NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
617547 |
5ghd   |
36008 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5ghd
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 2053
_Distance_constraint_stats_list.Viol_count 4193
_Distance_constraint_stats_list.Viol_total 5786.184
_Distance_constraint_stats_list.Viol_max 0.490
_Distance_constraint_stats_list.Viol_rms 0.0301
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0070
_Distance_constraint_stats_list.Viol_average_violations_only 0.0690
_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 15 MET 1.725 0.479 13 0 "[ . 1 . 2]"
1 16 SER 2.163 0.479 13 0 "[ . 1 . 2]"
1 17 ASP 0.673 0.205 6 0 "[ . 1 . 2]"
1 18 GLN 2.320 0.434 4 0 "[ . 1 . 2]"
1 19 GLU 3.478 0.434 4 0 "[ . 1 . 2]"
1 20 ALA 2.678 0.304 13 0 "[ . 1 . 2]"
1 21 LYS 3.842 0.304 13 0 "[ . 1 . 2]"
1 22 PRO 3.636 0.316 2 0 "[ . 1 . 2]"
1 23 SER 3.068 0.316 2 0 "[ . 1 . 2]"
1 24 THR 4.228 0.392 14 0 "[ . 1 . 2]"
1 25 GLU 4.548 0.487 2 0 "[ . 1 . 2]"
1 26 ASP 2.746 0.488 10 0 "[ . 1 . 2]"
1 27 LEU 8.248 0.488 10 0 "[ . 1 . 2]"
1 28 GLY 3.352 0.347 2 0 "[ . 1 . 2]"
1 29 ASP 2.930 0.304 2 0 "[ . 1 . 2]"
1 30 LYS 6.016 0.482 13 0 "[ . 1 . 2]"
1 31 LYS 6.857 0.490 17 0 "[ . 1 . 2]"
1 32 GLU 4.897 0.364 14 0 "[ . 1 . 2]"
1 33 GLY 2.594 0.349 20 0 "[ . 1 . 2]"
1 34 GLU 2.672 0.357 11 0 "[ . 1 . 2]"
1 35 TYR 3.998 0.357 11 0 "[ . 1 . 2]"
1 36 ILE 8.346 0.218 20 0 "[ . 1 . 2]"
1 37 LYS 3.567 0.264 5 0 "[ . 1 . 2]"
1 38 LEU 7.266 0.264 5 0 "[ . 1 . 2]"
1 39 LYS 15.205 0.239 8 0 "[ . 1 . 2]"
1 40 VAL 10.618 0.239 8 0 "[ . 1 . 2]"
1 41 ILE 5.065 0.198 16 0 "[ . 1 . 2]"
1 42 GLY 1.660 0.126 19 0 "[ . 1 . 2]"
1 43 GLN 5.139 0.126 19 0 "[ . 1 . 2]"
1 44 ASP 2.607 0.198 12 0 "[ . 1 . 2]"
1 45 SER 0.451 0.112 3 0 "[ . 1 . 2]"
1 46 SER 1.728 0.198 12 0 "[ . 1 . 2]"
1 47 GLU 3.779 0.203 6 0 "[ . 1 . 2]"
1 48 ILE 3.016 0.107 13 0 "[ . 1 . 2]"
1 49 HIS 6.416 0.225 5 0 "[ . 1 . 2]"
1 50 PHE 3.808 0.137 1 0 "[ . 1 . 2]"
1 51 LYS 6.414 0.461 13 0 "[ . 1 . 2]"
1 52 VAL 12.570 0.461 13 0 "[ . 1 . 2]"
1 54 MET 5.884 0.166 4 0 "[ . 1 . 2]"
1 55 THR 6.163 0.224 14 0 "[ . 1 . 2]"
1 56 THR 3.302 0.181 20 0 "[ . 1 . 2]"
1 57 HIS 2.544 0.288 1 0 "[ . 1 . 2]"
1 58 LEU 4.126 0.288 1 0 "[ . 1 . 2]"
1 59 LYS 12.811 0.422 14 0 "[ . 1 . 2]"
1 60 LYS 5.170 0.422 14 0 "[ . 1 . 2]"
1 61 LEU 15.797 0.225 2 0 "[ . 1 . 2]"
1 62 LYS 6.557 0.313 20 0 "[ . 1 . 2]"
1 63 GLU 2.826 0.377 6 0 "[ . 1 . 2]"
1 64 SER 0.932 0.112 1 0 "[ . 1 . 2]"
1 65 TYR 9.502 0.237 4 0 "[ . 1 . 2]"
1 66 CYS 4.314 0.247 8 0 "[ . 1 . 2]"
1 67 GLN 3.288 0.247 8 0 "[ . 1 . 2]"
1 68 ARG 2.899 0.170 19 0 "[ . 1 . 2]"
1 69 GLN 8.836 0.237 4 0 "[ . 1 . 2]"
1 70 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 VAL 10.197 0.338 18 0 "[ . 1 . 2]"
1 72 PRO 8.563 0.338 18 0 "[ . 1 . 2]"
1 73 MET 8.094 0.192 13 0 "[ . 1 . 2]"
1 74 ASN 7.309 0.445 16 0 "[ . 1 . 2]"
1 75 SER 5.527 0.445 16 0 "[ . 1 . 2]"
1 76 LEU 24.481 0.333 15 0 "[ . 1 . 2]"
1 77 ARG 8.011 0.333 15 0 "[ . 1 . 2]"
1 78 PHE 5.703 0.272 11 0 "[ . 1 . 2]"
1 79 LEU 6.894 0.259 12 0 "[ . 1 . 2]"
1 80 PHE 12.588 0.248 12 0 "[ . 1 . 2]"
1 81 GLU 4.062 0.136 7 0 "[ . 1 . 2]"
1 82 GLY 4.984 0.232 4 0 "[ . 1 . 2]"
1 83 GLN 18.770 0.289 4 0 "[ . 1 . 2]"
1 84 ARG 4.380 0.289 4 0 "[ . 1 . 2]"
1 85 ILE 5.039 0.254 6 0 "[ . 1 . 2]"
1 86 ALA 3.781 0.228 6 0 "[ . 1 . 2]"
1 87 ASP 4.348 0.289 2 0 "[ . 1 . 2]"
1 88 ASN 1.503 0.196 11 0 "[ . 1 . 2]"
1 89 HIS 10.332 0.228 6 0 "[ . 1 . 2]"
1 90 THR 12.691 0.285 10 0 "[ . 1 . 2]"
1 91 PRO 2.672 0.216 19 0 "[ . 1 . 2]"
1 92 LYS 13.983 0.365 1 0 "[ . 1 . 2]"
1 93 GLU 13.986 0.365 1 0 "[ . 1 . 2]"
1 94 LEU 18.703 0.408 19 0 "[ . 1 . 2]"
1 95 GLY 2.052 0.118 4 0 "[ . 1 . 2]"
1 96 MET 7.592 0.408 19 0 "[ . 1 . 2]"
1 97 GLU 0.785 0.176 4 0 "[ . 1 . 2]"
1 98 GLU 3.453 0.218 20 0 "[ . 1 . 2]"
1 99 GLU 1.714 0.154 18 0 "[ . 1 . 2]"
1 100 ASP 1.899 0.113 4 0 "[ . 1 . 2]"
1 101 VAL 2.481 0.169 2 0 "[ . 1 . 2]"
1 102 ILE 6.262 0.188 14 0 "[ . 1 . 2]"
1 103 GLU 3.986 0.156 8 0 "[ . 1 . 2]"
1 104 VAL 9.091 0.259 12 0 "[ . 1 . 2]"
1 105 TYR 6.602 0.158 3 0 "[ . 1 . 2]"
1 106 GLN 8.263 0.193 2 0 "[ . 1 . 2]"
1 107 GLU 2.402 0.170 3 0 "[ . 1 . 2]"
1 108 GLN 1.767 0.214 20 0 "[ . 1 . 2]"
1 109 THR 3.196 0.344 17 0 "[ . 1 . 2]"
1 110 GLY 2.243 0.344 17 0 "[ . 1 . 2]"
1 111 GLY 0.014 0.014 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 77 ARG H 1 104 VAL QG 3.900 . 3.900 3.214 3.080 3.382 . 0 0 "[ . 1 . 2]" 1
2 1 104 VAL QG 1 106 GLN H 4.910 . 4.910 4.157 3.921 4.291 . 0 0 "[ . 1 . 2]" 1
3 1 104 VAL QG 1 105 TYR H 3.420 . 3.420 2.483 2.373 2.641 . 0 0 "[ . 1 . 2]" 1
4 1 104 VAL H 1 104 VAL QG . . 3.310 3.028 2.962 3.074 . 0 0 "[ . 1 . 2]" 1
5 1 78 PHE QE 1 104 VAL QG . . 4.440 3.897 3.682 3.988 . 0 0 "[ . 1 . 2]" 1
6 1 104 VAL HA 1 104 VAL QG 3.220 . 3.220 2.118 2.109 2.126 . 0 0 "[ . 1 . 2]" 1
7 1 104 VAL QG 1 105 TYR HA 3.890 . 3.890 3.348 3.262 3.424 . 0 0 "[ . 1 . 2]" 1
8 1 42 GLY QA 1 104 VAL QG 4.090 . 4.090 2.963 2.861 3.089 . 0 0 "[ . 1 . 2]" 1
9 1 104 VAL QG 1 106 GLN HB3 4.040 . 4.040 3.348 3.117 3.746 . 0 0 "[ . 1 . 2]" 1
10 1 61 LEU MD2 1 65 TYR QD 4.480 . 4.480 4.490 4.379 4.582 0.102 2 0 "[ . 1 . 2]" 1
11 1 61 LEU MD2 1 65 TYR HB2 4.000 . 4.000 3.426 3.130 3.746 . 0 0 "[ . 1 . 2]" 1
12 1 50 PHE HB2 1 61 LEU MD2 4.320 . 4.320 3.528 3.368 3.622 . 0 0 "[ . 1 . 2]" 1
13 1 93 GLU H 1 94 LEU MD2 5.440 . 5.440 5.341 5.241 5.448 0.008 20 0 "[ . 1 . 2]" 1
14 1 94 LEU MD2 1 95 GLY H 5.020 . 5.020 4.818 4.760 4.864 . 0 0 "[ . 1 . 2]" 1
15 1 85 ILE HA 1 94 LEU MD2 4.300 . 4.300 3.490 3.223 3.630 . 0 0 "[ . 1 . 2]" 1
16 1 89 HIS HB3 1 94 LEU MD2 4.090 . 4.090 3.038 2.851 3.306 . 0 0 "[ . 1 . 2]" 1
17 1 94 LEU MD2 1 96 MET ME 4.220 . 4.220 4.224 3.844 4.330 0.110 7 0 "[ . 1 . 2]" 1
18 1 50 PHE QD 1 61 LEU HG 4.330 . 4.330 3.177 2.903 3.330 . 0 0 "[ . 1 . 2]" 1
19 1 61 LEU HG 1 64 SER QB 4.640 . 4.640 4.231 3.960 4.417 . 0 0 "[ . 1 . 2]" 1
20 1 40 VAL MG1 1 41 ILE H 3.490 . 3.490 2.591 2.494 2.669 . 0 0 "[ . 1 . 2]" 1
21 1 40 VAL MG1 1 65 TYR QD 4.010 . 4.010 3.842 3.665 4.011 0.001 2 0 "[ . 1 . 2]" 1
22 1 40 VAL MG1 1 65 TYR HE2 4.720 . 4.720 4.576 4.316 4.733 0.013 15 0 "[ . 1 . 2]" 1
23 1 36 ILE MD 1 37 LYS H 4.120 . 4.120 4.110 3.940 4.214 0.094 10 0 "[ . 1 . 2]" 1
24 1 36 ILE MD 1 98 GLU H 4.170 . 4.170 3.513 3.274 3.803 . 0 0 "[ . 1 . 2]" 1
25 1 36 ILE MD 1 38 LEU HA 5.000 . 5.000 4.718 4.594 4.873 . 0 0 "[ . 1 . 2]" 1
26 1 36 ILE MD 1 98 GLU HA 3.780 . 3.780 2.664 2.266 3.099 . 0 0 "[ . 1 . 2]" 1
27 1 36 ILE MD 1 91 PRO QB 3.430 . 3.430 2.141 1.943 2.413 . 0 0 "[ . 1 . 2]" 1
28 1 36 ILE HB 1 36 ILE MD 3.230 . 3.230 2.397 2.362 2.429 . 0 0 "[ . 1 . 2]" 1
29 1 36 ILE MD 1 36 ILE MG 2.810 . 2.810 1.907 1.855 1.961 . 0 0 "[ . 1 . 2]" 1
30 1 36 ILE MD 1 38 LEU QD 3.070 . 3.070 2.046 1.909 2.323 . 0 0 "[ . 1 . 2]" 1
31 1 90 THR HA 1 94 LEU MD1 4.230 . 4.230 4.107 3.993 4.224 . 0 0 "[ . 1 . 2]" 1
32 1 89 HIS HA 1 94 LEU MD1 4.870 . 4.870 4.334 4.287 4.416 . 0 0 "[ . 1 . 2]" 1
33 1 89 HIS HB2 1 94 LEU MD1 4.330 . 4.330 3.616 3.424 3.798 . 0 0 "[ . 1 . 2]" 1
34 1 79 LEU H 1 79 LEU MD2 4.290 . 4.290 3.922 3.554 4.066 . 0 0 "[ . 1 . 2]" 1
35 1 79 LEU MD2 1 105 TYR QD 3.920 . 3.920 2.737 2.220 3.266 . 0 0 "[ . 1 . 2]" 1
36 1 79 LEU HB2 1 79 LEU MD2 3.200 . 3.200 2.458 2.401 2.647 . 0 0 "[ . 1 . 2]" 1
37 1 79 LEU HB3 1 79 LEU MD2 3.360 . 3.360 2.249 2.139 2.294 . 0 0 "[ . 1 . 2]" 1
38 1 38 LEU HG 1 52 VAL H 5.320 . 5.320 4.789 4.508 5.174 . 0 0 "[ . 1 . 2]" 1
39 1 38 LEU HG 1 39 LYS H 5.070 . 5.070 4.871 4.812 4.925 . 0 0 "[ . 1 . 2]" 1
40 1 38 LEU HG 1 52 VAL HB 5.130 . 5.130 5.190 5.094 5.268 0.138 15 0 "[ . 1 . 2]" 1
41 1 38 LEU HG 1 91 PRO QB 5.420 . 5.420 3.814 3.657 4.068 . 0 0 "[ . 1 . 2]" 1
42 1 58 LEU HG 1 61 LEU MD1 4.870 . 4.870 4.939 4.879 5.028 0.158 1 0 "[ . 1 . 2]" 1
43 1 80 PHE HA 1 102 ILE MD 5.350 . 5.350 5.182 4.877 5.375 0.025 8 0 "[ . 1 . 2]" 1
44 1 40 VAL HA 1 102 ILE MD 4.150 . 4.150 3.833 3.698 3.985 . 0 0 "[ . 1 . 2]" 1
45 1 102 ILE HA 1 102 ILE MD 3.710 . 3.710 2.712 2.642 2.783 . 0 0 "[ . 1 . 2]" 1
46 1 80 PHE HB2 1 102 ILE MD 4.530 . 4.530 3.642 3.507 3.729 . 0 0 "[ . 1 . 2]" 1
47 1 100 ASP HB3 1 102 ILE MD 4.750 . 4.750 3.293 3.014 3.556 . 0 0 "[ . 1 . 2]" 1
48 1 38 LEU HB3 1 102 ILE MD 3.260 . 3.260 2.809 2.461 2.991 . 0 0 "[ . 1 . 2]" 1
49 1 101 VAL QG 1 102 ILE MD 4.040 . 4.040 3.959 3.861 3.992 . 0 0 "[ . 1 . 2]" 1
50 1 102 ILE MD 1 104 VAL QG 5.650 . 5.650 5.291 5.145 5.410 . 0 0 "[ . 1 . 2]" 1
51 1 40 VAL H 1 48 ILE MG 5.140 . 5.140 4.866 4.821 4.906 . 0 0 "[ . 1 . 2]" 1
52 1 48 ILE MG 1 49 HIS H 3.690 . 3.690 3.728 3.700 3.751 0.061 3 0 "[ . 1 . 2]" 1
53 1 48 ILE MG 1 50 PHE HE2 3.500 . 3.500 2.835 2.663 2.963 . 0 0 "[ . 1 . 2]" 1
54 1 48 ILE MG 1 49 HIS HA 5.690 . 5.690 5.496 5.475 5.513 . 0 0 "[ . 1 . 2]" 1
55 1 40 VAL HB 1 48 ILE MG 4.670 . 4.670 4.314 4.247 4.412 . 0 0 "[ . 1 . 2]" 1
56 1 74 ASN H 1 76 LEU QD 3.980 . 3.980 4.013 3.939 4.092 0.112 16 0 "[ . 1 . 2]" 1
57 1 75 SER H 1 76 LEU QD 4.710 . 4.710 3.367 3.178 3.486 . 0 0 "[ . 1 . 2]" 1
58 1 65 TYR QD 1 76 LEU QD 4.260 . 4.260 3.407 3.112 3.726 . 0 0 "[ . 1 . 2]" 1
59 1 73 MET HA 1 76 LEU QD 4.100 . 4.100 1.765 1.734 1.800 0.066 20 0 "[ . 1 . 2]" 1
60 1 76 LEU QD 1 106 GLN HA 3.630 . 3.630 3.626 3.526 3.690 0.060 17 0 "[ . 1 . 2]" 1
61 1 76 LEU QD 1 106 GLN HB2 4.790 . 4.790 4.240 4.003 4.634 . 0 0 "[ . 1 . 2]" 1
62 1 79 LEU H 1 79 LEU MD1 4.290 . 4.290 2.611 2.304 3.336 . 0 0 "[ . 1 . 2]" 1
63 1 79 LEU MD1 1 80 PHE H 4.550 . 4.550 3.667 3.452 3.815 . 0 0 "[ . 1 . 2]" 1
64 1 79 LEU MD1 1 105 TYR QE 3.780 . 3.780 1.997 1.864 2.306 . 0 0 "[ . 1 . 2]" 1
65 1 79 LEU HA 1 79 LEU MD1 4.170 . 4.170 3.595 3.554 3.719 . 0 0 "[ . 1 . 2]" 1
66 1 79 LEU HB2 1 79 LEU MD1 3.200 . 3.200 2.332 2.211 2.373 . 0 0 "[ . 1 . 2]" 1
67 1 79 LEU HB3 1 79 LEU MD1 3.360 . 3.360 3.186 3.121 3.212 . 0 0 "[ . 1 . 2]" 1
68 1 79 LEU H 1 85 ILE MD 4.470 . 4.470 4.489 4.266 4.564 0.094 7 0 "[ . 1 . 2]" 1
69 1 85 ILE H 1 85 ILE MD 3.560 . 3.560 2.882 2.830 2.931 . 0 0 "[ . 1 . 2]" 1
70 1 78 PHE HA 1 85 ILE MD 5.660 . 5.660 5.338 5.244 5.480 . 0 0 "[ . 1 . 2]" 1
71 1 85 ILE HA 1 85 ILE MD 3.940 . 3.940 2.229 2.097 2.293 . 0 0 "[ . 1 . 2]" 1
72 1 85 ILE HB 1 85 ILE MD 3.320 . 3.320 3.248 3.239 3.251 . 0 0 "[ . 1 . 2]" 1
73 1 52 VAL MG2 1 56 THR H 5.250 . 5.250 4.530 4.172 4.888 . 0 0 "[ . 1 . 2]" 1
74 1 50 PHE HB3 1 52 VAL MG2 5.350 . 5.350 5.039 4.854 5.245 . 0 0 "[ . 1 . 2]" 1
75 1 52 VAL MG2 1 56 THR MG 4.140 . 4.140 3.760 3.530 3.992 . 0 0 "[ . 1 . 2]" 1
76 1 71 VAL MG2 1 72 PRO QD 3.790 . 3.790 3.799 3.541 3.949 0.159 12 0 "[ . 1 . 2]" 1
77 1 48 ILE H 1 48 ILE MD 3.990 . 3.990 3.851 3.718 3.930 . 0 0 "[ . 1 . 2]" 1
78 1 47 GLU HA 1 48 ILE MD 5.170 . 5.170 4.860 4.724 4.969 . 0 0 "[ . 1 . 2]" 1
79 1 48 ILE HA 1 48 ILE MD 4.260 . 4.260 4.191 4.175 4.199 . 0 0 "[ . 1 . 2]" 1
80 1 48 ILE HB 1 48 ILE MD 3.070 . 3.070 2.493 2.474 2.515 . 0 0 "[ . 1 . 2]" 1
81 1 86 ALA H 1 86 ALA MB 3.040 . 3.040 2.205 2.186 2.228 . 0 0 "[ . 1 . 2]" 1
82 1 58 LEU H 1 85 ILE MG 4.460 . 4.460 3.747 3.561 3.971 . 0 0 "[ . 1 . 2]" 1
83 1 85 ILE MG 1 90 THR HA 5.000 . 5.000 4.647 4.427 4.789 . 0 0 "[ . 1 . 2]" 1
84 1 62 LYS QE 1 85 ILE MG 3.490 . 3.490 3.005 2.388 3.534 0.044 19 0 "[ . 1 . 2]" 1
85 1 85 ILE MG 1 94 LEU MD2 3.790 . 3.790 3.611 3.437 3.742 . 0 0 "[ . 1 . 2]" 1
86 1 36 ILE MG 1 37 LYS H 4.270 . 4.270 4.198 4.115 4.238 . 0 0 "[ . 1 . 2]" 1
87 1 36 ILE MG 1 37 LYS HA 4.690 . 4.690 4.624 4.456 4.765 0.075 20 0 "[ . 1 . 2]" 1
88 1 41 ILE H 1 41 ILE MD 4.810 . 4.810 4.724 4.695 4.773 . 0 0 "[ . 1 . 2]" 1
89 1 41 ILE HA 1 41 ILE MD 3.800 . 3.800 3.798 3.778 3.830 0.030 4 0 "[ . 1 . 2]" 1
90 1 39 LYS QE 1 41 ILE MD 3.700 . 3.700 2.527 2.091 3.735 0.035 4 0 "[ . 1 . 2]" 1
91 1 71 VAL H 1 71 VAL MG1 3.820 . 3.820 3.321 3.076 3.851 0.031 5 0 "[ . 1 . 2]" 1
92 1 51 LYS HA 1 52 VAL MG1 4.190 . 4.190 3.665 3.359 3.858 . 0 0 "[ . 1 . 2]" 1
93 1 71 VAL MG1 1 72 PRO QD 3.790 . 3.790 2.401 1.994 2.725 . 0 0 "[ . 1 . 2]" 1
94 1 36 ILE H 1 36 ILE HG12 4.610 . 4.610 4.098 3.988 4.204 . 0 0 "[ . 1 . 2]" 1
95 1 36 ILE HG12 1 52 VAL H 4.700 . 4.700 4.220 4.014 4.416 . 0 0 "[ . 1 . 2]" 1
96 1 76 LEU HG 1 106 GLN HB3 4.540 . 4.540 3.963 3.522 4.271 . 0 0 "[ . 1 . 2]" 1
97 1 40 VAL H 1 40 VAL MG2 3.070 . 3.070 2.596 2.536 2.665 . 0 0 "[ . 1 . 2]" 1
98 1 51 LYS H 1 52 VAL MG1 4.460 . 4.460 3.959 3.697 4.170 . 0 0 "[ . 1 . 2]" 1
99 1 50 PHE HB3 1 52 VAL MG1 3.920 . 3.920 3.086 2.793 3.348 . 0 0 "[ . 1 . 2]" 1
100 1 40 VAL MG2 1 102 ILE HB 3.140 . 3.140 2.310 2.082 2.557 . 0 0 "[ . 1 . 2]" 1
101 1 80 PHE QD 1 102 ILE QG 4.220 . 4.220 3.270 2.819 3.556 . 0 0 "[ . 1 . 2]" 1
102 1 76 LEU HG 1 78 PHE QD 4.660 . 4.660 4.359 4.286 4.540 . 0 0 "[ . 1 . 2]" 1
103 1 73 MET HA 1 76 LEU HG 4.500 . 4.500 3.932 3.742 4.119 . 0 0 "[ . 1 . 2]" 1
104 1 66 CYS HA 1 76 LEU HG 5.150 . 5.150 4.210 3.913 4.564 . 0 0 "[ . 1 . 2]" 1
105 1 76 LEU HG 1 104 VAL QG 3.580 . 3.580 3.549 3.506 3.583 0.003 4 0 "[ . 1 . 2]" 1
106 1 102 ILE H 1 102 ILE MG 4.020 . 4.020 3.706 3.656 3.748 . 0 0 "[ . 1 . 2]" 1
107 1 80 PHE HA 1 102 ILE MG 4.110 . 4.110 3.842 3.469 4.121 0.011 4 0 "[ . 1 . 2]" 1
108 1 78 PHE HA 1 102 ILE MG 3.920 . 3.920 3.545 3.356 3.714 . 0 0 "[ . 1 . 2]" 1
109 1 102 ILE HA 1 102 ILE MG 3.370 . 3.370 2.607 2.552 2.671 . 0 0 "[ . 1 . 2]" 1
110 1 78 PHE HB3 1 102 ILE MG 4.060 . 4.060 3.076 2.841 3.338 . 0 0 "[ . 1 . 2]" 1
111 1 80 PHE HB2 1 102 ILE MG 4.310 . 4.310 2.884 2.617 3.198 . 0 0 "[ . 1 . 2]" 1
112 1 80 PHE HB3 1 102 ILE MG 4.560 . 4.560 4.161 3.894 4.501 . 0 0 "[ . 1 . 2]" 1
113 1 102 ILE MD 1 102 ILE MG 3.410 . 3.410 3.250 3.242 3.256 . 0 0 "[ . 1 . 2]" 1
114 1 40 VAL MG1 1 102 ILE MG 3.590 . 3.590 2.709 2.432 2.965 . 0 0 "[ . 1 . 2]" 1
115 1 41 ILE H 1 41 ILE MG 3.780 . 3.780 2.234 2.173 2.297 . 0 0 "[ . 1 . 2]" 1
116 1 41 ILE MG 1 42 GLY QA 4.280 . 4.280 3.601 3.367 3.774 . 0 0 "[ . 1 . 2]" 1
117 1 57 HIS H 1 90 THR MG 5.170 . 5.170 3.470 3.011 3.855 . 0 0 "[ . 1 . 2]" 1
118 1 90 THR HA 1 90 THR MG 3.360 . 3.360 2.429 2.397 2.465 . 0 0 "[ . 1 . 2]" 1
119 1 90 THR MG 1 91 PRO QD 3.690 . 3.690 3.150 3.077 3.230 . 0 0 "[ . 1 . 2]" 1
120 1 90 THR MG 1 93 GLU HB2 3.890 . 3.890 3.198 3.087 3.426 . 0 0 "[ . 1 . 2]" 1
121 1 90 THR MG 1 94 LEU MD1 5.110 . 5.110 5.105 5.042 5.145 0.035 17 0 "[ . 1 . 2]" 1
122 1 41 ILE QG 1 101 VAL HB 5.370 . 5.370 5.260 5.111 5.431 0.061 20 0 "[ . 1 . 2]" 1
123 1 39 LYS QD 1 41 ILE QG 4.050 . 4.050 3.952 3.452 4.180 0.130 7 0 "[ . 1 . 2]" 1
124 1 109 THR MG 1 110 GLY H 4.370 . 4.370 3.936 2.422 4.324 . 0 0 "[ . 1 . 2]" 1
125 1 55 THR HA 1 55 THR MG 2.910 . 2.910 2.268 2.203 2.375 . 0 0 "[ . 1 . 2]" 1
126 1 54 MET HA 1 55 THR MG 4.720 . 4.720 4.468 4.374 4.554 . 0 0 "[ . 1 . 2]" 1
127 1 43 GLN H 1 104 VAL HB 4.910 . 4.910 4.778 4.525 4.954 0.044 15 0 "[ . 1 . 2]" 1
128 1 78 PHE HA 1 104 VAL HB 5.160 . 5.160 4.623 4.523 4.710 . 0 0 "[ . 1 . 2]" 1
129 1 102 ILE MG 1 104 VAL HB 4.300 . 4.300 4.337 4.188 4.444 0.144 6 0 "[ . 1 . 2]" 1
130 1 76 LEU QD 1 104 VAL HB 4.420 . 4.420 4.168 4.108 4.219 . 0 0 "[ . 1 . 2]" 1
131 1 78 PHE H 1 79 LEU HB3 5.370 . 5.370 5.004 4.866 5.134 . 0 0 "[ . 1 . 2]" 1
132 1 91 PRO QB 1 92 LYS QG 5.240 . 5.240 4.936 4.782 5.128 . 0 0 "[ . 1 . 2]" 1
133 1 54 MET ME 1 92 LYS QG 4.310 . 4.310 3.840 3.593 4.151 . 0 0 "[ . 1 . 2]" 1
134 1 20 ALA MB 1 21 LYS HA 4.310 . 4.310 4.138 4.011 4.250 . 0 0 "[ . 1 . 2]" 1
135 1 59 LYS QE 1 59 LYS HG3 3.910 . 3.910 2.843 2.220 3.491 . 0 0 "[ . 1 . 2]" 1
136 1 92 LYS QG 1 93 GLU QG 4.660 . 4.660 4.540 4.164 4.824 0.164 6 0 "[ . 1 . 2]" 1
137 1 62 LYS QD 1 85 ILE MG 4.340 . 4.340 3.479 3.173 3.832 . 0 0 "[ . 1 . 2]" 1
138 1 31 LYS HA 1 31 LYS QG 3.450 . 3.450 2.938 2.371 3.476 0.026 10 0 "[ . 1 . 2]" 1
139 1 19 GLU QB 1 21 LYS QG 5.180 . 5.180 3.989 2.602 5.035 . 0 0 "[ . 1 . 2]" 1
140 1 21 LYS QG 1 22 PRO QG 5.810 . 5.810 4.641 4.161 5.033 . 0 0 "[ . 1 . 2]" 1
141 1 84 ARG QG 1 85 ILE H 4.330 . 4.330 3.987 3.702 4.257 . 0 0 "[ . 1 . 2]" 1
142 1 59 LYS HB3 1 87 ASP QB 4.590 . 4.590 3.724 3.291 4.613 0.023 3 0 "[ . 1 . 2]" 1
143 1 39 LYS H 1 39 LYS QD 4.430 . 4.430 3.909 3.755 4.200 . 0 0 "[ . 1 . 2]" 1
144 1 92 LYS HA 1 92 LYS QD 4.280 . 4.280 4.044 3.655 4.372 0.092 14 0 "[ . 1 . 2]" 1
145 1 92 LYS QD 1 93 GLU HA 4.600 . 4.600 3.849 2.539 4.647 0.047 14 0 "[ . 1 . 2]" 1
146 1 77 ARG QB 1 104 VAL HA 5.350 . 5.350 5.210 5.042 5.399 0.049 7 0 "[ . 1 . 2]" 1
147 1 85 ILE HB 1 94 LEU MD1 5.290 . 5.290 4.697 4.470 4.835 . 0 0 "[ . 1 . 2]" 1
148 1 27 LEU H 1 27 LEU HB2 4.140 . 4.140 3.448 2.174 4.008 . 0 0 "[ . 1 . 2]" 1
149 1 54 MET ME 1 92 LYS HB3 3.820 . 3.820 2.254 2.051 2.814 . 0 0 "[ . 1 . 2]" 1
150 1 31 LYS QD 1 32 GLU H 4.690 . 4.690 3.797 1.743 4.743 0.057 16 0 "[ . 1 . 2]" 1
151 1 21 LYS HA 1 21 LYS QD 4.100 . 4.100 3.445 2.486 3.997 . 0 0 "[ . 1 . 2]" 1
152 1 27 LEU H 1 27 LEU HB3 4.140 . 4.140 2.867 2.250 3.486 . 0 0 "[ . 1 . 2]" 1
153 1 37 LYS HB3 1 52 VAL MG2 5.210 . 5.210 5.033 4.744 5.236 0.026 20 0 "[ . 1 . 2]" 1
154 1 40 VAL MG2 1 62 LYS QB 5.050 . 5.050 4.759 4.591 4.909 . 0 0 "[ . 1 . 2]" 1
155 1 40 VAL HB 1 48 ILE HB 4.410 . 4.410 4.349 4.308 4.393 . 0 0 "[ . 1 . 2]" 1
156 1 79 LEU HB2 1 83 GLN HA 4.680 . 4.680 4.392 4.280 4.534 . 0 0 "[ . 1 . 2]" 1
157 1 24 THR MG 1 25 GLU QB 5.140 . 5.140 4.513 3.171 5.324 0.184 20 0 "[ . 1 . 2]" 1
158 1 38 LEU QD 1 98 GLU HB3 5.350 . 5.350 4.674 4.349 4.978 . 0 0 "[ . 1 . 2]" 1
159 1 54 MET ME 1 92 LYS H 3.690 . 3.690 3.081 2.888 3.248 . 0 0 "[ . 1 . 2]" 1
160 1 96 MET H 1 96 MET ME 4.060 . 4.060 3.610 3.530 3.964 . 0 0 "[ . 1 . 2]" 1
161 1 54 MET HA 1 54 MET ME 3.140 . 3.140 1.786 1.770 1.804 0.030 13 0 "[ . 1 . 2]" 1
162 1 91 PRO QD 1 96 MET ME 3.540 . 3.540 3.408 3.188 3.756 0.216 19 0 "[ . 1 . 2]" 1
163 1 36 ILE MG 1 54 MET ME 3.310 . 3.310 2.286 1.971 2.649 . 0 0 "[ . 1 . 2]" 1
164 1 38 LEU QD 1 96 MET ME 3.700 . 3.700 2.104 1.904 2.919 . 0 0 "[ . 1 . 2]" 1
165 1 36 ILE MD 1 54 MET ME 3.000 . 3.000 2.877 2.439 3.101 0.101 15 0 "[ . 1 . 2]" 1
166 1 19 GLU H 1 19 GLU QB 3.270 . 3.270 2.874 2.522 3.338 0.068 20 0 "[ . 1 . 2]" 1
167 1 48 ILE MD 1 68 ARG QB 6.000 . 6.000 4.943 4.379 5.412 . 0 0 "[ . 1 . 2]" 1
168 1 36 ILE MG 1 98 GLU HB3 4.790 . 4.790 4.416 4.017 4.789 . 0 0 "[ . 1 . 2]" 1
169 1 36 ILE HG12 1 98 GLU HB3 5.060 . 5.060 4.127 3.755 4.398 . 0 0 "[ . 1 . 2]" 1
170 1 15 MET QB 1 16 SER QB 4.110 . 4.110 4.012 3.376 4.589 0.479 13 0 "[ . 1 . 2]" 1
171 1 21 LYS HA 1 22 PRO QG 4.310 . 4.310 3.994 3.870 4.227 . 0 0 "[ . 1 . 2]" 1
172 1 101 VAL H 1 101 VAL HB 3.970 . 3.970 3.900 3.872 3.930 . 0 0 "[ . 1 . 2]" 1
173 1 32 GLU QB 1 33 GLY H 3.440 . 3.440 2.911 1.798 3.789 0.349 20 0 "[ . 1 . 2]" 1
174 1 73 MET H 1 73 MET ME 4.190 . 4.190 3.980 3.426 4.327 0.137 1 0 "[ . 1 . 2]" 1
175 1 73 MET ME 1 74 ASN HB3 3.510 . 3.510 3.434 2.487 3.701 0.191 5 0 "[ . 1 . 2]" 1
176 1 73 MET ME 1 73 MET QG 2.850 . 2.850 2.205 2.170 2.236 . 0 0 "[ . 1 . 2]" 1
177 1 105 TYR HA 1 106 GLN HB3 4.670 . 4.670 4.346 4.201 4.460 . 0 0 "[ . 1 . 2]" 1
178 1 43 GLN HB3 1 105 TYR HB3 4.730 . 4.730 4.602 4.361 4.772 0.042 14 0 "[ . 1 . 2]" 1
179 1 83 GLN H 1 83 GLN HB3 3.860 . 3.860 2.852 2.606 2.990 . 0 0 "[ . 1 . 2]" 1
180 1 103 GLU HA 1 103 GLU HG3 4.030 . 4.030 2.930 2.507 3.096 . 0 0 "[ . 1 . 2]" 1
181 1 54 MET HA 1 91 PRO QB 4.510 . 4.510 3.912 3.518 4.243 . 0 0 "[ . 1 . 2]" 1
182 1 54 MET HA 1 91 PRO QG 3.870 . 3.870 2.803 2.422 3.040 . 0 0 "[ . 1 . 2]" 1
183 1 64 SER HA 1 67 GLN QB 4.040 . 4.040 3.289 2.679 4.111 0.071 7 0 "[ . 1 . 2]" 1
184 1 40 VAL HB 1 50 PHE HE2 4.740 . 4.740 4.779 4.727 4.813 0.073 18 0 "[ . 1 . 2]" 1
185 1 39 LYS HA 1 40 VAL HB 4.640 . 4.640 4.478 4.438 4.522 . 0 0 "[ . 1 . 2]" 1
186 1 32 GLU QG 1 33 GLY H 3.280 . 3.280 2.823 1.750 3.560 0.280 13 0 "[ . 1 . 2]" 1
187 1 19 GLU QG 1 20 ALA H 4.260 . 4.260 3.737 2.953 4.250 . 0 0 "[ . 1 . 2]" 1
188 1 32 GLU HA 1 32 GLU QG 3.480 . 3.480 2.792 2.237 3.501 0.021 5 0 "[ . 1 . 2]" 1
189 1 34 GLU HA 1 34 GLU QG 3.550 . 3.550 2.725 2.259 3.480 . 0 0 "[ . 1 . 2]" 1
190 1 93 GLU HB3 1 93 GLU QG 2.770 . 2.770 2.170 2.150 2.347 . 0 0 "[ . 1 . 2]" 1
191 1 93 GLU H 1 93 GLU QG 4.110 . 4.110 4.023 3.945 4.076 . 0 0 "[ . 1 . 2]" 1
192 1 93 GLU HA 1 93 GLU QG 3.270 . 3.270 2.632 2.253 2.835 . 0 0 "[ . 1 . 2]" 1
193 1 93 GLU QG 1 94 LEU MD2 4.360 . 4.360 4.052 3.805 4.234 . 0 0 "[ . 1 . 2]" 1
194 1 93 GLU QG 1 94 LEU H 4.460 . 4.460 4.083 3.972 4.180 . 0 0 "[ . 1 . 2]" 1
195 1 89 HIS HA 1 93 GLU QG 4.740 . 4.740 3.090 2.637 3.930 . 0 0 "[ . 1 . 2]" 1
196 1 90 THR H 1 93 GLU QG 4.220 . 4.220 3.305 3.054 3.844 . 0 0 "[ . 1 . 2]" 1
197 1 39 LYS QE 1 47 GLU QG 4.800 . 4.800 3.844 3.492 4.938 0.138 5 0 "[ . 1 . 2]" 1
198 1 103 GLU HA 1 103 GLU HG2 4.030 . 4.030 3.762 3.403 3.814 . 0 0 "[ . 1 . 2]" 1
199 1 18 GLN QG 1 19 GLU H 4.030 . 4.030 3.939 3.028 4.464 0.434 4 0 "[ . 1 . 2]" 1
200 1 83 GLN H 1 83 GLN QG 3.430 . 3.430 2.274 2.179 2.605 . 0 0 "[ . 1 . 2]" 1
201 1 80 PHE QD 1 83 GLN QG 4.650 . 4.650 3.523 3.310 4.036 . 0 0 "[ . 1 . 2]" 1
202 1 108 GLN HA 1 108 GLN QG 3.370 . 3.370 2.913 2.355 3.475 0.105 1 0 "[ . 1 . 2]" 1
203 1 82 GLY HA2 1 83 GLN QG 5.420 . 5.420 5.272 5.190 5.505 0.085 14 0 "[ . 1 . 2]" 1
204 1 108 GLN QG 1 109 THR MG 4.840 . 4.840 3.826 1.985 5.002 0.162 11 0 "[ . 1 . 2]" 1
205 1 83 GLN QG 1 85 ILE MG 4.630 . 4.630 4.816 4.676 4.884 0.254 6 0 "[ . 1 . 2]" 1
206 1 98 GLU HB2 1 99 GLU QB 3.700 . 3.700 3.542 3.347 3.731 0.031 6 0 "[ . 1 . 2]" 1
207 1 106 GLN QG 1 107 GLU H 4.510 . 4.510 4.179 3.982 4.391 . 0 0 "[ . 1 . 2]" 1
208 1 43 GLN QG 1 44 ASP H 3.560 . 3.560 2.919 2.720 3.044 . 0 0 "[ . 1 . 2]" 1
209 1 106 GLN HE22 1 106 GLN QG 3.810 . 3.810 3.467 3.451 3.476 . 0 0 "[ . 1 . 2]" 1
210 1 76 LEU HA 1 106 GLN QG 5.280 . 5.280 5.137 5.038 5.199 . 0 0 "[ . 1 . 2]" 1
211 1 43 GLN QG 1 105 TYR HA 4.090 . 4.090 4.073 4.012 4.118 0.028 3 0 "[ . 1 . 2]" 1
212 1 106 GLN HA 1 106 GLN QG 3.510 . 3.510 3.354 3.341 3.375 . 0 0 "[ . 1 . 2]" 1
213 1 106 GLN QG 1 107 GLU HA 4.840 . 4.840 4.361 3.964 4.790 . 0 0 "[ . 1 . 2]" 1
214 1 42 GLY QA 1 43 GLN QG 4.590 . 4.590 4.638 4.518 4.716 0.126 19 0 "[ . 1 . 2]" 1
215 1 43 GLN QG 1 105 TYR HB3 6.000 . 6.000 4.646 4.517 4.753 . 0 0 "[ . 1 . 2]" 1
216 1 105 TYR HB3 1 106 GLN QG 6.000 . 6.000 4.867 4.524 5.136 . 0 0 "[ . 1 . 2]" 1
217 1 43 GLN HB2 1 43 GLN QG 2.520 . 2.520 2.148 2.135 2.156 . 0 0 "[ . 1 . 2]" 1
218 1 104 VAL QG 1 106 GLN QG 4.430 . 4.430 4.129 3.819 4.339 . 0 0 "[ . 1 . 2]" 1
219 1 99 GLU H 1 99 GLU QG 4.550 . 4.550 4.037 3.139 4.555 0.005 9 0 "[ . 1 . 2]" 1
220 1 99 GLU HA 1 99 GLU QG 3.880 . 3.880 2.494 2.225 3.002 . 0 0 "[ . 1 . 2]" 1
221 1 37 LYS QE 1 99 GLU QG 4.300 . 4.300 2.659 1.991 4.186 . 0 0 "[ . 1 . 2]" 1
222 1 59 LYS HA 1 62 LYS QE 4.880 . 4.880 4.852 4.304 5.193 0.313 20 0 "[ . 1 . 2]" 1
223 1 40 VAL MG2 1 62 LYS QE 3.880 . 3.880 2.276 1.933 2.797 . 0 0 "[ . 1 . 2]" 1
