NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
588635 |
2mn2   |
19876 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mn2
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 1344
_Distance_constraint_stats_list.Viol_count 3956
_Distance_constraint_stats_list.Viol_total 7204.471
_Distance_constraint_stats_list.Viol_max 0.905
_Distance_constraint_stats_list.Viol_rms 0.0459
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0134
_Distance_constraint_stats_list.Viol_average_violations_only 0.0911
_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 12 MET 6.397 0.871 9 5 "[* .- +1 * . *]"
1 13 ASP 3.505 0.719 9 3 "[ . +1 * . -]"
1 14 GLU 0.505 0.202 14 0 "[ . 1 . 2]"
1 15 TYR 1.116 0.242 8 0 "[ . 1 . 2]"
1 16 SER 1.711 0.243 13 0 "[ . 1 . 2]"
1 17 PRO 0.406 0.128 13 0 "[ . 1 . 2]"
1 19 ARG 5.515 0.325 5 0 "[ . 1 . 2]"
1 20 HIS 1.372 0.194 6 0 "[ . 1 . 2]"
1 21 ASP 2.894 0.167 20 0 "[ . 1 . 2]"
1 22 VAL 4.406 0.183 4 0 "[ . 1 . 2]"
1 23 ALA 0.368 0.075 4 0 "[ . 1 . 2]"
1 24 GLN 2.476 0.143 3 0 "[ . 1 . 2]"
1 25 LEU 1.795 0.142 14 0 "[ . 1 . 2]"
1 26 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 PHE 1.005 0.113 5 0 "[ . 1 . 2]"
1 28 LEU 0.555 0.121 3 0 "[ . 1 . 2]"
1 29 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 GLU 2.059 0.166 1 0 "[ . 1 . 2]"
1 31 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 LEU 6.991 0.208 10 0 "[ . 1 . 2]"
1 33 TYR 0.761 0.090 13 0 "[ . 1 . 2]"
1 34 ASP 3.430 0.186 8 0 "[ . 1 . 2]"
1 35 GLU 2.955 0.111 4 0 "[ . 1 . 2]"
1 36 GLY 1.028 0.104 18 0 "[ . 1 . 2]"
1 37 ILE 1.334 0.121 9 0 "[ . 1 . 2]"
1 38 ALA 0.019 0.010 2 0 "[ . 1 . 2]"
1 39 THR 5.242 0.266 17 0 "[ . 1 . 2]"
1 40 LEU 4.062 0.154 15 0 "[ . 1 . 2]"
1 41 GLY 1.001 0.187 1 0 "[ . 1 . 2]"
1 42 ASP 4.745 0.187 1 0 "[ . 1 . 2]"
1 43 SER 2.311 0.237 1 0 "[ . 1 . 2]"
1 44 HIS 0.612 0.161 15 0 "[ . 1 . 2]"
1 45 HIS 0.535 0.338 6 0 "[ . 1 . 2]"
1 46 GLY 1.101 0.098 1 0 "[ . 1 . 2]"
1 47 TRP 2.278 0.140 12 0 "[ . 1 . 2]"
1 48 VAL 0.398 0.129 19 0 "[ . 1 . 2]"
1 49 ASN 1.286 0.150 3 0 "[ . 1 . 2]"
1 50 ASP 0.548 0.084 1 0 "[ . 1 . 2]"
1 51 PRO 0.362 0.080 17 0 "[ . 1 . 2]"
1 52 THR 4.695 0.320 9 0 "[ . 1 . 2]"
1 53 SER 7.435 0.320 9 0 "[ . 1 . 2]"
1 54 ALA 3.179 0.210 15 0 "[ . 1 . 2]"
1 55 VAL 17.614 0.478 3 0 "[ . 1 . 2]"
1 56 ASN 3.728 0.282 9 0 "[ . 1 . 2]"
1 57 LEU 3.943 0.337 8 0 "[ . 1 . 2]"
1 58 GLN 20.951 0.599 2 6 "[*+ . 1* *-* 2]"
1 59 LEU 10.846 0.245 8 0 "[ . 1 . 2]"
1 60 ASN 4.608 0.186 5 0 "[ . 1 . 2]"
1 61 ASP 3.914 0.186 5 0 "[ . 1 . 2]"
1 62 LEU 11.006 0.325 6 0 "[ . 1 . 2]"
1 63 ILE 6.908 0.238 6 0 "[ . 1 . 2]"
1 64 GLU 8.008 0.262 17 0 "[ . 1 . 2]"
1 65 HIS 4.898 0.262 17 0 "[ . 1 . 2]"
1 66 ILE 1.839 0.121 3 0 "[ . 1 . 2]"
1 67 ALA 2.402 0.189 14 0 "[ . 1 . 2]"
1 68 SER 2.640 0.163 5 0 "[ . 1 . 2]"
1 69 PHE 2.348 0.149 10 0 "[ . 1 . 2]"
1 70 VAL 7.015 0.282 7 0 "[ . 1 . 2]"
1 71 MET 10.816 0.310 14 0 "[ . 1 . 2]"
1 72 SER 6.814 0.232 1 0 "[ . 1 . 2]"
1 73 PHE 5.276 0.282 7 0 "[ . 1 . 2]"
1 74 LYS 4.723 0.281 1 0 "[ . 1 . 2]"
1 75 ILE 5.976 0.180 16 0 "[ . 1 . 2]"
1 76 LYS 4.891 0.180 16 0 "[ . 1 . 2]"
1 77 TYR 1.192 0.282 14 0 "[ . 1 . 2]"
1 78 PRO 0.850 0.259 14 0 "[ . 1 . 2]"
1 79 ASP 2.111 0.282 14 0 "[ . 1 . 2]"
1 80 ASP 19.373 0.485 6 0 "[ . 1 . 2]"
1 81 GLY 5.583 0.326 6 0 "[ . 1 . 2]"
1 82 ASP 7.952 0.315 12 0 "[ . 1 . 2]"
1 83 LEU 8.909 0.397 18 0 "[ . 1 . 2]"
1 84 SER 6.256 0.411 6 0 "[ . 1 . 2]"
1 85 GLU 16.053 0.460 5 0 "[ . 1 . 2]"
1 86 LEU 11.085 0.226 2 0 "[ . 1 . 2]"
1 87 VAL 4.218 0.170 5 0 "[ . 1 . 2]"
1 88 GLU 2.367 0.166 18 0 "[ . 1 . 2]"
1 89 GLU 1.869 0.120 14 0 "[ . 1 . 2]"
1 90 TYR 1.387 0.493 7 0 "[ . 1 . 2]"
1 91 LEU 4.483 0.493 7 0 "[ . 1 . 2]"
1 92 ASP 6.207 0.247 6 0 "[ . 1 . 2]"
1 93 ASP 2.545 0.247 6 0 "[ . 1 . 2]"
1 94 THR 2.001 0.158 9 0 "[ . 1 . 2]"
1 95 TYR 1.897 0.091 19 0 "[ . 1 . 2]"
1 96 THR 0.809 0.072 13 0 "[ . 1 . 2]"
1 97 LEU 11.673 0.280 10 0 "[ . 1 . 2]"
1 98 PHE 1.880 0.141 3 0 "[ . 1 . 2]"
1 99 SER 10.641 0.280 10 0 "[ . 1 . 2]"
1 100 SER 0.511 0.125 3 0 "[ . 1 . 2]"
1 101 TYR 2.077 0.421 17 0 "[ . 1 . 2]"
1 102 GLY 4.473 0.421 17 0 "[ . 1 . 2]"
1 103 ILE 8.295 0.237 17 0 "[ . 1 . 2]"
1 104 ASN 2.722 0.186 12 0 "[ . 1 . 2]"
1 105 ASP 0.287 0.090 2 0 "[ . 1 . 2]"
1 106 PRO 0.599 0.112 14 0 "[ . 1 . 2]"
1 107 GLU 2.146 0.160 20 0 "[ . 1 . 2]"
1 108 LEU 6.377 0.173 4 0 "[ . 1 . 2]"
1 109 GLN 9.821 0.328 14 0 "[ . 1 . 2]"
1 110 ARG 3.226 0.240 20 0 "[ . 1 . 2]"
1 111 TRP 6.603 0.324 1 0 "[ . 1 . 2]"
1 112 GLN 10.285 0.324 1 0 "[ . 1 . 2]"
1 113 LYS 8.088 0.306 15 0 "[ . 1 . 2]"
1 114 THR 3.269 0.233 8 0 "[ . 1 . 2]"
1 115 LYS 1.398 0.195 9 0 "[ . 1 . 2]"
1 116 GLU 1.485 0.195 9 0 "[ . 1 . 2]"
1 117 ARG 8.262 0.274 15 0 "[ . 1 . 2]"
1 118 LEU 3.204 0.158 1 0 "[ . 1 . 2]"
1 119 PHE 6.305 0.249 18 0 "[ . 1 . 2]"
1 120 ARG 3.059 0.249 18 0 "[ . 1 . 2]"
1 121 LEU 29.682 0.905 2 2 "[ + . 1 . -]"
1 122 PHE 2.205 0.152 9 0 "[ . 1 . 2]"
1 123 SER 0.216 0.061 2 0 "[ . 1 . 2]"
1 124 GLY 0.220 0.112 9 0 "[ . 1 . 2]"
1 125 GLU 6.354 0.339 4 0 "[ . 1 . 2]"
1 126 TYR 5.959 0.282 12 0 "[ . 1 . 2]"
1 127 ILE 4.316 0.197 5 0 "[ . 1 . 2]"
1 128 SER 3.134 0.172 15 0 "[ . 1 . 2]"
1 129 THR 4.158 0.361 5 0 "[ . 1 . 2]"
1 130 LEU 7.681 0.203 16 0 "[ . 1 . 2]"
1 131 MET 8.307 0.241 11 0 "[ . 1 . 2]"
1 132 LYS 9.483 0.373 19 0 "[ . 1 . 2]"
1 133 THR 5.090 0.226 17 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 75 ILE H 1 76 LYS H 2.580 . 3.360 2.560 2.463 2.664 . 0 0 "[ . 1 . 2]" 1
2 1 108 LEU MD1 1 112 GLN HE21 2.940 . 4.090 2.535 2.006 3.176 . 0 0 "[ . 1 . 2]" 1
3 1 109 GLN H 1 109 GLN HE21 3.070 . 4.340 3.361 2.301 4.055 . 0 0 "[ . 1 . 2]" 1
4 1 108 LEU MD2 1 109 GLN H 3.380 . 4.950 3.963 3.718 4.141 . 0 0 "[ . 1 . 2]" 1
5 1 109 GLN H 1 109 GLN HG3 2.790 . 3.770 3.821 3.773 3.868 0.098 10 0 "[ . 1 . 2]" 1
6 1 109 GLN H 1 109 GLN HG2 2.840 . 3.870 2.405 2.301 2.566 . 0 0 "[ . 1 . 2]" 1
7 1 71 MET H 1 72 SER H 2.550 . 3.300 2.964 2.822 3.092 . 0 0 "[ . 1 . 2]" 1
8 1 86 LEU MD1 1 118 LEU MD1 2.640 . 3.480 2.700 1.775 3.487 0.025 13 0 "[ . 1 . 2]" 1
9 1 86 LEU H 1 87 VAL H 2.550 . 3.310 2.715 2.382 2.826 . 0 0 "[ . 1 . 2]" 1
10 1 83 LEU H 1 84 SER H 2.550 . 3.310 2.735 2.513 3.095 . 0 0 "[ . 1 . 2]" 1
11 1 58 GLN H 1 58 GLN QG 2.670 . 3.550 2.484 1.909 2.949 . 0 0 "[ . 1 . 2]" 1
12 1 86 LEU MD2 1 118 LEU MD1 2.600 . 3.400 3.212 2.295 3.501 0.101 20 0 "[ . 1 . 2]" 1
13 1 58 GLN H 1 59 LEU H 2.310 . 2.830 2.898 2.830 2.966 0.136 11 0 "[ . 1 . 2]" 1
14 1 51 PRO HG2 1 52 THR H 3.350 . 4.900 3.920 2.580 4.746 . 0 0 "[ . 1 . 2]" 1
15 1 68 SER H 1 69 PHE H 2.650 . 3.500 2.771 2.649 2.862 . 0 0 "[ . 1 . 2]" 1
16 1 108 LEU H 1 108 LEU MD2 3.120 . 4.440 4.256 4.124 4.318 . 0 0 "[ . 1 . 2]" 1
17 1 83 LEU MD1 1 121 LEU MD1 2.580 . 3.370 2.747 1.631 3.458 0.169 18 0 "[ . 1 . 2]" 1
18 1 71 MET H 1 71 MET ME 3.150 . 4.490 2.896 2.581 3.668 . 0 0 "[ . 1 . 2]" 1
19 1 108 LEU MD1 1 109 GLN H 3.210 . 4.620 4.452 4.292 4.604 . 0 0 "[ . 1 . 2]" 1
20 1 85 GLU H 1 86 LEU H 2.580 . 3.360 2.878 2.636 3.019 . 0 0 "[ . 1 . 2]" 1
21 1 97 LEU MD1 1 98 PHE H 3.290 . 4.790 4.299 4.188 4.364 . 0 0 "[ . 1 . 2]" 1
22 1 58 GLN H 1 58 GLN HB2 2.580 . 3.360 2.265 2.126 2.710 . 0 0 "[ . 1 . 2]" 1
23 1 57 LEU H 1 58 GLN H 2.590 . 3.390 2.757 2.550 2.922 . 0 0 "[ . 1 . 2]" 1
24 1 69 PHE H 1 70 VAL H 2.680 . 3.560 2.757 2.622 2.849 . 0 0 "[ . 1 . 2]" 1
25 1 120 ARG H 1 121 LEU H 2.540 . 3.280 2.733 2.595 2.886 . 0 0 "[ . 1 . 2]" 1
26 1 97 LEU HB2 1 98 PHE H 2.670 . 3.540 2.514 2.347 2.660 . 0 0 "[ . 1 . 2]" 1
27 1 58 GLN H 1 58 GLN HB3 2.690 . 3.580 3.480 3.440 3.532 . 0 0 "[ . 1 . 2]" 1
28 1 83 LEU MD1 1 121 LEU MD2 2.480 . 3.160 1.974 1.693 2.526 0.107 17 0 "[ . 1 . 2]" 1
29 1 58 GLN H 1 58 GLN HE22 3.500 . 5.210 5.097 4.091 5.609 0.399 5 0 "[ . 1 . 2]" 1
30 1 119 PHE H 1 119 PHE QD 2.640 . 3.480 2.388 2.114 2.767 . 0 0 "[ . 1 . 2]" 1
31 1 103 ILE HA 1 104 ASN H 2.340 . 2.890 2.122 2.054 2.235 . 0 0 "[ . 1 . 2]" 1
32 1 98 PHE H 1 99 SER H 2.630 . 3.460 2.719 2.553 2.848 . 0 0 "[ . 1 . 2]" 1
33 1 37 ILE H 1 38 ALA H 2.620 . 3.440 2.856 2.745 2.956 . 0 0 "[ . 1 . 2]" 1
34 1 108 LEU MD2 1 109 GLN HE21 3.170 . 4.550 2.632 2.059 3.374 . 0 0 "[ . 1 . 2]" 1
35 1 112 GLN H 1 112 GLN HG2 2.760 . 3.710 2.037 1.844 2.214 . 0 0 "[ . 1 . 2]" 1
36 1 83 LEU MD1 1 84 SER H 3.320 . 4.840 4.482 4.154 4.707 . 0 0 "[ . 1 . 2]" 1
37 1 112 GLN H 1 113 LYS H 2.640 . 3.480 2.870 2.763 3.008 . 0 0 "[ . 1 . 2]" 1
38 1 112 GLN H 1 112 GLN HG3 2.820 . 3.840 2.865 2.463 3.118 . 0 0 "[ . 1 . 2]" 1
39 1 108 LEU H 1 109 GLN H 2.520 . 3.240 2.832 2.606 2.959 . 0 0 "[ . 1 . 2]" 1
40 1 97 LEU H 1 98 PHE H 2.740 . 3.680 3.010 2.890 3.112 . 0 0 "[ . 1 . 2]" 1
41 1 108 LEU MD1 1 112 GLN HG2 2.850 . 3.900 3.095 2.508 3.373 . 0 0 "[ . 1 . 2]" 1
42 1 64 GLU H 1 64 GLU HG2 2.760 . 3.720 3.407 2.981 3.765 0.045 4 0 "[ . 1 . 2]" 1
43 1 85 GLU HB3 1 86 LEU H 2.840 . 3.870 2.751 2.187 3.595 . 0 0 "[ . 1 . 2]" 1
44 1 86 LEU MD2 1 117 ARG HB2 2.750 . 3.700 2.525 1.803 3.273 . 0 0 "[ . 1 . 2]" 1
45 1 109 GLN H 1 110 ARG H 2.500 . 3.200 2.738 2.661 2.802 . 0 0 "[ . 1 . 2]" 1
46 1 67 ALA MB 1 70 VAL MG2 3.060 . 4.320 4.171 3.820 4.405 0.085 7 0 "[ . 1 . 2]" 1
47 1 103 ILE MG 1 104 ASN H 2.860 . 3.910 2.614 2.390 2.996 . 0 0 "[ . 1 . 2]" 1
48 1 95 TYR H 1 96 THR H 2.880 . 3.960 2.864 2.790 2.966 . 0 0 "[ . 1 . 2]" 1
49 1 113 LYS H 1 113 LYS HB2 2.300 . 2.800 2.552 2.152 2.726 . 0 0 "[ . 1 . 2]" 1
50 1 113 LYS H 1 113 LYS HG2 2.690 . 3.580 3.610 3.418 3.886 0.306 15 0 "[ . 1 . 2]" 1
51 1 84 SER H 1 85 GLU H 2.680 . 3.570 2.806 2.516 2.990 . 0 0 "[ . 1 . 2]" 1
52 1 121 LEU H 1 121 LEU MD1 2.870 . 3.940 2.365 1.629 4.063 0.171 3 0 "[ . 1 . 2]" 1
53 1 103 ILE H 1 103 ILE MD 2.930 . 4.060 2.991 2.669 3.270 . 0 0 "[ . 1 . 2]" 1
54 1 95 TYR QD 1 96 THR H 2.930 . 4.070 2.849 2.372 3.096 . 0 0 "[ . 1 . 2]" 1
55 1 103 ILE H 1 104 ASN H 3.170 . 4.540 4.509 4.340 4.578 0.038 13 0 "[ . 1 . 2]" 1
56 1 71 MET HB3 1 72 SER H 2.580 . 3.370 2.753 2.424 3.146 . 0 0 "[ . 1 . 2]" 1
57 1 109 GLN HA 1 109 GLN HE21 3.160 . 4.510 3.557 2.961 3.994 . 0 0 "[ . 1 . 2]" 1
58 1 114 THR H 1 115 LYS H 2.590 . 3.390 2.908 2.682 3.035 . 0 0 "[ . 1 . 2]" 1
59 1 91 LEU H 1 91 LEU MD2 2.920 . 4.030 2.813 2.275 3.647 . 0 0 "[ . 1 . 2]" 1
60 1 97 LEU H 1 97 LEU MD1 3.040 . 4.290 3.354 2.363 3.746 . 0 0 "[ . 1 . 2]" 1
61 1 58 GLN QG 1 59 LEU H 3.070 . 4.340 4.087 3.696 4.295 . 0 0 "[ . 1 . 2]" 1
62 1 55 VAL HA 1 58 GLN HE22 3.300 . 4.800 3.564 2.212 4.466 . 0 0 "[ . 1 . 2]" 1
63 1 56 ASN H 1 57 LEU H 2.710 . 3.630 2.835 2.761 2.948 . 0 0 "[ . 1 . 2]" 1
64 1 91 LEU H 1 91 LEU MD1 2.690 . 3.580 3.632 3.550 3.732 0.152 5 0 "[ . 1 . 2]" 1
65 1 97 LEU MD2 1 98 PHE H 3.180 . 4.560 4.200 4.001 4.330 . 0 0 "[ . 1 . 2]" 1
66 1 59 LEU H 1 59 LEU QD 2.930 . 4.070 2.677 2.079 2.982 . 0 0 "[ . 1 . 2]" 1
67 1 71 MET ME 1 72 SER H 3.420 . 5.030 4.534 4.069 4.950 . 0 0 "[ . 1 . 2]" 1
68 1 120 ARG HG2 1 121 LEU H 2.990 . 4.180 3.965 3.523 4.240 0.060 9 0 "[ . 1 . 2]" 1
69 1 76 LYS H 1 76 LYS QG 2.560 . 3.330 2.194 1.791 2.910 0.009 17 0 "[ . 1 . 2]" 1
70 1 127 ILE MG 1 131 MET H 3.390 . 4.970 3.560 3.024 4.036 . 0 0 "[ . 1 . 2]" 1
71 1 120 ARG HB2 1 121 LEU H 2.800 . 3.800 2.569 2.285 3.095 . 0 0 "[ . 1 . 2]" 1
72 1 97 LEU HG 1 98 PHE H 3.120 . 4.440 4.485 4.407 4.581 0.141 3 0 "[ . 1 . 2]" 1
73 1 97 LEU HB3 1 98 PHE H 2.790 . 3.780 2.328 2.201 2.460 . 0 0 "[ . 1 . 2]" 1
74 1 83 LEU HB2 1 84 SER H 2.640 . 3.480 3.568 3.496 3.621 0.141 6 0 "[ . 1 . 2]" 1
75 1 103 ILE HG13 1 104 ASN H 3.540 . 5.280 5.333 5.116 5.466 0.186 12 0 "[ . 1 . 2]" 1
76 1 103 ILE HB 1 104 ASN H 3.050 . 4.300 4.139 3.968 4.337 0.037 18 0 "[ . 1 . 2]" 1
77 1 83 LEU HB3 1 84 SER H 2.800 . 3.800 2.298 2.198 2.418 . 0 0 "[ . 1 . 2]" 1
78 1 22 VAL H 1 23 ALA H 2.730 . 3.660 2.842 2.687 2.968 . 0 0 "[ . 1 . 2]" 1
79 1 113 LYS H 1 113 LYS QD 2.660 . 3.520 3.329 2.194 3.682 0.162 11 0 "[ . 1 . 2]" 1
80 1 70 VAL H 1 70 VAL MG2 2.640 . 3.480 2.113 1.894 2.409 . 0 0 "[ . 1 . 2]" 1
81 1 91 LEU H 1 92 ASP H 2.520 . 3.240 2.814 2.702 2.893 . 0 0 "[ . 1 . 2]" 1
82 1 131 MET H 1 131 MET HG2 2.810 . 3.810 2.449 1.948 2.710 . 0 0 "[ . 1 . 2]" 1
83 1 97 LEU H 1 97 LEU HB3 2.550 . 3.310 3.383 3.334 3.427 0.117 13 0 "[ . 1 . 2]" 1
84 1 109 GLN HE21 1 109 GLN HG2 2.660 . 3.510 2.106 2.061 2.161 . 0 0 "[ . 1 . 2]" 1
85 1 69 PHE H 1 70 VAL MG2 3.330 . 4.850 4.236 3.996 4.493 . 0 0 "[ . 1 . 2]" 1
86 1 131 MET H 1 131 MET HG3 2.690 . 3.580 2.421 2.071 3.033 . 0 0 "[ . 1 . 2]" 1
