA 1 24 ILE HB . . 5.450 5.387 5.270 5.490 0.040 8 0 "[ . 1 . 2]" 1
1079 1 24 ILE HB 1 65 LEU HB3 . . 3.710 2.157 2.045 2.288 . 0 0 "[ . 1 . 2]" 1
1080 1 59 ASP HB2 1 60 GLY H . . 4.320 3.379 2.117 4.296 . 0 0 "[ . 1 . 2]" 1
1081 1 59 ASP H 1 59 ASP HB2 . . 3.860 3.479 2.791 3.873 0.013 6 0 "[ . 1 . 2]" 1
1082 1 42 ARG HD2 1 44 PHE HZ . . 4.240 3.024 1.993 4.232 . 0 0 "[ . 1 . 2]" 1
1083 1 42 ARG QB 1 42 ARG HD2 . . 3.750 2.294 2.080 3.233 . 0 0 "[ . 1 . 2]" 1
1084 1 59 ASP HB3 1 60 GLY H . . 4.320 3.826 2.648 4.241 . 0 0 "[ . 1 . 2]" 1
1085 1 83 ARG QD 1 84 TYR QE . . 4.380 3.120 2.078 4.402 0.022 14 0 "[ . 1 . 2]" 1
1086 1 83 ARG HA 1 83 ARG QD . . 4.580 4.143 2.409 4.564 . 0 0 "[ . 1 . 2]" 1
1087 1 83 ARG HB2 1 83 ARG QD . . 3.430 2.675 2.234 3.259 . 0 0 "[ . 1 . 2]" 1
1088 1 83 ARG HB3 1 83 ARG QD . . 3.430 2.593 2.101 3.451 0.021 19 0 "[ . 1 . 2]" 1
1089 1 42 ARG QB 1 42 ARG HD3 . . 3.750 2.782 2.147 3.246 . 0 0 "[ . 1 . 2]" 1
1090 1 63 TYR QD 1 65 LEU HB3 . . 5.180 4.969 4.847 5.108 . 0 0 "[ . 1 . 2]" 1
1091 1 24 ILE HG13 1 65 LEU HB3 . . 4.530 3.033 2.847 3.206 . 0 0 "[ . 1 . 2]" 1
1092 1 24 ILE MD 1 65 LEU HB3 . . 4.680 3.528 3.306 3.742 . 0 0 "[ . 1 . 2]" 1
1093 1 63 TYR QE 1 65 LEU HB3 . . 4.900 4.691 4.415 4.809 . 0 0 "[ . 1 . 2]" 1
1094 1 24 ILE H 1 65 LEU HB2 . . 4.330 3.678 3.576 3.758 . 0 0 "[ . 1 . 2]" 1
1095 1 65 LEU HB2 1 66 GLU H . . 4.700 4.199 4.154 4.246 . 0 0 "[ . 1 . 2]" 1
1096 1 65 LEU HB2 1 65 LEU MD1 . . 3.550 2.046 1.993 2.207 . 0 0 "[ . 1 . 2]" 1
1097 1 65 LEU HB2 1 68 LEU MD1 . . 4.310 3.823 3.585 4.011 . 0 0 "[ . 1 . 2]" 1
1098 1 43 LEU H 1 56 ILE HB . . 4.380 3.803 3.468 4.305 . 0 0 "[ . 1 . 2]" 1
1099 1 56 ILE HB 1 57 GLU H . . 4.200 3.980 3.846 4.206 0.006 20 0 "[ . 1 . 2]" 1
1100 1 43 LEU HB3 1 56 ILE HB . . 3.630 2.627 2.354 3.043 . 0 0 "[ . 1 . 2]" 1
1101 1 43 LEU HB2 1 56 ILE HB . . 4.790 4.344 4.100 4.694 . 0 0 "[ . 1 . 2]" 1
1102 1 43 LEU MD2 1 56 ILE HB . . 3.610 2.602 2.286 2.874 . 0 0 "[ . 1 . 2]" 1
1103 1 56 ILE HB 1 58 VAL MG2 . . 4.980 4.837 4.585 4.986 0.006 6 0 "[ . 1 . 2]" 1
1104 1 56 ILE HB 1 58 VAL MG1 . . 4.220 3.506 3.271 3.623 . 0 0 "[ . 1 . 2]" 1
1105 1 21 PRO HB3 1 98 LEU HB2 . . 5.000 4.486 4.404 4.586 . 0 0 "[ . 1 . 2]" 1
1106 1 21 PRO HG2 1 98 LEU HB2 . . 5.500 5.578 5.532 5.598 0.098 17 0 "[ . 1 . 2]" 1
1107 1 28 TRP HZ3 1 63 TYR HB2 . . 4.120 3.132 2.830 3.372 . 0 0 "[ . 1 . 2]" 1
1108 1 58 VAL MG1 1 63 TYR HB2 . . 4.630 3.088 2.785 3.328 . 0 0 "[ . 1 . 2]" 1
1109 1 62 SER H 1 63 TYR HB2 . . 5.220 4.407 4.025 4.997 . 0 0 "[ . 1 . 2]" 1
1110 1 52 LYS H 1 52 LYS QE . . 5.030 4.478 3.595 5.072 0.042 7 0 "[ . 1 . 2]" 1
1111 1 50 THR HB 1 52 LYS QE . . 4.320 3.419 2.522 4.327 0.007 3 0 "[ . 1 . 2]" 1
1112 1 50 THR MG 1 52 LYS QE . . 4.440 3.575 2.784 4.289 . 0 0 "[ . 1 . 2]" 1
1113 1 81 TYR HB2 1 86 PRO HA . . 3.970 2.560 2.331 2.887 . 0 0 "[ . 1 . 2]" 1
1114 1 28 TRP HH2 1 63 TYR HB3 . . 3.800 3.121 2.985 3.193 . 0 0 "[ . 1 . 2]" 1
1115 1 28 TRP HZ3 1 63 TYR HB3 . . 3.940 2.696 2.524 2.914 . 0 0 "[ . 1 . 2]" 1
1116 1 58 VAL MG1 1 63 TYR HB3 . . 4.660 3.163 2.741 3.502 . 0 0 "[ . 1 . 2]" 1
1117 1 81 TYR HB3 1 86 PRO QB . . 4.590 2.598 2.472 2.771 . 0 0 "[ . 1 . 2]" 1
1118 1 14 LEU HB3 1 14 LEU MD2 . . 3.300 1.973 1.959 2.005 . 0 0 "[ . 1 . 2]" 1
1119 1 98 LEU H 1 98 LEU HB3 . . 3.960 3.574 3.567 3.583 . 0 0 "[ . 1 . 2]" 1
1120 1 21 PRO HD3 1 98 LEU HB3 . . 5.330 5.059 4.981 5.177 . 0 0 "[ . 1 . 2]" 1
1121 1 21 PRO HB2 1 100 ASP QB . . 4.540 3.994 3.554 4.391 . 0 0 "[ . 1 . 2]" 1
1122 1 70 LYS QD 1 100 ASP QB . . 4.030 1.974 1.799 2.196 . 0 0 "[ . 1 . 2]" 1
1123 1 24 ILE HG12 1 74 TYR HB2 . . 5.500 5.038 4.798 5.217 . 0 0 "[ . 1 . 2]" 1
1124 1 68 LEU HB3 1 74 TYR HB2 . . 5.500 5.504 5.312 5.559 0.059 15 0 "[ . 1 . 2]" 1
1125 1 81 TYR HB3 1 86 PRO HA . . 3.680 2.207 1.987 2.658 . 0 0 "[ . 1 . 2]" 1
1126 1 41 TYR HB2 1 78 PHE HZ . . 5.060 2.194 2.000 2.402 . 0 0 "[ . 1 . 2]" 1
1127 1 41 TYR HB3 1 78 PHE QD . . 4.810 3.934 3.780 4.116 . 0 0 "[ . 1 . 2]" 1
1128 1 41 TYR HB3 1 78 PHE QE . . 4.630 2.563 2.228 2.808 . 0 0 "[ . 1 . 2]" 1
1129 1 41 TYR HB3 1 78 PHE HZ . . 4.460 2.315 2.209 2.644 . 0 0 "[ . 1 . 2]" 1
1130 1 11 VAL MG1 1 41 TYR HB3 . . 5.240 4.063 3.878 4.264 . 0 0 "[ . 1 . 2]" 1
1131 1 41 TYR HB3 1 58 VAL MG2 . . 4.300 4.085 3.746 4.253 . 0 0 "[ . 1 . 2]" 1
1132 1 23 SER HB2 1 64 LYS HE2 . . 5.500 3.723 1.999 4.979 . 0 0 "[ . 1 . 2]" 1
1133 1 23 SER HB3 1 64 LYS HE2 . . 5.500 4.160 3.189 5.505 0.005 14 0 "[ . 1 . 2]" 1
1134 1 64 LYS HE2 1 64 LYS QG . . 3.650 2.650 2.077 3.263 . 0 0 "[ . 1 . 2]" 1
1135 1 64 LYS HE3 1 64 LYS QG . . 3.650 2.439 2.055 3.301 . 0 0 "[ . 1 . 2]" 1
1136 1 44 PHE QD 1 55 ASN HB2 . . 4.320 4.076 3.666 4.320 . 0 0 "[ . 1 . 2]" 1
1137 1 44 PHE HB3 1 55 ASN HB3 . . 5.400 5.082 4.715 5.390 . 0 0 "[ . 1 . 2]" 1
1138 1 26 ILE HB 1 63 TYR HB2 . . 4.800 4.639 4.498 4.813 0.013 3 0 "[ . 1 . 2]" 1
1139 1 26 ILE HB 1 27 THR H . . 4.680 4.257 4.197 4.299 . 0 0 "[ . 1 . 2]" 1
1140 1 26 ILE HB 1 28 TRP HZ3 . . 3.630 2.552 2.325 2.703 . 0 0 "[ . 1 . 2]" 1
1141 1 16 ALA HA 1 26 ILE HB . . 5.450 5.206 5.129 5.277 . 0 0 "[ . 1 . 2]" 1
1142 1 25 LEU HA 1 26 ILE HB . . 4.920 4.845 4.797 4.881 . 0 0 "[ . 1 . 2]" 1
1143 1 26 ILE HB 1 63 TYR HB3 . . 4.000 3.193 3.064 3.281 . 0 0 "[ . 1 . 2]" 1
1144 1 68 LEU HB2 1 74 TYR QE . . 4.710 3.849 3.579 4.146 . 0 0 "[ . 1 . 2]" 1
1145 1 26 ILE HB 1 63 TYR QD . . 4.830 4.402 4.273 4.538 . 0 0 "[ . 1 . 2]" 1
1146 1 44 PHE HB3 1 76 LEU HA . . 5.500 5.342 4.970 5.545 0.045 19 0 "[ . 1 . 2]" 1
1147 1 92 ASP H 1 92 ASP HB2 . . 3.780 3.041 2.180 3.626 . 0 0 "[ . 1 . 2]" 1
1148 1 92 ASP HB3 1 93 ILE H . . 4.490 3.955 3.509 4.457 . 0 0 "[ . 1 . 2]" 1
1149 1 38 VAL HA 1 82 ASN HB2 . . 4.170 3.381 2.816 4.053 . 0 0 "[ . 1 . 2]" 1
1150 1 8 PRO HG3 1 82 ASN HB2 . . 4.880 4.752 4.445 4.918 0.038 17 0 "[ . 1 . 2]" 1
1151 1 44 PHE HB3 1 53 GLU HG2 . . 5.020 3.188 2.552 3.935 . 0 0 "[ . 1 . 2]" 1
1152 1 93 ILE HB 1 94 THR H . . 4.500 4.409 4.369 4.434 . 0 0 "[ . 1 . 2]" 1
1153 1 76 LEU HB3 1 93 ILE HB . . 4.550 4.136 3.779 4.403 . 0 0 "[ . 1 . 2]" 1
1154 1 27 THR HB 1 28 TRP HE3 . . 5.400 5.223 5.121 5.323 . 0 0 "[ . 1 . 2]" 1
1155 1 25 LEU MD2 1 27 THR HB . . 5.460 5.414 5.291 5.473 0.013 9 0 "[ . 1 . 2]" 1
1156 1 27 THR HB 1 28 TRP H . . 3.810 3.825 3.717 3.894 0.084 11 0 "[ . 1 . 2]" 1
1157 1 72 THR HB 1 74 TYR QD . . 4.440 3.543 3.287 3.753 . 0 0 "[ . 1 . 2]" 1
1158 1 72 THR HB 1 74 TYR QE . . 3.190 2.453 2.158 2.663 . 0 0 "[ . 1 . 2]" 1
1159 1 72 THR HB 1 97 THR HG1 . . 3.920 3.890 3.803 3.951 0.031 3 0 "[ . 1 . 2]" 1
1160 1 69 LYS HB3 1 72 THR HB . . 3.870 3.380 3.240 3.519 . 0 0 "[ . 1 . 2]" 1
1161 1 72 THR HB 1 97 THR MG . . 4.440 4.253 4.147 4.341 . 0 0 "[ . 1 . 2]" 1
1162 1 71 PHE HB3 1 99 SER HA . . 4.560 4.402 3.876 4.592 0.032 18 0 "[ . 1 . 2]" 1
1163 1 71 PHE HB2 1 99 SER HA . . 3.600 2.823 2.194 3.062 . 0 0 "[ . 1 . 2]" 1
1164 1 33 TYR H 1 33 TYR HB2 . . 3.760 3.561 3.499 3.638 . 0 0 "[ . 1 . 2]" 1
1165 1 33 TYR HB2 1 34 ALA HA . . 4.900 4.628 4.518 4.781 . 0 0 "[ . 1 . 2]" 1
1166 1 32 ALA MB 1 33 TYR HB2 . . 5.500 5.092 5.014 5.191 . 0 0 "[ . 1 . 2]" 1
1167 1 33 TYR HB2 1 34 ALA MB . . 5.500 5.276 5.115 5.406 . 0 0 "[ . 1 . 2]" 1
1168 1 50 THR HB 1 52 LYS H . . 3.860 3.580 3.006 3.871 0.011 9 0 "[ . 1 . 2]" 1
1169 1 50 THR HA 1 50 THR HB . . 2.940 2.504 2.466 2.600 . 0 0 "[ . 1 . 2]" 1
1170 1 47 GLU HB3 1 50 THR HB . . 5.130 4.532 4.096 4.847 . 0 0 "[ . 1 . 2]" 1
1171 1 50 THR HB 1 52 LYS QD . . 5.190 3.987 1.829 5.207 0.017 14 0 "[ . 1 . 2]" 1
1172 1 46 THR HB 1 75 SER H . . 4.220 3.900 3.453 4.235 0.015 4 0 "[ . 1 . 2]" 1
1173 1 46 THR HB 1 75 SER QB . . 3.910 3.257 2.653 3.888 . 0 0 "[ . 1 . 2]" 1
1174 1 46 THR HB 1 48 VAL HA . . 5.500 5.267 4.917 5.516 0.016 3 0 "[ . 1 . 2]" 1
1175 1 46 THR HB 1 47 GLU H . . 4.660 4.107 3.918 4.316 . 0 0 "[ . 1 . 2]" 1
1176 1 94 THR H 1 94 THR HB . . 2.980 2.648 2.603 2.709 . 0 0 "[ . 1 . 2]" 1
1177 1 75 SER HA 1 94 THR HB . . 5.410 5.276 4.948 5.417 0.007 10 0 "[ . 1 . 2]" 1
1178 1 73 GLU HG3 1 94 THR HB . . 5.000 4.634 4.460 4.873 . 0 0 "[ . 1 . 2]" 1
1179 1 94 THR HB 1 95 VAL QG . . 4.600 4.465 4.357 4.559 . 0 0 "[ . 1 . 2]" 1
1180 1 35 ASN HB2 1 84 TYR QD . . 5.000 4.561 3.585 5.000 0.000 3 0 "[ . 1 . 2]" 1
1181 1 35 ASN HB3 1 84 TYR QD . . 5.000 3.242 2.817 5.002 0.002 8 0 "[ . 1 . 2]" 1
1182 1 35 ASN HB3 1 36 GLY H . . 4.820 4.344 3.922 4.523 . 0 0 "[ . 1 . 2]" 1
1183 1 13 ASN H 1 13 ASN HB2 . . 4.140 3.322 3.202 3.498 . 0 0 "[ . 1 . 2]" 1
1184 1 13 ASN HB2 1 29 GLU HB2 . . 4.010 2.031 1.990 2.165 . 0 0 "[ . 1 . 2]" 1
1185 1 13 ASN HB3 1 29 GLU HB2 . . 4.010 3.602 3.410 3.907 . 0 0 "[ . 1 . 2]" 1
1186 1 53 GLU HA 1 53 GLU HG2 . . 3.720 3.011 2.475 3.459 . 0 0 "[ . 1 . 2]" 1
1187 1 44 PHE QD 1 53 GLU HG3 . . 4.610 4.189 3.426 4.620 0.010 18 0 "[ . 1 . 2]" 1
1188 1 53 GLU HA 1 53 GLU HG3 . . 3.720 2.919 2.410 3.660 . 0 0 "[ . 1 . 2]" 1
1189 1 42 ARG HG2 1 57 GLU HG2 . . 4.760 3.484 2.519 4.506 . 0 0 "[ . 1 . 2]" 1
1190 1 29 GLU HG3 1 30 PRO HD2 . . 4.200 3.634 2.342 4.050 . 0 0 "[ . 1 . 2]" 1
1191 1 44 PHE HB3 1 53 GLU HG3 . . 5.020 2.853 2.417 3.257 . 0 0 "[ . 1 . 2]" 1
1192 1 42 ARG HG2 1 57 GLU HG3 . . 5.370 3.936 3.073 4.974 . 0 0 "[ . 1 . 2]" 1
1193 1 19 THR HB 1 20 SER H . . 5.120 4.469 4.312 4.571 . 0 0 "[ . 1 . 2]" 1
1194 1 53 GLU H 1 53 GLU HG3 . . 4.740 4.680 4.559 4.763 0.023 16 0 "[ . 1 . 2]" 1
1195 1 57 GLU HG3 1 81 TYR QE . . 5.500 5.157 4.714 5.493 . 0 0 "[ . 1 . 2]" 1
1196 1 42 ARG QB 1 57 GLU HG3 . . 5.500 5.115 4.604 5.445 . 0 0 "[ . 1 . 2]" 1
1197 1 57 GLU H 1 57 GLU HG2 . . 4.230 4.134 3.934 4.202 . 0 0 "[ . 1 . 2]" 1
1198 1 57 GLU HG2 1 81 TYR QE . . 4.720 3.657 3.242 4.062 . 0 0 "[ . 1 . 2]" 1
1199 1 42 ARG HG3 1 57 GLU HG2 . . 4.970 2.765 2.271 3.108 . 0 0 "[ . 1 . 2]" 1
1200 1 66 GLU HA 1 66 GLU HG2 . . 3.960 2.637 2.537 2.791 . 0 0 "[ . 1 . 2]" 1
1201 1 65 LEU HA 1 66 GLU HG2 . . 4.920 4.372 3.563 4.668 . 0 0 "[ . 1 . 2]" 1
1202 1 64 LYS QG 1 66 GLU HG2 . . 4.010 3.299 2.678 3.682 . 0 0 "[ . 1 . 2]" 1
1203 1 57 GLU H 1 57 GLU HG3 . . 3.940 3.585 3.329 3.734 . 0 0 "[ . 1 . 2]" 1
1204 1 73 GLU HG3 1 74 TYR H . . 4.240 3.533 3.264 3.750 . 0 0 "[ . 1 . 2]" 1
1205 1 73 GLU H 1 73 GLU HG3 . . 4.530 4.419 4.297 4.508 . 0 0 "[ . 1 . 2]" 1
1206 1 66 GLU HA 1 66 GLU HG3 . . 3.960 3.400 3.229 3.825 . 0 0 "[ . 1 . 2]" 1
1207 1 64 LYS QD 1 66 GLU HG3 . . 4.860 4.049 3.388 4.870 0.010 5 0 "[ . 1 . 2]" 1
1208 1 64 LYS QG 1 66 GLU HG3 . . 4.010 3.804 2.888 4.027 0.017 13 0 "[ . 1 . 2]" 1
1209 1 73 GLU HG2 1 74 TYR H . . 4.280 3.959 3.594 4.231 . 0 0 "[ . 1 . 2]" 1
1210 1 73 GLU HA 1 73 GLU HG2 . . 3.940 3.302 3.079 3.466 . 0 0 "[ . 1 . 2]" 1
1211 1 73 GLU HG2 1 94 THR MG . . 3.770 2.476 2.198 2.687 . 0 0 "[ . 1 . 2]" 1
1212 1 73 GLU H 1 73 GLU HG2 . . 4.800 4.485 4.392 4.615 . 0 0 "[ . 1 . 2]" 1
1213 1 74 TYR H 1 95 VAL HB . . 4.810 4.769 4.624 4.828 0.018 16 0 "[ . 1 . 2]" 1
1214 1 74 TYR HB3 1 95 VAL HB . . 5.500 5.023 4.641 5.323 . 0 0 "[ . 1 . 2]" 1
1215 1 23 SER HB2 1 66 GLU HA . . 4.800 4.327 3.348 4.878 0.078 16 0 "[ . 1 . 2]" 1
1216 1 23 SER HB2 1 64 LYS HE3 . . 5.500 4.265 2.884 5.207 . 0 0 "[ . 1 . 2]" 1
1217 1 23 SER HB3 1 68 LEU MD1 . . 5.500 4.276 4.062 4.456 . 0 0 "[ . 1 . 2]" 1
1218 1 23 SER HB3 1 66 GLU HA . . 4.800 4.070 3.612 4.892 0.092 20 0 "[ . 1 . 2]" 1
1219 1 23 SER HB3 1 64 LYS QD . . 5.050 4.634 3.584 5.065 0.015 3 0 "[ . 1 . 2]" 1
1220 1 23 SER HB3 1 64 LYS QG . . 4.330 3.909 2.856 4.319 . 0 0 "[ . 1 . 2]" 1
1221 1 12 GLU HG2 1 13 ASN H . . 5.140 4.615 4.293 4.952 . 0 0 "[ . 1 . 2]" 1
1222 1 12 GLU HG2 1 31 PRO HA . . 4.120 2.691 2.011 3.384 . 0 0 "[ . 1 . 2]" 1
1223 1 11 VAL HA 1 12 GLU HG2 . . 4.970 3.686 3.162 4.774 . 0 0 "[ . 1 . 2]" 1
1224 1 12 GLU HG3 1 31 PRO HA . . 4.120 2.553 1.993 3.260 . 0 0 "[ . 1 . 2]" 1
1225 1 12 GLU HA 1 12 GLU HG3 . . 4.070 3.667 3.477 3.875 . 0 0 "[ . 1 . 2]" 1
1226 1 11 VAL HA 1 12 GLU HG3 . . 4.970 4.098 3.215 4.819 . 0 0 "[ . 1 . 2]" 1
1227 1 47 GLU H 1 47 GLU HG2 . . 4.700 4.499 4.410 4.666 . 0 0 "[ . 1 . 2]" 1
1228 1 47 GLU HG2 1 74 TYR QE . . 4.190 3.747 3.472 4.126 . 0 0 "[ . 1 . 2]" 1
1229 1 47 GLU HA 1 47 GLU HG2 . . 3.750 3.112 2.798 3.756 0.006 11 0 "[ . 1 . 2]" 1
1230 1 95 VAL HB 1 96 VAL H . . 4.470 4.388 4.340 4.412 . 0 0 "[ . 1 . 2]" 1
1231 1 74 TYR HB2 1 95 VAL HB . . 4.460 4.130 3.944 4.317 . 0 0 "[ . 1 . 2]" 1
1232 1 24 ILE HG12 1 95 VAL HB . . 4.850 3.928 3.730 4.091 . 0 0 "[ . 1 . 2]" 1
1233 1 16 ALA MB 1 95 VAL HB . . 4.290 3.847 3.639 4.082 . 0 0 "[ . 1 . 2]" 1
1234 1 94 THR HA 1 95 VAL HB . . 4.910 4.654 4.607 4.702 . 0 0 "[ . 1 . 2]" 1
1235 1 47 GLU H 1 47 GLU HG3 . . 4.700 4.495 4.406 4.686 . 0 0 "[ . 1 . 2]" 1
1236 1 23 SER HB2 1 64 LYS QD . . 5.050 4.204 2.596 4.912 . 0 0 "[ . 1 . 2]" 1
1237 1 23 SER HB3 1 64 LYS HE3 . . 5.500 4.878 3.381 5.510 0.010 3 0 "[ . 1 . 2]" 1
1238 1 58 VAL HB 1 59 ASP H . . 3.360 2.429 2.118 3.020 . 0 0 "[ . 1 . 2]" 1
1239 1 58 VAL HB 1 63 TYR HB3 . . 4.940 4.002 3.421 4.461 . 0 0 "[ . 1 . 2]" 1
1240 1 58 VAL HB 1 63 TYR QE . . 4.930 3.947 3.568 4.371 . 0 0 "[ . 1 . 2]" 1
1241 1 28 TRP HH2 1 58 VAL HB . . 4.290 3.206 2.593 3.520 . 0 0 "[ . 1 . 2]" 1
1242 1 58 VAL HB 1 63 TYR HB2 . . 4.520 2.847 2.307 3.185 . 0 0 "[ . 1 . 2]" 1
1243 1 48 VAL HA 1 74 TYR HA . . 5.500 5.445 5.277 5.507 0.007 14 0 "[ . 1 . 2]" 1
1244 1 47 GLU HA 1 48 VAL HA . . 4.540 4.448 4.379 4.526 . 0 0 "[ . 1 . 2]" 1