224 1 40 VAL MG2 1 50 PHE HB2 5.170 . 5.170 4.464 4.339 4.555 . 0 0 "[ . 1 . 2]" 1
225 1 67 GLN HA 1 67 GLN HG2 4.040 . 4.040 3.104 2.528 3.775 . 0 0 "[ . 1 . 2]" 1
226 1 29 ASP QB 1 30 LYS HA 5.310 . 5.310 4.408 3.871 4.768 . 0 0 "[ . 1 . 2]" 1
227 1 15 MET ME 1 15 MET QG 3.030 . 3.030 2.338 2.225 2.469 . 0 0 "[ . 1 . 2]" 1
228 1 17 ASP QB 1 18 GLN H 3.690 . 3.690 2.648 1.864 3.479 . 0 0 "[ . 1 . 2]" 1
229 1 27 LEU HG 1 29 ASP QB 5.880 . 5.880 4.075 3.108 5.303 . 0 0 "[ . 1 . 2]" 1
230 1 80 PHE HB3 1 83 GLN QG 3.870 . 3.870 3.003 2.807 3.259 . 0 0 "[ . 1 . 2]" 1
231 1 39 LYS H 1 39 LYS QE 5.760 . 5.760 5.542 4.362 5.869 0.109 17 0 "[ . 1 . 2]" 1
232 1 39 LYS H 1 100 ASP HB2 6.000 . 6.000 5.621 5.129 5.959 . 0 0 "[ . 1 . 2]" 1
233 1 37 LYS QE 1 99 GLU HA 4.590 . 4.590 3.206 2.455 3.939 . 0 0 "[ . 1 . 2]" 1
234 1 97 GLU HB2 1 100 ASP HB2 4.100 . 4.100 3.506 3.021 4.213 0.113 4 0 "[ . 1 . 2]" 1
235 1 39 LYS QE 1 41 ILE HB 3.420 . 3.420 2.292 1.776 3.618 0.198 16 0 "[ . 1 . 2]" 1
236 1 92 LYS QE 1 93 GLU HA 3.990 . 3.990 3.228 2.305 4.139 0.149 1 0 "[ . 1 . 2]" 1
237 1 59 LYS HA 1 59 LYS QE 4.790 . 4.790 3.708 2.418 4.579 . 0 0 "[ . 1 . 2]" 1
238 1 59 LYS QE 1 87 ASP QB 3.540 . 3.540 2.836 1.860 3.669 0.129 2 0 "[ . 1 . 2]" 1
239 1 92 LYS QE 1 93 GLU QG 4.010 . 4.010 3.972 3.492 4.375 0.365 1 0 "[ . 1 . 2]" 1
240 1 92 LYS QD 1 92 LYS QE 2.490 . 2.490 2.075 2.017 2.092 . 0 0 "[ . 1 . 2]" 1
241 1 92 LYS QE 1 92 LYS QG 2.810 . 2.810 2.184 2.103 2.273 . 0 0 "[ . 1 . 2]" 1
242 1 59 LYS QE 1 59 LYS HG2 3.910 . 3.910 2.541 2.200 3.459 . 0 0 "[ . 1 . 2]" 1
243 1 78 PHE HB3 1 79 LEU H 4.110 . 4.110 3.798 3.588 3.924 . 0 0 "[ . 1 . 2]" 1
244 1 38 LEU HA 1 100 ASP HB3 4.890 . 4.890 4.576 4.266 4.868 . 0 0 "[ . 1 . 2]" 1
245 1 100 ASP HB3 1 101 VAL HA 5.270 . 5.270 4.281 4.184 4.357 . 0 0 "[ . 1 . 2]" 1
246 1 21 LYS HA 1 21 LYS QE 4.430 . 4.430 4.177 3.772 4.718 0.288 17 0 "[ . 1 . 2]" 1
247 1 31 LYS QB 1 31 LYS QE 4.250 . 4.250 2.469 1.917 3.660 . 0 0 "[ . 1 . 2]" 1
248 1 60 LYS QB 1 60 LYS QE 4.100 . 4.100 2.880 1.866 3.848 . 0 0 "[ . 1 . 2]" 1
249 1 21 LYS QE 1 21 LYS QG 3.420 . 3.420 2.466 2.078 2.836 . 0 0 "[ . 1 . 2]" 1
250 1 21 LYS H 1 21 LYS QE 4.460 . 4.460 3.936 3.011 4.585 0.125 13 0 "[ . 1 . 2]" 1
251 1 76 LEU QD 1 77 ARG QD 4.850 . 4.850 4.995 3.759 5.183 0.333 15 0 "[ . 1 . 2]" 1
252 1 48 ILE QG 1 65 TYR HB2 4.110 . 4.110 3.911 3.724 4.110 0.000 14 0 "[ . 1 . 2]" 1
253 1 62 LYS HA 1 78 PHE QE 5.120 . 5.120 4.805 4.571 5.014 . 0 0 "[ . 1 . 2]" 1
254 1 84 ARG HA 1 84 ARG QD 4.530 . 4.530 4.225 2.842 4.558 0.028 12 0 "[ . 1 . 2]" 1
255 1 59 LYS HA 1 62 LYS QD 4.260 . 4.260 3.213 2.764 3.575 . 0 0 "[ . 1 . 2]" 1
256 1 21 LYS HA 1 22 PRO HD2 2.960 . 2.960 2.378 2.146 2.729 . 0 0 "[ . 1 . 2]" 1
257 1 60 LYS QD 1 61 LEU HA 4.470 . 4.470 3.874 2.515 4.643 0.173 10 0 "[ . 1 . 2]" 1
258 1 42 GLY QA 1 103 GLU HA 4.930 . 4.930 4.018 3.693 4.376 . 0 0 "[ . 1 . 2]" 1
259 1 42 GLY QA 1 104 VAL HA 5.530 . 5.530 4.273 4.141 4.444 . 0 0 "[ . 1 . 2]" 1
260 1 21 LYS HA 1 22 PRO HD3 2.910 . 2.910 2.323 2.055 2.484 . 0 0 "[ . 1 . 2]" 1
261 1 75 SER HB2 1 76 LEU HB3 5.370 . 5.370 4.535 3.482 5.378 0.008 12 0 "[ . 1 . 2]" 1
262 1 59 LYS HB3 1 87 ASP HA 4.180 . 4.180 2.572 1.972 3.331 . 0 0 "[ . 1 . 2]" 1
263 1 59 LYS QD 1 87 ASP HA 4.500 . 4.500 3.370 2.460 3.990 . 0 0 "[ . 1 . 2]" 1
264 1 22 PRO HB2 1 23 SER QB 5.000 . 5.000 3.593 3.354 3.881 . 0 0 "[ . 1 . 2]" 1
265 1 22 PRO HB3 1 23 SER QB 5.000 . 5.000 5.040 4.835 5.297 0.297 4 0 "[ . 1 . 2]" 1
266 1 28 GLY QA 1 29 ASP HA 4.280 . 4.280 4.023 3.862 4.465 0.185 13 0 "[ . 1 . 2]" 1
267 1 28 GLY QA 1 29 ASP QB 4.600 . 4.600 4.197 3.590 4.603 0.003 10 0 "[ . 1 . 2]" 1
268 1 66 CYS HA 1 70 GLY H 5.060 . 5.060 4.279 4.019 4.495 . 0 0 "[ . 1 . 2]" 1
269 1 66 CYS HA 1 69 GLN QB 4.260 . 4.260 2.896 2.692 3.061 . 0 0 "[ . 1 . 2]" 1
270 1 32 GLU HA 1 33 GLY QA 4.580 . 4.580 4.079 3.859 4.411 . 0 0 "[ . 1 . 2]" 1
271 1 33 GLY QA 1 34 GLU HA 5.070 . 5.070 3.990 3.889 4.200 . 0 0 "[ . 1 . 2]" 1
272 1 109 THR HA 1 110 GLY QA 5.200 . 5.200 3.952 3.857 4.270 . 0 0 "[ . 1 . 2]" 1
273 1 56 THR HB 1 58 LEU HG 4.930 . 4.930 4.333 4.043 4.848 . 0 0 "[ . 1 . 2]" 1
274 1 52 VAL MG2 1 56 THR HB 4.430 . 4.430 3.346 3.042 3.660 . 0 0 "[ . 1 . 2]" 1
275 1 58 LEU HA 1 60 LYS H 4.580 . 4.580 3.873 3.677 4.102 . 0 0 "[ . 1 . 2]" 1
276 1 93 GLU HA 1 93 GLU HB2 2.990 . 2.990 2.656 2.576 2.725 . 0 0 "[ . 1 . 2]" 1
277 1 56 THR MG 1 58 LEU HA 3.260 . 3.260 3.134 2.829 3.294 0.034 19 0 "[ . 1 . 2]" 1
278 1 68 ARG HA 1 68 ARG QD 4.100 . 4.100 3.772 1.942 4.232 0.132 5 0 "[ . 1 . 2]" 1
279 1 68 ARG HA 1 68 ARG QG 3.200 . 3.200 2.540 2.388 3.081 . 0 0 "[ . 1 . 2]" 1
280 1 65 TYR HA 1 67 GLN H 4.740 . 4.740 4.560 4.313 4.672 . 0 0 "[ . 1 . 2]" 1
281 1 65 TYR HA 1 65 TYR QD 3.380 . 3.380 3.109 3.005 3.244 . 0 0 "[ . 1 . 2]" 1
282 1 65 TYR HA 1 68 ARG QG 4.610 . 4.610 4.491 3.700 4.780 0.170 19 0 "[ . 1 . 2]" 1
283 1 48 ILE MG 1 65 TYR HA 4.910 . 4.910 4.197 3.666 4.575 . 0 0 "[ . 1 . 2]" 1
284 1 61 LEU MD2 1 65 TYR HA 5.070 . 5.070 4.756 4.468 5.009 . 0 0 "[ . 1 . 2]" 1
285 1 43 GLN HA 1 45 SER H 3.700 . 3.700 3.274 3.211 3.380 . 0 0 "[ . 1 . 2]" 1
286 1 67 GLN HA 1 69 GLN H 4.260 . 4.260 4.312 4.229 4.377 0.117 14 0 "[ . 1 . 2]" 1
287 1 43 GLN HA 1 43 GLN QG 3.420 . 3.420 3.419 3.390 3.440 0.020 3 0 "[ . 1 . 2]" 1
288 1 59 LYS QD 1 60 LYS HA 4.240 . 4.240 3.796 2.888 4.443 0.203 18 0 "[ . 1 . 2]" 1
289 1 52 VAL MG1 1 56 THR HA 5.060 . 5.060 5.137 5.085 5.241 0.181 20 0 "[ . 1 . 2]" 1
290 1 75 SER HB3 1 76 LEU HB2 5.270 . 5.270 5.252 5.015 5.513 0.243 2 0 "[ . 1 . 2]" 1
291 1 25 GLU HA 1 26 ASP H 2.700 . 2.700 2.422 2.129 2.823 0.123 17 0 "[ . 1 . 2]" 1
292 1 34 GLU HA 1 35 TYR H 2.810 . 2.810 2.190 2.096 2.454 . 0 0 "[ . 1 . 2]" 1
293 1 24 THR HB 1 25 GLU H 3.830 . 3.830 3.644 2.159 4.222 0.392 14 0 "[ . 1 . 2]" 1
294 1 98 GLU HA 1 99 GLU QB 4.380 . 4.380 4.308 4.251 4.374 . 0 0 "[ . 1 . 2]" 1
295 1 36 ILE HB 1 98 GLU HA 4.210 . 4.210 4.050 3.819 4.232 0.022 14 0 "[ . 1 . 2]" 1
296 1 83 GLN HE22 1 94 LEU HA 4.850 . 4.850 3.427 3.107 3.933 . 0 0 "[ . 1 . 2]" 1
297 1 93 GLU QG 1 94 LEU HA 4.460 . 4.460 4.431 4.180 4.807 0.347 16 0 "[ . 1 . 2]" 1
298 1 94 LEU HA 1 94 LEU MD1 4.190 . 4.190 3.870 3.850 3.889 . 0 0 "[ . 1 . 2]" 1
299 1 91 PRO HA 1 92 LYS HA 4.740 . 4.740 4.720 4.696 4.748 0.008 1 0 "[ . 1 . 2]" 1
300 1 31 LYS HA 1 31 LYS QB 2.800 . 2.800 2.307 2.167 2.526 . 0 0 "[ . 1 . 2]" 1
301 1 20 ALA HA 1 21 LYS H 3.030 . 3.030 2.647 2.141 3.180 0.150 17 0 "[ . 1 . 2]" 1
302 1 19 GLU QG 1 20 ALA HA 4.170 . 4.170 4.046 3.487 4.316 0.146 13 0 "[ . 1 . 2]" 1
303 1 63 GLU QB 1 64 SER HA 4.270 . 4.270 3.996 3.714 4.382 0.112 1 0 "[ . 1 . 2]" 1
304 1 49 HIS HA 1 50 PHE HB2 4.740 . 4.740 4.404 4.298 4.476 . 0 0 "[ . 1 . 2]" 1
305 1 48 ILE HB 1 49 HIS HA 4.570 . 4.570 4.568 4.519 4.612 0.042 5 0 "[ . 1 . 2]" 1
306 1 38 LEU QD 1 99 GLU HA 4.020 . 4.020 3.826 3.520 4.128 0.108 1 0 "[ . 1 . 2]" 1
307 1 38 LEU HB2 1 38 LEU QD 3.020 . 3.020 2.250 2.190 2.279 . 0 0 "[ . 1 . 2]" 1
308 1 101 VAL H 1 101 VAL QG 3.340 . 3.340 2.260 2.204 2.303 . 0 0 "[ . 1 . 2]" 1
309 1 101 VAL HA 1 101 VAL QG 3.150 . 3.150 2.313 2.262 2.354 . 0 0 "[ . 1 . 2]" 1
310 1 39 LYS QE 1 101 VAL QG 3.510 . 3.510 2.663 1.846 3.115 . 0 0 "[ . 1 . 2]" 1
311 1 41 ILE HB 1 101 VAL QG 3.860 . 3.860 3.824 3.662 3.925 0.065 13 0 "[ . 1 . 2]" 1
312 1 39 LYS HB3 1 101 VAL QG 3.330 . 3.330 2.545 2.299 2.749 . 0 0 "[ . 1 . 2]" 1
313 1 41 ILE H 1 104 VAL QG 4.340 . 4.340 3.751 3.565 3.885 . 0 0 "[ . 1 . 2]" 1
314 1 78 PHE HA 1 104 VAL QG 3.890 . 3.890 2.044 1.912 2.146 . 0 0 "[ . 1 . 2]" 1
315 1 78 PHE HB3 1 104 VAL QG . . 4.400 1.968 1.881 2.137 . 0 0 "[ . 1 . 2]" 1
316 1 62 LYS QE 1 104 VAL QG 4.260 . 4.260 3.453 3.045 3.793 . 0 0 "[ . 1 . 2]" 1
317 1 62 LYS QB 1 104 VAL QG 4.460 . 4.460 4.049 3.814 4.228 . 0 0 "[ . 1 . 2]" 1
318 1 102 ILE MG 1 104 VAL QG 3.060 . 3.060 2.249 2.099 2.453 . 0 0 "[ . 1 . 2]" 1
319 1 76 LEU QD 1 104 VAL QG . . 2.890 1.732 1.714 1.750 0.086 2 0 "[ . 1 . 2]" 1
320 1 40 VAL MG1 1 104 VAL QG 2.900 . 2.900 2.042 1.945 2.125 . 0 0 "[ . 1 . 2]" 1
321 1 61 LEU H 1 63 GLU H 4.440 . 4.440 4.092 3.953 4.281 . 0 0 "[ . 1 . 2]" 1
322 1 61 LEU H 1 64 SER H 4.770 . 4.770 4.643 4.517 4.767 . 0 0 "[ . 1 . 2]" 1
323 1 60 LYS H 1 61 LEU H 3.290 . 3.290 2.599 2.535 2.708 . 0 0 "[ . 1 . 2]" 1
324 1 61 LEU H 1 62 LYS HA 5.430 . 5.430 5.065 4.972 5.177 . 0 0 "[ . 1 . 2]" 1
325 1 61 LEU H 1 62 LYS QE 5.470 . 5.470 5.387 5.090 5.666 0.196 2 0 "[ . 1 . 2]" 1
326 1 60 LYS QB 1 61 LEU H 3.380 . 3.380 2.884 2.709 3.566 0.186 5 0 "[ . 1 . 2]" 1
327 1 54 MET H 1 55 THR H 3.560 . 3.560 2.343 2.233 2.452 . 0 0 "[ . 1 . 2]" 1
328 1 55 THR H 1 92 LYS H 5.660 . 5.660 5.474 5.242 5.556 . 0 0 "[ . 1 . 2]" 1
329 1 55 THR H 1 55 THR MG 3.220 . 3.220 2.812 2.669 2.934 . 0 0 "[ . 1 . 2]" 1
330 1 86 ALA H 1 89 HIS H 4.330 . 4.330 3.993 3.842 4.181 . 0 0 "[ . 1 . 2]" 1
331 1 87 ASP H 1 89 HIS H 4.340 . 4.340 4.014 3.853 4.157 . 0 0 "[ . 1 . 2]" 1
332 1 88 ASN H 1 89 HIS H 3.170 . 3.170 2.287 2.083 2.490 . 0 0 "[ . 1 . 2]" 1
333 1 87 ASP HA 1 89 HIS H 4.250 . 4.250 3.852 3.736 4.003 . 0 0 "[ . 1 . 2]" 1
334 1 89 HIS H 1 89 HIS HB2 3.140 . 3.140 2.213 2.152 2.253 . 0 0 "[ . 1 . 2]" 1
335 1 89 HIS H 1 89 HIS HB3 3.450 . 3.450 3.453 3.353 3.489 0.039 5 0 "[ . 1 . 2]" 1
336 1 88 ASN HB2 1 89 HIS H 4.610 . 4.610 4.346 3.837 4.450 . 0 0 "[ . 1 . 2]" 1
337 1 86 ALA MB 1 89 HIS H 3.050 . 3.050 2.850 2.676 2.950 . 0 0 "[ . 1 . 2]" 1
338 1 54 MET H 1 56 THR H 4.140 . 4.140 3.991 3.872 4.083 . 0 0 "[ . 1 . 2]" 1
339 1 56 THR H 1 56 THR HB 3.130 . 3.130 2.527 2.469 2.581 . 0 0 "[ . 1 . 2]" 1
340 1 52 VAL HB 1 56 THR H 4.390 . 4.390 4.004 3.934 4.089 . 0 0 "[ . 1 . 2]" 1
341 1 56 THR H 1 56 THR MG 3.740 . 3.740 3.776 3.765 3.792 0.052 10 0 "[ . 1 . 2]" 1
342 1 76 LEU H 1 77 ARG H 4.680 . 4.680 4.482 4.438 4.541 . 0 0 "[ . 1 . 2]" 1
343 1 74 ASN H 1 76 LEU H 4.120 . 4.120 4.051 3.916 4.162 0.042 13 0 "[ . 1 . 2]" 1
344 1 73 MET HA 1 76 LEU H 3.620 . 3.620 3.482 3.266 3.645 0.025 19 0 "[ . 1 . 2]" 1
345 1 75 SER HB3 1 76 LEU H 4.250 . 4.250 3.433 2.904 3.939 . 0 0 "[ . 1 . 2]" 1
346 1 75 SER HB2 1 76 LEU H 4.090 . 4.090 3.555 2.703 4.140 0.050 8 0 "[ . 1 . 2]" 1
347 1 72 PRO QB 1 76 LEU H 4.700 . 4.700 4.485 3.951 4.733 0.033 17 0 "[ . 1 . 2]" 1
348 1 72 PRO QG 1 76 LEU H 4.600 . 4.600 4.476 4.225 4.778 0.178 18 0 "[ . 1 . 2]" 1
349 1 76 LEU H 1 76 LEU HG 4.210 . 4.210 4.049 3.875 4.137 . 0 0 "[ . 1 . 2]" 1
350 1 89 HIS HA 1 90 THR H 2.980 . 2.980 2.182 2.151 2.214 . 0 0 "[ . 1 . 2]" 1
351 1 90 THR H 1 91 PRO HA 5.280 . 5.280 5.199 5.145 5.263 . 0 0 "[ . 1 . 2]" 1
352 1 89 HIS HB2 1 90 THR H 4.200 . 4.200 4.268 4.224 4.345 0.145 14 0 "[ . 1 . 2]" 1
353 1 89 HIS HB3 1 90 THR H 3.670 . 3.670 3.144 3.065 3.316 . 0 0 "[ . 1 . 2]" 1
354 1 90 THR H 1 93 GLU HB2 3.270 . 3.270 2.341 2.051 2.752 . 0 0 "[ . 1 . 2]" 1
355 1 90 THR H 1 93 GLU HB3 3.450 . 3.450 2.146 1.905 2.337 . 0 0 "[ . 1 . 2]" 1
356 1 90 THR H 1 96 MET ME 5.040 . 5.040 5.085 5.005 5.167 0.127 14 0 "[ . 1 . 2]" 1
357 1 90 THR H 1 90 THR MG 3.390 . 3.390 2.663 2.555 2.769 . 0 0 "[ . 1 . 2]" 1
358 1 85 ILE MG 1 90 THR H 4.920 . 4.920 4.799 4.638 4.902 . 0 0 "[ . 1 . 2]" 1
359 1 90 THR H 1 94 LEU MD2 4.490 . 4.490 4.286 4.188 4.469 . 0 0 "[ . 1 . 2]" 1
360 1 59 LYS HB3 1 60 LYS H 3.630 . 3.630 2.687 2.383 2.879 . 0 0 "[ . 1 . 2]" 1
361 1 58 LEU QD 1 60 LYS H 5.430 . 5.430 5.112 4.917 5.288 . 0 0 "[ . 1 . 2]" 1
362 1 89 HIS HD2 1 94 LEU H 5.400 . 5.400 5.373 4.282 5.501 0.101 5 0 "[ . 1 . 2]" 1
363 1 89 HIS HA 1 94 LEU H 5.910 . 5.910 5.203 5.044 5.479 . 0 0 "[ . 1 . 2]" 1
364 1 89 HIS HB3 1 94 LEU H 5.580 . 5.580 5.069 4.861 5.319 . 0 0 "[ . 1 . 2]" 1
365 1 93 GLU HB2 1 94 LEU H 3.580 . 3.580 3.430 3.218 3.652 0.072 14 0 "[ . 1 . 2]" 1
366 1 93 GLU HB3 1 94 LEU H 3.510 . 3.510 2.526 2.177 2.661 . 0 0 "[ . 1 . 2]" 1
367 1 94 LEU H 1 94 LEU HG 2.830 . 2.830 2.339 2.129 2.486 . 0 0 "[ . 1 . 2]" 1
368 1 94 LEU H 1 94 LEU MD1 3.360 . 3.360 3.410 3.370 3.445 0.085 19 0 "[ . 1 . 2]" 1
369 1 94 LEU H 1 94 LEU MD2 3.550 . 3.550 3.561 3.365 3.680 0.130 14 0 "[ . 1 . 2]" 1
370 1 62 LYS H 1 65 TYR H 5.140 . 5.140 4.707 4.573 4.847 . 0 0 "[ . 1 . 2]" 1
371 1 61 LEU H 1 62 LYS H 3.340 . 3.340 2.439 2.333 2.559 . 0 0 "[ . 1 . 2]" 1
372 1 58 LEU HA 1 62 LYS H 4.900 . 4.900 4.267 4.095 4.483 . 0 0 "[ . 1 . 2]" 1
373 1 62 LYS H 1 64 SER QB 5.360 . 5.360 4.952 4.618 5.181 . 0 0 "[ . 1 . 2]" 1
374 1 62 LYS H 1 65 TYR HB3 5.410 . 5.410 4.867 4.621 5.115 . 0 0 "[ . 1 . 2]" 1
375 1 62 LYS H 1 62 LYS QE 4.130 . 4.130 4.104 3.962 4.216 0.086 13 0 "[ . 1 . 2]" 1
376 1 61 LEU MD2 1 62 LYS H 3.890 . 3.890 3.313 3.142 3.421 . 0 0 "[ . 1 . 2]" 1
377 1 80 PHE QE 1 96 MET H 4.750 . 4.750 4.851 4.466 4.923 0.173 17 0 "[ . 1 . 2]" 1
378 1 96 MET H 1 96 MET QB 3.800 . 3.800 2.471 2.427 2.858 . 0 0 "[ . 1 . 2]" 1
379 1 94 LEU HA 1 95 GLY H 3.520 . 3.520 3.394 3.352 3.430 . 0 0 "[ . 1 . 2]" 1
380 1 93 GLU HB2 1 95 GLY H 5.370 . 5.370 5.209 5.069 5.328 . 0 0 "[ . 1 . 2]" 1
381 1 95 GLY H 1 96 MET QG 4.300 . 4.300 3.832 3.747 3.915 . 0 0 "[ . 1 . 2]" 1
382 1 95 GLY H 1 96 MET QB 4.710 . 4.710 4.676 4.585 4.743 0.033 19 0 "[ . 1 . 2]" 1
383 1 94 LEU MD1 1 95 GLY H 4.930 . 4.930 4.917 4.869 4.968 0.038 6 0 "[ . 1 . 2]" 1
384 1 70 GLY H 1 71 VAL H 2.940 . 2.940 2.641 2.524 2.827 . 0 0 "[ . 1 . 2]" 1
385 1 69 GLN HA 1 71 VAL H 4.870 . 4.870 4.921 4.876 4.986 0.116 20 0 "[ . 1 . 2]" 1
386 1 70 GLY QA 1 71 VAL H 3.060 . 3.060 2.732 2.640 2.800 . 0 0 "[ . 1 . 2]" 1
387 1 71 VAL H 1 72 PRO QD 4.550 . 4.550 4.276 4.226 4.369 . 0 0 "[ . 1 . 2]" 1
388 1 69 GLN QB 1 71 VAL H 3.810 . 3.810 3.296 3.183 3.414 . 0 0 "[ . 1 . 2]" 1
389 1 71 VAL H 1 71 VAL MG2 3.820 . 3.820 2.038 1.948 2.161 . 0 0 "[ . 1 . 2]" 1
390 1 86 ALA H 1 88 ASN H 5.250 . 5.250 4.776 4.532 4.965 . 0 0 "[ . 1 . 2]" 1
391 1 88 ASN H 1 89 HIS HB2 4.500 . 4.500 4.010 3.792 4.191 . 0 0 "[ . 1 . 2]" 1
392 1 87 ASP QB 1 88 ASN H 3.700 . 3.700 3.477 2.869 3.739 0.039 6 0 "[ . 1 . 2]" 1
393 1 59 LYS HB2 1 88 ASN H 4.790 . 4.790 4.701 4.414 4.913 0.123 7 0 "[ . 1 . 2]" 1
394 1 86 ALA MB 1 88 ASN H 3.110 . 3.110 2.445 2.260 2.608 . 0 0 "[ . 1 . 2]" 1
395 1 79 LEU H 1 104 VAL H 5.110 . 5.110 4.910 4.816 5.051 . 0 0 "[ . 1 . 2]" 1
396 1 43 GLN H 1 104 VAL H 4.360 . 4.360 4.179 3.830 4.419 0.059 1 0 "[ . 1 . 2]" 1
397 1 104 VAL H 1 105 TYR H 4.380 . 4.380 4.289 4.208 4.335 . 0 0 "[ . 1 . 2]" 1
398 1 104 VAL H 1 105 TYR QD 5.180 . 5.180 4.988 4.944 5.085 . 0 0 "[ . 1 . 2]" 1
399 1 104 VAL H 1 105 TYR QE 5.050 . 5.050 5.123 5.062 5.208 0.158 3 0 "[ . 1 . 2]" 1
400 1 103 GLU HA 1 104 VAL H 2.670 . 2.670 2.197 2.167 2.229 . 0 0 "[ . 1 . 2]" 1
401 1 42 GLY QA 1 104 VAL H 4.310 . 4.310 2.360 2.104 2.676 . 0 0 "[ . 1 . 2]" 1
402 1 104 VAL H 1 104 VAL HB 3.270 . 3.270 2.644 2.575 2.701 . 0 0 "[ . 1 . 2]" 1
403 1 66 CYS H 1 69 GLN H 5.080 . 5.080 4.682 4.623 4.737 . 0 0 "[ . 1 . 2]" 1
404 1 68 ARG QD 1 69 GLN H 4.970 . 4.970 4.726 4.382 5.053 0.083 14 0 "[ . 1 . 2]" 1
405 1 73 MET H 1 75 SER H 4.520 . 4.520 4.105 3.956 4.194 . 0 0 "[ . 1 . 2]" 1
406 1 74 ASN H 1 75 SER H 3.360 . 3.360 2.440 2.306 2.561 . 0 0 "[ . 1 . 2]" 1
407 1 75 SER H 1 76 LEU H 2.930 . 2.930 2.175 2.072 2.293 . 0 0 "[ . 1 . 2]" 1
408 1 74 ASN HD21 1 75 SER H 4.680 . 4.680 4.177 3.884 4.543 . 0 0 "[ . 1 . 2]" 1
409 1 75 SER H 1 76 LEU HA 4.970 . 4.970 4.853 4.788 4.965 . 0 0 "[ . 1 . 2]" 1
410 1 73 MET HA 1 75 SER H 3.870 . 3.870 3.786 3.691 3.884 0.014 2 0 "[ . 1 . 2]" 1
411 1 75 SER H 1 75 SER HB3 3.570 . 3.570 3.037 2.515 3.559 . 0 0 "[ . 1 . 2]" 1
412 1 75 SER H 1 75 SER HB2 3.400 . 3.400 2.519 2.210 2.844 . 0 0 "[ . 1 . 2]" 1
413 1 72 PRO QD 1 75 SER H 5.050 . 5.050 4.702 3.815 5.113 0.063 16 0 "[ . 1 . 2]" 1
414 1 74 ASN HB3 1 75 SER H 4.350 . 4.350 4.242 4.089 4.397 0.047 4 0 "[ . 1 . 2]" 1
415 1 74 ASN HB2 1 75 SER H 4.400 . 4.400 4.184 4.027 4.270 . 0 0 "[ . 1 . 2]" 1
416 1 73 MET QG 1 75 SER H 5.000 . 5.000 4.519 4.281 4.723 . 0 0 "[ . 1 . 2]" 1
417 1 72 PRO QB 1 75 SER H 4.160 . 4.160 2.687 2.357 2.894 . 0 0 "[ . 1 . 2]" 1
418 1 72 PRO QG 1 75 SER H 3.890 . 3.890 3.337 2.976 3.850 . 0 0 "[ . 1 . 2]" 1
419 1 70 GLY H 1 71 VAL HA 5.510 . 5.510 5.231 5.147 5.371 . 0 0 "[ . 1 . 2]" 1
420 1 70 GLY H 1 70 GLY QA 2.630 . 2.630 2.243 2.216 2.278 . 0 0 "[ . 1 . 2]" 1
421 1 69 GLN QB 1 70 GLY H 3.680 . 3.680 3.135 2.946 3.283 . 0 0 "[ . 1 . 2]" 1
422 1 81 GLU H 1 83 GLN H 4.430 . 4.430 4.229 4.107 4.303 . 0 0 "[ . 1 . 2]" 1
423 1 82 GLY H 1 83 GLN H 2.990 . 2.990 2.393 2.278 2.497 . 0 0 "[ . 1 . 2]" 1
424 1 93 GLU H 1 95 GLY H 3.620 . 3.620 3.641 3.591 3.680 0.060 1 0 "[ . 1 . 2]" 1
425 1 93 GLU H 1 94 LEU H 3.200 . 3.200 2.434 2.368 2.505 . 0 0 "[ . 1 . 2]" 1
426 1 90 THR H 1 93 GLU H 3.920 . 3.920 3.251 3.158 3.408 . 0 0 "[ . 1 . 2]" 1
427 1 83 GLN H 1 83 GLN HE22 5.560 . 5.560 5.358 4.976 5.533 . 0 0 "[ . 1 . 2]" 1
428 1 92 LYS QE 1 93 GLU H 4.300 . 4.300 3.587 3.204 4.129 . 0 0 "[ . 1 . 2]" 1
429 1 80 PHE HB3 1 83 GLN H 4.550 . 4.550 4.360 4.247 4.556 0.006 20 0 "[ . 1 . 2]" 1
430 1 92 LYS QG 1 93 GLU H 3.190 . 3.190 2.163 2.066 2.284 . 0 0 "[ . 1 . 2]" 1
431 1 90 THR MG 1 93 GLU H 3.880 . 3.880 3.964 3.916 4.021 0.141 1 0 "[ . 1 . 2]" 1
432 1 64 SER H 1 65 TYR H 3.680 . 3.680 2.661 2.524 2.787 . 0 0 "[ . 1 . 2]" 1
433 1 63 GLU H 1 64 SER H 3.640 . 3.640 2.840 2.654 2.962 . 0 0 "[ . 1 . 2]" 1
434 1 62 LYS H 1 64 SER H 4.370 . 4.370 4.099 3.955 4.265 . 0 0 "[ . 1 . 2]" 1
435 1 64 SER H 1 64 SER QB 3.040 . 3.040 2.423 2.238 2.559 . 0 0 "[ . 1 . 2]" 1
436 1 61 LEU HA 1 64 SER H 4.150 . 4.150 3.571 3.373 3.722 . 0 0 "[ . 1 . 2]" 1
437 1 64 SER H 1 65 TYR HB3 4.780 . 4.780 4.478 4.357 4.620 . 0 0 "[ . 1 . 2]" 1
438 1 62 LYS HA 1 64 SER H 4.880 . 4.880 4.317 4.203 4.423 . 0 0 "[ . 1 . 2]" 1
439 1 43 GLN H 1 45 SER H 4.510 . 4.510 4.352 4.208 4.466 . 0 0 "[ . 1 . 2]" 1
440 1 44 ASP H 1 45 SER H 2.900 . 2.900 2.587 2.439 2.706 . 0 0 "[ . 1 . 2]" 1
441 1 44 ASP HA 1 45 SER H 3.280 . 3.280 3.142 3.058 3.226 . 0 0 "[ . 1 . 2]" 1
442 1 45 SER H 1 45 SER HA 2.570 . 2.570 2.257 2.245 2.270 . 0 0 "[ . 1 . 2]" 1
443 1 42 GLY QA 1 45 SER H 4.410 . 4.410 4.130 3.980 4.262 . 0 0 "[ . 1 . 2]" 1
444 1 44 ASP HB2 1 45 SER H 4.610 . 4.610 4.231 3.599 4.471 . 0 0 "[ . 1 . 2]" 1
445 1 44 ASP HB3 1 45 SER H 4.610 . 4.610 3.965 3.651 4.534 . 0 0 "[ . 1 . 2]" 1
446 1 92 LYS H 1 95 GLY H 4.970 . 4.970 4.647 4.584 4.744 . 0 0 "[ . 1 . 2]" 1
447 1 92 LYS H 1 94 LEU H 4.590 . 4.590 4.098 4.007 4.179 . 0 0 "[ . 1 . 2]" 1
448 1 56 THR H 1 92 LYS H 5.040 . 5.040 4.799 4.670 4.892 . 0 0 "[ . 1 . 2]" 1
449 1 90 THR HB 1 92 LYS H 3.890 . 3.890 2.803 2.673 2.884 . 0 0 "[ . 1 . 2]" 1
450 1 54 MET HA 1 92 LYS H 4.450 . 4.450 4.144 3.578 4.450 . 0 0 "[ . 1 . 2]" 1
451 1 92 LYS H 1 92 LYS QE 5.020 . 5.020 4.553 4.314 5.027 0.007 8 0 "[ . 1 . 2]" 1
452 1 91 PRO QB 1 92 LYS H 3.500 . 3.500 3.096 3.053 3.149 . 0 0 "[ . 1 . 2]" 1
453 1 92 LYS H 1 92 LYS HB2 3.660 . 3.660 3.612 3.588 3.636 . 0 0 "[ . 1 . 2]" 1
454 1 92 LYS H 1 92 LYS HB3 3.220 . 3.220 2.461 2.339 2.555 . 0 0 "[ . 1 . 2]" 1
455 1 92 LYS H 1 92 LYS QG 3.550 . 3.550 2.452 2.249 2.711 . 0 0 "[ . 1 . 2]" 1
456 1 90 THR MG 1 92 LYS H 4.150 . 4.150 4.223 4.183 4.263 0.113 19 0 "[ . 1 . 2]" 1
457 1 36 ILE MG 1 92 LYS H 6.000 . 6.000 5.137 4.788 5.530 . 0 0 "[ . 1 . 2]" 1
458 1 38 LEU QD 1 92 LYS H 5.790 . 5.790 5.298 5.085 5.449 . 0 0 "[ . 1 . 2]" 1
459 1 43 GLN H 1 46 SER H 5.420 . 5.420 5.272 5.081 5.410 . 0 0 "[ . 1 . 2]" 1
460 1 42 GLY H 1 46 SER H 3.750 . 3.750 3.117 2.998 3.237 . 0 0 "[ . 1 . 2]" 1
461 1 44 ASP H 1 46 SER H 3.440 . 3.440 3.286 3.122 3.444 0.004 18 0 "[ . 1 . 2]" 1
462 1 44 ASP HA 1 46 SER H 4.360 . 4.360 4.321 4.230 4.423 0.063 6 0 "[ . 1 . 2]" 1
463 1 45 SER HA 1 46 SER H 3.260 . 3.260 3.066 3.002 3.102 . 0 0 "[ . 1 . 2]" 1
464 1 44 ASP HB3 1 46 SER H 4.550 . 4.550 3.313 2.689 4.668 0.118 12 0 "[ . 1 . 2]" 1
465 1 99 GLU H 1 100 ASP H 3.710 . 3.710 2.528 2.424 2.598 . 0 0 "[ . 1 . 2]" 1
466 1 99 GLU QB 1 100 ASP H 4.120 . 4.120 3.647 3.530 3.780 . 0 0 "[ . 1 . 2]" 1
467 1 38 LEU HB3 1 100 ASP H 5.390 . 5.390 5.012 4.671 5.229 . 0 0 "[ . 1 . 2]" 1
468 1 100 ASP H 1 101 VAL QG 4.840 . 4.840 4.663 4.587 4.749 . 0 0 "[ . 1 . 2]" 1
469 1 100 ASP HB2 1 101 VAL H 4.670 . 4.670 3.827 3.703 3.952 . 0 0 "[ . 1 . 2]" 1
470 1 28 GLY QA 1 29 ASP H 2.970 . 2.970 2.664 2.253 2.934 . 0 0 "[ . 1 . 2]" 1
471 1 33 GLY QA 1 34 GLU H 2.670 . 2.670 2.344 2.068 2.794 0.124 20 0 "[ . 1 . 2]" 1
472 1 18 GLN H 1 18 GLN QG 3.190 . 3.190 2.647 1.922 3.289 0.099 13 0 "[ . 1 . 2]" 1
473 1 24 THR H 1 25 GLU QG 6.000 . 6.000 5.228 3.498 6.044 0.044 17 0 "[ . 1 . 2]" 1
474 1 19 GLU HA 1 20 ALA H 2.610 . 2.610 2.337 2.074 2.630 0.020 20 0 "[ . 1 . 2]" 1
475 1 65 TYR H 1 67 GLN H 4.330 . 4.330 4.231 4.048 4.345 0.015 4 0 "[ . 1 . 2]" 1
476 1 66 CYS H 1 67 GLN H 3.200 . 3.200 2.599 2.534 2.703 . 0 0 "[ . 1 . 2]" 1
477 1 67 GLN H 1 68 ARG H 3.140 . 3.140 2.617 2.527 2.697 . 0 0 "[ . 1 . 2]" 1
478 1 67 GLN H 1 69 GLN H 4.060 . 4.060 4.054 3.950 4.120 0.060 4 0 "[ . 1 . 2]" 1
479 1 43 GLN HE21 1 44 ASP H 4.590 . 4.590 2.026 1.749 2.414 0.051 17 0 "[ . 1 . 2]" 1
480 1 67 GLN H 1 71 VAL H 5.220 . 5.220 4.805 4.646 4.925 . 0 0 "[ . 1 . 2]" 1
481 1 65 TYR QD 1 67 GLN H 5.260 . 5.260 5.261 5.162 5.338 0.078 11 0 "[ . 1 . 2]" 1
482 1 64 SER HA 1 67 GLN H 3.900 . 3.900 3.610 3.319 3.895 . 0 0 "[ . 1 . 2]" 1
483 1 43 GLN HA 1 44 ASP H 3.520 . 3.520 3.361 3.308 3.406 . 0 0 "[ . 1 . 2]" 1
484 1 42 GLY QA 1 44 ASP H 3.800 . 3.800 2.912 2.862 2.994 . 0 0 "[ . 1 . 2]" 1
485 1 66 CYS HB2 1 67 GLN H 3.830 . 3.830 2.675 2.458 3.673 . 0 0 "[ . 1 . 2]" 1
486 1 66 CYS HB3 1 67 GLN H 3.830 . 3.830 3.658 2.483 3.914 0.084 8 0 "[ . 1 . 2]" 1
487 1 44 ASP H 1 44 ASP HB2 3.780 . 3.780 2.591 2.395 3.548 . 0 0 "[ . 1 . 2]" 1
488 1 44 ASP H 1 44 ASP HB3 3.780 . 3.780 2.855 2.406 3.675 . 0 0 "[ . 1 . 2]" 1
489 1 67 GLN H 1 67 GLN HG2 3.820 . 3.820 2.637 1.979 3.697 . 0 0 "[ . 1 . 2]" 1
490 1 67 GLN H 1 67 GLN HG3 3.820 . 3.820 3.044 2.164 3.766 . 0 0 "[ . 1 . 2]" 1
491 1 67 GLN H 1 67 GLN QB 2.680 . 2.680 2.488 2.279 2.633 . 0 0 "[ . 1 . 2]" 1
492 1 98 GLU H 1 98 GLU HB3 3.110 . 3.110 2.939 2.649 3.219 0.109 14 0 "[ . 1 . 2]" 1
493 1 44 ASP H 1 104 VAL QG 5.640 . 5.640 5.194 4.857 5.489 . 0 0 "[ . 1 . 2]" 1
494 1 35 TYR H 1 35 TYR HB2 4.130 . 4.130 3.861 3.663 3.950 . 0 0 "[ . 1 . 2]" 1
495 1 31 LYS H 1 31 LYS QE 5.070 . 5.070 4.609 3.368 5.560 0.490 17 0 "[ . 1 . 2]" 1
496 1 24 THR MG 1 25 GLU H 3.640 . 3.640 2.835 1.845 3.597 . 0 0 "[ . 1 . 2]" 1
497 1 16 SER QB 1 17 ASP H 3.930 . 3.930 3.079 1.777 4.009 0.079 14 0 "[ . 1 . 2]" 1
498 1 26 ASP H 1 26 ASP QB 3.070 . 3.070 2.398 2.210 3.089 0.019 18 0 "[ . 1 . 2]" 1
499 1 31 LYS H 1 31 LYS QG 3.760 . 3.760 3.107 1.742 4.139 0.379 6 0 "[ . 1 . 2]" 1