87 1 83 LEU H 1 83 LEU HB2 2.520 . 3.240 2.358 2.244 2.472 . 0 0 "[ . 1 . 2]" 1
88 1 126 TYR QD 1 127 ILE H 3.040 . 4.280 3.103 2.297 3.995 . 0 0 "[ . 1 . 2]" 1
89 1 108 LEU HG 1 109 GLN H 3.240 . 4.680 3.518 3.246 3.772 . 0 0 "[ . 1 . 2]" 1
90 1 86 LEU HB2 1 87 VAL H 2.930 . 4.050 3.414 3.224 3.727 . 0 0 "[ . 1 . 2]" 1
91 1 120 ARG H 1 120 ARG HB2 2.520 . 3.230 2.831 2.611 3.296 0.066 18 0 "[ . 1 . 2]" 1
92 1 58 GLN H 1 58 GLN QB 2.350 . 2.910 2.235 2.107 2.625 . 0 0 "[ . 1 . 2]" 1
93 1 117 ARG H 1 117 ARG HB2 2.520 . 3.230 2.499 2.065 3.171 . 0 0 "[ . 1 . 2]" 1
94 1 103 ILE H 1 103 ILE MG 2.810 . 3.820 3.792 3.752 3.813 . 0 0 "[ . 1 . 2]" 1
95 1 36 GLY H 1 59 LEU QD 2.960 . 4.120 2.534 2.051 3.135 . 0 0 "[ . 1 . 2]" 1
96 1 75 ILE H 1 75 ILE HG13 2.770 . 3.730 2.212 1.914 3.727 . 0 0 "[ . 1 . 2]" 1
97 1 91 LEU H 1 91 LEU HB3 2.820 . 3.840 3.586 3.540 3.611 . 0 0 "[ . 1 . 2]" 1
98 1 112 GLN H 1 112 GLN HB3 2.740 . 3.680 3.583 3.554 3.618 . 0 0 "[ . 1 . 2]" 1
99 1 118 LEU H 1 119 PHE H 2.720 . 3.650 2.820 2.682 2.944 . 0 0 "[ . 1 . 2]" 1
100 1 91 LEU H 1 91 LEU HB2 2.670 . 3.530 2.687 2.307 3.056 . 0 0 "[ . 1 . 2]" 1
101 1 51 PRO HD2 1 52 THR H 2.870 . 3.930 2.902 2.321 3.267 . 0 0 "[ . 1 . 2]" 1
102 1 52 THR H 1 53 SER H 2.490 . 3.180 2.460 2.262 2.673 . 0 0 "[ . 1 . 2]" 1
103 1 120 ARG HB2 1 120 ARG HG2 2.380 . 2.950 2.604 2.415 2.987 0.037 18 0 "[ . 1 . 2]" 1
104 1 127 ILE H 1 127 ILE HG12 2.800 . 3.790 1.989 1.801 2.605 . 0 0 "[ . 1 . 2]" 1
105 1 109 GLN H 1 109 GLN QG 2.650 . 3.500 2.381 2.281 2.529 . 0 0 "[ . 1 . 2]" 1
106 1 127 ILE MG 1 130 LEU H 3.470 . 5.150 4.454 4.041 4.643 . 0 0 "[ . 1 . 2]" 1
107 1 59 LEU QD 1 60 ASN H 3.120 . 4.440 3.832 3.575 3.988 . 0 0 "[ . 1 . 2]" 1
108 1 103 ILE HA 1 103 ILE MD 2.560 . 3.320 1.998 1.876 2.090 . 0 0 "[ . 1 . 2]" 1
109 1 121 LEU H 1 121 LEU HB3 2.450 . 3.100 3.158 2.102 3.511 0.411 20 0 "[ . 1 . 2]" 1
110 1 75 ILE H 1 75 ILE HB 2.370 . 2.930 2.666 2.351 2.796 . 0 0 "[ . 1 . 2]" 1
111 1 59 LEU H 1 59 LEU QB 2.400 . 2.990 2.528 2.409 2.675 . 0 0 "[ . 1 . 2]" 1
112 1 86 LEU H 1 86 LEU MD2 3.040 . 4.290 3.695 3.322 4.111 . 0 0 "[ . 1 . 2]" 1
113 1 59 LEU H 1 59 LEU HG 2.810 . 3.820 2.293 2.053 2.612 . 0 0 "[ . 1 . 2]" 1
114 1 108 LEU MD1 1 109 GLN HE21 3.470 . 5.140 4.788 4.135 5.177 0.037 15 0 "[ . 1 . 2]" 1
115 1 78 PRO HG2 1 79 ASP H 2.770 . 3.730 2.625 2.042 3.478 . 0 0 "[ . 1 . 2]" 1
116 1 90 TYR H 1 91 LEU H 2.780 . 3.760 2.889 2.749 3.022 . 0 0 "[ . 1 . 2]" 1
117 1 76 LYS H 1 76 LYS QD 3.270 . 4.740 3.615 2.484 4.364 . 0 0 "[ . 1 . 2]" 1
118 1 117 ARG H 1 117 ARG HG3 2.790 . 3.780 2.403 1.857 3.359 . 0 0 "[ . 1 . 2]" 1
119 1 127 ILE H 1 127 ILE MD 2.940 . 4.090 3.006 2.308 3.865 . 0 0 "[ . 1 . 2]" 1
120 1 108 LEU MD2 1 112 GLN HE21 3.020 . 4.240 2.499 2.178 3.065 . 0 0 "[ . 1 . 2]" 1
121 1 117 ARG H 1 117 ARG HD3 3.120 . 4.430 4.082 3.516 4.547 0.117 14 0 "[ . 1 . 2]" 1
122 1 86 LEU H 1 86 LEU HB2 2.560 . 3.330 2.196 2.101 2.338 . 0 0 "[ . 1 . 2]" 1
123 1 68 SER H 1 70 VAL MG2 3.520 . 5.240 5.047 4.654 5.263 0.023 15 0 "[ . 1 . 2]" 1
124 1 108 LEU MD2 1 109 GLN HA 3.080 . 4.350 4.451 4.373 4.523 0.173 4 0 "[ . 1 . 2]" 1
125 1 97 LEU H 1 97 LEU MD2 2.970 . 4.150 2.896 2.467 3.527 . 0 0 "[ . 1 . 2]" 1
126 1 83 LEU MD2 1 84 SER H 3.180 . 4.560 4.178 3.609 4.567 0.007 15 0 "[ . 1 . 2]" 1
127 1 108 LEU H 1 108 LEU MD1 3.200 . 4.610 4.169 4.059 4.295 . 0 0 "[ . 1 . 2]" 1
128 1 58 GLN HB2 1 59 LEU H 2.770 . 3.730 2.481 2.249 2.783 . 0 0 "[ . 1 . 2]" 1
129 1 25 LEU H 1 25 LEU MD1 3.090 . 4.380 3.978 3.769 4.225 . 0 0 "[ . 1 . 2]" 1
130 1 58 GLN HB3 1 59 LEU H 2.800 . 3.790 3.139 2.775 3.640 . 0 0 "[ . 1 . 2]" 1
131 1 62 LEU H 1 62 LEU MD1 2.680 . 3.570 3.022 2.132 3.665 0.095 7 0 "[ . 1 . 2]" 1
132 1 62 LEU H 1 63 ILE H 2.750 . 3.700 2.968 2.720 3.117 . 0 0 "[ . 1 . 2]" 1
133 1 51 PRO HB3 1 52 THR H 3.170 . 4.540 4.230 4.076 4.470 . 0 0 "[ . 1 . 2]" 1
134 1 83 LEU H 1 83 LEU MD1 3.000 . 4.210 3.953 3.727 4.119 . 0 0 "[ . 1 . 2]" 1
135 1 86 LEU HB3 1 87 VAL H 2.860 . 3.910 2.454 2.331 2.688 . 0 0 "[ . 1 . 2]" 1
136 1 86 LEU MD2 1 117 ARG HB3 2.520 . 3.230 1.779 1.605 2.206 0.195 15 0 "[ . 1 . 2]" 1
137 1 103 ILE H 1 103 ILE HB 2.480 . 3.160 2.638 2.515 2.755 . 0 0 "[ . 1 . 2]" 1
138 1 103 ILE H 1 103 ILE HG13 2.870 . 3.940 3.656 3.526 3.835 . 0 0 "[ . 1 . 2]" 1
139 1 103 ILE H 1 103 ILE HG12 2.780 . 3.760 2.136 1.960 2.373 . 0 0 "[ . 1 . 2]" 1
140 1 91 LEU HB2 1 92 ASP H 2.550 . 3.300 2.309 2.162 2.564 . 0 0 "[ . 1 . 2]" 1
141 1 68 SER H 1 70 VAL H 3.140 . 4.470 4.330 4.141 4.501 0.031 11 0 "[ . 1 . 2]" 1
142 1 112 GLN HG2 1 113 LYS H 3.250 . 4.710 4.292 4.100 4.435 . 0 0 "[ . 1 . 2]" 1
143 1 65 HIS H 1 66 ILE H 2.740 . 3.680 2.874 2.755 2.994 . 0 0 "[ . 1 . 2]" 1
144 1 121 LEU H 1 122 PHE H 2.530 . 3.260 2.696 2.471 2.884 . 0 0 "[ . 1 . 2]" 1
145 1 120 ARG H 1 120 ARG HG3 2.670 . 3.550 3.285 2.290 3.545 . 0 0 "[ . 1 . 2]" 1
146 1 112 GLN HA 1 112 GLN HG2 2.760 . 3.710 2.707 2.600 2.819 . 0 0 "[ . 1 . 2]" 1
147 1 85 GLU H 1 85 GLU HB3 2.520 . 3.240 2.557 2.036 3.112 . 0 0 "[ . 1 . 2]" 1
148 1 59 LEU QB 1 60 ASN H 2.500 . 3.190 2.424 2.179 2.635 . 0 0 "[ . 1 . 2]" 1
149 1 91 LEU MD2 1 92 ASP H 3.030 . 4.260 4.376 4.258 4.492 0.232 12 0 "[ . 1 . 2]" 1
150 1 64 GLU H 1 64 GLU HG3 2.950 . 4.100 2.949 1.833 4.090 . 0 0 "[ . 1 . 2]" 1
151 1 67 ALA MB 1 70 VAL H 3.480 . 5.160 4.670 4.527 4.809 . 0 0 "[ . 1 . 2]" 1
152 1 86 LEU MD2 1 117 ARG HD3 2.830 . 3.860 3.061 2.201 4.079 0.219 15 0 "[ . 1 . 2]" 1
153 1 127 ILE H 1 127 ILE MG 2.770 . 3.740 3.761 3.703 3.788 0.048 12 0 "[ . 1 . 2]" 1
154 1 86 LEU MD2 1 87 VAL H 3.220 . 4.650 4.713 4.583 4.795 0.145 18 0 "[ . 1 . 2]" 1
155 1 119 PHE H 1 119 PHE HB3 2.730 . 3.670 3.566 3.516 3.618 . 0 0 "[ . 1 . 2]" 1
156 1 111 TRP H 1 112 GLN H 2.770 . 3.730 2.847 2.697 2.998 . 0 0 "[ . 1 . 2]" 1
157 1 112 GLN HG3 1 113 LYS H 3.260 . 4.730 4.314 3.890 4.689 . 0 0 "[ . 1 . 2]" 1
158 1 113 LYS H 1 114 THR H 2.580 . 3.360 2.711 2.537 2.885 . 0 0 "[ . 1 . 2]" 1
159 1 103 ILE HA 1 103 ILE MG 2.570 . 3.350 2.372 2.273 2.439 . 0 0 "[ . 1 . 2]" 1
160 1 112 GLN HA 1 112 GLN HG3 2.810 . 3.810 3.804 3.731 3.843 0.033 14 0 "[ . 1 . 2]" 1
161 1 90 TYR QD 1 91 LEU H 2.990 . 4.180 4.023 3.263 4.266 0.086 6 0 "[ . 1 . 2]" 1
162 1 109 GLN HA 1 109 GLN HG2 2.590 . 3.380 3.184 2.755 3.447 0.067 11 0 "[ . 1 . 2]" 1
163 1 66 ILE H 1 66 ILE HB 2.670 . 3.550 2.592 2.467 2.680 . 0 0 "[ . 1 . 2]" 1
164 1 95 TYR H 1 95 TYR QD 2.940 . 4.090 4.116 3.869 4.181 0.091 19 0 "[ . 1 . 2]" 1
165 1 108 LEU HG 1 112 GLN HE21 3.090 . 4.370 2.139 1.919 2.403 . 0 0 "[ . 1 . 2]" 1
166 1 112 GLN H 1 112 GLN HE21 3.150 . 4.500 4.416 4.173 4.575 0.075 16 0 "[ . 1 . 2]" 1
167 1 97 LEU MD1 1 108 LEU MD1 2.770 . 3.740 3.253 2.822 3.830 0.090 20 0 "[ . 1 . 2]" 1
168 1 109 GLN HG2 1 110 ARG H 3.220 . 4.650 4.478 4.259 4.700 0.050 5 0 "[ . 1 . 2]" 1
169 1 121 LEU H 1 121 LEU HG 2.320 . 2.850 3.201 2.950 3.755 0.905 2 2 "[ + . 1 . -]" 1
170 1 97 LEU H 1 97 LEU HG 3.270 . 4.740 4.412 4.261 4.556 . 0 0 "[ . 1 . 2]" 1
171 1 97 LEU H 1 97 LEU HB2 2.530 . 3.260 2.081 2.062 2.108 . 0 0 "[ . 1 . 2]" 1
172 1 130 LEU H 1 130 LEU HB3 2.330 . 2.870 2.783 2.309 3.012 0.142 4 0 "[ . 1 . 2]" 1
173 1 103 ILE MD 1 103 ILE MG 2.400 . 2.990 1.976 1.835 2.095 . 0 0 "[ . 1 . 2]" 1
174 1 59 LEU H 1 60 ASN H 2.560 . 3.320 2.778 2.689 2.932 . 0 0 "[ . 1 . 2]" 1
175 1 86 LEU MD1 1 117 ARG HB2 3.080 . 4.360 2.127 1.574 3.019 0.226 2 0 "[ . 1 . 2]" 1
176 1 69 PHE H 1 69 PHE HB3 2.570 . 3.340 2.583 2.340 2.900 . 0 0 "[ . 1 . 2]" 1
177 1 120 ARG HA 1 120 ARG HG2 2.570 . 3.350 3.104 2.827 3.438 0.088 20 0 "[ . 1 . 2]" 1
178 1 70 VAL H 1 70 VAL HB 2.500 . 3.200 2.562 2.405 2.672 . 0 0 "[ . 1 . 2]" 1
179 1 121 LEU H 1 121 LEU MD2 3.120 . 4.430 3.739 2.336 4.034 . 0 0 "[ . 1 . 2]" 1
180 1 69 PHE HB3 1 70 VAL H 2.810 . 3.810 2.446 2.185 2.776 . 0 0 "[ . 1 . 2]" 1
181 1 69 PHE H 1 69 PHE QD 3.030 . 4.260 4.173 4.001 4.241 . 0 0 "[ . 1 . 2]" 1
182 1 25 LEU H 1 25 LEU HB2 2.950 . 4.110 2.192 2.111 2.314 . 0 0 "[ . 1 . 2]" 1
183 1 86 LEU H 1 86 LEU HB3 2.550 . 3.290 2.911 2.652 3.143 . 0 0 "[ . 1 . 2]" 1
184 1 97 LEU MD1 1 108 LEU H 3.080 . 4.350 2.331 2.120 2.714 . 0 0 "[ . 1 . 2]" 1
185 1 55 VAL H 1 56 ASN H 2.550 . 3.300 2.768 2.421 2.980 . 0 0 "[ . 1 . 2]" 1
186 1 37 ILE H 1 37 ILE HG12 2.720 . 3.640 2.122 2.017 2.242 . 0 0 "[ . 1 . 2]" 1
187 1 37 ILE H 1 37 ILE HB 2.520 . 3.240 2.620 2.567 2.692 . 0 0 "[ . 1 . 2]" 1
188 1 120 ARG H 1 120 ARG HG2 2.350 . 2.910 1.911 1.669 2.050 0.131 12 0 "[ . 1 . 2]" 1
189 1 113 LYS HB2 1 113 LYS QD 2.400 . 3.000 2.086 1.962 2.515 . 0 0 "[ . 1 . 2]" 1
190 1 75 ILE HB 1 76 LYS H 2.620 . 3.440 2.522 2.263 2.938 . 0 0 "[ . 1 . 2]" 1
191 1 71 MET H 1 73 PHE H 3.320 . 4.840 4.099 3.962 4.222 . 0 0 "[ . 1 . 2]" 1
192 1 66 ILE H 1 66 ILE MD 2.830 . 3.860 3.425 3.290 3.528 . 0 0 "[ . 1 . 2]" 1
193 1 127 ILE HA 1 130 LEU HB3 2.540 . 3.270 2.476 1.829 2.898 . 0 0 "[ . 1 . 2]" 1
194 1 112 GLN H 1 112 GLN HB2 2.590 . 3.380 2.708 2.520 2.885 . 0 0 "[ . 1 . 2]" 1
195 1 104 ASN H 1 104 ASN HD22 3.050 . 4.300 3.574 2.981 3.952 . 0 0 "[ . 1 . 2]" 1
196 1 83 LEU MD1 1 121 LEU HB3 2.670 . 3.550 2.443 1.645 3.947 0.397 18 0 "[ . 1 . 2]" 1
197 1 25 LEU MD2 1 69 PHE QE 2.980 . 4.160 2.512 1.681 3.866 0.119 9 0 "[ . 1 . 2]" 1
198 1 59 LEU HG 1 60 ASN H 3.050 . 4.300 4.315 3.918 4.419 0.119 2 0 "[ . 1 . 2]" 1
199 1 127 ILE HA 1 127 ILE HG12 2.820 . 3.830 3.078 2.548 3.419 . 0 0 "[ . 1 . 2]" 1
200 1 24 GLN H 1 24 GLN HG2 3.160 . 4.510 3.440 2.388 4.200 . 0 0 "[ . 1 . 2]" 1
201 1 127 ILE HA 1 130 LEU MD2 2.660 . 3.510 3.237 2.745 3.567 0.057 12 0 "[ . 1 . 2]" 1
202 1 121 LEU MD1 1 122 PHE H 3.350 . 4.900 3.620 2.891 4.059 . 0 0 "[ . 1 . 2]" 1
203 1 127 ILE H 1 127 ILE HG13 2.800 . 3.790 3.479 3.155 3.717 . 0 0 "[ . 1 . 2]" 1
204 1 108 LEU MD1 1 112 GLN HG3 2.940 . 4.090 3.890 3.347 4.180 0.090 7 0 "[ . 1 . 2]" 1
205 1 130 LEU H 1 131 MET H 2.550 . 3.310 2.751 2.456 2.971 . 0 0 "[ . 1 . 2]" 1
206 1 86 LEU MD1 1 118 LEU H 3.080 . 4.360 2.979 2.196 3.396 . 0 0 "[ . 1 . 2]" 1
207 1 69 PHE H 1 70 VAL HB 3.290 . 4.780 4.843 4.727 4.929 0.149 10 0 "[ . 1 . 2]" 1
208 1 109 GLN HE22 1 109 GLN HG2 2.740 . 3.680 3.415 3.389 3.444 . 0 0 "[ . 1 . 2]" 1
209 1 85 GLU HB2 1 86 LEU H 2.830 . 3.860 3.658 3.084 4.025 0.165 7 0 "[ . 1 . 2]" 1
210 1 79 ASP H 1 80 ASP H 2.400 . 2.990 2.620 2.318 2.754 . 0 0 "[ . 1 . 2]" 1
211 1 109 GLN H 1 109 GLN QB 2.540 . 3.270 2.446 2.295 2.536 . 0 0 "[ . 1 . 2]" 1
212 1 85 GLU H 1 85 GLU HG3 2.810 . 3.820 4.075 3.929 4.280 0.460 5 0 "[ . 1 . 2]" 1
213 1 108 LEU HA 1 108 LEU MD2 2.930 . 4.070 3.912 3.822 3.990 . 0 0 "[ . 1 . 2]" 1
214 1 80 ASP H 1 81 GLY H 2.550 . 3.310 2.633 2.464 2.962 . 0 0 "[ . 1 . 2]" 1
215 1 57 LEU HB2 1 58 GLN H 2.780 . 3.760 2.393 2.286 2.612 . 0 0 "[ . 1 . 2]" 1
216 1 113 LYS HB2 1 114 THR H 2.500 . 3.190 2.483 2.323 2.772 . 0 0 "[ . 1 . 2]" 1
217 1 37 ILE MG 1 38 ALA H 3.040 . 4.290 3.389 3.161 3.564 . 0 0 "[ . 1 . 2]" 1
218 1 24 GLN H 1 24 GLN HE21 3.510 . 5.230 4.860 4.506 5.185 . 0 0 "[ . 1 . 2]" 1
219 1 82 ASP H 1 84 SER H 3.120 . 4.430 4.177 3.851 4.548 0.118 4 0 "[ . 1 . 2]" 1
220 1 62 LEU H 1 62 LEU QB 2.920 . 4.030 2.330 2.136 2.621 . 0 0 "[ . 1 . 2]" 1
221 1 127 ILE H 1 127 ILE HB 2.450 . 3.100 2.736 2.321 3.063 . 0 0 "[ . 1 . 2]" 1
222 1 62 LEU H 1 62 LEU HG 2.740 . 3.680 2.807 2.223 4.005 0.325 6 0 "[ . 1 . 2]" 1
223 1 96 THR H 1 97 LEU H 2.700 . 3.610 2.901 2.775 3.094 . 0 0 "[ . 1 . 2]" 1
224 1 57 LEU H 1 58 GLN QG 3.330 . 4.850 4.742 4.010 5.187 0.337 8 0 "[ . 1 . 2]" 1
225 1 64 GLU H 1 65 HIS H 2.650 . 3.490 2.642 2.499 2.852 . 0 0 "[ . 1 . 2]" 1
226 1 57 LEU HB3 1 58 GLN H 3.080 . 4.350 3.467 3.252 3.717 . 0 0 "[ . 1 . 2]" 1
227 1 86 LEU MD2 1 117 ARG HD2 2.940 . 4.090 3.956 2.211 4.179 0.089 6 0 "[ . 1 . 2]" 1
228 1 132 LYS HB3 1 133 THR H 2.530 . 3.260 2.313 1.785 3.083 0.015 17 0 "[ . 1 . 2]" 1
229 1 95 TYR HB2 1 96 THR H 2.860 . 3.920 3.849 3.663 3.984 0.064 1 0 "[ . 1 . 2]" 1
230 1 76 LYS H 1 77 TYR H 2.540 . 3.270 2.597 2.191 2.879 . 0 0 "[ . 1 . 2]" 1
231 1 66 ILE H 1 66 ILE MG 2.810 . 3.810 3.779 3.756 3.795 . 0 0 "[ . 1 . 2]" 1
232 1 127 ILE HG12 1 127 ILE MG 2.560 . 3.320 3.181 3.142 3.199 . 0 0 "[ . 1 . 2]" 1
233 1 55 VAL HB 1 56 ASN H 2.930 . 4.060 3.048 2.605 4.079 0.019 10 0 "[ . 1 . 2]" 1
234 1 119 PHE H 1 121 LEU H 2.950 . 4.100 4.227 4.126 4.293 0.193 4 0 "[ . 1 . 2]" 1
235 1 113 LYS HB2 1 113 LYS HG2 2.390 . 2.980 2.935 2.351 2.996 0.016 5 0 "[ . 1 . 2]" 1