1245 1 48 VAL HA 1 51 GLY HA2 . . 4.290 3.499 3.341 3.621 . 0 0 "[ . 1 . 2]" 1
1246 1 69 LYS H 1 69 LYS HB2 . . 3.590 2.321 2.237 2.380 . 0 0 "[ . 1 . 2]" 1
1247 1 69 LYS HB2 1 72 THR HG1 . . 4.240 2.953 2.099 3.643 . 0 0 "[ . 1 . 2]" 1
1248 1 69 LYS HB2 1 72 THR HB . . 4.390 2.271 2.181 2.398 . 0 0 "[ . 1 . 2]" 1
1249 1 69 LYS HB2 1 74 TYR QE . . 5.060 2.526 2.323 2.726 . 0 0 "[ . 1 . 2]" 1
1250 1 69 LYS HB3 1 72 THR MG . . 4.460 4.140 4.065 4.235 . 0 0 "[ . 1 . 2]" 1
1251 1 69 LYS HB2 1 72 THR MG . . 4.000 3.352 3.279 3.432 . 0 0 "[ . 1 . 2]" 1
1252 1 69 LYS HB3 1 74 TYR QE . . 4.930 4.082 3.792 4.316 . 0 0 "[ . 1 . 2]" 1
1253 1 69 LYS HB3 1 72 THR HG1 . . 4.330 2.619 1.978 3.226 . 0 0 "[ . 1 . 2]" 1
1254 1 39 GLN QG 1 82 ASN HB3 . . 4.830 4.080 3.564 4.456 . 0 0 "[ . 1 . 2]" 1
1255 1 39 GLN QG 1 82 ASN HA . . 3.610 2.287 1.973 2.601 . 0 0 "[ . 1 . 2]" 1
1256 1 38 VAL HA 1 39 GLN QG . . 4.520 4.260 4.017 4.518 . 0 0 "[ . 1 . 2]" 1
1257 1 39 GLN QG 1 82 ASN HB2 . . 4.820 3.289 2.627 3.762 . 0 0 "[ . 1 . 2]" 1
1258 1 38 VAL MG1 1 39 GLN QG . . 5.300 4.866 4.749 5.010 . 0 0 "[ . 1 . 2]" 1
1259 1 39 GLN QG 1 83 ARG QD . . 5.500 4.926 3.471 5.496 . 0 0 "[ . 1 . 2]" 1
1260 1 45 CYS H 1 54 GLN QG . . 4.000 2.644 2.364 2.875 . 0 0 "[ . 1 . 2]" 1
1261 1 44 PHE HA 1 54 GLN QG . . 4.970 4.116 3.730 4.464 . 0 0 "[ . 1 . 2]" 1
1262 1 53 GLU HA 1 54 GLN QG . . 5.500 3.892 3.746 4.002 . 0 0 "[ . 1 . 2]" 1
1263 1 54 GLN QG 1 55 ASN HA . . 5.500 4.187 3.968 4.406 . 0 0 "[ . 1 . 2]" 1
1264 1 54 GLN QG 1 56 ILE HG12 . . 4.580 3.958 3.575 4.182 . 0 0 "[ . 1 . 2]" 1
1265 1 54 GLN QG 1 55 ASN H . . 4.480 4.027 3.792 4.201 . 0 0 "[ . 1 . 2]" 1
1266 1 15 GLN HA 1 15 GLN HG2 . . 3.890 2.374 2.215 2.586 . 0 0 "[ . 1 . 2]" 1
1267 1 15 GLN H 1 15 GLN HG3 . . 4.490 4.067 3.688 4.510 0.020 11 0 "[ . 1 . 2]" 1
1268 1 15 GLN HA 1 15 GLN HG3 . . 3.890 3.317 2.956 3.693 . 0 0 "[ . 1 . 2]" 1
1269 1 53 GLU HB3 1 54 GLN H . . 4.280 4.031 3.838 4.265 . 0 0 "[ . 1 . 2]" 1
1270 1 52 LYS HA 1 53 GLU HB3 . . 4.690 4.500 4.418 4.604 . 0 0 "[ . 1 . 2]" 1
1271 1 53 GLU HB2 1 54 GLN H . . 4.280 3.997 3.848 4.223 . 0 0 "[ . 1 . 2]" 1
1272 1 77 ARG HB2 1 77 ARG HE . . 4.510 3.111 2.083 4.353 . 0 0 "[ . 1 . 2]" 1
1273 1 44 PHE HB2 1 77 ARG HB2 . . 3.790 3.594 3.328 3.787 . 0 0 "[ . 1 . 2]" 1
1274 1 76 LEU HA 1 77 ARG HB2 . . 4.980 4.270 4.137 4.456 . 0 0 "[ . 1 . 2]" 1
1275 1 77 ARG HB2 1 77 ARG QD . . 3.860 2.478 2.151 3.159 . 0 0 "[ . 1 . 2]" 1
1276 1 77 ARG HB3 1 92 ASP HA . . 5.370 5.100 4.896 5.196 . 0 0 "[ . 1 . 2]" 1
1277 1 77 ARG HB3 1 77 ARG QD . . 3.810 2.763 2.246 3.420 . 0 0 "[ . 1 . 2]" 1
1278 1 44 PHE HB2 1 77 ARG HB3 . . 3.860 2.195 1.998 2.490 . 0 0 "[ . 1 . 2]" 1
1279 1 76 LEU HA 1 77 ARG HB3 . . 5.130 4.511 4.325 4.682 . 0 0 "[ . 1 . 2]" 1
1280 1 42 ARG QB 1 86 PRO QB . . 4.680 4.323 3.911 4.679 . 0 0 "[ . 1 . 2]" 1
1281 1 42 ARG QB 1 44 PHE HZ . . 4.270 2.819 2.395 3.492 . 0 0 "[ . 1 . 2]" 1
1282 1 42 ARG QB 1 79 LEU HG . . 3.880 2.971 2.716 3.160 . 0 0 "[ . 1 . 2]" 1
1283 1 8 PRO HB2 1 38 VAL MG1 . . 5.000 4.588 4.084 4.940 . 0 0 "[ . 1 . 2]" 1
1284 1 21 PRO HB3 1 100 ASP HA . . 5.050 4.360 4.224 4.610 . 0 0 "[ . 1 . 2]" 1
1285 1 81 TYR HB2 1 86 PRO QB . . 4.830 3.167 3.018 3.412 . 0 0 "[ . 1 . 2]" 1
1286 1 21 PRO HB2 1 70 LYS HA . . 3.930 3.596 3.474 3.658 . 0 0 "[ . 1 . 2]" 1
1287 1 87 GLY HA2 1 88 VAL HB . . 5.500 5.458 5.020 5.520 0.020 19 0 "[ . 1 . 2]" 1
1288 1 28 TRP HE3 1 62 SER QB . . 5.490 5.113 4.505 5.449 . 0 0 "[ . 1 . 2]" 1
1289 1 28 TRP HZ3 1 62 SER QB . . 5.500 4.409 3.844 4.744 . 0 0 "[ . 1 . 2]" 1
1290 1 61 LEU H 1 62 SER QB . . 5.470 4.352 4.000 5.284 . 0 0 "[ . 1 . 2]" 1
1291 1 27 THR HB 1 62 SER QB . . 4.380 4.055 3.463 4.361 . 0 0 "[ . 1 . 2]" 1
1292 1 61 LEU QB 1 62 SER QB . . 5.020 3.709 3.380 3.995 . 0 0 "[ . 1 . 2]" 1
1293 1 25 LEU HG 1 62 SER QB . . 4.580 4.034 3.450 4.525 . 0 0 "[ . 1 . 2]" 1
1294 1 25 LEU MD1 1 62 SER QB . . 3.310 3.037 2.606 3.329 0.019 10 0 "[ . 1 . 2]" 1
1295 1 21 PRO HB3 1 70 LYS HA . . 4.170 3.191 3.006 3.274 . 0 0 "[ . 1 . 2]" 1
1296 1 21 PRO HB3 1 100 ASP QB . . 4.800 2.579 2.138 2.912 . 0 0 "[ . 1 . 2]" 1
1297 1 21 PRO HB3 1 70 LYS QD . . 4.200 3.514 1.758 4.213 0.013 20 0 "[ . 1 . 2]" 1
1298 1 21 PRO HB3 1 70 LYS HG2 . . 4.430 3.963 3.616 4.305 . 0 0 "[ . 1 . 2]" 1
1299 1 8 PRO HG2 1 86 PRO QB . . 5.500 5.435 5.162 5.508 0.008 19 0 "[ . 1 . 2]" 1
1300 1 66 GLU HB3 1 68 LEU H . . 5.070 4.765 4.682 4.841 . 0 0 "[ . 1 . 2]" 1
1301 1 73 GLU HA 1 96 VAL HB . . 4.720 4.495 4.396 4.663 . 0 0 "[ . 1 . 2]" 1
1302 1 66 GLU HB2 1 67 GLY HA2 . . 5.080 4.902 4.845 5.051 . 0 0 "[ . 1 . 2]" 1
1303 1 9 GLY HA2 1 88 VAL HB . . 4.200 3.475 3.243 3.741 . 0 0 "[ . 1 . 2]" 1
1304 1 10 PRO HD2 1 88 VAL HB . . 4.440 3.995 3.750 4.525 0.085 6 0 "[ . 1 . 2]" 1
1305 1 45 CYS HB3 1 54 GLN HB2 . . 4.690 4.643 4.477 4.721 0.031 19 0 "[ . 1 . 2]" 1
1306 1 11 VAL MG1 1 31 PRO HB3 . . 4.320 3.603 3.284 3.871 . 0 0 "[ . 1 . 2]" 1
1307 1 15 GLN HB3 1 16 ALA H . . 3.310 3.031 2.819 3.209 . 0 0 "[ . 1 . 2]" 1
1308 1 38 VAL HB 1 40 GLY H . . 5.420 4.511 4.308 4.666 . 0 0 "[ . 1 . 2]" 1
1309 1 37 PRO HA 1 38 VAL HB . . 4.690 4.583 4.511 4.633 . 0 0 "[ . 1 . 2]" 1
1310 1 38 VAL HB 1 80 ALA MB . . 5.500 5.016 4.750 5.327 . 0 0 "[ . 1 . 2]" 1
1311 1 45 CYS HB3 1 54 GLN HB3 . . 4.690 4.479 4.375 4.573 . 0 0 "[ . 1 . 2]" 1
1312 1 52 LYS H 1 52 LYS HB2 . . 3.650 2.574 2.281 3.683 0.033 14 0 "[ . 1 . 2]" 1
1313 1 50 THR HG1 1 52 LYS HB2 . . 4.770 2.949 2.412 4.739 . 0 0 "[ . 1 . 2]" 1
1314 1 96 VAL HB 1 97 THR H . . 4.430 4.279 4.210 4.333 . 0 0 "[ . 1 . 2]" 1
1315 1 52 LYS HB3 1 53 GLU H . . 4.320 3.336 2.887 4.250 . 0 0 "[ . 1 . 2]" 1
1316 1 50 THR HG1 1 52 LYS HB3 . . 4.770 4.147 2.811 4.745 . 0 0 "[ . 1 . 2]" 1
1317 1 31 PRO HB3 1 33 TYR H . . 4.920 4.651 4.463 4.829 . 0 0 "[ . 1 . 2]" 1
1318 1 11 VAL HA 1 31 PRO HB3 . . 4.090 2.193 1.988 2.393 . 0 0 "[ . 1 . 2]" 1
1319 1 31 PRO HB3 1 34 ALA MB . . 4.390 3.609 3.214 3.941 . 0 0 "[ . 1 . 2]" 1
1320 1 46 THR H 1 75 SER QB . . 4.630 4.218 3.834 4.654 0.024 16 0 "[ . 1 . 2]" 1
1321 1 48 VAL HB 1 75 SER QB . . 5.500 4.990 4.636 5.350 . 0 0 "[ . 1 . 2]" 1
1322 1 75 SER QB 1 76 LEU HG . . 5.500 5.236 5.034 5.381 . 0 0 "[ . 1 . 2]" 1
1323 1 12 GLU HB2 1 13 ASN HD21 . . 4.670 3.518 2.556 4.390 . 0 0 "[ . 1 . 2]" 1
1324 1 12 GLU HB2 1 13 ASN HA . . 5.030 4.781 4.150 5.048 0.018 17 0 "[ . 1 . 2]" 1
1325 1 12 GLU H 1 12 GLU HB3 . . 3.970 3.687 3.421 3.837 . 0 0 "[ . 1 . 2]" 1
1326 1 89 SER H 1 89 SER QB . . 3.170 2.692 2.385 2.941 . 0 0 "[ . 1 . 2]" 1
1327 1 77 ARG QD 1 89 SER QB . . 4.150 2.644 2.201 3.298 . 0 0 "[ . 1 . 2]" 1
1328 1 79 LEU HB2 1 89 SER QB . . 3.820 3.330 2.703 3.826 0.006 3 0 "[ . 1 . 2]" 1
1329 1 79 LEU HB3 1 89 SER QB . . 4.620 2.462 2.030 2.816 . 0 0 "[ . 1 . 2]" 1
1330 1 77 ARG HG3 1 89 SER QB . . 4.220 3.046 2.748 3.956 . 0 0 "[ . 1 . 2]" 1
1331 1 78 PHE H 1 89 SER QB . . 4.970 4.694 4.361 4.984 0.014 17 0 "[ . 1 . 2]" 1
1332 1 6 SER QB 1 84 TYR HB3 . . 5.190 4.584 3.276 4.899 . 0 0 "[ . 1 . 2]" 1
1333 1 6 SER QB 1 84 TYR QD . . 4.680 3.945 3.367 4.682 0.002 20 0 "[ . 1 . 2]" 1
1334 1 6 SER QB 1 35 ASN HD21 . . 5.050 2.274 1.864 3.858 . 0 0 "[ . 1 . 2]" 1
1335 1 6 SER QB 1 84 TYR HB2 . . 5.190 4.866 3.989 5.209 0.019 9 0 "[ . 1 . 2]" 1
1336 1 74 TYR HA 1 75 SER QB . . 4.440 4.125 3.955 4.365 . 0 0 "[ . 1 . 2]" 1
1337 1 99 SER H 1 99 SER HB2 . . 3.620 3.437 3.356 3.491 . 0 0 "[ . 1 . 2]" 1
1338 1 71 PHE QD 1 99 SER HB2 . . 4.050 2.060 1.989 2.574 . 0 0 "[ . 1 . 2]" 1
1339 1 71 PHE HB2 1 99 SER HB2 . . 3.830 2.441 2.201 2.627 . 0 0 "[ . 1 . 2]" 1
1340 1 70 LYS QD 1 99 SER HB2 . . 5.500 5.350 5.002 5.538 0.038 19 0 "[ . 1 . 2]" 1
1341 1 98 LEU HB3 1 99 SER HB2 . . 5.500 5.339 5.243 5.399 . 0 0 "[ . 1 . 2]" 1
1342 1 98 LEU HA 1 99 SER HB3 . . 4.440 4.364 4.294 4.469 0.029 18 0 "[ . 1 . 2]" 1
1343 1 71 PHE HB2 1 99 SER HB3 . . 4.170 4.130 3.955 4.191 0.021 15 0 "[ . 1 . 2]" 1
1344 1 98 LEU HB3 1 99 SER HB3 . . 4.930 4.651 4.519 4.795 . 0 0 "[ . 1 . 2]" 1
1345 1 71 PHE HA 1 99 SER HB2 . . 4.630 4.586 4.381 4.678 0.048 13 0 "[ . 1 . 2]" 1
1346 1 99 SER HB3 1 100 ASP HA . . 5.500 5.472 5.306 5.534 0.034 16 0 "[ . 1 . 2]" 1
1347 1 10 PRO QB 1 90 THR HA . . 4.590 3.854 3.564 4.268 . 0 0 "[ . 1 . 2]" 1
1348 1 38 VAL HA 1 38 VAL MG2 . . 3.310 2.292 2.239 2.421 . 0 0 "[ . 1 . 2]" 1
1349 1 11 VAL HB 1 28 TRP HB3 . . 5.290 4.742 4.440 4.890 . 0 0 "[ . 1 . 2]" 1
1350 1 11 VAL HB 1 31 PRO HA . . 5.180 4.982 4.755 5.191 0.011 1 0 "[ . 1 . 2]" 1
1351 1 11 VAL HB 1 28 TRP HB2 . . 4.050 3.072 2.790 3.222 . 0 0 "[ . 1 . 2]" 1
1352 1 11 VAL HB 1 90 THR MG . . 5.380 4.995 4.635 5.319 . 0 0 "[ . 1 . 2]" 1
1353 1 11 VAL HB 1 14 LEU MD1 . . 5.030 4.342 4.126 4.620 . 0 0 "[ . 1 . 2]" 1
1354 1 48 VAL HB 1 74 TYR HA . . 5.130 4.140 3.977 4.269 . 0 0 "[ . 1 . 2]" 1
1355 1 48 VAL HB 1 49 SER HA . . 4.540 4.218 4.163 4.345 . 0 0 "[ . 1 . 2]" 1
1356 1 18 SER HB3 1 97 THR HA . . 3.600 2.781 2.609 2.943 . 0 0 "[ . 1 . 2]" 1
1357 1 38 VAL HA 1 40 GLY H . . 4.090 3.702 3.582 3.791 . 0 0 "[ . 1 . 2]" 1
1358 1 38 VAL HA 1 82 ASN HB3 . . 3.840 2.439 2.081 2.861 . 0 0 "[ . 1 . 2]" 1
1359 1 37 PRO HB2 1 38 VAL HA . . 4.820 4.156 4.142 4.190 . 0 0 "[ . 1 . 2]" 1
1360 1 38 VAL HA 1 38 VAL MG1 . . 3.320 2.403 2.316 2.466 . 0 0 "[ . 1 . 2]" 1
1361 1 5 SER HB2 1 84 TYR QD . . 5.040 4.079 2.413 5.013 . 0 0 "[ . 1 . 2]" 1
1362 1 5 SER HB3 1 84 TYR QD . . 5.040 3.876 2.413 5.041 0.001 15 0 "[ . 1 . 2]" 1
1363 1 73 GLU HB2 1 94 THR MG . . 4.500 4.032 3.841 4.276 . 0 0 "[ . 1 . 2]" 1
1364 1 73 GLU HB3 1 94 THR MG . . 4.500 4.230 3.995 4.389 . 0 0 "[ . 1 . 2]" 1
1365 1 11 VAL HA 1 31 PRO HG3 . . 3.800 3.202 2.770 3.506 . 0 0 "[ . 1 . 2]" 1
1366 1 11 VAL HA 1 31 PRO HA . . 3.650 3.230 3.020 3.483 . 0 0 "[ . 1 . 2]" 1
1367 1 18 SER HB3 1 24 ILE HG12 . . 4.700 4.494 4.392 4.613 . 0 0 "[ . 1 . 2]" 1
1368 1 18 SER HB3 1 98 LEU MD2 . . 3.380 2.447 2.338 2.557 . 0 0 "[ . 1 . 2]" 1
1369 1 18 SER HB3 1 98 LEU HG . . 3.650 2.911 2.713 3.142 . 0 0 "[ . 1 . 2]" 1
1370 1 18 SER HB3 1 98 LEU MD1 . . 4.210 4.036 3.865 4.221 0.011 17 0 "[ . 1 . 2]" 1
1371 1 18 SER HB2 1 24 ILE HA . . 4.010 3.065 2.894 3.253 . 0 0 "[ . 1 . 2]" 1
1372 1 18 SER HB2 1 24 ILE HG12 . . 4.580 2.755 2.666 2.857 . 0 0 "[ . 1 . 2]" 1
1373 1 18 SER HB2 1 20 SER H . . 5.060 4.469 4.402 4.545 . 0 0 "[ . 1 . 2]" 1
1374 1 18 SER HB2 1 98 LEU H . . 4.250 4.033 3.910 4.121 . 0 0 "[ . 1 . 2]" 1
1375 1 18 SER HB2 1 97 THR HA . . 3.520 2.972 2.819 3.082 . 0 0 "[ . 1 . 2]" 1
1376 1 18 SER HB2 1 98 LEU HG . . 4.540 4.251 4.097 4.415 . 0 0 "[ . 1 . 2]" 1
1377 1 29 GLU HB3 1 30 PRO HD3 . . 4.060 3.443 3.422 3.537 . 0 0 "[ . 1 . 2]" 1
1378 1 30 PRO HB3 1 31 PRO HD2 . . 4.400 3.449 3.368 3.532 . 0 0 "[ . 1 . 2]" 1
1379 1 39 GLN HB2 1 82 ASN HA . . 4.120 2.410 2.129 2.591 . 0 0 "[ . 1 . 2]" 1
1380 1 29 GLU HB2 1 30 PRO HD3 . . 5.300 4.669 4.648 4.713 . 0 0 "[ . 1 . 2]" 1
1381 1 29 GLU HB2 1 61 LEU MD2 . . 5.500 4.436 3.938 4.938 . 0 0 "[ . 1 . 2]" 1
1382 1 39 GLN HB3 1 82 ASN HA . . 4.120 3.998 3.806 4.115 . 0 0 "[ . 1 . 2]" 1
1383 1 102 GLY H 1 103 PRO HA . . 4.950 4.592 4.140 5.001 0.051 6 0 "[ . 1 . 2]" 1
1384 1 28 TRP HB3 1 29 GLU H . . 3.960 3.717 3.585 3.952 . 0 0 "[ . 1 . 2]" 1
1385 1 28 TRP HB3 1 28 TRP HE3 . . 4.180 2.731 2.708 2.763 . 0 0 "[ . 1 . 2]" 1
1386 1 14 LEU HB2 1 28 TRP HB3 . . 4.240 3.585 3.266 3.812 . 0 0 "[ . 1 . 2]" 1
1387 1 14 LEU HB2 1 28 TRP HB2 . . 4.780 3.275 3.018 3.519 . 0 0 "[ . 1 . 2]" 1
1388 1 12 GLU H 1 29 GLU HB3 . . 5.500 4.140 3.963 4.328 . 0 0 "[ . 1 . 2]" 1
1389 1 12 GLU HB2 1 29 GLU HB2 . . 4.410 3.547 2.825 4.255 . 0 0 "[ . 1 . 2]" 1
1390 1 8 PRO HD2 1 86 PRO HA . . 4.940 3.459 3.287 3.746 . 0 0 "[ . 1 . 2]" 1
1391 1 72 THR HA 1 97 THR H . . 5.230 5.066 4.967 5.175 . 0 0 "[ . 1 . 2]" 1
1392 1 71 PHE HA 1 72 THR HA . . 4.820 4.360 4.356 4.363 . 0 0 "[ . 1 . 2]" 1
1393 1 72 THR HA 1 72 THR MG . . 3.130 2.422 2.338 2.481 . 0 0 "[ . 1 . 2]" 1
1394 1 81 TYR HA 1 86 PRO HA . . 3.880 2.276 2.088 2.427 . 0 0 "[ . 1 . 2]" 1
1395 1 47 GLU HB3 1 50 THR HG1 . . 4.200 2.682 2.008 2.910 . 0 0 "[ . 1 . 2]" 1
1396 1 47 GLU HB3 1 74 TYR QE . . 4.470 3.782 3.574 4.091 . 0 0 "[ . 1 . 2]" 1
1397 1 46 THR HA 1 47 GLU HB3 . . 4.980 4.705 4.621 4.797 . 0 0 "[ . 1 . 2]" 1
1398 1 57 GLU H 1 57 GLU HB3 . . 3.600 3.539 3.477 3.586 . 0 0 "[ . 1 . 2]" 1
1399 1 56 ILE HA 1 57 GLU HB3 . . 5.500 5.574 5.562 5.589 0.089 2 0 "[ . 1 . 2]" 1
1400 1 47 GLU HB2 1 49 SER H . . 5.130 4.812 4.541 4.976 . 0 0 "[ . 1 . 2]" 1
1401 1 47 GLU HB2 1 50 THR HG1 . . 4.370 4.100 3.451 4.378 0.008 14 0 "[ . 1 . 2]" 1
1402 1 47 GLU HB2 1 72 THR MG . . 4.950 4.723 4.529 4.932 . 0 0 "[ . 1 . 2]" 1
1403 1 47 GLU HB2 1 48 VAL H . . 4.990 4.475 4.294 4.575 . 0 0 "[ . 1 . 2]" 1
1404 1 47 GLU HB2 1 74 TYR QD . . 4.410 3.534 3.371 3.848 . 0 0 "[ . 1 . 2]" 1
1405 1 46 THR HA 1 47 GLU HB2 . . 4.670 4.436 4.330 4.527 . 0 0 "[ . 1 . 2]" 1
1406 1 47 GLU HB2 1 50 THR MG . . 5.040 4.844 4.583 5.062 0.022 9 0 "[ . 1 . 2]" 1
1407 1 70 LYS HA 1 70 LYS QD . . 4.400 3.642 2.003 4.067 . 0 0 "[ . 1 . 2]" 1
1408 1 69 LYS H 1 69 LYS QD . . 4.910 4.221 3.522 4.740 . 0 0 "[ . 1 . 2]" 1
1409 1 70 LYS H 1 70 LYS QD . . 5.470 4.345 3.692 4.611 . 0 0 "[ . 1 . 2]" 1
1410 1 70 LYS QD 1 99 SER HA . . 4.870 3.727 3.289 3.957 . 0 0 "[ . 1 . 2]" 1
1411 1 69 LYS QD 1 72 THR HG1 . . 4.460 3.154 2.435 3.856 . 0 0 "[ . 1 . 2]" 1