500 1 35 TYR H 1 35 TYR HB3 3.440 . 3.440 3.226 2.735 3.465 0.025 18 0 "[ . 1 . 2]" 1
501 1 35 TYR H 1 36 ILE MG 4.790 . 4.790 4.608 4.341 4.864 0.074 10 0 "[ . 1 . 2]" 1
502 1 28 GLY QA 1 30 LYS H 4.290 . 4.290 3.757 3.064 4.489 0.199 13 0 "[ . 1 . 2]" 1
503 1 29 ASP QB 1 30 LYS H 3.950 . 3.950 3.714 2.911 4.017 0.067 4 0 "[ . 1 . 2]" 1
504 1 27 LEU H 1 28 GLY QA 4.900 . 4.900 4.315 3.696 4.982 0.082 15 0 "[ . 1 . 2]" 1
505 1 109 THR H 1 109 THR HB 3.930 . 3.930 3.460 2.588 3.744 . 0 0 "[ . 1 . 2]" 1
506 1 108 GLN QG 1 109 THR H 4.560 . 4.560 3.578 2.016 4.637 0.077 18 0 "[ . 1 . 2]" 1
507 1 106 GLN H 1 107 GLU H 4.440 . 4.440 4.182 4.090 4.276 . 0 0 "[ . 1 . 2]" 1
508 1 76 LEU H 1 107 GLU H 4.520 . 4.520 4.473 4.281 4.610 0.090 19 0 "[ . 1 . 2]" 1
509 1 106 GLN HA 1 107 GLU H 2.720 . 2.720 2.108 2.066 2.134 . 0 0 "[ . 1 . 2]" 1
510 1 75 SER HB3 1 107 GLU H 4.810 . 4.810 3.807 3.073 4.584 . 0 0 "[ . 1 . 2]" 1
511 1 107 GLU H 1 107 GLU QG 3.180 . 3.180 2.495 2.182 3.128 . 0 0 "[ . 1 . 2]" 1
512 1 107 GLU H 1 107 GLU HB2 3.570 . 3.570 2.437 2.157 2.548 . 0 0 "[ . 1 . 2]" 1
513 1 107 GLU H 1 107 GLU HB3 3.570 . 3.570 3.613 3.452 3.670 0.100 7 0 "[ . 1 . 2]" 1
514 1 73 MET H 1 74 ASN H 3.650 . 3.650 2.614 2.541 2.680 . 0 0 "[ . 1 . 2]" 1
515 1 72 PRO HA 1 74 ASN H 3.840 . 3.840 3.768 3.659 3.828 . 0 0 "[ . 1 . 2]" 1
516 1 74 ASN H 1 75 SER HB3 5.320 . 5.320 5.265 4.730 5.765 0.445 16 0 "[ . 1 . 2]" 1
517 1 74 ASN H 1 75 SER HB2 4.910 . 4.910 4.464 4.250 4.786 . 0 0 "[ . 1 . 2]" 1
518 1 74 ASN H 1 74 ASN HB3 3.380 . 3.380 2.690 2.534 2.893 . 0 0 "[ . 1 . 2]" 1
519 1 73 MET QB 1 74 ASN H 4.350 . 4.350 3.607 3.540 3.686 . 0 0 "[ . 1 . 2]" 1
520 1 73 MET ME 1 74 ASN H 4.270 . 4.270 3.845 3.420 4.304 0.034 1 0 "[ . 1 . 2]" 1
521 1 28 GLY H 1 28 GLY QA 2.590 . 2.590 2.292 2.094 2.406 . 0 0 "[ . 1 . 2]" 1
522 1 27 LEU HG 1 28 GLY H 5.370 . 5.370 2.920 1.724 4.164 0.076 5 0 "[ . 1 . 2]" 1
523 1 27 LEU MD2 1 28 GLY H 4.750 . 4.750 3.495 1.949 5.061 0.311 10 0 "[ . 1 . 2]" 1
524 1 42 GLY H 1 104 VAL H 4.970 . 4.970 4.681 4.566 4.845 . 0 0 "[ . 1 . 2]" 1
525 1 41 ILE HA 1 42 GLY H 2.820 . 2.820 2.271 2.211 2.337 . 0 0 "[ . 1 . 2]" 1
526 1 41 ILE HB 1 42 GLY H 4.150 . 4.150 4.012 3.965 4.077 . 0 0 "[ . 1 . 2]" 1
527 1 42 GLY H 1 104 VAL HB 4.950 . 4.950 4.498 4.322 4.668 . 0 0 "[ . 1 . 2]" 1
528 1 41 ILE MG 1 42 GLY H 3.730 . 3.730 3.607 3.419 3.760 0.030 15 0 "[ . 1 . 2]" 1
529 1 40 VAL MG1 1 42 GLY H 4.620 . 4.620 4.541 4.426 4.640 0.020 4 0 "[ . 1 . 2]" 1
530 1 42 GLY H 1 104 VAL QG 5.530 . 5.530 4.745 4.633 4.880 . 0 0 "[ . 1 . 2]" 1
531 1 62 LYS H 1 63 GLU H 3.420 . 3.420 2.808 2.751 2.862 . 0 0 "[ . 1 . 2]" 1
532 1 59 LYS HA 1 63 GLU H 4.280 . 4.280 3.891 3.608 4.231 . 0 0 "[ . 1 . 2]" 1
533 1 59 LYS QE 1 63 GLU H 5.140 . 5.140 4.808 4.028 5.285 0.145 8 0 "[ . 1 . 2]" 1
534 1 62 LYS QB 1 63 GLU H 3.430 . 3.430 2.564 2.471 2.659 . 0 0 "[ . 1 . 2]" 1
535 1 63 GLU H 1 76 LEU QD 5.980 . 5.980 5.539 5.343 5.749 . 0 0 "[ . 1 . 2]" 1
536 1 61 LEU MD2 1 63 GLU H 5.070 . 5.070 5.014 4.861 5.107 0.037 3 0 "[ . 1 . 2]" 1
537 1 62 LYS QG 1 63 GLU H 4.560 . 4.560 4.494 4.417 4.573 0.013 10 0 "[ . 1 . 2]" 1
538 1 31 LYS QG 1 32 GLU H 4.120 . 4.120 3.202 2.183 4.249 0.129 9 0 "[ . 1 . 2]" 1
539 1 110 GLY H 1 111 GLY H 4.900 . 4.900 3.351 1.786 4.471 0.014 6 0 "[ . 1 . 2]" 1
540 1 59 LYS H 1 60 LYS H 4.060 . 4.060 2.699 2.548 2.839 . 0 0 "[ . 1 . 2]" 1
541 1 31 LYS QE 1 32 GLU H 5.070 . 5.070 3.432 2.005 4.799 . 0 0 "[ . 1 . 2]" 1
542 1 59 LYS H 1 59 LYS HB3 3.420 . 3.420 2.409 2.164 2.721 . 0 0 "[ . 1 . 2]" 1
543 1 59 LYS H 1 90 THR MG 6.000 . 6.000 5.283 5.015 5.529 . 0 0 "[ . 1 . 2]" 1
544 1 58 LEU QD 1 59 LYS H 4.950 . 4.950 4.314 4.250 4.367 . 0 0 "[ . 1 . 2]" 1
545 1 77 ARG H 1 105 TYR H 3.620 . 3.620 2.986 2.887 3.065 . 0 0 "[ . 1 . 2]" 1
546 1 105 TYR H 1 105 TYR QE 5.170 . 5.170 4.944 4.854 5.074 . 0 0 "[ . 1 . 2]" 1
547 1 76 LEU HA 1 105 TYR H 4.980 . 4.980 5.002 4.947 5.072 0.092 6 0 "[ . 1 . 2]" 1
548 1 104 VAL HA 1 105 TYR H 2.830 . 2.830 2.137 2.117 2.170 . 0 0 "[ . 1 . 2]" 1
549 1 105 TYR H 1 105 TYR HB2 3.620 . 3.620 2.629 2.575 2.675 . 0 0 "[ . 1 . 2]" 1
550 1 77 ARG QG 1 105 TYR H 3.980 . 3.980 2.600 2.351 3.025 . 0 0 "[ . 1 . 2]" 1
551 1 54 MET H 1 91 PRO QD 5.890 . 5.890 5.862 5.630 6.045 0.155 19 0 "[ . 1 . 2]" 1
552 1 54 MET H 1 55 THR MG 4.430 . 4.430 4.299 3.999 4.452 0.022 14 0 "[ . 1 . 2]" 1
553 1 36 ILE MG 1 54 MET H 3.830 . 3.830 3.907 3.851 3.995 0.165 16 0 "[ . 1 . 2]" 1
554 1 23 SER H 1 23 SER QB 3.190 . 3.190 2.932 2.525 3.298 0.108 11 0 "[ . 1 . 2]" 1
555 1 22 PRO HB2 1 23 SER H 4.330 . 4.330 2.925 1.903 4.155 . 0 0 "[ . 1 . 2]" 1
556 1 37 LYS H 1 99 GLU H 4.290 . 4.290 3.230 3.036 3.416 . 0 0 "[ . 1 . 2]" 1
557 1 36 ILE H 1 37 LYS H 4.530 . 4.530 4.236 4.193 4.286 . 0 0 "[ . 1 . 2]" 1
558 1 37 LYS H 1 38 LEU H 4.730 . 4.730 4.483 4.429 4.526 . 0 0 "[ . 1 . 2]" 1
559 1 35 TYR QD 1 37 LYS H 5.090 . 5.090 4.197 3.882 4.458 . 0 0 "[ . 1 . 2]" 1
560 1 36 ILE HA 1 37 LYS H 3.010 . 3.010 2.209 2.130 2.264 . 0 0 "[ . 1 . 2]" 1
561 1 37 LYS H 1 98 GLU HA 4.050 . 4.050 3.294 2.646 3.880 . 0 0 "[ . 1 . 2]" 1
562 1 37 LYS H 1 37 LYS QE 4.730 . 4.730 4.453 3.886 4.792 0.062 11 0 "[ . 1 . 2]" 1
563 1 37 LYS H 1 98 GLU HB2 4.390 . 4.390 2.678 2.020 3.362 . 0 0 "[ . 1 . 2]" 1
564 1 37 LYS H 1 37 LYS HB3 3.240 . 3.240 3.031 2.896 3.272 0.032 16 0 "[ . 1 . 2]" 1
565 1 37 LYS H 1 37 LYS QG 4.340 . 4.340 1.966 1.826 2.115 . 0 0 "[ . 1 . 2]" 1
566 1 37 LYS H 1 38 LEU QD 4.900 . 4.900 4.371 4.237 4.457 . 0 0 "[ . 1 . 2]" 1
567 1 37 LYS H 1 38 LEU HG 4.560 . 4.560 4.518 4.388 4.599 0.039 20 0 "[ . 1 . 2]" 1
568 1 47 GLU H 1 47 GLU HB2 3.850 . 3.850 3.930 3.858 3.966 0.116 18 0 "[ . 1 . 2]" 1
569 1 39 LYS H 1 102 ILE H 4.150 . 4.150 4.092 3.961 4.206 0.056 13 0 "[ . 1 . 2]" 1
570 1 39 LYS H 1 49 HIS HA 4.940 . 4.940 4.643 4.473 4.759 . 0 0 "[ . 1 . 2]" 1
571 1 38 LEU HA 1 39 LYS H 2.980 . 2.980 2.303 2.238 2.372 . 0 0 "[ . 1 . 2]" 1
572 1 39 LYS H 1 99 GLU HA 5.000 . 5.000 4.230 3.559 4.834 . 0 0 "[ . 1 . 2]" 1
573 1 39 LYS H 1 39 LYS HB3 3.360 . 3.360 2.612 2.499 2.719 . 0 0 "[ . 1 . 2]" 1
574 1 38 LEU HB3 1 39 LYS H 3.680 . 3.680 2.663 2.541 2.813 . 0 0 "[ . 1 . 2]" 1
575 1 38 LEU QD 1 39 LYS H 3.400 . 3.400 3.162 3.086 3.255 . 0 0 "[ . 1 . 2]" 1
576 1 39 LYS H 1 102 ILE MD 3.990 . 3.990 3.689 3.488 3.821 . 0 0 "[ . 1 . 2]" 1
577 1 64 SER H 1 66 CYS H 4.240 . 4.240 4.045 3.858 4.256 0.016 8 0 "[ . 1 . 2]" 1
578 1 66 CYS H 1 71 VAL H 6.000 . 6.000 5.642 5.423 5.805 . 0 0 "[ . 1 . 2]" 1
579 1 65 TYR QD 1 66 CYS H 3.540 . 3.540 2.928 2.745 2.993 . 0 0 "[ . 1 . 2]" 1
580 1 64 SER HA 1 66 CYS H 4.610 . 4.610 4.375 4.214 4.635 0.025 8 0 "[ . 1 . 2]" 1
581 1 66 CYS H 1 66 CYS HB3 3.700 . 3.700 3.473 2.587 3.588 . 0 0 "[ . 1 . 2]" 1
582 1 62 LYS QB 1 66 CYS H 4.930 . 4.930 4.587 4.370 4.749 . 0 0 "[ . 1 . 2]" 1
583 1 48 ILE MD 1 66 CYS H 5.790 . 5.790 5.299 5.153 5.448 . 0 0 "[ . 1 . 2]" 1
584 1 61 LEU MD2 1 66 CYS H 5.480 . 5.480 5.526 5.454 5.601 0.121 4 0 "[ . 1 . 2]" 1
585 1 40 VAL H 1 48 ILE H 3.500 . 3.500 2.855 2.727 3.007 . 0 0 "[ . 1 . 2]" 1
586 1 48 ILE H 1 50 PHE QD 5.700 . 5.700 5.377 5.244 5.497 . 0 0 "[ . 1 . 2]" 1
587 1 48 ILE H 1 49 HIS HD2 4.200 . 4.200 3.721 3.445 3.961 . 0 0 "[ . 1 . 2]" 1
588 1 48 ILE H 1 49 HIS HA 4.980 . 4.980 4.683 4.587 4.858 . 0 0 "[ . 1 . 2]" 1
589 1 47 GLU HA 1 48 ILE H 2.790 . 2.790 2.121 2.039 2.188 . 0 0 "[ . 1 . 2]" 1
590 1 48 ILE H 1 48 ILE QG 3.910 . 3.910 2.140 1.988 2.236 . 0 0 "[ . 1 . 2]" 1
591 1 48 ILE H 1 48 ILE MG 3.720 . 3.720 3.228 3.040 3.354 . 0 0 "[ . 1 . 2]" 1
592 1 40 VAL MG1 1 48 ILE H 4.500 . 4.500 4.239 4.085 4.349 . 0 0 "[ . 1 . 2]" 1
593 1 49 HIS H 1 50 PHE H 4.570 . 4.570 4.366 4.229 4.462 . 0 0 "[ . 1 . 2]" 1
594 1 39 LYS HB2 1 49 HIS H 5.030 . 5.030 4.902 4.747 4.999 . 0 0 "[ . 1 . 2]" 1
595 1 48 ILE QG 1 49 HIS H 4.650 . 4.650 4.246 4.158 4.340 . 0 0 "[ . 1 . 2]" 1
596 1 77 ARG H 1 106 GLN H 4.880 . 4.880 4.797 4.703 4.843 . 0 0 "[ . 1 . 2]" 1
597 1 43 GLN H 1 44 ASP H 3.180 . 3.180 2.680 2.559 2.810 . 0 0 "[ . 1 . 2]" 1
598 1 43 GLN H 1 105 TYR QD 4.340 . 4.340 3.630 3.409 3.890 . 0 0 "[ . 1 . 2]" 1
599 1 43 GLN H 1 105 TYR QE 4.580 . 4.580 4.490 4.328 4.635 0.055 5 0 "[ . 1 . 2]" 1
600 1 105 TYR HA 1 106 GLN H 2.610 . 2.610 2.254 2.181 2.309 . 0 0 "[ . 1 . 2]" 1
601 1 42 GLY QA 1 43 GLN H 2.990 . 2.990 2.273 2.247 2.309 . 0 0 "[ . 1 . 2]" 1
602 1 105 TYR HB3 1 106 GLN H 3.430 . 3.430 2.840 2.630 3.107 . 0 0 "[ . 1 . 2]" 1
603 1 43 GLN H 1 43 GLN HB3 2.940 . 2.940 2.435 2.345 2.514 . 0 0 "[ . 1 . 2]" 1
604 1 76 LEU HB2 1 106 GLN H 4.370 . 4.370 4.372 4.222 4.424 0.054 5 0 "[ . 1 . 2]" 1
605 1 86 ALA H 1 87 ASP H 4.680 . 4.680 4.570 4.522 4.616 . 0 0 "[ . 1 . 2]" 1
606 1 87 ASP H 1 88 ASN H 3.360 . 3.360 2.586 2.456 2.721 . 0 0 "[ . 1 . 2]" 1
607 1 76 LEU HA 1 106 GLN H 4.640 . 4.640 4.695 4.611 4.765 0.125 11 0 "[ . 1 . 2]" 1
608 1 86 ALA HA 1 87 ASP H 3.060 . 3.060 2.437 2.351 2.555 . 0 0 "[ . 1 . 2]" 1
609 1 87 ASP H 1 87 ASP QB 3.110 . 3.110 2.430 2.188 2.686 . 0 0 "[ . 1 . 2]" 1
610 1 86 ALA MB 1 87 ASP H 3.020 . 3.020 2.235 2.043 2.388 . 0 0 "[ . 1 . 2]" 1
611 1 50 PHE H 1 51 LYS H 4.540 . 4.540 4.406 4.356 4.477 . 0 0 "[ . 1 . 2]" 1
612 1 37 LYS HA 1 51 LYS H 5.430 . 5.430 4.902 4.724 5.134 . 0 0 "[ . 1 . 2]" 1
613 1 108 GLN H 1 109 THR H 3.430 . 3.430 2.145 1.780 2.754 0.020 17 0 "[ . 1 . 2]" 1
614 1 107 GLU HA 1 108 GLN H 2.710 . 2.710 2.536 2.316 2.838 0.128 6 0 "[ . 1 . 2]" 1
615 1 108 GLN H 1 108 GLN QG 3.310 . 3.310 2.459 1.823 3.342 0.032 18 0 "[ . 1 . 2]" 1
616 1 83 GLN H 1 84 ARG H 4.480 . 4.480 4.378 4.313 4.459 . 0 0 "[ . 1 . 2]" 1
617 1 84 ARG H 1 84 ARG QD 4.080 . 4.080 3.604 1.758 4.145 0.065 1 0 "[ . 1 . 2]" 1
618 1 83 GLN QG 1 84 ARG H 3.700 . 3.700 3.806 3.567 3.891 0.191 11 0 "[ . 1 . 2]" 1
619 1 84 ARG H 1 84 ARG QG 3.730 . 3.730 2.272 1.845 3.437 . 0 0 "[ . 1 . 2]" 1
620 1 56 THR MG 1 57 HIS H 3.560 . 3.560 2.815 2.608 3.192 . 0 0 "[ . 1 . 2]" 1
621 1 83 GLN HA 1 84 ARG H 2.700 . 2.700 2.160 2.127 2.232 . 0 0 "[ . 1 . 2]" 1
622 1 83 GLN HB2 1 84 ARG H 3.360 . 3.360 3.185 2.968 3.292 . 0 0 "[ . 1 . 2]" 1
623 1 84 ARG H 1 84 ARG QB 2.800 . 2.800 2.539 2.282 2.737 . 0 0 "[ . 1 . 2]" 1
624 1 65 TYR H 1 65 TYR QD 3.700 . 3.700 3.758 3.573 3.865 0.165 20 0 "[ . 1 . 2]" 1
625 1 64 SER QB 1 65 TYR H 3.110 . 3.110 2.558 2.433 2.747 . 0 0 "[ . 1 . 2]" 1
626 1 61 LEU HA 1 65 TYR H 4.560 . 4.560 4.370 4.179 4.526 . 0 0 "[ . 1 . 2]" 1
627 1 65 TYR H 1 65 TYR HB3 3.370 . 3.370 2.112 2.078 2.140 . 0 0 "[ . 1 . 2]" 1
628 1 61 LEU MD2 1 65 TYR H 4.320 . 4.320 3.552 3.407 3.660 . 0 0 "[ . 1 . 2]" 1
629 1 81 GLU H 1 103 GLU H 5.060 . 5.060 4.959 4.587 5.155 0.095 4 0 "[ . 1 . 2]" 1
630 1 102 ILE H 1 103 GLU H 4.550 . 4.550 4.522 4.477 4.571 0.021 17 0 "[ . 1 . 2]" 1
631 1 80 PHE HA 1 103 GLU H 4.380 . 4.380 3.186 2.870 3.394 . 0 0 "[ . 1 . 2]" 1
632 1 102 ILE HA 1 103 GLU H 2.950 . 2.950 2.292 2.265 2.322 . 0 0 "[ . 1 . 2]" 1
633 1 102 ILE MG 1 103 GLU H 3.140 . 3.140 2.288 2.161 2.429 . 0 0 "[ . 1 . 2]" 1
634 1 81 GLU H 1 82 GLY H 3.400 . 3.400 2.719 2.574 2.826 . 0 0 "[ . 1 . 2]" 1
635 1 80 PHE QD 1 82 GLY H 5.130 . 5.130 5.160 5.113 5.211 0.081 4 0 "[ . 1 . 2]" 1
636 1 80 PHE HA 1 82 GLY H 4.100 . 4.100 3.468 3.379 3.555 . 0 0 "[ . 1 . 2]" 1
637 1 82 GLY H 1 83 GLN HA 5.100 . 5.100 5.003 4.915 5.119 0.019 20 0 "[ . 1 . 2]" 1
638 1 82 GLY H 1 82 GLY HA3 2.920 . 2.920 2.912 2.870 2.924 0.004 5 0 "[ . 1 . 2]" 1
639 1 82 GLY H 1 83 GLN QG 4.740 . 4.740 4.166 4.031 4.627 . 0 0 "[ . 1 . 2]" 1
640 1 82 GLY H 1 83 GLN HB3 4.840 . 4.840 5.002 4.902 5.072 0.232 4 0 "[ . 1 . 2]" 1
641 1 77 ARG HA 1 78 PHE H 3.010 . 3.010 2.164 2.118 2.204 . 0 0 "[ . 1 . 2]" 1
642 1 78 PHE H 1 78 PHE HB3 3.780 . 3.780 3.621 3.573 3.668 . 0 0 "[ . 1 . 2]" 1
643 1 78 PHE H 1 78 PHE HB2 3.680 . 3.680 3.285 3.177 3.386 . 0 0 "[ . 1 . 2]" 1
644 1 76 LEU QD 1 78 PHE H 4.040 . 4.040 3.397 3.254 3.559 . 0 0 "[ . 1 . 2]" 1
645 1 78 PHE H 1 104 VAL QG 4.750 . 4.750 3.875 3.770 3.979 . 0 0 "[ . 1 . 2]" 1
646 1 38 LEU H 1 99 GLU H 5.120 . 5.120 4.611 4.325 4.841 . 0 0 "[ . 1 . 2]" 1
647 1 38 LEU H 1 49 HIS HB3 5.880 . 5.880 4.972 4.649 5.322 . 0 0 "[ . 1 . 2]" 1
648 1 38 LEU H 1 50 PHE HB3 6.000 . 6.000 4.903 4.761 5.093 . 0 0 "[ . 1 . 2]" 1
649 1 37 LYS QE 1 38 LEU H 5.760 . 5.760 5.193 4.299 6.024 0.264 5 0 "[ . 1 . 2]" 1
650 1 38 LEU H 1 52 VAL HB 6.000 . 6.000 6.142 6.078 6.255 0.255 4 0 "[ . 1 . 2]" 1
651 1 37 LYS HB3 1 38 LEU H 4.070 . 4.070 3.997 3.840 4.104 0.034 6 0 "[ . 1 . 2]" 1
652 1 38 LEU H 1 38 LEU HB2 3.520 . 3.520 2.688 2.627 2.754 . 0 0 "[ . 1 . 2]" 1
653 1 79 LEU H 1 80 PHE H 4.440 . 4.440 4.431 4.386 4.468 0.028 10 0 "[ . 1 . 2]" 1
654 1 80 PHE H 1 81 GLU H 4.420 . 4.420 4.167 4.079 4.223 . 0 0 "[ . 1 . 2]" 1
655 1 80 PHE H 1 83 GLN H 3.490 . 3.490 2.571 2.462 2.678 . 0 0 "[ . 1 . 2]" 1
656 1 80 PHE H 1 80 PHE QD 4.460 . 4.460 4.331 4.269 4.422 . 0 0 "[ . 1 . 2]" 1
657 1 77 ARG H 1 105 TYR QD 5.070 . 5.070 4.983 4.837 5.125 0.055 12 0 "[ . 1 . 2]" 1
658 1 79 LEU HA 1 80 PHE H 2.960 . 2.960 2.254 2.195 2.326 . 0 0 "[ . 1 . 2]" 1
659 1 76 LEU HA 1 77 ARG H 3.030 . 3.030 2.376 2.287 2.508 . 0 0 "[ . 1 . 2]" 1
660 1 77 ARG H 1 78 PHE HA 4.900 . 4.900 4.824 4.679 4.923 0.023 11 0 "[ . 1 . 2]" 1
661 1 77 ARG H 1 104 VAL HA 4.760 . 4.760 4.563 4.384 4.740 . 0 0 "[ . 1 . 2]" 1
662 1 80 PHE H 1 83 GLN HA 4.770 . 4.770 4.498 4.440 4.562 . 0 0 "[ . 1 . 2]" 1
663 1 77 ARG H 1 106 GLN HA 3.810 . 3.810 3.299 3.181 3.438 . 0 0 "[ . 1 . 2]" 1
664 1 80 PHE H 1 84 ARG HA 4.160 . 4.160 3.810 3.639 4.011 . 0 0 "[ . 1 . 2]" 1
665 1 80 PHE H 1 82 GLY HA3 5.820 . 5.820 5.609 5.489 5.709 . 0 0 "[ . 1 . 2]" 1
666 1 80 PHE H 1 80 PHE HB2 3.780 . 3.780 3.367 3.296 3.418 . 0 0 "[ . 1 . 2]" 1
667 1 80 PHE H 1 80 PHE HB3 3.720 . 3.720 2.771 2.701 2.887 . 0 0 "[ . 1 . 2]" 1
668 1 77 ARG H 1 105 TYR HB2 4.240 . 4.240 3.633 3.471 3.787 . 0 0 "[ . 1 . 2]" 1
669 1 80 PHE H 1 83 GLN QG 4.290 . 4.290 2.692 2.533 2.805 . 0 0 "[ . 1 . 2]" 1
670 1 80 PHE H 1 83 GLN HB3 4.710 . 4.710 4.733 4.507 4.835 0.125 4 0 "[ . 1 . 2]" 1
671 1 79 LEU HB2 1 80 PHE H 3.610 . 3.610 2.555 2.477 2.628 . 0 0 "[ . 1 . 2]" 1
672 1 76 LEU HB2 1 77 ARG H 3.300 . 3.300 2.824 2.603 2.930 . 0 0 "[ . 1 . 2]" 1
673 1 79 LEU HB3 1 80 PHE H 3.930 . 3.930 3.549 3.476 3.667 . 0 0 "[ . 1 . 2]" 1
674 1 76 LEU QD 1 77 ARG H 3.240 . 3.240 2.194 1.967 2.435 . 0 0 "[ . 1 . 2]" 1
675 1 79 LEU MD2 1 80 PHE H 4.550 . 4.550 4.616 4.546 4.798 0.248 12 0 "[ . 1 . 2]" 1
676 1 72 PRO HA 1 73 MET H 2.930 . 2.930 2.160 2.124 2.202 . 0 0 "[ . 1 . 2]" 1
677 1 73 MET H 1 74 ASN HB3 5.810 . 5.810 4.977 4.788 5.169 . 0 0 "[ . 1 . 2]" 1
678 1 73 MET H 1 73 MET QG 3.390 . 3.390 2.458 2.109 2.980 . 0 0 "[ . 1 . 2]" 1
679 1 72 PRO QB 1 73 MET H 3.520 . 3.520 3.255 3.064 3.410 . 0 0 "[ . 1 . 2]" 1
680 1 73 MET H 1 76 LEU HB3 6.000 . 6.000 6.122 6.014 6.192 0.192 13 0 "[ . 1 . 2]" 1
681 1 79 LEU HA 1 85 ILE H 3.950 . 3.950 2.756 2.601 2.965 . 0 0 "[ . 1 . 2]" 1
682 1 84 ARG HA 1 85 ILE H 3.180 . 3.180 2.174 2.137 2.200 . 0 0 "[ . 1 . 2]" 1
683 1 78 PHE HB2 1 85 ILE H 4.720 . 4.720 3.212 2.864 3.499 . 0 0 "[ . 1 . 2]" 1
684 1 85 ILE H 1 85 ILE HB 3.480 . 3.480 2.733 2.629 2.783 . 0 0 "[ . 1 . 2]" 1
685 1 79 LEU HB3 1 85 ILE H 4.660 . 4.660 4.144 3.944 4.474 . 0 0 "[ . 1 . 2]" 1
686 1 41 ILE H 1 48 ILE H 5.100 . 5.100 5.037 4.947 5.112 0.012 20 0 "[ . 1 . 2]" 1
687 1 41 ILE H 1 42 GLY H 4.550 . 4.550 4.401 4.372 4.439 . 0 0 "[ . 1 . 2]" 1
688 1 41 ILE H 1 104 VAL H 4.550 . 4.550 4.132 3.871 4.294 . 0 0 "[ . 1 . 2]" 1
689 1 40 VAL HA 1 41 ILE H 2.990 . 2.990 2.181 2.169 2.199 . 0 0 "[ . 1 . 2]" 1
690 1 41 ILE H 1 103 GLU HA 3.740 . 3.740 3.505 3.294 3.756 0.016 16 0 "[ . 1 . 2]" 1
691 1 40 VAL HB 1 41 ILE H 4.400 . 4.400 4.180 4.117 4.225 . 0 0 "[ . 1 . 2]" 1
692 1 41 ILE H 1 101 VAL HB 4.490 . 4.490 4.267 3.967 4.427 . 0 0 "[ . 1 . 2]" 1
693 1 41 ILE H 1 41 ILE HB 3.340 . 3.340 3.122 3.028 3.244 . 0 0 "[ . 1 . 2]" 1
694 1 39 LYS QD 1 41 ILE H 3.710 . 3.710 3.478 3.277 3.796 0.086 8 0 "[ . 1 . 2]" 1
695 1 40 VAL MG2 1 41 ILE H 4.410 . 4.410 3.945 3.887 3.989 . 0 0 "[ . 1 . 2]" 1
696 1 41 ILE H 1 102 ILE MG 4.700 . 4.700 3.804 3.637 3.990 . 0 0 "[ . 1 . 2]" 1
697 1 41 ILE H 1 102 ILE MD 5.250 . 5.250 5.133 5.025 5.223 . 0 0 "[ . 1 . 2]" 1
698 1 40 VAL H 1 50 PHE QD 4.400 . 4.400 4.201 4.059 4.292 . 0 0 "[ . 1 . 2]" 1
699 1 40 VAL H 1 49 HIS HD2 4.860 . 4.860 4.843 4.601 5.060 0.200 12 0 "[ . 1 . 2]" 1
700 1 40 VAL H 1 49 HIS HA 3.830 . 3.830 3.705 3.634 3.788 . 0 0 "[ . 1 . 2]" 1
701 1 39 LYS HA 1 40 VAL H 3.060 . 3.060 2.080 2.042 2.130 . 0 0 "[ . 1 . 2]" 1
702 1 40 VAL H 1 48 ILE HA 4.770 . 4.770 4.756 4.687 4.805 0.035 17 0 "[ . 1 . 2]" 1
703 1 40 VAL H 1 40 VAL HB 3.440 . 3.440 2.484 2.456 2.523 . 0 0 "[ . 1 . 2]" 1
704 1 40 VAL H 1 48 ILE HB 4.380 . 4.380 4.385 4.325 4.420 0.040 16 0 "[ . 1 . 2]" 1
705 1 40 VAL H 1 41 ILE HB 5.940 . 5.940 5.286 5.201 5.410 . 0 0 "[ . 1 . 2]" 1
706 1 40 VAL H 1 102 ILE HB 6.000 . 6.000 5.067 4.850 5.301 . 0 0 "[ . 1 . 2]" 1
707 1 39 LYS HB2 1 40 VAL H 4.330 . 4.330 3.973 3.906 4.027 . 0 0 "[ . 1 . 2]" 1
708 1 39 LYS QD 1 40 VAL H 4.470 . 4.470 3.545 3.368 3.785 . 0 0 "[ . 1 . 2]" 1
709 1 40 VAL H 1 40 VAL MG1 3.850 . 3.850 3.770 3.754 3.793 . 0 0 "[ . 1 . 2]" 1
710 1 49 HIS HD2 1 50 PHE H 5.660 . 5.660 5.497 5.346 5.640 . 0 0 "[ . 1 . 2]" 1
711 1 49 HIS HA 1 50 PHE H 2.960 . 2.960 2.151 2.130 2.178 . 0 0 "[ . 1 . 2]" 1
712 1 39 LYS HA 1 50 PHE H 3.870 . 3.870 3.237 3.073 3.352 . 0 0 "[ . 1 . 2]" 1
713 1 50 PHE H 1 50 PHE HB3 3.910 . 3.910 3.741 3.666 3.806 . 0 0 "[ . 1 . 2]" 1
714 1 50 PHE H 1 50 PHE HB2 3.670 . 3.670 2.614 2.483 2.723 . 0 0 "[ . 1 . 2]" 1
715 1 39 LYS HB2 1 50 PHE H 4.360 . 4.360 4.394 4.145 4.497 0.137 1 0 "[ . 1 . 2]" 1
716 1 36 ILE MG 1 52 VAL H 3.710 . 3.710 3.720 3.513 3.829 0.119 2 0 "[ . 1 . 2]" 1
717 1 35 TYR QD 1 52 VAL H 4.950 . 4.950 4.434 3.483 4.918 . 0 0 "[ . 1 . 2]" 1
718 1 37 LYS HA 1 52 VAL H 3.020 . 3.020 2.688 2.380 2.961 . 0 0 "[ . 1 . 2]" 1
719 1 52 VAL H 1 52 VAL HB 4.180 . 4.180 3.801 3.730 3.860 . 0 0 "[ . 1 . 2]" 1
720 1 52 VAL H 1 52 VAL MG2 3.320 . 3.320 2.162 2.039 2.274 . 0 0 "[ . 1 . 2]" 1
721 1 36 ILE MD 1 52 VAL H 5.760 . 5.760 5.474 5.297 5.615 . 0 0 "[ . 1 . 2]" 1
722 1 35 TYR H 1 36 ILE H 4.430 . 4.430 4.369 4.334 4.440 0.010 14 0 "[ . 1 . 2]" 1
723 1 35 TYR HA 1 36 ILE H 3.310 . 3.310 2.481 2.333 2.617 . 0 0 "[ . 1 . 2]" 1
724 1 35 TYR HB3 1 36 ILE H 4.000 . 4.000 3.662 3.408 3.826 . 0 0 "[ . 1 . 2]" 1
725 1 35 TYR HB2 1 36 ILE H 3.980 . 3.980 2.235 1.979 2.458 . 0 0 "[ . 1 . 2]" 1
726 1 36 ILE H 1 52 VAL HB 5.590 . 5.590 5.356 5.118 5.615 0.025 3 0 "[ . 1 . 2]" 1
727 1 36 ILE H 1 36 ILE HG13 4.750 . 4.750 4.633 4.557 4.692 . 0 0 "[ . 1 . 2]" 1
728 1 36 ILE H 1 36 ILE MG 3.430 . 3.430 2.331 2.237 2.411 . 0 0 "[ . 1 . 2]" 1
729 1 101 VAL H 1 102 ILE H 4.700 . 4.700 4.298 4.201 4.365 . 0 0 "[ . 1 . 2]" 1
730 1 101 VAL HA 1 102 ILE H 3.070 . 3.070 2.110 2.068 2.144 . 0 0 "[ . 1 . 2]" 1
731 1 101 VAL HB 1 102 ILE H 4.260 . 4.260 3.098 2.924 3.246 . 0 0 "[ . 1 . 2]" 1
732 1 102 ILE H 1 102 ILE HB 3.490 . 3.490 2.423 2.375 2.535 . 0 0 "[ . 1 . 2]" 1
733 1 39 LYS QD 1 102 ILE H 3.890 . 3.890 3.638 3.369 3.905 0.015 5 0 "[ . 1 . 2]" 1
734 1 38 LEU HB3 1 102 ILE H 5.190 . 5.190 4.899 4.699 5.162 . 0 0 "[ . 1 . 2]" 1
735 1 101 VAL QG 1 102 ILE H 3.730 . 3.730 3.452 3.368 3.520 . 0 0 "[ . 1 . 2]" 1
736 1 102 ILE H 1 102 ILE MD 3.900 . 3.900 2.503 2.376 2.605 . 0 0 "[ . 1 . 2]" 1
737 1 58 LEU H 1 59 LYS H 4.010 . 4.010 2.649 2.531 2.783 . 0 0 "[ . 1 . 2]" 1
738 1 58 LEU H 1 61 LEU H 5.570 . 5.570 5.210 5.032 5.337 . 0 0 "[ . 1 . 2]" 1
739 1 58 LEU H 1 58 LEU HG 3.250 . 3.250 2.379 2.245 2.489 . 0 0 "[ . 1 . 2]" 1
740 1 56 THR MG 1 58 LEU H 4.450 . 4.450 3.941 3.610 4.242 . 0 0 "[ . 1 . 2]" 1
741 1 58 LEU H 1 58 LEU QD 3.780 . 3.780 3.110 3.011 3.187 . 0 0 "[ . 1 . 2]" 1
742 1 38 LEU HA 1 99 GLU H 4.450 . 4.450 3.161 2.900 3.410 . 0 0 "[ . 1 . 2]" 1
743 1 36 ILE HA 1 99 GLU H 5.120 . 5.120 5.071 4.813 5.274 0.154 18 0 "[ . 1 . 2]" 1
744 1 98 GLU HA 1 99 GLU H 3.240 . 3.240 2.164 2.068 2.254 . 0 0 "[ . 1 . 2]" 1
745 1 37 LYS QE 1 99 GLU H 5.080 . 5.080 4.009 3.191 4.452 . 0 0 "[ . 1 . 2]" 1
746 1 99 GLU H 1 99 GLU QB 3.560 . 3.560 3.052 2.938 3.235 . 0 0 "[ . 1 . 2]" 1
747 1 98 GLU HB2 1 99 GLU H 3.750 . 3.750 2.811 2.575 2.962 . 0 0 "[ . 1 . 2]" 1
748 1 98 GLU HB3 1 99 GLU H 4.210 . 4.210 3.717 3.448 3.888 . 0 0 "[ . 1 . 2]" 1
749 1 37 LYS HB3 1 99 GLU H 5.280 . 5.280 4.871 4.632 5.137 . 0 0 "[ . 1 . 2]" 1
750 1 38 LEU HB3 1 99 GLU H 6.000 . 6.000 5.455 5.237 5.695 . 0 0 "[ . 1 . 2]" 1
751 1 80 PHE QD 1 81 GLU H 3.890 . 3.890 3.227 3.055 3.490 . 0 0 "[ . 1 . 2]" 1
752 1 80 PHE HA 1 81 GLU H 3.190 . 3.190 2.173 2.117 2.206 . 0 0 "[ . 1 . 2]" 1
753 1 81 GLU H 1 82 GLY HA2 5.090 . 5.090 5.012 4.853 5.115 0.025 11 0 "[ . 1 . 2]" 1
754 1 80 PHE HB2 1 81 GLU H 4.410 . 4.410 4.218 4.180 4.314 . 0 0 "[ . 1 . 2]" 1
755 1 80 PHE HB3 1 81 GLU H 4.610 . 4.610 4.277 4.208 4.343 . 0 0 "[ . 1 . 2]" 1
756 1 81 GLU H 1 81 GLU HB3 4.090 . 4.090 4.039 3.965 4.111 0.021 4 0 "[ . 1 . 2]" 1
757 1 79 LEU H 1 105 TYR H 5.020 . 5.020 4.545 4.383 4.707 . 0 0 "[ . 1 . 2]" 1
758 1 79 LEU H 1 105 TYR QD 4.860 . 4.860 4.820 4.662 4.919 0.059 12 0 "[ . 1 . 2]" 1
759 1 79 LEU H 1 105 TYR QE 5.500 . 5.500 5.273 5.105 5.499 . 0 0 "[ . 1 . 2]" 1
760 1 78 PHE HA 1 79 LEU H 2.980 . 2.980 2.117 2.082 2.143 . 0 0 "[ . 1 . 2]" 1
761 1 79 LEU H 1 104 VAL HA 3.610 . 3.610 3.149 3.010 3.336 . 0 0 "[ . 1 . 2]" 1
762 1 78 PHE HB2 1 79 LEU H 4.000 . 4.000 3.749 3.638 3.828 . 0 0 "[ . 1 . 2]" 1
763 1 79 LEU H 1 103 GLU HG2 5.500 . 5.500 5.411 4.445 5.606 0.106 4 0 "[ . 1 . 2]" 1
764 1 79 LEU H 1 103 GLU HG3 5.500 . 5.500 4.693 4.502 5.579 0.079 15 0 "[ . 1 . 2]" 1
765 1 79 LEU H 1 79 LEU HB2 4.180 . 4.180 3.785 3.726 3.890 . 0 0 "[ . 1 . 2]" 1
766 1 79 LEU H 1 85 ILE QG 4.410 . 4.410 3.712 3.412 3.879 . 0 0 "[ . 1 . 2]" 1
767 1 77 ARG QB 1 79 LEU H 5.170 . 5.170 4.935 4.643 5.203 0.033 17 0 "[ . 1 . 2]" 1
768 1 79 LEU H 1 79 LEU HG 3.560 . 3.560 2.321 2.062 2.501 . 0 0 "[ . 1 . 2]" 1
769 1 79 LEU H 1 79 LEU HB3 3.620 . 3.620 3.462 3.353 3.559 . 0 0 "[ . 1 . 2]" 1
770 1 79 LEU H 1 102 ILE MG 3.400 . 3.400 3.176 3.039 3.325 . 0 0 "[ . 1 . 2]" 1
771 1 79 LEU H 1 104 VAL QG . . 4.550 3.353 3.158 3.488 . 0 0 "[ . 1 . 2]" 1
772 1 74 ASN H 1 74 ASN HD21 4.670 . 4.670 2.295 2.188 2.544 . 0 0 "[ . 1 . 2]" 1
773 1 73 MET ME 1 74 ASN HD21 4.370 . 4.370 3.224 2.130 4.215 . 0 0 "[ . 1 . 2]" 1
774 1 106 GLN H 1 106 GLN HE21 4.950 . 4.950 4.520 4.282 4.722 . 0 0 "[ . 1 . 2]" 1
775 1 83 GLN HE22 1 83 GLN QG 3.540 . 3.540 3.219 3.203 3.268 . 0 0 "[ . 1 . 2]" 1
776 1 83 GLN HB3 1 83 GLN HE22 4.550 . 4.550 4.224 3.701 4.308 . 0 0 "[ . 1 . 2]" 1