236 1 120 ARG HD2 1 120 ARG HG2 2.300 . 2.800 2.503 2.237 2.806 0.006 13 0 "[ . 1 . 2]" 1
237 1 127 ILE MG 1 128 SER H 3.170 . 4.530 3.411 2.975 3.764 . 0 0 "[ . 1 . 2]" 1
238 1 108 LEU MD1 1 112 GLN HE22 3.090 . 4.380 3.493 2.712 4.128 . 0 0 "[ . 1 . 2]" 1
239 1 37 ILE H 1 37 ILE HG13 2.800 . 3.800 3.580 3.419 3.736 . 0 0 "[ . 1 . 2]" 1
240 1 97 LEU MD1 1 108 LEU HA 2.820 . 3.840 2.535 2.116 3.212 . 0 0 "[ . 1 . 2]" 1
241 1 69 PHE QD 1 70 VAL H 3.070 . 4.330 3.703 3.282 4.209 . 0 0 "[ . 1 . 2]" 1
242 1 57 LEU H 1 57 LEU HB2 2.380 . 2.950 2.554 2.341 2.825 . 0 0 "[ . 1 . 2]" 1
243 1 96 THR MG 1 97 LEU H 2.920 . 4.040 3.617 3.155 3.916 . 0 0 "[ . 1 . 2]" 1
244 1 127 ILE HA 1 127 ILE MG 2.460 . 3.130 2.348 2.098 2.709 . 0 0 "[ . 1 . 2]" 1
245 1 83 LEU HB2 1 83 LEU MD1 2.980 . 4.170 2.437 2.145 2.741 . 0 0 "[ . 1 . 2]" 1
246 1 74 LYS H 1 75 ILE H 2.690 . 3.590 2.783 2.609 2.859 . 0 0 "[ . 1 . 2]" 1
247 1 55 VAL MG2 1 56 ASN H 2.910 . 4.020 2.522 2.080 3.461 . 0 0 "[ . 1 . 2]" 1
248 1 35 GLU H 1 59 LEU QD 3.230 . 4.660 3.904 3.408 4.338 . 0 0 "[ . 1 . 2]" 1
249 1 98 PHE H 1 98 PHE QD 2.650 . 3.490 2.817 2.408 3.182 . 0 0 "[ . 1 . 2]" 1
250 1 67 ALA H 1 69 PHE H 3.180 . 4.560 4.102 3.920 4.364 . 0 0 "[ . 1 . 2]" 1
251 1 104 ASN H 1 104 ASN HD21 3.160 . 4.510 2.739 2.108 3.913 . 0 0 "[ . 1 . 2]" 1
252 1 76 LYS H 1 76 LYS HB3 2.600 . 3.400 3.256 2.663 3.575 0.175 8 0 "[ . 1 . 2]" 1
253 1 130 LEU HB2 1 131 MET H 2.870 . 3.940 3.570 3.112 3.946 0.006 9 0 "[ . 1 . 2]" 1
254 1 57 LEU H 1 57 LEU HB3 2.760 . 3.710 3.605 3.574 3.633 . 0 0 "[ . 1 . 2]" 1
255 1 96 THR H 1 96 THR MG 2.800 . 3.800 3.724 3.646 3.778 . 0 0 "[ . 1 . 2]" 1
256 1 103 ILE HB 1 103 ILE MD 2.570 . 3.350 3.237 3.229 3.244 . 0 0 "[ . 1 . 2]" 1
257 1 113 LYS HB3 1 114 THR H 2.700 . 3.610 3.570 3.213 3.695 0.085 14 0 "[ . 1 . 2]" 1
258 1 120 ARG HA 1 120 ARG HB3 2.350 . 2.910 2.373 2.221 2.433 . 0 0 "[ . 1 . 2]" 1
259 1 25 LEU H 1 25 LEU MD2 3.100 . 4.400 3.756 3.206 4.269 . 0 0 "[ . 1 . 2]" 1
260 1 98 PHE H 1 98 PHE HB3 2.700 . 3.600 3.602 3.580 3.616 0.016 17 0 "[ . 1 . 2]" 1
261 1 98 PHE H 1 98 PHE HB2 2.670 . 3.550 2.459 2.374 2.535 . 0 0 "[ . 1 . 2]" 1
262 1 58 GLN HE22 1 58 GLN QG 2.540 . 3.270 3.283 3.215 3.349 0.079 7 0 "[ . 1 . 2]" 1
263 1 71 MET HA 1 71 MET ME 2.770 . 3.740 3.816 3.468 4.050 0.310 14 0 "[ . 1 . 2]" 1
264 1 121 LEU HB2 1 122 PHE H 2.870 . 3.940 2.810 2.141 4.092 0.152 9 0 "[ . 1 . 2]" 1
265 1 103 ILE HA 1 103 ILE HG13 2.700 . 3.610 3.705 3.653 3.766 0.156 13 0 "[ . 1 . 2]" 1
266 1 103 ILE HA 1 103 ILE HG12 2.850 . 3.900 3.164 3.022 3.352 . 0 0 "[ . 1 . 2]" 1
267 1 83 LEU HB3 1 83 LEU MD1 2.700 . 3.600 3.177 3.117 3.224 . 0 0 "[ . 1 . 2]" 1
268 1 70 VAL MG2 1 73 PHE H 3.330 . 4.860 4.937 4.855 4.987 0.127 11 0 "[ . 1 . 2]" 1
269 1 89 GLU H 1 90 TYR H 2.890 . 3.970 2.839 2.741 3.068 . 0 0 "[ . 1 . 2]" 1
270 1 22 VAL H 1 22 VAL MG1 3.180 . 4.560 3.772 3.741 3.789 . 0 0 "[ . 1 . 2]" 1
271 1 121 LEU MD1 1 126 TYR QE 2.850 . 3.890 3.284 1.996 4.017 0.127 15 0 "[ . 1 . 2]" 1
272 1 95 TYR HB3 1 96 THR H 3.000 . 4.210 2.478 2.227 2.822 . 0 0 "[ . 1 . 2]" 1
273 1 113 LYS QD 1 113 LYS HG2 2.100 . 2.400 2.321 2.136 2.528 0.128 4 0 "[ . 1 . 2]" 1
274 1 70 VAL H 1 71 MET H 2.660 . 3.520 2.871 2.786 2.959 . 0 0 "[ . 1 . 2]" 1
275 1 56 ASN H 1 56 ASN HB3 2.970 . 4.140 3.153 2.730 3.649 . 0 0 "[ . 1 . 2]" 1
276 1 22 VAL H 1 22 VAL HB 2.540 . 3.270 2.691 2.364 2.910 . 0 0 "[ . 1 . 2]" 1
277 1 71 MET QB 1 72 SER H 2.450 . 3.100 2.480 2.399 2.642 . 0 0 "[ . 1 . 2]" 1
278 1 84 SER H 1 86 LEU H 3.130 . 4.460 4.162 3.926 4.352 . 0 0 "[ . 1 . 2]" 1
279 1 112 GLN HB2 1 113 LYS H 2.670 . 3.540 2.494 2.306 2.683 . 0 0 "[ . 1 . 2]" 1
280 1 67 ALA H 1 91 LEU MD1 2.570 . 3.340 2.519 2.086 3.170 . 0 0 "[ . 1 . 2]" 1
281 1 108 LEU MD2 1 109 GLN HE22 3.120 . 4.430 2.906 2.202 4.415 . 0 0 "[ . 1 . 2]" 1
282 1 82 ASP H 1 83 LEU H 2.400 . 3.000 2.645 2.394 2.856 . 0 0 "[ . 1 . 2]" 1
283 1 113 LYS HB2 1 113 LYS HG3 2.390 . 2.970 2.627 2.523 2.992 0.022 15 0 "[ . 1 . 2]" 1
284 1 86 LEU MD1 1 118 LEU MD2 2.970 . 4.150 3.495 1.970 4.170 0.020 7 0 "[ . 1 . 2]" 1
285 1 25 LEU HB2 1 25 LEU MD1 2.690 . 3.580 2.941 2.463 3.202 . 0 0 "[ . 1 . 2]" 1
286 1 115 LYS H 1 116 GLU H 2.700 . 3.600 2.826 2.720 2.974 . 0 0 "[ . 1 . 2]" 1
287 1 127 ILE MD 1 127 ILE MG 2.100 . 2.400 1.968 1.786 2.261 0.014 9 0 "[ . 1 . 2]" 1
288 1 22 VAL MG1 1 131 MET ME 2.560 . 3.330 2.173 1.698 2.840 0.102 12 0 "[ . 1 . 2]" 1
289 1 113 LYS HA 1 113 LYS HG2 2.580 . 3.360 2.891 2.613 3.583 0.223 15 0 "[ . 1 . 2]" 1
290 1 58 GLN HB2 1 58 GLN QG 2.300 . 2.800 2.284 2.150 2.467 . 0 0 "[ . 1 . 2]" 1
291 1 40 LEU H 1 40 LEU HG 2.530 . 3.260 2.292 1.978 2.665 . 0 0 "[ . 1 . 2]" 1
292 1 28 LEU H 1 29 CYS H 2.870 . 3.940 2.785 2.719 2.836 . 0 0 "[ . 1 . 2]" 1
293 1 97 LEU MD1 1 108 LEU MD2 3.030 . 4.270 4.076 3.720 4.341 0.071 3 0 "[ . 1 . 2]" 1
294 1 127 ILE HA 1 127 ILE MD 2.440 . 3.080 2.163 1.812 2.508 . 0 0 "[ . 1 . 2]" 1
295 1 86 LEU MD1 1 89 GLU H 3.040 . 4.280 4.191 3.883 4.351 0.071 20 0 "[ . 1 . 2]" 1
296 1 70 VAL H 1 72 SER H 3.150 . 4.500 4.448 4.152 4.579 0.079 5 0 "[ . 1 . 2]" 1
297 1 127 ILE H 1 128 SER H 2.810 . 3.820 3.050 2.805 3.314 . 0 0 "[ . 1 . 2]" 1
298 1 108 LEU QB 1 108 LEU MD2 2.500 . 3.190 2.081 2.057 2.099 . 0 0 "[ . 1 . 2]" 1
299 1 24 GLN H 1 24 GLN HG3 2.430 . 3.070 2.889 2.425 3.170 0.100 5 0 "[ . 1 . 2]" 1
300 1 108 LEU MD1 1 112 GLN H 3.380 . 4.960 3.911 3.427 4.206 . 0 0 "[ . 1 . 2]" 1
301 1 83 LEU HB2 1 83 LEU MD2 2.690 . 3.590 2.404 2.186 2.674 . 0 0 "[ . 1 . 2]" 1
302 1 132 LYS HA 1 132 LYS HB2 2.170 . 2.550 2.687 2.352 2.923 0.373 19 0 "[ . 1 . 2]" 1
303 1 91 LEU HB3 1 92 ASP H 3.010 . 4.220 3.467 2.985 3.911 . 0 0 "[ . 1 . 2]" 1
304 1 101 TYR H 1 102 GLY H 2.710 . 3.620 2.992 2.146 3.974 0.354 17 0 "[ . 1 . 2]" 1
305 1 90 TYR QB 1 91 LEU H 3.010 . 4.220 2.429 2.191 3.602 . 0 0 "[ . 1 . 2]" 1
306 1 127 ILE MG 1 131 MET HG2 2.680 . 3.560 2.157 1.661 2.790 0.139 9 0 "[ . 1 . 2]" 1
307 1 108 LEU H 1 108 LEU QB 2.570 . 3.350 2.261 2.194 2.301 . 0 0 "[ . 1 . 2]" 1
308 1 75 ILE H 1 76 LYS HA 3.430 . 5.050 5.169 5.099 5.230 0.180 16 0 "[ . 1 . 2]" 1
309 1 117 ARG HB2 1 117 ARG HD3 2.670 . 3.540 2.432 2.058 3.556 0.016 11 0 "[ . 1 . 2]" 1
310 1 63 ILE H 1 64 GLU H 2.800 . 3.800 3.038 2.843 3.173 . 0 0 "[ . 1 . 2]" 1
311 1 71 MET H 1 71 MET QB 2.310 . 2.820 2.163 2.087 2.333 . 0 0 "[ . 1 . 2]" 1
312 1 109 GLN HE22 1 109 GLN HG3 2.710 . 3.620 3.860 3.794 3.948 0.328 14 0 "[ . 1 . 2]" 1
313 1 132 LYS H 1 132 LYS HB3 2.550 . 3.310 3.021 2.264 3.645 0.335 11 0 "[ . 1 . 2]" 1
314 1 66 ILE H 1 66 ILE QG 2.790 . 3.780 2.080 1.952 2.340 . 0 0 "[ . 1 . 2]" 1
315 1 98 PHE HB3 1 99 SER H 2.930 . 4.050 4.054 3.936 4.136 0.086 15 0 "[ . 1 . 2]" 1
316 1 107 GLU H 1 108 LEU H 2.720 . 3.650 2.757 2.574 2.967 . 0 0 "[ . 1 . 2]" 1
317 1 32 LEU H 1 32 LEU MD2 3.210 . 4.630 4.264 4.146 4.392 . 0 0 "[ . 1 . 2]" 1
318 1 121 LEU HB2 1 121 LEU MD1 2.410 . 3.020 2.275 2.046 3.076 0.056 20 0 "[ . 1 . 2]" 1
319 1 65 HIS HB2 1 66 ILE H 2.970 . 4.150 3.641 3.335 4.225 0.075 3 0 "[ . 1 . 2]" 1
320 1 71 MET ME 1 71 MET HG2 2.610 . 3.420 3.337 2.879 3.417 . 0 0 "[ . 1 . 2]" 1
321 1 115 LYS H 1 115 LYS QG 2.610 . 3.420 2.117 1.839 2.505 . 0 0 "[ . 1 . 2]" 1
322 1 126 TYR HA 1 126 TYR QD 2.660 . 3.520 3.269 2.953 3.593 0.073 12 0 "[ . 1 . 2]" 1
323 1 108 LEU HG 1 109 GLN HE21 3.650 . 5.500 3.454 2.523 3.903 . 0 0 "[ . 1 . 2]" 1
324 1 78 PRO HD3 1 79 ASP H 3.020 . 4.250 3.814 3.450 4.157 . 0 0 "[ . 1 . 2]" 1
325 1 119 PHE H 1 120 ARG H 2.640 . 3.470 2.615 2.553 2.740 . 0 0 "[ . 1 . 2]" 1
326 1 103 ILE HG13 1 103 ILE MG 2.790 . 3.770 2.308 2.230 2.365 . 0 0 "[ . 1 . 2]" 1
327 1 83 LEU HB3 1 83 LEU MD2 2.710 . 3.630 2.365 2.114 2.648 . 0 0 "[ . 1 . 2]" 1
328 1 103 ILE HG12 1 103 ILE MG 2.840 . 3.870 3.184 3.165 3.193 . 0 0 "[ . 1 . 2]" 1
329 1 132 LYS HB2 1 132 LYS QD 2.350 . 2.910 2.437 1.995 3.129 0.219 1 0 "[ . 1 . 2]" 1
330 1 37 ILE HB 1 38 ALA H 2.800 . 3.800 2.619 2.369 2.828 . 0 0 "[ . 1 . 2]" 1
331 1 67 ALA HA 1 70 VAL MG2 2.590 . 3.390 2.896 2.377 3.216 . 0 0 "[ . 1 . 2]" 1
332 1 131 MET H 1 131 MET HB3 2.550 . 3.310 3.195 2.857 3.542 0.232 11 0 "[ . 1 . 2]" 1
333 1 64 GLU HA 1 64 GLU HG2 2.510 . 3.220 2.207 1.993 2.894 . 0 0 "[ . 1 . 2]" 1
334 1 33 TYR H 1 34 ASP H 2.710 . 3.620 2.790 2.571 2.983 . 0 0 "[ . 1 . 2]" 1
335 1 127 ILE HB 1 128 SER H 2.880 . 3.960 2.539 2.212 3.035 . 0 0 "[ . 1 . 2]" 1
336 1 127 ILE HA 1 127 ILE HG13 2.920 . 4.030 3.785 3.612 3.911 . 0 0 "[ . 1 . 2]" 1
337 1 97 LEU HA 1 97 LEU MD1 2.610 . 3.420 1.796 1.708 1.994 0.092 4 0 "[ . 1 . 2]" 1
338 1 40 LEU H 1 40 LEU HB2 2.720 . 3.640 2.556 2.387 2.808 . 0 0 "[ . 1 . 2]" 1
339 1 35 GLU QB 1 59 LEU QD 2.540 . 3.280 1.767 1.689 1.995 0.111 4 0 "[ . 1 . 2]" 1
340 1 110 ARG H 1 110 ARG QB 2.330 . 2.860 2.227 2.014 2.668 . 0 0 "[ . 1 . 2]" 1
341 1 25 LEU H 1 25 LEU HG 3.310 . 4.820 4.659 4.460 4.735 . 0 0 "[ . 1 . 2]" 1
342 1 30 GLU H 1 30 GLU HG2 2.500 . 3.190 3.128 2.747 3.307 0.117 14 0 "[ . 1 . 2]" 1
343 1 91 LEU HA 1 91 LEU MD2 2.490 . 3.180 2.097 1.745 2.520 0.055 9 0 "[ . 1 . 2]" 1
344 1 114 THR H 1 115 LYS QG 3.030 . 4.270 4.155 3.746 4.369 0.099 12 0 "[ . 1 . 2]" 1
345 1 121 LEU HA 1 121 LEU MD1 2.410 . 3.020 3.001 2.249 3.237 0.217 15 0 "[ . 1 . 2]" 1
346 1 85 GLU H 1 85 GLU QB 2.430 . 3.060 2.048 1.884 2.144 . 0 0 "[ . 1 . 2]" 1
347 1 119 PHE H 1 120 ARG HG2 2.820 . 3.840 3.959 3.796 4.089 0.249 18 0 "[ . 1 . 2]" 1
348 1 58 GLN HB2 1 58 GLN HE22 3.030 . 4.260 3.579 3.185 4.089 . 0 0 "[ . 1 . 2]" 1
349 1 64 GLU H 1 67 ALA MB 3.270 . 4.750 4.216 4.024 4.387 . 0 0 "[ . 1 . 2]" 1
350 1 60 ASN H 1 60 ASN HD21 3.080 . 4.360 2.755 2.289 3.446 . 0 0 "[ . 1 . 2]" 1
351 1 72 SER HA 1 75 ILE MD 2.750 . 3.690 2.280 1.681 3.678 0.119 2 0 "[ . 1 . 2]" 1
352 1 127 ILE HG13 1 127 ILE MG 2.620 . 3.430 2.375 2.183 2.667 . 0 0 "[ . 1 . 2]" 1
353 1 75 ILE H 1 75 ILE MD 2.790 . 3.770 3.619 2.456 3.824 0.054 20 0 "[ . 1 . 2]" 1
354 1 117 ARG H 1 118 LEU H 2.710 . 3.630 2.940 2.872 3.066 . 0 0 "[ . 1 . 2]" 1
355 1 112 GLN HE21 1 112 GLN HG2 2.630 . 3.450 2.477 2.159 2.720 . 0 0 "[ . 1 . 2]" 1
356 1 121 LEU HB3 1 122 PHE H 2.730 . 3.660 3.357 3.157 3.625 . 0 0 "[ . 1 . 2]" 1
357 1 58 GLN HB3 1 58 GLN QG 2.300 . 2.810 2.383 2.160 2.523 . 0 0 "[ . 1 . 2]" 1
358 1 86 LEU MD1 1 117 ARG H 3.500 . 5.210 4.113 3.770 4.579 . 0 0 "[ . 1 . 2]" 1
359 1 25 LEU MD1 1 69 PHE QE 2.940 . 4.080 3.121 2.086 4.108 0.028 6 0 "[ . 1 . 2]" 1
360 1 86 LEU MD1 1 117 ARG HB3 2.980 . 4.160 2.770 1.851 3.548 . 0 0 "[ . 1 . 2]" 1
361 1 78 PRO HD2 1 79 ASP H 2.870 . 3.940 2.559 1.914 3.190 . 0 0 "[ . 1 . 2]" 1
362 1 65 HIS HB3 1 66 ILE H 2.870 . 3.930 2.432 2.222 3.386 . 0 0 "[ . 1 . 2]" 1
363 1 25 LEU HA 1 25 LEU MD1 2.550 . 3.310 1.907 1.795 2.187 0.005 4 0 "[ . 1 . 2]" 1
364 1 103 ILE HA 1 104 ASN HD22 3.400 . 4.990 4.539 4.239 5.015 0.025 14 0 "[ . 1 . 2]" 1
365 1 32 LEU H 1 32 LEU HB3 2.690 . 3.580 2.615 2.467 2.825 . 0 0 "[ . 1 . 2]" 1
366 1 61 ASP H 1 62 LEU H 2.620 . 3.430 2.759 2.579 2.897 . 0 0 "[ . 1 . 2]" 1
367 1 25 LEU H 1 25 LEU HB3 2.890 . 3.970 2.984 2.780 3.187 . 0 0 "[ . 1 . 2]" 1
368 1 103 ILE HA 1 104 ASN HD21 3.400 . 5.000 4.177 3.316 5.056 0.056 15 0 "[ . 1 . 2]" 1
369 1 24 GLN HB3 1 24 GLN HE21 2.950 . 4.110 2.363 1.791 3.146 0.009 9 0 "[ . 1 . 2]" 1
370 1 40 LEU H 1 40 LEU HB3 2.670 . 3.540 3.608 3.577 3.631 0.091 20 0 "[ . 1 . 2]" 1
371 1 40 LEU H 1 40 LEU MD2 3.220 . 4.640 3.695 3.563 4.002 . 0 0 "[ . 1 . 2]" 1
372 1 40 LEU H 1 40 LEU MD1 3.420 . 5.040 3.198 2.914 3.461 . 0 0 "[ . 1 . 2]" 1
373 1 132 LYS H 1 132 LYS HB2 2.700 . 3.610 2.307 2.076 2.818 . 0 0 "[ . 1 . 2]" 1
374 1 32 LEU H 1 32 LEU HB2 2.620 . 3.440 2.509 2.311 2.669 . 0 0 "[ . 1 . 2]" 1
375 1 67 ALA MB 1 69 PHE H 3.400 . 4.990 4.377 4.225 4.516 . 0 0 "[ . 1 . 2]" 1
376 1 127 ILE MG 1 131 MET ME 2.620 . 3.430 2.289 1.771 3.042 0.029 4 0 "[ . 1 . 2]" 1
377 1 86 LEU MD1 1 117 ARG HD3 3.060 . 4.310 2.615 1.882 3.878 . 0 0 "[ . 1 . 2]" 1
378 1 119 PHE H 1 119 PHE QB 2.430 . 3.050 2.292 2.206 2.465 . 0 0 "[ . 1 . 2]" 1
379 1 117 ARG HB2 1 118 LEU H 2.920 . 4.040 2.476 2.136 2.915 . 0 0 "[ . 1 . 2]" 1
380 1 83 LEU HA 1 83 LEU MD1 2.580 . 3.360 2.114 1.830 2.559 . 0 0 "[ . 1 . 2]" 1
381 1 74 LYS HA 1 75 ILE H 2.630 . 3.450 3.491 3.446 3.529 0.079 5 0 "[ . 1 . 2]" 1
382 1 83 LEU MD1 1 121 LEU HG 3.000 . 4.210 3.172 1.881 3.940 . 0 0 "[ . 1 . 2]" 1
383 1 37 ILE H 1 37 ILE MD 3.120 . 4.440 3.307 3.132 3.537 . 0 0 "[ . 1 . 2]" 1