1412 1 26 ILE HG13 1 28 TRP HZ3 . . 5.200 5.055 4.865 5.204 0.004 3 0 "[ . 1 . 2]" 1
1413 1 16 ALA HA 1 26 ILE HG13 . . 4.620 4.096 3.962 4.203 . 0 0 "[ . 1 . 2]" 1
1414 1 26 ILE HG13 1 26 ILE MG . . 3.420 3.148 3.138 3.154 . 0 0 "[ . 1 . 2]" 1
1415 1 26 ILE HG13 1 27 THR H . . 4.960 4.933 4.897 4.961 0.001 8 0 "[ . 1 . 2]" 1
1416 1 64 LYS H 1 64 LYS QD . . 4.890 4.471 4.164 4.594 . 0 0 "[ . 1 . 2]" 1
1417 1 64 LYS QD 1 66 GLU HG2 . . 4.860 3.554 2.939 4.220 . 0 0 "[ . 1 . 2]" 1
1418 1 26 ILE HG12 1 26 ILE MG . . 3.240 2.225 2.141 2.252 . 0 0 "[ . 1 . 2]" 1
1419 1 16 ALA HA 1 26 ILE HG12 . . 4.610 3.921 3.797 3.990 . 0 0 "[ . 1 . 2]" 1
1420 1 50 THR HG1 1 52 LYS QD . . 4.890 3.500 1.875 4.590 . 0 0 "[ . 1 . 2]" 1
1421 1 52 LYS QD 1 53 GLU H . . 5.350 4.962 4.400 5.404 0.054 3 0 "[ . 1 . 2]" 1
1422 1 52 LYS HA 1 52 LYS QD . . 4.500 3.858 2.945 4.430 . 0 0 "[ . 1 . 2]" 1
1423 1 52 LYS H 1 52 LYS QD . . 5.100 3.972 1.954 4.702 . 0 0 "[ . 1 . 2]" 1
1424 1 19 THR HA 1 19 THR MG . . 3.230 2.553 2.452 2.625 . 0 0 "[ . 1 . 2]" 1
1425 1 94 THR MG 1 95 VAL HA . . 4.350 3.781 3.661 3.930 . 0 0 "[ . 1 . 2]" 1
1426 1 95 VAL HA 1 96 VAL HA . . 4.790 4.424 4.406 4.430 . 0 0 "[ . 1 . 2]" 1
1427 1 49 SER HA 1 51 GLY H . . 5.500 5.355 5.108 5.459 . 0 0 "[ . 1 . 2]" 1
1428 1 49 SER HA 1 50 THR HA . . 4.710 4.605 4.591 4.627 . 0 0 "[ . 1 . 2]" 1
1429 1 49 SER HA 1 49 SER QB . . 2.700 2.413 2.291 2.495 . 0 0 "[ . 1 . 2]" 1
1430 1 49 SER HA 1 50 THR MG . . 4.850 4.709 4.607 4.876 0.026 17 0 "[ . 1 . 2]" 1
1431 1 24 ILE HG12 1 25 LEU H . . 5.090 4.493 4.457 4.576 . 0 0 "[ . 1 . 2]" 1
1432 1 24 ILE HA 1 24 ILE HG12 . . 4.180 2.389 2.356 2.459 . 0 0 "[ . 1 . 2]" 1
1433 1 24 ILE HG12 1 68 LEU MD1 . . 3.670 3.111 3.068 3.155 . 0 0 "[ . 1 . 2]" 1
1434 1 24 ILE HG13 1 25 LEU H . . 5.370 5.241 5.213 5.266 . 0 0 "[ . 1 . 2]" 1
1435 1 18 SER HA 1 24 ILE HG13 . . 5.040 4.890 4.673 5.053 0.013 17 0 "[ . 1 . 2]" 1
1436 1 24 ILE HA 1 24 ILE HG13 . . 4.170 3.159 3.137 3.180 . 0 0 "[ . 1 . 2]" 1
1437 1 18 SER HB2 1 24 ILE HG13 . . 4.430 3.961 3.849 4.129 . 0 0 "[ . 1 . 2]" 1
1438 1 9 GLY H 1 31 PRO HG2 . . 5.500 4.565 3.995 5.202 . 0 0 "[ . 1 . 2]" 1
1439 1 31 PRO HG2 1 33 TYR H . . 5.500 5.376 5.196 5.550 0.050 17 0 "[ . 1 . 2]" 1
1440 1 30 PRO HA 1 31 PRO HG2 . . 4.640 4.226 4.198 4.256 . 0 0 "[ . 1 . 2]" 1
1441 1 11 VAL HA 1 31 PRO HG2 . . 4.620 4.394 4.098 4.618 . 0 0 "[ . 1 . 2]" 1
1442 1 8 PRO HB2 1 31 PRO HG2 . . 4.510 4.170 3.823 4.415 . 0 0 "[ . 1 . 2]" 1
1443 1 31 PRO HG2 1 34 ALA MB . . 4.500 2.015 1.867 2.275 . 0 0 "[ . 1 . 2]" 1
1444 1 31 PRO HG2 1 80 ALA MB . . 4.070 3.804 3.515 3.967 . 0 0 "[ . 1 . 2]" 1
1445 1 31 PRO HG2 1 38 VAL MG1 . . 5.050 4.404 4.095 4.816 . 0 0 "[ . 1 . 2]" 1
1446 1 30 PRO HA 1 31 PRO HG3 . . 4.810 4.328 4.324 4.333 . 0 0 "[ . 1 . 2]" 1
1447 1 8 PRO HB2 1 31 PRO HG3 . . 4.410 3.736 3.243 4.145 . 0 0 "[ . 1 . 2]" 1
1448 1 9 GLY H 1 31 PRO HG3 . . 5.110 4.434 3.788 5.088 . 0 0 "[ . 1 . 2]" 1
1449 1 24 ILE HG12 1 95 VAL QG . . 3.900 3.063 2.860 3.260 . 0 0 "[ . 1 . 2]" 1
1450 1 24 ILE HG13 1 65 LEU MD2 . . 3.730 3.007 2.744 3.272 . 0 0 "[ . 1 . 2]" 1
1451 1 45 CYS HB3 1 46 THR H . . 4.920 4.327 4.195 4.403 . 0 0 "[ . 1 . 2]" 1
1452 1 45 CYS HB3 1 54 GLN QG . . 4.100 1.958 1.879 2.024 . 0 0 "[ . 1 . 2]" 1
1453 1 43 LEU HG 1 45 CYS HB3 . . 4.720 4.613 4.431 4.729 0.009 6 0 "[ . 1 . 2]" 1
1454 1 45 CYS HB3 1 76 LEU MD2 . . 3.770 3.444 3.212 3.675 . 0 0 "[ . 1 . 2]" 1
1455 1 45 CYS HB2 1 76 LEU HA . . 4.890 4.414 4.056 4.796 . 0 0 "[ . 1 . 2]" 1
1456 1 45 CYS HB2 1 76 LEU HB3 . . 5.060 4.247 3.952 4.603 . 0 0 "[ . 1 . 2]" 1
1457 1 45 CYS HB2 1 76 LEU MD2 . . 3.400 2.130 1.892 2.437 . 0 0 "[ . 1 . 2]" 1
1458 1 11 VAL HB 1 31 PRO HG3 . . 5.480 4.996 4.731 5.321 . 0 0 "[ . 1 . 2]" 1
1459 1 74 TYR HB2 1 76 LEU HG . . 5.500 4.476 4.253 4.837 . 0 0 "[ . 1 . 2]" 1
1460 1 42 ARG HG3 1 57 GLU HG3 . . 4.590 3.676 2.701 4.362 . 0 0 "[ . 1 . 2]" 1
1461 1 42 ARG HG3 1 43 LEU H . . 4.590 4.042 3.440 4.587 . 0 0 "[ . 1 . 2]" 1
1462 1 55 ASN HA 1 56 ILE HA . . 4.960 4.423 4.404 4.451 . 0 0 "[ . 1 . 2]" 1
1463 1 54 GLN QG 1 56 ILE HA . . 5.500 5.449 5.217 5.506 0.006 18 0 "[ . 1 . 2]" 1
1464 1 56 ILE HA 1 57 GLU HG2 . . 5.500 5.414 5.346 5.506 0.006 19 0 "[ . 1 . 2]" 1
1465 1 56 ILE HA 1 57 GLU HG3 . . 4.830 4.591 4.517 4.754 . 0 0 "[ . 1 . 2]" 1
1466 1 56 ILE HA 1 57 GLU HB2 . . 4.360 4.209 4.172 4.260 . 0 0 "[ . 1 . 2]" 1
1467 1 56 ILE HA 1 56 ILE HG13 . . 3.660 2.849 2.667 2.945 . 0 0 "[ . 1 . 2]" 1
1468 1 56 ILE HA 1 56 ILE HG12 . . 3.490 2.674 2.570 2.828 . 0 0 "[ . 1 . 2]" 1
1469 1 56 ILE HA 1 56 ILE MD . . 3.930 3.873 3.847 3.886 . 0 0 "[ . 1 . 2]" 1
1470 1 21 PRO HG2 1 100 ASP HA . . 4.930 4.920 4.788 4.961 0.031 1 0 "[ . 1 . 2]" 1
1471 1 21 PRO HG2 1 100 ASP QB . . 4.240 3.494 2.958 4.017 . 0 0 "[ . 1 . 2]" 1
1472 1 21 PRO HG2 1 98 LEU MD1 . . 5.500 5.459 5.282 5.515 0.015 2 0 "[ . 1 . 2]" 1
1473 1 45 CYS HA 1 76 LEU HG . . 4.490 4.315 4.118 4.505 0.015 4 0 "[ . 1 . 2]" 1
1474 1 43 LEU MD1 1 76 LEU HG . . 4.760 4.439 4.238 4.682 . 0 0 "[ . 1 . 2]" 1
1475 1 76 LEU H 1 76 LEU HG . . 3.680 2.394 2.221 2.524 . 0 0 "[ . 1 . 2]" 1
1476 1 21 PRO HG3 1 98 LEU HB2 . . 4.340 4.346 4.291 4.382 0.042 20 0 "[ . 1 . 2]" 1
1477 1 21 PRO HG3 1 98 LEU MD1 . . 4.940 4.578 4.339 4.656 . 0 0 "[ . 1 . 2]" 1
1478 1 21 PRO HG3 1 100 ASP HA . . 4.260 3.347 3.211 3.419 . 0 0 "[ . 1 . 2]" 1
1479 1 77 ARG HG2 1 89 SER QB . . 4.220 2.761 2.346 3.446 . 0 0 "[ . 1 . 2]" 1
1480 1 21 PRO HG3 1 100 ASP QB . . 4.660 2.592 1.993 3.211 . 0 0 "[ . 1 . 2]" 1
1481 1 77 ARG H 1 77 ARG HG3 . . 5.090 4.755 4.570 4.956 . 0 0 "[ . 1 . 2]" 1
1482 1 93 ILE HA 1 94 THR HA . . 4.730 4.431 4.413 4.444 . 0 0 "[ . 1 . 2]" 1
1483 1 93 ILE HA 1 94 THR HB . . 4.940 4.813 4.767 4.885 . 0 0 "[ . 1 . 2]" 1
1484 1 93 ILE HA 1 93 ILE HG13 . . 3.780 2.897 2.788 2.982 . 0 0 "[ . 1 . 2]" 1
1485 1 76 LEU HG 1 77 ARG H . . 5.310 4.939 4.857 5.057 . 0 0 "[ . 1 . 2]" 1
1486 1 8 PRO HG3 1 86 PRO HA . . 5.100 4.310 3.980 4.505 . 0 0 "[ . 1 . 2]" 1
1487 1 8 PRO HG3 1 34 ALA MB . . 4.750 4.562 4.251 4.773 0.023 8 0 "[ . 1 . 2]" 1
1488 1 8 PRO HG2 1 82 ASN HB3 . . 5.500 5.013 4.449 5.496 . 0 0 "[ . 1 . 2]" 1
1489 1 8 PRO HG2 1 38 VAL MG1 . . 5.360 4.948 4.539 5.247 . 0 0 "[ . 1 . 2]" 1
1490 1 43 LEU H 1 43 LEU HG . . 4.810 4.248 4.160 4.346 . 0 0 "[ . 1 . 2]" 1
1491 1 43 LEU HG 1 45 CYS HB2 . . 4.460 3.700 3.490 3.872 . 0 0 "[ . 1 . 2]" 1
1492 1 56 ILE HG13 1 57 GLU H . . 4.980 4.848 4.669 4.974 . 0 0 "[ . 1 . 2]" 1
1493 1 55 ASN HA 1 56 ILE HG13 . . 4.460 3.642 3.548 3.743 . 0 0 "[ . 1 . 2]" 1
1494 1 54 GLN QG 1 56 ILE HG13 . . 4.440 2.837 2.566 3.042 . 0 0 "[ . 1 . 2]" 1
1495 1 79 LEU MD2 1 87 GLY H . . 5.450 4.771 4.324 5.104 . 0 0 "[ . 1 . 2]" 1
1496 1 79 LEU MD2 1 90 THR H . . 5.080 4.599 4.333 4.970 . 0 0 "[ . 1 . 2]" 1
1497 1 79 LEU MD2 1 81 TYR HB3 . . 4.960 4.533 4.369 4.670 . 0 0 "[ . 1 . 2]" 1
1498 1 44 PHE QE 1 79 LEU MD2 . . 3.260 1.885 1.773 2.024 . 0 0 "[ . 1 . 2]" 1
1499 1 78 PHE HA 1 79 LEU MD2 . . 5.050 4.535 4.359 4.756 . 0 0 "[ . 1 . 2]" 1
1500 1 79 LEU MD2 1 86 PRO HA . . 4.690 4.475 4.174 4.690 . 0 0 "[ . 1 . 2]" 1
1501 1 79 LEU MD2 1 89 SER QB . . 3.470 2.468 1.953 3.210 . 0 0 "[ . 1 . 2]" 1
1502 1 79 LEU MD2 1 86 PRO QB . . 3.230 2.777 2.342 2.966 . 0 0 "[ . 1 . 2]" 1
1503 1 43 LEU MD2 1 56 ILE H . . 4.690 4.538 4.222 4.668 . 0 0 "[ . 1 . 2]" 1
1504 1 43 LEU MD2 1 44 PHE H . . 4.640 4.274 4.081 4.656 0.016 11 0 "[ . 1 . 2]" 1
1505 1 43 LEU H 1 43 LEU MD2 . . 4.330 4.209 4.064 4.332 0.002 2 0 "[ . 1 . 2]" 1
1506 1 43 LEU MD2 1 63 TYR QE . . 4.030 3.901 3.637 4.041 0.011 17 0 "[ . 1 . 2]" 1
1507 1 43 LEU MD2 1 78 PHE QD . . 4.350 4.025 3.745 4.335 . 0 0 "[ . 1 . 2]" 1
1508 1 43 LEU MD2 1 78 PHE QE . . 4.510 3.942 3.674 4.337 . 0 0 "[ . 1 . 2]" 1
1509 1 43 LEU MD2 1 45 CYS HA . . 5.080 4.881 4.585 5.091 0.011 3 0 "[ . 1 . 2]" 1
1510 1 43 LEU MD2 1 65 LEU HA . . 5.140 5.099 4.929 5.159 0.019 16 0 "[ . 1 . 2]" 1
1511 1 43 LEU MD2 1 45 CYS HB3 . . 4.510 4.395 4.235 4.517 0.007 9 0 "[ . 1 . 2]" 1
1512 1 43 LEU MD2 1 45 CYS HB2 . . 4.020 3.388 3.234 3.563 . 0 0 "[ . 1 . 2]" 1
1513 1 43 LEU HB2 1 43 LEU MD2 . . 3.220 2.567 2.428 2.636 . 0 0 "[ . 1 . 2]" 1
1514 1 43 LEU MD2 1 58 VAL MG1 . . 3.930 2.878 2.414 3.116 . 0 0 "[ . 1 . 2]" 1
1515 1 36 GLY HA2 1 37 PRO QG . . 4.620 4.514 4.395 4.584 . 0 0 "[ . 1 . 2]" 1
1516 1 8 PRO HG3 1 81 TYR H . . 5.090 3.687 3.339 4.053 . 0 0 "[ . 1 . 2]" 1
1517 1 8 PRO HG3 1 82 ASN HD21 . . 4.770 3.117 1.972 4.566 . 0 0 "[ . 1 . 2]" 1
1518 1 8 PRO HG3 1 82 ASN HB3 . . 4.490 3.270 2.761 3.740 . 0 0 "[ . 1 . 2]" 1
1519 1 8 PRO HG3 1 81 TYR HA . . 4.600 2.467 2.167 2.934 . 0 0 "[ . 1 . 2]" 1
1520 1 7 GLY HA2 1 8 PRO HG3 . . 4.770 4.362 4.320 4.439 . 0 0 "[ . 1 . 2]" 1
1521 1 8 PRO HG3 1 38 VAL HA . . 4.730 4.487 4.192 4.680 . 0 0 "[ . 1 . 2]" 1
1522 1 8 PRO HG3 1 80 ALA MB . . 3.860 2.984 2.680 3.257 . 0 0 "[ . 1 . 2]" 1
1523 1 8 PRO HG3 1 38 VAL MG2 . . 4.250 4.061 3.816 4.249 . 0 0 "[ . 1 . 2]" 1
1524 1 8 PRO HG3 1 38 VAL MG1 . . 4.820 4.293 3.910 4.586 . 0 0 "[ . 1 . 2]" 1
1525 1 8 PRO HG2 1 81 TYR H . . 5.500 4.045 3.585 4.417 . 0 0 "[ . 1 . 2]" 1
1526 1 8 PRO HG2 1 81 TYR HA . . 4.320 2.942 2.654 3.303 . 0 0 "[ . 1 . 2]" 1
1527 1 8 PRO HG2 1 86 PRO HA . . 5.070 3.960 3.642 4.080 . 0 0 "[ . 1 . 2]" 1
1528 1 7 GLY HA2 1 8 PRO HG2 . . 4.810 4.325 4.148 4.465 . 0 0 "[ . 1 . 2]" 1
1529 1 8 PRO HG2 1 87 GLY HA2 . . 5.200 4.375 4.110 4.851 . 0 0 "[ . 1 . 2]" 1
1530 1 8 PRO HG2 1 87 GLY HA3 . . 4.630 2.990 2.694 3.439 . 0 0 "[ . 1 . 2]" 1
1531 1 8 PRO HG2 1 79 LEU MD1 . . 4.380 4.255 4.105 4.390 0.010 9 0 "[ . 1 . 2]" 1
1532 1 25 LEU HA 1 25 LEU HG . . 4.170 2.999 2.932 3.049 . 0 0 "[ . 1 . 2]" 1
1533 1 17 VAL HA 1 18 SER HA . . 5.000 4.357 4.348 4.364 . 0 0 "[ . 1 . 2]" 1
1534 1 17 VAL HA 1 24 ILE MG . . 4.670 4.159 3.992 4.287 . 0 0 "[ . 1 . 2]" 1
1535 1 102 GLY QA 1 103 PRO QG . . 4.520 3.800 3.645 4.069 . 0 0 "[ . 1 . 2]" 1
1536 1 85 GLY HA2 1 86 PRO HG2 . . 5.500 4.852 4.780 4.940 . 0 0 "[ . 1 . 2]" 1
1537 1 65 LEU HG 1 68 LEU MD2 . . 3.980 3.898 3.755 3.994 0.014 20 0 "[ . 1 . 2]" 1
1538 1 63 TYR QE 1 65 LEU HG . . 4.550 3.482 3.313 3.610 . 0 0 "[ . 1 . 2]" 1
1539 1 15 GLN HA 1 93 ILE HG12 . . 5.500 5.175 4.860 5.489 . 0 0 "[ . 1 . 2]" 1
1540 1 92 ASP HA 1 93 ILE HG12 . . 5.500 5.313 5.097 5.452 . 0 0 "[ . 1 . 2]" 1
1541 1 93 ILE HG12 1 93 ILE MG . . 3.120 2.266 2.106 2.370 . 0 0 "[ . 1 . 2]" 1
1542 1 92 ASP HA 1 93 ILE HG13 . . 4.970 3.817 3.613 3.936 . 0 0 "[ . 1 . 2]" 1
1543 1 93 ILE HG13 1 94 THR H . . 5.120 4.996 4.903 5.060 . 0 0 "[ . 1 . 2]" 1
1544 1 14 LEU MD2 1 93 ILE HG13 . . 4.540 3.362 3.019 3.798 . 0 0 "[ . 1 . 2]" 1
1545 1 24 ILE H 1 65 LEU MD2 . . 4.710 4.436 4.302 4.639 . 0 0 "[ . 1 . 2]" 1
1546 1 79 LEU MD2 1 86 PRO HG2 . . 4.920 4.712 4.300 4.910 . 0 0 "[ . 1 . 2]" 1
1547 1 79 LEU MD1 1 86 PRO HG2 . . 4.750 4.350 4.076 4.556 . 0 0 "[ . 1 . 2]" 1
1548 1 85 GLY HA2 1 86 PRO HG3 . . 5.500 4.767 4.698 4.855 . 0 0 "[ . 1 . 2]" 1
1549 1 79 LEU MD2 1 86 PRO HG3 . . 4.920 4.448 4.164 4.631 . 0 0 "[ . 1 . 2]" 1
1550 1 79 LEU MD1 1 86 PRO HG3 . . 4.750 4.071 3.809 4.280 . 0 0 "[ . 1 . 2]" 1
1551 1 93 ILE HG12 1 94 THR H . . 4.950 4.736 4.642 4.859 . 0 0 "[ . 1 . 2]" 1
1552 1 93 ILE HA 1 93 ILE HG12 . . 3.950 2.646 2.586 2.749 . 0 0 "[ . 1 . 2]" 1
1553 1 61 LEU H 1 61 LEU HG . . 5.060 3.137 2.582 3.737 . 0 0 "[ . 1 . 2]" 1
1554 1 30 PRO HD3 1 61 LEU HG . . 5.500 4.055 2.989 4.224 . 0 0 "[ . 1 . 2]" 1
1555 1 76 LEU HB2 1 93 ILE HG13 . . 4.600 4.396 4.078 4.572 . 0 0 "[ . 1 . 2]" 1
1556 1 65 LEU MD2 1 66 GLU H . . 4.460 3.671 3.560 3.876 . 0 0 "[ . 1 . 2]" 1
1557 1 65 LEU HA 1 65 LEU MD2 . . 3.830 3.778 3.757 3.799 . 0 0 "[ . 1 . 2]" 1
1558 1 65 LEU H 1 65 LEU MD2 . . 4.400 4.343 4.294 4.376 . 0 0 "[ . 1 . 2]" 1
1559 1 63 TYR QE 1 65 LEU MD2 . . 4.670 4.463 4.241 4.594 . 0 0 "[ . 1 . 2]" 1
1560 1 54 GLN QG 1 65 LEU MD2 . . 4.890 4.697 4.490 4.918 0.028 6 0 "[ . 1 . 2]" 1
1561 1 65 LEU MD2 1 68 LEU MD2 . . 3.060 1.908 1.802 2.050 . 0 0 "[ . 1 . 2]" 1
1562 1 14 LEU MD2 1 15 GLN HA . . 4.510 4.401 4.291 4.491 . 0 0 "[ . 1 . 2]" 1
1563 1 11 VAL H 1 14 LEU MD2 . . 5.500 5.268 4.823 5.471 . 0 0 "[ . 1 . 2]" 1
1564 1 14 LEU MD2 1 16 ALA H . . 5.500 5.401 5.284 5.539 0.039 15 0 "[ . 1 . 2]" 1
1565 1 14 LEU MD2 1 78 PHE H . . 4.740 3.768 3.508 3.982 . 0 0 "[ . 1 . 2]" 1
1566 1 14 LEU MD2 1 90 THR HG1 . . 4.870 2.811 2.127 3.467 . 0 0 "[ . 1 . 2]" 1
1567 1 14 LEU MD2 1 90 THR HB . . 3.980 2.576 2.305 2.858 . 0 0 "[ . 1 . 2]" 1
1568 1 14 LEU MD2 1 28 TRP HB3 . . 4.690 4.617 4.338 4.702 0.012 15 0 "[ . 1 . 2]" 1
1569 1 14 LEU MD2 1 78 PHE HB3 . . 3.770 2.627 2.229 2.956 . 0 0 "[ . 1 . 2]" 1
1570 1 14 LEU MD2 1 78 PHE HB2 . . 3.760 3.389 3.164 3.707 . 0 0 "[ . 1 . 2]" 1
1571 1 22 THR HA 1 69 LYS H . . 4.800 4.715 4.612 4.830 0.030 1 0 "[ . 1 . 2]" 1
1572 1 22 THR HA 1 68 LEU HB3 . . 4.080 4.040 3.949 4.106 0.026 17 0 "[ . 1 . 2]" 1
1573 1 22 THR HA 1 68 LEU HB2 . . 3.400 2.675 2.623 2.711 . 0 0 "[ . 1 . 2]" 1
1574 1 98 LEU HG 1 99 SER H . . 4.940 4.749 4.737 4.762 . 0 0 "[ . 1 . 2]" 1
1575 1 18 SER HG 1 98 LEU HG . . 4.340 3.661 3.565 3.776 . 0 0 "[ . 1 . 2]" 1
1576 1 23 SER HA 1 68 LEU HG . . 4.590 4.263 3.925 4.531 . 0 0 "[ . 1 . 2]" 1
1577 1 68 LEU HG 1 74 TYR QE . . 5.500 5.061 4.787 5.358 . 0 0 "[ . 1 . 2]" 1