777 1 81 GLU HB2 1 83 GLN HE22 4.980 . 4.980 3.683 3.192 4.138 . 0 0 "[ . 1 . 2]" 1
778 1 83 GLN HE22 1 94 LEU MD2 4.040 . 4.040 2.605 2.433 2.789 . 0 0 "[ . 1 . 2]" 1
779 1 43 GLN HE22 1 106 GLN H 4.250 . 4.250 2.344 1.976 2.635 . 0 0 "[ . 1 . 2]" 1
780 1 43 GLN HE22 1 105 TYR H 4.980 . 4.980 4.975 4.721 5.047 0.067 8 0 "[ . 1 . 2]" 1
781 1 43 GLN HA 1 43 GLN HE22 5.340 . 5.340 5.323 5.274 5.362 0.022 19 0 "[ . 1 . 2]" 1
782 1 43 GLN HE22 1 43 GLN QG 3.440 . 3.440 3.281 3.274 3.294 . 0 0 "[ . 1 . 2]" 1
783 1 43 GLN HB3 1 43 GLN HE22 4.310 . 4.310 4.143 4.085 4.203 . 0 0 "[ . 1 . 2]" 1
784 1 73 MET H 1 74 ASN HD22 5.100 . 5.100 4.576 4.085 4.916 . 0 0 "[ . 1 . 2]" 1
785 1 82 GLY H 1 83 GLN HE21 5.440 . 5.440 5.423 4.886 5.519 0.079 13 0 "[ . 1 . 2]" 1
786 1 74 ASN H 1 74 ASN HD22 4.550 . 4.550 3.260 3.032 3.442 . 0 0 "[ . 1 . 2]" 1
787 1 72 PRO HA 1 74 ASN HD22 4.360 . 4.360 4.341 3.890 4.457 0.097 14 0 "[ . 1 . 2]" 1
788 1 74 ASN HB3 1 74 ASN HD22 3.480 . 3.480 3.477 3.465 3.489 0.009 18 0 "[ . 1 . 2]" 1
789 1 74 ASN HB2 1 74 ASN HD22 4.050 . 4.050 4.039 4.023 4.053 0.003 7 0 "[ . 1 . 2]" 1
790 1 73 MET QG 1 74 ASN HD22 5.110 . 5.110 4.596 4.124 5.138 0.028 3 0 "[ . 1 . 2]" 1
791 1 83 GLN HE21 1 83 GLN QG 3.040 . 3.040 2.134 2.111 2.156 . 0 0 "[ . 1 . 2]" 1
792 1 83 GLN HB3 1 83 GLN HE21 4.630 . 4.630 3.824 2.865 3.977 . 0 0 "[ . 1 . 2]" 1
793 1 81 GLU HB3 1 83 GLN HE21 5.080 . 5.080 4.564 3.712 5.004 . 0 0 "[ . 1 . 2]" 1
794 1 83 GLN HE21 1 94 LEU MD1 4.930 . 4.930 3.781 3.424 4.813 . 0 0 "[ . 1 . 2]" 1
795 1 83 GLN HE21 1 94 LEU MD2 4.140 . 4.140 2.608 2.314 3.057 . 0 0 "[ . 1 . 2]" 1
796 1 43 GLN HE21 1 106 GLN H 4.150 . 4.150 3.776 3.464 4.012 . 0 0 "[ . 1 . 2]" 1
797 1 43 GLN HE21 1 44 ASP HA 5.020 . 5.020 3.864 3.486 4.314 . 0 0 "[ . 1 . 2]" 1
798 1 77 ARG HE 1 105 TYR HB2 4.780 . 4.780 3.504 2.206 4.846 0.066 11 0 "[ . 1 . 2]" 1
799 1 77 ARG HE 1 77 ARG QG 3.880 . 3.880 2.501 2.205 2.913 . 0 0 "[ . 1 . 2]" 1
800 1 21 LYS H 1 22 PRO HD2 4.930 . 4.930 4.831 4.711 4.937 0.007 10 0 "[ . 1 . 2]" 1
801 1 21 LYS H 1 21 LYS QD 3.000 . 3.000 2.279 1.796 2.777 0.004 17 0 "[ . 1 . 2]" 1
802 1 85 ILE HA 1 86 ALA H 3.140 . 3.140 2.150 2.122 2.174 . 0 0 "[ . 1 . 2]" 1
803 1 86 ALA H 1 89 HIS HB3 4.450 . 4.450 3.564 3.368 3.850 . 0 0 "[ . 1 . 2]" 1
804 1 85 ILE HB 1 86 ALA H 4.610 . 4.610 4.302 4.216 4.346 . 0 0 "[ . 1 . 2]" 1
805 1 86 ALA H 1 94 LEU HG 6.000 . 6.000 5.884 5.644 6.014 0.014 8 0 "[ . 1 . 2]" 1
806 1 16 SER H 1 16 SER QB 3.090 . 3.090 2.684 2.264 3.261 0.171 19 0 "[ . 1 . 2]" 1
807 1 57 HIS HD2 1 58 LEU H 4.830 . 4.830 4.941 4.806 5.118 0.288 1 0 "[ . 1 . 2]" 1
808 1 57 HIS H 1 57 HIS HD2 3.890 . 3.890 2.667 2.035 3.403 . 0 0 "[ . 1 . 2]" 1
809 1 104 VAL HA 1 105 TYR QD 4.340 . 4.340 4.110 3.788 4.257 . 0 0 "[ . 1 . 2]" 1
810 1 77 ARG QB 1 105 TYR QD 4.670 . 4.670 4.408 4.136 4.777 0.107 7 0 "[ . 1 . 2]" 1
811 1 77 ARG QG 1 105 TYR QD 3.780 . 3.780 2.541 2.333 2.818 . 0 0 "[ . 1 . 2]" 1
812 1 79 LEU HG 1 105 TYR QD 4.170 . 4.170 3.237 3.084 3.517 . 0 0 "[ . 1 . 2]" 1
813 1 65 TYR QD 1 68 ARG H 5.830 . 5.830 5.596 5.465 5.755 . 0 0 "[ . 1 . 2]" 1
814 1 65 TYR QD 1 66 CYS HB2 5.140 . 5.140 4.494 3.147 4.837 . 0 0 "[ . 1 . 2]" 1
815 1 62 LYS HA 1 65 TYR QD 3.600 . 3.600 2.981 2.739 3.389 . 0 0 "[ . 1 . 2]" 1
816 1 65 TYR QD 1 68 ARG QB 4.730 . 4.730 4.529 4.157 4.769 0.039 9 0 "[ . 1 . 2]" 1
817 1 65 TYR QD 1 69 GLN QB 4.210 . 4.210 3.981 3.797 4.102 . 0 0 "[ . 1 . 2]" 1
818 1 62 LYS QD 1 65 TYR QD 5.190 . 5.190 4.882 4.604 5.261 0.071 20 0 "[ . 1 . 2]" 1
819 1 35 TYR QD 1 36 ILE H 3.960 . 3.960 3.050 2.787 3.224 . 0 0 "[ . 1 . 2]" 1
820 1 67 GLN H 1 69 GLN HE21 6.000 . 6.000 5.849 5.651 6.001 0.001 2 0 "[ . 1 . 2]" 1
821 1 44 ASP H 1 106 GLN HE21 6.000 . 6.000 5.873 5.408 6.145 0.145 2 0 "[ . 1 . 2]" 1
822 1 69 GLN H 1 69 GLN HE21 4.700 . 4.700 3.257 3.042 3.471 . 0 0 "[ . 1 . 2]" 1
823 1 34 GLU HA 1 35 TYR QD 4.390 . 4.390 3.450 3.056 3.984 . 0 0 "[ . 1 . 2]" 1
824 1 106 GLN HB3 1 106 GLN HE21 4.440 . 4.440 1.830 1.736 1.961 0.064 6 0 "[ . 1 . 2]" 1
825 1 106 GLN HB2 1 106 GLN HE21 4.310 . 4.310 2.763 2.610 2.934 . 0 0 "[ . 1 . 2]" 1
826 1 34 GLU QB 1 35 TYR QD 4.890 . 4.890 4.868 4.271 5.056 0.166 17 0 "[ . 1 . 2]" 1
827 1 35 TYR QD 1 51 LYS QG 4.140 . 4.140 2.820 2.148 4.124 . 0 0 "[ . 1 . 2]" 1
828 1 35 TYR QD 1 51 LYS QD 4.510 . 4.510 3.069 2.209 4.190 . 0 0 "[ . 1 . 2]" 1
829 1 89 HIS HD2 1 90 THR H 3.590 . 3.590 3.482 2.803 3.659 0.069 5 0 "[ . 1 . 2]" 1
830 1 89 HIS HD2 1 93 GLU HB2 4.450 . 4.450 4.091 3.486 4.310 . 0 0 "[ . 1 . 2]" 1
831 1 89 HIS HD2 1 93 GLU HB3 4.300 . 4.300 3.158 2.261 3.534 . 0 0 "[ . 1 . 2]" 1
832 1 49 HIS H 1 49 HIS HD2 3.990 . 3.990 2.656 2.467 2.833 . 0 0 "[ . 1 . 2]" 1
833 1 39 LYS QE 1 49 HIS HD2 4.520 . 4.520 4.467 4.010 4.745 0.225 5 0 "[ . 1 . 2]" 1
834 1 39 LYS HB2 1 49 HIS HD2 3.950 . 3.950 3.523 3.203 3.699 . 0 0 "[ . 1 . 2]" 1
835 1 39 LYS HB3 1 49 HIS HD2 4.870 . 4.870 4.897 4.500 5.000 0.130 8 0 "[ . 1 . 2]" 1
836 1 39 LYS HG3 1 49 HIS HD2 4.560 . 4.560 2.749 2.154 2.959 . 0 0 "[ . 1 . 2]" 1
837 1 39 LYS HG2 1 49 HIS HD2 4.290 . 4.290 3.235 2.909 3.476 . 0 0 "[ . 1 . 2]" 1
838 1 65 TYR HE2 1 66 CYS H 4.900 . 4.900 4.819 4.712 4.949 0.049 20 0 "[ . 1 . 2]" 1
839 1 65 TYR HE2 1 78 PHE QD 4.760 . 4.760 3.659 3.297 4.294 . 0 0 "[ . 1 . 2]" 1
840 1 65 TYR HE2 1 106 GLN HE21 4.310 . 4.310 4.240 3.575 4.380 0.070 9 0 "[ . 1 . 2]" 1
841 1 43 GLN QG 1 105 TYR QE 4.530 . 4.530 4.427 4.046 4.602 0.072 9 0 "[ . 1 . 2]" 1
842 1 103 GLU HG2 1 105 TYR QE 4.090 . 4.090 2.839 2.464 3.181 . 0 0 "[ . 1 . 2]" 1
843 1 103 GLU HG3 1 105 TYR QE 4.090 . 4.090 3.158 2.948 3.836 . 0 0 "[ . 1 . 2]" 1
844 1 79 LEU HG 1 105 TYR QE 4.180 . 4.180 3.682 3.357 4.022 . 0 0 "[ . 1 . 2]" 1
845 1 65 TYR HE2 1 104 VAL HB 4.790 . 4.790 4.687 4.430 4.874 0.084 11 0 "[ . 1 . 2]" 1
846 1 65 TYR HE2 1 76 LEU HG 3.450 . 3.450 2.697 2.240 3.321 . 0 0 "[ . 1 . 2]" 1
847 1 35 TYR QE 1 36 ILE H 5.270 . 5.270 5.216 4.964 5.343 0.073 1 0 "[ . 1 . 2]" 1
848 1 34 GLU HA 1 35 TYR QE 5.070 . 5.070 4.887 4.338 5.249 0.179 10 0 "[ . 1 . 2]" 1
849 1 58 LEU HA 1 61 LEU H 4.780 . 4.780 3.045 2.916 3.152 . 0 0 "[ . 1 . 2]" 1
850 1 60 LYS QE 1 61 LEU H 5.400 . 5.400 4.979 3.669 5.625 0.225 2 0 "[ . 1 . 2]" 1
851 1 65 TYR HE1 1 69 GLN QG 4.470 . 4.470 2.419 2.241 2.695 . 0 0 "[ . 1 . 2]" 1
852 1 65 TYR HE1 1 69 GLN QB 3.940 . 3.940 3.904 3.681 4.039 0.099 8 0 "[ . 1 . 2]" 1
853 1 35 TYR QE 1 37 LYS QD 4.260 . 4.260 3.921 3.136 4.358 0.098 2 0 "[ . 1 . 2]" 1
854 1 59 LYS HB3 1 61 LEU H 5.580 . 5.580 4.924 4.707 5.035 . 0 0 "[ . 1 . 2]" 1
855 1 59 LYS QD 1 61 LEU H 6.000 . 6.000 5.137 4.883 5.408 . 0 0 "[ . 1 . 2]" 1
856 1 61 LEU H 1 61 LEU HB2 3.580 . 3.580 2.472 2.434 2.516 . 0 0 "[ . 1 . 2]" 1
857 1 61 LEU H 1 62 LYS QD 3.980 . 3.980 3.703 3.551 3.840 . 0 0 "[ . 1 . 2]" 1
858 1 58 LEU QD 1 61 LEU H 4.240 . 4.240 4.221 4.046 4.324 0.084 20 0 "[ . 1 . 2]" 1
859 1 61 LEU H 1 61 LEU MD1 4.240 . 4.240 4.245 4.207 4.280 0.040 15 0 "[ . 1 . 2]" 1
860 1 48 ILE H 1 50 PHE HE2 5.730 . 5.730 5.454 5.349 5.554 . 0 0 "[ . 1 . 2]" 1
861 1 50 PHE HB2 1 50 PHE HE2 4.810 . 4.810 4.636 4.609 4.659 . 0 0 "[ . 1 . 2]" 1
862 1 73 MET QB 1 76 LEU H 5.560 . 5.560 4.922 4.803 5.063 . 0 0 "[ . 1 . 2]" 1
863 1 48 ILE HB 1 50 PHE HE2 3.630 . 3.630 2.004 1.917 2.161 . 0 0 "[ . 1 . 2]" 1
864 1 62 LYS QB 1 78 PHE QD 4.710 . 4.710 3.032 2.693 3.335 . 0 0 "[ . 1 . 2]" 1
865 1 76 LEU H 1 76 LEU HB2 3.670 . 3.670 3.739 3.675 3.822 0.152 19 0 "[ . 1 . 2]" 1
866 1 48 ILE QG 1 50 PHE HE2 4.750 . 4.750 3.148 3.087 3.250 . 0 0 "[ . 1 . 2]" 1
867 1 48 ILE MD 1 50 PHE HE2 3.730 . 3.730 1.880 1.834 1.924 . 0 0 "[ . 1 . 2]" 1
868 1 50 PHE HE2 1 61 LEU MD1 4.490 . 4.490 4.325 4.156 4.527 0.037 1 0 "[ . 1 . 2]" 1
869 1 50 PHE HE2 1 61 LEU HG 4.100 . 4.100 4.089 3.879 4.155 0.055 11 0 "[ . 1 . 2]" 1
870 1 49 HIS HA 1 50 PHE QD 4.220 . 4.220 4.057 3.881 4.247 0.027 17 0 "[ . 1 . 2]" 1
871 1 40 VAL HB 1 50 PHE QD 4.680 . 4.680 4.422 4.348 4.519 . 0 0 "[ . 1 . 2]" 1
872 1 48 ILE HB 1 50 PHE QD 4.000 . 4.000 2.945 2.753 3.093 . 0 0 "[ . 1 . 2]" 1
873 1 50 PHE QD 1 51 LYS QB 5.090 . 5.090 4.790 4.605 4.958 . 0 0 "[ . 1 . 2]" 1
874 1 48 ILE MD 1 50 PHE QD 4.300 . 4.300 2.976 2.758 3.113 . 0 0 "[ . 1 . 2]" 1
875 1 50 PHE QD 1 61 LEU MD1 3.570 . 3.570 2.504 2.299 2.669 . 0 0 "[ . 1 . 2]" 1
876 1 80 PHE QE 1 101 VAL H 3.970 . 3.970 3.503 3.050 3.976 0.006 14 0 "[ . 1 . 2]" 1
877 1 80 PHE QE 1 102 ILE HA 4.360 . 4.360 4.395 4.280 4.548 0.188 14 0 "[ . 1 . 2]" 1
878 1 80 PHE QE 1 96 MET HA 3.890 . 3.890 3.586 3.226 3.865 . 0 0 "[ . 1 . 2]" 1
879 1 90 THR H 1 91 PRO QD 4.460 . 4.460 4.389 4.372 4.418 . 0 0 "[ . 1 . 2]" 1
880 1 90 THR H 1 92 LYS QE 5.380 . 5.380 5.102 4.353 5.523 0.143 14 0 "[ . 1 . 2]" 1
881 1 80 PHE QE 1 96 MET QG 4.130 . 4.130 2.187 1.933 3.989 . 0 0 "[ . 1 . 2]" 1
882 1 80 PHE QE 1 81 GLU HB3 5.280 . 5.280 5.095 4.854 5.363 0.083 14 0 "[ . 1 . 2]" 1
883 1 80 PHE QE 1 96 MET QB 4.200 . 4.200 3.888 2.205 4.139 . 0 0 "[ . 1 . 2]" 1
884 1 80 PHE QE 1 94 LEU QB 4.340 . 4.340 3.466 3.073 3.926 . 0 0 "[ . 1 . 2]" 1
885 1 90 THR H 1 94 LEU HG 3.840 . 3.840 3.106 3.003 3.254 . 0 0 "[ . 1 . 2]" 1
886 1 90 THR H 1 92 LYS QG 5.270 . 5.270 4.396 4.288 4.532 . 0 0 "[ . 1 . 2]" 1
887 1 76 LEU QD 1 78 PHE QE 4.070 . 4.070 1.798 1.773 1.893 0.027 18 0 "[ . 1 . 2]" 1
888 1 80 PHE QE 1 102 ILE MD 4.660 . 4.660 4.162 3.697 4.425 . 0 0 "[ . 1 . 2]" 1
889 1 90 THR H 1 94 LEU MD1 3.720 . 3.720 3.736 3.689 3.786 0.066 18 0 "[ . 1 . 2]" 1
890 1 80 PHE QD 1 83 GLN HE21 4.400 . 4.400 2.099 1.796 3.253 0.004 15 0 "[ . 1 . 2]" 1
891 1 80 PHE QD 1 96 MET HA 5.440 . 5.440 5.437 5.072 5.659 0.219 14 0 "[ . 1 . 2]" 1
892 1 80 PHE QD 1 81 GLU HB2 4.280 . 4.280 3.503 3.068 3.931 . 0 0 "[ . 1 . 2]" 1
893 1 80 PHE QD 1 101 VAL QG 4.570 . 4.570 4.046 3.797 4.432 . 0 0 "[ . 1 . 2]" 1
894 1 80 PHE QD 1 102 ILE MD 4.380 . 4.380 3.584 3.075 3.860 . 0 0 "[ . 1 . 2]" 1
895 1 42 GLY H 1 45 SER H 5.030 . 5.030 4.029 3.820 4.244 . 0 0 "[ . 1 . 2]" 1
896 1 45 SER H 1 46 SER H 4.070 . 4.070 2.555 2.448 2.632 . 0 0 "[ . 1 . 2]" 1
897 1 92 LYS H 1 93 GLU H 4.290 . 4.290 2.434 2.386 2.465 . 0 0 "[ . 1 . 2]" 1
898 1 79 LEU HA 1 83 GLN H 4.230 . 4.230 4.287 4.215 4.371 0.141 7 0 "[ . 1 . 2]" 1
899 1 80 PHE HA 1 83 GLN H 4.610 . 4.610 4.297 4.192 4.360 . 0 0 "[ . 1 . 2]" 1
900 1 89 HIS HA 1 93 GLU H 5.960 . 5.960 5.243 5.091 5.458 . 0 0 "[ . 1 . 2]" 1
901 1 83 GLN H 1 84 ARG HA 4.820 . 4.820 4.890 4.820 5.009 0.189 15 0 "[ . 1 . 2]" 1
902 1 67 GLN QB 1 68 ARG H 3.820 . 3.820 2.864 2.484 3.517 . 0 0 "[ . 1 . 2]" 1
903 1 93 GLU H 1 93 GLU HB2 3.200 . 3.200 2.238 2.126 2.384 . 0 0 "[ . 1 . 2]" 1
904 1 93 GLU H 1 93 GLU HB3 3.590 . 3.590 2.844 2.689 2.969 . 0 0 "[ . 1 . 2]" 1
905 1 68 ARG H 1 68 ARG QB 3.420 . 3.420 2.242 2.206 2.270 . 0 0 "[ . 1 . 2]" 1
906 1 68 ARG H 1 68 ARG QG 4.100 . 4.100 3.971 3.943 4.027 . 0 0 "[ . 1 . 2]" 1
907 1 60 LYS QD 1 64 SER H 4.630 . 4.630 3.953 3.586 4.636 0.006 5 0 "[ . 1 . 2]" 1
908 1 39 LYS HB2 1 49 HIS HE1 4.440 . 4.440 3.948 3.506 4.506 0.066 5 0 "[ . 1 . 2]" 1
909 1 92 LYS QD 1 93 GLU H 4.790 . 4.790 3.899 3.061 4.373 . 0 0 "[ . 1 . 2]" 1
910 1 41 ILE QG 1 45 SER H 4.320 . 4.320 4.025 3.698 4.272 . 0 0 "[ . 1 . 2]" 1
911 1 93 GLU H 1 94 LEU MD1 4.770 . 4.770 4.854 4.799 4.885 0.115 16 0 "[ . 1 . 2]" 1
912 1 68 ARG H 1 69 GLN H 3.510 . 3.510 2.612 2.519 2.699 . 0 0 "[ . 1 . 2]" 1
913 1 69 GLN H 1 71 VAL H 4.540 . 4.540 3.883 3.728 3.994 . 0 0 "[ . 1 . 2]" 1
914 1 89 HIS HA 1 89 HIS HE1 5.610 . 5.610 5.569 5.527 5.599 . 0 0 "[ . 1 . 2]" 1
915 1 66 CYS HA 1 69 GLN H 3.850 . 3.850 3.595 3.449 3.690 . 0 0 "[ . 1 . 2]" 1
916 1 89 HIS HB2 1 89 HIS HE1 5.080 . 5.080 4.859 4.800 4.883 . 0 0 "[ . 1 . 2]" 1
917 1 89 HIS HB3 1 89 HIS HE1 5.080 . 5.080 4.885 4.857 4.974 . 0 0 "[ . 1 . 2]" 1
918 1 83 GLN HB2 1 89 HIS HE1 4.680 . 4.680 3.552 3.203 4.092 . 0 0 "[ . 1 . 2]" 1
919 1 69 GLN H 1 69 GLN QG 3.710 . 3.710 3.578 3.486 3.638 . 0 0 "[ . 1 . 2]" 1
920 1 68 ARG QB 1 69 GLN H 4.440 . 4.440 2.641 2.497 2.769 . 0 0 "[ . 1 . 2]" 1
921 1 69 GLN H 1 69 GLN QB 3.540 . 3.540 2.209 2.187 2.236 . 0 0 "[ . 1 . 2]" 1
922 1 105 TYR H 1 105 TYR QD 3.670 . 3.670 3.163 3.032 3.313 . 0 0 "[ . 1 . 2]" 1
923 1 78 PHE HA 1 105 TYR QD 5.260 . 5.260 5.235 5.072 5.321 0.061 6 0 "[ . 1 . 2]" 1
924 1 105 TYR HA 1 105 TYR QD 3.450 . 3.450 2.612 2.488 2.815 . 0 0 "[ . 1 . 2]" 1
925 1 56 THR HA 1 57 HIS HD2 4.960 . 4.960 3.837 3.088 5.054 0.094 8 0 "[ . 1 . 2]" 1
926 1 56 THR MG 1 57 HIS HD2 4.790 . 4.790 4.317 2.852 4.855 0.065 16 0 "[ . 1 . 2]" 1
927 1 35 TYR QD 1 36 ILE MG 4.690 . 4.690 4.618 4.365 4.721 0.031 19 0 "[ . 1 . 2]" 1
928 1 104 VAL QG 1 105 TYR QD 4.850 . 4.850 4.500 4.393 4.587 . 0 0 "[ . 1 . 2]" 1
929 1 65 TYR QD 1 69 GLN H 5.000 . 5.000 4.810 4.656 4.956 . 0 0 "[ . 1 . 2]" 1
930 1 65 TYR QD 1 66 CYS HA 3.720 . 3.720 3.643 3.419 3.786 0.066 16 0 "[ . 1 . 2]" 1
931 1 65 TYR QD 1 69 GLN QG 4.580 . 4.580 2.916 2.705 3.081 . 0 0 "[ . 1 . 2]" 1
932 1 48 ILE QG 1 65 TYR QD 4.490 . 4.490 4.061 3.565 4.451 . 0 0 "[ . 1 . 2]" 1
933 1 65 TYR QD 1 104 VAL QG 4.020 . 4.020 3.475 3.373 3.642 . 0 0 "[ . 1 . 2]" 1
934 1 35 TYR H 1 35 TYR QD 3.390 . 3.390 2.616 1.867 3.177 . 0 0 "[ . 1 . 2]" 1
935 1 34 GLU H 1 35 TYR QD 5.510 . 5.510 4.592 3.419 5.607 0.097 15 0 "[ . 1 . 2]" 1
936 1 35 TYR QD 1 37 LYS HA 4.960 . 4.960 4.565 3.773 4.989 0.029 9 0 "[ . 1 . 2]" 1
937 1 35 TYR HA 1 35 TYR QD 3.880 . 3.880 3.738 3.717 3.759 . 0 0 "[ . 1 . 2]" 1
938 1 72 PRO HA 1 74 ASN HD21 5.080 . 5.080 4.392 4.096 4.799 . 0 0 "[ . 1 . 2]" 1
939 1 106 GLN HA 1 106 GLN HE21 5.540 . 5.540 4.249 4.116 4.387 . 0 0 "[ . 1 . 2]" 1
940 1 89 HIS HA 1 89 HIS HD2 2.910 . 2.910 2.021 1.979 2.082 . 0 0 "[ . 1 . 2]" 1
941 1 49 HIS HA 1 49 HIS HD2 3.710 . 3.710 3.393 3.194 3.589 . 0 0 "[ . 1 . 2]" 1
942 1 48 ILE HA 1 49 HIS HD2 4.200 . 4.200 3.084 2.932 3.250 . 0 0 "[ . 1 . 2]" 1
943 1 48 ILE QG 1 49 HIS HD2 5.030 . 5.030 4.861 4.651 5.055 0.025 12 0 "[ . 1 . 2]" 1
944 1 105 TYR HA 1 105 TYR QE 4.680 . 4.680 4.548 4.493 4.610 . 0 0 "[ . 1 . 2]" 1
945 1 43 GLN HA 1 105 TYR QE 4.820 . 4.820 4.301 3.961 4.744 . 0 0 "[ . 1 . 2]" 1
946 1 65 TYR HE2 1 66 CYS HA 4.600 . 4.600 4.075 3.907 4.183 . 0 0 "[ . 1 . 2]" 1
947 1 65 TYR HE2 1 76 LEU QD 3.620 . 3.620 2.222 1.917 2.866 . 0 0 "[ . 1 . 2]" 1
948 1 79 LEU MD2 1 105 TYR QE 3.780 . 3.780 2.571 2.184 3.069 . 0 0 "[ . 1 . 2]" 1
949 1 65 TYR HE2 1 104 VAL QG 3.340 . 3.340 2.222 2.022 2.372 . 0 0 "[ . 1 . 2]" 1
950 1 35 TYR H 1 35 TYR QE 4.330 . 4.330 4.166 3.832 4.348 0.018 18 0 "[ . 1 . 2]" 1
951 1 61 LEU H 1 61 LEU HG 4.400 . 4.400 4.481 4.460 4.508 0.108 19 0 "[ . 1 . 2]" 1
952 1 61 LEU H 1 61 LEU MD2 4.380 . 4.380 4.184 4.143 4.214 . 0 0 "[ . 1 . 2]" 1
953 1 76 LEU H 1 76 LEU QD 3.530 . 3.530 2.192 2.070 2.291 . 0 0 "[ . 1 . 2]" 1
954 1 50 PHE H 1 50 PHE QD 3.780 . 3.780 3.378 3.148 3.565 . 0 0 "[ . 1 . 2]" 1
955 1 50 PHE QD 1 51 LYS H 4.020 . 4.020 3.210 3.048 3.349 . 0 0 "[ . 1 . 2]" 1
956 1 50 PHE QD 1 61 LEU MD2 3.920 . 3.920 2.287 2.151 2.459 . 0 0 "[ . 1 . 2]" 1
957 1 80 PHE QE 1 81 GLU H 4.450 . 4.450 4.331 4.244 4.489 0.039 19 0 "[ . 1 . 2]" 1
958 1 80 PHE HA 1 80 PHE QE 4.610 . 4.610 4.562 4.426 4.641 0.031 9 0 "[ . 1 . 2]" 1
959 1 80 PHE QE 1 81 GLU HA 5.170 . 5.170 5.280 5.213 5.306 0.136 7 0 "[ . 1 . 2]" 1
960 1 76 LEU HG 1 78 PHE QE 3.380 . 3.380 3.544 3.486 3.601 0.221 18 0 "[ . 1 . 2]" 1
961 1 80 PHE QD 1 103 GLU H 4.430 . 4.430 3.730 3.555 3.985 . 0 0 "[ . 1 . 2]" 1
962 1 80 PHE QD 1 96 MET H 5.890 . 5.890 5.919 5.746 6.013 0.123 10 0 "[ . 1 . 2]" 1
963 1 79 LEU HA 1 80 PHE QD 6.000 . 6.000 5.829 5.781 5.870 . 0 0 "[ . 1 . 2]" 1
964 1 80 PHE HA 1 80 PHE QD 3.350 . 3.350 2.524 2.303 2.740 . 0 0 "[ . 1 . 2]" 1
965 1 80 PHE QD 1 81 GLU HA 4.820 . 4.820 4.859 4.812 4.888 0.068 12 0 "[ . 1 . 2]" 1
966 1 80 PHE QD 1 94 LEU QB 4.190 . 4.190 2.759 2.418 3.218 . 0 0 "[ . 1 . 2]" 1
967 1 80 PHE QD 1 85 ILE MD 4.050 . 4.050 3.667 3.493 3.768 . 0 0 "[ . 1 . 2]" 1
968 1 80 PHE QD 1 83 GLN H 5.330 . 5.330 5.065 4.865 5.319 . 0 0 "[ . 1 . 2]" 1
969 1 64 SER HA 1 68 ARG H 4.270 . 4.270 3.961 3.797 4.093 . 0 0 "[ . 1 . 2]" 1
970 1 91 PRO QD 1 93 GLU H 4.560 . 4.560 4.275 4.216 4.327 . 0 0 "[ . 1 . 2]" 1
971 1 81 GLU HA 1 83 GLN H 4.880 . 4.880 4.548 4.474 4.649 . 0 0 "[ . 1 . 2]" 1
972 1 43 GLN QG 1 45 SER H 4.520 . 4.520 4.497 4.395 4.632 0.112 3 0 "[ . 1 . 2]" 1
973 1 55 THR MG 1 93 GLU H 5.440 . 5.440 5.138 5.012 5.254 . 0 0 "[ . 1 . 2]" 1
974 1 86 ALA H 1 89 HIS HE1 3.910 . 3.910 3.722 3.398 4.001 0.091 18 0 "[ . 1 . 2]" 1
975 1 69 GLN H 1 70 GLY H 3.470 . 3.470 2.256 2.191 2.330 . 0 0 "[ . 1 . 2]" 1
976 1 83 GLN QG 1 89 HIS HE1 4.500 . 4.500 3.365 2.484 4.027 . 0 0 "[ . 1 . 2]" 1
977 1 89 HIS HE1 1 94 LEU MD2 3.680 . 3.680 2.770 2.695 2.846 . 0 0 "[ . 1 . 2]" 1
978 1 55 THR H 1 56 THR H 3.600 . 3.600 2.673 2.549 2.852 . 0 0 "[ . 1 . 2]" 1
979 1 55 THR H 1 55 THR HB 3.980 . 3.980 3.655 3.605 3.736 . 0 0 "[ . 1 . 2]" 1
980 1 43 GLN HE22 1 106 GLN HB3 4.320 . 4.320 3.300 3.091 3.465 . 0 0 "[ . 1 . 2]" 1
981 1 56 THR H 1 57 HIS H 4.620 . 4.620 4.490 4.326 4.563 . 0 0 "[ . 1 . 2]" 1
982 1 55 THR HB 1 56 THR H 4.760 . 4.760 4.419 4.350 4.464 . 0 0 "[ . 1 . 2]" 1
983 1 56 THR H 1 90 THR HB 4.500 . 4.500 3.390 3.086 3.551 . 0 0 "[ . 1 . 2]" 1
984 1 56 THR H 1 91 PRO QD 4.350 . 4.350 2.869 2.686 3.078 . 0 0 "[ . 1 . 2]" 1
985 1 77 ARG QB 1 77 ARG HE 4.040 . 4.040 2.827 1.775 4.094 0.054 12 0 "[ . 1 . 2]" 1
986 1 56 THR H 1 90 THR MG 4.780 . 4.780 3.880 3.591 4.068 . 0 0 "[ . 1 . 2]" 1
987 1 59 LYS HB2 1 60 LYS H 4.970 . 4.970 3.929 3.641 4.129 . 0 0 "[ . 1 . 2]" 1
988 1 60 LYS H 1 60 LYS QB 3.290 . 3.290 2.214 2.097 2.394 . 0 0 "[ . 1 . 2]" 1
989 1 58 LEU QB 1 60 LYS H 5.100 . 5.100 4.822 4.685 5.034 . 0 0 "[ . 1 . 2]" 1
990 1 94 LEU H 1 96 MET QG 4.980 . 4.980 4.115 3.973 4.222 . 0 0 "[ . 1 . 2]" 1
991 1 94 LEU H 1 96 MET ME 5.350 . 5.350 3.927 3.828 4.055 . 0 0 "[ . 1 . 2]" 1
992 1 68 ARG H 1 69 GLN HE22 5.210 . 5.210 4.613 4.487 4.811 . 0 0 "[ . 1 . 2]" 1
993 1 83 GLN H 1 83 GLN HE21 5.490 . 5.490 4.064 3.384 4.223 . 0 0 "[ . 1 . 2]" 1
994 1 69 GLN HA 1 69 GLN HE22 4.910 . 4.910 4.343 4.117 4.682 . 0 0 "[ . 1 . 2]" 1
995 1 60 LYS HA 1 62 LYS H 4.990 . 4.990 4.511 4.303 4.700 . 0 0 "[ . 1 . 2]" 1
996 1 59 LYS HA 1 62 LYS H 4.420 . 4.420 3.401 3.162 3.700 . 0 0 "[ . 1 . 2]" 1
997 1 71 VAL HB 1 106 GLN HE22 5.440 . 5.440 5.140 4.631 5.457 0.017 2 0 "[ . 1 . 2]" 1
998 1 106 GLN HB3 1 106 GLN HE22 4.910 . 4.910 3.454 3.331 3.573 . 0 0 "[ . 1 . 2]" 1
999 1 61 LEU HB2 1 62 LYS H 4.110 . 4.110 3.668 3.571 3.761 . 0 0 "[ . 1 . 2]" 1
1000 1 62 LYS H 1 62 LYS QD 3.890 . 3.890 2.172 2.019 2.317 . 0 0 "[ . 1 . 2]" 1
1001 1 61 LEU MD1 1 62 LYS H 4.810 . 4.810 4.440 4.278 4.576 . 0 0 "[ . 1 . 2]" 1
1002 1 62 LYS H 1 62 LYS QG 4.010 . 4.010 3.484 3.424 3.547 . 0 0 "[ . 1 . 2]" 1
1003 1 96 MET H 1 97 GLU H 4.740 . 4.740 4.525 4.481 4.566 . 0 0 "[ . 1 . 2]" 1
1004 1 43 GLN HE21 1 45 SER H 4.840 . 4.840 4.547 4.296 4.840 0.000 11 0 "[ . 1 . 2]" 1
1005 1 94 LEU H 1 95 GLY H 3.540 . 3.540 2.482 2.421 2.619 . 0 0 "[ . 1 . 2]" 1
1006 1 91 PRO HA 1 96 MET H 4.250 . 4.250 3.371 3.198 3.562 . 0 0 "[ . 1 . 2]" 1
1007 1 96 MET H 1 96 MET QG 3.550 . 3.550 2.413 2.061 2.619 . 0 0 "[ . 1 . 2]" 1
1008 1 94 LEU QB 1 95 GLY H 4.770 . 4.770 3.168 3.128 3.231 . 0 0 "[ . 1 . 2]" 1
1009 1 94 LEU QB 1 96 MET H 4.980 . 4.980 3.271 2.956 3.639 . 0 0 "[ . 1 . 2]" 1
1010 1 43 GLN HA 1 43 GLN HE21 4.470 . 4.470 4.227 4.172 4.331 . 0 0 "[ . 1 . 2]" 1
1011 1 67 GLN HA 1 71 VAL H 4.820 . 4.820 3.785 3.614 4.139 . 0 0 "[ . 1 . 2]" 1
1012 1 43 GLN HE21 1 43 GLN QG 3.210 . 3.210 2.200 2.173 2.240 . 0 0 "[ . 1 . 2]" 1
1013 1 71 VAL H 1 71 VAL HB 4.060 . 4.060 3.540 2.716 3.798 . 0 0 "[ . 1 . 2]" 1
1014 1 91 PRO QB 1 96 MET H 4.100 . 4.100 3.934 3.744 4.095 . 0 0 "[ . 1 . 2]" 1
1015 1 93 GLU HB3 1 95 GLY H 4.590 . 4.590 4.655 4.470 4.708 0.118 4 0 "[ . 1 . 2]" 1
1016 1 86 ALA HA 1 88 ASN H 4.250 . 4.250 4.104 3.914 4.295 0.045 3 0 "[ . 1 . 2]" 1
1017 1 88 ASN H 1 88 ASN HB3 3.870 . 3.870 3.068 2.858 3.683 . 0 0 "[ . 1 . 2]" 1
1018 1 103 GLU H 1 104 VAL H 4.580 . 4.580 4.460 4.422 4.494 . 0 0 "[ . 1 . 2]" 1
1019 1 103 GLU HG2 1 104 VAL H 4.610 . 4.610 4.213 3.299 4.435 . 0 0 "[ . 1 . 2]" 1
1020 1 103 GLU HG3 1 104 VAL H 4.610 . 4.610 2.681 2.431 2.791 . 0 0 "[ . 1 . 2]" 1
1021 1 103 GLU QB 1 104 VAL H 3.810 . 3.810 3.660 3.589 3.766 . 0 0 "[ . 1 . 2]" 1
1022 1 102 ILE MG 1 104 VAL H 4.260 . 4.260 4.253 4.101 4.347 0.087 17 0 "[ . 1 . 2]" 1
1023 1 40 VAL MG1 1 104 VAL H 4.570 . 4.570 4.292 4.016 4.485 . 0 0 "[ . 1 . 2]" 1
1024 1 67 GLN HA 1 70 GLY H 4.080 . 4.080 3.314 3.172 3.465 . 0 0 "[ . 1 . 2]" 1
1025 1 68 ARG QB 1 70 GLY H 4.840 . 4.840 4.352 4.257 4.496 . 0 0 "[ . 1 . 2]" 1
1026 1 68 ARG QG 1 70 GLY H 5.110 . 5.110 4.878 4.745 5.048 . 0 0 "[ . 1 . 2]" 1
1027 1 75 SER H 1 76 LEU HB3 4.480 . 4.480 4.249 4.127 4.367 . 0 0 "[ . 1 . 2]" 1
1028 1 64 SER H 1 65 TYR QD 5.660 . 5.660 5.575 5.230 5.763 0.103 6 0 "[ . 1 . 2]" 1
1029 1 63 GLU QB 1 64 SER H 3.690 . 3.690 2.803 2.334 3.556 . 0 0 "[ . 1 . 2]" 1
1030 1 92 LYS HB2 1 93 GLU H 4.190 . 4.190 4.077 4.010 4.194 0.004 8 0 "[ . 1 . 2]" 1
1031 1 93 GLU H 1 94 LEU HG 4.280 . 4.280 4.206 4.121 4.314 0.034 20 0 "[ . 1 . 2]" 1
1032 1 46 SER H 1 47 GLU H 4.490 . 4.490 4.485 4.416 4.527 0.037 2 0 "[ . 1 . 2]" 1
1033 1 90 THR H 1 92 LYS H 5.110 . 5.110 4.744 4.688 4.844 . 0 0 "[ . 1 . 2]" 1
1034 1 91 PRO QD 1 92 LYS H 3.460 . 3.460 2.946 2.839 3.016 . 0 0 "[ . 1 . 2]" 1
1035 1 42 GLY QA 1 46 SER H 4.720 . 4.720 3.743 3.491 3.921 . 0 0 "[ . 1 . 2]" 1
1036 1 44 ASP HB2 1 46 SER H 4.550 . 4.550 4.045 2.683 4.574 0.024 4 0 "[ . 1 . 2]" 1
1037 1 92 LYS H 1 93 GLU HB2 4.770 . 4.770 4.369 4.214 4.548 . 0 0 "[ . 1 . 2]" 1
1038 1 92 LYS H 1 93 GLU HB3 5.410 . 5.410 5.107 4.939 5.242 . 0 0 "[ . 1 . 2]" 1
1039 1 55 THR MG 1 92 LYS H 4.540 . 4.540 4.608 4.531 4.666 0.126 15 0 "[ . 1 . 2]" 1
1040 1 41 ILE QG 1 46 SER H 4.740 . 4.740 3.870 3.581 4.098 . 0 0 "[ . 1 . 2]" 1
1041 1 39 LYS H 1 100 ASP H 4.900 . 4.900 4.370 4.033 4.645 . 0 0 "[ . 1 . 2]" 1
1042 1 38 LEU HA 1 100 ASP H 4.510 . 4.510 3.322 3.015 3.610 . 0 0 "[ . 1 . 2]" 1
1043 1 98 GLU HA 1 100 ASP H 3.170 . 3.170 3.090 2.915 3.187 0.017 3 0 "[ . 1 . 2]" 1
1044 1 38 LEU QD 1 100 ASP H 3.420 . 3.420 2.323 2.203 2.458 . 0 0 "[ . 1 . 2]" 1
1045 1 38 LEU HG 1 100 ASP H 4.810 . 4.810 4.739 4.534 4.855 0.045 15 0 "[ . 1 . 2]" 1
1046 1 36 ILE MD 1 100 ASP H 4.590 . 4.590 4.292 4.049 4.598 0.008 1 0 "[ . 1 . 2]" 1
1047 1 98 GLU H 1 100 ASP H 4.800 . 4.800 4.636 4.466 4.735 . 0 0 "[ . 1 . 2]" 1
1048 1 100 ASP HA 1 101 VAL H 3.100 . 3.100 2.575 2.497 2.678 . 0 0 "[ . 1 . 2]" 1
1049 1 100 ASP H 1 100 ASP HB3 3.600 . 3.600 2.971 2.869 3.136 . 0 0 "[ . 1 . 2]" 1