384 1 30 GLU H 1 30 GLU HB3 2.800 . 3.790 3.518 2.270 3.638 . 0 0 "[ . 1 . 2]" 1
385 1 95 TYR QB 1 96 THR H 2.610 . 3.420 2.449 2.209 2.767 . 0 0 "[ . 1 . 2]" 1
386 1 112 GLN HE21 1 112 GLN HG3 2.600 . 3.410 2.545 2.286 2.941 . 0 0 "[ . 1 . 2]" 1
387 1 109 GLN HE21 1 109 GLN QG 2.820 . 3.830 2.074 2.037 2.112 . 0 0 "[ . 1 . 2]" 1
388 1 127 ILE HB 1 127 ILE MD 2.520 . 3.230 3.226 3.165 3.241 0.011 9 0 "[ . 1 . 2]" 1
389 1 71 MET HB2 1 71 MET ME 2.550 . 3.300 2.211 1.700 2.962 0.100 18 0 "[ . 1 . 2]" 1
390 1 130 LEU MD2 1 131 MET H 3.420 . 5.040 3.908 2.941 4.838 . 0 0 "[ . 1 . 2]" 1
391 1 74 LYS H 1 74 LYS HG3 2.760 . 3.720 2.568 1.705 3.584 0.095 7 0 "[ . 1 . 2]" 1
392 1 110 ARG HA 1 110 ARG QB 2.380 . 2.950 2.460 2.292 2.558 . 0 0 "[ . 1 . 2]" 1
393 1 29 CYS H 1 30 GLU H 2.500 . 3.190 2.793 2.691 2.876 . 0 0 "[ . 1 . 2]" 1
394 1 86 LEU MD2 1 118 LEU H 3.010 . 4.230 3.255 2.440 3.927 . 0 0 "[ . 1 . 2]" 1
395 1 121 LEU HA 1 121 LEU HB3 2.380 . 2.960 2.551 2.378 2.734 . 0 0 "[ . 1 . 2]" 1
396 1 86 LEU HB2 1 86 LEU MD2 2.470 . 3.140 2.056 1.900 2.220 . 0 0 "[ . 1 . 2]" 1
397 1 86 LEU HB3 1 86 LEU MD2 2.800 . 3.800 2.891 2.454 3.139 . 0 0 "[ . 1 . 2]" 1
398 1 86 LEU HA 1 86 LEU MD2 2.820 . 3.830 3.108 2.462 3.657 . 0 0 "[ . 1 . 2]" 1
399 1 132 LYS HB3 1 132 LYS QD 2.430 . 3.050 2.378 1.899 3.134 0.084 9 0 "[ . 1 . 2]" 1
400 1 91 LEU HA 1 91 LEU MD1 2.890 . 3.980 3.859 3.764 3.990 0.010 19 0 "[ . 1 . 2]" 1
401 1 75 ILE HA 1 75 ILE HG12 2.620 . 3.440 2.676 2.499 3.441 0.001 16 0 "[ . 1 . 2]" 1
402 1 125 GLU H 1 125 GLU QB 2.680 . 3.570 2.537 2.228 2.988 . 0 0 "[ . 1 . 2]" 1
403 1 58 GLN HB3 1 58 GLN HE22 2.980 . 4.170 3.654 3.210 4.465 0.295 18 0 "[ . 1 . 2]" 1
404 1 37 ILE HG12 1 37 ILE MG 2.600 . 3.410 3.193 3.188 3.202 . 0 0 "[ . 1 . 2]" 1
405 1 116 GLU HG2 1 117 ARG H 3.250 . 4.710 3.911 2.833 4.471 . 0 0 "[ . 1 . 2]" 1
406 1 97 LEU HA 1 97 LEU MD2 2.880 . 3.950 3.292 2.877 3.780 . 0 0 "[ . 1 . 2]" 1
407 1 103 ILE MG 1 104 ASN HD22 3.650 . 5.500 5.475 4.882 5.619 0.119 5 0 "[ . 1 . 2]" 1
408 1 85 GLU HA 1 87 VAL H 3.290 . 4.790 4.666 4.250 4.855 0.065 20 0 "[ . 1 . 2]" 1
409 1 113 LYS HB2 1 113 LYS QE 2.670 . 3.530 3.576 3.338 3.742 0.212 8 0 "[ . 1 . 2]" 1
410 1 127 ILE MG 1 131 MET HG3 2.770 . 3.740 2.959 2.003 3.687 . 0 0 "[ . 1 . 2]" 1
411 1 88 GLU H 1 88 GLU HB2 2.420 . 3.030 2.584 2.386 2.861 . 0 0 "[ . 1 . 2]" 1
412 1 32 LEU MD2 1 33 TYR H 3.100 . 4.400 3.569 2.885 4.412 0.012 9 0 "[ . 1 . 2]" 1
413 1 86 LEU MD2 1 118 LEU HA 2.610 . 3.420 2.885 2.127 3.497 0.077 2 0 "[ . 1 . 2]" 1
414 1 66 ILE H 1 67 ALA H 2.690 . 3.590 2.633 2.460 2.781 . 0 0 "[ . 1 . 2]" 1
415 1 72 SER H 1 72 SER HB3 2.550 . 3.310 3.271 2.105 3.542 0.232 1 0 "[ . 1 . 2]" 1
416 1 117 ARG HB3 1 117 ARG HD3 2.370 . 2.940 2.850 2.202 3.214 0.274 15 0 "[ . 1 . 2]" 1
417 1 84 SER QB 1 85 GLU H 2.640 . 3.480 2.617 2.263 3.175 . 0 0 "[ . 1 . 2]" 1
418 1 74 LYS HA 1 74 LYS HG3 2.960 . 4.120 3.739 2.883 4.193 0.073 9 0 "[ . 1 . 2]" 1
419 1 86 LEU MD1 1 118 LEU HA 2.920 . 4.030 3.784 2.980 4.114 0.084 13 0 "[ . 1 . 2]" 1
420 1 104 ASN HA 1 104 ASN HD22 3.370 . 4.940 4.659 4.299 5.049 0.109 14 0 "[ . 1 . 2]" 1
421 1 127 ILE HA 1 130 LEU H 3.000 . 4.210 3.276 2.992 3.482 . 0 0 "[ . 1 . 2]" 1
422 1 67 ALA HA 1 70 VAL HB 2.810 . 3.810 2.718 2.414 2.970 . 0 0 "[ . 1 . 2]" 1
423 1 132 LYS H 1 132 LYS HG3 3.000 . 4.200 4.102 3.275 4.342 0.142 10 0 "[ . 1 . 2]" 1
424 1 60 ASN H 1 60 ASN QB 2.400 . 3.000 2.223 2.129 2.401 . 0 0 "[ . 1 . 2]" 1
425 1 130 LEU HB3 1 131 MET H 2.720 . 3.640 2.486 2.155 3.158 . 0 0 "[ . 1 . 2]" 1
426 1 118 LEU MD1 1 119 PHE H 3.320 . 4.840 4.461 4.242 4.796 . 0 0 "[ . 1 . 2]" 1
427 1 130 LEU HA 1 130 LEU HB2 2.300 . 2.810 2.603 2.372 2.790 . 0 0 "[ . 1 . 2]" 1
428 1 74 LYS H 1 74 LYS QB 2.630 . 3.450 2.860 2.574 3.043 . 0 0 "[ . 1 . 2]" 1
429 1 108 LEU HA 1 108 LEU MD1 2.620 . 3.430 2.232 2.049 2.494 . 0 0 "[ . 1 . 2]" 1
430 1 62 LEU H 1 62 LEU MD2 2.890 . 3.980 3.861 3.275 4.177 0.197 3 0 "[ . 1 . 2]" 1
431 1 83 LEU HA 1 83 LEU MD2 3.000 . 4.200 3.785 3.595 3.904 . 0 0 "[ . 1 . 2]" 1
432 1 104 ASN HA 1 104 ASN HD21 3.240 . 4.680 3.989 3.048 4.513 . 0 0 "[ . 1 . 2]" 1
433 1 114 THR H 1 114 THR MG 2.890 . 3.980 3.717 3.598 3.774 . 0 0 "[ . 1 . 2]" 1
434 1 71 MET ME 1 71 MET HG3 2.670 . 3.540 2.442 2.111 3.350 . 0 0 "[ . 1 . 2]" 1
435 1 68 SER HA 1 71 MET ME 2.660 . 3.520 1.895 1.721 2.177 0.079 6 0 "[ . 1 . 2]" 1
436 1 35 GLU H 1 35 GLU QB 2.430 . 3.050 2.761 2.478 3.049 . 0 0 "[ . 1 . 2]" 1
437 1 64 GLU HG2 1 65 HIS H 3.240 . 4.680 4.801 4.700 4.882 0.202 20 0 "[ . 1 . 2]" 1
438 1 35 GLU H 1 35 GLU HG3 2.910 . 4.020 3.166 2.410 3.647 . 0 0 "[ . 1 . 2]" 1
439 1 35 GLU H 1 35 GLU HG2 2.880 . 3.950 1.904 1.717 2.305 0.083 3 0 "[ . 1 . 2]" 1
440 1 35 GLU H 1 36 GLY H 2.660 . 3.510 2.780 2.566 2.929 . 0 0 "[ . 1 . 2]" 1
441 1 22 VAL HB 1 23 ALA H 2.940 . 4.080 2.416 2.141 2.773 . 0 0 "[ . 1 . 2]" 1
442 1 83 LEU MD1 1 122 PHE QE 2.880 . 3.950 2.709 2.191 3.234 . 0 0 "[ . 1 . 2]" 1
443 1 80 ASP HA 1 81 GLY H 2.520 . 3.240 3.154 2.825 3.339 0.099 18 0 "[ . 1 . 2]" 1
444 1 111 TRP H 1 112 GLN HG3 3.390 . 4.970 5.073 4.580 5.294 0.324 1 0 "[ . 1 . 2]" 1
445 1 25 LEU HB3 1 25 LEU MD1 2.640 . 3.480 2.908 2.437 3.215 . 0 0 "[ . 1 . 2]" 1
446 1 113 LYS HB3 1 113 LYS QE 2.930 . 4.070 3.830 2.932 4.241 0.171 19 0 "[ . 1 . 2]" 1
447 1 72 SER H 1 73 PHE H 2.530 . 3.250 2.672 2.506 2.768 . 0 0 "[ . 1 . 2]" 1
448 1 63 ILE MG 1 64 GLU H 2.720 . 3.640 3.038 2.844 3.225 . 0 0 "[ . 1 . 2]" 1
449 1 65 HIS H 1 65 HIS HB3 2.500 . 3.200 2.741 2.038 2.973 . 0 0 "[ . 1 . 2]" 1
450 1 113 LYS HA 1 113 LYS HG3 2.590 . 3.390 2.842 2.507 3.018 . 0 0 "[ . 1 . 2]" 1
451 1 15 TYR H 1 16 SER H 2.660 . 3.520 2.668 1.996 3.464 . 0 0 "[ . 1 . 2]" 1
452 1 127 ILE HA 1 130 LEU HB2 2.700 . 3.610 2.649 2.051 3.691 0.081 9 0 "[ . 1 . 2]" 1
453 1 71 MET H 1 71 MET QG 2.840 . 3.880 3.272 2.829 3.939 0.059 14 0 "[ . 1 . 2]" 1
454 1 101 TYR H 1 101 TYR QD 2.970 . 4.150 3.060 2.049 3.946 . 0 0 "[ . 1 . 2]" 1
455 1 24 GLN HB3 1 25 LEU H 3.170 . 4.550 3.302 2.962 3.952 . 0 0 "[ . 1 . 2]" 1
456 1 66 ILE MG 1 67 ALA H 2.680 . 3.560 3.495 3.282 3.580 0.020 6 0 "[ . 1 . 2]" 1
457 1 113 LYS QE 1 113 LYS HG2 2.530 . 3.250 2.723 1.922 3.525 0.275 15 0 "[ . 1 . 2]" 1
458 1 112 GLN HB3 1 112 GLN HE21 2.960 . 4.120 4.191 4.070 4.263 0.143 13 0 "[ . 1 . 2]" 1
459 1 126 TYR H 1 126 TYR QD 3.110 . 4.410 2.463 1.923 2.835 . 0 0 "[ . 1 . 2]" 1
460 1 37 ILE HA 1 37 ILE MG 2.540 . 3.270 2.449 2.405 2.480 . 0 0 "[ . 1 . 2]" 1
461 1 101 TYR QD 1 102 GLY H 3.420 . 5.030 4.398 3.782 4.731 . 0 0 "[ . 1 . 2]" 1
462 1 130 LEU HA 1 131 MET H 2.660 . 3.520 3.545 3.456 3.584 0.064 9 0 "[ . 1 . 2]" 1
463 1 87 VAL H 1 118 LEU MD1 3.340 . 4.880 2.893 2.318 3.416 . 0 0 "[ . 1 . 2]" 1
464 1 58 GLN HA 1 58 GLN QG 2.450 . 3.100 2.148 2.012 2.512 . 0 0 "[ . 1 . 2]" 1
465 1 96 THR HB 1 97 LEU H 2.840 . 3.880 2.480 2.179 2.791 . 0 0 "[ . 1 . 2]" 1
466 1 108 LEU QB 1 108 LEU MD1 2.710 . 3.620 2.255 2.187 2.307 . 0 0 "[ . 1 . 2]" 1
467 1 86 LEU HA 1 86 LEU MD1 2.470 . 3.140 1.890 1.796 2.099 0.004 17 0 "[ . 1 . 2]" 1
468 1 97 LEU MD1 1 99 SER H 3.590 . 5.380 5.277 5.081 5.505 0.125 3 0 "[ . 1 . 2]" 1
469 1 85 GLU QB 1 86 LEU H 2.660 . 3.520 2.651 2.160 3.350 . 0 0 "[ . 1 . 2]" 1
470 1 128 SER HA 1 131 MET H 2.940 . 4.080 3.628 3.060 4.122 0.042 20 0 "[ . 1 . 2]" 1
471 1 25 LEU MD1 1 26 LYS H 3.360 . 4.910 4.150 3.706 4.560 . 0 0 "[ . 1 . 2]" 1
472 1 47 TRP H 1 47 TRP HB2 2.420 . 3.030 2.522 2.141 3.149 0.119 6 0 "[ . 1 . 2]" 1
473 1 72 SER HA 1 75 ILE HG12 2.840 . 3.880 3.722 2.013 3.975 0.095 17 0 "[ . 1 . 2]" 1
474 1 51 PRO HD3 1 52 THR H 3.010 . 4.230 4.015 3.692 4.219 . 0 0 "[ . 1 . 2]" 1
475 1 132 LYS QD 1 132 LYS HG3 2.150 . 2.500 2.486 2.266 2.532 0.032 8 0 "[ . 1 . 2]" 1
476 1 112 GLN HA 1 112 GLN HE21 3.330 . 4.860 4.734 4.350 4.954 0.094 7 0 "[ . 1 . 2]" 1
477 1 25 LEU H 1 69 PHE QE 3.210 . 4.630 2.669 2.373 3.133 . 0 0 "[ . 1 . 2]" 1
478 1 22 VAL MG1 1 23 ALA H 3.360 . 4.920 3.402 2.981 3.659 . 0 0 "[ . 1 . 2]" 1
479 1 71 MET HA 1 71 MET HG3 2.460 . 3.120 2.278 1.987 3.016 . 0 0 "[ . 1 . 2]" 1
480 1 55 VAL HA 1 58 GLN QG 2.620 . 3.430 3.257 1.858 3.741 0.311 17 0 "[ . 1 . 2]" 1
481 1 25 LEU HB2 1 69 PHE QE 2.930 . 4.060 2.460 1.836 3.003 . 0 0 "[ . 1 . 2]" 1
482 1 98 PHE HB2 1 99 SER H 2.920 . 4.030 3.278 3.126 3.443 . 0 0 "[ . 1 . 2]" 1
483 1 22 VAL H 1 22 VAL MG2 2.670 . 3.530 2.093 1.805 2.573 . 0 0 "[ . 1 . 2]" 1
484 1 131 MET HA 1 131 MET HG3 2.780 . 3.750 3.698 3.611 3.867 0.117 16 0 "[ . 1 . 2]" 1
485 1 101 TYR HB3 1 102 GLY H 2.750 . 3.700 3.026 2.503 3.811 0.111 17 0 "[ . 1 . 2]" 1
486 1 86 LEU MD1 1 117 ARG HD2 2.960 . 4.130 3.780 2.551 4.191 0.061 20 0 "[ . 1 . 2]" 1
487 1 25 LEU HB2 1 25 LEU MD2 2.980 . 4.170 2.164 1.965 2.382 . 0 0 "[ . 1 . 2]" 1
488 1 32 LEU HA 1 32 LEU MD1 2.580 . 3.360 2.849 2.013 3.393 0.033 13 0 "[ . 1 . 2]" 1
489 1 24 GLN HE21 1 24 GLN HG3 2.730 . 3.670 3.163 2.197 3.565 . 0 0 "[ . 1 . 2]" 1
490 1 130 LEU HB2 1 130 LEU MD2 2.430 . 3.060 2.747 2.343 3.063 0.003 10 0 "[ . 1 . 2]" 1
491 1 71 MET HB2 1 71 MET HG2 2.360 . 2.920 2.935 2.794 2.966 0.046 14 0 "[ . 1 . 2]" 1
492 1 48 VAL MG2 1 49 ASN H 3.030 . 4.270 3.636 3.324 4.261 . 0 0 "[ . 1 . 2]" 1
493 1 86 LEU HA 1 89 GLU H 2.750 . 3.700 3.384 3.146 3.551 . 0 0 "[ . 1 . 2]" 1
494 1 130 LEU H 1 131 MET HG3 3.170 . 4.540 4.583 4.313 4.716 0.176 14 0 "[ . 1 . 2]" 1
495 1 97 LEU HB3 1 97 LEU MD1 2.600 . 3.400 2.855 2.614 3.164 . 0 0 "[ . 1 . 2]" 1
496 1 58 GLN HA 1 58 GLN HE22 3.340 . 4.880 5.316 5.113 5.479 0.599 2 6 "[*+ . 1* *-* 2]" 1
497 1 114 THR H 1 114 THR HB 2.430 . 3.070 2.741 2.581 3.021 . 0 0 "[ . 1 . 2]" 1
498 1 79 ASP HA 1 80 ASP H 2.540 . 3.280 3.319 2.995 3.414 0.134 10 0 "[ . 1 . 2]" 1
499 1 101 TYR H 1 101 TYR HB3 2.660 . 3.510 3.463 3.163 3.615 0.105 17 0 "[ . 1 . 2]" 1
500 1 28 LEU MD2 1 29 CYS H 3.330 . 4.860 4.447 4.038 4.812 . 0 0 "[ . 1 . 2]" 1
501 1 127 ILE MG 1 130 LEU HB2 3.000 . 4.210 4.169 3.499 4.407 0.197 5 0 "[ . 1 . 2]" 1
502 1 101 TYR H 1 101 TYR HB2 2.730 . 3.670 2.300 2.091 2.743 . 0 0 "[ . 1 . 2]" 1
503 1 32 LEU HB2 1 32 LEU MD1 2.780 . 3.750 2.168 1.975 2.385 . 0 0 "[ . 1 . 2]" 1
504 1 63 ILE MG 1 95 TYR H 3.340 . 4.870 3.332 2.937 3.624 . 0 0 "[ . 1 . 2]" 1
505 1 30 GLU H 1 30 GLU HB2 2.900 . 3.990 2.561 2.335 3.537 . 0 0 "[ . 1 . 2]" 1
506 1 121 LEU HB2 1 121 LEU MD2 2.670 . 3.550 2.536 1.921 2.769 . 0 0 "[ . 1 . 2]" 1
507 1 121 LEU HB3 1 121 LEU MD2 2.700 . 3.600 2.227 2.052 2.946 . 0 0 "[ . 1 . 2]" 1
508 1 120 ARG HD3 1 120 ARG HG3 2.280 . 2.760 2.508 2.241 2.809 0.049 13 0 "[ . 1 . 2]" 1
509 1 12 MET H 1 13 ASP H 2.770 . 3.740 3.632 2.055 4.459 0.719 9 3 "[ . +1 * . -]" 1
510 1 86 LEU HB3 1 86 LEU MD1 2.900 . 4.000 2.902 2.595 3.176 . 0 0 "[ . 1 . 2]" 1
511 1 115 LYS H 1 115 LYS QB 2.930 . 4.070 2.778 2.423 3.073 . 0 0 "[ . 1 . 2]" 1
512 1 56 ASN HB3 1 57 LEU H 2.980 . 4.160 2.817 2.386 3.626 . 0 0 "[ . 1 . 2]" 1
513 1 86 LEU HB2 1 86 LEU MD1 2.550 . 3.300 2.998 2.622 3.186 . 0 0 "[ . 1 . 2]" 1
514 1 40 LEU MD2 1 103 ILE MD 2.520 . 3.230 1.979 1.752 2.357 0.048 19 0 "[ . 1 . 2]" 1
515 1 72 SER H 1 72 SER QB 2.320 . 2.840 2.658 2.081 2.924 0.084 15 0 "[ . 1 . 2]" 1
516 1 95 TYR H 1 95 TYR QB 2.510 . 3.220 2.220 2.084 2.288 . 0 0 "[ . 1 . 2]" 1
517 1 84 SER H 1 87 VAL H 3.400 . 5.000 4.586 4.429 4.733 . 0 0 "[ . 1 . 2]" 1
518 1 73 PHE QB 1 74 LYS H 2.720 . 3.650 2.334 2.150 2.564 . 0 0 "[ . 1 . 2]" 1
519 1 110 ARG QB 1 111 TRP H 2.610 . 3.420 2.368 2.015 2.601 . 0 0 "[ . 1 . 2]" 1
520 1 72 SER H 1 72 SER HB2 2.540 . 3.280 2.962 2.189 3.458 0.178 9 0 "[ . 1 . 2]" 1
521 1 60 ASN H 1 60 ASN HD22 3.070 . 4.330 4.207 3.701 4.471 0.141 11 0 "[ . 1 . 2]" 1
522 1 75 ILE HG12 1 75 ILE MG 2.500 . 3.190 2.495 2.269 3.122 . 0 0 "[ . 1 . 2]" 1
523 1 75 ILE HA 1 75 ILE HG13 2.650 . 3.500 3.301 2.695 3.675 0.175 16 0 "[ . 1 . 2]" 1
524 1 112 GLN HE22 1 112 GLN HG2 2.670 . 3.550 3.564 3.435 3.658 0.108 11 0 "[ . 1 . 2]" 1
525 1 64 GLU H 1 66 ILE H 3.190 . 4.590 4.197 4.039 4.346 . 0 0 "[ . 1 . 2]" 1
526 1 88 GLU H 1 89 GLU H 3.030 . 4.270 2.854 2.709 2.927 . 0 0 "[ . 1 . 2]" 1
527 1 67 ALA MB 1 91 LEU MD1 2.480 . 3.160 2.043 1.711 2.476 0.089 6 0 "[ . 1 . 2]" 1
528 1 71 MET HA 1 71 MET HG2 2.480 . 3.160 2.884 2.687 3.274 0.114 18 0 "[ . 1 . 2]" 1
529 1 62 LEU HG 1 63 ILE H 3.130 . 4.460 4.005 2.386 4.698 0.238 6 0 "[ . 1 . 2]" 1
530 1 109 GLN HB3 1 109 GLN HG3 2.330 . 2.860 2.343 2.273 2.433 . 0 0 "[ . 1 . 2]" 1
531 1 112 GLN HE22 1 112 GLN HG3 2.690 . 3.580 3.597 3.480 3.776 0.196 5 0 "[ . 1 . 2]" 1