1578 1 76 LEU MD1 1 77 ARG H . . 4.650 4.416 4.265 4.637 . 0 0 "[ . 1 . 2]" 1
1579 1 45 CYS HA 1 76 LEU MD1 . . 4.630 4.348 3.929 4.650 0.020 2 0 "[ . 1 . 2]" 1
1580 1 76 LEU H 1 76 LEU MD1 . . 4.240 3.755 3.585 3.955 . 0 0 "[ . 1 . 2]" 1
1581 1 76 LEU MD1 1 95 VAL H . . 5.200 4.830 4.391 5.235 0.035 20 0 "[ . 1 . 2]" 1
1582 1 76 LEU HA 1 76 LEU MD1 . . 4.290 3.933 3.859 4.001 . 0 0 "[ . 1 . 2]" 1
1583 1 74 TYR HB3 1 76 LEU MD1 . . 4.600 4.287 4.138 4.541 . 0 0 "[ . 1 . 2]" 1
1584 1 74 TYR HB2 1 76 LEU MD1 . . 5.000 4.712 4.410 5.019 0.019 20 0 "[ . 1 . 2]" 1
1585 1 66 GLU HA 1 68 LEU MD1 . . 4.780 3.200 3.152 3.266 . 0 0 "[ . 1 . 2]" 1
1586 1 22 THR HB 1 68 LEU MD1 . . 4.680 3.555 3.467 3.623 . 0 0 "[ . 1 . 2]" 1
1587 1 68 LEU MD1 1 69 LYS H . . 4.570 4.283 4.219 4.351 . 0 0 "[ . 1 . 2]" 1
1588 1 22 THR HA 1 68 LEU MD1 . . 4.140 3.387 3.321 3.484 . 0 0 "[ . 1 . 2]" 1
1589 1 18 SER HB2 1 68 LEU MD1 . . 5.450 4.445 4.353 4.594 . 0 0 "[ . 1 . 2]" 1
1590 1 23 SER HB2 1 68 LEU MD1 . . 5.500 4.292 4.024 4.458 . 0 0 "[ . 1 . 2]" 1
1591 1 65 LEU HB3 1 68 LEU MD1 . . 3.780 2.448 2.204 2.625 . 0 0 "[ . 1 . 2]" 1
1592 1 68 LEU HB3 1 68 LEU MD1 . . 2.930 2.638 2.620 2.660 . 0 0 "[ . 1 . 2]" 1
1593 1 68 LEU HB2 1 68 LEU MD1 . . 2.890 2.172 2.147 2.184 . 0 0 "[ . 1 . 2]" 1
1594 1 82 ASN HA 1 83 ARG HA . . 4.930 4.327 4.313 4.344 . 0 0 "[ . 1 . 2]" 1
1595 1 83 ARG HA 1 84 TYR HA . . 4.960 4.772 4.741 4.804 . 0 0 "[ . 1 . 2]" 1
1596 1 39 GLN QG 1 83 ARG HA . . 4.550 2.963 2.557 3.369 . 0 0 "[ . 1 . 2]" 1
1597 1 79 LEU HG 1 86 PRO QB . . 4.640 4.336 3.986 4.520 . 0 0 "[ . 1 . 2]" 1
1598 1 79 LEU H 1 79 LEU MD1 . . 3.750 3.658 3.380 3.769 0.019 8 0 "[ . 1 . 2]" 1
1599 1 44 PHE QE 1 79 LEU MD1 . . 4.470 3.723 3.357 3.971 . 0 0 "[ . 1 . 2]" 1
1600 1 79 LEU MD1 1 81 TYR QD . . 3.850 2.596 2.276 3.055 . 0 0 "[ . 1 . 2]" 1
1601 1 78 PHE HA 1 79 LEU MD1 . . 5.400 5.257 5.004 5.384 . 0 0 "[ . 1 . 2]" 1
1602 1 41 TYR HA 1 79 LEU MD1 . . 4.560 4.134 3.854 4.372 . 0 0 "[ . 1 . 2]" 1
1603 1 79 LEU MD1 1 81 TYR HA . . 4.770 3.680 3.460 3.789 . 0 0 "[ . 1 . 2]" 1
1604 1 79 LEU MD1 1 86 PRO HA . . 3.660 2.664 2.385 2.859 . 0 0 "[ . 1 . 2]" 1
1605 1 79 LEU MD1 1 87 GLY HA3 . . 5.030 4.565 4.371 4.786 . 0 0 "[ . 1 . 2]" 1
1606 1 79 LEU MD1 1 81 TYR HB2 . . 3.840 3.733 3.628 3.840 . 0 0 "[ . 1 . 2]" 1
1607 1 79 LEU MD1 1 81 TYR HB3 . . 3.960 2.380 2.292 2.454 . 0 0 "[ . 1 . 2]" 1
1608 1 79 LEU MD1 1 86 PRO QB . . 3.170 2.029 1.811 2.200 . 0 0 "[ . 1 . 2]" 1
1609 1 25 LEU MD2 1 26 ILE H . . 5.080 5.034 4.974 5.116 0.036 13 0 "[ . 1 . 2]" 1
1610 1 19 THR HB 1 25 LEU MD2 . . 5.010 5.002 4.879 5.041 0.031 5 0 "[ . 1 . 2]" 1
1611 1 25 LEU HB3 1 25 LEU MD2 . . 3.060 2.332 2.146 2.402 . 0 0 "[ . 1 . 2]" 1
1612 1 68 LEU MD1 1 74 TYR QE . . 4.350 4.072 3.840 4.324 . 0 0 "[ . 1 . 2]" 1
1613 1 68 LEU HA 1 68 LEU MD1 . . 4.050 3.931 3.914 3.953 . 0 0 "[ . 1 . 2]" 1
1614 1 67 GLY H 1 68 LEU MD1 . . 5.500 4.217 4.139 4.266 . 0 0 "[ . 1 . 2]" 1
1615 1 68 LEU MD1 1 74 TYR QD . . 4.820 3.897 3.758 4.136 . 0 0 "[ . 1 . 2]" 1
1616 1 67 GLY HA2 1 68 LEU MD1 . . 5.500 5.540 5.523 5.561 0.061 13 0 "[ . 1 . 2]" 1
1617 1 65 LEU MD2 1 68 LEU MD1 . . 3.300 1.868 1.753 2.023 . 0 0 "[ . 1 . 2]" 1
1618 1 24 ILE HG13 1 68 LEU MD1 . . 3.660 1.819 1.794 1.856 . 0 0 "[ . 1 . 2]" 1
1619 1 68 LEU HA 1 69 LYS HG3 . . 5.040 4.106 3.854 4.368 . 0 0 "[ . 1 . 2]" 1
1620 1 69 LYS H 1 69 LYS HG2 . . 4.280 3.867 3.657 4.174 . 0 0 "[ . 1 . 2]" 1
1621 1 30 PRO HD3 1 61 LEU MD1 . . 4.040 2.845 1.949 4.050 0.010 17 0 "[ . 1 . 2]" 1
1622 1 61 LEU QB 1 61 LEU MD1 . . 3.120 2.056 1.994 2.094 . 0 0 "[ . 1 . 2]" 1
1623 1 61 LEU H 1 61 LEU MD1 . . 5.070 3.981 2.693 4.214 . 0 0 "[ . 1 . 2]" 1
1624 1 30 PRO HD2 1 61 LEU MD1 . . 4.510 3.536 2.688 4.587 0.077 11 0 "[ . 1 . 2]" 1
1625 1 25 LEU H 1 25 LEU MD2 . . 4.300 4.267 4.245 4.288 . 0 0 "[ . 1 . 2]" 1
1626 1 25 LEU HA 1 25 LEU MD2 . . 4.200 3.851 3.827 3.873 . 0 0 "[ . 1 . 2]" 1
1627 1 25 LEU MD2 1 62 SER QB . . 4.660 4.390 4.025 4.679 0.019 2 0 "[ . 1 . 2]" 1
1628 1 21 PRO HD3 1 98 LEU MD1 . . 3.810 3.259 3.100 3.338 . 0 0 "[ . 1 . 2]" 1
1629 1 21 PRO HD2 1 98 LEU MD1 . . 4.600 4.279 4.182 4.362 . 0 0 "[ . 1 . 2]" 1
1630 1 69 LYS H 1 69 LYS HG3 . . 3.920 2.922 2.683 3.186 . 0 0 "[ . 1 . 2]" 1
1631 1 19 THR HA 1 98 LEU MD1 . . 3.460 2.452 2.303 2.961 . 0 0 "[ . 1 . 2]" 1
1632 1 33 TYR HA 1 33 TYR QD . . 4.260 3.702 3.673 3.728 . 0 0 "[ . 1 . 2]" 1
1633 1 33 TYR HA 1 34 ALA MB . . 5.380 4.480 4.387 4.574 . 0 0 "[ . 1 . 2]" 1
1634 1 70 LYS HG3 1 99 SER HA . . 4.830 3.151 2.129 3.620 . 0 0 "[ . 1 . 2]" 1
1635 1 52 LYS HA 1 52 LYS HG2 . . 4.090 2.750 2.259 3.828 . 0 0 "[ . 1 . 2]" 1
1636 1 52 LYS HA 1 53 GLU HA . . 4.600 4.387 4.375 4.403 . 0 0 "[ . 1 . 2]" 1
1637 1 52 LYS HA 1 53 GLU HB2 . . 4.690 4.564 4.427 4.661 . 0 0 "[ . 1 . 2]" 1
1638 1 5 SER HA 1 84 TYR QE . . 4.710 4.222 3.124 4.722 0.012 6 0 "[ . 1 . 2]" 1
1639 1 5 SER HA 1 6 SER HA . . 5.150 4.415 4.386 4.535 . 0 0 "[ . 1 . 2]" 1
1640 1 5 SER HA 1 84 TYR HA . . 5.380 4.103 3.433 4.890 . 0 0 "[ . 1 . 2]" 1
1641 1 52 LYS HA 1 52 LYS HG3 . . 4.090 3.126 2.324 3.925 . 0 0 "[ . 1 . 2]" 1
1642 1 52 LYS H 1 52 LYS HG2 . . 4.080 3.548 1.981 4.083 0.003 17 0 "[ . 1 . 2]" 1
1643 1 25 LEU HA 1 64 LYS QG . . 4.090 3.471 3.080 4.142 0.052 5 0 "[ . 1 . 2]" 1
1644 1 23 SER HB2 1 64 LYS QG . . 4.330 3.196 2.717 4.170 . 0 0 "[ . 1 . 2]" 1
1645 1 14 LEU MD1 1 29 GLU H . . 4.630 4.244 4.021 4.451 . 0 0 "[ . 1 . 2]" 1
1646 1 11 VAL H 1 14 LEU MD1 . . 5.500 5.399 4.985 5.512 0.012 10 0 "[ . 1 . 2]" 1
1647 1 14 LEU MD1 1 16 ALA H . . 5.500 5.274 5.015 5.499 . 0 0 "[ . 1 . 2]" 1
1648 1 14 LEU MD1 1 78 PHE QD . . 3.750 2.683 2.268 2.954 . 0 0 "[ . 1 . 2]" 1
1649 1 14 LEU MD1 1 78 PHE QE . . 4.450 3.864 3.517 4.086 . 0 0 "[ . 1 . 2]" 1
1650 1 14 LEU MD1 1 15 GLN HA . . 4.970 4.490 4.213 4.686 . 0 0 "[ . 1 . 2]" 1
1651 1 14 LEU MD1 1 90 THR HB . . 5.050 4.664 4.354 5.041 . 0 0 "[ . 1 . 2]" 1
1652 1 14 LEU MD1 1 28 TRP HB2 . . 3.770 2.710 2.513 2.947 . 0 0 "[ . 1 . 2]" 1
1653 1 14 LEU MD1 1 78 PHE HB2 . . 3.870 2.571 2.309 2.795 . 0 0 "[ . 1 . 2]" 1
1654 1 43 LEU MD1 1 76 LEU MD2 . . 3.250 2.958 2.689 3.258 0.008 20 0 "[ . 1 . 2]" 1
1655 1 76 LEU H 1 76 LEU MD2 . . 4.240 3.370 3.144 3.600 . 0 0 "[ . 1 . 2]" 1
1656 1 75 SER H 1 76 LEU MD2 . . 4.520 3.741 3.375 3.990 . 0 0 "[ . 1 . 2]" 1
1657 1 45 CYS H 1 76 LEU MD2 . . 4.780 3.968 3.742 4.218 . 0 0 "[ . 1 . 2]" 1
1658 1 76 LEU MD2 1 77 ARG H . . 3.940 3.737 3.503 3.912 . 0 0 "[ . 1 . 2]" 1
1659 1 76 LEU HA 1 76 LEU MD2 . . 3.190 2.242 1.979 2.559 . 0 0 "[ . 1 . 2]" 1
1660 1 45 CYS HA 1 76 LEU MD2 . . 3.220 1.888 1.810 1.962 . 0 0 "[ . 1 . 2]" 1
1661 1 74 TYR HB3 1 76 LEU MD2 . . 3.710 2.811 2.518 3.040 . 0 0 "[ . 1 . 2]" 1
1662 1 74 TYR HB2 1 76 LEU MD2 . . 4.210 4.025 3.751 4.216 0.006 14 0 "[ . 1 . 2]" 1
1663 1 76 LEU HB3 1 76 LEU MD2 . . 3.120 2.310 2.115 2.485 . 0 0 "[ . 1 . 2]" 1
1664 1 14 LEU H 1 14 LEU MD1 . . 4.420 4.384 4.317 4.441 0.021 11 0 "[ . 1 . 2]" 1
1665 1 14 LEU MD1 1 28 TRP HE3 . . 3.940 3.735 3.438 3.862 . 0 0 "[ . 1 . 2]" 1
1666 1 14 LEU MD1 1 26 ILE HA . . 4.810 4.646 4.463 4.820 0.010 8 0 "[ . 1 . 2]" 1
1667 1 14 LEU MD1 1 28 TRP HB3 . . 3.520 1.997 1.892 2.170 . 0 0 "[ . 1 . 2]" 1
1668 1 14 LEU MD1 1 78 PHE HB3 . . 3.800 2.277 2.034 2.484 . 0 0 "[ . 1 . 2]" 1
1669 1 14 LEU MD1 1 26 ILE HB . . 5.170 4.919 4.769 5.103 . 0 0 "[ . 1 . 2]" 1
1670 1 14 LEU HB3 1 14 LEU MD1 . . 3.540 3.118 3.098 3.145 . 0 0 "[ . 1 . 2]" 1
1671 1 14 LEU MD1 1 90 THR MG . . 3.770 3.175 2.918 3.486 . 0 0 "[ . 1 . 2]" 1
1672 1 70 LYS H 1 70 LYS HG3 . . 4.790 4.201 4.024 4.509 . 0 0 "[ . 1 . 2]" 1
1673 1 70 LYS HA 1 70 LYS HG3 . . 4.190 2.317 2.172 2.700 . 0 0 "[ . 1 . 2]" 1
1674 1 21 PRO HB3 1 70 LYS HG3 . . 4.430 2.525 2.199 3.316 . 0 0 "[ . 1 . 2]" 1
1675 1 70 LYS HG2 1 99 SER HA . . 4.830 2.570 2.061 3.483 . 0 0 "[ . 1 . 2]" 1
1676 1 70 LYS H 1 70 LYS HG2 . . 4.790 4.662 4.609 4.676 . 0 0 "[ . 1 . 2]" 1
1677 1 70 LYS HA 1 70 LYS HG2 . . 4.190 3.316 3.125 3.699 . 0 0 "[ . 1 . 2]" 1
1678 1 18 SER HB3 1 97 THR MG . . 4.260 3.899 3.748 4.086 . 0 0 "[ . 1 . 2]" 1
1679 1 68 LEU HB2 1 97 THR MG . . 3.440 2.687 2.545 2.780 . 0 0 "[ . 1 . 2]" 1
1680 1 43 LEU MD1 1 78 PHE QD . . 3.130 2.169 1.980 2.361 . 0 0 "[ . 1 . 2]" 1
1681 1 43 LEU H 1 43 LEU MD1 . . 4.790 4.439 4.327 4.506 . 0 0 "[ . 1 . 2]" 1
1682 1 43 LEU MD1 1 78 PHE H . . 5.130 4.403 4.123 4.592 . 0 0 "[ . 1 . 2]" 1
1683 1 63 TYR QD 1 65 LEU MD1 . . 3.910 2.752 2.435 3.015 . 0 0 "[ . 1 . 2]" 1
1684 1 43 LEU MD1 1 44 PHE QD . . 5.040 4.607 4.276 5.050 0.010 11 0 "[ . 1 . 2]" 1
1685 1 43 LEU MD1 1 78 PHE QE . . 3.990 3.472 3.275 3.678 . 0 0 "[ . 1 . 2]" 1
1686 1 43 LEU MD1 1 76 LEU HA . . 4.110 3.794 3.572 4.044 . 0 0 "[ . 1 . 2]" 1
1687 1 43 LEU MD1 1 78 PHE HA . . 4.170 3.501 3.205 3.752 . 0 0 "[ . 1 . 2]" 1
1688 1 43 LEU MD1 1 45 CYS HA . . 4.310 4.133 3.903 4.311 0.001 3 0 "[ . 1 . 2]" 1
1689 1 45 CYS HB3 1 65 LEU MD1 . . 4.350 4.257 3.970 4.368 0.018 19 0 "[ . 1 . 2]" 1
1690 1 43 LEU MD1 1 78 PHE HB2 . . 4.110 3.447 3.290 3.617 . 0 0 "[ . 1 . 2]" 1
1691 1 43 LEU MD1 1 45 CYS HB2 . . 4.200 3.869 3.657 4.151 . 0 0 "[ . 1 . 2]" 1
1692 1 45 CYS HB2 1 65 LEU MD1 . . 4.380 3.493 3.180 3.831 . 0 0 "[ . 1 . 2]" 1
1693 1 65 LEU MD1 1 68 LEU MD2 . . 4.390 4.129 3.895 4.303 . 0 0 "[ . 1 . 2]" 1
1694 1 65 LEU MD1 1 66 GLU H . . 3.910 3.601 3.460 3.716 . 0 0 "[ . 1 . 2]" 1
1695 1 65 LEU HA 1 65 LEU MD1 . . 3.180 2.591 2.490 2.669 . 0 0 "[ . 1 . 2]" 1
1696 1 71 PHE H 1 97 THR MG . . 5.500 5.469 5.364 5.587 0.087 13 0 "[ . 1 . 2]" 1
1697 1 97 THR HG1 1 97 THR MG . . 3.150 2.584 2.540 2.642 . 0 0 "[ . 1 . 2]" 1
1698 1 22 THR HA 1 97 THR MG . . 4.080 2.495 2.409 2.603 . 0 0 "[ . 1 . 2]" 1
1699 1 74 TYR HB3 1 97 THR MG . . 5.360 4.949 4.721 5.219 . 0 0 "[ . 1 . 2]" 1
1700 1 69 LYS HB2 1 97 THR MG . . 4.830 4.454 4.293 4.602 . 0 0 "[ . 1 . 2]" 1
1701 1 97 THR MG 1 98 LEU HG . . 4.730 4.693 4.646 4.751 0.021 10 0 "[ . 1 . 2]" 1
1702 1 24 ILE HG12 1 97 THR MG . . 3.720 3.338 3.211 3.420 . 0 0 "[ . 1 . 2]" 1
1703 1 68 LEU HB3 1 97 THR MG . . 3.840 2.698 2.609 2.847 . 0 0 "[ . 1 . 2]" 1
1704 1 95 VAL QG 1 97 THR MG . . 3.970 3.770 3.603 3.853 . 0 0 "[ . 1 . 2]" 1
1705 1 74 TYR QD 1 97 THR MG . . 3.690 2.470 2.259 2.671 . 0 0 "[ . 1 . 2]" 1
1706 1 74 TYR QE 1 97 THR MG . . 3.400 2.777 2.504 3.000 . 0 0 "[ . 1 . 2]" 1
1707 1 96 VAL HA 1 97 THR MG . . 4.320 4.089 4.052 4.123 . 0 0 "[ . 1 . 2]" 1
1708 1 97 THR HA 1 97 THR MG . . 3.250 2.289 2.281 2.300 . 0 0 "[ . 1 . 2]" 1
1709 1 18 SER HG 1 97 THR MG . . 3.840 2.925 2.676 3.105 . 0 0 "[ . 1 . 2]" 1
1710 1 18 SER HB2 1 97 THR MG . . 4.190 3.199 2.974 3.406 . 0 0 "[ . 1 . 2]" 1
1711 1 24 ILE HG13 1 97 THR MG . . 3.620 3.332 3.263 3.396 . 0 0 "[ . 1 . 2]" 1
1712 1 24 ILE MD 1 97 THR MG . . 3.250 3.127 3.076 3.207 . 0 0 "[ . 1 . 2]" 1
1713 1 68 LEU MD1 1 97 THR MG . . 3.120 2.372 2.232 2.457 . 0 0 "[ . 1 . 2]" 1
1714 1 73 GLU HA 1 97 THR H . . 4.870 3.984 3.844 4.168 . 0 0 "[ . 1 . 2]" 1
1715 1 73 GLU HA 1 96 VAL HA . . 3.660 2.338 2.200 2.535 . 0 0 "[ . 1 . 2]" 1
1716 1 73 GLU HA 1 73 GLU HG3 . . 4.200 2.477 2.231 2.656 . 0 0 "[ . 1 . 2]" 1
1717 1 72 THR MG 1 73 GLU HA . . 4.830 4.111 3.901 4.224 . 0 0 "[ . 1 . 2]" 1
1718 1 38 VAL HA 1 39 GLN HA . . 4.860 4.504 4.494 4.519 . 0 0 "[ . 1 . 2]" 1
1719 1 39 GLN HA 1 40 GLY HA2 . . 5.320 4.703 4.676 4.728 . 0 0 "[ . 1 . 2]" 1
1720 1 39 GLN HA 1 39 GLN QG . . 3.210 2.485 2.175 2.914 . 0 0 "[ . 1 . 2]" 1
1721 1 47 GLU HA 1 74 TYR QE . . 4.080 2.832 2.640 3.109 . 0 0 "[ . 1 . 2]" 1
1722 1 47 GLU HA 1 75 SER H . . 4.280 3.758 3.562 3.975 . 0 0 "[ . 1 . 2]" 1
1723 1 47 GLU HA 1 74 TYR QD . . 3.820 2.238 2.005 2.545 . 0 0 "[ . 1 . 2]" 1
1724 1 47 GLU HA 1 74 TYR HA . . 3.650 3.208 3.124 3.355 . 0 0 "[ . 1 . 2]" 1
1725 1 47 GLU HA 1 74 TYR HB3 . . 5.010 4.529 4.317 4.877 . 0 0 "[ . 1 . 2]" 1
1726 1 47 GLU HA 1 47 GLU HG3 . . 3.750 2.554 2.326 3.095 . 0 0 "[ . 1 . 2]" 1
1727 1 47 GLU HA 1 72 THR MG . . 4.370 3.976 3.676 4.210 . 0 0 "[ . 1 . 2]" 1
1728 1 69 LYS HA 1 70 LYS HA . . 4.860 4.317 4.310 4.331 . 0 0 "[ . 1 . 2]" 1
1729 1 69 LYS HA 1 69 LYS HG3 . . 3.700 3.020 2.654 3.232 . 0 0 "[ . 1 . 2]" 1
1730 1 69 LYS HA 1 69 LYS HG2 . . 3.520 2.398 2.215 2.744 . 0 0 "[ . 1 . 2]" 1
1731 1 22 THR MG 1 69 LYS HA . . 4.160 2.846 2.629 2.963 . 0 0 "[ . 1 . 2]" 1
1732 1 48 VAL HA 1 48 VAL MG1 . . 3.100 2.362 2.283 2.448 . 0 0 "[ . 1 . 2]" 1
1733 1 98 LEU HA 1 98 LEU MD1 . . 4.040 3.834 3.800 3.855 . 0 0 "[ . 1 . 2]" 1
1734 1 11 VAL MG1 1 41 TYR QD . . 3.510 2.423 2.278 2.575 . 0 0 "[ . 1 . 2]" 1
1735 1 11 VAL MG1 1 30 PRO HA . . 4.130 3.573 3.359 3.764 . 0 0 "[ . 1 . 2]" 1
1736 1 11 VAL MG1 1 31 PRO HD2 . . 3.800 3.522 3.373 3.749 . 0 0 "[ . 1 . 2]" 1
1737 1 11 VAL MG1 1 31 PRO HG3 . . 3.620 2.992 2.707 3.305 . 0 0 "[ . 1 . 2]" 1
1738 1 11 VAL MG1 1 12 GLU H . . 3.720 3.663 3.538 3.739 0.019 12 0 "[ . 1 . 2]" 1
1739 1 11 VAL MG1 1 78 PHE QD . . 3.430 2.755 2.487 2.994 . 0 0 "[ . 1 . 2]" 1
1740 1 11 VAL MG1 1 28 TRP HD1 . . 3.690 2.782 2.539 3.014 . 0 0 "[ . 1 . 2]" 1
1741 1 11 VAL MG1 1 78 PHE QE . . 3.550 2.516 2.298 3.020 . 0 0 "[ . 1 . 2]" 1
1742 1 10 PRO HA 1 11 VAL MG1 . . 4.310 3.720 3.596 3.843 . 0 0 "[ . 1 . 2]" 1
1743 1 11 VAL HA 1 11 VAL MG1 . . 3.330 2.341 2.258 2.420 . 0 0 "[ . 1 . 2]" 1
1744 1 11 VAL MG1 1 28 TRP HB3 . . 4.800 4.560 4.385 4.725 . 0 0 "[ . 1 . 2]" 1