1050 1 100 ASP HB3 1 101 VAL H 4.000 . 4.000 2.807 2.640 2.928 . 0 0 "[ . 1 . 2]" 1
1051 1 38 LEU QD 1 101 VAL H 4.560 . 4.560 4.297 4.160 4.565 0.005 3 0 "[ . 1 . 2]" 1
1052 1 23 SER H 1 24 THR H 4.500 . 4.500 3.558 2.457 4.361 . 0 0 "[ . 1 . 2]" 1
1053 1 28 GLY H 1 29 ASP H 3.580 . 3.580 2.934 1.937 3.884 0.304 2 0 "[ . 1 . 2]" 1
1054 1 17 ASP H 1 18 GLN H 3.040 . 3.040 2.416 1.809 2.920 . 0 0 "[ . 1 . 2]" 1
1055 1 23 SER HA 1 24 THR H 2.820 . 2.820 2.491 2.136 2.955 0.135 20 0 "[ . 1 . 2]" 1
1056 1 29 ASP H 1 29 ASP QB 3.240 . 3.240 2.444 2.169 3.029 . 0 0 "[ . 1 . 2]" 1
1057 1 19 GLU QB 1 20 ALA H 2.970 . 2.970 2.591 1.925 3.233 0.263 14 0 "[ . 1 . 2]" 1
1058 1 20 ALA H 1 21 LYS QD 4.480 . 4.480 2.549 1.912 3.265 . 0 0 "[ . 1 . 2]" 1
1059 1 27 LEU HG 1 29 ASP H 4.660 . 4.660 2.798 1.864 4.240 . 0 0 "[ . 1 . 2]" 1
1060 1 20 ALA H 1 20 ALA MB 2.770 . 2.770 2.501 2.320 2.768 . 0 0 "[ . 1 . 2]" 1
1061 1 27 LEU MD1 1 29 ASP H 4.760 . 4.760 3.036 1.799 4.526 0.001 20 0 "[ . 1 . 2]" 1
1062 1 42 GLY H 1 44 ASP H 4.620 . 4.620 4.219 4.057 4.356 . 0 0 "[ . 1 . 2]" 1
1063 1 28 GLY H 1 30 LYS H 4.300 . 4.300 3.828 2.785 4.530 0.230 2 0 "[ . 1 . 2]" 1
1064 1 64 SER H 1 67 GLN H 5.480 . 5.480 4.763 4.627 4.912 . 0 0 "[ . 1 . 2]" 1
1065 1 67 GLN H 1 70 GLY H 5.850 . 5.850 4.550 4.406 4.697 . 0 0 "[ . 1 . 2]" 1
1066 1 97 GLU HA 1 98 GLU H 3.180 . 3.180 2.597 2.451 2.724 . 0 0 "[ . 1 . 2]" 1
1067 1 18 GLN HA 1 19 GLU H 2.850 . 2.850 2.386 2.018 3.270 0.420 6 0 "[ . 1 . 2]" 1
1068 1 64 SER QB 1 67 GLN H 5.510 . 5.510 5.080 4.786 5.303 . 0 0 "[ . 1 . 2]" 1
1069 1 98 GLU H 1 98 GLU QG 3.720 . 3.720 1.939 1.780 2.166 0.020 6 0 "[ . 1 . 2]" 1
1070 1 19 GLU H 1 19 GLU QG 3.250 . 3.250 2.584 1.874 2.935 . 0 0 "[ . 1 . 2]" 1
1071 1 98 GLU H 1 98 GLU HB2 4.110 . 4.110 3.593 3.470 3.678 . 0 0 "[ . 1 . 2]" 1
1072 1 97 GLU HB3 1 98 GLU H 3.450 . 3.450 2.151 1.883 3.374 . 0 0 "[ . 1 . 2]" 1
1073 1 21 LYS H 1 21 LYS QG 3.700 . 3.700 3.158 2.508 3.820 0.120 11 0 "[ . 1 . 2]" 1
1074 1 20 ALA MB 1 21 LYS H 3.740 . 3.740 3.470 3.032 3.687 . 0 0 "[ . 1 . 2]" 1
1075 1 31 LYS H 1 32 GLU H 5.650 . 5.650 4.097 2.310 4.596 . 0 0 "[ . 1 . 2]" 1
1076 1 35 TYR H 1 36 ILE HA 4.930 . 4.930 4.788 4.575 5.070 0.140 8 0 "[ . 1 . 2]" 1
1077 1 24 THR HA 1 25 GLU H 2.740 . 2.740 2.270 2.072 2.746 0.006 11 0 "[ . 1 . 2]" 1
1078 1 25 GLU H 1 25 GLU QG 4.170 . 4.170 2.356 1.825 2.908 . 0 0 "[ . 1 . 2]" 1
1079 1 97 GLU QG 1 98 GLU H 3.950 . 3.950 3.712 1.901 4.071 0.121 7 0 "[ . 1 . 2]" 1
1080 1 34 GLU QB 1 35 TYR H 4.600 . 4.600 3.441 2.471 4.014 . 0 0 "[ . 1 . 2]" 1
1081 1 109 THR H 1 110 GLY H 3.990 . 3.990 3.893 2.596 4.334 0.344 17 0 "[ . 1 . 2]" 1
1082 1 30 LYS HA 1 31 LYS H 3.060 . 3.060 2.499 2.144 3.332 0.272 16 0 "[ . 1 . 2]" 1
1083 1 26 ASP QB 1 27 LEU H 3.760 . 3.760 3.082 2.000 3.838 0.078 4 0 "[ . 1 . 2]" 1
1084 1 31 LYS H 1 31 LYS QB 3.580 . 3.580 2.484 2.055 3.209 . 0 0 "[ . 1 . 2]" 1
1085 1 27 LEU H 1 27 LEU HG 4.170 . 4.170 3.289 2.040 4.329 0.159 17 0 "[ . 1 . 2]" 1
1086 1 109 THR H 1 109 THR MG 4.340 . 4.340 2.572 2.015 3.177 . 0 0 "[ . 1 . 2]" 1
1087 1 27 LEU H 1 27 LEU MD1 4.590 . 4.590 4.072 3.625 4.449 . 0 0 "[ . 1 . 2]" 1
1088 1 76 LEU HA 1 107 GLU H 3.550 . 3.550 2.583 2.283 2.751 . 0 0 "[ . 1 . 2]" 1
1089 1 74 ASN H 1 74 ASN HB2 3.720 . 3.720 3.643 3.597 3.672 . 0 0 "[ . 1 . 2]" 1
1090 1 72 PRO QB 1 74 ASN H 3.860 . 3.860 2.765 2.450 3.046 . 0 0 "[ . 1 . 2]" 1
1091 1 106 GLN HB2 1 107 GLU H 3.630 . 3.630 3.415 3.223 3.632 0.002 6 0 "[ . 1 . 2]" 1
1092 1 25 GLU QB 1 26 ASP H 3.990 . 3.990 2.541 1.785 3.990 0.015 9 0 "[ . 1 . 2]" 1
1093 1 76 LEU HB3 1 107 GLU H 4.460 . 4.460 3.893 3.493 4.259 . 0 0 "[ . 1 . 2]" 1
1094 1 27 LEU HB3 1 28 GLY H 4.660 . 4.660 4.095 2.144 4.716 0.056 2 0 "[ . 1 . 2]" 1
1095 1 42 GLY H 1 43 GLN H 4.560 . 4.560 4.464 4.423 4.494 . 0 0 "[ . 1 . 2]" 1
1096 1 42 GLY H 1 47 GLU HA 4.110 . 4.110 3.987 3.823 4.130 0.020 12 0 "[ . 1 . 2]" 1
1097 1 31 LYS HA 1 32 GLU H 3.000 . 3.000 2.496 2.073 3.364 0.364 14 0 "[ . 1 . 2]" 1
1098 1 32 GLU H 1 32 GLU QB 3.450 . 3.450 2.511 2.104 3.029 . 0 0 "[ . 1 . 2]" 1
1099 1 31 LYS QB 1 32 GLU H 3.850 . 3.850 3.059 1.861 3.956 0.106 20 0 "[ . 1 . 2]" 1
1100 1 59 LYS QD 1 63 GLU H 4.400 . 4.400 3.396 2.957 4.218 . 0 0 "[ . 1 . 2]" 1
1101 1 62 LYS QD 1 63 GLU H 5.340 . 5.340 4.233 4.113 4.346 . 0 0 "[ . 1 . 2]" 1
1102 1 41 ILE QG 1 42 GLY H 4.350 . 4.350 2.161 1.993 2.287 . 0 0 "[ . 1 . 2]" 1
1103 1 41 ILE MD 1 42 GLY H 4.220 . 4.220 3.858 3.710 3.987 . 0 0 "[ . 1 . 2]" 1
1104 1 63 GLU H 1 65 TYR H 4.620 . 4.620 4.231 4.069 4.374 . 0 0 "[ . 1 . 2]" 1
1105 1 60 LYS HA 1 63 GLU H 3.940 . 3.940 3.593 3.213 3.964 0.024 20 0 "[ . 1 . 2]" 1
1106 1 63 GLU H 1 63 GLU QB 3.290 . 3.290 2.382 1.991 2.566 . 0 0 "[ . 1 . 2]" 1
1107 1 59 LYS H 1 61 LEU H 4.330 . 4.330 4.042 3.969 4.187 . 0 0 "[ . 1 . 2]" 1
1108 1 35 TYR HA 1 54 MET H 5.420 . 5.420 4.639 3.897 5.427 0.007 12 0 "[ . 1 . 2]" 1
1109 1 105 TYR H 1 105 TYR HB3 3.890 . 3.890 3.752 3.728 3.781 . 0 0 "[ . 1 . 2]" 1
1110 1 59 LYS H 1 62 LYS QD 4.580 . 4.580 4.363 4.197 4.550 . 0 0 "[ . 1 . 2]" 1
1111 1 38 LEU H 1 39 LYS H 5.300 . 5.300 4.439 4.404 4.480 . 0 0 "[ . 1 . 2]" 1
1112 1 39 LYS H 1 40 VAL HA 5.390 . 5.390 4.776 4.728 4.841 . 0 0 "[ . 1 . 2]" 1
1113 1 41 ILE HA 1 47 GLU H 5.720 . 5.720 4.675 4.584 4.775 . 0 0 "[ . 1 . 2]" 1
1114 1 23 SER H 1 24 THR HA 5.600 . 5.600 4.944 4.271 5.515 . 0 0 "[ . 1 . 2]" 1
1115 1 37 LYS H 1 51 LYS HA 6.000 . 6.000 4.919 4.665 5.222 . 0 0 "[ . 1 . 2]" 1
1116 1 47 GLU H 1 47 GLU QG 4.780 . 4.780 2.569 2.380 2.667 . 0 0 "[ . 1 . 2]" 1
1117 1 37 LYS H 1 98 GLU QG 4.800 . 4.800 4.347 3.862 4.744 . 0 0 "[ . 1 . 2]" 1
1118 1 37 LYS H 1 98 GLU HB3 4.080 . 4.080 2.912 2.242 3.572 . 0 0 "[ . 1 . 2]" 1
1119 1 22 PRO HB3 1 23 SER H 4.330 . 4.330 3.811 3.236 4.504 0.174 2 0 "[ . 1 . 2]" 1
1120 1 47 GLU H 1 47 GLU HB3 3.850 . 3.850 3.301 3.192 3.410 . 0 0 "[ . 1 . 2]" 1
1121 1 37 LYS H 1 37 LYS HB2 4.190 . 4.190 3.674 3.490 3.736 . 0 0 "[ . 1 . 2]" 1
1122 1 39 LYS H 1 40 VAL H 4.490 . 4.490 4.269 4.225 4.321 . 0 0 "[ . 1 . 2]" 1
1123 1 47 GLU H 1 48 ILE MG 5.020 . 5.020 3.894 3.803 4.004 . 0 0 "[ . 1 . 2]" 1
1124 1 65 TYR H 1 66 CYS H 3.680 . 3.680 2.667 2.581 2.738 . 0 0 "[ . 1 . 2]" 1
1125 1 66 CYS H 1 69 GLN HE21 4.940 . 4.940 4.939 4.890 4.973 0.033 3 0 "[ . 1 . 2]" 1
1126 1 41 ILE HA 1 48 ILE H 4.110 . 4.110 3.817 3.674 3.907 . 0 0 "[ . 1 . 2]" 1
1127 1 48 ILE HA 1 49 HIS H 2.940 . 2.940 2.156 2.125 2.180 . 0 0 "[ . 1 . 2]" 1
1128 1 66 CYS H 1 66 CYS HB2 3.700 . 3.700 2.576 2.295 3.640 . 0 0 "[ . 1 . 2]" 1
1129 1 65 TYR HB3 1 66 CYS H 3.800 . 3.800 3.052 2.821 3.236 . 0 0 "[ . 1 . 2]" 1
1130 1 49 HIS H 1 49 HIS HB3 3.740 . 3.740 3.712 3.684 3.742 0.002 17 0 "[ . 1 . 2]" 1
1131 1 40 VAL HB 1 48 ILE H 3.830 . 3.830 3.511 3.345 3.638 . 0 0 "[ . 1 . 2]" 1
1132 1 66 CYS H 1 69 GLN QG 6.000 . 6.000 5.838 5.604 6.003 0.003 2 0 "[ . 1 . 2]" 1
1133 1 66 CYS H 1 73 MET QB 6.000 . 6.000 5.817 5.382 6.159 0.159 7 0 "[ . 1 . 2]" 1
1134 1 48 ILE H 1 48 ILE HB 3.860 . 3.860 3.765 3.706 3.807 . 0 0 "[ . 1 . 2]" 1
1135 1 39 LYS HG3 1 48 ILE H 4.300 . 4.300 3.893 3.385 4.280 . 0 0 "[ . 1 . 2]" 1
1136 1 48 ILE H 1 61 LEU MD2 6.000 . 6.000 5.385 5.266 5.526 . 0 0 "[ . 1 . 2]" 1
1137 1 105 TYR QD 1 106 GLN H 3.990 . 3.990 3.825 3.701 3.926 . 0 0 "[ . 1 . 2]" 1
1138 1 49 HIS H 1 49 HIS HB2 3.690 . 3.690 2.545 2.493 2.606 . 0 0 "[ . 1 . 2]" 1
1139 1 106 GLN H 1 106 GLN QG 3.750 . 3.750 2.303 2.083 2.431 . 0 0 "[ . 1 . 2]" 1
1140 1 105 TYR HB2 1 106 GLN H 4.270 . 4.270 3.903 3.735 4.082 . 0 0 "[ . 1 . 2]" 1
1141 1 76 LEU QD 1 106 GLN H 4.780 . 4.780 4.905 4.822 4.967 0.187 10 0 "[ . 1 . 2]" 1
1142 1 39 LYS HA 1 49 HIS H 5.010 . 5.010 4.630 4.474 4.758 . 0 0 "[ . 1 . 2]" 1
1143 1 51 LYS H 1 52 VAL H 5.160 . 5.160 4.398 4.269 4.515 . 0 0 "[ . 1 . 2]" 1
1144 1 87 ASP H 1 88 ASN HA 5.350 . 5.350 5.202 5.103 5.335 . 0 0 "[ . 1 . 2]" 1
1145 1 56 THR HA 1 57 HIS H 3.460 . 3.460 2.160 2.136 2.207 . 0 0 "[ . 1 . 2]" 1
1146 1 50 PHE HB3 1 51 LYS H 3.850 . 3.850 2.614 2.435 2.786 . 0 0 "[ . 1 . 2]" 1
1147 1 43 GLN H 1 106 GLN QG 4.740 . 4.740 4.557 4.402 4.756 0.016 18 0 "[ . 1 . 2]" 1
1148 1 43 GLN H 1 43 GLN QG 3.460 . 3.460 3.227 3.098 3.329 . 0 0 "[ . 1 . 2]" 1
1149 1 43 GLN H 1 43 GLN HB2 3.740 . 3.740 3.621 3.590 3.649 . 0 0 "[ . 1 . 2]" 1
1150 1 107 GLU HB2 1 108 GLN H 3.920 . 3.920 3.565 3.176 3.925 0.005 16 0 "[ . 1 . 2]" 1
1151 1 51 LYS H 1 51 LYS QG 4.810 . 4.810 4.037 3.956 4.146 . 0 0 "[ . 1 . 2]" 1
1152 1 51 LYS H 1 51 LYS QD 5.340 . 5.340 4.649 4.404 4.845 . 0 0 "[ . 1 . 2]" 1
1153 1 108 GLN H 1 109 THR MG 4.610 . 4.610 3.655 2.801 4.544 . 0 0 "[ . 1 . 2]" 1
1154 1 41 ILE QG 1 43 GLN H 5.270 . 5.270 4.983 4.895 5.092 . 0 0 "[ . 1 . 2]" 1
1155 1 43 GLN H 1 104 VAL QG . . 4.420 4.107 3.975 4.234 . 0 0 "[ . 1 . 2]" 1
1156 1 57 HIS H 1 58 LEU H 4.530 . 4.530 4.338 4.215 4.421 . 0 0 "[ . 1 . 2]" 1
1157 1 56 THR HB 1 57 HIS H 4.590 . 4.590 4.266 4.167 4.443 . 0 0 "[ . 1 . 2]" 1
1158 1 79 LEU HA 1 84 ARG H 4.750 . 4.750 4.499 4.400 4.613 . 0 0 "[ . 1 . 2]" 1
1159 1 63 GLU HA 1 65 TYR H 4.670 . 4.670 4.306 4.097 4.480 . 0 0 "[ . 1 . 2]" 1
1160 1 62 LYS HA 1 65 TYR H 4.300 . 4.300 3.284 3.061 3.484 . 0 0 "[ . 1 . 2]" 1
1161 1 83 GLN HB3 1 84 ARG H 4.730 . 4.730 4.232 4.095 4.358 . 0 0 "[ . 1 . 2]" 1
1162 1 65 TYR H 1 66 CYS HA 5.280 . 5.280 5.225 5.134 5.282 0.002 16 0 "[ . 1 . 2]" 1
1163 1 65 TYR H 1 65 TYR HB2 3.810 . 3.810 3.049 2.914 3.176 . 0 0 "[ . 1 . 2]" 1
1164 1 80 PHE HB2 1 103 GLU H 4.180 . 4.180 3.648 3.424 4.146 . 0 0 "[ . 1 . 2]" 1
1165 1 79 LEU HA 1 82 GLY H 6.000 . 6.000 5.119 4.945 5.362 . 0 0 "[ . 1 . 2]" 1
1166 1 79 LEU HA 1 103 GLU H 6.000 . 6.000 5.066 4.916 5.172 . 0 0 "[ . 1 . 2]" 1
1167 1 81 GLU HA 1 82 GLY H 3.370 . 3.370 2.982 2.938 3.032 . 0 0 "[ . 1 . 2]" 1
1168 1 103 GLU H 1 103 GLU HG2 4.850 . 4.850 4.661 4.344 4.717 . 0 0 "[ . 1 . 2]" 1
1169 1 103 GLU H 1 103 GLU QB 3.490 . 3.490 2.338 2.308 2.370 . 0 0 "[ . 1 . 2]" 1
1170 1 102 ILE HB 1 103 GLU H 4.410 . 4.410 4.107 4.030 4.184 . 0 0 "[ . 1 . 2]" 1
1171 1 81 GLU HB2 1 82 GLY H 4.050 . 4.050 4.023 4.003 4.045 . 0 0 "[ . 1 . 2]" 1
1172 1 102 ILE MD 1 103 GLU H 4.490 . 4.490 4.598 4.548 4.646 0.156 8 0 "[ . 1 . 2]" 1
1173 1 38 LEU H 1 50 PHE H 3.980 . 3.980 3.074 2.901 3.331 . 0 0 "[ . 1 . 2]" 1
1174 1 78 PHE H 1 85 ILE H 4.470 . 4.470 4.191 4.065 4.360 . 0 0 "[ . 1 . 2]" 1
1175 1 38 LEU H 1 50 PHE HB2 4.720 . 4.720 4.220 4.036 4.462 . 0 0 "[ . 1 . 2]" 1
1176 1 77 ARG QB 1 78 PHE H 4.060 . 4.060 2.967 2.723 3.123 . 0 0 "[ . 1 . 2]" 1
1177 1 37 LYS HB2 1 38 LEU H 3.820 . 3.820 2.964 2.694 3.328 . 0 0 "[ . 1 . 2]" 1
1178 1 38 LEU H 1 38 LEU HB3 4.100 . 4.100 3.799 3.768 3.840 . 0 0 "[ . 1 . 2]" 1
1179 1 38 LEU H 1 52 VAL MG2 4.210 . 4.210 3.303 3.102 3.536 . 0 0 "[ . 1 . 2]" 1
1180 1 38 LEU H 1 38 LEU HG 4.090 . 4.090 3.358 3.204 3.484 . 0 0 "[ . 1 . 2]" 1
1181 1 38 LEU H 1 49 HIS HA 5.090 . 5.090 4.584 4.341 4.951 . 0 0 "[ . 1 . 2]" 1
1182 1 80 PHE H 1 82 GLY H 4.470 . 4.470 3.457 3.369 3.649 . 0 0 "[ . 1 . 2]" 1
1183 1 77 ARG H 1 78 PHE QE 5.870 . 5.870 5.354 5.209 5.494 . 0 0 "[ . 1 . 2]" 1
1184 1 77 ARG H 1 77 ARG QD 4.630 . 4.630 4.048 1.897 4.469 . 0 0 "[ . 1 . 2]" 1
1185 1 78 PHE QD 1 85 ILE H 4.600 . 4.600 3.081 2.734 3.497 . 0 0 "[ . 1 . 2]" 1
1186 1 77 ARG H 1 105 TYR HB3 6.000 . 6.000 4.731 4.589 4.819 . 0 0 "[ . 1 . 2]" 1
1187 1 73 MET H 1 73 MET QB 3.510 . 3.510 2.504 2.447 2.611 . 0 0 "[ . 1 . 2]" 1
1188 1 76 LEU HB3 1 77 ARG H 4.250 . 4.250 4.050 3.910 4.119 . 0 0 "[ . 1 . 2]" 1
1189 1 84 ARG H 1 85 ILE H 4.680 . 4.680 4.561 4.533 4.585 . 0 0 "[ . 1 . 2]" 1
1190 1 78 PHE HB3 1 85 ILE H 5.470 . 5.470 4.889 4.546 5.150 . 0 0 "[ . 1 . 2]" 1
1191 1 85 ILE H 1 85 ILE QG 3.780 . 3.780 1.955 1.897 2.042 . 0 0 "[ . 1 . 2]" 1
1192 1 84 ARG QB 1 85 ILE H 4.040 . 4.040 2.965 2.824 3.111 . 0 0 "[ . 1 . 2]" 1
1193 1 41 ILE H 1 47 GLU HA 5.010 . 5.010 4.720 4.602 4.827 . 0 0 "[ . 1 . 2]" 1
1194 1 41 ILE H 1 101 VAL HA 4.870 . 4.870 4.866 4.707 4.989 0.119 6 0 "[ . 1 . 2]" 1
1195 1 41 ILE H 1 41 ILE QG 4.090 . 4.090 4.099 4.076 4.117 0.027 14 0 "[ . 1 . 2]" 1
1196 1 40 VAL H 1 50 PHE HE2 5.490 . 5.490 5.398 5.304 5.491 0.001 18 0 "[ . 1 . 2]" 1
1197 1 40 VAL H 1 47 GLU HA 4.700 . 4.700 4.505 4.396 4.629 . 0 0 "[ . 1 . 2]" 1
1198 1 36 ILE HA 1 52 VAL H 5.140 . 5.140 4.942 4.787 5.057 . 0 0 "[ . 1 . 2]" 1
1199 1 49 HIS HB3 1 50 PHE H 3.880 . 3.880 3.379 3.176 3.613 . 0 0 "[ . 1 . 2]" 1
1200 1 39 LYS HB3 1 40 VAL H 4.200 . 4.200 4.244 4.145 4.298 0.098 3 0 "[ . 1 . 2]" 1
1201 1 40 VAL H 1 101 VAL QG 5.420 . 5.420 5.351 5.165 5.505 0.085 3 0 "[ . 1 . 2]" 1
1202 1 39 LYS HG2 1 40 VAL H 4.200 . 4.200 2.549 2.294 2.769 . 0 0 "[ . 1 . 2]" 1
1203 1 40 VAL H 1 61 LEU MD1 4.590 . 4.590 4.429 4.338 4.553 . 0 0 "[ . 1 . 2]" 1
1204 1 50 PHE H 1 61 LEU MD1 4.810 . 4.810 3.735 3.594 3.913 . 0 0 "[ . 1 . 2]" 1
1205 1 37 LYS HB3 1 52 VAL H 4.850 . 4.850 4.473 4.093 4.778 . 0 0 "[ . 1 . 2]" 1
1206 1 41 ILE H 1 102 ILE H 4.280 . 4.280 3.424 3.305 3.547 . 0 0 "[ . 1 . 2]" 1
1207 1 36 ILE H 1 52 VAL MG2 4.170 . 4.170 3.474 3.286 3.704 . 0 0 "[ . 1 . 2]" 1
1208 1 97 GLU H 1 98 GLU H 4.730 . 4.730 4.437 4.381 4.520 . 0 0 "[ . 1 . 2]" 1
1209 1 97 GLU H 1 100 ASP H 5.220 . 5.220 4.617 4.349 4.924 . 0 0 "[ . 1 . 2]" 1
1210 1 96 MET HA 1 97 GLU H 3.220 . 3.220 2.476 2.372 2.572 . 0 0 "[ . 1 . 2]" 1
1211 1 97 GLU H 1 100 ASP HB3 4.350 . 4.350 3.692 3.282 4.028 . 0 0 "[ . 1 . 2]" 1
1212 1 97 GLU H 1 97 GLU HB2 4.100 . 4.100 2.583 2.421 2.818 . 0 0 "[ . 1 . 2]" 1
1213 1 38 LEU QD 1 97 GLU H 4.270 . 4.270 3.879 3.388 4.291 0.021 19 0 "[ . 1 . 2]" 1
1214 1 98 GLU H 1 99 GLU H 4.710 . 4.710 4.544 4.513 4.586 . 0 0 "[ . 1 . 2]" 1
1215 1 58 LEU H 1 91 PRO QD 4.450 . 4.450 3.905 3.711 4.073 . 0 0 "[ . 1 . 2]" 1
1216 1 36 ILE HG13 1 99 GLU H 4.770 . 4.770 3.342 2.996 3.684 . 0 0 "[ . 1 . 2]" 1
1217 1 37 LYS QG 1 99 GLU H 4.000 . 4.000 2.348 2.069 2.682 . 0 0 "[ . 1 . 2]" 1
1218 1 58 LEU H 1 90 THR MG 4.920 . 4.920 3.581 3.337 3.928 . 0 0 "[ . 1 . 2]" 1
1219 1 36 ILE MD 1 99 GLU H 4.800 . 4.800 4.154 3.673 4.608 . 0 0 "[ . 1 . 2]" 1
1220 1 81 GLU H 1 82 GLY HA3 5.320 . 5.320 5.304 5.197 5.374 0.054 11 0 "[ . 1 . 2]" 1
1221 1 78 PHE H 1 79 LEU H 4.490 . 4.490 4.252 4.180 4.343 . 0 0 "[ . 1 . 2]" 1
1222 1 79 LEU H 1 103 GLU H 4.060 . 4.060 3.733 3.506 3.881 . 0 0 "[ . 1 . 2]" 1
1223 1 79 LEU H 1 103 GLU QB 4.650 . 4.650 3.664 3.365 3.864 . 0 0 "[ . 1 . 2]" 1
1224 1 73 MET H 1 74 ASN HD21 4.610 . 4.610 3.812 3.624 3.997 . 0 0 "[ . 1 . 2]" 1
1225 1 65 TYR H 1 69 GLN HE21 5.280 . 5.280 5.227 5.158 5.293 0.013 4 0 "[ . 1 . 2]" 1
1226 1 65 TYR QD 1 69 GLN HE21 3.310 . 3.310 1.926 1.762 2.154 0.038 19 0 "[ . 1 . 2]" 1
1227 1 74 ASN HA 1 74 ASN HD21 4.440 . 4.440 4.077 3.932 4.157 . 0 0 "[ . 1 . 2]" 1
1228 1 65 TYR HA 1 69 GLN HE21 4.510 . 4.510 2.666 2.561 2.772 . 0 0 "[ . 1 . 2]" 1
1229 1 65 TYR HB3 1 69 GLN HE21 4.620 . 4.620 4.481 4.330 4.628 0.008 5 0 "[ . 1 . 2]" 1
1230 1 73 MET QG 1 74 ASN HD21 4.570 . 4.570 3.184 2.880 3.599 . 0 0 "[ . 1 . 2]" 1
1231 1 68 ARG QB 1 69 GLN HE21 4.530 . 4.530 3.116 2.777 3.439 . 0 0 "[ . 1 . 2]" 1
1232 1 76 LEU QD 1 106 GLN HE21 4.720 . 4.720 4.012 3.756 4.232 . 0 0 "[ . 1 . 2]" 1
1233 1 104 VAL QG 1 106 GLN HE21 3.580 . 3.580 3.554 3.336 3.682 0.102 6 0 "[ . 1 . 2]" 1
1234 1 72 PRO QB 1 74 ASN HD22 3.900 . 3.900 2.469 2.261 2.762 . 0 0 "[ . 1 . 2]" 1
1235 1 85 ILE H 1 86 ALA H 4.640 . 4.640 4.211 4.164 4.337 . 0 0 "[ . 1 . 2]" 1
1236 1 86 ALA H 1 89 HIS HB2 4.370 . 4.370 2.404 2.209 2.684 . 0 0 "[ . 1 . 2]" 1
1237 1 85 ILE MD 1 86 ALA H 4.580 . 4.580 4.058 3.880 4.120 . 0 0 "[ . 1 . 2]" 1
1238 1 86 ALA H 1 94 LEU MD1 4.600 . 4.600 4.414 4.080 4.681 0.081 20 0 "[ . 1 . 2]" 1
1239 1 16 SER H 1 17 ASP H 3.780 . 3.780 2.702 1.948 3.786 0.006 7 0 "[ . 1 . 2]" 1
1240 1 98 GLU HB2 1 100 ASP H 4.740 . 4.740 4.765 4.615 4.847 0.107 3 0 "[ . 1 . 2]" 1
1241 1 40 VAL H 1 61 LEU MD2 4.440 . 4.440 4.092 3.941 4.270 . 0 0 "[ . 1 . 2]" 1
1242 1 50 PHE HE2 1 61 LEU MD2 4.180 . 4.180 2.897 2.726 3.034 . 0 0 "[ . 1 . 2]" 1
1243 1 78 PHE QD 1 104 VAL QG 4.610 . 4.610 2.368 2.242 2.426 . 0 0 "[ . 1 . 2]" 1
1244 1 76 LEU HA 1 104 VAL QG 4.610 . 4.610 4.543 4.383 4.650 0.040 6 0 "[ . 1 . 2]" 1
1245 1 104 VAL QG 1 106 GLN HA 4.470 . 4.470 4.214 4.026 4.327 . 0 0 "[ . 1 . 2]" 1
1246 1 61 LEU MD2 1 64 SER QB 4.070 . 4.070 3.570 3.370 3.747 . 0 0 "[ . 1 . 2]" 1
1247 1 61 LEU HA 1 61 LEU MD2 3.760 . 3.760 2.952 2.853 3.073 . 0 0 "[ . 1 . 2]" 1
1248 1 61 LEU MD2 1 65 TYR HB3 4.450 . 4.450 3.267 3.149 3.391 . 0 0 "[ . 1 . 2]" 1
1249 1 61 LEU MD2 1 62 LYS HA 3.630 . 3.630 2.917 2.738 3.064 . 0 0 "[ . 1 . 2]" 1
1250 1 40 VAL HB 1 61 LEU MD2 4.200 . 4.200 3.127 3.017 3.282 . 0 0 "[ . 1 . 2]" 1
1251 1 104 VAL QG 1 106 GLN HB2 5.160 . 5.160 4.729 4.464 5.115 . 0 0 "[ . 1 . 2]" 1
1252 1 48 ILE HB 1 61 LEU MD2 4.440 . 4.440 3.860 3.703 4.036 . 0 0 "[ . 1 . 2]" 1
1253 1 76 LEU HB2 1 104 VAL QG 3.750 . 3.750 3.294 3.163 3.396 . 0 0 "[ . 1 . 2]" 1
1254 1 61 LEU HB2 1 61 LEU MD2 3.410 . 3.410 3.213 3.202 3.220 . 0 0 "[ . 1 . 2]" 1
1255 1 61 LEU MD2 1 62 LYS QD 3.560 . 3.560 2.288 2.027 2.555 . 0 0 "[ . 1 . 2]" 1
1256 1 48 ILE QG 1 61 LEU MD2 4.230 . 4.230 2.941 2.771 3.122 . 0 0 "[ . 1 . 2]" 1
1257 1 40 VAL MG2 1 61 LEU MD2 2.880 . 2.880 1.895 1.844 1.972 . 0 0 "[ . 1 . 2]" 1
1258 1 48 ILE MD 1 61 LEU MD2 3.380 . 3.380 2.105 1.972 2.175 . 0 0 "[ . 1 . 2]" 1
1259 1 61 LEU MD2 1 62 LYS QG 4.550 . 4.550 3.764 3.492 4.067 . 0 0 "[ . 1 . 2]" 1
1260 1 62 LYS QG 1 104 VAL QG 4.880 . 4.880 2.827 2.702 2.919 . 0 0 "[ . 1 . 2]" 1
1261 1 80 PHE QD 1 94 LEU MD2 4.560 . 4.560 3.300 2.382 3.813 . 0 0 "[ . 1 . 2]" 1
1262 1 89 HIS HD2 1 94 LEU MD2 4.020 . 4.020 3.712 3.369 3.957 . 0 0 "[ . 1 . 2]" 1
1263 1 89 HIS HA 1 94 LEU MD2 4.840 . 4.840 4.272 4.107 4.555 . 0 0 "[ . 1 . 2]" 1
1264 1 94 LEU HA 1 94 LEU MD2 2.760 . 2.760 2.092 2.030 2.132 . 0 0 "[ . 1 . 2]" 1
1265 1 58 LEU HA 1 61 LEU HG 6.000 . 6.000 5.399 5.286 5.557 . 0 0 "[ . 1 . 2]" 1
1266 1 93 GLU HA 1 94 LEU MD2 6.000 . 6.000 5.323 5.192 5.547 . 0 0 "[ . 1 . 2]" 1
1267 1 61 LEU HA 1 61 LEU HG 3.740 . 3.740 2.591 2.548 2.631 . 0 0 "[ . 1 . 2]" 1
1268 1 89 HIS HB2 1 94 LEU MD2 4.480 . 4.480 3.979 3.823 4.155 . 0 0 "[ . 1 . 2]" 1
1269 1 80 PHE HB3 1 94 LEU MD2 4.770 . 4.770 3.676 2.841 4.171 . 0 0 "[ . 1 . 2]" 1
1270 1 83 GLN QG 1 94 LEU MD2 4.150 . 4.150 2.481 2.297 2.734 . 0 0 "[ . 1 . 2]" 1
1271 1 83 GLN HB3 1 94 LEU MD2 4.300 . 4.300 4.473 4.406 4.580 0.280 20 0 "[ . 1 . 2]" 1
1272 1 93 GLU HB3 1 94 LEU MD2 4.220 . 4.220 3.601 3.337 3.997 . 0 0 "[ . 1 . 2]" 1
1273 1 94 LEU MD2 1 96 MET QG 4.750 . 4.750 4.284 4.032 5.158 0.408 19 0 "[ . 1 . 2]" 1
1274 1 85 ILE QG 1 94 LEU MD2 5.350 . 5.350 4.811 4.489 4.994 . 0 0 "[ . 1 . 2]" 1
1275 1 40 VAL MG1 1 41 ILE QG 5.100 . 5.100 5.014 4.949 5.084 . 0 0 "[ . 1 . 2]" 1
1276 1 90 THR MG 1 94 LEU MD2 5.890 . 5.890 5.893 5.816 5.987 0.097 14 0 "[ . 1 . 2]" 1
1277 1 48 ILE MD 1 61 LEU HG 4.370 . 4.370 4.004 3.762 4.129 . 0 0 "[ . 1 . 2]" 1
1278 1 40 VAL MG1 1 102 ILE H 4.360 . 4.360 4.259 4.088 4.378 0.018 3 0 "[ . 1 . 2]" 1
1279 1 40 VAL MG1 1 78 PHE QD 4.720 . 4.720 4.471 4.210 4.654 . 0 0 "[ . 1 . 2]" 1
1280 1 40 VAL MG1 1 47 GLU HA 4.740 . 4.740 4.427 4.208 4.611 . 0 0 "[ . 1 . 2]" 1
1281 1 40 VAL HA 1 40 VAL MG1 3.330 . 3.330 2.449 2.431 2.468 . 0 0 "[ . 1 . 2]" 1
1282 1 40 VAL MG1 1 103 GLU HA 5.100 . 5.100 4.531 4.256 4.720 . 0 0 "[ . 1 . 2]" 1
1283 1 40 VAL MG1 1 104 VAL HA 5.570 . 5.570 4.691 4.510 4.801 . 0 0 "[ . 1 . 2]" 1
1284 1 40 VAL MG1 1 62 LYS QE 4.770 . 4.770 3.077 2.603 3.877 . 0 0 "[ . 1 . 2]" 1
1285 1 40 VAL MG1 1 102 ILE HB 3.640 . 3.640 3.106 2.849 3.321 . 0 0 "[ . 1 . 2]" 1
1286 1 39 LYS QD 1 40 VAL MG1 4.610 . 4.610 4.679 4.599 4.849 0.239 8 0 "[ . 1 . 2]" 1
1287 1 40 VAL MG1 1 41 ILE MG 4.550 . 4.550 4.084 3.993 4.151 . 0 0 "[ . 1 . 2]" 1
1288 1 40 VAL MG1 1 48 ILE MD 3.990 . 3.990 2.658 2.558 2.801 . 0 0 "[ . 1 . 2]" 1
1289 1 40 VAL MG1 1 61 LEU MD2 3.660 . 3.660 3.359 3.309 3.428 . 0 0 "[ . 1 . 2]" 1
1290 1 36 ILE H 1 36 ILE MD 4.970 . 4.970 4.761 4.683 4.833 . 0 0 "[ . 1 . 2]" 1
1291 1 36 ILE HA 1 36 ILE MD 3.990 . 3.990 3.901 3.830 3.947 . 0 0 "[ . 1 . 2]" 1
1292 1 36 ILE MD 1 97 GLU HA 3.680 . 3.680 3.149 2.735 3.730 0.050 7 0 "[ . 1 . 2]" 1
1293 1 36 ILE MD 1 54 MET HA 4.350 . 4.350 4.192 3.816 4.403 0.053 10 0 "[ . 1 . 2]" 1
1294 1 36 ILE MD 1 98 GLU QG 4.660 . 4.660 4.107 3.528 4.489 . 0 0 "[ . 1 . 2]" 1
1295 1 36 ILE MD 1 52 VAL MG2 3.500 . 3.500 3.141 2.977 3.308 . 0 0 "[ . 1 . 2]" 1
1296 1 80 PHE H 1 94 LEU MD1 5.660 . 5.660 4.960 4.786 5.055 . 0 0 "[ . 1 . 2]" 1
1297 1 89 HIS HE1 1 94 LEU MD1 4.490 . 4.490 4.642 4.582 4.715 0.225 10 0 "[ . 1 . 2]" 1
1298 1 94 LEU MD1 1 96 MET H 5.310 . 5.310 4.914 4.622 5.219 . 0 0 "[ . 1 . 2]" 1
1299 1 80 PHE QD 1 94 LEU MD1 3.720 . 3.720 3.167 2.817 3.468 . 0 0 "[ . 1 . 2]" 1
1300 1 89 HIS HD2 1 94 LEU MD1 5.110 . 5.110 4.751 4.178 4.900 . 0 0 "[ . 1 . 2]" 1
1301 1 85 ILE HA 1 94 LEU MD1 3.740 . 3.740 3.227 2.915 3.536 . 0 0 "[ . 1 . 2]" 1
1302 1 91 PRO HA 1 94 LEU MD1 3.570 . 3.570 3.316 3.213 3.400 . 0 0 "[ . 1 . 2]" 1
1303 1 80 PHE HB2 1 94 LEU MD1 4.800 . 4.800 3.921 3.485 4.212 . 0 0 "[ . 1 . 2]" 1
1304 1 89 HIS HB3 1 94 LEU MD1 3.510 . 3.510 2.255 2.120 2.397 . 0 0 "[ . 1 . 2]" 1
1305 1 80 PHE HB3 1 94 LEU MD1 4.080 . 4.080 3.100 2.834 3.303 . 0 0 "[ . 1 . 2]" 1
1306 1 93 GLU HB3 1 94 LEU MD1 4.500 . 4.500 4.140 3.999 4.314 . 0 0 "[ . 1 . 2]" 1
1307 1 94 LEU MD1 1 96 MET ME 3.970 . 3.970 2.027 1.883 2.089 . 0 0 "[ . 1 . 2]" 1
1308 1 85 ILE QG 1 94 LEU MD1 4.210 . 4.210 3.720 3.561 3.829 . 0 0 "[ . 1 . 2]" 1
1309 1 85 ILE MD 1 94 LEU MD1 2.850 . 2.850 1.994 1.896 2.076 . 0 0 "[ . 1 . 2]" 1
1310 1 79 LEU HA 1 79 LEU MD2 4.170 . 4.170 4.054 3.943 4.082 . 0 0 "[ . 1 . 2]" 1
1311 1 38 LEU HA 1 38 LEU HG 4.110 . 4.110 3.028 2.936 3.087 . 0 0 "[ . 1 . 2]" 1
1312 1 38 LEU HG 1 98 GLU HA 4.570 . 4.570 4.137 3.787 4.390 . 0 0 "[ . 1 . 2]" 1
1313 1 61 LEU HA 1 61 LEU MD1 3.780 . 3.780 3.817 3.800 3.845 0.065 4 0 "[ . 1 . 2]" 1
1314 1 50 PHE HB3 1 61 LEU MD1 3.730 . 3.730 2.919 2.777 3.041 . 0 0 "[ . 1 . 2]" 1
1315 1 50 PHE HB2 1 61 LEU MD1 4.100 . 4.100 1.996 1.917 2.066 . 0 0 "[ . 1 . 2]" 1
1316 1 61 LEU HB2 1 61 LEU MD1 3.000 . 3.000 2.315 2.302 2.336 . 0 0 "[ . 1 . 2]" 1
1317 1 36 ILE HG13 1 38 LEU HG 3.500 . 3.500 3.392 3.201 3.557 0.057 3 0 "[ . 1 . 2]" 1
1318 1 61 LEU HB3 1 61 LEU MD1 3.360 . 3.360 2.405 2.372 2.430 . 0 0 "[ . 1 . 2]" 1
1319 1 36 ILE HG12 1 38 LEU HG 3.170 . 3.170 2.372 2.198 2.636 . 0 0 "[ . 1 . 2]" 1
1320 1 40 VAL MG2 1 61 LEU MD1 3.490 . 3.490 2.653 2.582 2.700 . 0 0 "[ . 1 . 2]" 1
1321 1 48 ILE MD 1 61 LEU MD1 3.870 . 3.870 3.885 3.808 3.925 0.055 15 0 "[ . 1 . 2]" 1
1322 1 36 ILE MD 1 38 LEU HG 3.390 . 3.390 2.901 2.692 3.094 . 0 0 "[ . 1 . 2]" 1