532 1 101 TYR HB2 1 102 GLY H 2.780 . 3.750 2.940 2.358 4.171 0.421 17 0 "[ . 1 . 2]" 1
533 1 70 VAL HA 1 70 VAL MG2 2.480 . 3.170 2.357 2.251 2.462 . 0 0 "[ . 1 . 2]" 1
534 1 66 ILE MG 1 69 PHE H 3.350 . 4.890 4.636 4.402 4.935 0.045 5 0 "[ . 1 . 2]" 1
535 1 117 ARG HA 1 117 ARG HG3 2.550 . 3.310 2.945 2.525 3.537 0.227 11 0 "[ . 1 . 2]" 1
536 1 63 ILE MG 1 95 TYR QD 2.750 . 3.700 3.255 2.365 3.779 0.079 7 0 "[ . 1 . 2]" 1
537 1 111 TRP H 1 112 GLN HG2 3.220 . 4.640 4.525 4.120 4.837 0.197 4 0 "[ . 1 . 2]" 1
538 1 64 GLU HA 1 67 ALA MB 2.440 . 3.080 1.984 1.782 2.160 0.018 8 0 "[ . 1 . 2]" 1
539 1 59 LEU HA 1 59 LEU QD 2.460 . 3.120 2.458 2.103 2.803 . 0 0 "[ . 1 . 2]" 1
540 1 74 LYS QE 1 74 LYS HG3 2.780 . 3.750 2.473 2.041 3.540 . 0 0 "[ . 1 . 2]" 1
541 1 130 LEU HB3 1 130 LEU MD1 2.500 . 3.190 3.017 2.739 3.205 0.015 2 0 "[ . 1 . 2]" 1
542 1 58 GLN HE21 1 58 GLN QG 2.590 . 3.390 2.387 2.187 2.582 . 0 0 "[ . 1 . 2]" 1
543 1 110 ARG H 1 110 ARG QD 2.980 . 4.170 4.193 3.631 4.369 0.199 4 0 "[ . 1 . 2]" 1
544 1 59 LEU QB 1 59 LEU QD 2.320 . 2.850 1.860 1.785 1.988 0.015 10 0 "[ . 1 . 2]" 1
545 1 86 LEU MD2 1 117 ARG HG3 2.900 . 4.000 4.009 3.628 4.148 0.148 3 0 "[ . 1 . 2]" 1
546 1 15 TYR QD 1 16 SER H 3.580 . 5.360 3.991 2.575 4.848 . 0 0 "[ . 1 . 2]" 1
547 1 15 TYR HB3 1 16 SER H 2.890 . 3.980 3.134 1.605 4.147 0.195 2 0 "[ . 1 . 2]" 1
548 1 15 TYR HB2 1 16 SER H 2.910 . 4.020 2.942 1.963 3.825 . 0 0 "[ . 1 . 2]" 1
549 1 53 SER H 1 53 SER HB2 2.600 . 3.400 3.442 2.255 3.592 0.192 19 0 "[ . 1 . 2]" 1
550 1 117 ARG HA 1 117 ARG HG2 2.740 . 3.680 2.661 2.441 3.016 . 0 0 "[ . 1 . 2]" 1
551 1 39 THR MG 1 40 LEU H 3.170 . 4.530 3.365 2.082 3.931 . 0 0 "[ . 1 . 2]" 1
552 1 22 VAL MG2 1 23 ALA H 3.060 . 4.310 3.672 3.431 4.080 . 0 0 "[ . 1 . 2]" 1
553 1 35 GLU HG3 1 59 LEU QD 2.850 . 3.900 3.243 2.806 3.626 . 0 0 "[ . 1 . 2]" 1
554 1 52 THR H 1 52 THR MG 2.690 . 3.580 3.113 2.297 3.710 0.130 3 0 "[ . 1 . 2]" 1
555 1 58 GLN QB 1 58 GLN HE22 3.430 . 5.050 3.126 3.054 3.230 . 0 0 "[ . 1 . 2]" 1
556 1 119 PHE H 1 119 PHE QE 3.180 . 4.560 4.545 4.338 4.683 0.123 13 0 "[ . 1 . 2]" 1
557 1 32 LEU H 1 33 TYR H 2.820 . 3.840 2.797 2.716 2.918 . 0 0 "[ . 1 . 2]" 1
558 1 109 GLN HB3 1 109 GLN HG2 2.380 . 2.960 2.994 2.964 3.009 0.049 9 0 "[ . 1 . 2]" 1
559 1 50 ASP HA 1 52 THR H 3.000 . 4.210 3.690 3.519 4.007 . 0 0 "[ . 1 . 2]" 1
560 1 82 ASP QB 1 83 LEU H 2.500 . 3.200 2.621 2.332 3.252 0.052 1 0 "[ . 1 . 2]" 1
561 1 111 TRP H 1 111 TRP HB3 2.580 . 3.360 2.726 2.349 3.064 . 0 0 "[ . 1 . 2]" 1
562 1 90 TYR H 1 90 TYR QB 2.630 . 3.450 2.175 2.072 2.384 . 0 0 "[ . 1 . 2]" 1
563 1 69 PHE H 1 69 PHE HB2 2.600 . 3.410 2.564 2.244 2.853 . 0 0 "[ . 1 . 2]" 1
564 1 75 ILE H 1 76 LYS QG 3.210 . 4.620 4.062 3.572 4.739 0.119 10 0 "[ . 1 . 2]" 1
565 1 34 ASP H 1 35 GLU H 2.770 . 3.730 2.755 2.609 2.878 . 0 0 "[ . 1 . 2]" 1
566 1 28 LEU H 1 28 LEU MD2 2.790 . 3.780 2.834 2.353 3.781 0.001 1 0 "[ . 1 . 2]" 1
567 1 94 THR H 1 96 THR H 3.130 . 4.460 4.395 4.231 4.528 0.068 3 0 "[ . 1 . 2]" 1
568 1 85 GLU H 1 87 VAL H 3.090 . 4.380 4.288 3.985 4.444 0.064 9 0 "[ . 1 . 2]" 1
569 1 104 ASN H 1 104 ASN QB 2.550 . 3.300 2.751 2.511 3.218 . 0 0 "[ . 1 . 2]" 1
570 1 64 GLU H 1 64 GLU QB 2.290 . 2.780 2.284 2.079 2.734 . 0 0 "[ . 1 . 2]" 1
571 1 63 ILE H 1 63 ILE QG 2.920 . 4.030 2.164 2.041 2.440 . 0 0 "[ . 1 . 2]" 1
572 1 12 MET QB 1 13 ASP H 3.090 . 4.380 3.374 2.175 3.999 . 0 0 "[ . 1 . 2]" 1
573 1 75 ILE HG13 1 75 ILE MG 2.540 . 3.280 3.129 2.153 3.203 . 0 0 "[ . 1 . 2]" 1
574 1 90 TYR QD 1 114 THR MG 2.940 . 4.090 3.055 2.183 3.960 . 0 0 "[ . 1 . 2]" 1
575 1 74 LYS QB 1 74 LYS QE 2.340 . 2.890 2.605 2.109 2.942 0.052 5 0 "[ . 1 . 2]" 1
576 1 23 ALA MB 1 24 GLN H 2.700 . 3.610 2.387 2.221 2.464 . 0 0 "[ . 1 . 2]" 1
577 1 69 PHE HB2 1 70 VAL H 2.990 . 4.190 3.775 3.529 4.071 . 0 0 "[ . 1 . 2]" 1
578 1 37 ILE HG13 1 37 ILE MG 2.440 . 3.080 2.395 2.296 2.534 . 0 0 "[ . 1 . 2]" 1
579 1 74 LYS H 1 74 LYS HG2 2.450 . 3.110 2.272 1.759 3.391 0.281 1 0 "[ . 1 . 2]" 1
580 1 88 GLU H 1 88 GLU HG2 2.660 . 3.520 3.126 2.165 3.540 0.020 16 0 "[ . 1 . 2]" 1
581 1 86 LEU H 1 88 GLU H 2.940 . 4.080 4.188 4.084 4.246 0.166 18 0 "[ . 1 . 2]" 1
582 1 125 GLU QB 1 126 TYR H 2.710 . 3.630 1.866 1.765 2.160 0.035 16 0 "[ . 1 . 2]" 1
583 1 91 LEU HB3 1 91 LEU MD2 2.900 . 4.000 2.426 2.161 2.555 . 0 0 "[ . 1 . 2]" 1
584 1 132 LYS QD 1 132 LYS HG2 2.100 . 2.400 2.190 2.113 2.405 0.005 9 0 "[ . 1 . 2]" 1
585 1 85 GLU HB3 1 85 GLU HG3 2.400 . 2.990 2.864 2.640 2.973 . 0 0 "[ . 1 . 2]" 1
586 1 24 GLN HA 1 24 GLN HG2 2.880 . 3.960 2.685 2.154 4.051 0.091 10 0 "[ . 1 . 2]" 1
587 1 85 GLU HA 1 85 GLU HB3 2.370 . 2.940 2.877 2.622 3.016 0.076 3 0 "[ . 1 . 2]" 1
588 1 63 ILE H 1 63 ILE HB 2.500 . 3.190 2.528 2.363 2.604 . 0 0 "[ . 1 . 2]" 1
589 1 40 LEU MD2 1 98 PHE QE 2.910 . 4.010 2.689 2.255 2.998 . 0 0 "[ . 1 . 2]" 1
590 1 86 LEU MD2 1 117 ARG HG2 3.120 . 4.440 3.486 2.885 3.987 . 0 0 "[ . 1 . 2]" 1
591 1 108 LEU HA 1 108 LEU HG 2.910 . 4.020 3.104 2.956 3.279 . 0 0 "[ . 1 . 2]" 1
592 1 67 ALA H 1 68 SER H 2.620 . 3.440 2.969 2.903 3.072 . 0 0 "[ . 1 . 2]" 1
593 1 57 LEU H 1 57 LEU MD2 2.650 . 3.500 3.133 2.114 3.482 . 0 0 "[ . 1 . 2]" 1
594 1 32 LEU HA 1 32 LEU MD2 2.950 . 4.100 3.756 3.276 3.954 . 0 0 "[ . 1 . 2]" 1
595 1 71 MET HB3 1 71 MET HG3 2.260 . 2.720 2.941 2.788 2.971 0.251 7 0 "[ . 1 . 2]" 1
596 1 75 ILE HA 1 75 ILE MG 2.390 . 2.980 2.377 2.303 2.664 . 0 0 "[ . 1 . 2]" 1
597 1 77 TYR HA 1 79 ASP H 3.030 . 4.260 3.638 2.954 4.542 0.282 14 0 "[ . 1 . 2]" 1
598 1 40 LEU HA 1 40 LEU MD2 2.470 . 3.150 2.486 2.178 2.905 . 0 0 "[ . 1 . 2]" 1
599 1 40 LEU HA 1 40 LEU MD1 2.910 . 4.010 3.947 3.876 4.010 0.000 1 0 "[ . 1 . 2]" 1
600 1 15 TYR H 1 15 TYR HB3 2.670 . 3.550 3.367 2.547 3.792 0.242 8 0 "[ . 1 . 2]" 1
601 1 15 TYR H 1 15 TYR HB2 2.750 . 3.700 2.500 2.122 3.345 . 0 0 "[ . 1 . 2]" 1
602 1 15 TYR H 1 15 TYR QD 3.010 . 4.230 3.284 2.170 4.217 . 0 0 "[ . 1 . 2]" 1
603 1 48 VAL H 1 48 VAL MG2 2.670 . 3.540 1.987 1.806 2.318 . 0 0 "[ . 1 . 2]" 1
604 1 130 LEU HB2 1 130 LEU MD1 2.250 . 2.700 2.208 2.072 2.394 . 0 0 "[ . 1 . 2]" 1
605 1 32 LEU HB2 1 32 LEU MD2 2.930 . 4.070 2.854 2.386 3.110 . 0 0 "[ . 1 . 2]" 1
606 1 24 GLN HA 1 24 GLN HE21 3.530 . 5.270 4.593 4.144 5.251 . 0 0 "[ . 1 . 2]" 1
607 1 76 LYS QD 1 77 TYR H 3.290 . 4.780 3.929 2.232 4.870 0.090 6 0 "[ . 1 . 2]" 1
608 1 113 LYS QE 1 113 LYS HG3 2.390 . 2.980 2.647 1.962 3.180 0.200 17 0 "[ . 1 . 2]" 1
609 1 63 ILE HA 1 63 ILE MG 2.760 . 3.710 2.557 2.466 2.734 . 0 0 "[ . 1 . 2]" 1
610 1 25 LEU MD1 1 69 PHE QD 2.970 . 4.140 2.722 1.668 3.979 0.132 4 0 "[ . 1 . 2]" 1
611 1 97 LEU HB2 1 99 SER H 3.130 . 4.460 4.673 4.608 4.740 0.280 10 0 "[ . 1 . 2]" 1
612 1 107 GLU HB2 1 108 LEU H 3.230 . 4.660 2.702 2.394 3.289 . 0 0 "[ . 1 . 2]" 1
613 1 25 LEU HA 1 25 LEU MD2 2.890 . 3.970 3.132 2.125 3.837 . 0 0 "[ . 1 . 2]" 1
614 1 57 LEU HA 1 57 LEU QD 2.320 . 2.840 2.076 1.886 2.318 . 0 0 "[ . 1 . 2]" 1
615 1 109 GLN HE22 1 112 GLN HE21 3.450 . 5.100 3.338 2.743 4.551 . 0 0 "[ . 1 . 2]" 1
616 1 63 ILE H 1 63 ILE MD 2.710 . 3.630 3.348 3.163 3.586 . 0 0 "[ . 1 . 2]" 1
617 1 25 LEU H 1 26 LYS H 2.650 . 3.490 2.905 2.778 3.049 . 0 0 "[ . 1 . 2]" 1
618 1 21 ASP HA 1 24 GLN H 2.950 . 4.100 3.488 3.132 3.834 . 0 0 "[ . 1 . 2]" 1
619 1 87 VAL H 1 87 VAL HB 2.510 . 3.210 2.687 2.465 2.832 . 0 0 "[ . 1 . 2]" 1
620 1 83 LEU MD1 1 122 PHE HZ 3.050 . 4.300 3.280 2.853 3.846 . 0 0 "[ . 1 . 2]" 1
621 1 80 ASP HB2 1 81 GLY H 3.140 . 4.480 4.388 3.678 4.610 0.130 12 0 "[ . 1 . 2]" 1
622 1 96 THR H 1 96 THR HB 2.510 . 3.210 2.745 2.557 3.023 . 0 0 "[ . 1 . 2]" 1
623 1 32 LEU HB2 1 33 TYR H 2.840 . 3.880 3.890 3.800 3.970 0.090 13 0 "[ . 1 . 2]" 1
624 1 83 LEU MD1 1 121 LEU H 3.480 . 5.160 4.160 3.722 4.776 . 0 0 "[ . 1 . 2]" 1
625 1 84 SER H 1 84 SER QB 2.460 . 3.130 2.531 2.038 2.940 . 0 0 "[ . 1 . 2]" 1
626 1 53 SER H 1 53 SER HB3 2.620 . 3.430 2.491 2.159 2.776 . 0 0 "[ . 1 . 2]" 1
627 1 48 VAL HB 1 49 ASN H 3.090 . 4.380 2.470 2.290 3.198 . 0 0 "[ . 1 . 2]" 1
628 1 126 TYR QB 1 127 ILE H 2.740 . 3.680 2.954 2.571 3.366 . 0 0 "[ . 1 . 2]" 1
629 1 24 GLN H 1 25 LEU H 2.890 . 3.980 2.831 2.695 2.985 . 0 0 "[ . 1 . 2]" 1
630 1 31 SER H 1 32 LEU H 2.790 . 3.770 2.834 2.620 2.981 . 0 0 "[ . 1 . 2]" 1
631 1 61 ASP HA 1 64 GLU H 2.810 . 3.820 3.753 3.454 3.879 0.059 7 0 "[ . 1 . 2]" 1
632 1 116 GLU QB 1 117 ARG H 2.880 . 3.960 2.499 2.117 3.472 . 0 0 "[ . 1 . 2]" 1
633 1 55 VAL MG2 1 57 LEU H 3.430 . 5.050 4.621 4.400 4.944 . 0 0 "[ . 1 . 2]" 1
634 1 25 LEU HB3 1 25 LEU MD2 2.630 . 3.450 2.853 2.324 3.184 . 0 0 "[ . 1 . 2]" 1
635 1 40 LEU HB2 1 40 LEU MD2 2.900 . 4.000 3.135 3.065 3.181 . 0 0 "[ . 1 . 2]" 1
636 1 40 LEU HB2 1 40 LEU MD1 2.980 . 4.170 2.168 2.010 2.254 . 0 0 "[ . 1 . 2]" 1
637 1 95 TYR HA 1 95 TYR QD 2.710 . 3.620 2.971 2.759 3.270 . 0 0 "[ . 1 . 2]" 1
638 1 47 TRP HB2 1 48 VAL H 2.770 . 3.730 3.200 2.173 3.859 0.129 19 0 "[ . 1 . 2]" 1
639 1 62 LEU H 1 63 ILE HA 3.650 . 5.500 5.497 5.316 5.599 0.099 6 0 "[ . 1 . 2]" 1
640 1 58 GLN H 1 59 LEU HG 3.330 . 4.860 4.802 4.568 4.979 0.119 13 0 "[ . 1 . 2]" 1
641 1 101 TYR HA 1 101 TYR QD 2.720 . 3.640 2.656 1.901 3.015 . 0 0 "[ . 1 . 2]" 1
642 1 109 GLN H 1 110 ARG HA 3.570 . 5.340 5.333 5.267 5.364 0.024 14 0 "[ . 1 . 2]" 1
643 1 87 VAL MG1 1 88 GLU H 2.930 . 4.050 3.423 3.039 3.691 . 0 0 "[ . 1 . 2]" 1
644 1 81 GLY H 1 82 ASP H 2.480 . 3.160 3.104 2.803 3.155 . 0 0 "[ . 1 . 2]" 1
645 1 65 HIS H 1 65 HIS HB2 2.500 . 3.200 2.363 2.105 3.243 0.043 3 0 "[ . 1 . 2]" 1
646 1 112 GLN HB3 1 112 GLN HE22 3.060 . 4.320 4.333 4.253 4.367 0.047 14 0 "[ . 1 . 2]" 1
647 1 93 ASP H 1 94 THR H 2.690 . 3.590 2.896 2.781 2.989 . 0 0 "[ . 1 . 2]" 1
648 1 30 GLU HA 1 30 GLU HG2 2.900 . 3.990 2.518 2.245 3.773 . 0 0 "[ . 1 . 2]" 1
649 1 69 PHE HB3 1 70 VAL MG2 3.020 . 4.240 3.289 2.742 3.811 . 0 0 "[ . 1 . 2]" 1
650 1 110 ARG HA 1 110 ARG HG2 2.770 . 3.740 2.741 2.168 3.779 0.039 11 0 "[ . 1 . 2]" 1
651 1 111 TRP H 1 111 TRP HB2 2.630 . 3.460 2.345 2.141 2.720 . 0 0 "[ . 1 . 2]" 1
652 1 83 LEU H 1 121 LEU MD1 3.450 . 5.110 4.793 3.829 5.199 0.089 4 0 "[ . 1 . 2]" 1
653 1 55 VAL MG1 1 56 ASN H 3.400 . 5.000 3.537 1.914 4.103 . 0 0 "[ . 1 . 2]" 1
654 1 125 GLU QB 1 126 TYR QD 2.820 . 3.830 2.884 2.144 3.281 . 0 0 "[ . 1 . 2]" 1
655 1 33 TYR H 1 33 TYR HB3 2.620 . 3.440 2.736 2.415 3.148 . 0 0 "[ . 1 . 2]" 1
656 1 102 GLY H 1 103 ILE H 3.100 . 4.400 4.324 3.180 4.474 0.074 19 0 "[ . 1 . 2]" 1
657 1 100 SER HA 1 101 TYR H 2.450 . 3.110 2.265 2.161 2.801 . 0 0 "[ . 1 . 2]" 1
658 1 131 MET HA 1 131 MET HB2 2.280 . 2.760 2.673 2.459 3.001 0.241 11 0 "[ . 1 . 2]" 1
659 1 112 GLN HA 1 112 GLN HE22 3.590 . 5.380 5.129 4.811 5.410 0.030 20 0 "[ . 1 . 2]" 1
660 1 82 ASP H 1 83 LEU HB2 3.320 . 4.840 4.832 4.398 5.028 0.188 3 0 "[ . 1 . 2]" 1
661 1 84 SER H 1 85 GLU HB3 3.250 . 4.700 4.889 4.778 5.111 0.411 6 0 "[ . 1 . 2]" 1
662 1 80 ASP H 1 80 ASP HB3 2.430 . 3.050 2.574 2.187 3.535 0.485 6 0 "[ . 1 . 2]" 1
663 1 80 ASP H 1 80 ASP HB2 2.550 . 3.310 3.380 2.209 3.644 0.334 14 0 "[ . 1 . 2]" 1
664 1 83 LEU MD1 1 121 LEU HB2 2.830 . 3.850 2.603 1.912 3.992 0.142 9 0 "[ . 1 . 2]" 1
665 1 97 LEU MD1 1 107 GLU HG3 3.080 . 4.350 3.745 2.637 4.386 0.036 7 0 "[ . 1 . 2]" 1
666 1 109 GLN HA 1 112 GLN HG2 2.920 . 4.030 3.112 2.955 3.406 . 0 0 "[ . 1 . 2]" 1
667 1 97 LEU MD1 1 107 GLU HG2 2.970 . 4.150 3.555 2.935 4.124 . 0 0 "[ . 1 . 2]" 1
668 1 109 GLN HE21 1 112 GLN HE21 3.260 . 4.730 4.251 3.712 4.757 0.027 8 0 "[ . 1 . 2]" 1
669 1 23 ALA H 1 23 ALA MB 2.800 . 3.790 2.264 2.184 2.284 . 0 0 "[ . 1 . 2]" 1
670 1 28 LEU H 1 28 LEU MD1 2.990 . 4.180 3.793 2.851 4.112 . 0 0 "[ . 1 . 2]" 1
671 1 67 ALA HA 1 70 VAL H 3.290 . 4.790 3.585 3.378 3.761 . 0 0 "[ . 1 . 2]" 1
672 1 74 LYS QE 1 74 LYS HG2 2.960 . 4.130 2.982 1.983 3.322 . 0 0 "[ . 1 . 2]" 1
673 1 63 ILE MG 1 95 TYR HB2 3.000 . 4.200 2.154 1.745 2.698 0.055 14 0 "[ . 1 . 2]" 1
674 1 40 LEU HB3 1 40 LEU MD2 2.680 . 3.560 2.179 2.062 2.276 . 0 0 "[ . 1 . 2]" 1
675 1 40 LEU HB3 1 40 LEU MD1 2.650 . 3.490 2.631 2.492 2.782 . 0 0 "[ . 1 . 2]" 1
676 1 59 LEU QB 1 59 LEU HG 2.390 . 2.970 2.438 2.181 2.524 . 0 0 "[ . 1 . 2]" 1
677 1 66 ILE HB 1 66 ILE MD 2.720 . 3.640 2.336 2.278 2.380 . 0 0 "[ . 1 . 2]" 1
678 1 57 LEU HB2 1 57 LEU QD 2.600 . 3.400 2.279 2.205 2.380 . 0 0 "[ . 1 . 2]" 1
679 1 70 VAL H 1 73 PHE H 3.650 . 5.500 4.465 4.353 4.786 . 0 0 "[ . 1 . 2]" 1