1745 1 11 VAL MG1 1 28 TRP HB2 . . 3.710 3.412 3.227 3.572 . 0 0 "[ . 1 . 2]" 1
1746 1 11 VAL MG1 1 41 TYR HB2 . . 5.500 5.217 5.040 5.437 . 0 0 "[ . 1 . 2]" 1
1747 1 11 VAL MG1 1 14 LEU MD2 . . 4.990 4.873 4.612 4.997 0.007 14 0 "[ . 1 . 2]" 1
1748 1 11 VAL MG1 1 14 LEU MD1 . . 4.510 4.057 3.764 4.236 . 0 0 "[ . 1 . 2]" 1
1749 1 11 VAL MG1 1 12 GLU HA . . 5.500 5.482 5.447 5.503 0.003 14 0 "[ . 1 . 2]" 1
1750 1 17 VAL H 1 19 THR MG . . 5.050 4.961 4.758 5.070 0.020 3 0 "[ . 1 . 2]" 1
1751 1 18 SER HA 1 19 THR MG . . 4.570 3.277 3.118 3.456 . 0 0 "[ . 1 . 2]" 1
1752 1 19 THR MG 1 25 LEU HA . . 5.070 4.950 4.754 5.042 . 0 0 "[ . 1 . 2]" 1
1753 1 18 SER HB3 1 19 THR MG . . 5.400 5.152 5.066 5.261 . 0 0 "[ . 1 . 2]" 1
1754 1 19 THR MG 1 25 LEU MD2 . . 3.100 2.595 2.469 2.701 . 0 0 "[ . 1 . 2]" 1
1755 1 25 LEU MD1 1 63 TYR H . . 3.710 3.521 3.304 3.724 0.014 5 0 "[ . 1 . 2]" 1
1756 1 25 LEU MD1 1 26 ILE H . . 3.450 3.318 3.058 3.414 . 0 0 "[ . 1 . 2]" 1
1757 1 25 LEU MD1 1 65 LEU H . . 4.470 4.322 4.086 4.472 0.002 18 0 "[ . 1 . 2]" 1
1758 1 25 LEU MD1 1 64 LYS H . . 4.380 3.770 3.364 4.079 . 0 0 "[ . 1 . 2]" 1
1759 1 25 LEU MD1 1 28 TRP HZ3 . . 5.500 5.445 5.259 5.521 0.021 18 0 "[ . 1 . 2]" 1
1760 1 25 LEU HA 1 25 LEU MD1 . . 3.050 1.986 1.947 2.145 . 0 0 "[ . 1 . 2]" 1
1761 1 25 LEU MD1 1 63 TYR HA . . 4.690 4.355 4.116 4.620 . 0 0 "[ . 1 . 2]" 1
1762 1 24 ILE HA 1 25 LEU MD1 . . 5.500 5.493 5.401 5.561 0.061 10 0 "[ . 1 . 2]" 1
1763 1 25 LEU HB3 1 25 LEU MD1 . . 3.420 3.183 3.179 3.196 . 0 0 "[ . 1 . 2]" 1
1764 1 12 GLU HA 1 12 GLU HG2 . . 4.070 3.023 2.493 4.128 0.058 7 0 "[ . 1 . 2]" 1
1765 1 41 TYR QD 1 80 ALA MB . . 3.690 3.275 2.967 3.511 . 0 0 "[ . 1 . 2]" 1
1766 1 41 TYR QE 1 80 ALA MB . . 3.930 3.208 2.988 3.453 . 0 0 "[ . 1 . 2]" 1
1767 1 80 ALA MB 1 81 TYR HA . . 4.020 3.885 3.824 3.958 . 0 0 "[ . 1 . 2]" 1
1768 1 10 PRO HA 1 80 ALA MB . . 4.920 3.469 3.220 3.803 . 0 0 "[ . 1 . 2]" 1
1769 1 8 PRO HA 1 80 ALA MB . . 5.160 4.705 4.365 4.981 . 0 0 "[ . 1 . 2]" 1
1770 1 80 ALA MB 1 86 PRO HA . . 5.500 4.915 4.661 5.112 . 0 0 "[ . 1 . 2]" 1
1771 1 31 PRO HD2 1 80 ALA MB . . 4.660 3.950 3.805 4.118 . 0 0 "[ . 1 . 2]" 1
1772 1 31 PRO HD3 1 80 ALA MB . . 4.280 3.460 3.201 3.834 . 0 0 "[ . 1 . 2]" 1
1773 1 8 PRO HD3 1 80 ALA MB . . 5.100 4.789 4.535 5.006 . 0 0 "[ . 1 . 2]" 1
1774 1 8 PRO HD2 1 80 ALA MB . . 4.890 4.413 4.150 4.670 . 0 0 "[ . 1 . 2]" 1
1775 1 8 PRO HB2 1 80 ALA MB . . 3.790 2.411 2.195 2.678 . 0 0 "[ . 1 . 2]" 1
1776 1 8 PRO HB3 1 80 ALA MB . . 3.830 3.619 3.365 3.849 0.019 8 0 "[ . 1 . 2]" 1
1777 1 31 PRO HG3 1 80 ALA MB . . 3.350 2.671 2.397 2.924 . 0 0 "[ . 1 . 2]" 1
1778 1 8 PRO HG2 1 80 ALA MB . . 3.320 2.374 2.046 2.726 . 0 0 "[ . 1 . 2]" 1
1779 1 38 VAL MG1 1 80 ALA MB . . 3.190 2.635 2.433 2.922 . 0 0 "[ . 1 . 2]" 1
1780 1 14 LEU H 1 90 THR MG . . 5.500 5.303 4.944 5.513 0.013 17 0 "[ . 1 . 2]" 1
1781 1 90 THR HA 1 90 THR MG . . 3.050 2.355 2.277 2.448 . 0 0 "[ . 1 . 2]" 1
1782 1 78 PHE HB3 1 90 THR MG . . 3.640 2.934 2.160 3.166 . 0 0 "[ . 1 . 2]" 1
1783 1 16 ALA MB 1 27 THR H . . 4.760 4.057 3.885 4.189 . 0 0 "[ . 1 . 2]" 1
1784 1 16 ALA MB 1 18 SER H . . 5.500 5.295 5.134 5.491 . 0 0 "[ . 1 . 2]" 1
1785 1 15 GLN HA 1 16 ALA MB . . 4.150 3.840 3.789 3.896 . 0 0 "[ . 1 . 2]" 1
1786 1 16 ALA MB 1 17 VAL HA . . 4.210 3.893 3.813 3.968 . 0 0 "[ . 1 . 2]" 1
1787 1 14 LEU MD1 1 16 ALA MB . . 4.270 4.092 3.751 4.274 0.004 12 0 "[ . 1 . 2]" 1
1788 1 30 PRO HA 1 38 VAL MG2 . . 4.380 3.966 3.667 4.123 . 0 0 "[ . 1 . 2]" 1
1789 1 37 PRO HA 1 38 VAL MG2 . . 3.960 3.425 3.247 3.532 . 0 0 "[ . 1 . 2]" 1
1790 1 38 VAL MG2 1 82 ASN HB3 . . 4.700 3.470 3.217 3.763 . 0 0 "[ . 1 . 2]" 1
1791 1 38 VAL H 1 38 VAL MG2 . . 3.190 2.998 2.889 3.068 . 0 0 "[ . 1 . 2]" 1
1792 1 38 VAL MG2 1 81 TYR H . . 4.590 4.475 4.261 4.588 . 0 0 "[ . 1 . 2]" 1
1793 1 38 VAL MG2 1 41 TYR QE . . 4.140 3.786 3.407 4.036 . 0 0 "[ . 1 . 2]" 1
1794 1 8 PRO HB2 1 38 VAL MG2 . . 3.830 3.636 3.386 3.835 0.005 9 0 "[ . 1 . 2]" 1
1795 1 31 PRO HB2 1 38 VAL MG2 . . 4.950 4.689 4.265 4.930 . 0 0 "[ . 1 . 2]" 1
1796 1 34 ALA MB 1 38 VAL MG2 . . 3.230 2.877 2.611 3.116 . 0 0 "[ . 1 . 2]" 1
1797 1 38 VAL MG2 1 80 ALA MB . . 3.360 3.041 2.800 3.267 . 0 0 "[ . 1 . 2]" 1
1798 1 95 VAL QG 1 98 LEU H . . 5.440 5.116 4.979 5.234 . 0 0 "[ . 1 . 2]" 1
1799 1 74 TYR QD 1 95 VAL QG . . 5.090 5.026 4.835 5.111 0.021 14 0 "[ . 1 . 2]" 1
1800 1 18 SER HB3 1 95 VAL QG . . 3.640 3.340 3.188 3.600 . 0 0 "[ . 1 . 2]" 1
1801 1 95 VAL QG 1 97 THR HA . . 3.960 3.613 3.499 3.719 . 0 0 "[ . 1 . 2]" 1
1802 1 18 SER HB2 1 95 VAL QG . . 3.390 2.835 2.574 2.964 . 0 0 "[ . 1 . 2]" 1
1803 1 74 TYR HB3 1 95 VAL QG . . 5.400 5.195 4.916 5.412 0.012 8 0 "[ . 1 . 2]" 1
1804 1 74 TYR HB2 1 95 VAL QG . . 4.730 4.419 4.267 4.565 . 0 0 "[ . 1 . 2]" 1
1805 1 65 LEU HA 1 66 GLU HA . . 4.790 4.457 4.449 4.469 . 0 0 "[ . 1 . 2]" 1
1806 1 65 LEU HA 1 66 GLU HG3 . . 4.920 3.620 3.346 4.846 . 0 0 "[ . 1 . 2]" 1
1807 1 65 LEU HA 1 66 GLU HB2 . . 4.760 4.640 4.490 4.683 . 0 0 "[ . 1 . 2]" 1
1808 1 65 LEU HA 1 65 LEU HG . . 4.260 2.464 2.423 2.525 . 0 0 "[ . 1 . 2]" 1
1809 1 76 LEU H 1 94 THR MG . . 5.480 5.242 5.028 5.326 . 0 0 "[ . 1 . 2]" 1
1810 1 74 TYR H 1 94 THR MG . . 4.160 3.764 3.539 3.871 . 0 0 "[ . 1 . 2]" 1
1811 1 94 THR MG 1 95 VAL H . . 3.370 2.948 2.692 3.105 . 0 0 "[ . 1 . 2]" 1
1812 1 75 SER HA 1 94 THR MG . . 3.780 3.691 3.406 3.781 0.001 17 0 "[ . 1 . 2]" 1
1813 1 94 THR HA 1 94 THR MG . . 3.160 2.272 2.180 2.364 . 0 0 "[ . 1 . 2]" 1
1814 1 95 VAL QG 1 96 VAL H . . 3.130 2.914 2.739 3.043 . 0 0 "[ . 1 . 2]" 1
1815 1 17 VAL HA 1 95 VAL QG . . 3.440 2.183 1.944 2.493 . 0 0 "[ . 1 . 2]" 1
1816 1 18 SER H 1 95 VAL QG . . 3.340 2.523 2.392 2.683 . 0 0 "[ . 1 . 2]" 1
1817 1 16 ALA H 1 95 VAL QG . . 4.450 3.783 3.593 4.097 . 0 0 "[ . 1 . 2]" 1
1818 1 94 THR H 1 95 VAL QG . . 4.750 3.850 3.760 3.995 . 0 0 "[ . 1 . 2]" 1
1819 1 16 ALA HA 1 95 VAL QG . . 4.460 4.124 3.961 4.345 . 0 0 "[ . 1 . 2]" 1
1820 1 18 SER HA 1 95 VAL QG . . 4.240 4.090 3.841 4.218 . 0 0 "[ . 1 . 2]" 1
1821 1 95 VAL HA 1 95 VAL QG . . 2.880 2.112 2.043 2.176 . 0 0 "[ . 1 . 2]" 1
1822 1 38 VAL MG1 1 39 GLN H . . 3.400 3.239 3.178 3.403 0.003 4 0 "[ . 1 . 2]" 1
1823 1 38 VAL MG1 1 41 TYR QE . . 3.680 2.804 2.604 2.958 . 0 0 "[ . 1 . 2]" 1
1824 1 30 PRO HA 1 38 VAL MG1 . . 5.190 4.375 4.015 4.591 . 0 0 "[ . 1 . 2]" 1
1825 1 30 PRO HA 1 61 LEU MD2 . . 5.500 4.244 3.596 5.066 . 0 0 "[ . 1 . 2]" 1
1826 1 38 VAL MG1 1 41 TYR HA . . 5.500 4.104 3.891 4.237 . 0 0 "[ . 1 . 2]" 1
1827 1 38 VAL MG1 1 82 ASN HA . . 4.720 4.107 3.951 4.303 . 0 0 "[ . 1 . 2]" 1
1828 1 38 VAL MG1 1 39 GLN HA . . 4.640 4.441 4.366 4.551 . 0 0 "[ . 1 . 2]" 1
1829 1 30 PRO HD3 1 61 LEU MD2 . . 3.730 1.940 1.781 2.140 . 0 0 "[ . 1 . 2]" 1
1830 1 58 VAL H 1 58 VAL MG1 . . 4.290 2.615 2.476 2.823 . 0 0 "[ . 1 . 2]" 1
1831 1 28 TRP HH2 1 58 VAL MG1 . . 4.470 3.993 3.724 4.166 . 0 0 "[ . 1 . 2]" 1
1832 1 58 VAL HA 1 58 VAL MG1 . . 3.660 2.386 2.306 2.455 . 0 0 "[ . 1 . 2]" 1
1833 1 43 LEU HB3 1 58 VAL MG1 . . 4.660 3.312 2.924 3.569 . 0 0 "[ . 1 . 2]" 1
1834 1 56 ILE HG13 1 58 VAL MG1 . . 5.500 5.473 5.320 5.504 0.004 18 0 "[ . 1 . 2]" 1
1835 1 43 LEU HB2 1 58 VAL MG1 . . 4.760 3.955 3.395 4.192 . 0 0 "[ . 1 . 2]" 1
1836 1 43 LEU MD1 1 58 VAL MG1 . . 5.150 4.673 4.347 4.825 . 0 0 "[ . 1 . 2]" 1
1837 1 58 VAL MG1 1 65 LEU MD1 . . 5.300 3.909 3.654 4.224 . 0 0 "[ . 1 . 2]" 1
1838 1 88 VAL MG2 1 89 SER H . . 4.170 3.761 1.986 4.063 . 0 0 "[ . 1 . 2]" 1
1839 1 75 SER QB 1 94 THR MG . . 3.840 3.615 3.376 3.842 0.002 20 0 "[ . 1 . 2]" 1
1840 1 88 VAL HA 1 88 VAL MG2 . . 3.250 2.329 2.106 2.445 . 0 0 "[ . 1 . 2]" 1
1841 1 10 PRO HD3 1 88 VAL MG2 . . 3.900 2.905 2.541 3.403 . 0 0 "[ . 1 . 2]" 1
1842 1 18 SER H 1 98 LEU MD2 . . 4.490 3.813 3.674 4.016 . 0 0 "[ . 1 . 2]" 1
1843 1 98 LEU H 1 98 LEU MD2 . . 3.570 2.733 2.650 2.848 . 0 0 "[ . 1 . 2]" 1
1844 1 97 THR HA 1 98 LEU MD2 . . 4.180 3.705 3.603 3.811 . 0 0 "[ . 1 . 2]" 1
1845 1 19 THR HA 1 98 LEU MD2 . . 4.110 3.663 3.390 3.950 . 0 0 "[ . 1 . 2]" 1
1846 1 98 LEU HA 1 98 LEU MD2 . . 2.790 1.953 1.941 1.964 . 0 0 "[ . 1 . 2]" 1
1847 1 18 SER HB2 1 98 LEU MD2 . . 4.100 4.058 3.955 4.145 0.045 13 0 "[ . 1 . 2]" 1
1848 1 98 LEU HB3 1 98 LEU MD2 . . 3.140 2.423 2.410 2.442 . 0 0 "[ . 1 . 2]" 1
1849 1 50 THR MG 1 52 LYS H . . 4.450 4.408 4.286 4.551 0.101 9 0 "[ . 1 . 2]" 1
1850 1 50 THR HG1 1 50 THR MG . . 3.130 2.675 2.141 3.043 . 0 0 "[ . 1 . 2]" 1
1851 1 50 THR HA 1 50 THR MG . . 2.940 2.264 2.133 2.393 . 0 0 "[ . 1 . 2]" 1
1852 1 47 GLU HB3 1 50 THR MG . . 4.350 3.879 3.614 4.073 . 0 0 "[ . 1 . 2]" 1
1853 1 96 VAL HA 1 96 VAL MG2 . . 3.350 2.351 2.313 2.396 . 0 0 "[ . 1 . 2]" 1
1854 1 73 GLU HA 1 96 VAL MG2 . . 3.640 2.115 1.974 2.350 . 0 0 "[ . 1 . 2]" 1
1855 1 88 VAL H 1 88 VAL MG1 . . 3.940 3.669 2.732 3.778 . 0 0 "[ . 1 . 2]" 1
1856 1 88 VAL HA 1 88 VAL MG1 . . 3.250 2.439 2.299 3.139 . 0 0 "[ . 1 . 2]" 1
1857 1 10 PRO HD3 1 88 VAL MG1 . . 3.900 3.079 1.930 3.487 . 0 0 "[ . 1 . 2]" 1
1858 1 26 ILE H 1 27 THR MG . . 4.820 4.213 4.114 4.316 . 0 0 "[ . 1 . 2]" 1
1859 1 27 THR MG 1 28 TRP H . . 4.180 4.172 4.130 4.189 0.009 6 0 "[ . 1 . 2]" 1
1860 1 27 THR MG 1 28 TRP HZ3 . . 5.500 4.846 4.721 4.940 . 0 0 "[ . 1 . 2]" 1
1861 1 26 ILE HA 1 27 THR MG . . 4.580 3.952 3.866 4.059 . 0 0 "[ . 1 . 2]" 1
1862 1 27 THR MG 1 62 SER QB . . 3.010 2.630 2.018 2.994 . 0 0 "[ . 1 . 2]" 1
1863 1 96 VAL MG2 1 97 THR H . . 4.420 4.148 4.103 4.192 . 0 0 "[ . 1 . 2]" 1
1864 1 68 LEU HA 1 74 TYR QE . . 4.840 4.012 3.840 4.264 . 0 0 "[ . 1 . 2]" 1
1865 1 9 GLY H 1 34 ALA HA . . 3.250 2.029 1.873 2.324 . 0 0 "[ . 1 . 2]" 1
1866 1 31 PRO HA 1 32 ALA HA . . 4.680 4.386 4.361 4.463 . 0 0 "[ . 1 . 2]" 1
1867 1 22 THR MG 1 67 GLY H . . 4.790 4.632 4.582 4.684 . 0 0 "[ . 1 . 2]" 1
1868 1 22 THR MG 1 68 LEU H . . 4.110 3.527 3.412 3.665 . 0 0 "[ . 1 . 2]" 1
1869 1 22 THR HA 1 22 THR MG . . 2.970 2.463 2.388 2.555 . 0 0 "[ . 1 . 2]" 1
1870 1 21 PRO HB3 1 22 THR MG . . 3.970 3.265 3.165 3.346 . 0 0 "[ . 1 . 2]" 1
1871 1 46 THR MG 1 47 GLU H . . 3.290 2.520 2.163 3.068 . 0 0 "[ . 1 . 2]" 1
1872 1 46 THR MG 1 48 VAL H . . 4.440 4.064 3.501 4.411 . 0 0 "[ . 1 . 2]" 1
1873 1 46 THR HA 1 46 THR MG . . 3.170 2.333 2.210 2.436 . 0 0 "[ . 1 . 2]" 1
1874 1 46 THR MG 1 53 GLU HA . . 3.600 2.865 2.502 3.100 . 0 0 "[ . 1 . 2]" 1
1875 1 46 THR MG 1 51 GLY HA3 . . 4.220 4.109 3.818 4.236 0.016 3 0 "[ . 1 . 2]" 1
1876 1 46 THR MG 1 51 GLY HA2 . . 3.200 2.857 2.555 3.027 . 0 0 "[ . 1 . 2]" 1
1877 1 46 THR MG 1 48 VAL HA . . 3.910 3.648 3.342 3.881 . 0 0 "[ . 1 . 2]" 1
1878 1 46 THR MG 1 47 GLU HB3 . . 4.440 4.196 3.971 4.444 0.004 4 0 "[ . 1 . 2]" 1
1879 1 49 SER H 1 72 THR MG . . 3.720 3.114 2.891 3.306 . 0 0 "[ . 1 . 2]" 1
1880 1 74 TYR H 1 96 VAL MG2 . . 4.340 3.541 3.377 3.649 . 0 0 "[ . 1 . 2]" 1
1881 1 72 THR MG 1 74 TYR HA . . 4.510 3.858 3.740 4.046 . 0 0 "[ . 1 . 2]" 1
1882 1 72 THR MG 1 97 THR MG . . 5.500 5.013 4.831 5.144 . 0 0 "[ . 1 . 2]" 1
1883 1 96 VAL MG2 1 97 THR MG . . 5.500 5.520 5.480 5.560 0.060 8 0 "[ . 1 . 2]" 1
1884 1 42 ARG H 1 58 VAL MG2 . . 5.300 5.170 4.749 5.309 0.009 6 0 "[ . 1 . 2]" 1
1885 1 58 VAL H 1 58 VAL MG2 . . 3.420 2.164 1.922 2.299 . 0 0 "[ . 1 . 2]" 1
1886 1 58 VAL MG2 1 59 ASP H . . 4.100 3.373 3.042 3.780 . 0 0 "[ . 1 . 2]" 1
1887 1 41 TYR H 1 58 VAL MG2 . . 4.380 4.295 4.176 4.389 0.009 13 0 "[ . 1 . 2]" 1
1888 1 58 VAL MG2 1 63 TYR QD . . 4.250 3.692 3.424 3.967 . 0 0 "[ . 1 . 2]" 1
1889 1 41 TYR QD 1 58 VAL MG2 . . 4.120 3.881 3.602 4.130 0.010 4 0 "[ . 1 . 2]" 1
1890 1 58 VAL MG2 1 62 SER H . . 5.500 5.061 4.455 5.519 0.019 3 0 "[ . 1 . 2]" 1
1891 1 28 TRP HZ2 1 58 VAL MG2 . . 3.900 2.627 2.353 2.994 . 0 0 "[ . 1 . 2]" 1
1892 1 28 TRP HZ3 1 58 VAL MG2 . . 4.480 3.674 3.416 4.008 . 0 0 "[ . 1 . 2]" 1
1893 1 58 VAL MG2 1 78 PHE QE . . 3.640 2.558 1.962 2.855 . 0 0 "[ . 1 . 2]" 1
1894 1 58 VAL HA 1 58 VAL MG2 . . 3.630 3.188 3.181 3.202 . 0 0 "[ . 1 . 2]" 1
1895 1 58 VAL MG2 1 78 PHE HZ . . 3.860 3.082 2.529 3.393 . 0 0 "[ . 1 . 2]" 1
1896 1 58 VAL MG2 1 63 TYR HB2 . . 4.280 2.984 2.656 3.416 . 0 0 "[ . 1 . 2]" 1
1897 1 58 VAL MG2 1 63 TYR HB3 . . 4.340 3.373 3.033 3.573 . 0 0 "[ . 1 . 2]" 1
1898 1 41 TYR HB2 1 58 VAL MG2 . . 3.350 2.916 2.581 3.077 . 0 0 "[ . 1 . 2]" 1
1899 1 43 LEU HB3 1 58 VAL MG2 . . 4.270 3.431 3.055 3.608 . 0 0 "[ . 1 . 2]" 1
1900 1 43 LEU HG 1 58 VAL MG2 . . 5.500 5.399 4.987 5.510 0.010 3 0 "[ . 1 . 2]" 1
1901 1 43 LEU HB2 1 58 VAL MG2 . . 4.030 3.254 2.746 3.430 . 0 0 "[ . 1 . 2]" 1
1902 1 43 LEU MD1 1 58 VAL MG2 . . 4.500 4.364 4.017 4.500 0.000 5 0 "[ . 1 . 2]" 1
1903 1 12 GLU HA 1 13 ASN HA . . 4.650 4.541 4.515 4.562 . 0 0 "[ . 1 . 2]" 1
1904 1 12 GLU HB3 1 13 ASN HA . . 5.500 4.735 4.302 5.550 0.050 7 0 "[ . 1 . 2]" 1
1905 1 13 ASN HA 1 14 LEU HB3 . . 5.500 5.053 4.967 5.133 . 0 0 "[ . 1 . 2]" 1
1906 1 68 LEU HA 1 68 LEU HG . . 3.980 2.823 2.776 2.886 . 0 0 "[ . 1 . 2]" 1
1907 1 33 TYR QD 1 34 ALA HA . . 4.610 3.962 3.406 4.340 . 0 0 "[ . 1 . 2]" 1
1908 1 8 PRO HA 1 34 ALA HA . . 3.650 3.160 2.761 3.555 . 0 0 "[ . 1 . 2]" 1
1909 1 8 PRO HB2 1 34 ALA HA . . 4.720 4.027 3.387 4.438 . 0 0 "[ . 1 . 2]" 1
1910 1 31 PRO HG2 1 32 ALA HA . . 5.500 5.254 5.107 5.414 . 0 0 "[ . 1 . 2]" 1
1911 1 31 PRO HG2 1 34 ALA HA . . 5.500 4.476 4.215 4.935 . 0 0 "[ . 1 . 2]" 1