1323 1 50 PHE HA 1 61 LEU MD1 4.810 . 4.810 4.558 4.464 4.633 . 0 0 "[ . 1 . 2]" 1
1324 1 38 LEU HA 1 102 ILE MD 5.240 . 5.240 4.470 4.137 4.697 . 0 0 "[ . 1 . 2]" 1
1325 1 101 VAL HA 1 102 ILE MD 4.450 . 4.450 3.122 3.019 3.233 . 0 0 "[ . 1 . 2]" 1
1326 1 100 ASP HB2 1 102 ILE MD 5.260 . 5.260 4.719 4.407 5.012 . 0 0 "[ . 1 . 2]" 1
1327 1 51 LYS H 1 61 LEU MD1 4.880 . 4.880 4.987 4.910 5.046 0.166 6 0 "[ . 1 . 2]" 1
1328 1 76 LEU QD 1 78 PHE QD 3.490 . 3.490 1.926 1.846 2.104 . 0 0 "[ . 1 . 2]" 1
1329 1 48 ILE MG 1 65 TYR QD 3.740 . 3.740 3.413 2.720 3.795 0.055 16 0 "[ . 1 . 2]" 1
1330 1 49 HIS HA 1 61 LEU MD1 4.920 . 4.920 4.948 4.833 5.012 0.092 19 0 "[ . 1 . 2]" 1
1331 1 48 ILE HA 1 48 ILE MG 3.140 . 3.140 2.258 2.235 2.276 . 0 0 "[ . 1 . 2]" 1
1332 1 47 GLU QG 1 48 ILE MG 4.640 . 4.640 4.461 4.281 4.649 0.009 15 0 "[ . 1 . 2]" 1
1333 1 40 VAL HB 1 61 LEU MD1 4.290 . 4.290 4.433 4.387 4.497 0.207 14 0 "[ . 1 . 2]" 1
1334 1 101 VAL HB 1 102 ILE MD 4.810 . 4.810 4.695 4.588 4.785 . 0 0 "[ . 1 . 2]" 1
1335 1 48 ILE QG 1 48 ILE MG 3.180 . 3.180 2.366 2.343 2.401 . 0 0 "[ . 1 . 2]" 1
1336 1 51 LYS H 1 52 VAL MG2 5.460 . 5.460 5.275 5.108 5.410 . 0 0 "[ . 1 . 2]" 1
1337 1 76 LEU QD 1 105 TYR H 3.660 . 3.660 3.451 3.305 3.607 . 0 0 "[ . 1 . 2]" 1
1338 1 85 ILE MD 1 89 HIS HE1 5.110 . 5.110 4.670 4.219 4.976 . 0 0 "[ . 1 . 2]" 1
1339 1 83 GLN HE21 1 85 ILE MD 4.130 . 4.130 4.026 3.692 4.238 0.108 14 0 "[ . 1 . 2]" 1
1340 1 79 LEU MD1 1 105 TYR QD 3.920 . 3.920 3.142 2.704 3.493 . 0 0 "[ . 1 . 2]" 1
1341 1 37 LYS HA 1 52 VAL MG2 3.830 . 3.830 2.970 2.661 3.212 . 0 0 "[ . 1 . 2]" 1
1342 1 79 LEU HA 1 85 ILE MD 3.980 . 3.980 2.888 2.803 3.028 . 0 0 "[ . 1 . 2]" 1
1343 1 80 PHE HA 1 85 ILE MD 4.090 . 4.090 3.880 3.674 4.057 . 0 0 "[ . 1 . 2]" 1
1344 1 76 LEU HA 1 76 LEU QD 3.060 . 3.060 3.046 3.022 3.065 0.005 4 0 "[ . 1 . 2]" 1
1345 1 52 VAL HA 1 52 VAL MG2 3.720 . 3.720 3.223 3.217 3.231 . 0 0 "[ . 1 . 2]" 1
1346 1 76 LEU QD 1 78 PHE HA 4.130 . 4.130 3.763 3.554 3.896 . 0 0 "[ . 1 . 2]" 1
1347 1 76 LEU QD 1 104 VAL HA 3.910 . 3.910 3.870 3.754 3.950 0.040 11 0 "[ . 1 . 2]" 1
1348 1 76 LEU QD 1 77 ARG HA 4.100 . 4.100 2.726 2.657 2.819 . 0 0 "[ . 1 . 2]" 1
1349 1 83 GLN HA 1 85 ILE MD 6.000 . 6.000 5.401 5.243 5.554 . 0 0 "[ . 1 . 2]" 1
1350 1 84 ARG HA 1 85 ILE MD 3.730 . 3.730 3.705 3.602 3.791 0.061 15 0 "[ . 1 . 2]" 1
1351 1 51 LYS HA 1 52 VAL MG2 4.240 . 4.240 3.630 3.502 3.834 . 0 0 "[ . 1 . 2]" 1
1352 1 58 LEU HA 1 58 LEU QD 3.540 . 3.540 1.959 1.919 2.000 . 0 0 "[ . 1 . 2]" 1
1353 1 56 THR HB 1 58 LEU QD 4.740 . 4.740 3.248 2.925 3.781 . 0 0 "[ . 1 . 2]" 1
1354 1 58 LEU QD 1 91 PRO QD 3.570 . 3.570 2.316 2.027 2.540 . 0 0 "[ . 1 . 2]" 1
1355 1 85 ILE MD 1 89 HIS HB3 4.610 . 4.610 3.711 3.506 3.859 . 0 0 "[ . 1 . 2]" 1
1356 1 50 PHE HB2 1 52 VAL MG2 5.180 . 5.180 5.003 4.831 5.194 0.014 2 0 "[ . 1 . 2]" 1
1357 1 83 GLN QG 1 85 ILE MD 3.900 . 3.900 2.827 2.616 3.007 . 0 0 "[ . 1 . 2]" 1
1358 1 76 LEU HB2 1 76 LEU QD 3.260 . 3.260 2.190 2.157 2.224 . 0 0 "[ . 1 . 2]" 1
1359 1 36 ILE HG13 1 52 VAL MG2 3.670 . 3.670 3.771 3.704 3.846 0.176 18 0 "[ . 1 . 2]" 1
1360 1 56 THR MG 1 58 LEU QD 4.140 . 4.140 2.698 2.267 3.182 . 0 0 "[ . 1 . 2]" 1
1361 1 58 LEU QD 1 61 LEU HB3 4.350 . 4.350 3.273 3.124 3.387 . 0 0 "[ . 1 . 2]" 1
1362 1 85 ILE MD 1 94 LEU MD2 3.340 . 3.340 2.965 2.620 3.148 . 0 0 "[ . 1 . 2]" 1
1363 1 80 PHE HB2 1 85 ILE MD 3.300 . 3.300 2.332 2.138 2.431 . 0 0 "[ . 1 . 2]" 1
1364 1 80 PHE HB3 1 85 ILE MD 3.630 . 3.630 2.177 1.941 2.328 . 0 0 "[ . 1 . 2]" 1
1365 1 39 LYS HG2 1 41 ILE H 4.800 . 4.800 4.877 4.723 4.935 0.135 5 0 "[ . 1 . 2]" 1
1366 1 39 LYS HG2 1 48 ILE H 3.750 . 3.750 2.581 2.245 2.876 . 0 0 "[ . 1 . 2]" 1
1367 1 39 LYS H 1 39 LYS HG2 4.540 . 4.540 4.536 4.442 4.562 0.022 7 0 "[ . 1 . 2]" 1
1368 1 48 ILE MD 1 65 TYR QD 3.290 . 3.290 2.667 2.168 3.013 . 0 0 "[ . 1 . 2]" 1
1369 1 39 LYS HG2 1 40 VAL HA 4.770 . 4.770 4.228 4.059 4.361 . 0 0 "[ . 1 . 2]" 1
1370 1 40 VAL HA 1 48 ILE MD 5.480 . 5.480 4.853 4.751 4.975 . 0 0 "[ . 1 . 2]" 1
1371 1 39 LYS HG2 1 41 ILE HA 4.810 . 4.810 4.541 4.429 4.633 . 0 0 "[ . 1 . 2]" 1
1372 1 71 VAL HA 1 71 VAL MG2 3.510 . 3.510 3.078 2.575 3.206 . 0 0 "[ . 1 . 2]" 1
1373 1 39 LYS HA 1 39 LYS HG2 3.850 . 3.850 2.672 2.507 2.760 . 0 0 "[ . 1 . 2]" 1
1374 1 76 LEU HB3 1 106 GLN HA 4.150 . 4.150 3.017 2.866 3.137 . 0 0 "[ . 1 . 2]" 1
1375 1 39 LYS HG2 1 48 ILE HA 4.790 . 4.790 4.489 4.237 4.596 . 0 0 "[ . 1 . 2]" 1
1376 1 75 SER HB3 1 76 LEU HB3 4.690 . 4.690 3.928 3.492 4.343 . 0 0 "[ . 1 . 2]" 1
1377 1 48 ILE MD 1 65 TYR HA 3.890 . 3.890 3.378 2.898 3.671 . 0 0 "[ . 1 . 2]" 1
1378 1 48 ILE MD 1 61 LEU HA 5.440 . 5.440 5.087 4.792 5.317 . 0 0 "[ . 1 . 2]" 1
1379 1 48 ILE MD 1 65 TYR HB2 4.450 . 4.450 1.914 1.797 2.073 0.003 17 0 "[ . 1 . 2]" 1
1380 1 48 ILE MD 1 50 PHE HB2 5.030 . 5.030 4.953 4.775 5.067 0.037 16 0 "[ . 1 . 2]" 1
1381 1 40 VAL HB 1 48 ILE MD 3.300 . 3.300 2.210 2.093 2.358 . 0 0 "[ . 1 . 2]" 1
1382 1 76 LEU HB3 1 106 GLN HB3 4.080 . 4.080 3.391 3.143 3.608 . 0 0 "[ . 1 . 2]" 1
1383 1 38 LEU QD 1 99 GLU H 3.790 . 3.790 2.870 2.620 3.170 . 0 0 "[ . 1 . 2]" 1
1384 1 85 ILE H 1 85 ILE MG 3.810 . 3.810 3.766 3.751 3.784 . 0 0 "[ . 1 . 2]" 1
1385 1 38 LEU H 1 38 LEU QD 3.940 . 3.940 3.664 3.571 3.727 . 0 0 "[ . 1 . 2]" 1
1386 1 59 LYS H 1 85 ILE MG 4.090 . 4.090 3.687 3.202 4.136 0.046 15 0 "[ . 1 . 2]" 1
1387 1 27 LEU H 1 27 LEU MD2 4.590 . 4.590 2.664 1.717 4.583 0.083 14 0 "[ . 1 . 2]" 1
1388 1 27 LEU MD2 1 29 ASP H 4.760 . 4.760 3.959 1.801 4.819 0.059 2 0 "[ . 1 . 2]" 1
1389 1 37 LYS HA 1 38 LEU QD 5.180 . 5.180 4.367 4.272 4.495 . 0 0 "[ . 1 . 2]" 1
1390 1 35 TYR HA 1 36 ILE MG 3.950 . 3.950 3.004 2.897 3.141 . 0 0 "[ . 1 . 2]" 1
1391 1 38 LEU HA 1 38 LEU QD 3.050 . 3.050 2.015 1.969 2.057 . 0 0 "[ . 1 . 2]" 1
1392 1 86 ALA MB 1 89 HIS HA 3.700 . 3.700 3.832 3.750 3.928 0.228 6 0 "[ . 1 . 2]" 1
1393 1 38 LEU QD 1 100 ASP HA 4.090 . 4.090 4.118 3.989 4.189 0.099 15 0 "[ . 1 . 2]" 1
1394 1 36 ILE HA 1 36 ILE MG 3.190 . 3.190 3.146 3.121 3.169 . 0 0 "[ . 1 . 2]" 1
1395 1 85 ILE HA 1 85 ILE MG 3.090 . 3.090 2.245 2.207 2.312 . 0 0 "[ . 1 . 2]" 1
1396 1 27 LEU HA 1 27 LEU MD2 4.190 . 4.190 3.638 2.483 3.970 . 0 0 "[ . 1 . 2]" 1
1397 1 27 LEU MD2 1 30 LYS HA 4.330 . 4.330 3.474 1.965 4.353 0.023 15 0 "[ . 1 . 2]" 1
1398 1 38 LEU QD 1 98 GLU HA 3.350 . 3.350 2.920 2.539 3.215 . 0 0 "[ . 1 . 2]" 1
1399 1 36 ILE MG 1 54 MET HA 3.650 . 3.650 2.822 2.679 3.015 . 0 0 "[ . 1 . 2]" 1
1400 1 41 ILE MD 1 45 SER HA 3.850 . 3.850 3.342 2.626 3.870 0.020 14 0 "[ . 1 . 2]" 1
1401 1 38 LEU QD 1 91 PRO QD 4.000 . 4.000 3.082 2.826 3.273 . 0 0 "[ . 1 . 2]" 1
1402 1 85 ILE MG 1 89 HIS HB2 4.060 . 4.060 2.518 2.295 2.670 . 0 0 "[ . 1 . 2]" 1
1403 1 86 ALA MB 1 89 HIS HB2 4.200 . 4.200 2.745 2.470 2.982 . 0 0 "[ . 1 . 2]" 1
1404 1 38 LEU QD 1 100 ASP HB3 3.400 . 3.400 2.413 2.181 2.577 . 0 0 "[ . 1 . 2]" 1
1405 1 85 ILE MG 1 89 HIS HB3 3.590 . 3.590 2.380 2.187 2.494 . 0 0 "[ . 1 . 2]" 1
1406 1 38 LEU QD 1 100 ASP HB2 3.470 . 3.470 2.889 2.377 3.209 . 0 0 "[ . 1 . 2]" 1
1407 1 35 TYR HB2 1 36 ILE MG 4.570 . 4.570 4.069 3.761 4.305 . 0 0 "[ . 1 . 2]" 1
1408 1 86 ALA MB 1 87 ASP QB 4.650 . 4.650 4.067 3.677 4.269 . 0 0 "[ . 1 . 2]" 1
1409 1 86 ALA MB 1 88 ASN HB3 5.100 . 5.100 4.568 4.265 5.064 . 0 0 "[ . 1 . 2]" 1
1410 1 38 LEU QD 1 91 PRO QB 3.320 . 3.320 1.936 1.801 2.060 . 0 0 "[ . 1 . 2]" 1
1411 1 27 LEU MD2 1 30 LYS QB 3.520 . 3.520 2.268 1.755 3.555 0.045 6 0 "[ . 1 . 2]" 1
1412 1 36 ILE HG13 1 36 ILE MG 3.620 . 3.620 3.204 3.196 3.212 . 0 0 "[ . 1 . 2]" 1
1413 1 36 ILE HG13 1 38 LEU QD 3.820 . 3.820 3.225 3.068 3.510 . 0 0 "[ . 1 . 2]" 1
1414 1 38 LEU HB3 1 38 LEU QD 2.840 . 2.840 2.103 2.096 2.110 . 0 0 "[ . 1 . 2]" 1
1415 1 41 ILE MD 1 41 ILE MG 2.680 . 2.680 1.918 1.890 1.938 . 0 0 "[ . 1 . 2]" 1
1416 1 36 ILE MG 1 52 VAL MG2 2.850 . 2.850 1.899 1.844 2.008 . 0 0 "[ . 1 . 2]" 1
1417 1 38 LEU QD 1 52 VAL MG2 3.250 . 3.250 2.064 1.982 2.207 . 0 0 "[ . 1 . 2]" 1
1418 1 85 ILE MD 1 85 ILE MG 3.270 . 3.270 1.999 1.966 2.069 . 0 0 "[ . 1 . 2]" 1
1419 1 85 ILE MG 1 94 LEU MD1 2.740 . 2.740 2.168 1.914 2.306 . 0 0 "[ . 1 . 2]" 1
1420 1 71 VAL HA 1 71 VAL MG1 3.510 . 3.510 2.216 2.173 2.312 . 0 0 "[ . 1 . 2]" 1
1421 1 39 LYS HA 1 40 VAL MG2 3.950 . 3.950 3.654 3.581 3.735 . 0 0 "[ . 1 . 2]" 1
1422 1 40 VAL MG2 1 104 VAL QG 4.040 . 4.040 3.566 3.410 3.691 . 0 0 "[ . 1 . 2]" 1
1423 1 40 VAL MG2 1 102 ILE H 3.990 . 3.990 3.724 3.540 3.889 . 0 0 "[ . 1 . 2]" 1
1424 1 102 ILE H 1 102 ILE QG 4.340 . 4.340 3.726 3.651 3.811 . 0 0 "[ . 1 . 2]" 1
1425 1 52 VAL H 1 52 VAL MG1 3.930 . 3.930 2.902 2.605 3.154 . 0 0 "[ . 1 . 2]" 1
1426 1 76 LEU HG 1 77 ARG H 4.460 . 4.460 4.476 4.299 4.622 0.162 18 0 "[ . 1 . 2]" 1
1427 1 40 VAL MG2 1 48 ILE H 4.810 . 4.810 4.647 4.553 4.737 . 0 0 "[ . 1 . 2]" 1
1428 1 36 ILE HG12 1 37 LYS H 3.990 . 3.990 3.293 3.060 3.495 . 0 0 "[ . 1 . 2]" 1
1429 1 27 LEU MD1 1 28 GLY H 4.750 . 4.750 3.819 2.114 5.097 0.347 2 0 "[ . 1 . 2]" 1
1430 1 40 VAL MG2 1 50 PHE QD 3.700 . 3.700 3.740 3.700 3.773 0.073 10 0 "[ . 1 . 2]" 1
1431 1 40 VAL HA 1 40 VAL MG2 3.400 . 3.400 2.337 2.309 2.368 . 0 0 "[ . 1 . 2]" 1
1432 1 36 ILE HA 1 36 ILE HG12 3.780 . 3.780 3.515 3.450 3.558 . 0 0 "[ . 1 . 2]" 1
1433 1 27 LEU HA 1 27 LEU MD1 4.190 . 4.190 3.600 2.116 4.139 . 0 0 "[ . 1 . 2]" 1
1434 1 36 ILE HG12 1 98 GLU HA 4.350 . 4.350 3.493 3.336 3.663 . 0 0 "[ . 1 . 2]" 1
1435 1 40 VAL MG2 1 62 LYS HA 3.770 . 3.770 3.849 3.761 3.917 0.147 7 0 "[ . 1 . 2]" 1
1436 1 51 LYS QE 1 52 VAL MG1 5.480 . 5.480 5.608 5.320 5.941 0.461 13 0 "[ . 1 . 2]" 1
1437 1 36 ILE HG12 1 38 LEU H 5.170 . 5.170 4.544 4.330 4.701 . 0 0 "[ . 1 . 2]" 1
1438 1 52 VAL MG1 1 56 THR H 5.420 . 5.420 5.144 5.020 5.278 . 0 0 "[ . 1 . 2]" 1
1439 1 36 ILE HG12 1 37 LYS HA 4.380 . 4.380 3.831 3.622 3.969 . 0 0 "[ . 1 . 2]" 1
1440 1 79 LEU HA 1 102 ILE MG 4.860 . 4.860 3.954 3.851 4.127 . 0 0 "[ . 1 . 2]" 1
1441 1 27 LEU MD1 1 30 LYS HA 4.330 . 4.330 3.387 2.465 4.423 0.093 6 0 "[ . 1 . 2]" 1
1442 1 80 PHE HB2 1 102 ILE QG 3.420 . 3.420 2.127 2.009 2.277 . 0 0 "[ . 1 . 2]" 1
1443 1 50 PHE HB2 1 52 VAL MG1 3.870 . 3.870 3.381 3.231 3.605 . 0 0 "[ . 1 . 2]" 1
1444 1 40 VAL MG2 1 48 ILE QG 3.500 . 3.500 2.945 2.882 3.013 . 0 0 "[ . 1 . 2]" 1
1445 1 80 PHE HA 1 102 ILE QG 4.850 . 4.850 4.125 3.769 4.358 . 0 0 "[ . 1 . 2]" 1
1446 1 52 VAL HA 1 52 VAL MG1 3.050 . 3.050 2.344 2.298 2.402 . 0 0 "[ . 1 . 2]" 1
1447 1 52 VAL MG1 1 56 THR HB 3.830 . 3.830 3.129 2.992 3.300 . 0 0 "[ . 1 . 2]" 1
1448 1 40 VAL MG2 1 65 TYR HB3 4.820 . 4.820 4.647 4.502 4.787 . 0 0 "[ . 1 . 2]" 1
1449 1 38 LEU HB2 1 52 VAL MG1 3.340 . 3.340 3.287 3.071 3.371 0.031 18 0 "[ . 1 . 2]" 1
1450 1 40 VAL MG2 1 61 LEU HG 4.510 . 4.510 4.278 4.178 4.406 . 0 0 "[ . 1 . 2]" 1
1451 1 80 PHE H 1 102 ILE MG 5.410 . 5.410 4.355 4.125 4.606 . 0 0 "[ . 1 . 2]" 1
1452 1 38 LEU H 1 52 VAL MG1 4.100 . 4.100 3.767 3.530 3.955 . 0 0 "[ . 1 . 2]" 1
1453 1 39 LYS H 1 40 VAL MG2 4.680 . 4.680 4.523 4.443 4.621 . 0 0 "[ . 1 . 2]" 1
1454 1 102 ILE MG 1 103 GLU HA 4.100 . 4.100 3.682 3.609 3.783 . 0 0 "[ . 1 . 2]" 1
1455 1 102 ILE MG 1 104 VAL HA 4.590 . 4.590 4.096 4.015 4.178 . 0 0 "[ . 1 . 2]" 1
1456 1 38 LEU HG 1 52 VAL MG1 4.510 . 4.510 4.025 3.801 4.249 . 0 0 "[ . 1 . 2]" 1
1457 1 39 LYS HG3 1 47 GLU HA 4.480 . 4.480 4.512 4.193 4.683 0.203 6 0 "[ . 1 . 2]" 1
1458 1 41 ILE HA 1 41 ILE MG 3.200 . 3.200 3.220 3.215 3.225 0.025 18 0 "[ . 1 . 2]" 1
1459 1 41 ILE MG 1 101 VAL HB 3.880 . 3.880 2.577 2.311 2.819 . 0 0 "[ . 1 . 2]" 1
1460 1 41 ILE QG 1 41 ILE MG 3.150 . 3.150 2.353 2.325 2.392 . 0 0 "[ . 1 . 2]" 1
1461 1 89 HIS H 1 90 THR MG 5.000 . 5.000 4.302 4.129 4.419 . 0 0 "[ . 1 . 2]" 1
1462 1 89 HIS HD2 1 90 THR MG 5.220 . 5.220 4.768 4.428 4.949 . 0 0 "[ . 1 . 2]" 1
1463 1 89 HIS HA 1 90 THR MG 4.140 . 4.140 3.252 3.126 3.330 . 0 0 "[ . 1 . 2]" 1
1464 1 55 THR HB 1 90 THR MG 3.950 . 3.950 3.137 2.938 3.399 . 0 0 "[ . 1 . 2]" 1
1465 1 57 HIS HA 1 90 THR MG 4.440 . 4.440 2.299 2.048 2.669 . 0 0 "[ . 1 . 2]" 1
1466 1 88 ASN HA 1 90 THR MG 4.700 . 4.700 4.051 3.845 4.185 . 0 0 "[ . 1 . 2]" 1
1467 1 90 THR MG 1 93 GLU HA 5.190 . 5.190 5.338 5.245 5.475 0.285 10 0 "[ . 1 . 2]" 1
1468 1 90 THR MG 1 93 GLU HB3 4.300 . 4.300 4.113 3.877 4.304 0.004 8 0 "[ . 1 . 2]" 1
1469 1 90 THR MG 1 94 LEU HG 5.200 . 5.200 5.331 5.285 5.376 0.176 18 0 "[ . 1 . 2]" 1
1470 1 90 THR MG 1 92 LYS QG 4.050 . 4.050 3.293 3.195 3.396 . 0 0 "[ . 1 . 2]" 1
1471 1 39 LYS H 1 101 VAL QG 4.150 . 4.150 3.726 3.509 3.889 . 0 0 "[ . 1 . 2]" 1
1472 1 80 PHE QE 1 101 VAL QG 4.200 . 4.200 3.688 3.331 4.109 . 0 0 "[ . 1 . 2]" 1
1473 1 41 ILE QG 1 47 GLU HA 4.730 . 4.730 3.414 3.146 3.589 . 0 0 "[ . 1 . 2]" 1
1474 1 41 ILE HA 1 41 ILE QG 3.860 . 3.860 2.354 2.298 2.398 . 0 0 "[ . 1 . 2]" 1
1475 1 100 ASP HB3 1 101 VAL QG 4.610 . 4.610 4.243 4.142 4.322 . 0 0 "[ . 1 . 2]" 1
1476 1 41 ILE QG 1 47 GLU QG 4.750 . 4.750 4.378 4.046 4.604 . 0 0 "[ . 1 . 2]" 1
1477 1 39 LYS QD 1 101 VAL QG 2.770 . 2.770 1.959 1.778 2.612 0.022 17 0 "[ . 1 . 2]" 1
1478 1 55 THR MG 1 56 THR H 4.370 . 4.370 4.388 4.332 4.425 0.055 10 0 "[ . 1 . 2]" 1
1479 1 54 MET HB2 1 55 THR MG 4.530 . 4.530 4.001 2.907 4.429 . 0 0 "[ . 1 . 2]" 1
1480 1 55 THR MG 1 92 LYS QG 2.750 . 2.750 2.234 1.828 2.793 0.043 11 0 "[ . 1 . 2]" 1
1481 1 55 THR MG 1 90 THR MG 3.710 . 3.710 3.471 3.140 3.728 0.018 20 0 "[ . 1 . 2]" 1
1482 1 37 LYS QG 1 38 LEU H 4.440 . 4.440 4.028 3.811 4.479 0.039 16 0 "[ . 1 . 2]" 1
1483 1 59 LYS H 1 59 LYS HG2 4.640 . 4.640 4.446 4.202 4.575 . 0 0 "[ . 1 . 2]" 1
1484 1 40 VAL H 1 48 ILE QG 4.570 . 4.570 2.352 2.273 2.434 . 0 0 "[ . 1 . 2]" 1
1485 1 24 THR H 1 24 THR MG 3.860 . 3.860 3.397 2.223 3.991 0.131 18 0 "[ . 1 . 2]" 1
1486 1 47 GLU HA 1 48 ILE QG 4.640 . 4.640 3.337 3.247 3.421 . 0 0 "[ . 1 . 2]" 1
1487 1 108 GLN HA 1 109 THR MG 5.150 . 5.150 4.814 4.485 5.172 0.022 6 0 "[ . 1 . 2]" 1
1488 1 24 THR HA 1 24 THR MG 2.990 . 2.990 2.420 2.180 3.202 0.212 11 0 "[ . 1 . 2]" 1
1489 1 59 LYS HG2 1 87 ASP QB 4.320 . 4.320 3.173 2.151 4.609 0.289 2 0 "[ . 1 . 2]" 1
1490 1 40 VAL HB 1 48 ILE QG 4.080 . 4.080 1.878 1.833 1.917 . 0 0 "[ . 1 . 2]" 1
1491 1 48 ILE QG 1 65 TYR HE1 5.690 . 5.690 5.251 4.560 5.711 0.021 5 0 "[ . 1 . 2]" 1
1492 1 48 ILE QG 1 49 HIS HA 4.790 . 4.790 4.341 4.253 4.433 . 0 0 "[ . 1 . 2]" 1
1493 1 104 VAL HB 1 105 TYR H 4.330 . 4.330 4.269 4.208 4.336 0.006 2 0 "[ . 1 . 2]" 1
1494 1 60 LYS H 1 61 LEU HB3 6.000 . 6.000 4.941 4.826 5.092 . 0 0 "[ . 1 . 2]" 1
1495 1 104 VAL HB 1 105 TYR HA 5.040 . 5.040 5.020 4.964 5.073 0.033 13 0 "[ . 1 . 2]" 1
1496 1 42 GLY QA 1 104 VAL HB 4.240 . 4.240 2.675 2.513 2.846 . 0 0 "[ . 1 . 2]" 1
1497 1 59 LYS HG3 1 87 ASP QB 4.320 . 4.320 3.473 2.475 4.398 0.078 3 0 "[ . 1 . 2]" 1
1498 1 40 VAL MG1 1 104 VAL HB 3.880 . 3.880 2.987 2.800 3.210 . 0 0 "[ . 1 . 2]" 1
1499 1 79 LEU HB3 1 84 ARG HA 4.640 . 4.640 2.485 2.244 2.744 . 0 0 "[ . 1 . 2]" 1
1500 1 81 GLU HB2 1 82 GLY HA3 5.250 . 5.250 5.158 5.070 5.262 0.012 8 0 "[ . 1 . 2]" 1
1501 1 80 PHE HB3 1 81 GLU HB2 4.480 . 4.480 4.412 4.200 4.539 0.059 3 0 "[ . 1 . 2]" 1
1502 1 81 GLU H 1 81 GLU HB2 3.690 . 3.690 3.482 3.425 3.590 . 0 0 "[ . 1 . 2]" 1
1503 1 59 LYS H 1 59 LYS HG3 4.640 . 4.640 4.389 4.167 4.609 . 0 0 "[ . 1 . 2]" 1
1504 1 61 LEU HB3 1 62 LYS H 4.860 . 4.860 2.432 2.285 2.552 . 0 0 "[ . 1 . 2]" 1
1505 1 80 PHE QE 1 81 GLU HB2 4.520 . 4.520 4.119 3.784 4.553 0.033 20 0 "[ . 1 . 2]" 1
1506 1 55 THR HB 1 92 LYS QG 4.760 . 4.760 4.056 3.619 4.736 . 0 0 "[ . 1 . 2]" 1
1507 1 90 THR HB 1 92 LYS QG 4.500 . 4.500 2.975 2.666 3.251 . 0 0 "[ . 1 . 2]" 1
1508 1 58 LEU HA 1 61 LEU HB3 5.020 . 5.020 3.110 2.976 3.250 . 0 0 "[ . 1 . 2]" 1
1509 1 56 THR MG 1 91 PRO QD 4.740 . 4.740 3.895 3.674 4.102 . 0 0 "[ . 1 . 2]" 1
1510 1 91 PRO QD 1 92 LYS QG 5.110 . 5.110 4.071 3.847 4.320 . 0 0 "[ . 1 . 2]" 1
1511 1 20 ALA MB 1 22 PRO HD3 5.840 . 5.840 5.565 4.993 5.960 0.120 3 0 "[ . 1 . 2]" 1
1512 1 20 ALA MB 1 21 LYS QE 4.720 . 4.720 4.327 2.422 4.821 0.101 16 0 "[ . 1 . 2]" 1
1513 1 81 GLU HB2 1 83 GLN QG 4.040 . 4.040 3.508 3.172 3.918 . 0 0 "[ . 1 . 2]" 1
1514 1 36 ILE HG13 1 98 GLU QG 4.420 . 4.420 4.146 3.729 4.425 0.005 20 0 "[ . 1 . 2]" 1
1515 1 52 VAL HB 1 56 THR MG 3.880 . 3.880 2.555 2.261 2.825 . 0 0 "[ . 1 . 2]" 1
1516 1 92 LYS QG 1 93 GLU HB3 4.510 . 4.510 4.295 4.063 4.586 0.076 17 0 "[ . 1 . 2]" 1
1517 1 36 ILE HG13 1 98 GLU HB3 3.450 . 3.450 2.456 2.105 2.731 . 0 0 "[ . 1 . 2]" 1
1518 1 48 ILE MD 1 61 LEU HB3 5.220 . 5.220 5.048 4.857 5.179 . 0 0 "[ . 1 . 2]" 1
1519 1 36 ILE HG13 1 37 LYS H 4.190 . 4.190 2.460 2.254 2.588 . 0 0 "[ . 1 . 2]" 1
1520 1 36 ILE HA 1 36 ILE HG13 3.970 . 3.970 2.824 2.726 2.899 . 0 0 "[ . 1 . 2]" 1
1521 1 92 LYS QG 1 93 GLU HB2 4.030 . 4.030 2.996 2.819 3.306 . 0 0 "[ . 1 . 2]" 1
1522 1 92 LYS HB3 1 92 LYS QG 2.800 . 2.800 2.155 2.129 2.235 . 0 0 "[ . 1 . 2]" 1
1523 1 56 THR H 1 92 LYS QG 5.080 . 5.080 4.785 4.576 5.144 0.064 1 0 "[ . 1 . 2]" 1
1524 1 36 ILE HG13 1 98 GLU HA 3.250 . 3.250 2.020 1.919 2.194 . 0 0 "[ . 1 . 2]" 1
1525 1 81 GLU HA 1 81 GLU HG3 4.080 . 4.080 3.512 3.106 3.745 . 0 0 "[ . 1 . 2]" 1
1526 1 91 PRO QG 1 92 LYS QG 4.260 . 4.260 4.086 3.883 4.295 0.035 8 0 "[ . 1 . 2]" 1
1527 1 36 ILE HG13 1 98 GLU HB2 3.860 . 3.860 3.248 2.497 3.912 0.052 12 0 "[ . 1 . 2]" 1
1528 1 20 ALA H 1 21 LYS QG 5.050 . 5.050 4.573 3.963 5.089 0.039 1 0 "[ . 1 . 2]" 1
1529 1 37 LYS HA 1 38 LEU HB2 5.050 . 5.050 4.423 4.326 4.493 . 0 0 "[ . 1 . 2]" 1
1530 1 37 LYS HA 1 51 LYS QG 5.270 . 5.270 3.898 3.429 4.905 . 0 0 "[ . 1 . 2]" 1
1531 1 58 LEU HA 1 62 LYS QD 4.250 . 4.250 3.846 3.612 4.087 . 0 0 "[ . 1 . 2]" 1
1532 1 89 HIS HB2 1 94 LEU HG 5.500 . 5.500 4.701 4.507 4.859 . 0 0 "[ . 1 . 2]" 1
1533 1 51 LYS QB 1 51 LYS QD 3.380 . 3.380 2.450 2.104 2.857 . 0 0 "[ . 1 . 2]" 1
1534 1 61 LEU HB3 1 62 LYS QD 3.240 . 3.240 2.463 2.317 2.703 . 0 0 "[ . 1 . 2]" 1
1535 1 21 LYS HA 1 21 LYS QG 3.860 . 3.860 3.033 2.335 3.528 . 0 0 "[ . 1 . 2]" 1
1536 1 85 ILE HA 1 94 LEU HG 5.790 . 5.790 5.284 5.047 5.443 . 0 0 "[ . 1 . 2]" 1
1537 1 93 GLU HB3 1 94 LEU HG 3.840 . 3.840 2.691 2.484 2.938 . 0 0 "[ . 1 . 2]" 1
1538 1 89 HIS HD2 1 94 LEU HG 4.480 . 4.480 4.137 3.105 4.349 . 0 0 "[ . 1 . 2]" 1
1539 1 39 LYS HB3 1 40 VAL HA 5.410 . 5.410 5.140 4.930 5.215 . 0 0 "[ . 1 . 2]" 1
1540 1 94 LEU HA 1 94 LEU HG 3.220 . 3.220 2.950 2.851 3.002 . 0 0 "[ . 1 . 2]" 1
1541 1 93 GLU HA 1 94 LEU HG 5.370 . 5.370 5.075 4.982 5.212 . 0 0 "[ . 1 . 2]" 1
1542 1 21 LYS QG 1 22 PRO HD2 4.110 . 4.110 3.507 2.558 4.157 0.047 16 0 "[ . 1 . 2]" 1
1543 1 94 LEU HG 1 96 MET ME 3.830 . 3.830 3.816 3.707 3.909 0.079 20 0 "[ . 1 . 2]" 1
1544 1 51 LYS QG 1 52 VAL H 3.950 . 3.950 2.981 2.607 3.714 . 0 0 "[ . 1 . 2]" 1
1545 1 39 LYS HB3 1 101 VAL HA 3.990 . 3.990 3.418 3.158 3.616 . 0 0 "[ . 1 . 2]" 1
1546 1 84 ARG HA 1 84 ARG QG 3.730 . 3.730 3.220 2.326 3.547 . 0 0 "[ . 1 . 2]" 1
1547 1 36 ILE MD 1 38 LEU HB2 5.200 . 5.200 4.988 4.777 5.171 . 0 0 "[ . 1 . 2]" 1
1548 1 79 LEU HA 1 79 LEU HG 3.720 . 3.720 3.646 3.590 3.664 . 0 0 "[ . 1 . 2]" 1
1549 1 77 ARG H 1 77 ARG QG 3.870 . 3.870 2.369 2.143 3.193 . 0 0 "[ . 1 . 2]" 1
1550 1 77 ARG QG 1 78 PHE H 4.600 . 4.600 4.063 3.815 4.290 . 0 0 "[ . 1 . 2]" 1
1551 1 78 PHE H 1 79 LEU HG 5.180 . 5.180 4.830 4.652 5.215 0.035 5 0 "[ . 1 . 2]" 1
1552 1 77 ARG QG 1 104 VAL HA 5.020 . 5.020 3.926 3.596 4.165 . 0 0 "[ . 1 . 2]" 1
1553 1 79 LEU HG 1 104 VAL HA 5.450 . 5.450 4.002 3.628 4.365 . 0 0 "[ . 1 . 2]" 1
1554 1 77 ARG HA 1 77 ARG QG 3.990 . 3.990 3.344 3.290 3.518 . 0 0 "[ . 1 . 2]" 1
1555 1 77 ARG QG 1 105 TYR HB2 3.910 . 3.910 2.130 1.970 2.847 . 0 0 "[ . 1 . 2]" 1
1556 1 76 LEU HA 1 77 ARG QG 5.580 . 5.580 3.652 3.160 4.849 . 0 0 "[ . 1 . 2]" 1
1557 1 91 PRO HA 1 94 LEU QB 3.670 . 3.670 3.024 2.882 3.116 . 0 0 "[ . 1 . 2]" 1
1558 1 59 LYS HB3 1 60 LYS HA 5.060 . 5.060 4.377 3.921 4.703 . 0 0 "[ . 1 . 2]" 1
1559 1 80 PHE HB3 1 94 LEU QB 5.060 . 5.060 4.146 3.963 4.501 . 0 0 "[ . 1 . 2]" 1
1560 1 76 LEU HB2 1 106 GLN HA 4.390 . 4.390 2.123 1.956 2.264 . 0 0 "[ . 1 . 2]" 1
1561 1 39 LYS QD 1 48 ILE H 3.930 . 3.930 3.819 3.256 4.037 0.107 13 0 "[ . 1 . 2]" 1
1562 1 76 LEU HB2 1 106 GLN HE21 4.350 . 4.350 3.762 3.496 4.028 . 0 0 "[ . 1 . 2]" 1
1563 1 65 TYR HE2 1 76 LEU HB2 4.880 . 4.880 4.151 3.775 4.530 . 0 0 "[ . 1 . 2]" 1
1564 1 39 LYS QD 1 40 VAL HA 4.130 . 4.130 3.454 3.260 3.841 . 0 0 "[ . 1 . 2]" 1
1565 1 39 LYS QD 1 41 ILE HA 4.420 . 4.420 3.639 3.187 3.930 . 0 0 "[ . 1 . 2]" 1
1566 1 37 LYS HB2 1 99 GLU HA 4.640 . 4.640 4.225 3.751 4.668 0.028 9 0 "[ . 1 . 2]" 1
1567 1 59 LYS QD 1 87 ASP QB 3.770 . 3.770 3.520 2.326 4.024 0.254 5 0 "[ . 1 . 2]" 1
1568 1 39 LYS QD 1 101 VAL HA 3.970 . 3.970 3.032 2.701 3.459 . 0 0 "[ . 1 . 2]" 1
1569 1 39 LYS HB2 1 49 HIS HA 4.500 . 4.500 2.787 2.674 2.851 . 0 0 "[ . 1 . 2]" 1
1570 1 36 ILE HA 1 37 LYS QD 5.390 . 5.390 5.257 4.915 5.412 0.022 17 0 "[ . 1 . 2]" 1
1571 1 27 LEU HB2 1 28 GLY H 4.660 . 4.660 3.968 3.144 4.506 . 0 0 "[ . 1 . 2]" 1
1572 1 59 LYS HA 1 85 ILE HB 5.270 . 5.270 4.575 3.995 5.331 0.061 15 0 "[ . 1 . 2]" 1
1573 1 78 PHE HB2 1 85 ILE HB 3.790 . 3.790 2.633 2.290 2.921 . 0 0 "[ . 1 . 2]" 1
1574 1 27 LEU HG 1 28 GLY QA 6.000 . 6.000 3.971 3.514 5.587 . 0 0 "[ . 1 . 2]" 1
1575 1 55 THR HB 1 92 LYS QD 5.030 . 5.030 4.653 4.092 5.197 0.167 3 0 "[ . 1 . 2]" 1
1576 1 27 LEU HG 1 30 LYS H 4.940 . 4.940 3.113 2.077 4.578 . 0 0 "[ . 1 . 2]" 1
1577 1 91 PRO QD 1 92 LYS HB3 4.810 . 4.810 4.720 4.565 4.843 0.033 9 0 "[ . 1 . 2]" 1
1578 1 92 LYS HB2 1 92 LYS QD 3.340 . 3.340 2.228 2.103 2.270 . 0 0 "[ . 1 . 2]" 1
1579 1 66 CYS H 1 69 GLN QB 4.950 . 4.950 4.851 4.705 4.954 0.004 7 0 "[ . 1 . 2]" 1
1580 1 36 ILE H 1 36 ILE HB 4.020 . 4.020 3.654 3.563 3.728 . 0 0 "[ . 1 . 2]" 1
1581 1 55 THR H 1 92 LYS HB3 4.740 . 4.740 4.826 4.629 4.964 0.224 14 0 "[ . 1 . 2]" 1
1582 1 69 GLN QB 1 71 VAL HA 4.990 . 4.990 4.946 4.754 5.095 0.105 12 0 "[ . 1 . 2]" 1
1583 1 27 LEU HA 1 27 LEU HG 3.920 . 3.920 3.519 2.444 3.785 . 0 0 "[ . 1 . 2]" 1
1584 1 55 THR HA 1 92 LYS HB3 4.400 . 4.400 3.814 3.600 4.128 . 0 0 "[ . 1 . 2]" 1
1585 1 26 ASP QB 1 27 LEU HG 6.000 . 6.000 5.529 3.898 6.488 0.488 10 0 "[ . 1 . 2]" 1
1586 1 77 ARG QB 1 105 TYR H 4.520 . 4.520 4.326 4.194 4.570 0.050 7 0 "[ . 1 . 2]" 1
1587 1 36 ILE HB 1 98 GLU QG 4.360 . 4.360 4.291 3.781 4.578 0.218 20 0 "[ . 1 . 2]" 1
1588 1 77 ARG H 1 77 ARG QB 3.810 . 3.810 3.123 3.007 3.204 . 0 0 "[ . 1 . 2]" 1
1589 1 36 ILE HB 1 37 LYS H 3.920 . 3.920 3.781 3.701 3.890 . 0 0 "[ . 1 . 2]" 1
1590 1 69 GLN QB 1 69 GLN HE21 4.110 . 4.110 2.923 2.866 2.988 . 0 0 "[ . 1 . 2]" 1
1591 1 65 TYR HE2 1 69 GLN QB 5.520 . 5.520 5.144 4.594 5.498 . 0 0 "[ . 1 . 2]" 1
1592 1 58 LEU HA 1 58 LEU HG 4.150 . 4.150 3.036 2.901 3.168 . 0 0 "[ . 1 . 2]" 1