680 1 63 ILE MG 1 95 TYR HA 2.860 . 3.910 3.658 3.255 3.949 0.039 10 0 "[ . 1 . 2]" 1
681 1 92 ASP H 1 93 ASP H 2.450 . 3.110 2.879 2.705 2.985 . 0 0 "[ . 1 . 2]" 1
682 1 12 MET HA 1 13 ASP H 2.480 . 3.160 2.293 2.138 2.894 . 0 0 "[ . 1 . 2]" 1
683 1 64 GLU HA 1 64 GLU HG3 2.550 . 3.300 3.228 3.018 3.525 0.225 6 0 "[ . 1 . 2]" 1
684 1 22 VAL H 1 23 ALA MB 3.540 . 5.290 4.453 4.327 4.595 . 0 0 "[ . 1 . 2]" 1
685 1 97 LEU MD2 1 108 LEU MD1 2.660 . 3.520 2.599 2.053 3.243 . 0 0 "[ . 1 . 2]" 1
686 1 86 LEU HA 1 89 GLU HB2 2.570 . 3.350 2.397 2.120 2.626 . 0 0 "[ . 1 . 2]" 1
687 1 28 LEU MD1 1 29 CYS H 3.460 . 5.120 4.323 2.284 4.622 . 0 0 "[ . 1 . 2]" 1
688 1 47 TRP HA 1 47 TRP HD1 3.230 . 4.670 3.800 3.154 4.709 0.039 18 0 "[ . 1 . 2]" 1
689 1 64 GLU H 1 65 HIS HB3 3.320 . 4.830 4.909 4.600 5.092 0.262 17 0 "[ . 1 . 2]" 1
690 1 54 ALA MB 1 58 GLN HE22 3.370 . 4.930 4.271 2.505 5.022 0.092 7 0 "[ . 1 . 2]" 1
691 1 31 SER HB3 1 32 LEU H 2.820 . 3.830 3.621 3.407 3.817 . 0 0 "[ . 1 . 2]" 1
692 1 61 ASP HB2 1 62 LEU H 2.690 . 3.580 3.635 3.345 3.735 0.155 20 0 "[ . 1 . 2]" 1
693 1 55 VAL H 1 55 VAL HB 2.380 . 2.950 3.230 2.610 3.428 0.478 3 0 "[ . 1 . 2]" 1
694 1 61 ASP HB3 1 62 LEU H 2.900 . 4.000 2.197 2.126 2.275 . 0 0 "[ . 1 . 2]" 1
695 1 118 LEU H 1 119 PHE QD 3.180 . 4.560 4.343 3.938 4.620 0.060 10 0 "[ . 1 . 2]" 1
696 1 110 ARG HG2 1 111 TRP H 3.240 . 4.680 4.646 4.362 4.832 0.152 13 0 "[ . 1 . 2]" 1
697 1 115 LYS QG 1 116 GLU H 2.740 . 3.680 2.391 1.737 3.875 0.195 9 0 "[ . 1 . 2]" 1
698 1 58 GLN HB2 1 58 GLN HE21 2.850 . 3.890 2.171 1.931 2.553 . 0 0 "[ . 1 . 2]" 1
699 1 37 ILE HB 1 37 ILE MD 2.530 . 3.260 3.235 3.224 3.242 . 0 0 "[ . 1 . 2]" 1
700 1 28 LEU HA 1 28 LEU MD2 2.910 . 4.020 2.498 2.201 3.957 . 0 0 "[ . 1 . 2]" 1
701 1 118 LEU MD2 1 119 PHE H 3.250 . 4.700 4.523 3.954 4.768 0.068 5 0 "[ . 1 . 2]" 1
702 1 63 ILE MD 1 95 TYR QD 3.140 . 4.470 3.231 2.485 4.297 . 0 0 "[ . 1 . 2]" 1
703 1 35 GLU QB 1 36 GLY H 2.650 . 3.500 2.577 2.244 3.058 . 0 0 "[ . 1 . 2]" 1
704 1 117 ARG H 1 117 ARG QD 2.860 . 3.910 3.696 2.916 4.064 0.154 14 0 "[ . 1 . 2]" 1
705 1 34 ASP HB2 1 35 GLU H 2.790 . 3.780 3.525 2.956 3.810 0.030 8 0 "[ . 1 . 2]" 1
706 1 35 GLU HG3 1 36 GLY H 3.410 . 5.010 4.345 3.559 4.710 . 0 0 "[ . 1 . 2]" 1
707 1 35 GLU HG2 1 36 GLY H 3.280 . 4.770 3.968 3.093 4.487 . 0 0 "[ . 1 . 2]" 1
708 1 79 ASP H 1 79 ASP HB2 2.580 . 3.370 2.276 2.119 2.560 . 0 0 "[ . 1 . 2]" 1
709 1 34 ASP HB3 1 35 GLU H 2.870 . 3.930 2.386 2.189 2.658 . 0 0 "[ . 1 . 2]" 1
710 1 128 SER HA 1 131 MET HG2 2.730 . 3.670 3.640 2.724 3.826 0.156 4 0 "[ . 1 . 2]" 1
711 1 55 VAL HA 1 58 GLN H 2.840 . 3.870 3.352 2.975 3.785 . 0 0 "[ . 1 . 2]" 1
712 1 74 LYS HD2 1 74 LYS QE 2.320 . 2.850 2.344 2.147 2.531 . 0 0 "[ . 1 . 2]" 1
713 1 47 TRP HA 1 47 TRP HE3 2.870 . 3.930 3.328 1.988 4.070 0.140 12 0 "[ . 1 . 2]" 1
714 1 130 LEU HA 1 130 LEU HG 2.290 . 2.780 2.566 2.180 2.983 0.203 16 0 "[ . 1 . 2]" 1
715 1 60 ASN HA 1 63 ILE MD 2.710 . 3.630 1.903 1.677 2.243 0.123 2 0 "[ . 1 . 2]" 1
716 1 125 GLU QB 1 126 TYR HA 2.830 . 3.850 3.978 3.864 4.132 0.282 12 0 "[ . 1 . 2]" 1
717 1 83 LEU MD1 1 122 PHE H 3.430 . 5.060 3.346 2.743 3.676 . 0 0 "[ . 1 . 2]" 1
718 1 28 LEU H 1 28 LEU QB 2.560 . 3.330 2.274 2.073 2.778 . 0 0 "[ . 1 . 2]" 1
719 1 38 ALA H 1 38 ALA MB 2.420 . 3.040 2.260 2.232 2.277 . 0 0 "[ . 1 . 2]" 1
720 1 30 GLU HB3 1 31 SER H 2.800 . 3.790 3.454 3.141 3.687 . 0 0 "[ . 1 . 2]" 1
721 1 131 MET ME 1 131 MET HG3 2.500 . 3.200 3.284 3.182 3.365 0.165 16 0 "[ . 1 . 2]" 1
722 1 111 TRP HB3 1 112 GLN H 2.800 . 3.790 2.354 2.197 2.488 . 0 0 "[ . 1 . 2]" 1
723 1 128 SER H 1 128 SER HB3 2.660 . 3.520 3.370 3.028 3.574 0.054 15 0 "[ . 1 . 2]" 1
724 1 128 SER H 1 128 SER HB2 2.680 . 3.570 3.176 2.821 3.537 . 0 0 "[ . 1 . 2]" 1
725 1 70 VAL MG1 1 73 PHE HB3 2.480 . 3.170 3.169 2.888 3.452 0.282 7 0 "[ . 1 . 2]" 1
726 1 56 ASN H 1 56 ASN QB 2.650 . 3.500 2.243 2.111 2.613 . 0 0 "[ . 1 . 2]" 1
727 1 107 GLU HB3 1 108 LEU H 3.100 . 4.400 3.660 3.193 4.287 . 0 0 "[ . 1 . 2]" 1
728 1 116 GLU H 1 116 GLU HG2 2.710 . 3.620 2.178 1.825 2.427 . 0 0 "[ . 1 . 2]" 1
729 1 47 TRP H 1 47 TRP HD1 3.240 . 4.690 3.879 2.927 4.740 0.050 17 0 "[ . 1 . 2]" 1
730 1 48 VAL H 1 48 VAL HB 2.780 . 3.750 3.680 3.570 3.781 0.031 17 0 "[ . 1 . 2]" 1
731 1 48 VAL HA 1 49 ASN H 2.620 . 3.440 2.421 2.198 2.556 . 0 0 "[ . 1 . 2]" 1
732 1 28 LEU QB 1 28 LEU MD2 2.620 . 3.440 2.274 2.077 2.531 . 0 0 "[ . 1 . 2]" 1
733 1 38 ALA MB 1 39 THR H 2.750 . 3.690 2.479 2.348 2.628 . 0 0 "[ . 1 . 2]" 1
734 1 53 SER H 1 53 SER QB 2.570 . 3.340 2.412 2.138 2.686 . 0 0 "[ . 1 . 2]" 1
735 1 118 LEU H 1 118 LEU QB 2.730 . 3.670 2.152 2.034 2.223 . 0 0 "[ . 1 . 2]" 1
736 1 90 TYR H 1 92 ASP H 3.100 . 4.400 4.365 4.082 4.476 0.076 15 0 "[ . 1 . 2]" 1
737 1 87 VAL HA 1 91 LEU H 3.260 . 4.720 3.878 3.625 4.263 . 0 0 "[ . 1 . 2]" 1
738 1 69 PHE QD 1 70 VAL MG2 2.920 . 4.040 3.492 2.902 4.154 0.114 6 0 "[ . 1 . 2]" 1
739 1 39 THR HB 1 40 LEU H 2.990 . 4.180 3.014 2.230 4.258 0.078 10 0 "[ . 1 . 2]" 1
740 1 118 LEU H 1 118 LEU MD2 3.440 . 5.080 3.973 2.569 4.323 . 0 0 "[ . 1 . 2]" 1
741 1 30 GLU H 1 31 SER H 2.730 . 3.670 2.872 2.714 2.986 . 0 0 "[ . 1 . 2]" 1
742 1 34 ASP H 1 34 ASP HB3 2.620 . 3.440 2.775 2.432 3.302 . 0 0 "[ . 1 . 2]" 1
743 1 34 ASP H 1 34 ASP HB2 2.580 . 3.360 2.451 2.089 2.719 . 0 0 "[ . 1 . 2]" 1
744 1 79 ASP HB2 1 80 ASP H 2.920 . 4.040 3.968 3.628 4.162 0.122 9 0 "[ . 1 . 2]" 1
745 1 83 LEU H 1 121 LEU MD2 3.160 . 4.510 2.983 2.393 4.610 0.100 20 0 "[ . 1 . 2]" 1
746 1 91 LEU HA 1 93 ASP H 3.350 . 4.900 4.743 4.567 4.915 0.015 4 0 "[ . 1 . 2]" 1
747 1 110 ARG QB 1 110 ARG QD 2.340 . 2.890 2.536 1.947 2.909 0.019 10 0 "[ . 1 . 2]" 1
748 1 59 LEU QD 1 60 ASN HD21 3.650 . 5.500 4.982 4.389 5.630 0.130 16 0 "[ . 1 . 2]" 1
749 1 109 GLN HA 1 112 GLN H 3.080 . 4.360 3.156 2.954 3.415 . 0 0 "[ . 1 . 2]" 1
750 1 66 ILE MD 1 66 ILE MG 2.350 . 2.900 2.007 1.944 2.108 . 0 0 "[ . 1 . 2]" 1
751 1 66 ILE HA 1 66 ILE MG 2.670 . 3.540 2.399 2.337 2.462 . 0 0 "[ . 1 . 2]" 1
752 1 21 ASP HA 1 23 ALA H 3.340 . 4.880 4.710 4.388 4.955 0.075 4 0 "[ . 1 . 2]" 1
753 1 55 VAL H 1 57 LEU H 3.060 . 4.320 4.097 3.748 4.309 . 0 0 "[ . 1 . 2]" 1
754 1 121 LEU HA 1 121 LEU HG 2.710 . 3.620 2.776 2.178 3.766 0.146 9 0 "[ . 1 . 2]" 1
755 1 66 ILE HB 1 67 ALA H 2.730 . 3.670 2.556 2.430 2.643 . 0 0 "[ . 1 . 2]" 1
756 1 57 LEU H 1 59 LEU H 3.000 . 4.200 4.228 4.085 4.308 0.108 18 0 "[ . 1 . 2]" 1
757 1 40 LEU MD1 1 98 PHE QE 3.010 . 4.220 3.215 2.654 3.737 . 0 0 "[ . 1 . 2]" 1
758 1 12 MET H 1 12 MET QB 2.650 . 3.490 3.169 2.323 3.519 0.029 5 0 "[ . 1 . 2]" 1
759 1 22 VAL MG2 1 131 MET ME 2.700 . 3.600 3.175 1.785 3.638 0.038 4 0 "[ . 1 . 2]" 1
760 1 100 SER H 1 101 TYR H 3.160 . 4.520 4.419 4.094 4.602 0.082 3 0 "[ . 1 . 2]" 1
761 1 37 ILE H 1 38 ALA MB 3.180 . 4.560 4.489 4.415 4.569 0.009 1 0 "[ . 1 . 2]" 1
762 1 52 THR MG 1 53 SER H 2.950 . 4.110 4.271 4.097 4.430 0.320 9 0 "[ . 1 . 2]" 1
763 1 117 ARG HB3 1 117 ARG HD2 2.700 . 3.610 3.587 2.397 3.837 0.227 10 0 "[ . 1 . 2]" 1
764 1 71 MET HB2 1 71 MET HG3 2.290 . 2.780 2.616 2.276 2.869 0.089 18 0 "[ . 1 . 2]" 1
765 1 19 ARG HA 1 19 ARG QD 2.930 . 4.070 4.136 3.462 4.395 0.325 5 0 "[ . 1 . 2]" 1
766 1 85 GLU HA 1 85 GLU HG3 2.500 . 3.190 2.671 2.092 3.503 0.313 9 0 "[ . 1 . 2]" 1
767 1 88 GLU HA 1 88 GLU HG2 2.800 . 3.800 2.557 2.256 2.884 . 0 0 "[ . 1 . 2]" 1
768 1 28 LEU MD1 1 66 ILE HA 2.950 . 4.110 3.453 2.055 4.164 0.054 7 0 "[ . 1 . 2]" 1
769 1 33 TYR H 1 33 TYR HB2 2.640 . 3.480 2.390 2.104 2.655 . 0 0 "[ . 1 . 2]" 1
770 1 110 ARG HA 1 110 ARG QD 2.690 . 3.580 2.781 1.978 3.820 0.240 20 0 "[ . 1 . 2]" 1
771 1 68 SER H 1 69 PHE HB3 3.450 . 5.110 5.021 4.786 5.256 0.146 4 0 "[ . 1 . 2]" 1
772 1 33 TYR HB3 1 34 ASP H 2.700 . 3.610 2.577 2.347 2.764 . 0 0 "[ . 1 . 2]" 1
773 1 19 ARG HA 1 19 ARG HG2 2.790 . 3.770 3.438 2.737 3.916 0.146 2 0 "[ . 1 . 2]" 1
774 1 22 VAL H 1 24 GLN H 3.320 . 4.830 4.198 4.044 4.395 . 0 0 "[ . 1 . 2]" 1
775 1 108 LEU HG 1 112 GLN HE22 3.250 . 4.710 3.732 3.463 3.990 . 0 0 "[ . 1 . 2]" 1
776 1 62 LEU QB 1 62 LEU MD1 2.850 . 3.900 2.091 1.969 2.591 . 0 0 "[ . 1 . 2]" 1
777 1 117 ARG HD2 1 117 ARG HG2 2.360 . 2.920 2.626 2.370 3.009 0.089 9 0 "[ . 1 . 2]" 1
778 1 114 THR H 1 116 GLU H 3.140 . 4.470 4.390 4.045 4.557 0.087 15 0 "[ . 1 . 2]" 1
779 1 39 THR H 1 39 THR MG 2.870 . 3.940 3.368 1.958 3.797 . 0 0 "[ . 1 . 2]" 1
780 1 94 THR MG 1 95 TYR H 3.160 . 4.520 3.653 3.494 3.969 . 0 0 "[ . 1 . 2]" 1
781 1 54 ALA H 1 54 ALA MB 2.670 . 3.550 2.270 2.248 2.298 . 0 0 "[ . 1 . 2]" 1
782 1 23 ALA H 1 24 GLN H 2.850 . 3.900 2.841 2.762 2.946 . 0 0 "[ . 1 . 2]" 1
783 1 27 PHE H 1 27 PHE HB2 2.670 . 3.530 2.465 2.143 3.538 0.008 3 0 "[ . 1 . 2]" 1
784 1 107 GLU H 1 107 GLU HB2 2.820 . 3.840 2.730 2.171 3.517 . 0 0 "[ . 1 . 2]" 1
785 1 22 VAL MG1 1 130 LEU MD2 2.650 . 3.490 2.629 1.740 3.512 0.060 3 0 "[ . 1 . 2]" 1
786 1 110 ARG H 1 111 TRP H 2.820 . 3.840 2.767 2.429 2.890 . 0 0 "[ . 1 . 2]" 1
787 1 75 ILE HB 1 75 ILE MD 2.430 . 3.070 2.534 2.290 3.185 0.115 16 0 "[ . 1 . 2]" 1
788 1 59 LEU HA 1 59 LEU HG 2.710 . 3.630 2.908 2.565 3.671 0.041 13 0 "[ . 1 . 2]" 1
789 1 16 SER H 1 16 SER QB 2.930 . 4.050 2.850 2.329 3.332 . 0 0 "[ . 1 . 2]" 1
790 1 86 LEU H 1 89 GLU H 3.430 . 5.050 4.551 4.410 4.705 . 0 0 "[ . 1 . 2]" 1
791 1 25 LEU HB2 1 26 LYS H 3.210 . 4.630 3.410 3.174 3.615 . 0 0 "[ . 1 . 2]" 1
792 1 125 GLU QB 1 125 GLU QG 2.100 . 2.400 2.018 1.989 2.062 . 0 0 "[ . 1 . 2]" 1
793 1 125 GLU HA 1 125 GLU QB 2.220 . 2.630 2.383 2.216 2.506 . 0 0 "[ . 1 . 2]" 1
794 1 64 GLU HG3 1 67 ALA MB 3.120 . 4.430 4.528 4.451 4.619 0.189 14 0 "[ . 1 . 2]" 1
795 1 22 VAL HA 1 22 VAL MG1 2.660 . 3.520 2.382 2.251 2.626 . 0 0 "[ . 1 . 2]" 1
796 1 48 VAL MG1 1 102 GLY HA3 3.650 . 5.500 2.609 1.755 3.308 0.045 3 0 "[ . 1 . 2]" 1
797 1 31 SER H 1 31 SER HB3 2.790 . 3.780 3.610 3.568 3.636 . 0 0 "[ . 1 . 2]" 1
798 1 29 CYS HB2 1 30 GLU H 2.860 . 3.920 2.557 2.299 3.686 . 0 0 "[ . 1 . 2]" 1
799 1 36 GLY H 1 38 ALA H 3.180 . 4.570 4.143 3.986 4.320 . 0 0 "[ . 1 . 2]" 1
800 1 36 GLY HA3 1 38 ALA H 3.330 . 4.850 4.649 4.495 4.804 . 0 0 "[ . 1 . 2]" 1
801 1 29 CYS HB3 1 30 GLU H 3.040 . 4.290 3.356 2.385 3.678 . 0 0 "[ . 1 . 2]" 1
802 1 37 ILE HA 1 37 ILE MD 2.440 . 3.090 2.072 1.865 2.248 . 0 0 "[ . 1 . 2]" 1
803 1 36 GLY HA2 1 59 LEU QD 2.830 . 3.850 2.073 1.728 2.701 0.072 3 0 "[ . 1 . 2]" 1
804 1 62 LEU H 1 64 GLU H 3.290 . 4.790 4.578 4.328 4.779 . 0 0 "[ . 1 . 2]" 1
805 1 66 ILE H 1 67 ALA MB 3.390 . 4.980 4.289 4.138 4.436 . 0 0 "[ . 1 . 2]" 1
806 1 89 GLU H 1 91 LEU H 3.150 . 4.490 4.309 4.083 4.478 . 0 0 "[ . 1 . 2]" 1
807 1 24 GLN HB3 1 24 GLN HE22 3.060 . 4.320 3.671 3.259 4.204 . 0 0 "[ . 1 . 2]" 1
808 1 120 ARG H 1 122 PHE H 3.150 . 4.490 4.194 3.910 4.520 0.030 6 0 "[ . 1 . 2]" 1
809 1 132 LYS HB2 1 132 LYS QE 2.620 . 3.430 3.534 3.454 3.718 0.288 9 0 "[ . 1 . 2]" 1
810 1 97 LEU MD2 1 108 LEU HA 2.850 . 3.900 1.713 1.633 1.882 0.167 12 0 "[ . 1 . 2]" 1
811 1 75 ILE H 1 77 TYR H 2.950 . 4.100 4.022 3.668 4.238 0.138 20 0 "[ . 1 . 2]" 1
812 1 79 ASP H 1 79 ASP HB3 2.510 . 3.220 3.010 2.455 3.304 0.084 9 0 "[ . 1 . 2]" 1
813 1 130 LEU HA 1 130 LEU MD1 2.530 . 3.250 2.687 1.899 3.341 0.091 10 0 "[ . 1 . 2]" 1
814 1 55 VAL HA 1 55 VAL MG2 2.310 . 2.820 2.902 2.379 3.090 0.270 15 0 "[ . 1 . 2]" 1
815 1 86 LEU MD1 1 89 GLU HB2 2.650 . 3.500 2.664 2.224 3.192 . 0 0 "[ . 1 . 2]" 1
816 1 131 MET H 1 131 MET QB 2.610 . 3.420 2.809 2.344 3.023 . 0 0 "[ . 1 . 2]" 1
817 1 102 GLY HA3 1 103 ILE H 2.450 . 3.110 3.137 2.579 3.347 0.237 17 0 "[ . 1 . 2]" 1
818 1 63 ILE HA 1 63 ILE MD 2.820 . 3.840 3.855 3.807 3.885 0.045 9 0 "[ . 1 . 2]" 1
819 1 20 HIS H 1 21 ASP H 2.880 . 3.960 2.757 2.317 3.012 . 0 0 "[ . 1 . 2]" 1
820 1 21 ASP H 1 22 VAL H 2.680 . 3.560 2.828 2.612 3.050 . 0 0 "[ . 1 . 2]" 1
821 1 72 SER H 1 75 ILE MD 3.310 . 4.820 4.257 3.270 4.809 . 0 0 "[ . 1 . 2]" 1
822 1 94 THR H 1 94 THR HB 2.640 . 3.470 2.856 2.732 3.011 . 0 0 "[ . 1 . 2]" 1
823 1 67 ALA H 1 67 ALA MB 2.490 . 3.180 2.263 2.247 2.278 . 0 0 "[ . 1 . 2]" 1
824 1 91 LEU HA 1 94 THR H 3.310 . 4.820 3.778 3.596 4.055 . 0 0 "[ . 1 . 2]" 1
825 1 70 VAL MG1 1 74 LYS QE 2.540 . 3.280 3.015 1.988 3.382 0.102 4 0 "[ . 1 . 2]" 1
826 1 99 SER H 1 99 SER HB3 2.580 . 3.370 3.545 3.477 3.589 0.219 3 0 "[ . 1 . 2]" 1
827 1 99 SER H 1 99 SER HB2 2.520 . 3.240 2.333 2.241 2.608 . 0 0 "[ . 1 . 2]" 1
828 1 29 CYS H 1 29 CYS HB2 2.500 . 3.200 2.508 2.338 2.669 . 0 0 "[ . 1 . 2]" 1