1912 1 31 PRO HB2 1 34 ALA HA . . 4.480 3.934 3.316 4.460 . 0 0 "[ . 1 . 2]" 1
1913 1 48 VAL H 1 48 VAL MG2 . . 4.030 1.942 1.841 2.088 . 0 0 "[ . 1 . 2]" 1
1914 1 48 VAL H 1 72 THR MG . . 4.390 3.982 3.474 4.270 . 0 0 "[ . 1 . 2]" 1
1915 1 48 VAL HA 1 48 VAL MG2 . . 3.100 2.428 2.392 2.454 . 0 0 "[ . 1 . 2]" 1
1916 1 72 THR MG 1 74 TYR QD . . 4.260 3.647 3.418 3.812 . 0 0 "[ . 1 . 2]" 1
1917 1 47 GLU HB3 1 72 THR MG . . 5.440 5.051 4.773 5.272 . 0 0 "[ . 1 . 2]" 1
1918 1 69 LYS HG3 1 72 THR MG . . 5.160 4.354 4.106 4.801 . 0 0 "[ . 1 . 2]" 1
1919 1 69 LYS HG2 1 72 THR MG . . 5.500 5.128 4.896 5.370 . 0 0 "[ . 1 . 2]" 1
1920 1 72 THR MG 1 74 TYR QE . . 3.530 3.300 3.070 3.522 . 0 0 "[ . 1 . 2]" 1
1921 1 74 TYR H 1 96 VAL MG1 . . 4.340 4.351 4.321 4.370 0.030 8 0 "[ . 1 . 2]" 1
1922 1 96 VAL H 1 96 VAL MG1 . . 3.940 3.780 3.774 3.786 . 0 0 "[ . 1 . 2]" 1
1923 1 96 VAL HA 1 96 VAL MG1 . . 3.350 2.261 2.211 2.292 . 0 0 "[ . 1 . 2]" 1
1924 1 73 GLU HA 1 96 VAL MG1 . . 3.640 3.059 2.930 3.185 . 0 0 "[ . 1 . 2]" 1
1925 1 8 PRO HB3 1 34 ALA HA . . 4.760 4.247 3.569 4.765 0.005 8 0 "[ . 1 . 2]" 1
1926 1 33 TYR QD 1 34 ALA MB . . 5.130 4.418 4.049 4.832 . 0 0 "[ . 1 . 2]" 1
1927 1 34 ALA MB 1 35 ASN H . . 4.390 2.644 2.190 3.016 . 0 0 "[ . 1 . 2]" 1
1928 1 9 GLY H 1 34 ALA MB . . 4.360 2.472 1.878 3.060 . 0 0 "[ . 1 . 2]" 1
1929 1 33 TYR QE 1 34 ALA MB . . 5.480 5.384 5.052 5.505 0.025 10 0 "[ . 1 . 2]" 1
1930 1 8 PRO HA 1 34 ALA MB . . 4.010 3.145 2.594 3.632 . 0 0 "[ . 1 . 2]" 1
1931 1 34 ALA MB 1 38 VAL MG1 . . 4.870 4.577 4.255 4.804 . 0 0 "[ . 1 . 2]" 1
1932 1 11 VAL MG2 1 41 TYR QD . . 4.710 4.215 4.004 4.445 . 0 0 "[ . 1 . 2]" 1
1933 1 11 VAL HA 1 11 VAL MG2 . . 3.680 3.195 3.187 3.203 . 0 0 "[ . 1 . 2]" 1
1934 1 11 VAL MG2 1 78 PHE HB3 . . 4.160 3.253 3.092 3.373 . 0 0 "[ . 1 . 2]" 1
1935 1 11 VAL MG2 1 28 TRP HB2 . . 4.010 2.577 2.296 2.776 . 0 0 "[ . 1 . 2]" 1
1936 1 11 VAL MG2 1 14 LEU HB3 . . 3.790 3.169 3.025 3.364 . 0 0 "[ . 1 . 2]" 1
1937 1 11 VAL MG2 1 14 LEU HB2 . . 3.250 2.032 1.966 2.173 . 0 0 "[ . 1 . 2]" 1
1938 1 10 PRO HA 1 11 VAL MG2 . . 4.240 3.834 3.701 3.951 . 0 0 "[ . 1 . 2]" 1
1939 1 11 VAL MG2 1 28 TRP HB3 . . 4.260 3.439 3.122 3.666 . 0 0 "[ . 1 . 2]" 1
1940 1 26 ILE MG 1 63 TYR H . . 4.730 4.482 4.326 4.630 . 0 0 "[ . 1 . 2]" 1
1941 1 26 ILE H 1 26 ILE MG . . 4.220 3.831 3.820 3.840 . 0 0 "[ . 1 . 2]" 1
1942 1 26 ILE MG 1 78 PHE QD . . 3.990 3.332 2.981 3.823 . 0 0 "[ . 1 . 2]" 1
1943 1 26 ILE MG 1 28 TRP HB3 . . 4.420 3.070 2.947 3.242 . 0 0 "[ . 1 . 2]" 1
1944 1 17 VAL H 1 26 ILE MG . . 5.300 5.239 5.149 5.313 0.013 16 0 "[ . 1 . 2]" 1
1945 1 26 ILE MG 1 28 TRP HE3 . . 2.980 2.054 1.974 2.230 . 0 0 "[ . 1 . 2]" 1
1946 1 26 ILE MG 1 78 PHE QE . . 4.130 3.767 3.386 4.129 . 0 0 "[ . 1 . 2]" 1
1947 1 26 ILE HA 1 26 ILE MG . . 3.170 2.218 2.145 2.349 . 0 0 "[ . 1 . 2]" 1
1948 1 26 ILE MG 1 63 TYR HB3 . . 4.500 4.496 4.361 4.528 0.028 13 0 "[ . 1 . 2]" 1
1949 1 68 LEU MD2 1 74 TYR QD . . 4.630 3.210 3.042 3.542 . 0 0 "[ . 1 . 2]" 1
1950 1 68 LEU MD2 1 74 TYR QE . . 3.650 2.967 2.716 3.248 . 0 0 "[ . 1 . 2]" 1
1951 1 23 SER HA 1 68 LEU MD2 . . 5.310 4.944 4.705 5.161 . 0 0 "[ . 1 . 2]" 1
1952 1 68 LEU HA 1 68 LEU MD2 . . 2.800 2.570 2.453 2.687 . 0 0 "[ . 1 . 2]" 1
1953 1 45 CYS HG 1 68 LEU MD2 . . 4.090 3.791 3.250 4.084 . 0 0 "[ . 1 . 2]" 1
1954 1 65 LEU HB3 1 68 LEU MD2 . . 4.570 3.974 3.813 4.217 . 0 0 "[ . 1 . 2]" 1
1955 1 68 LEU HB3 1 68 LEU MD2 . . 3.000 2.091 1.986 2.207 . 0 0 "[ . 1 . 2]" 1
1956 1 68 LEU MD2 1 97 THR MG . . 3.990 3.459 3.365 3.598 . 0 0 "[ . 1 . 2]" 1
1957 1 68 LEU H 1 68 LEU MD2 . . 4.200 4.040 3.983 4.098 . 0 0 "[ . 1 . 2]" 1
1958 1 22 THR HA 1 68 LEU MD2 . . 5.160 5.158 5.088 5.185 0.025 16 0 "[ . 1 . 2]" 1
1959 1 31 PRO HA 1 32 ALA MB . . 4.170 3.928 3.883 3.993 . 0 0 "[ . 1 . 2]" 1
1960 1 32 ALA MB 1 33 TYR HA . . 4.600 3.847 3.748 3.905 . 0 0 "[ . 1 . 2]" 1
1961 1 32 ALA MB 1 33 TYR HB3 . . 4.580 3.969 3.727 4.180 . 0 0 "[ . 1 . 2]" 1
1962 1 21 PRO HD3 1 22 THR H . . 4.840 4.221 4.197 4.232 . 0 0 "[ . 1 . 2]" 1
1963 1 21 PRO HD3 1 98 LEU HB2 . . 4.440 4.042 3.929 4.133 . 0 0 "[ . 1 . 2]" 1
1964 1 21 PRO HD2 1 22 THR MG . . 5.240 4.845 4.722 4.989 . 0 0 "[ . 1 . 2]" 1
1965 1 21 PRO HD2 1 98 LEU HB2 . . 5.500 4.987 4.924 5.079 . 0 0 "[ . 1 . 2]" 1
1966 1 31 PRO HD2 1 38 VAL MG1 . . 4.790 3.642 3.327 4.011 . 0 0 "[ . 1 . 2]" 1
1967 1 30 PRO HA 1 31 PRO HD2 . . 3.300 2.036 2.001 2.074 . 0 0 "[ . 1 . 2]" 1
1968 1 30 PRO HB2 1 31 PRO HD2 . . 4.400 3.302 3.185 3.421 . 0 0 "[ . 1 . 2]" 1
1969 1 29 GLU H 1 30 PRO HD3 . . 5.030 4.976 4.938 5.043 0.013 20 0 "[ . 1 . 2]" 1
1970 1 31 PRO HD3 1 41 TYR QE . . 4.000 2.856 2.539 3.157 . 0 0 "[ . 1 . 2]" 1
1971 1 30 PRO HA 1 31 PRO HD3 . . 3.370 2.296 2.279 2.318 . 0 0 "[ . 1 . 2]" 1
1972 1 11 VAL HB 1 31 PRO HD3 . . 3.700 3.390 3.177 3.647 . 0 0 "[ . 1 . 2]" 1
1973 1 31 PRO HD3 1 34 ALA MB . . 4.830 4.479 4.264 4.681 . 0 0 "[ . 1 . 2]" 1
1974 1 11 VAL MG1 1 31 PRO HD3 . . 4.170 2.116 1.975 2.396 . 0 0 "[ . 1 . 2]" 1
1975 1 31 PRO HD3 1 38 VAL MG2 . . 3.860 3.658 3.326 3.874 0.014 17 0 "[ . 1 . 2]" 1
1976 1 29 GLU H 1 30 PRO HD2 . . 5.110 4.785 4.768 4.796 . 0 0 "[ . 1 . 2]" 1
1977 1 29 GLU HB3 1 30 PRO HD2 . . 3.100 1.999 1.975 2.110 . 0 0 "[ . 1 . 2]" 1
1978 1 29 GLU HB2 1 30 PRO HD2 . . 3.820 3.577 3.548 3.645 . 0 0 "[ . 1 . 2]" 1
1979 1 30 PRO HD2 1 61 LEU HG . . 5.500 5.449 4.311 5.590 0.090 7 0 "[ . 1 . 2]" 1
1980 1 30 PRO HD2 1 61 LEU MD2 . . 4.090 3.025 2.396 3.473 . 0 0 "[ . 1 . 2]" 1
1981 1 18 SER HG 1 24 ILE MG . . 5.450 5.215 5.133 5.291 . 0 0 "[ . 1 . 2]" 1
1982 1 18 SER HB2 1 24 ILE MG . . 4.400 4.187 4.116 4.249 . 0 0 "[ . 1 . 2]" 1
1983 1 24 ILE MG 1 65 LEU H . . 4.830 3.959 3.743 4.091 . 0 0 "[ . 1 . 2]" 1
1984 1 24 ILE H 1 24 ILE MG . . 4.270 3.960 3.945 3.986 . 0 0 "[ . 1 . 2]" 1
1985 1 16 ALA HA 1 24 ILE MG . . 3.880 3.744 3.559 3.838 . 0 0 "[ . 1 . 2]" 1
1986 1 24 ILE MG 1 25 LEU HA . . 4.540 4.005 3.926 4.120 . 0 0 "[ . 1 . 2]" 1
1987 1 24 ILE HA 1 24 ILE MG . . 3.240 2.379 2.296 2.439 . 0 0 "[ . 1 . 2]" 1
1988 1 18 SER HB3 1 24 ILE MG . . 5.500 5.518 5.449 5.564 0.064 2 0 "[ . 1 . 2]" 1
1989 1 24 ILE MG 1 26 ILE HB . . 4.600 4.352 4.314 4.395 . 0 0 "[ . 1 . 2]" 1
1990 1 24 ILE MG 1 65 LEU HB3 . . 4.170 3.843 3.756 3.952 . 0 0 "[ . 1 . 2]" 1
1991 1 24 ILE MG 1 95 VAL HB . . 4.380 3.531 3.241 3.721 . 0 0 "[ . 1 . 2]" 1
1992 1 24 ILE MG 1 68 LEU MD1 . . 4.030 3.915 3.874 3.973 . 0 0 "[ . 1 . 2]" 1
1993 1 56 ILE MG 1 57 GLU H . . 3.160 2.190 2.074 2.665 . 0 0 "[ . 1 . 2]" 1
1994 1 56 ILE MG 1 63 TYR QD . . 4.830 4.508 4.340 4.632 . 0 0 "[ . 1 . 2]" 1
1995 1 56 ILE MG 1 63 TYR QE . . 3.670 3.636 3.418 3.694 0.024 5 0 "[ . 1 . 2]" 1
1996 1 55 ASN HA 1 56 ILE MG . . 5.500 5.439 5.429 5.451 . 0 0 "[ . 1 . 2]" 1
1997 1 56 ILE HA 1 56 ILE MG . . 3.100 2.399 2.302 2.462 . 0 0 "[ . 1 . 2]" 1
1998 1 54 GLN QG 1 56 ILE MG . . 5.500 5.086 4.845 5.222 . 0 0 "[ . 1 . 2]" 1
1999 1 56 ILE MG 1 57 GLU HG2 . . 5.500 5.269 5.119 5.499 . 0 0 "[ . 1 . 2]" 1
2000 1 56 ILE MG 1 57 GLU HB3 . . 5.280 4.773 4.680 4.915 . 0 0 "[ . 1 . 2]" 1
2001 1 56 ILE MG 1 58 VAL HB . . 5.500 4.597 4.466 4.728 . 0 0 "[ . 1 . 2]" 1
2002 1 56 ILE MG 1 57 GLU HB2 . . 4.310 4.133 4.042 4.277 . 0 0 "[ . 1 . 2]" 1
2003 1 85 GLY HA2 1 86 PRO HD2 . . 3.510 2.807 2.724 2.909 . 0 0 "[ . 1 . 2]" 1
2004 1 102 GLY QA 1 103 PRO QD . . 2.830 2.021 1.844 2.290 . 0 0 "[ . 1 . 2]" 1
2005 1 85 GLY H 1 86 PRO HD3 . . 5.030 4.928 4.869 4.975 . 0 0 "[ . 1 . 2]" 1
2006 1 85 GLY HA2 1 86 PRO HD3 . . 3.510 2.543 2.479 2.627 . 0 0 "[ . 1 . 2]" 1
2007 1 85 GLY HA3 1 86 PRO HD3 . . 3.510 3.118 3.017 3.198 . 0 0 "[ . 1 . 2]" 1
2008 1 76 LEU H 1 93 ILE MG . . 4.460 3.904 3.657 4.287 . 0 0 "[ . 1 . 2]" 1
2009 1 93 ILE MG 1 95 VAL H . . 4.870 4.039 3.882 4.308 . 0 0 "[ . 1 . 2]" 1
2010 1 16 ALA H 1 93 ILE MG . . 3.780 3.272 3.063 3.625 . 0 0 "[ . 1 . 2]" 1
2011 1 93 ILE MG 1 94 THR HA . . 4.510 4.049 3.872 4.227 . 0 0 "[ . 1 . 2]" 1
2012 1 15 GLN HA 1 93 ILE MG . . 4.690 4.163 3.853 4.491 . 0 0 "[ . 1 . 2]" 1
2013 1 93 ILE HA 1 93 ILE MG . . 3.160 2.351 2.266 2.468 . 0 0 "[ . 1 . 2]" 1
2014 1 93 ILE MG 1 94 THR HB . . 5.170 4.894 4.729 5.085 . 0 0 "[ . 1 . 2]" 1
2015 1 36 GLY H 1 37 PRO HD3 . . 5.180 5.007 4.916 5.056 . 0 0 "[ . 1 . 2]" 1
2016 1 25 LEU H 1 26 ILE MD . . 5.500 5.514 5.484 5.538 0.038 3 0 "[ . 1 . 2]" 1
2017 1 9 GLY HA3 1 10 PRO HD2 . . 3.370 2.426 2.238 2.593 . 0 0 "[ . 1 . 2]" 1
2018 1 8 PRO HD3 1 87 GLY H . . 4.720 3.928 3.691 4.275 . 0 0 "[ . 1 . 2]" 1
2019 1 8 PRO HD3 1 81 TYR HA . . 4.260 3.478 3.126 3.818 . 0 0 "[ . 1 . 2]" 1
2020 1 7 GLY HA2 1 8 PRO HD3 . . 3.410 2.266 2.252 2.373 . 0 0 "[ . 1 . 2]" 1
2021 1 9 GLY HA3 1 10 PRO HD3 . . 3.540 3.313 3.116 3.468 . 0 0 "[ . 1 . 2]" 1
2022 1 8 PRO HD2 1 81 TYR HA . . 4.120 3.114 2.660 3.379 . 0 0 "[ . 1 . 2]" 1
2023 1 8 PRO HD2 1 79 LEU MD1 . . 5.050 4.810 4.629 4.995 . 0 0 "[ . 1 . 2]" 1
2024 1 8 PRO HD2 1 82 ASN HD21 . . 5.120 3.936 3.275 4.743 . 0 0 "[ . 1 . 2]" 1
2025 1 7 GLY HA2 1 8 PRO HD2 . . 3.550 2.168 1.945 2.344 . 0 0 "[ . 1 . 2]" 1
2026 1 8 PRO HD2 1 87 GLY HA3 . . 4.080 2.492 2.282 2.717 . 0 0 "[ . 1 . 2]" 1
2027 1 26 ILE H 1 26 ILE MD . . 3.850 3.285 3.247 3.325 . 0 0 "[ . 1 . 2]" 1
2028 1 26 ILE MD 1 27 THR H . . 5.500 5.454 5.418 5.476 . 0 0 "[ . 1 . 2]" 1
2029 1 26 ILE MD 1 65 LEU H . . 4.170 3.900 3.719 4.092 . 0 0 "[ . 1 . 2]" 1
2030 1 24 ILE H 1 26 ILE MD . . 5.500 5.407 5.332 5.479 . 0 0 "[ . 1 . 2]" 1
2031 1 26 ILE MD 1 63 TYR QD . . 3.450 2.948 2.742 3.145 . 0 0 "[ . 1 . 2]" 1
2032 1 26 ILE MD 1 63 TYR QE . . 4.480 4.350 4.202 4.457 . 0 0 "[ . 1 . 2]" 1
2033 1 26 ILE MD 1 78 PHE QD . . 4.490 3.928 3.721 4.224 . 0 0 "[ . 1 . 2]" 1
2034 1 26 ILE MD 1 28 TRP HZ3 . . 4.360 3.828 3.594 3.989 . 0 0 "[ . 1 . 2]" 1
2035 1 26 ILE MD 1 78 PHE QE . . 4.490 4.040 3.834 4.316 . 0 0 "[ . 1 . 2]" 1
2036 1 16 ALA HA 1 26 ILE MD . . 5.210 5.185 5.082 5.233 0.023 15 0 "[ . 1 . 2]" 1
2037 1 25 LEU HA 1 26 ILE MD . . 4.730 4.647 4.615 4.700 . 0 0 "[ . 1 . 2]" 1
2038 1 26 ILE MD 1 65 LEU HA . . 4.860 4.787 4.692 4.888 0.028 12 0 "[ . 1 . 2]" 1
2039 1 26 ILE MD 1 63 TYR HB2 . . 4.960 4.580 4.332 4.848 . 0 0 "[ . 1 . 2]" 1
2040 1 26 ILE HB 1 26 ILE MD . . 3.250 2.131 2.099 2.172 . 0 0 "[ . 1 . 2]" 1
2041 1 26 ILE MD 1 63 TYR HB3 . . 4.080 3.124 2.885 3.395 . 0 0 "[ . 1 . 2]" 1
2042 1 26 ILE MD 1 65 LEU HG . . 5.080 5.045 4.902 5.097 0.017 18 0 "[ . 1 . 2]" 1
2043 1 9 GLY H 1 10 PRO HD2 . . 4.740 4.666 4.542 4.731 . 0 0 "[ . 1 . 2]" 1
2044 1 10 PRO HD2 1 31 PRO HB2 . . 5.500 5.278 4.946 5.492 . 0 0 "[ . 1 . 2]" 1
2045 1 9 GLY HA2 1 10 PRO HD3 . . 3.510 2.402 2.311 2.544 . 0 0 "[ . 1 . 2]" 1
2046 1 10 PRO HD3 1 88 VAL HB . . 3.750 2.251 1.999 2.887 . 0 0 "[ . 1 . 2]" 1
2047 1 45 CYS HA 1 46 THR HB . . 4.870 4.696 4.627 4.805 . 0 0 "[ . 1 . 2]" 1
2048 1 16 ALA MB 1 24 ILE MG . . 2.960 2.382 2.188 2.571 . 0 0 "[ . 1 . 2]" 1
2049 1 16 ALA MB 1 26 ILE MG . . 2.780 2.601 2.228 2.800 0.020 7 0 "[ . 1 . 2]" 1
2050 1 16 ALA MB 1 24 ILE HG12 . . 5.480 4.862 4.685 5.014 . 0 0 "[ . 1 . 2]" 1
2051 1 16 ALA MB 1 93 ILE HG12 . . 5.500 4.304 4.134 4.562 . 0 0 "[ . 1 . 2]" 1
2052 1 16 ALA MB 1 26 ILE HG13 . . 3.800 3.010 2.772 3.265 . 0 0 "[ . 1 . 2]" 1
2053 1 16 ALA MB 1 93 ILE HB . . 4.170 3.795 3.491 4.097 . 0 0 "[ . 1 . 2]" 1
2054 1 16 ALA MB 1 26 ILE HB . . 4.400 4.316 4.074 4.418 0.018 17 0 "[ . 1 . 2]" 1
2055 1 8 PRO HB2 1 34 ALA MB . . 3.870 2.629 2.374 2.857 . 0 0 "[ . 1 . 2]" 1
2056 1 8 PRO HB3 1 34 ALA MB . . 4.330 2.791 2.466 3.104 . 0 0 "[ . 1 . 2]" 1
2057 1 24 ILE HB 1 65 LEU MD2 . . 3.770 2.621 2.349 2.939 . 0 0 "[ . 1 . 2]" 1
2058 1 24 ILE HB 1 65 LEU MD1 . . 4.620 3.692 3.497 3.884 . 0 0 "[ . 1 . 2]" 1
2059 1 24 ILE MG 1 26 ILE HG13 . . 3.230 1.959 1.931 1.978 . 0 0 "[ . 1 . 2]" 1
2060 1 24 ILE MG 1 26 ILE HG12 . . 3.280 2.511 2.398 2.621 . 0 0 "[ . 1 . 2]" 1
2061 1 24 ILE MG 1 26 ILE MD . . 3.120 2.621 2.456 2.748 . 0 0 "[ . 1 . 2]" 1
2062 1 24 ILE MG 1 95 VAL QG . . 3.170 2.911 2.711 3.130 . 0 0 "[ . 1 . 2]" 1
2063 1 14 LEU HG 1 26 ILE MG . . 4.160 3.929 3.779 4.172 0.012 10 0 "[ . 1 . 2]" 1
2064 1 43 LEU HB3 1 56 ILE MG . . 3.990 3.482 3.134 3.813 . 0 0 "[ . 1 . 2]" 1
2065 1 56 ILE HG13 1 56 ILE MG . . 3.450 3.177 3.140 3.200 . 0 0 "[ . 1 . 2]" 1
2066 1 56 ILE HG12 1 56 ILE MG . . 3.050 2.245 2.158 2.391 . 0 0 "[ . 1 . 2]" 1
2067 1 56 ILE MG 1 58 VAL MG1 . . 3.160 2.077 1.937 2.261 . 0 0 "[ . 1 . 2]" 1
2068 1 56 ILE HB 1 56 ILE MD . . 3.000 2.274 2.148 2.364 . 0 0 "[ . 1 . 2]" 1
2069 1 76 LEU HB2 1 93 ILE MG . . 3.990 3.523 3.126 3.880 . 0 0 "[ . 1 . 2]" 1
2070 1 93 ILE HG13 1 93 ILE MG . . 3.250 3.182 3.159 3.194 . 0 0 "[ . 1 . 2]" 1
2071 1 93 ILE MD 1 93 ILE MG . . 2.780 2.186 2.018 2.402 . 0 0 "[ . 1 . 2]" 1
2072 1 14 LEU MD2 1 93 ILE MG . . 4.360 4.039 3.706 4.318 . 0 0 "[ . 1 . 2]" 1
2073 1 76 LEU HB2 1 93 ILE MD . . 3.680 3.099 2.763 3.464 . 0 0 "[ . 1 . 2]" 1
2074 1 14 LEU HG 1 93 ILE MD . . 3.620 2.676 2.286 2.936 . 0 0 "[ . 1 . 2]" 1
2075 1 70 LYS HA 1 97 THR HG1 . . 4.100 3.788 3.711 3.845 . 0 0 "[ . 1 . 2]" 1
2076 1 77 ARG HB2 1 92 ASP HA . . 4.810 3.450 3.263 3.616 . 0 0 "[ . 1 . 2]" 1
2077 1 42 ARG HA 1 42 ARG HG3 . . 4.030 2.481 2.322 2.618 . 0 0 "[ . 1 . 2]" 1
2078 1 14 LEU HB2 1 14 LEU MD2 . . 3.450 2.695 2.648 2.724 . 0 0 "[ . 1 . 2]" 1
2079 1 14 LEU MD2 1 16 ALA MB . . 4.720 4.701 4.561 4.744 0.024 12 0 "[ . 1 . 2]" 1