1593 1 19 GLU QB 1 21 LYS QD 3.620 . 3.620 2.396 1.828 3.277 . 0 0 "[ . 1 . 2]" 1
1594 1 54 MET HB3 1 92 LYS HB3 4.180 . 4.180 3.713 2.076 4.271 0.091 14 0 "[ . 1 . 2]" 1
1595 1 107 GLU HB3 1 108 GLN H 3.920 . 3.920 2.355 1.903 2.871 . 0 0 "[ . 1 . 2]" 1
1596 1 62 LYS QB 1 78 PHE HB3 4.250 . 4.250 4.024 3.655 4.287 0.037 17 0 "[ . 1 . 2]" 1
1597 1 21 LYS HB3 1 22 PRO HD3 4.710 . 4.710 4.117 3.531 4.651 . 0 0 "[ . 1 . 2]" 1
1598 1 21 LYS HB3 1 22 PRO HD2 3.800 . 3.800 2.987 2.085 3.891 0.091 17 0 "[ . 1 . 2]" 1
1599 1 62 LYS QB 1 65 TYR QD 4.260 . 4.260 3.502 3.136 4.198 . 0 0 "[ . 1 . 2]" 1
1600 1 35 TYR QD 1 37 LYS HB3 4.200 . 4.200 3.955 3.608 4.257 0.057 2 0 "[ . 1 . 2]" 1
1601 1 35 TYR QE 1 37 LYS HB3 5.120 . 5.120 4.037 2.812 4.847 . 0 0 "[ . 1 . 2]" 1
1602 1 60 LYS QD 1 61 LEU H 5.720 . 5.720 4.100 2.855 4.603 . 0 0 "[ . 1 . 2]" 1
1603 1 57 HIS HA 1 58 LEU QB 4.520 . 4.520 4.335 4.266 4.380 . 0 0 "[ . 1 . 2]" 1
1604 1 60 LYS HA 1 60 LYS QD 3.670 . 3.670 2.700 1.927 3.749 0.079 5 0 "[ . 1 . 2]" 1
1605 1 95 GLY QA 1 96 MET QB 5.420 . 5.420 4.610 4.528 4.655 . 0 0 "[ . 1 . 2]" 1
1606 1 101 VAL HA 1 102 ILE HB 4.390 . 4.390 4.392 4.343 4.438 0.048 5 0 "[ . 1 . 2]" 1
1607 1 39 LYS QD 1 41 ILE HB 3.430 . 3.430 2.229 1.920 2.514 . 0 0 "[ . 1 . 2]" 1
1608 1 58 LEU QB 1 61 LEU MD2 5.690 . 5.690 4.392 4.209 4.630 . 0 0 "[ . 1 . 2]" 1
1609 1 61 LEU MD2 1 102 ILE HB 6.000 . 6.000 5.333 5.045 5.609 . 0 0 "[ . 1 . 2]" 1
1610 1 68 ARG QG 1 69 GLN H 4.430 . 4.430 3.663 3.471 3.759 . 0 0 "[ . 1 . 2]" 1
1611 1 94 LEU H 1 96 MET QB 5.310 . 5.310 5.210 5.035 5.317 0.007 10 0 "[ . 1 . 2]" 1
1612 1 40 VAL HA 1 102 ILE HB 3.920 . 3.920 2.607 2.454 2.759 . 0 0 "[ . 1 . 2]" 1
1613 1 68 ARG QG 1 69 GLN HA 3.690 . 3.690 3.706 3.534 3.814 0.124 14 0 "[ . 1 . 2]" 1
1614 1 92 LYS HB2 1 92 LYS QE 4.310 . 4.310 3.376 2.210 4.055 . 0 0 "[ . 1 . 2]" 1
1615 1 54 MET QG 1 92 LYS HB2 4.350 . 4.350 3.137 2.585 4.516 0.166 4 0 "[ . 1 . 2]" 1
1616 1 55 THR MG 1 92 LYS HB2 4.110 . 4.110 4.070 3.893 4.248 0.138 12 0 "[ . 1 . 2]" 1
1617 1 41 ILE HB 1 41 ILE MD 2.990 . 2.990 2.446 2.419 2.488 . 0 0 "[ . 1 . 2]" 1
1618 1 78 PHE H 1 84 ARG QB 4.700 . 4.700 4.232 3.878 4.521 . 0 0 "[ . 1 . 2]" 1
1619 1 47 GLU HB3 1 48 ILE H 4.240 . 4.240 4.029 3.805 4.186 . 0 0 "[ . 1 . 2]" 1
1620 1 37 LYS HA 1 51 LYS QB 4.880 . 4.880 4.300 4.055 4.603 . 0 0 "[ . 1 . 2]" 1
1621 1 79 LEU HA 1 84 ARG QB 5.150 . 5.150 4.109 3.861 4.389 . 0 0 "[ . 1 . 2]" 1
1622 1 29 ASP QB 1 30 LYS QB 5.040 . 5.040 4.824 4.045 5.247 0.207 9 0 "[ . 1 . 2]" 1
1623 1 59 LYS H 1 60 LYS QB 4.640 . 4.640 4.442 4.252 4.716 0.076 5 0 "[ . 1 . 2]" 1
1624 1 79 LEU HB2 1 82 GLY HA3 5.610 . 5.610 4.812 4.447 5.043 . 0 0 "[ . 1 . 2]" 1
1625 1 27 LEU MD1 1 30 LYS QB 3.520 . 3.520 2.976 1.781 3.845 0.325 17 0 "[ . 1 . 2]" 1
1626 1 28 GLY QA 1 30 LYS QB 5.030 . 5.030 4.475 3.713 5.219 0.189 6 0 "[ . 1 . 2]" 1
1627 1 79 LEU HB2 1 82 GLY H 4.080 . 4.080 3.215 2.952 3.430 . 0 0 "[ . 1 . 2]" 1
1628 1 48 ILE HB 1 49 HIS H 3.650 . 3.650 3.226 3.084 3.391 . 0 0 "[ . 1 . 2]" 1
1629 1 30 LYS QB 1 31 LYS H 4.090 . 4.090 3.712 3.001 4.027 . 0 0 "[ . 1 . 2]" 1
1630 1 79 LEU HA 1 85 ILE QG 4.230 . 4.230 2.532 2.296 2.746 . 0 0 "[ . 1 . 2]" 1
1631 1 85 ILE HA 1 85 ILE QG 3.920 . 3.920 3.120 3.067 3.146 . 0 0 "[ . 1 . 2]" 1
1632 1 80 PHE HB2 1 85 ILE QG 3.960 . 3.960 3.843 3.629 3.984 0.024 12 0 "[ . 1 . 2]" 1
1633 1 79 LEU HB2 1 83 GLN QG 4.460 . 4.460 4.426 4.272 4.509 0.049 8 0 "[ . 1 . 2]" 1
1634 1 79 LEU HB2 1 83 GLN H 3.610 . 3.610 3.139 3.004 3.321 . 0 0 "[ . 1 . 2]" 1
1635 1 54 MET H 1 54 MET ME 4.690 . 4.690 4.117 3.933 4.173 . 0 0 "[ . 1 . 2]" 1
1636 1 54 MET ME 1 93 GLU H 6.000 . 6.000 4.934 4.748 5.083 . 0 0 "[ . 1 . 2]" 1
1637 1 93 GLU H 1 96 MET QG 6.000 . 6.000 5.830 5.085 5.943 . 0 0 "[ . 1 . 2]" 1
1638 1 93 GLU H 1 96 MET ME 6.000 . 6.000 5.046 4.943 5.272 . 0 0 "[ . 1 . 2]" 1
1639 1 78 PHE QD 1 85 ILE QG 4.720 . 4.720 3.454 3.121 3.783 . 0 0 "[ . 1 . 2]" 1
1640 1 54 MET ME 1 92 LYS HA 3.130 . 3.130 2.811 2.678 3.132 0.002 7 0 "[ . 1 . 2]" 1
1641 1 37 LYS QG 1 98 GLU HB3 4.470 . 4.470 3.646 3.051 4.225 . 0 0 "[ . 1 . 2]" 1
1642 1 90 THR MG 1 96 MET ME 5.880 . 5.880 5.671 5.558 5.876 . 0 0 "[ . 1 . 2]" 1
1643 1 36 ILE MD 1 98 GLU HB3 3.870 . 3.870 3.250 2.656 3.805 . 0 0 "[ . 1 . 2]" 1
1644 1 96 MET QG 1 97 GLU H 4.310 . 4.310 3.818 3.552 3.872 . 0 0 "[ . 1 . 2]" 1
1645 1 80 PHE QD 1 96 MET QG 4.850 . 4.850 3.186 2.763 4.799 . 0 0 "[ . 1 . 2]" 1
1646 1 80 PHE QD 1 96 MET ME 5.440 . 5.440 4.241 2.934 4.400 . 0 0 "[ . 1 . 2]" 1
1647 1 96 MET HA 1 96 MET QG 3.260 . 3.260 2.455 2.377 3.316 0.056 19 0 "[ . 1 . 2]" 1
1648 1 80 PHE HB2 1 96 MET ME 4.860 . 4.860 4.686 3.571 4.901 0.041 8 0 "[ . 1 . 2]" 1
1649 1 78 PHE HB3 1 85 ILE QG 3.940 . 3.940 3.518 3.190 3.695 . 0 0 "[ . 1 . 2]" 1
1650 1 89 HIS HB3 1 96 MET ME 4.990 . 4.990 4.916 4.769 5.065 0.075 14 0 "[ . 1 . 2]" 1
1651 1 47 GLU HB2 1 48 ILE H 4.240 . 4.240 2.967 2.639 3.313 . 0 0 "[ . 1 . 2]" 1
1652 1 92 LYS H 1 96 MET QG 6.000 . 6.000 5.963 4.498 6.087 0.087 14 0 "[ . 1 . 2]" 1
1653 1 103 GLU QB 1 105 TYR QE 3.850 . 3.850 3.810 3.586 3.934 0.084 11 0 "[ . 1 . 2]" 1
1654 1 65 TYR HA 1 68 ARG QB 3.660 . 3.660 2.686 2.333 2.898 . 0 0 "[ . 1 . 2]" 1
1655 1 19 GLU QB 1 21 LYS QE 4.280 . 4.280 2.899 1.873 4.354 0.074 3 0 "[ . 1 . 2]" 1
1656 1 59 LYS HB2 1 59 LYS QE 4.550 . 4.550 3.211 2.005 4.183 . 0 0 "[ . 1 . 2]" 1
1657 1 59 LYS QE 1 63 GLU QB 5.030 . 5.030 4.581 2.328 5.407 0.377 6 0 "[ . 1 . 2]" 1
1658 1 59 LYS HB2 1 87 ASP QB 3.750 . 3.750 3.600 3.085 3.883 0.133 3 0 "[ . 1 . 2]" 1
1659 1 76 LEU H 1 106 GLN HB2 5.370 . 5.370 5.395 5.242 5.530 0.160 3 0 "[ . 1 . 2]" 1
1660 1 59 LYS HB2 1 87 ASP HA 2.800 . 2.800 1.849 1.756 2.010 0.044 7 0 "[ . 1 . 2]" 1
1661 1 22 PRO QG 1 23 SER QB 3.720 . 3.720 3.502 3.149 3.824 0.104 9 0 "[ . 1 . 2]" 1
1662 1 76 LEU HB3 1 106 GLN HB2 4.890 . 4.890 3.154 2.957 3.451 . 0 0 "[ . 1 . 2]" 1
1663 1 22 PRO QG 1 23 SER H 4.380 . 4.380 3.309 2.203 4.450 0.070 9 0 "[ . 1 . 2]" 1
1664 1 76 LEU HA 1 106 GLN HB2 4.440 . 4.440 4.023 3.929 4.133 . 0 0 "[ . 1 . 2]" 1
1665 1 31 LYS QE 1 32 GLU QB 4.710 . 4.710 4.424 2.883 4.906 0.196 1 0 "[ . 1 . 2]" 1
1666 1 39 LYS H 1 101 VAL HB 5.150 . 5.150 5.183 4.943 5.319 0.169 2 0 "[ . 1 . 2]" 1
1667 1 43 GLN HB3 1 106 GLN H 4.800 . 4.800 4.788 4.548 4.870 0.070 1 0 "[ . 1 . 2]" 1
1668 1 97 GLU HB2 1 98 GLU H 3.640 . 3.640 3.354 3.148 3.816 0.176 4 0 "[ . 1 . 2]" 1
1669 1 15 MET HA 1 15 MET ME 5.380 . 5.380 4.250 2.584 5.426 0.046 4 0 "[ . 1 . 2]" 1
1670 1 106 GLN HA 1 107 GLU QG 5.820 . 5.820 3.987 3.651 4.750 . 0 0 "[ . 1 . 2]" 1
1671 1 43 GLN HB3 1 104 VAL H 6.000 . 6.000 5.648 5.369 5.916 . 0 0 "[ . 1 . 2]" 1
1672 1 89 HIS HE1 1 93 GLU HB3 6.000 . 6.000 6.051 5.639 6.160 0.160 9 0 "[ . 1 . 2]" 1
1673 1 43 GLN HB3 1 43 GLN HE21 4.810 . 4.810 3.712 3.665 3.807 . 0 0 "[ . 1 . 2]" 1
1674 1 43 GLN HB3 1 105 TYR QD 4.750 . 4.750 2.246 2.013 2.509 . 0 0 "[ . 1 . 2]" 1
1675 1 76 LEU HA 1 107 GLU QG 4.830 . 4.830 3.838 3.554 4.484 . 0 0 "[ . 1 . 2]" 1
1676 1 43 GLN HB3 1 105 TYR HA 4.470 . 4.470 3.636 3.410 3.781 . 0 0 "[ . 1 . 2]" 1
1677 1 98 GLU HB2 1 99 GLU HA 4.520 . 4.520 4.517 4.362 4.624 0.104 3 0 "[ . 1 . 2]" 1
1678 1 103 GLU H 1 103 GLU HG3 4.850 . 4.850 4.395 4.346 4.527 . 0 0 "[ . 1 . 2]" 1
1679 1 72 PRO QG 1 74 ASN HD22 4.710 . 4.710 4.066 3.700 4.462 . 0 0 "[ . 1 . 2]" 1
1680 1 43 GLN HB3 1 105 TYR QE 4.630 . 4.630 2.727 2.469 3.006 . 0 0 "[ . 1 . 2]" 1
1681 1 71 VAL HA 1 72 PRO QG 3.910 . 3.910 3.760 3.599 3.860 . 0 0 "[ . 1 . 2]" 1
1682 1 36 ILE HA 1 98 GLU HB2 4.640 . 4.640 3.598 3.002 4.421 . 0 0 "[ . 1 . 2]" 1
1683 1 73 MET QB 1 74 ASN HA 5.070 . 5.070 4.412 4.358 4.528 . 0 0 "[ . 1 . 2]" 1
1684 1 73 MET ME 1 74 ASN HA 5.370 . 5.370 4.668 3.822 5.033 . 0 0 "[ . 1 . 2]" 1
1685 1 91 PRO QB 1 92 LYS HA 4.100 . 4.100 3.929 3.888 3.969 . 0 0 "[ . 1 . 2]" 1
1686 1 66 CYS HB2 1 73 MET QB 4.830 . 4.830 3.870 3.369 4.283 . 0 0 "[ . 1 . 2]" 1
1687 1 97 GLU HB2 1 97 GLU QG 2.550 . 2.550 2.295 2.155 2.385 . 0 0 "[ . 1 . 2]" 1
1688 1 37 LYS QG 1 98 GLU HB2 3.660 . 3.660 2.555 2.042 3.180 . 0 0 "[ . 1 . 2]" 1
1689 1 91 PRO QB 1 94 LEU MD1 4.620 . 4.620 4.673 4.589 4.719 0.099 8 0 "[ . 1 . 2]" 1
1690 1 43 GLN HB2 1 43 GLN HE21 4.520 . 4.520 4.203 4.177 4.257 . 0 0 "[ . 1 . 2]" 1
1691 1 65 TYR HB2 1 69 GLN QG 4.990 . 4.990 5.020 4.865 5.089 0.099 6 0 "[ . 1 . 2]" 1
1692 1 36 ILE MG 1 91 PRO QG 4.440 . 4.440 2.864 2.625 3.212 . 0 0 "[ . 1 . 2]" 1
1693 1 38 LEU QD 1 91 PRO QG 4.180 . 4.180 2.849 2.438 3.055 . 0 0 "[ . 1 . 2]" 1
1694 1 38 LEU HG 1 91 PRO QG 5.600 . 5.600 4.307 4.096 4.556 . 0 0 "[ . 1 . 2]" 1
1695 1 97 GLU H 1 97 GLU QG 4.290 . 4.290 3.026 2.647 4.107 . 0 0 "[ . 1 . 2]" 1
1696 1 97 GLU HA 1 97 GLU QG 3.600 . 3.600 2.494 2.326 3.022 . 0 0 "[ . 1 . 2]" 1
1697 1 71 VAL HB 1 72 PRO QD 3.580 . 3.580 2.737 2.099 3.768 0.188 5 0 "[ . 1 . 2]" 1
1698 1 66 CYS HB3 1 71 VAL HB 6.000 . 6.000 4.212 2.541 6.030 0.030 7 0 "[ . 1 . 2]" 1
1699 1 19 GLU QG 1 21 LYS QD 4.140 . 4.140 3.154 1.977 4.209 0.069 3 0 "[ . 1 . 2]" 1
1700 1 58 LEU HG 1 91 PRO QG 4.670 . 4.670 4.275 3.966 4.575 . 0 0 "[ . 1 . 2]" 1
1701 1 25 GLU QG 1 26 ASP H 3.750 . 3.750 3.722 3.237 4.237 0.487 2 0 "[ . 1 . 2]" 1
1702 1 66 CYS HB2 1 71 VAL HB 6.000 . 6.000 5.696 4.159 6.110 0.110 16 0 "[ . 1 . 2]" 1
1703 1 92 LYS QE 1 93 GLU HB2 5.090 . 5.090 3.172 2.487 3.634 . 0 0 "[ . 1 . 2]" 1
1704 1 19 GLU QG 1 21 LYS QG 5.280 . 5.280 4.376 3.390 5.236 . 0 0 "[ . 1 . 2]" 1
1705 1 83 GLN HB2 1 84 ARG QG 5.710 . 5.710 4.565 4.167 5.999 0.289 4 0 "[ . 1 . 2]" 1
1706 1 40 VAL HB 1 104 VAL QG 4.590 . 4.590 4.358 4.241 4.458 . 0 0 "[ . 1 . 2]" 1
1707 1 32 GLU H 1 32 GLU QG 4.280 . 4.280 3.391 1.937 4.248 . 0 0 "[ . 1 . 2]" 1
1708 1 34 GLU H 1 34 GLU QG 4.140 . 4.140 3.363 1.889 4.153 0.013 9 0 "[ . 1 . 2]" 1
1709 1 34 GLU QG 1 35 TYR HA 5.240 . 5.240 4.229 3.525 5.597 0.357 11 0 "[ . 1 . 2]" 1
1710 1 40 VAL HB 1 47 GLU HA 5.830 . 5.830 4.731 4.561 4.913 . 0 0 "[ . 1 . 2]" 1
1711 1 32 GLU QG 1 33 GLY QA 4.640 . 4.640 3.716 3.074 4.890 0.250 3 0 "[ . 1 . 2]" 1
1712 1 34 GLU QG 1 35 TYR H 4.050 . 4.050 3.477 2.022 4.153 0.103 13 0 "[ . 1 . 2]" 1
1713 1 24 THR HA 1 25 GLU QG 4.260 . 4.260 3.824 3.518 4.384 0.124 11 0 "[ . 1 . 2]" 1
1714 1 25 GLU HA 1 25 GLU QG 3.850 . 3.850 2.905 2.284 3.355 . 0 0 "[ . 1 . 2]" 1
1715 1 83 GLN HA 1 83 GLN QG 3.310 . 3.310 3.330 3.301 3.345 0.035 18 0 "[ . 1 . 2]" 1
1716 1 83 GLN QG 1 84 ARG HA 4.650 . 4.650 4.292 4.131 4.375 . 0 0 "[ . 1 . 2]" 1
1717 1 107 GLU HA 1 108 GLN QG 4.990 . 4.990 3.849 2.996 5.156 0.166 1 0 "[ . 1 . 2]" 1
1718 1 18 GLN HA 1 18 GLN QG 3.410 . 3.410 2.846 2.342 3.358 . 0 0 "[ . 1 . 2]" 1
1719 1 77 ARG QD 1 105 TYR HB2 3.770 . 3.770 2.813 1.845 3.789 0.019 14 0 "[ . 1 . 2]" 1
1720 1 37 LYS QE 1 99 GLU QB 4.140 . 4.140 2.844 1.864 4.241 0.101 18 0 "[ . 1 . 2]" 1
1721 1 83 GLN HB3 1 83 GLN QG 2.760 . 2.760 2.399 2.375 2.420 . 0 0 "[ . 1 . 2]" 1
1722 1 83 GLN QG 1 84 ARG QB 5.230 . 5.230 5.137 4.926 5.249 0.019 18 0 "[ . 1 . 2]" 1
1723 1 77 ARG QB 1 105 TYR HB2 4.670 . 4.670 4.187 4.028 4.570 . 0 0 "[ . 1 . 2]" 1
1724 1 38 LEU QD 1 99 GLU QB 5.550 . 5.550 4.808 4.607 4.983 . 0 0 "[ . 1 . 2]" 1
1725 1 83 GLN QG 1 94 LEU MD1 4.550 . 4.550 3.673 3.476 4.042 . 0 0 "[ . 1 . 2]" 1
1726 1 83 GLN QG 1 94 LEU HG 5.180 . 5.180 5.161 5.030 5.308 0.128 20 0 "[ . 1 . 2]" 1
1727 1 104 VAL QG 1 105 TYR HB2 4.680 . 4.680 4.409 4.320 4.484 . 0 0 "[ . 1 . 2]" 1
1728 1 67 GLN HA 1 67 GLN HG3 4.040 . 4.040 3.492 2.835 3.843 . 0 0 "[ . 1 . 2]" 1
1729 1 72 PRO QB 1 75 SER HB2 4.110 . 4.110 2.853 2.223 3.449 . 0 0 "[ . 1 . 2]" 1
1730 1 62 LYS QE 1 85 ILE HB 4.810 . 4.810 3.738 2.930 4.583 . 0 0 "[ . 1 . 2]" 1
1731 1 62 LYS HA 1 62 LYS QE 4.450 . 4.450 4.164 3.934 4.390 . 0 0 "[ . 1 . 2]" 1
1732 1 105 TYR HA 1 106 GLN QG 4.350 . 4.350 3.734 3.542 3.916 . 0 0 "[ . 1 . 2]" 1
1733 1 62 LYS QE 1 85 ILE MD 4.920 . 4.920 4.103 3.598 4.620 . 0 0 "[ . 1 . 2]" 1
1734 1 76 LEU QD 1 78 PHE HB2 5.560 . 5.560 4.639 4.444 4.808 . 0 0 "[ . 1 . 2]" 1
1735 1 78 PHE HB2 1 85 ILE MD 5.430 . 5.430 4.001 3.840 4.190 . 0 0 "[ . 1 . 2]" 1
1736 1 61 LEU HB3 1 62 LYS QE 4.180 . 4.180 3.744 3.396 4.189 0.009 2 0 "[ . 1 . 2]" 1
1737 1 54 MET QG 1 55 THR MG 4.220 . 4.220 3.215 2.722 4.364 0.144 1 0 "[ . 1 . 2]" 1
1738 1 62 LYS QE 1 102 ILE MG 3.710 . 3.710 2.295 1.985 2.548 . 0 0 "[ . 1 . 2]" 1
1739 1 44 ASP H 1 106 GLN QG 4.700 . 4.700 4.555 4.185 4.893 0.193 2 0 "[ . 1 . 2]" 1
1740 1 63 GLU HA 1 63 GLU HG2 4.010 . 4.010 2.755 2.309 3.788 . 0 0 "[ . 1 . 2]" 1
1741 1 88 ASN HB3 1 89 HIS H 4.610 . 4.610 4.490 4.349 4.585 . 0 0 "[ . 1 . 2]" 1
1742 1 86 ALA HA 1 87 ASP QB 4.650 . 4.650 4.404 4.184 4.797 0.147 5 0 "[ . 1 . 2]" 1
1743 1 50 PHE HB2 1 51 LYS HA 5.350 . 5.350 5.143 5.035 5.220 . 0 0 "[ . 1 . 2]" 1
1744 1 26 ASP QB 1 27 LEU HA 4.960 . 4.960 4.446 3.934 4.979 0.019 19 0 "[ . 1 . 2]" 1
1745 1 26 ASP QB 1 28 GLY H 5.120 . 5.120 3.955 2.644 5.284 0.164 15 0 "[ . 1 . 2]" 1
1746 1 87 ASP QB 1 88 ASN HA 5.420 . 5.420 4.472 4.007 4.657 . 0 0 "[ . 1 . 2]" 1
1747 1 15 MET QG 1 16 SER HA 4.800 . 4.800 3.971 3.468 4.918 0.118 20 0 "[ . 1 . 2]" 1
1748 1 88 ASN H 1 88 ASN HB2 3.870 . 3.870 3.570 2.491 3.732 . 0 0 "[ . 1 . 2]" 1
1749 1 17 ASP QB 1 18 GLN QG 3.320 . 3.320 3.108 2.649 3.525 0.205 6 0 "[ . 1 . 2]" 1
1750 1 86 ALA MB 1 88 ASN HB2 5.100 . 5.100 4.731 3.668 5.074 . 0 0 "[ . 1 . 2]" 1
1751 1 79 LEU HA 1 80 PHE HB3 4.650 . 4.650 4.365 4.311 4.444 . 0 0 "[ . 1 . 2]" 1
1752 1 73 MET HA 1 73 MET QG 3.440 . 3.440 3.408 3.318 3.492 0.052 15 0 "[ . 1 . 2]" 1
1753 1 72 PRO HA 1 73 MET QG 4.710 . 4.710 4.253 3.861 4.796 0.086 15 0 "[ . 1 . 2]" 1
1754 1 73 MET QG 1 74 ASN HB3 3.670 . 3.670 3.222 3.017 3.672 0.002 6 0 "[ . 1 . 2]" 1
1755 1 73 MET QG 1 74 ASN HB2 4.950 . 4.950 4.659 4.423 5.132 0.182 6 0 "[ . 1 . 2]" 1
1756 1 72 PRO QB 1 73 MET QG 4.470 . 4.470 4.391 4.169 4.639 0.169 19 0 "[ . 1 . 2]" 1
1757 1 80 PHE HB3 1 85 ILE QG 4.730 . 4.730 4.087 3.865 4.228 . 0 0 "[ . 1 . 2]" 1
1758 1 80 PHE HB3 1 96 MET ME 5.230 . 5.230 4.737 3.476 4.947 . 0 0 "[ . 1 . 2]" 1
1759 1 80 PHE HB3 1 102 ILE QG 4.410 . 4.410 3.475 3.371 3.631 . 0 0 "[ . 1 . 2]" 1
1760 1 80 PHE HB3 1 102 ILE MD 4.590 . 4.590 4.655 4.609 4.697 0.107 5 0 "[ . 1 . 2]" 1
1761 1 73 MET QG 1 74 ASN H 3.560 . 3.560 2.480 2.333 2.716 . 0 0 "[ . 1 . 2]" 1
1762 1 37 LYS HB3 1 37 LYS QE 4.070 . 4.070 3.379 2.601 4.144 0.074 11 0 "[ . 1 . 2]" 1
1763 1 51 LYS QE 1 52 VAL H 4.620 . 4.620 4.552 3.969 4.773 0.153 18 0 "[ . 1 . 2]" 1
1764 1 85 ILE HA 1 89 HIS HB3 4.750 . 4.750 3.364 3.183 3.628 . 0 0 "[ . 1 . 2]" 1
1765 1 59 LYS H 1 59 LYS QE 5.440 . 5.440 5.046 4.093 5.814 0.374 1 0 "[ . 1 . 2]" 1
1766 1 55 THR HA 1 92 LYS QE 5.130 . 5.130 4.195 3.419 5.091 . 0 0 "[ . 1 . 2]" 1
1767 1 50 PHE HB3 1 61 LEU MD2 5.140 . 5.140 4.545 4.425 4.654 . 0 0 "[ . 1 . 2]" 1
1768 1 39 LYS HA 1 49 HIS HB3 4.580 . 4.580 4.467 4.325 4.576 . 0 0 "[ . 1 . 2]" 1
1769 1 80 PHE HB2 1 102 ILE HB 5.120 . 5.120 4.801 4.595 4.977 . 0 0 "[ . 1 . 2]" 1
1770 1 20 ALA H 1 21 LYS QE 4.750 . 4.750 3.302 2.557 3.808 . 0 0 "[ . 1 . 2]" 1
1771 1 77 ARG QD 1 105 TYR QD 4.690 . 4.690 2.888 2.232 3.491 . 0 0 "[ . 1 . 2]" 1
1772 1 79 LEU HA 1 80 PHE HB2 4.620 . 4.620 4.480 4.417 4.523 . 0 0 "[ . 1 . 2]" 1
1773 1 31 LYS HA 1 31 LYS QE 4.340 . 4.340 3.436 1.787 4.354 0.014 13 0 "[ . 1 . 2]" 1
1774 1 98 GLU HA 1 100 ASP HB3 5.580 . 5.580 5.227 4.860 5.534 . 0 0 "[ . 1 . 2]" 1
1775 1 60 LYS HA 1 60 LYS QE 4.810 . 4.810 3.880 2.450 4.514 . 0 0 "[ . 1 . 2]" 1
1776 1 50 PHE HB3 1 51 LYS QB 4.520 . 4.520 4.497 4.391 4.586 0.066 5 0 "[ . 1 . 2]" 1
1777 1 39 LYS H 1 100 ASP HB3 4.910 . 4.910 4.668 4.366 4.945 0.035 5 0 "[ . 1 . 2]" 1
1778 1 65 TYR HB2 1 69 GLN HE21 4.210 . 4.210 3.459 3.235 3.655 . 0 0 "[ . 1 . 2]" 1
1779 1 77 ARG QD 1 105 TYR QE 4.910 . 4.910 4.581 3.992 5.050 0.140 12 0 "[ . 1 . 2]" 1
1780 1 36 ILE MD 1 100 ASP HB3 5.220 . 5.220 4.784 4.440 5.209 . 0 0 "[ . 1 . 2]" 1
1781 1 50 PHE HB3 1 61 LEU HG 3.810 . 3.810 3.730 3.415 3.883 0.073 4 0 "[ . 1 . 2]" 1
1782 1 77 ARG QD 1 78 PHE H 5.060 . 5.060 5.070 4.804 5.332 0.272 11 0 "[ . 1 . 2]" 1
1783 1 48 ILE HB 1 65 TYR HB2 5.010 . 5.010 4.930 4.734 5.056 0.046 14 0 "[ . 1 . 2]" 1
1784 1 19 GLU HA 1 21 LYS QE 4.690 . 4.690 4.184 2.866 4.820 0.130 8 0 "[ . 1 . 2]" 1
1785 1 65 TYR QD 1 66 CYS HB3 5.140 . 5.140 4.698 3.302 4.955 . 0 0 "[ . 1 . 2]" 1
1786 1 43 GLN HE22 1 105 TYR HB3 4.450 . 4.450 4.528 4.476 4.557 0.107 2 0 "[ . 1 . 2]" 1
1787 1 39 LYS HB2 1 49 HIS HB2 4.520 . 4.520 4.599 4.453 4.697 0.177 5 0 "[ . 1 . 2]" 1
1788 1 77 ARG QG 1 105 TYR HB3 4.550 . 4.550 3.543 3.309 4.426 . 0 0 "[ . 1 . 2]" 1
1789 1 66 CYS HB3 1 73 MET QB 4.830 . 4.830 3.892 3.535 4.231 . 0 0 "[ . 1 . 2]" 1
1790 1 62 LYS HA 1 65 TYR HB3 4.020 . 4.020 2.410 2.045 2.754 . 0 0 "[ . 1 . 2]" 1
1791 1 40 VAL HB 1 62 LYS HA 5.400 . 5.400 5.402 5.237 5.522 0.122 9 0 "[ . 1 . 2]" 1
1792 1 62 LYS HA 1 62 LYS QD 4.530 . 4.530 2.511 2.333 2.695 . 0 0 "[ . 1 . 2]" 1
1793 1 48 ILE MD 1 62 LYS HA 4.390 . 4.390 3.929 3.686 4.111 . 0 0 "[ . 1 . 2]" 1
1794 1 62 LYS HA 1 76 LEU QD 5.100 . 5.100 4.854 4.682 5.026 . 0 0 "[ . 1 . 2]" 1
1795 1 62 LYS HA 1 62 LYS QG 3.820 . 3.820 2.421 2.365 2.477 . 0 0 "[ . 1 . 2]" 1
1796 1 65 TYR HB3 1 65 TYR HE2 4.750 . 4.750 4.644 4.623 4.667 . 0 0 "[ . 1 . 2]" 1
1797 1 81 GLU HB3 1 82 GLY HA3 5.090 . 5.090 4.851 4.776 5.019 . 0 0 "[ . 1 . 2]" 1
1798 1 80 PHE HA 1 81 GLU HA 4.460 . 4.460 4.339 4.305 4.363 . 0 0 "[ . 1 . 2]" 1
1799 1 81 GLU HA 1 81 GLU HG2 4.080 . 4.080 2.823 2.312 3.170 . 0 0 "[ . 1 . 2]" 1
1800 1 59 LYS HA 1 61 LEU H 4.630 . 4.630 4.083 3.961 4.214 . 0 0 "[ . 1 . 2]" 1
1801 1 71 VAL HA 1 72 PRO QD 3.410 . 3.410 1.891 1.833 1.981 . 0 0 "[ . 1 . 2]" 1
1802 1 59 LYS HA 1 87 ASP HA 4.190 . 4.190 4.098 3.690 4.277 0.087 19 0 "[ . 1 . 2]" 1
1803 1 21 LYS HB2 1 22 PRO HD2 3.800 . 3.800 2.868 1.840 3.943 0.143 2 0 "[ . 1 . 2]" 1
1804 1 59 LYS HA 1 62 LYS QB 4.210 . 4.210 2.603 2.179 3.052 . 0 0 "[ . 1 . 2]" 1
1805 1 59 LYS HA 1 59 LYS QD 4.450 . 4.450 2.752 2.090 3.639 . 0 0 "[ . 1 . 2]" 1
1806 1 59 LYS HA 1 61 LEU HB3 5.270 . 5.270 5.089 4.824 5.247 . 0 0 "[ . 1 . 2]" 1
1807 1 22 PRO HD2 1 23 SER QB 5.140 . 5.140 4.798 3.834 5.204 0.064 12 0 "[ . 1 . 2]" 1
1808 1 38 LEU HA 1 99 GLU HA 4.660 . 4.660 3.228 2.628 3.740 . 0 0 "[ . 1 . 2]" 1
1809 1 98 GLU HA 1 99 GLU HA 4.560 . 4.560 4.336 4.203 4.436 . 0 0 "[ . 1 . 2]" 1
1810 1 42 GLY QA 1 43 GLN HA 4.820 . 4.820 3.974 3.952 3.997 . 0 0 "[ . 1 . 2]" 1
1811 1 60 LYS HA 1 61 LEU HA 5.560 . 5.560 4.756 4.705 4.819 . 0 0 "[ . 1 . 2]" 1
1812 1 61 LEU HA 1 64 SER QB 3.770 . 3.770 2.862 2.516 3.140 . 0 0 "[ . 1 . 2]" 1
1813 1 41 ILE HA 1 42 GLY QA 4.500 . 4.500 3.897 3.876 3.922 . 0 0 "[ . 1 . 2]" 1
1814 1 110 GLY QA 1 111 GLY QA 4.070 . 4.070 3.595 3.513 3.798 . 0 0 "[ . 1 . 2]" 1
1815 1 21 LYS HB2 1 22 PRO HD3 4.710 . 4.710 4.094 3.214 4.789 0.079 6 0 "[ . 1 . 2]" 1
1816 1 91 PRO QD 1 94 LEU H 5.410 . 5.410 5.139 5.074 5.197 . 0 0 "[ . 1 . 2]" 1
1817 1 72 PRO QG 1 75 SER HB2 4.080 . 4.080 2.086 1.835 2.355 . 0 0 "[ . 1 . 2]" 1
1818 1 59 LYS HG3 1 87 ASP HA 4.660 . 4.660 3.104 1.881 4.279 . 0 0 "[ . 1 . 2]" 1
1819 1 59 LYS HG2 1 87 ASP HA 4.660 . 4.660 2.813 2.009 3.705 . 0 0 "[ . 1 . 2]" 1
1820 1 86 ALA MB 1 87 ASP HA 4.250 . 4.250 4.272 4.204 4.321 0.071 18 0 "[ . 1 . 2]" 1
1821 1 90 THR HB 1 91 PRO QD 3.490 . 3.490 1.865 1.832 1.907 . 0 0 "[ . 1 . 2]" 1
1822 1 91 PRO QD 1 94 LEU MD1 4.480 . 4.480 4.307 4.161 4.474 . 0 0 "[ . 1 . 2]" 1
1823 1 23 SER QB 1 24 THR HA 5.320 . 5.320 4.509 4.146 4.910 . 0 0 "[ . 1 . 2]" 1
1824 1 27 LEU HA 1 28 GLY QA 5.580 . 5.580 4.115 3.879 4.303 . 0 0 "[ . 1 . 2]" 1
1825 1 69 GLN HA 1 70 GLY QA 5.360 . 5.360 4.243 4.206 4.267 . 0 0 "[ . 1 . 2]" 1
1826 1 95 GLY QA 1 96 MET QG 4.530 . 4.530 4.090 3.975 4.211 . 0 0 "[ . 1 . 2]" 1
1827 1 69 GLN H 1 70 GLY QA 5.180 . 5.180 4.228 4.188 4.269 . 0 0 "[ . 1 . 2]" 1
1828 1 66 CYS HA 1 69 GLN QG 4.490 . 4.490 4.412 4.039 4.635 0.145 2 0 "[ . 1 . 2]" 1
1829 1 109 THR H 1 110 GLY QA 4.870 . 4.870 4.525 4.322 5.001 0.131 2 0 "[ . 1 . 2]" 1
1830 1 92 LYS HA 1 95 GLY H 4.060 . 4.060 3.463 3.309 3.604 . 0 0 "[ . 1 . 2]" 1
1831 1 93 GLU HA 1 95 GLY H 4.400 . 4.400 4.003 3.831 4.167 . 0 0 "[ . 1 . 2]" 1
1832 1 93 GLU HA 1 94 LEU HA 6.000 . 6.000 4.680 4.652 4.718 . 0 0 "[ . 1 . 2]" 1
1833 1 109 THR HB 1 110 GLY QA 6.000 . 6.000 4.661 3.993 5.318 . 0 0 "[ . 1 . 2]" 1
1834 1 52 VAL HB 1 56 THR HB 4.350 . 4.350 2.109 2.027 2.274 . 0 0 "[ . 1 . 2]" 1
1835 1 92 LYS HA 1 92 LYS QG 3.650 . 3.650 3.387 3.276 3.484 . 0 0 "[ . 1 . 2]" 1
1836 1 92 LYS QG 1 93 GLU HA 3.940 . 3.940 3.348 2.683 3.892 . 0 0 "[ . 1 . 2]" 1
1837 1 63 GLU HA 1 63 GLU HG3 4.010 . 4.010 3.333 2.910 3.817 . 0 0 "[ . 1 . 2]" 1
1838 1 67 GLN QB 1 68 ARG HA 4.480 . 4.480 4.048 3.866 4.456 . 0 0 "[ . 1 . 2]" 1
1839 1 65 TYR HA 1 69 GLN QG 4.440 . 4.440 4.588 4.505 4.677 0.237 4 0 "[ . 1 . 2]" 1
1840 1 44 ASP H 1 45 SER QB 5.540 . 5.540 5.219 4.934 5.423 . 0 0 "[ . 1 . 2]" 1
1841 1 41 ILE QG 1 45 SER QB 5.310 . 5.310 4.941 4.568 5.224 . 0 0 "[ . 1 . 2]" 1
1842 1 65 TYR HA 1 69 GLN H 4.980 . 4.980 3.957 3.840 4.117 . 0 0 "[ . 1 . 2]" 1
1843 1 65 TYR HA 1 68 ARG QD 5.070 . 5.070 3.990 3.333 5.211 0.141 1 0 "[ . 1 . 2]" 1
1844 1 62 LYS HA 1 64 SER QB 5.110 . 5.110 4.835 4.691 5.032 . 0 0 "[ . 1 . 2]" 1
1845 1 65 TYR HA 1 65 TYR HE1 5.800 . 5.800 5.384 5.259 5.556 . 0 0 "[ . 1 . 2]" 1
1846 1 65 TYR HA 1 69 GLN QB 4.950 . 4.950 4.562 4.428 4.733 . 0 0 "[ . 1 . 2]" 1
1847 1 60 LYS HA 1 63 GLU QB 4.040 . 4.040 2.929 2.143 4.078 0.038 1 0 "[ . 1 . 2]" 1
1848 1 54 MET HA 1 92 LYS HB2 4.970 . 4.970 4.948 4.383 5.110 0.140 18 0 "[ . 1 . 2]" 1
1849 1 38 LEU HA 1 98 GLU HA 5.040 . 5.040 4.433 4.157 4.759 . 0 0 "[ . 1 . 2]" 1
1850 1 93 GLU HB3 1 94 LEU HA 4.100 . 4.100 3.911 3.776 4.070 . 0 0 "[ . 1 . 2]" 1
1851 1 97 GLU HB3 1 98 GLU HA 4.680 . 4.680 4.583 4.480 4.771 0.091 4 0 "[ . 1 . 2]" 1
1852 1 19 GLU HA 1 21 LYS QD 4.650 . 4.650 3.852 2.847 4.788 0.138 1 0 "[ . 1 . 2]" 1
1853 1 109 THR HB 1 110 GLY H 4.790 . 4.790 3.957 3.007 4.332 . 0 0 "[ . 1 . 2]" 1
1854 1 91 PRO HA 1 93 GLU H 4.230 . 4.230 4.230 4.106 4.304 0.074 11 0 "[ . 1 . 2]" 1
1855 1 88 ASN HA 1 89 HIS HA 4.770 . 4.770 4.634 4.581 4.718 . 0 0 "[ . 1 . 2]" 1
1856 1 25 GLU HA 1 26 ASP QB 4.740 . 4.740 4.240 3.829 4.879 0.139 17 0 "[ . 1 . 2]" 1
1857 1 91 PRO HA 1 96 MET ME 4.610 . 4.610 1.832 1.776 2.097 0.024 10 0 "[ . 1 . 2]" 1
1858 1 91 PRO HA 1 96 MET QB 3.770 . 3.770 2.833 2.566 3.841 0.071 19 0 "[ . 1 . 2]" 1
1859 1 91 PRO HA 1 96 MET QG 3.840 . 3.840 3.165 1.896 3.404 . 0 0 "[ . 1 . 2]" 1
1860 1 54 MET H 1 55 THR HA 5.190 . 5.190 5.012 4.911 5.111 . 0 0 "[ . 1 . 2]" 1
1861 1 24 THR HA 1 25 GLU QB 4.580 . 4.580 4.423 4.240 4.735 0.155 11 0 "[ . 1 . 2]" 1
1862 1 47 GLU HA 1 48 ILE HA 4.620 . 4.620 4.374 4.329 4.416 . 0 0 "[ . 1 . 2]" 1