829 1 80 ASP HB2 1 82 ASP H 3.400 . 5.000 5.182 4.885 5.315 0.315 12 0 "[ . 1 . 2]" 1
830 1 80 ASP HA 1 82 ASP H 2.750 . 3.690 3.667 3.100 3.798 0.108 18 0 "[ . 1 . 2]" 1
831 1 111 TRP HB2 1 112 GLN H 3.080 . 4.350 3.603 3.376 3.863 . 0 0 "[ . 1 . 2]" 1
832 1 56 ASN HB2 1 57 LEU H 3.110 . 4.420 3.310 2.481 3.711 . 0 0 "[ . 1 . 2]" 1
833 1 28 LEU QB 1 28 LEU MD1 2.650 . 3.490 2.282 2.068 2.448 . 0 0 "[ . 1 . 2]" 1
834 1 119 PHE HA 1 119 PHE QD 2.700 . 3.610 2.835 2.512 3.053 . 0 0 "[ . 1 . 2]" 1
835 1 31 SER H 1 31 SER HB2 2.530 . 3.260 2.691 2.544 2.775 . 0 0 "[ . 1 . 2]" 1
836 1 127 ILE MG 1 128 SER HA 2.840 . 3.870 3.545 3.128 3.867 . 0 0 "[ . 1 . 2]" 1
837 1 125 GLU QB 1 126 TYR QE 2.720 . 3.640 3.074 2.724 3.444 . 0 0 "[ . 1 . 2]" 1
838 1 94 THR H 1 94 THR MG 3.020 . 4.240 3.714 3.626 3.749 . 0 0 "[ . 1 . 2]" 1
839 1 54 ALA H 1 55 VAL H 2.760 . 3.710 2.980 2.812 3.134 . 0 0 "[ . 1 . 2]" 1
840 1 63 ILE MD 1 95 TYR HA 2.830 . 3.860 2.201 1.792 3.150 0.008 3 0 "[ . 1 . 2]" 1
841 1 99 SER H 1 100 SER H 2.400 . 2.990 2.508 2.438 2.618 . 0 0 "[ . 1 . 2]" 1
842 1 70 VAL MG1 1 87 VAL MG1 2.580 . 3.370 3.358 3.104 3.540 0.170 5 0 "[ . 1 . 2]" 1
843 1 35 GLU HG2 1 59 LEU QD 2.870 . 3.940 3.871 3.361 4.043 0.103 16 0 "[ . 1 . 2]" 1
844 1 66 ILE QG 1 66 ILE MG 2.920 . 4.040 2.235 2.194 2.278 . 0 0 "[ . 1 . 2]" 1
845 1 12 MET HA 1 12 MET HG2 2.600 . 3.400 2.758 2.131 3.483 0.083 3 0 "[ . 1 . 2]" 1
846 1 35 GLU HA 1 59 LEU QD 3.090 . 4.380 3.585 3.219 3.853 . 0 0 "[ . 1 . 2]" 1
847 1 58 GLN HE21 1 59 LEU QD 3.650 . 5.500 4.591 3.380 5.418 . 0 0 "[ . 1 . 2]" 1
848 1 19 ARG HB2 1 19 ARG QD 2.400 . 3.000 2.587 1.963 3.151 0.151 5 0 "[ . 1 . 2]" 1
849 1 85 GLU HA 1 85 GLU HG2 2.630 . 3.450 3.560 3.190 3.848 0.398 7 0 "[ . 1 . 2]" 1
850 1 76 LYS H 1 76 LYS QE 3.440 . 5.090 4.573 3.761 4.994 . 0 0 "[ . 1 . 2]" 1
851 1 73 PHE QD 1 74 LYS H 2.880 . 3.950 3.782 2.566 4.048 0.098 12 0 "[ . 1 . 2]" 1
852 1 115 LYS H 1 116 GLU HG2 3.250 . 4.700 4.499 3.950 4.854 0.154 19 0 "[ . 1 . 2]" 1
853 1 39 THR MG 1 40 LEU HA 2.800 . 3.790 3.812 3.570 3.909 0.119 13 0 "[ . 1 . 2]" 1
854 1 64 GLU HB3 1 64 GLU HG3 2.350 . 2.900 2.895 2.481 2.987 0.087 11 0 "[ . 1 . 2]" 1
855 1 92 ASP H 1 92 ASP HB3 2.330 . 2.860 2.871 2.645 3.008 0.148 10 0 "[ . 1 . 2]" 1
856 1 47 TRP HB3 1 48 VAL H 3.340 . 4.880 2.353 1.907 3.026 . 0 0 "[ . 1 . 2]" 1
857 1 73 PHE H 1 74 LYS H 2.990 . 4.180 2.936 2.749 3.167 . 0 0 "[ . 1 . 2]" 1
858 1 114 THR HA 1 117 ARG HD3 2.700 . 3.600 2.578 1.779 3.796 0.196 11 0 "[ . 1 . 2]" 1
859 1 88 GLU H 1 88 GLU HG3 2.530 . 3.250 2.355 2.010 2.859 . 0 0 "[ . 1 . 2]" 1
860 1 38 ALA H 1 39 THR H 2.660 . 3.510 2.819 2.718 2.951 . 0 0 "[ . 1 . 2]" 1
861 1 19 ARG HA 1 19 ARG HG3 2.790 . 3.770 3.312 2.164 3.988 0.218 12 0 "[ . 1 . 2]" 1
862 1 63 ILE MG 1 64 GLU HG2 3.080 . 4.360 3.547 2.755 4.167 . 0 0 "[ . 1 . 2]" 1
863 1 14 GLU QB 1 15 TYR H 2.930 . 4.070 3.255 1.973 3.922 . 0 0 "[ . 1 . 2]" 1
864 1 85 GLU HA 1 88 GLU H 3.090 . 4.370 3.595 3.080 4.367 . 0 0 "[ . 1 . 2]" 1
865 1 78 PRO HA 1 80 ASP H 2.980 . 4.170 3.868 3.282 4.429 0.259 14 0 "[ . 1 . 2]" 1
866 1 133 THR H 1 133 THR MG 2.440 . 3.090 2.123 1.773 2.799 0.027 14 0 "[ . 1 . 2]" 1
867 1 129 THR MG 1 130 LEU H 2.960 . 4.120 3.952 2.083 4.195 0.075 4 0 "[ . 1 . 2]" 1
868 1 89 GLU QB 1 90 TYR H 2.520 . 3.230 2.331 2.127 2.593 . 0 0 "[ . 1 . 2]" 1
869 1 89 GLU QG 1 90 TYR H 3.280 . 4.770 4.087 3.839 4.415 . 0 0 "[ . 1 . 2]" 1
870 1 107 GLU H 1 107 GLU HB3 2.610 . 3.420 3.469 3.157 3.580 0.160 20 0 "[ . 1 . 2]" 1
871 1 12 MET H 1 12 MET HG2 3.130 . 4.460 4.298 3.394 5.331 0.871 9 3 "[* .- +1 . 2]" 1
872 1 86 LEU HB2 1 118 LEU MD1 2.830 . 3.850 3.278 2.545 3.889 0.039 7 0 "[ . 1 . 2]" 1
873 1 86 LEU HB3 1 118 LEU MD1 2.910 . 4.020 2.042 1.645 2.752 0.155 20 0 "[ . 1 . 2]" 1
874 1 60 ASN HA 1 63 ILE H 2.750 . 3.690 3.624 3.420 3.766 0.076 4 0 "[ . 1 . 2]" 1
875 1 55 VAL MG1 1 58 GLN HE22 3.080 . 4.350 4.000 2.881 4.488 0.138 6 0 "[ . 1 . 2]" 1
876 1 33 TYR HB2 1 34 ASP H 3.060 . 4.320 3.723 3.310 4.014 . 0 0 "[ . 1 . 2]" 1
877 1 67 ALA MB 1 68 SER H 2.570 . 3.350 2.225 2.114 2.364 . 0 0 "[ . 1 . 2]" 1
878 1 87 VAL H 1 87 VAL MG2 2.550 . 3.310 2.024 1.869 2.244 . 0 0 "[ . 1 . 2]" 1
879 1 80 ASP HB3 1 81 GLY H 2.980 . 4.170 4.269 3.932 4.496 0.326 6 0 "[ . 1 . 2]" 1
880 1 61 ASP H 1 61 ASP HB3 2.540 . 3.270 2.503 2.320 2.834 . 0 0 "[ . 1 . 2]" 1
881 1 90 TYR HD2 1 91 LEU H 3.300 . 4.800 4.378 3.293 5.293 0.493 7 0 "[ . 1 . 2]" 1
882 1 82 ASP H 1 82 ASP QB 2.280 . 2.750 2.252 2.093 2.828 0.078 1 0 "[ . 1 . 2]" 1
883 1 63 ILE MD 1 95 TYR HB2 3.020 . 4.250 2.344 1.797 3.323 0.003 19 0 "[ . 1 . 2]" 1
884 1 59 LEU QD 1 63 ILE MD 2.830 . 3.860 3.765 3.106 3.953 0.093 9 0 "[ . 1 . 2]" 1
885 1 39 THR H 1 39 THR HB 2.460 . 3.120 2.698 2.604 2.882 . 0 0 "[ . 1 . 2]" 1
886 1 116 GLU H 1 116 GLU QB 2.310 . 2.820 2.628 2.427 2.878 0.058 1 0 "[ . 1 . 2]" 1
887 1 87 VAL HA 1 90 TYR H 3.160 . 4.510 3.410 3.236 3.583 . 0 0 "[ . 1 . 2]" 1
888 1 96 THR HA 1 96 THR MG 2.690 . 3.580 2.362 2.258 2.453 . 0 0 "[ . 1 . 2]" 1
889 1 19 ARG HB3 1 19 ARG QD 2.850 . 3.890 2.391 1.900 3.226 . 0 0 "[ . 1 . 2]" 1
890 1 97 LEU MD1 1 108 LEU QB 2.790 . 3.780 2.297 1.898 2.616 . 0 0 "[ . 1 . 2]" 1
891 1 91 LEU HA 1 94 THR HB 2.870 . 3.940 3.027 2.654 3.564 . 0 0 "[ . 1 . 2]" 1
892 1 116 GLU HA 1 116 GLU HG2 2.880 . 3.950 3.158 2.629 3.811 . 0 0 "[ . 1 . 2]" 1
893 1 34 ASP HA 1 37 ILE H 2.810 . 3.820 3.723 3.447 3.906 0.086 17 0 "[ . 1 . 2]" 1
894 1 67 ALA MB 1 71 MET H 3.460 . 5.130 4.570 4.233 4.940 . 0 0 "[ . 1 . 2]" 1
895 1 40 LEU HA 1 103 ILE MD 2.960 . 4.120 3.448 2.886 4.182 0.062 18 0 "[ . 1 . 2]" 1
896 1 119 PHE HA 1 122 PHE H 2.870 . 3.940 3.059 2.519 3.466 . 0 0 "[ . 1 . 2]" 1
897 1 25 LEU H 1 69 PHE QD 3.390 . 4.970 4.619 4.340 5.004 0.034 2 0 "[ . 1 . 2]" 1
898 1 132 LYS QE 1 132 LYS HG3 2.350 . 2.910 2.185 1.927 2.991 0.081 9 0 "[ . 1 . 2]" 1
899 1 63 ILE MG 1 95 TYR HB3 2.840 . 3.880 3.417 2.430 3.903 0.023 17 0 "[ . 1 . 2]" 1
900 1 70 VAL HA 1 70 VAL MG1 2.530 . 3.250 2.449 2.354 2.633 . 0 0 "[ . 1 . 2]" 1
901 1 87 VAL HA 1 87 VAL MG1 2.680 . 3.560 2.369 2.281 2.540 . 0 0 "[ . 1 . 2]" 1
902 1 59 LEU HA 1 62 LEU MD2 2.640 . 3.470 3.139 1.803 3.715 0.245 8 0 "[ . 1 . 2]" 1
903 1 30 GLU HA 1 30 GLU HG3 2.760 . 3.720 3.274 2.980 3.620 . 0 0 "[ . 1 . 2]" 1
904 1 82 ASP QB 1 84 SER H 3.510 . 5.230 4.836 4.596 5.250 0.020 1 0 "[ . 1 . 2]" 1
905 1 97 LEU MD1 1 107 GLU HB2 2.790 . 3.780 2.121 1.762 2.535 0.038 16 0 "[ . 1 . 2]" 1
906 1 102 GLY H 1 103 ILE MD 3.370 . 4.940 4.813 3.473 5.064 0.124 16 0 "[ . 1 . 2]" 1
907 1 36 GLY HA3 1 59 LEU QD 2.550 . 3.290 2.854 2.648 3.315 0.025 18 0 "[ . 1 . 2]" 1
908 1 60 ASN QB 1 61 ASP H 2.600 . 3.410 2.864 2.486 3.557 0.147 7 0 "[ . 1 . 2]" 1
909 1 66 ILE MG 1 70 VAL H 3.020 . 4.250 3.570 3.363 3.739 . 0 0 "[ . 1 . 2]" 1
910 1 63 ILE MG 1 64 GLU HA 3.040 . 4.280 3.249 3.099 3.433 . 0 0 "[ . 1 . 2]" 1
911 1 132 LYS QE 1 132 LYS HG2 2.400 . 2.990 3.055 2.270 3.227 0.237 11 0 "[ . 1 . 2]" 1
912 1 32 LEU MD1 1 59 LEU QD 2.390 . 2.980 2.353 1.803 2.991 0.011 11 0 "[ . 1 . 2]" 1
913 1 64 GLU QB 1 65 HIS H 2.590 . 3.380 2.572 2.397 2.789 . 0 0 "[ . 1 . 2]" 1
914 1 52 THR H 1 53 SER HB3 3.260 . 4.720 4.586 4.304 4.891 0.171 15 0 "[ . 1 . 2]" 1
915 1 114 THR HB 1 115 LYS H 2.640 . 3.470 2.614 2.434 2.828 . 0 0 "[ . 1 . 2]" 1
916 1 40 LEU MD2 1 103 ILE MG 2.310 . 2.820 1.918 1.732 2.295 0.068 3 0 "[ . 1 . 2]" 1
917 1 22 VAL HA 1 22 VAL MG2 2.600 . 3.410 2.449 2.178 2.580 . 0 0 "[ . 1 . 2]" 1
918 1 35 GLU QB 1 35 GLU HG3 2.410 . 3.010 2.144 2.117 2.196 . 0 0 "[ . 1 . 2]" 1
919 1 35 GLU HA 1 35 GLU HG2 2.790 . 3.780 3.062 2.700 3.615 . 0 0 "[ . 1 . 2]" 1
920 1 15 TYR HA 1 15 TYR QD 2.650 . 3.490 2.682 2.009 3.440 . 0 0 "[ . 1 . 2]" 1
921 1 68 SER HA 1 71 MET H 2.870 . 3.940 3.411 3.078 3.843 . 0 0 "[ . 1 . 2]" 1
922 1 75 ILE MG 1 76 LYS HA 2.760 . 3.720 3.655 3.054 3.792 0.072 20 0 "[ . 1 . 2]" 1
923 1 72 SER HA 1 75 ILE MG 2.950 . 4.100 4.045 3.393 4.179 0.079 10 0 "[ . 1 . 2]" 1
924 1 83 LEU HA 1 121 LEU MD2 2.510 . 3.210 1.879 1.633 2.499 0.167 18 0 "[ . 1 . 2]" 1
925 1 56 ASN H 1 57 LEU HA 3.630 . 5.450 5.415 5.353 5.493 0.043 20 0 "[ . 1 . 2]" 1
926 1 74 LYS HD3 1 74 LYS QE 2.310 . 2.820 2.332 2.157 2.532 . 0 0 "[ . 1 . 2]" 1
927 1 123 SER H 1 124 GLY H 2.560 . 3.330 2.789 2.450 3.063 . 0 0 "[ . 1 . 2]" 1
928 1 122 PHE H 1 122 PHE HB3 2.880 . 3.960 3.579 3.530 3.630 . 0 0 "[ . 1 . 2]" 1
929 1 122 PHE H 1 122 PHE HB2 2.830 . 3.860 2.339 2.234 2.487 . 0 0 "[ . 1 . 2]" 1
930 1 110 ARG HA 1 110 ARG HG3 2.730 . 3.670 3.349 2.070 3.758 0.088 5 0 "[ . 1 . 2]" 1
931 1 42 ASP H 1 42 ASP HA 2.310 . 2.830 2.879 2.615 2.935 0.105 2 0 "[ . 1 . 2]" 1
932 1 70 VAL MG1 1 74 LYS HD3 2.790 . 3.770 2.474 1.701 3.838 0.099 16 0 "[ . 1 . 2]" 1
933 1 94 THR HB 1 95 TYR H 2.690 . 3.590 2.367 2.216 2.659 . 0 0 "[ . 1 . 2]" 1
934 1 53 SER HA 1 54 ALA H 2.580 . 3.370 2.251 2.127 2.377 . 0 0 "[ . 1 . 2]" 1
935 1 96 THR MG 1 97 LEU MD1 3.140 . 4.470 4.008 3.431 4.502 0.032 4 0 "[ . 1 . 2]" 1
936 1 112 GLN H 1 114 THR H 3.280 . 4.760 4.272 4.051 4.444 . 0 0 "[ . 1 . 2]" 1
937 1 132 LYS QD 1 132 LYS QE 2.100 . 2.400 2.016 1.980 2.082 . 0 0 "[ . 1 . 2]" 1
938 1 37 ILE H 1 39 THR H 3.120 . 4.430 4.302 4.162 4.479 0.049 8 0 "[ . 1 . 2]" 1
939 1 14 GLU H 1 15 TYR H 3.650 . 5.500 3.647 2.512 4.475 . 0 0 "[ . 1 . 2]" 1
940 1 132 LYS QG 1 133 THR H 3.030 . 4.270 3.493 2.016 4.288 0.018 16 0 "[ . 1 . 2]" 1
941 1 86 LEU HA 1 89 GLU HB3 2.870 . 3.930 3.725 2.771 4.046 0.116 13 0 "[ . 1 . 2]" 1
942 1 93 ASP H 1 93 ASP QB 2.390 . 2.970 2.311 2.098 2.550 . 0 0 "[ . 1 . 2]" 1
943 1 124 GLY H 1 125 GLU H 2.960 . 4.120 2.124 1.967 2.566 . 0 0 "[ . 1 . 2]" 1
944 1 47 TRP HE3 1 48 VAL MG2 3.010 . 4.220 3.592 2.223 4.232 0.012 6 0 "[ . 1 . 2]" 1
945 1 67 ALA HA 1 91 LEU MD1 2.470 . 3.140 2.073 1.819 2.433 . 0 0 "[ . 1 . 2]" 1
946 1 98 PHE HA 1 98 PHE QD 2.570 . 3.350 2.351 2.013 2.755 . 0 0 "[ . 1 . 2]" 1
947 1 84 SER H 1 87 VAL MG2 3.490 . 5.190 4.068 3.613 4.416 . 0 0 "[ . 1 . 2]" 1
948 1 94 THR HA 1 111 TRP HE1 2.860 . 3.920 2.904 2.577 3.142 . 0 0 "[ . 1 . 2]" 1
949 1 97 LEU MD2 1 108 LEU H 3.490 . 5.180 3.317 2.711 4.012 . 0 0 "[ . 1 . 2]" 1
950 1 54 ALA MB 1 55 VAL H 2.520 . 3.240 2.478 2.196 2.848 . 0 0 "[ . 1 . 2]" 1
951 1 16 SER H 1 16 SER HB3 2.720 . 3.640 3.605 2.913 3.883 0.243 13 0 "[ . 1 . 2]" 1
952 1 16 SER H 1 16 SER HB2 2.930 . 4.050 3.093 2.366 4.078 0.028 8 0 "[ . 1 . 2]" 1
953 1 113 LYS HA 1 115 LYS H 3.210 . 4.630 4.568 4.302 4.686 0.056 11 0 "[ . 1 . 2]" 1
954 1 40 LEU HG 1 103 ILE MD 3.060 . 4.310 4.013 3.720 4.326 0.016 13 0 "[ . 1 . 2]" 1
955 1 97 LEU MD2 1 108 LEU MD2 3.150 . 4.490 4.494 3.976 4.625 0.135 15 0 "[ . 1 . 2]" 1
956 1 105 ASP HB2 1 106 PRO HD3 3.290 . 4.790 3.175 1.710 4.207 0.090 2 0 "[ . 1 . 2]" 1
957 1 105 ASP HB2 1 106 PRO HD2 3.200 . 4.600 3.766 2.503 4.641 0.041 8 0 "[ . 1 . 2]" 1
958 1 105 ASP HB3 1 106 PRO HD3 3.320 . 4.840 2.929 1.765 4.340 0.035 15 0 "[ . 1 . 2]" 1
959 1 105 ASP HB3 1 106 PRO HD2 3.220 . 4.650 3.582 1.880 4.735 0.085 8 0 "[ . 1 . 2]" 1
960 1 94 THR H 1 111 TRP HE1 3.070 . 4.340 3.036 2.416 3.540 . 0 0 "[ . 1 . 2]" 1
961 1 66 ILE MG 1 70 VAL MG2 2.770 . 3.740 2.045 1.872 2.213 . 0 0 "[ . 1 . 2]" 1
962 1 89 GLU HA 1 89 GLU HG2 2.570 . 3.340 2.458 2.101 3.460 0.120 14 0 "[ . 1 . 2]" 1
963 1 61 ASP H 1 61 ASP HB2 2.410 . 3.010 2.583 2.192 2.738 . 0 0 "[ . 1 . 2]" 1
964 1 31 SER HB2 1 32 LEU H 2.830 . 3.850 2.400 2.169 2.589 . 0 0 "[ . 1 . 2]" 1
965 1 27 PHE H 1 28 LEU H 2.910 . 4.020 2.949 2.835 3.026 . 0 0 "[ . 1 . 2]" 1
966 1 121 LEU MD2 1 126 TYR QE 3.060 . 4.310 2.083 1.642 3.622 0.158 14 0 "[ . 1 . 2]" 1
967 1 48 VAL HA 1 48 VAL MG1 2.330 . 2.870 2.284 2.192 2.389 . 0 0 "[ . 1 . 2]" 1
968 1 68 SER QB 1 69 PHE H 3.010 . 4.230 2.967 2.506 3.403 . 0 0 "[ . 1 . 2]" 1
969 1 72 SER HA 1 75 ILE HB 2.630 . 3.450 2.975 2.084 3.281 . 0 0 "[ . 1 . 2]" 1
970 1 90 TYR H 1 114 THR MG 3.020 . 4.250 2.506 2.193 3.086 . 0 0 "[ . 1 . 2]" 1
971 1 65 HIS H 1 66 ILE HB 3.650 . 5.500 5.106 4.950 5.280 . 0 0 "[ . 1 . 2]" 1
972 1 53 SER H 1 54 ALA H 3.290 . 4.790 4.616 4.537 4.669 . 0 0 "[ . 1 . 2]" 1
973 1 55 VAL HA 1 58 GLN HE21 3.360 . 4.920 2.392 1.916 2.996 . 0 0 "[ . 1 . 2]" 1
974 1 77 TYR H 1 78 PRO HD3 3.260 . 4.720 3.949 2.900 4.692 . 0 0 "[ . 1 . 2]" 1
975 1 89 GLU HA 1 89 GLU HG3 2.720 . 3.640 3.140 2.149 3.642 0.002 11 0 "[ . 1 . 2]" 1
976 1 89 GLU H 1 89 GLU QB 2.250 . 2.700 2.304 2.050 2.503 . 0 0 "[ . 1 . 2]" 1