2080 1 11 VAL MG2 1 14 LEU MD2 . . 3.680 2.942 2.730 3.079 . 0 0 "[ . 1 . 2]" 1
2081 1 14 LEU HB2 1 14 LEU MD1 . . 3.300 2.117 1.990 2.205 . 0 0 "[ . 1 . 2]" 1
2082 1 11 VAL MG2 1 14 LEU MD1 . . 3.210 2.380 2.011 2.564 . 0 0 "[ . 1 . 2]" 1
2083 1 14 LEU MD1 1 26 ILE MG . . 2.930 2.521 2.401 2.700 . 0 0 "[ . 1 . 2]" 1
2084 1 25 LEU MD1 1 64 LYS QD . . 3.910 3.576 1.951 3.912 0.002 9 0 "[ . 1 . 2]" 1
2085 1 25 LEU MD1 1 64 LYS QG . . 3.120 2.512 1.964 3.155 0.035 5 0 "[ . 1 . 2]" 1
2086 1 43 LEU MD1 1 76 LEU HB3 . . 3.230 2.130 1.966 2.312 . 0 0 "[ . 1 . 2]" 1
2087 1 43 LEU MD2 1 65 LEU MD1 . . 2.790 2.169 2.010 2.284 . 0 0 "[ . 1 . 2]" 1
2088 1 45 CYS HB3 1 65 LEU MD2 . . 4.020 3.870 3.544 4.026 0.006 19 0 "[ . 1 . 2]" 1
2089 1 45 CYS HB2 1 65 LEU MD2 . . 3.730 3.139 2.825 3.362 . 0 0 "[ . 1 . 2]" 1
2090 1 65 LEU HB3 1 65 LEU MD2 . . 3.130 2.125 1.981 2.211 . 0 0 "[ . 1 . 2]" 1
2091 1 65 LEU HB2 1 65 LEU MD2 . . 3.180 2.627 2.570 2.682 . 0 0 "[ . 1 . 2]" 1
2092 1 24 ILE MD 1 65 LEU MD2 . . 3.620 2.246 1.943 2.664 . 0 0 "[ . 1 . 2]" 1
2093 1 65 LEU HB3 1 65 LEU MD1 . . 3.440 3.114 3.099 3.139 . 0 0 "[ . 1 . 2]" 1
2094 1 54 GLN QG 1 65 LEU MD1 . . 4.840 4.719 4.501 4.826 . 0 0 "[ . 1 . 2]" 1
2095 1 24 ILE MD 1 68 LEU MD2 . . 4.060 2.679 2.420 2.916 . 0 0 "[ . 1 . 2]" 1
2096 1 76 LEU HB2 1 76 LEU MD1 . . 3.250 2.280 2.071 2.442 . 0 0 "[ . 1 . 2]" 1
2097 1 25 LEU MD2 1 27 THR MG . . 2.960 2.823 2.719 2.886 . 0 0 "[ . 1 . 2]" 1
2098 1 24 ILE MD 1 76 LEU MD1 . . 3.400 1.943 1.757 2.248 . 0 0 "[ . 1 . 2]" 1
2099 1 79 LEU HB2 1 79 LEU MD2 . . 3.530 2.598 2.434 2.663 . 0 0 "[ . 1 . 2]" 1
2100 1 79 LEU HB3 1 79 LEU MD2 . . 3.420 2.154 2.003 2.231 . 0 0 "[ . 1 . 2]" 1
2101 1 42 ARG QB 1 79 LEU MD1 . . 3.180 2.914 2.640 3.190 0.010 12 0 "[ . 1 . 2]" 1
2102 1 98 LEU HA 1 99 SER HB2 . . 4.900 4.532 4.357 4.617 . 0 0 "[ . 1 . 2]" 1
2103 1 98 LEU HB2 1 98 LEU MD1 . . 3.250 2.387 2.360 2.484 . 0 0 "[ . 1 . 2]" 1
2104 1 98 LEU HB3 1 98 LEU MD1 . . 3.250 2.321 2.199 2.347 . 0 0 "[ . 1 . 2]" 1
2105 1 10 PRO QG 1 88 VAL HB . . 4.760 3.494 3.084 4.457 . 0 0 "[ . 1 . 2]" 1
2106 1 21 PRO HG2 1 22 THR MG . . 4.640 4.459 4.365 4.634 . 0 0 "[ . 1 . 2]" 1
2107 1 31 PRO HG2 1 38 VAL MG2 . . 4.130 2.760 2.324 3.006 . 0 0 "[ . 1 . 2]" 1
2108 1 31 PRO HG3 1 38 VAL MG2 . . 4.730 3.236 2.817 3.508 . 0 0 "[ . 1 . 2]" 1
2109 1 29 GLU HG2 1 30 PRO HD2 . . 4.200 2.918 2.378 3.737 . 0 0 "[ . 1 . 2]" 1
2110 1 19 THR MG 1 25 LEU HB3 . . 3.490 3.393 3.267 3.489 . 0 0 "[ . 1 . 2]" 1
2111 1 19 THR MG 1 25 LEU HB2 . . 2.880 2.846 2.687 2.919 0.039 9 0 "[ . 1 . 2]" 1
2112 1 22 THR HB 1 68 LEU HB2 . . 3.940 2.131 1.984 2.249 . 0 0 "[ . 1 . 2]" 1
2113 1 21 PRO HB2 1 22 THR MG . . 3.300 2.401 2.286 2.591 . 0 0 "[ . 1 . 2]" 1
2114 1 25 LEU HG 1 27 THR MG . . 3.050 2.388 2.290 2.481 . 0 0 "[ . 1 . 2]" 1
2115 1 25 LEU MD1 1 27 THR MG . . 3.380 3.217 3.061 3.354 . 0 0 "[ . 1 . 2]" 1
2116 1 14 LEU MD2 1 90 THR MG . . 3.190 1.884 1.714 2.066 . 0 0 "[ . 1 . 2]" 1
2117 1 90 THR MG 1 93 ILE MD . . 4.000 3.851 3.551 4.012 0.012 10 0 "[ . 1 . 2]" 1
2118 1 11 VAL MG2 1 90 THR MG . . 3.350 2.455 2.153 2.737 . 0 0 "[ . 1 . 2]" 1
2119 1 14 LEU HB3 1 90 THR MG . . 3.880 3.577 3.267 3.846 . 0 0 "[ . 1 . 2]" 1
2120 1 10 PRO QB 1 90 THR MG . . 3.840 2.813 2.409 3.403 . 0 0 "[ . 1 . 2]" 1
2121 1 73 GLU HG3 1 94 THR MG . . 3.200 2.035 1.897 2.232 . 0 0 "[ . 1 . 2]" 1
2122 1 97 THR HA 1 98 LEU HG . . 4.650 3.877 3.837 4.005 . 0 0 "[ . 1 . 2]" 1
2123 1 18 SER HG 1 97 THR HA . . 4.330 3.612 3.328 3.763 . 0 0 "[ . 1 . 2]" 1
2124 1 31 PRO HD2 1 38 VAL MG2 . . 3.780 2.518 2.112 2.806 . 0 0 "[ . 1 . 2]" 1
2125 1 43 LEU MD2 1 58 VAL MG2 . . 3.710 3.448 3.096 3.673 . 0 0 "[ . 1 . 2]" 1
2126 1 16 ALA MB 1 95 VAL QG . . 2.750 2.136 1.923 2.566 . 0 0 "[ . 1 . 2]" 1
2127 1 96 VAL MG1 1 97 THR MG . . 5.500 4.496 4.448 4.585 . 0 0 "[ . 1 . 2]" 1
2128 1 41 TYR HA 1 42 ARG QB . . 5.090 4.019 3.920 4.152 . 0 0 "[ . 1 . 2]" 1
2129 1 49 SER QB 1 50 THR HA . . 4.510 4.130 3.868 4.442 . 0 0 "[ . 1 . 2]" 1
2130 1 49 SER QB 1 72 THR MG . . 4.090 2.298 1.928 2.804 . 0 0 "[ . 1 . 2]" 1
2131 1 48 VAL HB 1 49 SER QB . . 4.770 4.359 4.213 4.715 . 0 0 "[ . 1 . 2]" 1
2132 1 45 CYS HG 1 74 TYR QD . . 5.240 3.045 2.459 3.893 . 0 0 "[ . 1 . 2]" 1
2133 1 26 ILE MD 1 26 ILE MG . . 2.690 2.409 2.352 2.460 . 0 0 "[ . 1 . 2]" 1
2134 1 24 ILE HB 1 26 ILE MD . . 3.510 3.510 3.415 3.572 0.062 12 0 "[ . 1 . 2]" 1
2135 1 33 TYR HB3 1 34 ALA H . . 5.130 4.638 4.588 4.665 . 0 0 "[ . 1 . 2]" 1
2136 1 33 TYR HB2 1 34 ALA H . . 5.200 4.345 4.269 4.406 . 0 0 "[ . 1 . 2]" 1
2137 1 5 SER QB 1 84 TYR QB . . 5.030 2.354 1.881 3.483 . 0 0 "[ . 1 . 2]" 1
2138 1 5 SER QB 1 84 TYR QD . . 4.400 3.424 2.150 4.028 . 0 0 "[ . 1 . 2]" 1
2139 1 5 SER QB 1 84 TYR QE . . 5.340 5.021 3.535 5.362 0.022 14 0 "[ . 1 . 2]" 1
2140 1 6 SER HA 1 35 ASN QD . . 4.980 4.515 3.948 4.984 0.004 8 0 "[ . 1 . 2]" 1
2141 1 6 SER QB 1 35 ASN QD . . 4.250 2.126 1.744 3.390 . 0 0 "[ . 1 . 2]" 1
2142 1 6 SER QB 1 84 TYR QB . . 4.440 4.193 3.133 4.450 0.010 14 0 "[ . 1 . 2]" 1
2143 1 7 GLY HA2 1 82 ASN QD . . 3.930 3.171 2.724 3.538 . 0 0 "[ . 1 . 2]" 1
2144 1 7 GLY HA2 1 84 TYR QB . . 4.540 3.445 2.992 3.810 . 0 0 "[ . 1 . 2]" 1
2145 1 8 PRO HA 1 82 ASN QD . . 5.340 4.182 3.072 4.815 . 0 0 "[ . 1 . 2]" 1
2146 1 8 PRO HG2 1 82 ASN QD . . 4.820 4.087 3.462 4.790 . 0 0 "[ . 1 . 2]" 1
2147 1 8 PRO HG3 1 82 ASN QD . . 4.100 2.824 1.961 3.743 . 0 0 "[ . 1 . 2]" 1
2148 1 8 PRO HD2 1 82 ASN QD . . 4.460 3.353 3.106 3.886 . 0 0 "[ . 1 . 2]" 1
2149 1 8 PRO HD3 1 82 ASN QD . . 4.420 1.923 1.765 2.373 . 0 0 "[ . 1 . 2]" 1
2150 1 8 PRO HD3 1 84 TYR QB . . 5.340 3.493 3.158 3.810 . 0 0 "[ . 1 . 2]" 1
2151 1 9 GLY H 1 35 ASN QB . . 4.720 4.447 3.791 4.731 0.011 12 0 "[ . 1 . 2]" 1
2152 1 9 GLY HA2 1 88 VAL QG . . 3.920 3.300 3.024 3.426 . 0 0 "[ . 1 . 2]" 1
2153 1 9 GLY HA3 1 88 VAL QG . . 4.670 4.564 4.041 4.681 0.011 8 0 "[ . 1 . 2]" 1
2154 1 10 PRO QB 1 88 VAL QG . . 3.620 2.596 1.742 3.050 . 0 0 "[ . 1 . 2]" 1
2155 1 10 PRO QG 1 88 VAL QG . . 3.960 2.884 2.505 3.273 . 0 0 "[ . 1 . 2]" 1
2156 1 10 PRO HD2 1 88 VAL QG . . 4.180 3.806 3.242 4.080 . 0 0 "[ . 1 . 2]" 1
2157 1 10 PRO HD3 1 88 VAL QG . . 3.310 2.590 1.919 2.823 . 0 0 "[ . 1 . 2]" 1
2158 1 11 VAL HA 1 12 GLU QG . . 4.300 3.316 3.118 3.471 . 0 0 "[ . 1 . 2]" 1
2159 1 11 VAL MG1 1 12 GLU QG . . 5.340 4.788 4.517 4.959 . 0 0 "[ . 1 . 2]" 1
2160 1 12 GLU H 1 12 GLU QG . . 3.460 2.456 1.847 2.798 . 0 0 "[ . 1 . 2]" 1
2161 1 12 GLU HA 1 12 GLU QG . . 3.330 2.825 2.445 3.304 . 0 0 "[ . 1 . 2]" 1
2162 1 12 GLU HB2 1 13 ASN QB . . 4.030 3.668 3.479 3.881 . 0 0 "[ . 1 . 2]" 1
2163 1 12 GLU QG 1 13 ASN H . . 4.430 4.105 4.005 4.220 . 0 0 "[ . 1 . 2]" 1
2164 1 12 GLU QG 1 31 PRO HA . . 3.560 2.134 1.979 2.460 . 0 0 "[ . 1 . 2]" 1
2165 1 12 GLU QG 1 32 ALA HA . . 5.340 5.284 5.192 5.356 0.016 14 0 "[ . 1 . 2]" 1
2166 1 12 GLU QG 1 32 ALA MB . . 3.800 3.804 3.726 3.851 0.051 11 0 "[ . 1 . 2]" 1
2167 1 13 ASN H 1 13 ASN QB . . 3.270 3.163 3.074 3.269 . 0 0 "[ . 1 . 2]" 1
2168 1 13 ASN QB 1 13 ASN HD21 . . 3.030 2.119 2.087 2.174 . 0 0 "[ . 1 . 2]" 1
2169 1 13 ASN QB 1 29 GLU H . . 4.650 3.815 3.300 3.974 . 0 0 "[ . 1 . 2]" 1
2170 1 13 ASN QB 1 29 GLU HB3 . . 4.750 3.411 3.283 3.580 . 0 0 "[ . 1 . 2]" 1
2171 1 13 ASN QB 1 29 GLU QG . . 3.570 2.563 2.082 3.060 . 0 0 "[ . 1 . 2]" 1
2172 1 13 ASN HD21 1 29 GLU QG . . 4.690 3.130 1.993 3.856 . 0 0 "[ . 1 . 2]" 1
2173 1 14 LEU H 1 15 GLN QG . . 4.690 4.124 4.014 4.217 . 0 0 "[ . 1 . 2]" 1
2174 1 15 GLN QG 1 16 ALA H . . 4.230 3.915 3.688 4.241 0.011 2 0 "[ . 1 . 2]" 1
2175 1 16 ALA HA 1 17 VAL QG . . 4.130 3.411 3.124 3.733 . 0 0 "[ . 1 . 2]" 1
2176 1 17 VAL H 1 17 VAL QG . . 3.210 2.348 2.043 2.510 . 0 0 "[ . 1 . 2]" 1
2177 1 17 VAL QG 1 18 SER H . . 3.410 2.773 2.095 3.417 0.007 14 0 "[ . 1 . 2]" 1
2178 1 17 VAL QG 1 18 SER HB3 . . 5.350 4.465 3.713 5.140 . 0 0 "[ . 1 . 2]" 1
2179 1 17 VAL QG 1 25 LEU H . . 3.930 3.523 3.310 3.834 . 0 0 "[ . 1 . 2]" 1
2180 1 17 VAL QG 1 25 LEU HB2 . . 4.180 3.668 3.417 3.993 . 0 0 "[ . 1 . 2]" 1
2181 1 17 VAL QG 1 25 LEU HB3 . . 3.780 2.480 2.246 2.830 . 0 0 "[ . 1 . 2]" 1
2182 1 20 SER H 1 20 SER QB . . 3.460 2.860 2.536 3.119 . 0 0 "[ . 1 . 2]" 1
2183 1 20 SER H 1 23 SER QB . . 4.760 3.691 2.557 4.328 . 0 0 "[ . 1 . 2]" 1
2184 1 20 SER QB 1 21 PRO HG2 . . 4.660 3.951 3.736 4.036 . 0 0 "[ . 1 . 2]" 1
2185 1 20 SER QB 1 21 PRO HG3 . . 4.730 4.462 4.167 4.566 . 0 0 "[ . 1 . 2]" 1
2186 1 20 SER QB 1 21 PRO HD2 . . 3.430 1.878 1.793 1.954 . 0 0 "[ . 1 . 2]" 1
2187 1 20 SER QB 1 21 PRO HD3 . . 3.620 2.882 2.417 3.052 . 0 0 "[ . 1 . 2]" 1
2188 1 20 SER QB 1 22 THR H . . 3.700 2.745 2.669 3.741 0.041 3 0 "[ . 1 . 2]" 1
2189 1 20 SER QB 1 23 SER H . . 5.340 4.492 4.376 5.311 . 0 0 "[ . 1 . 2]" 1
2190 1 20 SER QB 1 98 LEU MD1 . . 4.860 3.658 3.547 3.809 . 0 0 "[ . 1 . 2]" 1
2191 1 21 PRO HB2 1 70 LYS QE . . 4.110 3.817 3.348 4.166 0.056 18 0 "[ . 1 . 2]" 1
2192 1 21 PRO HB3 1 70 LYS QB . . 4.640 4.274 3.686 4.466 . 0 0 "[ . 1 . 2]" 1
2193 1 21 PRO HB3 1 70 LYS QG . . 3.830 2.490 2.181 3.209 . 0 0 "[ . 1 . 2]" 1
2194 1 21 PRO HB3 1 70 LYS QE . . 4.840 2.968 1.997 3.703 . 0 0 "[ . 1 . 2]" 1
2195 1 22 THR H 1 23 SER QB . . 5.030 4.000 3.710 4.517 . 0 0 "[ . 1 . 2]" 1
2196 1 22 THR MG 1 70 LYS QB . . 4.760 3.477 3.396 3.581 . 0 0 "[ . 1 . 2]" 1
2197 1 22 THR MG 1 70 LYS QG . . 3.900 3.637 3.365 4.010 0.110 7 0 "[ . 1 . 2]" 1
2198 1 22 THR MG 1 70 LYS QE . . 4.790 3.736 3.402 4.279 . 0 0 "[ . 1 . 2]" 1
2199 1 23 SER H 1 23 SER QB . . 3.530 3.180 2.863 3.344 . 0 0 "[ . 1 . 2]" 1
2200 1 23 SER HA 1 66 GLU QG . . 4.950 3.702 3.564 3.951 . 0 0 "[ . 1 . 2]" 1
2201 1 23 SER QB 1 24 ILE H . . 3.150 2.387 2.146 3.143 . 0 0 "[ . 1 . 2]" 1
2202 1 23 SER QB 1 64 LYS QG . . 3.520 2.936 2.683 3.527 0.007 3 0 "[ . 1 . 2]" 1
2203 1 23 SER QB 1 64 LYS QD . . 4.210 3.815 2.575 4.220 0.010 4 0 "[ . 1 . 2]" 1
2204 1 23 SER QB 1 64 LYS QE . . 4.030 3.100 1.947 3.917 . 0 0 "[ . 1 . 2]" 1
2205 1 23 SER QB 1 65 LEU H . . 4.830 4.347 4.080 4.855 0.025 20 0 "[ . 1 . 2]" 1
2206 1 23 SER QB 1 66 GLU HA . . 4.010 3.617 3.291 3.862 . 0 0 "[ . 1 . 2]" 1
2207 1 23 SER QB 1 66 GLU QG . . 3.600 3.261 2.899 3.653 0.053 13 0 "[ . 1 . 2]" 1
2208 1 23 SER QB 1 67 GLY H . . 5.340 5.114 4.800 5.339 . 0 0 "[ . 1 . 2]" 1
2209 1 23 SER QB 1 68 LEU MD1 . . 4.700 3.813 3.693 3.971 . 0 0 "[ . 1 . 2]" 1
2210 1 25 LEU HA 1 64 LYS QB . . 4.520 4.025 3.523 4.399 . 0 0 "[ . 1 . 2]" 1
2211 1 25 LEU MD1 1 64 LYS QB . . 3.480 2.603 2.216 3.033 . 0 0 "[ . 1 . 2]" 1
2212 1 25 LEU MD1 1 64 LYS QE . . 3.900 3.397 1.949 3.882 . 0 0 "[ . 1 . 2]" 1
2213 1 29 GLU H 1 29 GLU QG . . 4.020 3.699 3.517 4.064 0.044 17 0 "[ . 1 . 2]" 1
2214 1 29 GLU QG 1 30 PRO HD2 . . 3.670 2.647 2.300 3.359 . 0 0 "[ . 1 . 2]" 1
2215 1 29 GLU QG 1 30 PRO HD3 . . 4.170 3.368 3.138 4.129 . 0 0 "[ . 1 . 2]" 1
2216 1 29 GLU QG 1 61 LEU MD1 . . 4.770 3.059 2.082 4.121 . 0 0 "[ . 1 . 2]" 1
2217 1 30 PRO QB 1 31 PRO HD2 . . 3.680 3.002 2.911 3.095 . 0 0 "[ . 1 . 2]" 1
2218 1 30 PRO QB 1 38 VAL MG1 . . 5.340 4.511 4.141 4.834 . 0 0 "[ . 1 . 2]" 1
2219 1 30 PRO QB 1 38 VAL MG2 . . 4.390 3.852 3.581 4.063 . 0 0 "[ . 1 . 2]" 1
2220 1 30 PRO QB 1 61 LEU MD2 . . 4.540 3.714 3.174 4.402 . 0 0 "[ . 1 . 2]" 1
2221 1 30 PRO QG 1 61 LEU MD1 . . 4.740 3.681 2.938 4.583 . 0 0 "[ . 1 . 2]" 1
2222 1 30 PRO QG 1 61 LEU MD2 . . 3.650 3.407 3.154 3.705 0.055 1 0 "[ . 1 . 2]" 1
2223 1 34 ALA MB 1 35 ASN QB . . 4.920 4.218 3.997 4.571 . 0 0 "[ . 1 . 2]" 1
2224 1 35 ASN QB 1 35 ASN QD . . 3.060 2.148 2.067 2.222 . 0 0 "[ . 1 . 2]" 1
2225 1 35 ASN QB 1 36 GLY H . . 4.170 3.946 3.619 4.041 . 0 0 "[ . 1 . 2]" 1
2226 1 35 ASN QB 1 84 TYR QE . . 4.210 3.221 2.392 3.799 . 0 0 "[ . 1 . 2]" 1
2227 1 36 GLY H 1 37 PRO QD . . 4.550 4.364 4.334 4.377 . 0 0 "[ . 1 . 2]" 1
2228 1 36 GLY QA 1 37 PRO QG . . 3.990 3.664 3.655 3.680 . 0 0 "[ . 1 . 2]" 1
2229 1 36 GLY QA 1 37 PRO QD . . 2.820 1.926 1.895 1.979 . 0 0 "[ . 1 . 2]" 1
2230 1 36 GLY QA 1 84 TYR QE . . 4.140 3.186 2.676 3.406 . 0 0 "[ . 1 . 2]" 1
2231 1 37 PRO QD 1 84 TYR QE . . 4.950 3.983 3.397 4.422 . 0 0 "[ . 1 . 2]" 1
2232 1 38 VAL MG1 1 39 GLN QB . . 5.090 3.968 3.857 4.073 . 0 0 "[ . 1 . 2]" 1
2233 1 39 GLN H 1 39 GLN QB . . 3.230 2.434 2.317 2.527 . 0 0 "[ . 1 . 2]" 1
2234 1 39 GLN QB 1 39 GLN QE . . 4.050 3.354 2.238 3.727 . 0 0 "[ . 1 . 2]" 1
2235 1 39 GLN QB 1 40 GLY HA3 . . 5.340 3.855 3.819 3.895 . 0 0 "[ . 1 . 2]" 1
2236 1 39 GLN QB 1 81 TYR QD . . 3.720 2.599 2.197 2.864 . 0 0 "[ . 1 . 2]" 1
2237 1 39 GLN QB 1 82 ASN HA . . 3.540 2.391 2.118 2.565 . 0 0 "[ . 1 . 2]" 1
2238 1 39 GLN QB 1 83 ARG H . . 5.340 3.987 3.759 4.292 . 0 0 "[ . 1 . 2]" 1
2239 1 39 GLN QE 1 39 GLN QG . . 3.100 2.148 2.067 2.446 . 0 0 "[ . 1 . 2]" 1
2240 1 39 GLN QG 1 83 ARG QG . . 5.340 4.311 3.839 5.316 . 0 0 "[ . 1 . 2]" 1
2241 1 39 GLN QE 1 83 ARG HA . . 4.180 2.836 2.179 3.899 . 0 0 "[ . 1 . 2]" 1
2242 1 39 GLN QE 1 83 ARG QB . . 4.050 3.049 2.353 3.953 . 0 0 "[ . 1 . 2]" 1
2243 1 40 GLY HA3 1 59 ASP QB . . 5.340 5.110 4.125 5.350 0.010 19 0 "[ . 1 . 2]" 1
2244 1 42 ARG H 1 42 ARG QD . . 4.820 4.418 3.808 4.773 . 0 0 "[ . 1 . 2]" 1
2245 1 42 ARG QD 1 44 PHE QE . . 4.000 3.035 1.988 3.903 . 0 0 "[ . 1 . 2]" 1
2246 1 42 ARG QD 1 57 GLU HG3 . . 5.340 4.730 4.219 5.157 . 0 0 "[ . 1 . 2]" 1
2247 1 42 ARG QD 1 86 PRO QB . . 4.390 3.863 3.063 4.378 . 0 0 "[ . 1 . 2]" 1