1863 1 54 MET HB3 1 55 THR HA 4.500 . 4.500 4.384 4.066 4.506 0.006 15 0 "[ . 1 . 2]" 1
1864 1 55 THR HA 1 92 LYS QD 4.770 . 4.770 3.866 3.280 4.470 . 0 0 "[ . 1 . 2]" 1
1865 1 42 GLY H 1 46 SER HA 4.760 . 4.760 4.712 4.548 4.863 0.103 6 0 "[ . 1 . 2]" 1
1866 1 106 GLN HB2 1 107 GLU HA 5.730 . 5.730 4.959 4.641 5.148 . 0 0 "[ . 1 . 2]" 1
1867 1 84 ARG HA 1 85 ILE QG 5.040 . 5.040 3.459 3.388 3.593 . 0 0 "[ . 1 . 2]" 1
1868 1 46 SER HA 1 47 GLU QG 4.590 . 4.590 3.912 3.612 4.219 . 0 0 "[ . 1 . 2]" 1
1869 1 47 GLU QG 1 48 ILE HA 5.040 . 5.040 3.912 3.721 4.366 . 0 0 "[ . 1 . 2]" 1
1870 1 76 LEU HA 1 106 GLN HA 4.670 . 4.670 2.055 1.938 2.123 . 0 0 "[ . 1 . 2]" 1
1871 1 105 TYR HB3 1 106 GLN HA 4.910 . 4.910 4.500 4.392 4.613 . 0 0 "[ . 1 . 2]" 1
1872 1 71 VAL HA 1 72 PRO HA 4.500 . 4.500 4.414 4.381 4.472 . 0 0 "[ . 1 . 2]" 1
1873 1 79 LEU HA 1 83 GLN HA 5.390 . 5.390 5.118 4.999 5.222 . 0 0 "[ . 1 . 2]" 1
1874 1 89 HIS HA 1 90 THR HB 5.630 . 5.630 5.547 5.516 5.578 . 0 0 "[ . 1 . 2]" 1
1875 1 78 PHE HA 1 84 ARG HA 5.810 . 5.810 5.398 5.193 5.558 . 0 0 "[ . 1 . 2]" 1
1876 1 79 LEU HA 1 84 ARG HA 4.760 . 4.760 2.264 2.072 2.450 . 0 0 "[ . 1 . 2]" 1
1877 1 39 LYS HA 1 49 HIS HA 3.960 . 3.960 2.267 2.163 2.331 . 0 0 "[ . 1 . 2]" 1
1878 1 62 LYS QG 1 104 VAL HB 5.310 . 5.310 5.379 5.212 5.485 0.175 15 0 "[ . 1 . 2]" 1
1879 1 40 VAL MG2 1 62 LYS QG 4.010 . 4.010 3.395 3.093 3.729 . 0 0 "[ . 1 . 2]" 1
1880 1 62 LYS QG 1 102 ILE MG 4.390 . 4.390 3.634 3.191 4.022 . 0 0 "[ . 1 . 2]" 1
1881 1 103 GLU H 1 104 VAL QG 4.790 . 4.790 4.116 4.023 4.262 . 0 0 "[ . 1 . 2]" 1
1882 1 40 VAL HA 1 104 VAL QG 4.290 . 4.290 4.207 4.087 4.303 0.013 2 0 "[ . 1 . 2]" 1
1883 1 77 ARG HA 1 104 VAL QG 5.760 . 5.760 4.338 4.221 4.526 . 0 0 "[ . 1 . 2]" 1
1884 1 78 PHE HB2 1 104 VAL QG 5.210 . 5.210 3.356 3.275 3.507 . 0 0 "[ . 1 . 2]" 1
1885 1 102 ILE HB 1 104 VAL QG 4.290 . 4.290 4.008 3.821 4.132 . 0 0 "[ . 1 . 2]" 1
1886 1 18 GLN QB 1 18 GLN QG 2.310 . 2.310 2.060 1.988 2.086 . 0 0 "[ . 1 . 2]" 1
1887 1 18 GLN QB 1 18 GLN QE 3.320 . 3.320 2.662 1.779 3.424 0.104 13 0 "[ . 1 . 2]" 1
1888 1 20 ALA H 1 21 LYS QB 4.350 . 4.350 4.195 3.726 4.654 0.304 13 0 "[ . 1 . 2]" 1
1889 1 21 LYS H 1 21 LYS QB 3.610 . 3.610 2.845 2.156 3.293 . 0 0 "[ . 1 . 2]" 1
1890 1 21 LYS QB 1 21 LYS QD 3.390 . 3.390 2.449 2.206 2.748 . 0 0 "[ . 1 . 2]" 1
1891 1 21 LYS QB 1 21 LYS QE 4.550 . 4.550 2.710 1.917 3.854 . 0 0 "[ . 1 . 2]" 1
1892 1 21 LYS QB 1 22 PRO HD3 3.980 . 3.980 3.496 3.118 3.762 . 0 0 "[ . 1 . 2]" 1
1893 1 22 PRO QB 1 23 SER H 3.520 . 3.520 2.818 1.890 3.836 0.316 2 0 "[ . 1 . 2]" 1
1894 1 22 PRO QB 1 23 SER QB 4.300 . 4.300 3.520 3.297 3.789 . 0 0 "[ . 1 . 2]" 1
1895 1 26 ASP QB 1 27 LEU QB 5.810 . 5.810 4.888 3.605 5.545 . 0 0 "[ . 1 . 2]" 1
1896 1 27 LEU H 1 27 LEU QB 3.450 . 3.450 2.702 2.117 3.256 . 0 0 "[ . 1 . 2]" 1
1897 1 27 LEU HA 1 27 LEU QD 3.510 . 3.510 3.044 2.106 3.450 . 0 0 "[ . 1 . 2]" 1
1898 1 27 LEU QB 1 27 LEU QD 2.800 . 2.800 1.904 1.852 1.953 . 0 0 "[ . 1 . 2]" 1
1899 1 27 LEU QB 1 28 GLY QA 4.590 . 4.590 4.333 3.918 4.599 0.009 15 0 "[ . 1 . 2]" 1
1900 1 27 LEU QB 1 29 ASP H 3.810 . 3.810 3.554 2.550 4.075 0.265 10 0 "[ . 1 . 2]" 1
1901 1 27 LEU QD 1 28 GLY H 4.030 . 4.030 2.899 1.945 4.181 0.151 18 0 "[ . 1 . 2]" 1
1902 1 27 LEU QD 1 28 GLY QA 4.550 . 4.550 3.956 3.356 4.381 . 0 0 "[ . 1 . 2]" 1
1903 1 27 LEU QD 1 29 ASP H 4.050 . 4.050 2.708 1.797 3.609 0.003 20 0 "[ . 1 . 2]" 1
1904 1 27 LEU QD 1 29 ASP QB 4.670 . 4.670 2.880 1.994 4.314 . 0 0 "[ . 1 . 2]" 1
1905 1 27 LEU QD 1 30 LYS H 3.770 . 3.770 2.995 1.794 3.872 0.102 8 0 "[ . 1 . 2]" 1
1906 1 27 LEU QD 1 30 LYS HA 3.150 . 3.150 2.927 1.956 3.632 0.482 13 0 "[ . 1 . 2]" 1
1907 1 27 LEU QD 1 30 LYS QB 2.910 . 2.910 2.086 1.751 3.146 0.236 11 0 "[ . 1 . 2]" 1
1908 1 27 LEU QD 1 30 LYS QG 3.570 . 3.570 2.790 1.782 3.586 0.018 8 0 "[ . 1 . 2]" 1
1909 1 27 LEU QD 1 30 LYS QE 4.670 . 4.670 3.521 2.048 4.611 . 0 0 "[ . 1 . 2]" 1
1910 1 27 LEU QD 1 31 LYS H 4.800 . 4.800 4.385 3.270 4.968 0.168 8 0 "[ . 1 . 2]" 1
1911 1 39 LYS HG2 1 47 GLU QB 4.050 . 4.050 2.736 2.386 3.100 . 0 0 "[ . 1 . 2]" 1
1912 1 39 LYS QE 1 47 GLU QB 4.440 . 4.440 2.088 1.730 3.305 0.070 6 0 "[ . 1 . 2]" 1
1913 1 41 ILE HA 1 47 GLU QB 4.560 . 4.560 3.282 2.893 3.483 . 0 0 "[ . 1 . 2]" 1
1914 1 41 ILE MG 1 47 GLU QB 5.580 . 5.580 4.446 4.089 4.730 . 0 0 "[ . 1 . 2]" 1
1915 1 41 ILE QG 1 47 GLU QB 3.220 . 3.220 2.613 2.346 2.950 . 0 0 "[ . 1 . 2]" 1
1916 1 41 ILE MD 1 47 GLU QB 3.660 . 3.660 3.261 3.029 3.555 . 0 0 "[ . 1 . 2]" 1
1917 1 42 GLY H 1 46 SER QB 4.410 . 4.410 3.236 2.927 3.641 . 0 0 "[ . 1 . 2]" 1
1918 1 42 GLY QA 1 44 ASP QB 4.570 . 4.570 3.933 3.660 4.679 0.109 12 0 "[ . 1 . 2]" 1
1919 1 43 GLN HE21 1 44 ASP QB 4.620 . 4.620 2.708 2.179 3.741 . 0 0 "[ . 1 . 2]" 1
1920 1 44 ASP H 1 44 ASP QB 3.220 . 3.220 2.348 2.220 2.824 . 0 0 "[ . 1 . 2]" 1
1921 1 44 ASP H 1 46 SER QB 4.150 . 4.150 4.182 4.075 4.274 0.124 12 0 "[ . 1 . 2]" 1
1922 1 44 ASP QB 1 45 SER H 3.850 . 3.850 3.583 3.441 3.905 0.055 12 0 "[ . 1 . 2]" 1
1923 1 44 ASP QB 1 46 SER H 3.860 . 3.860 2.950 2.641 3.594 . 0 0 "[ . 1 . 2]" 1
1924 1 44 ASP QB 1 46 SER HA 4.890 . 4.890 4.715 4.392 5.088 0.198 12 0 "[ . 1 . 2]" 1
1925 1 44 ASP QB 1 46 SER QB 4.380 . 4.380 3.145 2.464 3.944 . 0 0 "[ . 1 . 2]" 1
1926 1 46 SER H 1 46 SER QB 2.930 . 2.930 2.411 2.252 2.543 . 0 0 "[ . 1 . 2]" 1
1927 1 46 SER H 1 47 GLU QB 5.810 . 5.810 5.178 5.087 5.266 . 0 0 "[ . 1 . 2]" 1
1928 1 46 SER QB 1 47 GLU H 4.170 . 4.170 3.249 2.742 3.745 . 0 0 "[ . 1 . 2]" 1
1929 1 46 SER QB 1 47 GLU HA 4.540 . 4.540 4.161 3.978 4.481 . 0 0 "[ . 1 . 2]" 1
1930 1 47 GLU H 1 47 GLU QB 3.150 . 3.150 3.139 3.053 3.214 0.064 8 0 "[ . 1 . 2]" 1
1931 1 47 GLU QB 1 48 ILE QG 4.850 . 4.850 4.472 4.290 4.619 . 0 0 "[ . 1 . 2]" 1
1932 1 56 THR MG 1 57 HIS QB 4.810 . 4.810 4.059 3.710 4.638 . 0 0 "[ . 1 . 2]" 1
1933 1 57 HIS H 1 57 HIS QB 3.490 . 3.490 2.464 2.269 2.821 . 0 0 "[ . 1 . 2]" 1
1934 1 57 HIS QB 1 58 LEU H 4.150 . 4.150 3.475 3.327 3.576 . 0 0 "[ . 1 . 2]" 1
1935 1 57 HIS QB 1 59 LYS H 4.030 . 4.030 2.949 2.692 3.138 . 0 0 "[ . 1 . 2]" 1
1936 1 57 HIS QB 1 59 LYS HB2 4.540 . 4.540 4.020 3.547 4.383 . 0 0 "[ . 1 . 2]" 1
1937 1 59 LYS H 1 59 LYS QG 4.030 . 4.030 3.928 3.825 4.012 . 0 0 "[ . 1 . 2]" 1
1938 1 59 LYS HA 1 63 GLU QG 5.560 . 5.560 4.296 3.675 5.252 . 0 0 "[ . 1 . 2]" 1
1939 1 59 LYS QE 1 59 LYS QG 3.230 . 3.230 2.281 2.044 2.626 . 0 0 "[ . 1 . 2]" 1
1940 1 59 LYS QG 1 60 LYS H 4.410 . 4.410 3.709 3.078 4.399 . 0 0 "[ . 1 . 2]" 1
1941 1 59 LYS QG 1 60 LYS HA 4.460 . 4.460 3.918 3.203 4.882 0.422 14 0 "[ . 1 . 2]" 1
1942 1 59 LYS QG 1 61 LEU H 5.810 . 5.810 5.251 4.882 5.791 . 0 0 "[ . 1 . 2]" 1
1943 1 59 LYS QG 1 63 GLU H 4.590 . 4.590 4.303 3.959 4.711 0.121 2 0 "[ . 1 . 2]" 1
1944 1 59 LYS QG 1 63 GLU QB 5.190 . 5.190 4.272 3.366 5.236 0.046 17 0 "[ . 1 . 2]" 1
1945 1 59 LYS QG 1 87 ASP H 5.470 . 5.470 4.232 3.343 5.110 . 0 0 "[ . 1 . 2]" 1
1946 1 59 LYS QG 1 87 ASP HA 3.970 . 3.970 2.248 1.868 2.917 . 0 0 "[ . 1 . 2]" 1
1947 1 59 LYS QG 1 87 ASP QB 3.670 . 3.670 2.541 2.138 2.997 . 0 0 "[ . 1 . 2]" 1
1948 1 59 LYS QG 1 88 ASN H 5.490 . 5.490 5.239 4.867 5.651 0.161 15 0 "[ . 1 . 2]" 1
1949 1 59 LYS QD 1 63 GLU QG 3.590 . 3.590 2.387 1.759 3.605 0.041 6 0 "[ . 1 . 2]" 1
1950 1 59 LYS QE 1 63 GLU QG 4.600 . 4.600 3.477 2.276 4.596 . 0 0 "[ . 1 . 2]" 1
1951 1 63 GLU H 1 63 GLU QG 3.150 . 3.150 2.343 1.921 3.270 0.120 14 0 "[ . 1 . 2]" 1
1952 1 63 GLU HA 1 63 GLU QG 3.500 . 3.500 2.602 2.233 3.347 . 0 0 "[ . 1 . 2]" 1
1953 1 63 GLU QB 1 67 GLN QE 5.350 . 5.350 3.589 2.262 5.363 0.013 11 0 "[ . 1 . 2]" 1
1954 1 63 GLU QG 1 64 SER H 4.760 . 4.760 3.807 2.075 4.474 . 0 0 "[ . 1 . 2]" 1
1955 1 64 SER HA 1 67 GLN QG 4.420 . 4.420 3.182 2.015 4.197 . 0 0 "[ . 1 . 2]" 1
1956 1 65 TYR QD 1 66 CYS QB 4.460 . 4.460 4.049 3.097 4.262 . 0 0 "[ . 1 . 2]" 1
1957 1 65 TYR QD 1 71 VAL QG 4.400 . 4.400 4.226 3.982 4.454 0.054 5 0 "[ . 1 . 2]" 1
1958 1 65 TYR HE2 1 71 VAL QG 4.090 . 4.090 3.688 3.303 4.092 0.002 1 0 "[ . 1 . 2]" 1
1959 1 66 CYS H 1 66 CYS QB 2.990 . 2.990 2.472 2.148 2.630 . 0 0 "[ . 1 . 2]" 1
1960 1 66 CYS H 1 67 GLN QG 4.590 . 4.590 4.106 3.748 4.529 . 0 0 "[ . 1 . 2]" 1
1961 1 66 CYS H 1 71 VAL QG 4.830 . 4.830 4.423 4.210 4.916 0.086 5 0 "[ . 1 . 2]" 1
1962 1 66 CYS HA 1 71 VAL QG 3.040 . 3.040 2.145 1.958 2.732 . 0 0 "[ . 1 . 2]" 1
1963 1 66 CYS QB 1 67 GLN H 3.240 . 3.240 2.560 2.421 3.308 0.068 8 0 "[ . 1 . 2]" 1
1964 1 66 CYS QB 1 67 GLN HA 4.550 . 4.550 3.881 3.810 4.230 . 0 0 "[ . 1 . 2]" 1
1965 1 66 CYS QB 1 67 GLN QB 4.710 . 4.710 4.254 3.829 4.957 0.247 8 0 "[ . 1 . 2]" 1
1966 1 66 CYS QB 1 67 GLN QG 3.950 . 3.950 3.431 2.968 4.065 0.115 17 0 "[ . 1 . 2]" 1
1967 1 66 CYS QB 1 68 ARG H 5.810 . 5.810 4.725 4.572 5.171 . 0 0 "[ . 1 . 2]" 1
1968 1 66 CYS QB 1 71 VAL H 4.620 . 4.620 3.584 3.350 4.544 . 0 0 "[ . 1 . 2]" 1
1969 1 66 CYS QB 1 71 VAL HB 5.160 . 5.160 4.045 2.519 5.210 0.050 7 0 "[ . 1 . 2]" 1
1970 1 66 CYS QB 1 71 VAL QG 3.520 . 3.520 2.690 2.314 3.438 . 0 0 "[ . 1 . 2]" 1
1971 1 66 CYS QB 1 73 MET H 5.280 . 5.280 4.060 3.744 4.917 . 0 0 "[ . 1 . 2]" 1
1972 1 66 CYS QB 1 73 MET QB 4.060 . 4.060 3.455 3.069 3.792 . 0 0 "[ . 1 . 2]" 1
1973 1 66 CYS QB 1 73 MET QG 5.430 . 5.430 5.054 4.693 5.416 . 0 0 "[ . 1 . 2]" 1
1974 1 66 CYS QB 1 76 LEU HG 4.720 . 4.720 3.887 2.882 4.218 . 0 0 "[ . 1 . 2]" 1
1975 1 66 CYS QB 1 76 LEU QD 4.220 . 4.220 3.179 2.541 3.518 . 0 0 "[ . 1 . 2]" 1
1976 1 67 GLN H 1 67 GLN QG 3.050 . 3.050 2.170 1.959 2.382 . 0 0 "[ . 1 . 2]" 1
1977 1 67 GLN H 1 67 GLN QE 4.650 . 4.650 3.690 3.008 4.740 0.090 4 0 "[ . 1 . 2]" 1
1978 1 67 GLN H 1 71 VAL QG 5.020 . 5.020 4.705 4.484 5.130 0.110 6 0 "[ . 1 . 2]" 1
1979 1 67 GLN HA 1 67 GLN QG 3.310 . 3.310 2.890 2.379 3.350 0.040 7 0 "[ . 1 . 2]" 1
1980 1 67 GLN QE 1 67 GLN QG 3.040 . 3.040 2.211 2.119 2.687 . 0 0 "[ . 1 . 2]" 1
1981 1 67 GLN QG 1 68 ARG H 4.330 . 4.330 3.524 2.072 4.212 . 0 0 "[ . 1 . 2]" 1
1982 1 67 GLN QG 1 69 GLN H 5.810 . 5.810 5.304 4.356 5.788 . 0 0 "[ . 1 . 2]" 1
1983 1 68 ARG QB 1 71 VAL QG 5.920 . 5.920 5.365 5.130 5.523 . 0 0 "[ . 1 . 2]" 1
1984 1 69 GLN H 1 71 VAL QG 3.730 . 3.730 3.643 3.476 3.761 0.031 12 0 "[ . 1 . 2]" 1
1985 1 69 GLN HA 1 71 VAL QG 4.440 . 4.440 4.048 3.914 4.237 . 0 0 "[ . 1 . 2]" 1
1986 1 69 GLN QB 1 71 VAL QG 2.980 . 2.980 2.066 1.904 2.217 . 0 0 "[ . 1 . 2]" 1
1987 1 69 GLN QG 1 71 VAL QG 3.600 . 3.600 3.383 3.262 3.559 . 0 0 "[ . 1 . 2]" 1
1988 1 70 GLY H 1 71 VAL QG 3.800 . 3.800 3.438 3.374 3.617 . 0 0 "[ . 1 . 2]" 1
1989 1 71 VAL H 1 71 VAL QG 2.710 . 2.710 2.019 1.934 2.150 . 0 0 "[ . 1 . 2]" 1
1990 1 71 VAL QG 1 72 PRO HA 4.690 . 4.690 4.557 4.182 4.705 0.015 12 0 "[ . 1 . 2]" 1
1991 1 71 VAL QG 1 72 PRO QG 3.550 . 3.550 3.738 3.108 3.888 0.338 18 0 "[ . 1 . 2]" 1
1992 1 71 VAL QG 1 72 PRO QD 3.240 . 3.240 2.374 1.986 2.656 . 0 0 "[ . 1 . 2]" 1
1993 1 71 VAL QG 1 106 GLN HA 4.990 . 4.990 4.529 3.842 4.748 . 0 0 "[ . 1 . 2]" 1
1994 1 71 VAL QG 1 106 GLN HB2 3.000 . 3.000 2.957 2.592 3.079 0.079 6 0 "[ . 1 . 2]" 1
1995 1 71 VAL QG 1 106 GLN HB3 3.810 . 3.810 3.444 2.961 3.689 . 0 0 "[ . 1 . 2]" 1
1996 1 71 VAL QG 1 106 GLN QG 4.230 . 4.230 3.821 3.486 4.092 . 0 0 "[ . 1 . 2]" 1
1997 1 71 VAL QG 1 106 GLN HE21 4.090 . 4.090 2.889 2.630 3.128 . 0 0 "[ . 1 . 2]" 1
1998 1 71 VAL QG 1 106 GLN HE22 4.030 . 4.030 2.808 2.458 3.089 . 0 0 "[ . 1 . 2]" 1
1999 1 71 VAL QG 1 107 GLU H 5.200 . 5.200 5.081 4.424 5.370 0.170 3 0 "[ . 1 . 2]" 1
2000 1 75 SER HA 1 107 GLU QB 4.420 . 4.420 3.229 2.867 3.626 . 0 0 "[ . 1 . 2]" 1
2001 1 75 SER HB3 1 107 GLU QB 4.760 . 4.760 3.315 1.894 4.814 0.054 6 0 "[ . 1 . 2]" 1
2002 1 76 LEU HA 1 107 GLU QB 4.510 . 4.510 4.236 3.865 4.555 0.045 17 0 "[ . 1 . 2]" 1
2003 1 77 ARG HE 1 79 LEU QD 5.810 . 5.810 4.543 3.033 5.584 . 0 0 "[ . 1 . 2]" 1
2004 1 78 PHE HA 1 79 LEU QD 4.430 . 4.430 4.038 3.878 4.135 . 0 0 "[ . 1 . 2]" 1
2005 1 78 PHE HB2 1 79 LEU QD 5.320 . 5.320 5.366 5.276 5.418 0.098 7 0 "[ . 1 . 2]" 1
2006 1 79 LEU H 1 79 LEU QD 3.630 . 3.630 2.561 2.290 3.113 . 0 0 "[ . 1 . 2]" 1
2007 1 79 LEU H 1 103 GLU QG 4.650 . 4.650 4.394 4.244 4.578 . 0 0 "[ . 1 . 2]" 1
2008 1 79 LEU HA 1 79 LEU QD 3.380 . 3.380 3.364 3.340 3.403 0.023 12 0 "[ . 1 . 2]" 1
2009 1 79 LEU HB3 1 79 LEU QD 2.870 . 2.870 2.206 2.104 2.247 . 0 0 "[ . 1 . 2]" 1
2010 1 79 LEU QD 1 80 PHE HA 4.520 . 4.520 3.376 3.074 3.594 . 0 0 "[ . 1 . 2]" 1
2011 1 79 LEU QD 1 81 GLU H 5.820 . 5.820 4.062 3.774 4.308 . 0 0 "[ . 1 . 2]" 1
2012 1 79 LEU QD 1 82 GLY H 4.270 . 4.270 3.066 2.800 3.333 . 0 0 "[ . 1 . 2]" 1
2013 1 79 LEU QD 1 82 GLY HA2 3.630 . 3.630 2.846 2.405 3.130 . 0 0 "[ . 1 . 2]" 1
2014 1 79 LEU QD 1 82 GLY HA3 5.200 . 5.200 4.201 3.799 4.478 . 0 0 "[ . 1 . 2]" 1
2015 1 79 LEU QD 1 83 GLN H 4.420 . 4.420 3.975 3.840 4.120 . 0 0 "[ . 1 . 2]" 1
2016 1 79 LEU QD 1 83 GLN HA 5.540 . 5.540 4.729 4.562 4.918 . 0 0 "[ . 1 . 2]" 1
2017 1 79 LEU QD 1 84 ARG HA 4.730 . 4.730 3.996 3.822 4.216 . 0 0 "[ . 1 . 2]" 1
2018 1 79 LEU QD 1 102 ILE MG 4.750 . 4.750 3.901 3.761 4.178 . 0 0 "[ . 1 . 2]" 1
2019 1 79 LEU QD 1 103 GLU H 3.730 . 3.730 3.196 2.969 3.423 . 0 0 "[ . 1 . 2]" 1
2020 1 79 LEU QD 1 103 GLU QB 4.290 . 4.290 1.853 1.766 1.931 0.034 3 0 "[ . 1 . 2]" 1
2021 1 79 LEU QD 1 103 GLU QG 3.640 . 3.640 2.408 2.219 2.595 . 0 0 "[ . 1 . 2]" 1
2022 1 79 LEU QD 1 104 VAL HA 3.850 . 3.850 3.927 3.864 4.109 0.259 12 0 "[ . 1 . 2]" 1
2023 1 79 LEU QD 1 104 VAL QG 4.680 . 4.680 4.229 4.163 4.369 . 0 0 "[ . 1 . 2]" 1
2024 1 79 LEU QD 1 105 TYR HB2 4.860 . 4.860 4.227 3.876 4.503 . 0 0 "[ . 1 . 2]" 1
2025 1 79 LEU QD 1 105 TYR QD 3.240 . 3.240 2.547 2.196 2.825 . 0 0 "[ . 1 . 2]" 1
2026 1 79 LEU QD 1 105 TYR QE 3.140 . 3.140 1.918 1.816 2.159 . 0 0 "[ . 1 . 2]" 1
2027 1 80 PHE HB3 1 81 GLU QG 4.780 . 4.780 4.415 3.986 4.587 . 0 0 "[ . 1 . 2]" 1
2028 1 80 PHE QD 1 81 GLU QG 4.470 . 4.470 3.120 2.812 3.317 . 0 0 "[ . 1 . 2]" 1
2029 1 80 PHE QE 1 81 GLU QG 3.830 . 3.830 2.801 2.551 3.031 . 0 0 "[ . 1 . 2]" 1
2030 1 81 GLU H 1 81 GLU QG 3.930 . 3.930 2.857 2.684 2.969 . 0 0 "[ . 1 . 2]" 1
2031 1 81 GLU HA 1 81 GLU QG 3.350 . 3.350 2.708 2.269 3.006 . 0 0 "[ . 1 . 2]" 1
2032 1 81 GLU QG 1 83 GLN HE21 4.150 . 4.150 3.917 3.339 4.179 0.029 6 0 "[ . 1 . 2]" 1
2033 1 87 ASP H 1 88 ASN QD 5.410 . 5.410 4.521 3.264 5.606 0.196 11 0 "[ . 1 . 2]" 1
2034 1 88 ASN H 1 88 ASN QB 3.300 . 3.300 2.833 2.453 2.952 . 0 0 "[ . 1 . 2]" 1
2035 1 88 ASN H 1 88 ASN QD 4.660 . 4.660 3.183 2.271 4.044 . 0 0 "[ . 1 . 2]" 1
2036 1 103 GLU H 1 103 GLU QG 4.140 . 4.140 4.020 3.945 4.051 . 0 0 "[ . 1 . 2]" 1
2037 1 103 GLU QG 1 104 VAL H 4.020 . 4.020 2.650 2.414 2.764 . 0 0 "[ . 1 . 2]" 1
2038 1 103 GLU QG 1 104 VAL HB 5.010 . 5.010 4.987 4.776 5.079 0.069 1 0 "[ . 1 . 2]" 1
2039 1 103 GLU QG 1 104 VAL QG 5.180 . 5.180 4.300 4.222 4.398 . 0 0 "[ . 1 . 2]" 1
2040 1 103 GLU QG 1 105 TYR H 4.910 . 4.910 4.451 4.232 4.658 . 0 0 "[ . 1 . 2]" 1
2041 1 103 GLU QG 1 105 TYR HA 5.190 . 5.190 4.923 4.737 5.172 . 0 0 "[ . 1 . 2]" 1
2042 1 103 GLU QG 1 105 TYR HB2 5.360 . 5.360 5.197 5.008 5.328 . 0 0 "[ . 1 . 2]" 1
2043 1 103 GLU QG 1 105 TYR QD 4.360 . 4.360 3.598 3.414 3.757 . 0 0 "[ . 1 . 2]" 1
2044 1 106 GLN HA 1 107 GLU QB 4.670 . 4.670 4.344 4.119 4.452 . 0 0 "[ . 1 . 2]" 1
2045 1 107 GLU H 1 107 GLU QB 3.000 . 3.000 2.401 2.137 2.501 . 0 0 "[ . 1 . 2]" 1
2046 1 107 GLU HA 1 108 GLN QB 5.810 . 5.810 4.441 4.093 4.742 . 0 0 "[ . 1 . 2]" 1
2047 1 107 GLU QB 1 108 GLN H 3.400 . 3.400 2.322 1.890 2.800 . 0 0 "[ . 1 . 2]" 1
2048 1 107 GLU QB 1 108 GLN QG 5.160 . 5.160 4.124 2.685 5.160 0.000 18 0 "[ . 1 . 2]" 1
2049 1 107 GLU QB 1 109 THR H 4.480 . 4.480 2.765 2.229 4.053 . 0 0 "[ . 1 . 2]" 1
2050 1 108 GLN QB 1 108 GLN QG 2.420 . 2.420 2.069 1.994 2.090 . 0 0 "[ . 1 . 2]" 1
2051 1 108 GLN QB 1 108 GLN QE 3.750 . 3.750 2.622 1.737 3.720 0.063 5 0 "[ . 1 . 2]" 1
2052 1 108 GLN QB 1 109 THR H 4.250 . 4.250 3.403 2.373 4.014 . 0 0 "[ . 1 . 2]" 1
2053 1 108 GLN QE 1 109 THR MG 4.390 . 4.390 3.869 2.020 4.604 0.214 20 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 58
_Distance_constraint_stats_list.Viol_count 193
_Distance_constraint_stats_list.Viol_total 155.168
_Distance_constraint_stats_list.Viol_max 0.169
_Distance_constraint_stats_list.Viol_rms 0.0207
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0067
_Distance_constraint_stats_list.Viol_average_violations_only 0.0402
_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 36 ILE 0.512 0.072 18 0 "[ . 1 . 2]"
1 37 LYS 2.193 0.169 4 0 "[ . 1 . 2]"
1 38 LEU 0.069 0.027 12 0 "[ . 1 . 2]"
1 39 LYS 1.136 0.098 17 0 "[ . 1 . 2]"
1 40 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 ILE 0.079 0.020 2 0 "[ . 1 . 2]"
1 42 GLY 0.544 0.079 15 0 "[ . 1 . 2]"
1 45 SER 0.361 0.079 15 0 "[ . 1 . 2]"
1 46 SER 0.183 0.054 17 0 "[ . 1 . 2]"
1 48 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 PHE 0.069 0.027 12 0 "[ . 1 . 2]"
1 52 VAL 0.512 0.072 18 0 "[ . 1 . 2]"
1 58 LEU 0.047 0.029 11 0 "[ . 1 . 2]"
1 59 LYS 0.161 0.088 14 0 "[ . 1 . 2]"
1 60 LYS 0.880 0.075 7 0 "[ . 1 . 2]"
1 61 LEU 0.003 0.003 18 0 "[ . 1 . 2]"
1 62 LYS 0.085 0.029 11 0 "[ . 1 . 2]"
1 63 GLU 0.282 0.088 14 0 "[ . 1 . 2]"
1 64 SER 0.890 0.075 7 0 "[ . 1 . 2]"
1 65 TYR 0.021 0.018 5 0 "[ . 1 . 2]"
1 66 CYS 0.039 0.023 8 0 "[ . 1 . 2]"
1 67 GLN 0.121 0.045 2 0 "[ . 1 . 2]"
1 68 ARG 0.011 0.011 2 0 "[ . 1 . 2]"
1 69 GLN 0.018 0.018 5 0 "[ . 1 . 2]"
1 75 SER 0.349 0.074 18 0 "[ . 1 . 2]"
1 77 ARG 1.169 0.094 12 0 "[ . 1 . 2]"
1 78 PHE 0.253 0.049 20 0 "[ . 1 . 2]"
1 79 LEU 0.052 0.032 12 0 "[ . 1 . 2]"
1 80 PHE 0.124 0.029 19 0 "[ . 1 . 2]"
1 83 GLN 0.124 0.029 19 0 "[ . 1 . 2]"
1 85 ILE 0.253 0.049 20 0 "[ . 1 . 2]"
1 99 GLU 2.193 0.169 4 0 "[ . 1 . 2]"
1 100 ASP 1.019 0.098 17 0 "[ . 1 . 2]"
1 102 ILE 0.130 0.055 8 0 "[ . 1 . 2]"
1 103 GLU 0.052 0.032 12 0 "[ . 1 . 2]"
1 104 VAL 0.066 0.020 2 0 "[ . 1 . 2]"
1 105 TYR 1.169 0.094 12 0 "[ . 1 . 2]"
1 107 GLU 0.349 0.074 18 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 58 LEU O 1 62 LYS H 2.220 . 2.220 1.993 1.793 2.231 0.011 11 0 "[ . 1 . 2]" 2
2 1 58 LEU O 1 62 LYS N 3.130 . 3.130 2.947 2.741 3.159 0.029 11 0 "[ . 1 . 2]" 2
3 1 59 LYS O 1 63 GLU H 2.220 . 2.220 1.870 1.712 2.036 0.088 14 0 "[ . 1 . 2]" 2
4 1 59 LYS O 1 63 GLU N 3.130 . 3.130 2.848 2.684 3.016 . 0 0 "[ . 1 . 2]" 2
5 1 60 LYS O 1 64 SER H 2.220 . 2.220 2.218 1.994 2.295 0.075 7 0 "[ . 1 . 2]" 2
6 1 60 LYS O 1 64 SER N 3.130 . 3.130 3.109 2.871 3.196 0.066 9 0 "[ . 1 . 2]" 2
7 1 61 LEU O 1 65 TYR H 2.220 . 2.220 2.092 1.953 2.191 . 0 0 "[ . 1 . 2]" 2
8 1 61 LEU O 1 65 TYR N 3.130 . 3.130 2.996 2.850 3.133 0.003 18 0 "[ . 1 . 2]" 2
9 1 62 LYS O 1 66 CYS H 2.220 . 2.220 1.906 1.777 2.044 0.023 8 0 "[ . 1 . 2]" 2
10 1 62 LYS O 1 66 CYS N 3.130 . 3.130 2.783 2.678 2.922 . 0 0 "[ . 1 . 2]" 2
11 1 63 GLU O 1 67 GLN H 2.220 . 2.220 1.897 1.755 2.116 0.045 2 0 "[ . 1 . 2]" 2
12 1 63 GLU O 1 67 GLN N 3.130 . 3.130 2.853 2.729 3.074 . 0 0 "[ . 1 . 2]" 2
13 1 64 SER O 1 68 ARG H 2.220 . 2.220 2.030 1.845 2.231 0.011 2 0 "[ . 1 . 2]" 2
14 1 64 SER O 1 68 ARG N 3.130 . 3.130 2.951 2.799 3.128 . 0 0 "[ . 1 . 2]" 2
15 1 65 TYR O 1 69 GLN H 2.220 . 2.220 2.057 1.878 2.238 0.018 5 0 "[ . 1 . 2]" 2
16 1 65 TYR O 1 69 GLN N 3.130 . 3.130 2.945 2.778 3.092 . 0 0 "[ . 1 . 2]" 2
17 1 36 ILE H 1 52 VAL O 2.120 . 2.120 1.957 1.763 2.170 0.050 3 0 "[ . 1 . 2]" 2
18 1 36 ILE N 1 52 VAL O 3.050 . 3.050 2.912 2.737 3.085 0.035 12 0 "[ . 1 . 2]" 2
19 1 36 ILE O 1 52 VAL H 2.120 . 2.120 1.807 1.728 1.873 0.072 18 0 "[ . 1 . 2]" 2
20 1 36 ILE O 1 52 VAL N 3.050 . 3.050 2.736 2.669 2.805 . 0 0 "[ . 1 . 2]" 2
21 1 38 LEU H 1 50 PHE O 2.120 . 2.120 1.911 1.804 2.037 . 0 0 "[ . 1 . 2]" 2
22 1 38 LEU N 1 50 PHE O 3.050 . 3.050 2.878 2.763 3.002 . 0 0 "[ . 1 . 2]" 2
23 1 38 LEU O 1 50 PHE H 2.120 . 2.120 1.821 1.773 1.874 0.027 12 0 "[ . 1 . 2]" 2
24 1 38 LEU O 1 50 PHE N 3.050 . 3.050 2.795 2.738 2.853 . 0 0 "[ . 1 . 2]" 2
25 1 40 VAL H 1 48 ILE O 2.120 . 2.120 1.919 1.858 1.980 . 0 0 "[ . 1 . 2]" 2
26 1 40 VAL N 1 48 ILE O 3.050 . 3.050 2.840 2.793 2.899 . 0 0 "[ . 1 . 2]" 2
27 1 40 VAL O 1 48 ILE H 2.120 . 2.120 1.978 1.884 2.047 . 0 0 "[ . 1 . 2]" 2
28 1 40 VAL O 1 48 ILE N 3.050 . 3.050 2.898 2.825 2.965 . 0 0 "[ . 1 . 2]" 2
29 1 42 GLY H 1 46 SER O 2.120 . 2.120 2.057 1.889 2.174 0.054 17 0 "[ . 1 . 2]" 2
30 1 42 GLY N 1 46 SER O 3.050 . 3.050 2.909 2.758 3.020 . 0 0 "[ . 1 . 2]" 2
31 1 42 GLY O 1 45 SER H 2.120 . 2.120 2.118 1.995 2.199 0.079 15 0 "[ . 1 . 2]" 2
32 1 42 GLY O 1 45 SER N 3.050 . 3.050 2.927 2.851 2.988 . 0 0 "[ . 1 . 2]" 2
33 1 37 LYS O 1 99 GLU H 2.120 . 2.120 1.690 1.631 1.753 0.169 4 0 "[ . 1 . 2]" 2
34 1 37 LYS O 1 99 GLU N 3.050 . 3.050 2.634 2.593 2.675 . 0 0 "[ . 1 . 2]" 2
35 1 39 LYS H 1 100 ASP O 2.120 . 2.120 2.095 1.906 2.218 0.098 17 0 "[ . 1 . 2]" 2
36 1 39 LYS N 1 100 ASP O 3.050 . 3.050 3.034 2.839 3.135 0.085 5 0 "[ . 1 . 2]" 2
37 1 39 LYS O 1 102 ILE H 2.120 . 2.120 2.042 1.882 2.166 0.046 8 0 "[ . 1 . 2]" 2
38 1 39 LYS O 1 102 ILE N 3.050 . 3.050 2.985 2.835 3.105 0.055 8 0 "[ . 1 . 2]" 2
39 1 41 ILE H 1 102 ILE O 2.120 . 2.120 1.908 1.787 2.078 0.013 7 0 "[ . 1 . 2]" 2
40 1 41 ILE N 1 102 ILE O 3.050 . 3.050 2.874 2.755 3.043 . 0 0 "[ . 1 . 2]" 2
41 1 41 ILE O 1 104 VAL H 2.120 . 2.120 2.070 1.921 2.140 0.020 2 0 "[ . 1 . 2]" 2
42 1 41 ILE O 1 104 VAL N 3.050 . 3.050 2.762 2.701 2.890 . 0 0 "[ . 1 . 2]" 2
43 1 80 PHE O 1 83 GLN H 2.120 . 2.120 2.038 1.937 2.130 0.010 20 0 "[ . 1 . 2]" 2
44 1 80 PHE O 1 83 GLN N 3.050 . 3.050 2.963 2.886 3.052 0.002 4 0 "[ . 1 . 2]" 2
45 1 80 PHE H 1 83 GLN O 2.120 . 2.120 1.819 1.771 1.877 0.029 19 0 "[ . 1 . 2]" 2
46 1 80 PHE N 1 83 GLN O 3.050 . 3.050 2.763 2.723 2.815 . 0 0 "[ . 1 . 2]" 2
47 1 78 PHE O 1 85 ILE H 2.120 . 2.120 1.797 1.751 1.859 0.049 20 0 "[ . 1 . 2]" 2
48 1 78 PHE O 1 85 ILE N 3.050 . 3.050 2.766 2.722 2.826 . 0 0 "[ . 1 . 2]" 2
49 1 75 SER O 1 107 GLU H 2.120 . 2.120 2.037 1.794 2.190 0.070 4 0 "[ . 1 . 2]" 2
50 1 75 SER O 1 107 GLU N 3.050 . 3.050 2.952 2.736 3.124 0.074 18 0 "[ . 1 . 2]" 2
51 1 77 ARG O 1 105 TYR H 2.120 . 2.120 1.927 1.865 2.015 . 0 0 "[ . 1 . 2]" 2
52 1 77 ARG O 1 105 TYR N 3.050 . 3.050 2.876 2.833 2.952 . 0 0 "[ . 1 . 2]" 2
53 1 77 ARG H 1 105 TYR O 2.120 . 2.120 1.742 1.706 1.786 0.094 12 0 "[ . 1 . 2]" 2
54 1 77 ARG N 1 105 TYR O 3.050 . 3.050 2.706 2.677 2.743 . 0 0 "[ . 1 . 2]" 2
55 1 79 LEU H 1 103 GLU O 2.120 . 2.120 1.887 1.768 2.007 0.032 12 0 "[ . 1 . 2]" 2
56 1 79 LEU N 1 103 GLU O 3.050 . 3.050 2.830 2.740 2.933 . 0 0 "[ . 1 . 2]" 2
57 1 79 LEU O 1 103 GLU H 2.120 . 2.120 2.011 1.875 2.132 0.012 16 0 "[ . 1 . 2]" 2
58 1 79 LEU O 1 103 GLU N 3.050 . 3.050 2.898 2.785 2.998 . 0 0 "[ . 1 . 2]" 2
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