2248 1 44 PHE HB2 1 77 ARG QG . . 4.310 4.039 3.563 4.321 0.011 9 0 "[ . 1 . 2]" 1
2249 1 44 PHE HB3 1 53 GLU QG . . 4.290 2.640 2.275 3.073 . 0 0 "[ . 1 . 2]" 1
2250 1 44 PHE HB3 1 55 ASN QD . . 5.340 4.952 3.510 5.350 0.010 12 0 "[ . 1 . 2]" 1
2251 1 44 PHE QD 1 55 ASN QD . . 4.860 3.118 1.883 3.837 . 0 0 "[ . 1 . 2]" 1
2252 1 44 PHE QD 1 77 ARG QG . . 4.210 2.966 2.087 3.555 . 0 0 "[ . 1 . 2]" 1
2253 1 44 PHE QE 1 55 ASN QD . . 4.080 3.219 1.889 4.095 0.015 11 0 "[ . 1 . 2]" 1
2254 1 46 THR HA 1 53 GLU QB . . 5.150 3.584 3.357 3.844 . 0 0 "[ . 1 . 2]" 1
2255 1 46 THR HA 1 53 GLU QG . . 4.510 3.705 3.372 3.968 . 0 0 "[ . 1 . 2]" 1
2256 1 46 THR MG 1 53 GLU QB . . 4.360 2.487 2.152 2.793 . 0 0 "[ . 1 . 2]" 1
2257 1 46 THR MG 1 53 GLU QG . . 4.060 3.745 3.543 3.963 . 0 0 "[ . 1 . 2]" 1
2258 1 47 GLU H 1 47 GLU QG . . 4.120 4.004 3.959 4.050 . 0 0 "[ . 1 . 2]" 1
2259 1 47 GLU H 1 52 LYS QB . . 5.340 3.947 3.572 4.751 . 0 0 "[ . 1 . 2]" 1
2260 1 47 GLU HA 1 47 GLU QG . . 3.180 2.429 2.283 2.955 . 0 0 "[ . 1 . 2]" 1
2261 1 47 GLU HA 1 48 VAL QG . . 3.620 3.628 3.524 3.709 0.089 1 0 "[ . 1 . 2]" 1
2262 1 47 GLU QG 1 48 VAL H . . 3.560 3.291 2.925 3.567 0.007 9 0 "[ . 1 . 2]" 1
2263 1 47 GLU QG 1 49 SER H . . 3.700 2.211 1.908 2.564 . 0 0 "[ . 1 . 2]" 1
2264 1 47 GLU QG 1 49 SER QB . . 4.560 2.057 1.930 2.317 . 0 0 "[ . 1 . 2]" 1
2265 1 47 GLU QG 1 50 THR H . . 3.310 2.167 1.875 2.385 . 0 0 "[ . 1 . 2]" 1
2266 1 47 GLU QG 1 50 THR MG . . 4.730 3.497 2.578 3.834 . 0 0 "[ . 1 . 2]" 1
2267 1 47 GLU QG 1 50 THR HG1 . . 4.570 3.923 3.198 4.405 . 0 0 "[ . 1 . 2]" 1
2268 1 47 GLU QG 1 51 GLY H . . 4.100 3.569 3.169 3.792 . 0 0 "[ . 1 . 2]" 1
2269 1 47 GLU QG 1 72 THR MG . . 3.430 2.568 2.319 3.072 . 0 0 "[ . 1 . 2]" 1
2270 1 47 GLU QG 1 74 TYR HA . . 5.340 4.414 4.046 5.096 . 0 0 "[ . 1 . 2]" 1
2271 1 47 GLU QG 1 74 TYR QD . . 4.990 3.501 3.056 4.416 . 0 0 "[ . 1 . 2]" 1
2272 1 47 GLU QG 1 74 TYR QE . . 3.490 2.331 1.994 3.453 . 0 0 "[ . 1 . 2]" 1
2273 1 48 VAL H 1 48 VAL QG . . 2.840 1.936 1.837 2.078 . 0 0 "[ . 1 . 2]" 1
2274 1 48 VAL HA 1 48 VAL QG . . 2.700 2.131 2.095 2.173 . 0 0 "[ . 1 . 2]" 1
2275 1 48 VAL QG 1 49 SER HA . . 3.970 3.571 3.457 3.714 . 0 0 "[ . 1 . 2]" 1
2276 1 48 VAL QG 1 73 GLU H . . 5.220 4.734 4.239 4.949 . 0 0 "[ . 1 . 2]" 1
2277 1 48 VAL QG 1 73 GLU HA . . 4.710 4.549 4.141 4.715 0.005 6 0 "[ . 1 . 2]" 1
2278 1 48 VAL QG 1 73 GLU HG2 . . 3.130 2.375 2.099 2.928 . 0 0 "[ . 1 . 2]" 1
2279 1 48 VAL QG 1 74 TYR H . . 4.770 4.395 4.165 4.528 . 0 0 "[ . 1 . 2]" 1
2280 1 48 VAL QG 1 74 TYR HA . . 3.340 2.872 2.690 3.034 . 0 0 "[ . 1 . 2]" 1
2281 1 48 VAL QG 1 74 TYR HB3 . . 4.870 4.827 4.650 4.883 0.013 18 0 "[ . 1 . 2]" 1
2282 1 48 VAL QG 1 75 SER H . . 3.390 2.860 2.600 3.154 . 0 0 "[ . 1 . 2]" 1
2283 1 48 VAL QG 1 75 SER HA . . 4.260 4.089 3.887 4.233 . 0 0 "[ . 1 . 2]" 1
2284 1 48 VAL QG 1 75 SER QB . . 2.950 2.462 2.194 2.705 . 0 0 "[ . 1 . 2]" 1
2285 1 48 VAL QG 1 94 THR MG . . 3.530 3.413 3.016 3.530 . 0 0 "[ . 1 . 2]" 1
2286 1 50 THR HB 1 52 LYS QB . . 4.660 4.057 3.510 4.434 . 0 0 "[ . 1 . 2]" 1
2287 1 50 THR HB 1 52 LYS QG . . 3.840 3.138 2.723 3.912 0.072 17 0 "[ . 1 . 2]" 1
2288 1 50 THR MG 1 52 LYS QG . . 4.500 4.043 3.745 4.541 0.041 17 0 "[ . 1 . 2]" 1
2289 1 50 THR HG1 1 52 LYS QB . . 3.920 2.729 2.396 3.635 . 0 0 "[ . 1 . 2]" 1
2290 1 50 THR HG1 1 52 LYS QG . . 4.600 2.687 1.956 4.209 . 0 0 "[ . 1 . 2]" 1
2291 1 51 GLY H 1 52 LYS QB . . 5.310 4.055 3.856 4.534 . 0 0 "[ . 1 . 2]" 1
2292 1 52 LYS H 1 52 LYS QB . . 2.850 2.400 2.256 2.740 . 0 0 "[ . 1 . 2]" 1
2293 1 52 LYS H 1 52 LYS QG . . 3.400 2.711 1.971 3.437 0.037 10 0 "[ . 1 . 2]" 1
2294 1 52 LYS HA 1 52 LYS QG . . 3.480 2.483 2.218 3.343 . 0 0 "[ . 1 . 2]" 1
2295 1 52 LYS QB 1 53 GLU H . . 3.490 3.086 2.750 3.307 . 0 0 "[ . 1 . 2]" 1
2296 1 52 LYS QE 1 52 LYS QG . . 3.340 2.181 2.055 2.624 . 0 0 "[ . 1 . 2]" 1
2297 1 52 LYS QG 1 53 GLU H . . 4.120 3.963 3.681 4.121 0.001 4 0 "[ . 1 . 2]" 1
2298 1 53 GLU H 1 53 GLU QB . . 2.880 2.371 2.283 2.448 . 0 0 "[ . 1 . 2]" 1
2299 1 53 GLU H 1 53 GLU QG . . 4.120 4.029 3.932 4.131 0.011 15 0 "[ . 1 . 2]" 1
2300 1 53 GLU HA 1 53 GLU QG . . 3.260 2.492 2.361 2.592 . 0 0 "[ . 1 . 2]" 1
2301 1 53 GLU HA 1 54 GLN QB . . 4.360 4.202 4.113 4.362 0.002 1 0 "[ . 1 . 2]" 1
2302 1 53 GLU QG 1 54 GLN H . . 3.230 2.336 1.952 2.753 . 0 0 "[ . 1 . 2]" 1
2303 1 54 GLN H 1 54 GLN QB . . 3.170 2.977 2.855 3.114 . 0 0 "[ . 1 . 2]" 1
2304 1 54 GLN QB 1 54 GLN HE21 . . 4.160 3.810 3.581 3.899 . 0 0 "[ . 1 . 2]" 1
2305 1 54 GLN QB 1 55 ASN H . . 4.230 3.261 3.027 3.410 . 0 0 "[ . 1 . 2]" 1
2306 1 54 GLN QB 1 55 ASN HA . . 5.340 4.786 4.706 4.895 . 0 0 "[ . 1 . 2]" 1
2307 1 54 GLN QB 1 56 ILE HG13 . . 4.070 3.837 3.647 3.930 . 0 0 "[ . 1 . 2]" 1
2308 1 54 GLN QB 1 56 ILE MD . . 3.880 3.855 3.753 3.890 0.010 5 0 "[ . 1 . 2]" 1
2309 1 55 ASN HA 1 55 ASN QD . . 4.330 3.539 2.739 4.122 . 0 0 "[ . 1 . 2]" 1
2310 1 59 ASP H 1 59 ASP QB . . 3.380 2.892 2.512 3.253 . 0 0 "[ . 1 . 2]" 1
2311 1 59 ASP HA 1 60 GLY QA . . 5.340 3.990 3.911 4.143 . 0 0 "[ . 1 . 2]" 1
2312 1 59 ASP QB 1 60 GLY QA . . 5.180 3.886 3.579 4.251 . 0 0 "[ . 1 . 2]" 1
2313 1 60 GLY QA 1 61 LEU HG . . 4.260 3.515 3.191 4.008 . 0 0 "[ . 1 . 2]" 1
2314 1 60 GLY QA 1 62 SER H . . 3.890 3.357 3.104 3.572 . 0 0 "[ . 1 . 2]" 1
2315 1 64 LYS H 1 64 LYS QB . . 2.870 2.319 2.270 2.368 . 0 0 "[ . 1 . 2]" 1
2316 1 64 LYS QB 1 64 LYS QD . . 3.310 2.144 2.092 2.429 . 0 0 "[ . 1 . 2]" 1
2317 1 64 LYS QB 1 64 LYS QE . . 3.830 3.414 2.427 3.805 . 0 0 "[ . 1 . 2]" 1
2318 1 64 LYS QB 1 66 GLU QG . . 5.180 3.635 3.519 3.884 . 0 0 "[ . 1 . 2]" 1
2319 1 64 LYS QG 1 66 GLU QG . . 3.520 3.101 2.508 3.407 . 0 0 "[ . 1 . 2]" 1
2320 1 64 LYS QD 1 66 GLU QG . . 4.090 3.334 2.770 3.979 . 0 0 "[ . 1 . 2]" 1
2321 1 64 LYS QE 1 66 GLU QG . . 4.760 4.342 3.809 4.773 0.013 7 0 "[ . 1 . 2]" 1
2322 1 65 LEU HB2 1 66 GLU QG . . 5.340 5.221 5.171 5.280 . 0 0 "[ . 1 . 2]" 1
2323 1 66 GLU H 1 66 GLU QG . . 3.430 2.934 2.840 3.103 . 0 0 "[ . 1 . 2]" 1
2324 1 66 GLU HA 1 66 GLU QG . . 3.360 2.549 2.481 2.726 . 0 0 "[ . 1 . 2]" 1
2325 1 66 GLU QG 1 67 GLY H . . 4.340 4.152 4.082 4.348 0.008 10 0 "[ . 1 . 2]" 1
2326 1 69 LYS H 1 69 LYS QE . . 5.340 4.855 4.135 5.290 . 0 0 "[ . 1 . 2]" 1
2327 1 69 LYS HA 1 69 LYS QE . . 5.340 4.462 3.761 4.885 . 0 0 "[ . 1 . 2]" 1
2328 1 69 LYS HB2 1 69 LYS QE . . 4.530 3.411 2.328 4.154 . 0 0 "[ . 1 . 2]" 1
2329 1 69 LYS QE 1 69 LYS HG2 . . 3.590 2.691 2.133 3.451 . 0 0 "[ . 1 . 2]" 1
2330 1 69 LYS QE 1 69 LYS HG3 . . 3.450 2.724 2.171 3.446 . 0 0 "[ . 1 . 2]" 1
2331 1 69 LYS QE 1 72 THR MG . . 4.260 3.397 1.945 4.240 . 0 0 "[ . 1 . 2]" 1
2332 1 69 LYS QE 1 72 THR HG1 . . 5.340 3.991 2.566 5.218 . 0 0 "[ . 1 . 2]" 1
2333 1 70 LYS H 1 70 LYS QB . . 2.780 2.177 2.140 2.256 . 0 0 "[ . 1 . 2]" 1
2334 1 70 LYS H 1 70 LYS QG . . 4.070 3.906 3.800 4.075 0.005 1 0 "[ . 1 . 2]" 1
2335 1 70 LYS H 1 70 LYS QE . . 4.970 4.009 3.477 4.823 . 0 0 "[ . 1 . 2]" 1
2336 1 70 LYS HA 1 70 LYS QG . . 3.670 2.275 2.137 2.637 . 0 0 "[ . 1 . 2]" 1
2337 1 70 LYS HA 1 70 LYS QE . . 5.080 3.480 3.250 4.116 . 0 0 "[ . 1 . 2]" 1
2338 1 70 LYS QB 1 70 LYS QE . . 4.230 2.378 1.957 3.051 . 0 0 "[ . 1 . 2]" 1
2339 1 70 LYS QB 1 71 PHE HA . . 4.860 4.228 4.173 4.362 . 0 0 "[ . 1 . 2]" 1
2340 1 70 LYS QB 1 71 PHE HB2 . . 4.920 3.657 3.554 3.747 . 0 0 "[ . 1 . 2]" 1
2341 1 70 LYS QB 1 71 PHE HB3 . . 4.870 3.722 3.650 4.087 . 0 0 "[ . 1 . 2]" 1
2342 1 70 LYS QB 1 71 PHE QD . . 5.190 5.161 5.103 5.253 0.063 13 0 "[ . 1 . 2]" 1
2343 1 70 LYS QB 1 99 SER HA . . 4.700 4.073 3.927 4.194 . 0 0 "[ . 1 . 2]" 1
2344 1 70 LYS QE 1 70 LYS QG . . 3.110 2.209 2.038 2.690 . 0 0 "[ . 1 . 2]" 1
2345 1 70 LYS QG 1 71 PHE H . . 3.970 3.358 2.862 3.509 . 0 0 "[ . 1 . 2]" 1
2346 1 70 LYS QG 1 71 PHE HB2 . . 4.620 3.339 2.710 3.543 . 0 0 "[ . 1 . 2]" 1
2347 1 70 LYS QG 1 71 PHE HB3 . . 5.200 4.209 3.820 4.446 . 0 0 "[ . 1 . 2]" 1
2348 1 70 LYS QG 1 99 SER HB3 . . 5.340 4.941 4.632 5.089 . 0 0 "[ . 1 . 2]" 1
2349 1 70 LYS QE 1 99 SER HA . . 5.340 5.008 4.500 5.271 . 0 0 "[ . 1 . 2]" 1
2350 1 71 PHE H 1 96 VAL QG . . 5.440 5.448 5.410 5.470 0.030 13 0 "[ . 1 . 2]" 1
2351 1 71 PHE HA 1 96 VAL QG . . 3.570 3.333 3.301 3.359 . 0 0 "[ . 1 . 2]" 1
2352 1 71 PHE HB2 1 96 VAL QG . . 4.750 4.329 4.283 4.487 . 0 0 "[ . 1 . 2]" 1
2353 1 71 PHE HB3 1 96 VAL QG . . 4.620 4.448 4.368 4.472 . 0 0 "[ . 1 . 2]" 1
2354 1 71 PHE QD 1 96 VAL QG . . 3.070 2.899 2.843 2.919 . 0 0 "[ . 1 . 2]" 1
2355 1 71 PHE HZ 1 96 VAL QG . . 4.660 2.337 2.290 2.474 . 0 0 "[ . 1 . 2]" 1
2356 1 72 THR H 1 96 VAL QG . . 3.470 2.958 2.892 2.990 . 0 0 "[ . 1 . 2]" 1
2357 1 72 THR HA 1 73 GLU QB . . 4.360 4.084 4.065 4.095 . 0 0 "[ . 1 . 2]" 1
2358 1 73 GLU HA 1 96 VAL QG . . 3.020 2.076 1.951 2.281 . 0 0 "[ . 1 . 2]" 1
2359 1 73 GLU QB 1 74 TYR H . . 4.340 3.943 3.913 3.977 . 0 0 "[ . 1 . 2]" 1
2360 1 73 GLU HG3 1 96 VAL QG . . 3.770 2.435 2.013 2.733 . 0 0 "[ . 1 . 2]" 1
2361 1 75 SER HA 1 92 ASP QB . . 5.340 4.180 3.890 4.950 . 0 0 "[ . 1 . 2]" 1
2362 1 75 SER QB 1 92 ASP QB . . 4.880 3.250 2.454 3.731 . 0 0 "[ . 1 . 2]" 1
2363 1 76 LEU H 1 92 ASP QB . . 5.010 4.558 4.098 5.032 0.022 4 0 "[ . 1 . 2]" 1
2364 1 77 ARG H 1 77 ARG QG . . 4.310 4.145 4.025 4.234 . 0 0 "[ . 1 . 2]" 1
2365 1 77 ARG QG 1 78 PHE H . . 3.570 2.950 2.572 3.074 . 0 0 "[ . 1 . 2]" 1
2366 1 77 ARG QG 1 89 SER QB . . 3.680 2.540 2.248 3.244 . 0 0 "[ . 1 . 2]" 1
2367 1 77 ARG QG 1 92 ASP H . . 5.010 4.718 4.101 5.043 0.033 6 0 "[ . 1 . 2]" 1
2368 1 77 ARG QG 1 92 ASP HA . . 4.740 3.877 3.402 4.313 . 0 0 "[ . 1 . 2]" 1
2369 1 79 LEU MD1 1 86 PRO QG . . 4.160 3.736 3.511 3.899 . 0 0 "[ . 1 . 2]" 1
2370 1 79 LEU MD2 1 86 PRO QG . . 4.300 4.068 3.767 4.235 . 0 0 "[ . 1 . 2]" 1
2371 1 82 ASN QD 1 84 TYR HA . . 5.340 4.400 3.735 5.361 0.021 12 0 "[ . 1 . 2]" 1
2372 1 82 ASN QD 1 84 TYR QB . . 3.750 2.060 1.795 2.756 . 0 0 "[ . 1 . 2]" 1
2373 1 82 ASN QD 1 84 TYR QD . . 3.580 1.998 1.880 2.306 . 0 0 "[ . 1 . 2]" 1
2374 1 82 ASN QD 1 84 TYR QE . . 5.170 3.882 3.377 4.177 . 0 0 "[ . 1 . 2]" 1
2375 1 83 ARG H 1 83 ARG QG . . 4.690 2.689 2.110 3.968 . 0 0 "[ . 1 . 2]" 1
2376 1 83 ARG QB 1 84 TYR H . . 3.960 3.299 2.682 3.486 . 0 0 "[ . 1 . 2]" 1
2377 1 83 ARG QB 1 84 TYR QD . . 5.340 4.230 3.183 4.885 . 0 0 "[ . 1 . 2]" 1
2378 1 83 ARG QG 1 84 TYR HA . . 4.810 3.289 2.908 3.638 . 0 0 "[ . 1 . 2]" 1
2379 1 83 ARG QG 1 84 TYR QD . . 4.170 2.675 2.106 3.399 . 0 0 "[ . 1 . 2]" 1
2380 1 84 TYR H 1 84 TYR QB . . 3.070 2.563 2.348 2.661 . 0 0 "[ . 1 . 2]" 1
2381 1 84 TYR QB 1 85 GLY H . . 3.440 2.235 2.089 2.564 . 0 0 "[ . 1 . 2]" 1
2382 1 85 GLY QA 1 86 PRO QB . . 5.000 4.274 4.272 4.276 . 0 0 "[ . 1 . 2]" 1
2383 1 85 GLY QA 1 86 PRO QG . . 3.890 3.693 3.685 3.698 . 0 0 "[ . 1 . 2]" 1
2384 1 85 GLY QA 1 86 PRO QD . . 2.630 2.018 1.993 2.032 . 0 0 "[ . 1 . 2]" 1
2385 1 87 GLY HA2 1 88 VAL QG . . 5.010 4.045 3.810 4.837 . 0 0 "[ . 1 . 2]" 1
2386 1 87 GLY HA3 1 88 VAL QG . . 4.880 3.870 3.707 4.155 . 0 0 "[ . 1 . 2]" 1
2387 1 88 VAL H 1 88 VAL QG . . 2.860 2.301 2.014 2.734 . 0 0 "[ . 1 . 2]" 1
2388 1 88 VAL QG 1 89 SER H . . 3.250 2.193 1.905 2.620 . 0 0 "[ . 1 . 2]" 1
2389 1 88 VAL QG 1 89 SER QB . . 4.430 4.027 3.733 4.363 . 0 0 "[ . 1 . 2]" 1
2390 1 88 VAL QG 1 90 THR H . . 5.210 4.487 3.442 4.820 . 0 0 "[ . 1 . 2]" 1
2391 1 90 THR MG 1 91 ASP QB . . 5.340 5.239 4.996 5.347 0.007 18 0 "[ . 1 . 2]" 1
2392 1 91 ASP H 1 91 ASP QB . . 3.010 2.382 2.116 2.561 . 0 0 "[ . 1 . 2]" 1
2393 1 91 ASP QB 1 92 ASP H . . 3.250 3.029 2.844 3.323 0.073 9 0 "[ . 1 . 2]" 1
2394 1 92 ASP H 1 92 ASP QB . . 2.960 2.530 2.139 2.761 . 0 0 "[ . 1 . 2]" 1
2395 1 92 ASP QB 1 93 ILE H . . 3.690 3.468 3.346 3.702 0.012 4 0 "[ . 1 . 2]" 1
2396 1 92 ASP QB 1 94 THR H . . 5.100 4.560 4.336 4.959 . 0 0 "[ . 1 . 2]" 1
2397 1 94 THR MG 1 96 VAL QG . . 3.180 2.894 2.770 3.155 . 0 0 "[ . 1 . 2]" 1
2398 1 96 VAL H 1 96 VAL QG . . 2.740 2.282 2.122 2.384 . 0 0 "[ . 1 . 2]" 1
2399 1 96 VAL HA 1 96 VAL QG . . 2.820 2.051 2.035 2.069 . 0 0 "[ . 1 . 2]" 1
2400 1 96 VAL QG 1 97 THR H . . 3.070 2.775 2.623 2.997 . 0 0 "[ . 1 . 2]" 1
2401 1 96 VAL QG 1 97 THR HA . . 4.730 4.270 4.214 4.338 . 0 0 "[ . 1 . 2]" 1
2402 1 96 VAL QG 1 97 THR MG . . 4.480 4.308 4.266 4.379 . 0 0 "[ . 1 . 2]" 1
2403 1 96 VAL QG 1 97 THR HG1 . . 4.720 4.357 4.299 4.432 . 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 4
_Distance_constraint_stats_list.Viol_count 11
_Distance_constraint_stats_list.Viol_total 0.736
_Distance_constraint_stats_list.Viol_max 0.018
_Distance_constraint_stats_list.Viol_rms 0.0022
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0033
_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 33 TYR 0.000 0.000 14 0 "[ . 1 . 2]"
1 34 ALA 0.000 0.000 14 0 "[ . 1 . 2]"
1 35 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 VAL 0.019 0.005 15 0 "[ . 1 . 2]"
1 39 GLN 0.019 0.005 15 0 "[ . 1 . 2]"
1 91 ASP 0.018 0.018 9 0 "[ . 1 . 2]"
1 92 ASP 0.018 0.018 9 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 91 ASP HA 1 92 ASP H . . 2.300 2.199 2.152 2.318 0.018 9 0 "[ . 1 . 2]" 2
2 1 35 ASN HA 1 36 GLY H . . 2.400 2.235 2.171 2.347 . 0 0 "[ . 1 . 2]" 2
3 1 38 VAL H 1 39 GLN H . . 3.800 3.791 3.750 3.805 0.005 15 0 "[ . 1 . 2]" 2
4 1 33 TYR HA 1 34 ALA H . . 2.800 2.644 2.466 2.800 . 14 0 "[ . 1 . 2]" 2
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