977 1 89 GLU H 1 89 GLU QG 2.980 . 4.160 2.781 2.158 3.907 . 0 0 "[ . 1 . 2]" 1
978 1 73 PHE H 1 73 PHE QB 2.730 . 3.660 2.144 2.034 2.270 . 0 0 "[ . 1 . 2]" 1
979 1 50 ASP HB2 1 52 THR H 3.520 . 5.240 4.456 3.698 5.183 . 0 0 "[ . 1 . 2]" 1
980 1 68 SER H 1 68 SER QB 2.300 . 2.800 2.736 2.392 2.885 0.085 14 0 "[ . 1 . 2]" 1
981 1 63 ILE MD 1 94 THR HB 2.930 . 4.070 2.290 1.827 2.807 . 0 0 "[ . 1 . 2]" 1
982 1 55 VAL HA 1 55 VAL MG1 2.570 . 3.350 2.427 2.148 3.228 . 0 0 "[ . 1 . 2]" 1
983 1 22 VAL HA 1 25 LEU MD2 3.000 . 4.210 3.637 3.315 3.974 . 0 0 "[ . 1 . 2]" 1
984 1 25 LEU HB3 1 69 PHE QE 3.650 . 5.500 3.969 3.511 4.472 . 0 0 "[ . 1 . 2]" 1
985 1 60 ASN QB 1 60 ASN HD21 2.540 . 3.280 2.246 2.048 2.490 . 0 0 "[ . 1 . 2]" 1
986 1 118 LEU HA 1 121 LEU H 2.810 . 3.810 3.585 3.343 3.873 0.063 20 0 "[ . 1 . 2]" 1
987 1 57 LEU HA 1 60 ASN HD21 3.320 . 4.840 2.744 2.019 3.341 . 0 0 "[ . 1 . 2]" 1
988 1 90 TYR HA 1 90 TYR QD 2.910 . 4.020 2.151 1.790 3.642 0.010 15 0 "[ . 1 . 2]" 1
989 1 104 ASN QB 1 104 ASN HD22 2.660 . 3.510 3.293 3.226 3.459 . 0 0 "[ . 1 . 2]" 1
990 1 65 HIS H 1 67 ALA MB 3.290 . 4.790 4.495 4.404 4.613 . 0 0 "[ . 1 . 2]" 1
991 1 39 THR HB 1 55 VAL HB 2.700 . 3.600 3.636 3.583 3.687 0.087 1 0 "[ . 1 . 2]" 1
992 1 119 PHE H 1 122 PHE H 3.440 . 5.090 4.620 4.480 4.905 . 0 0 "[ . 1 . 2]" 1
993 1 81 GLY H 1 81 GLY QA 2.230 . 2.650 2.170 2.147 2.199 . 0 0 "[ . 1 . 2]" 1
994 1 71 MET QB 1 73 PHE H 3.230 . 4.670 4.555 4.459 4.704 0.034 1 0 "[ . 1 . 2]" 1
995 1 79 ASP H 1 81 GLY H 3.320 . 4.840 4.407 3.916 4.808 . 0 0 "[ . 1 . 2]" 1
996 1 126 TYR H 1 126 TYR QB 2.600 . 3.400 2.869 2.410 3.034 . 0 0 "[ . 1 . 2]" 1
997 1 86 LEU MD1 1 89 GLU HB3 3.050 . 4.300 3.195 2.345 3.627 . 0 0 "[ . 1 . 2]" 1
998 1 55 VAL HA 1 58 GLN HB2 2.560 . 3.320 2.289 1.911 2.708 . 0 0 "[ . 1 . 2]" 1
999 1 25 LEU HA 1 69 PHE QE 3.030 . 4.260 2.715 1.780 3.840 0.020 2 0 "[ . 1 . 2]" 1
1000 1 104 ASN QB 1 104 ASN HD21 2.570 . 3.340 2.244 2.095 2.707 . 0 0 "[ . 1 . 2]" 1
1001 1 78 PRO HG2 1 80 ASP H 3.420 . 5.040 4.972 4.221 5.135 0.095 11 0 "[ . 1 . 2]" 1
1002 1 132 LYS HB3 1 133 THR MG 2.730 . 3.670 3.442 2.823 3.772 0.102 13 0 "[ . 1 . 2]" 1
1003 1 26 LYS H 1 27 PHE H 2.710 . 3.630 2.826 2.604 2.983 . 0 0 "[ . 1 . 2]" 1
1004 1 125 GLU H 1 125 GLU QG 3.020 . 4.240 2.520 1.712 3.102 0.088 9 0 "[ . 1 . 2]" 1
1005 1 22 VAL MG2 1 130 LEU MD2 2.770 . 3.730 1.779 1.658 1.872 0.142 14 0 "[ . 1 . 2]" 1
1006 1 22 VAL MG1 1 23 ALA HA 2.880 . 3.950 3.685 3.246 3.981 0.031 11 0 "[ . 1 . 2]" 1
1007 1 14 GLU HA 1 14 GLU HG2 2.720 . 3.650 3.208 2.189 3.852 0.202 14 0 "[ . 1 . 2]" 1
1008 1 87 VAL HA 1 87 VAL MG2 2.700 . 3.600 2.499 2.377 2.587 . 0 0 "[ . 1 . 2]" 1
1009 1 42 ASP H 1 42 ASP HB3 2.550 . 3.290 2.787 2.509 3.217 . 0 0 "[ . 1 . 2]" 1
1010 1 28 LEU MD1 1 66 ILE H 3.350 . 4.900 3.859 3.297 4.724 . 0 0 "[ . 1 . 2]" 1
1011 1 39 THR HB 1 55 VAL MG1 3.010 . 4.230 3.467 1.690 4.151 0.110 17 0 "[ . 1 . 2]" 1
1012 1 88 GLU HA 1 88 GLU HG3 2.860 . 3.910 3.249 2.835 3.794 . 0 0 "[ . 1 . 2]" 1
1013 1 133 THR H 1 133 THR HB 2.280 . 2.760 2.801 2.522 2.986 0.226 17 0 "[ . 1 . 2]" 1
1014 1 58 GLN QB 1 58 GLN HE21 2.900 . 4.000 2.059 1.873 2.368 . 0 0 "[ . 1 . 2]" 1
1015 1 14 GLU H 1 14 GLU HG2 3.350 . 4.890 3.308 2.104 4.686 . 0 0 "[ . 1 . 2]" 1
1016 1 28 LEU MD1 1 66 ILE MD 3.120 . 4.430 2.701 2.027 3.826 . 0 0 "[ . 1 . 2]" 1
1017 1 62 LEU HA 1 62 LEU MD1 2.710 . 3.620 3.525 1.909 3.705 0.085 8 0 "[ . 1 . 2]" 1
1018 1 70 VAL HA 1 73 PHE HB3 2.900 . 4.000 2.436 1.971 3.169 . 0 0 "[ . 1 . 2]" 1
1019 1 74 LYS QB 1 75 ILE HA 3.020 . 4.240 4.004 3.767 4.268 0.028 20 0 "[ . 1 . 2]" 1
1020 1 55 VAL MG2 1 56 ASN HA 3.020 . 4.240 4.177 3.032 4.522 0.282 9 0 "[ . 1 . 2]" 1
1021 1 122 PHE H 1 122 PHE QE 3.290 . 4.780 4.758 4.438 4.888 0.108 11 0 "[ . 1 . 2]" 1
1022 1 100 SER QB 1 101 TYR H 2.690 . 3.580 3.159 2.085 3.617 0.037 12 0 "[ . 1 . 2]" 1
1023 1 91 LEU H 1 92 ASP HA 3.640 . 5.470 5.401 5.320 5.454 . 0 0 "[ . 1 . 2]" 1
1024 1 54 ALA HA 1 57 LEU QD 2.410 . 3.010 2.372 1.899 2.694 . 0 0 "[ . 1 . 2]" 1
1025 1 42 ASP H 1 42 ASP HB2 2.570 . 3.340 2.887 2.378 3.441 0.101 19 0 "[ . 1 . 2]" 1
1026 1 113 LYS HA 1 116 GLU H 2.950 . 4.110 3.539 3.098 3.814 . 0 0 "[ . 1 . 2]" 1
1027 1 83 LEU MD1 1 86 LEU H 3.480 . 5.160 4.784 4.157 5.185 0.025 10 0 "[ . 1 . 2]" 1
1028 1 121 LEU HB2 1 126 TYR QE 2.810 . 3.820 3.475 1.862 4.012 0.192 10 0 "[ . 1 . 2]" 1
1029 1 121 LEU HA 1 126 TYR QE 2.960 . 4.130 3.494 2.749 4.213 0.083 17 0 "[ . 1 . 2]" 1
1030 1 80 ASP HB2 1 83 LEU H 3.040 . 4.290 4.049 3.422 4.499 0.209 4 0 "[ . 1 . 2]" 1
1031 1 26 LYS HE3 1 26 LYS QG 2.880 . 3.950 2.816 2.100 3.488 . 0 0 "[ . 1 . 2]" 1
1032 1 50 ASP HA 1 53 SER H 3.650 . 5.500 4.399 4.143 4.713 . 0 0 "[ . 1 . 2]" 1
1033 1 30 GLU HA 1 119 PHE HZ 2.780 . 3.760 2.438 1.744 3.428 0.056 4 0 "[ . 1 . 2]" 1
1034 1 92 ASP HB2 1 93 ASP H 2.560 . 3.320 3.441 3.209 3.567 0.247 6 0 "[ . 1 . 2]" 1
1035 1 86 LEU MD1 1 90 TYR H 3.230 . 4.660 3.318 3.028 3.593 . 0 0 "[ . 1 . 2]" 1
1036 1 63 ILE HA 1 63 ILE QG 2.960 . 4.120 2.406 2.323 2.455 . 0 0 "[ . 1 . 2]" 1
1037 1 125 GLU H 1 126 TYR H 3.070 . 4.330 3.344 2.824 4.159 . 0 0 "[ . 1 . 2]" 1
1038 1 67 ALA MB 1 71 MET ME 2.850 . 3.900 2.577 2.033 3.967 0.067 14 0 "[ . 1 . 2]" 1
1039 1 81 GLY QA 1 82 ASP H 2.450 . 3.100 2.779 2.716 2.848 . 0 0 "[ . 1 . 2]" 1
1040 1 63 ILE HB 1 63 ILE MD 2.610 . 3.420 2.301 2.258 2.352 . 0 0 "[ . 1 . 2]" 1
1041 1 65 HIS HA 1 65 HIS HD2 3.100 . 4.390 3.845 2.448 4.532 0.142 18 0 "[ . 1 . 2]" 1
1042 1 93 ASP QB 1 94 THR H 2.970 . 4.150 2.344 2.018 2.739 . 0 0 "[ . 1 . 2]" 1
1043 1 133 THR H 1 133 THR HA 2.290 . 2.770 2.868 2.724 2.917 0.147 7 0 "[ . 1 . 2]" 1
1044 1 39 THR MG 1 55 VAL HB 2.870 . 3.940 2.593 1.762 4.206 0.266 17 0 "[ . 1 . 2]" 1
1045 1 87 VAL MG1 1 88 GLU HA 3.000 . 4.200 3.643 3.286 3.918 . 0 0 "[ . 1 . 2]" 1
1046 1 14 GLU QB 1 14 GLU HG2 2.400 . 2.990 2.292 2.128 2.525 . 0 0 "[ . 1 . 2]" 1
1047 1 27 PHE H 1 27 PHE QB 2.440 . 3.090 2.278 2.115 2.518 . 0 0 "[ . 1 . 2]" 1
1048 1 27 PHE H 1 27 PHE HB3 2.700 . 3.600 3.151 2.194 3.619 0.019 1 0 "[ . 1 . 2]" 1
1049 1 70 VAL MG2 1 87 VAL MG1 2.280 . 2.750 1.858 1.752 2.103 0.048 20 0 "[ . 1 . 2]" 1
1050 1 39 THR H 1 40 LEU HG 3.100 . 4.390 4.342 4.202 4.444 0.054 13 0 "[ . 1 . 2]" 1
1051 1 49 ASN HA 1 50 ASP H 2.490 . 3.180 2.158 2.067 2.348 . 0 0 "[ . 1 . 2]" 1
1052 1 83 LEU MD1 1 87 VAL MG2 2.630 . 3.450 2.914 2.068 3.509 0.059 6 0 "[ . 1 . 2]" 1
1053 1 83 LEU MD1 1 122 PHE QD 3.030 . 4.270 3.028 2.526 3.609 . 0 0 "[ . 1 . 2]" 1
1054 1 66 ILE HA 1 69 PHE H 2.910 . 4.020 3.411 3.271 3.705 . 0 0 "[ . 1 . 2]" 1
1055 1 53 SER HB2 1 54 ALA H 2.900 . 3.990 3.125 2.810 4.200 0.210 15 0 "[ . 1 . 2]" 1
1056 1 97 LEU MD1 1 103 ILE MG 2.810 . 3.810 2.042 1.692 3.510 0.108 7 0 "[ . 1 . 2]" 1
1057 1 57 LEU HA 1 60 ASN QB 2.690 . 3.590 2.664 2.013 3.658 0.068 7 0 "[ . 1 . 2]" 1
1058 1 97 LEU MD1 1 107 GLU H 3.430 . 5.070 3.949 3.652 4.316 . 0 0 "[ . 1 . 2]" 1
1059 1 60 ASN HA 1 60 ASN HD21 3.140 . 4.470 3.746 3.126 4.493 0.023 18 0 "[ . 1 . 2]" 1
1060 1 124 GLY H 1 125 GLU QB 3.080 . 4.350 4.211 3.922 4.462 0.112 9 0 "[ . 1 . 2]" 1
1061 1 109 GLN HE22 1 112 GLN HG2 3.180 . 4.560 4.599 4.524 4.734 0.174 8 0 "[ . 1 . 2]" 1
1062 1 19 ARG QD 1 20 HIS HD2 2.990 . 4.190 3.684 2.378 4.227 0.037 9 0 "[ . 1 . 2]" 1
1063 1 97 LEU MD1 1 100 SER H 3.580 . 5.350 4.805 4.549 5.475 0.125 3 0 "[ . 1 . 2]" 1
1064 1 76 LYS H 1 77 TYR HA 3.650 . 5.500 5.138 4.615 5.355 . 0 0 "[ . 1 . 2]" 1
1065 1 60 ASN H 1 61 ASP HB3 3.290 . 4.790 4.844 4.578 4.976 0.186 5 0 "[ . 1 . 2]" 1
1066 1 74 LYS H 1 76 LYS H 3.140 . 4.470 4.364 4.165 4.537 0.067 3 0 "[ . 1 . 2]" 1
1067 1 48 VAL MG1 1 102 GLY HA2 2.820 . 3.840 2.855 2.001 3.894 0.054 11 0 "[ . 1 . 2]" 1
1068 1 53 SER HA 1 53 SER HB2 2.310 . 2.820 2.451 2.273 2.566 . 0 0 "[ . 1 . 2]" 1
1069 1 36 GLY HA3 1 39 THR H 3.170 . 4.550 4.587 4.519 4.654 0.104 18 0 "[ . 1 . 2]" 1
1070 1 63 ILE MG 1 94 THR HB 3.080 . 4.360 3.447 2.912 4.019 . 0 0 "[ . 1 . 2]" 1
1071 1 71 MET HA 1 74 LYS HD3 2.940 . 4.090 3.489 1.965 4.279 0.189 6 0 "[ . 1 . 2]" 1
1072 1 40 LEU HG 1 98 PHE QE 3.010 . 4.220 2.581 2.065 3.107 . 0 0 "[ . 1 . 2]" 1
1073 1 60 ASN QB 1 60 ASN HD22 2.630 . 3.460 3.292 3.195 3.377 . 0 0 "[ . 1 . 2]" 1
1074 1 94 THR HA 1 94 THR MG 2.780 . 3.750 2.299 2.057 2.396 . 0 0 "[ . 1 . 2]" 1
1075 1 54 ALA HA 1 55 VAL H 2.650 . 3.490 3.538 3.513 3.578 0.088 8 0 "[ . 1 . 2]" 1
1076 1 117 ARG HA 1 120 ARG HG2 2.910 . 4.020 2.630 1.870 3.770 . 0 0 "[ . 1 . 2]" 1
1077 1 63 ILE MG 1 94 THR H 3.460 . 5.120 4.959 4.688 5.230 0.110 5 0 "[ . 1 . 2]" 1
1078 1 90 TYR QB 1 114 THR MG 2.850 . 3.890 2.440 2.016 2.904 . 0 0 "[ . 1 . 2]" 1
1079 1 26 LYS HE2 1 26 LYS QG 2.910 . 4.020 3.002 2.187 3.409 . 0 0 "[ . 1 . 2]" 1
1080 1 90 TYR HA 1 114 THR MG 2.640 . 3.470 2.311 2.040 2.656 . 0 0 "[ . 1 . 2]" 1
1081 1 97 LEU MD2 1 103 ILE MD 3.020 . 4.240 4.181 3.750 4.313 0.073 8 0 "[ . 1 . 2]" 1
1082 1 70 VAL MG1 1 74 LYS HG3 2.980 . 4.160 3.119 2.260 4.195 0.035 20 0 "[ . 1 . 2]" 1
1083 1 46 GLY HA2 1 47 TRP H 2.600 . 3.400 3.247 3.086 3.498 0.098 1 0 "[ . 1 . 2]" 1
1084 1 54 ALA MB 1 55 VAL MG1 3.040 . 4.290 3.928 3.211 4.244 . 0 0 "[ . 1 . 2]" 1
1085 1 68 SER HA 1 71 MET HB2 2.760 . 3.710 2.507 1.952 3.677 . 0 0 "[ . 1 . 2]" 1
1086 1 87 VAL HA 1 90 TYR QD 2.950 . 4.110 3.477 2.217 4.157 0.047 10 0 "[ . 1 . 2]" 1
1087 1 88 GLU H 1 91 LEU H 3.650 . 5.500 4.614 4.500 4.717 . 0 0 "[ . 1 . 2]" 1
1088 1 83 LEU H 1 85 GLU H 3.200 . 4.610 4.239 3.946 4.468 . 0 0 "[ . 1 . 2]" 1
1089 1 20 HIS H 1 20 HIS HB3 2.880 . 3.950 3.519 3.256 3.627 . 0 0 "[ . 1 . 2]" 1
1090 1 89 GLU HB2 1 114 THR MG 2.590 . 3.380 2.579 2.106 3.466 0.086 14 0 "[ . 1 . 2]" 1
1091 1 54 ALA MB 1 57 LEU QD 2.710 . 3.620 3.590 3.244 3.705 0.085 12 0 "[ . 1 . 2]" 1
1092 1 35 GLU H 1 37 ILE H 3.600 . 5.400 4.637 4.323 4.802 . 0 0 "[ . 1 . 2]" 1
1093 1 37 ILE MG 1 38 ALA HA 2.830 . 3.860 3.496 3.339 3.643 . 0 0 "[ . 1 . 2]" 1
1094 1 62 LEU QB 1 62 LEU MD2 2.560 . 3.330 2.067 2.037 2.109 . 0 0 "[ . 1 . 2]" 1
1095 1 80 ASP H 1 81 GLY QA 2.950 . 4.110 4.212 4.086 4.367 0.257 9 0 "[ . 1 . 2]" 1
1096 1 46 GLY HA3 1 47 TRP H 2.590 . 3.380 3.308 3.001 3.460 0.080 6 0 "[ . 1 . 2]" 1
1097 1 122 PHE HB3 1 123 SER H 2.920 . 4.030 3.826 3.399 4.091 0.061 2 0 "[ . 1 . 2]" 1
1098 1 129 THR HA 1 129 THR HB 2.220 . 2.630 2.706 2.435 2.991 0.361 5 0 "[ . 1 . 2]" 1
1099 1 20 HIS H 1 20 HIS HB2 2.930 . 4.070 2.280 2.066 2.591 . 0 0 "[ . 1 . 2]" 1
1100 1 79 ASP HA 1 81 GLY H 2.710 . 3.620 3.379 3.105 3.676 0.056 7 0 "[ . 1 . 2]" 1
1101 1 77 TYR H 1 77 TYR QB 2.800 . 3.790 2.649 2.241 3.405 . 0 0 "[ . 1 . 2]" 1
1102 1 107 GLU H 1 109 GLN H 3.290 . 4.790 4.299 4.100 4.511 . 0 0 "[ . 1 . 2]" 1
1103 1 95 TYR H 1 97 LEU H 3.190 . 4.590 4.335 4.168 4.603 0.013 1 0 "[ . 1 . 2]" 1
1104 1 52 THR H 1 53 SER QB 3.110 . 4.420 4.376 3.915 4.515 0.095 18 0 "[ . 1 . 2]" 1
1105 1 53 SER HA 1 54 ALA MB 3.060 . 4.320 4.133 4.008 4.222 . 0 0 "[ . 1 . 2]" 1
1106 1 94 THR H 1 111 TRP HD1 2.860 . 3.920 2.416 2.115 3.142 . 0 0 "[ . 1 . 2]" 1
1107 1 89 GLU HA 1 92 ASP H 3.040 . 4.280 3.755 3.485 3.958 . 0 0 "[ . 1 . 2]" 1
1108 1 40 LEU HA 1 103 ILE MG 2.970 . 4.150 3.522 2.782 4.252 0.102 16 0 "[ . 1 . 2]" 1
1109 1 58 GLN HA 1 61 ASP HB2 2.900 . 3.990 3.561 2.672 3.863 . 0 0 "[ . 1 . 2]" 1
1110 1 52 THR HA 1 52 THR MG 2.370 . 2.940 2.229 2.105 2.495 . 0 0 "[ . 1 . 2]" 1
1111 1 93 ASP HA 1 96 THR H 3.200 . 4.600 3.613 3.270 3.801 . 0 0 "[ . 1 . 2]" 1
1112 1 116 GLU HA 1 116 GLU QB 2.300 . 2.800 2.314 2.151 2.440 . 0 0 "[ . 1 . 2]" 1
1113 1 123 SER H 1 123 SER QB 2.390 . 2.980 2.553 2.333 3.007 0.027 19 0 "[ . 1 . 2]" 1
1114 1 66 ILE HA 1 70 VAL H 3.010 . 4.230 3.742 3.575 3.933 . 0 0 "[ . 1 . 2]" 1
1115 1 103 ILE MG 1 108 LEU MD1 2.770 . 3.730 2.374 1.771 3.165 0.029 5 0 "[ . 1 . 2]" 1
1116 1 71 MET H 1 74 LYS H 3.540 . 5.280 4.766 4.528 5.199 . 0 0 "[ . 1 . 2]" 1
1117 1 22 VAL H 1 25 LEU MD2 3.600 . 5.390 5.383 5.071 5.495 0.105 1 0 "[ . 1 . 2]" 1
1118 1 26 LYS H 1 26 LYS QB 2.670 . 3.530 2.513 2.081 2.934 . 0 0 "[ . 1 . 2]" 1
1119 1 14 GLU HA 1 14 GLU HG3 2.810 . 3.820 3.400 2.334 3.871 0.051 15 0 "[ . 1 . 2]" 1
1120 1 30 GLU HA 1 119 PHE QE 2.930 . 4.070 3.452 2.636 4.069 . 0 0 "[ . 1 . 2]" 1
1121 1 100 SER H 1 100 SER QB 2.430 . 3.070 2.636 2.247 3.087 0.017 18 0 "[ . 1 . 2]" 1
1122 1 19 ARG HG2 1 20 HIS HD2 2.970 . 4.150 3.705 2.519 4.344 0.194 6 0 "[ . 1 . 2]" 1
1123 1 113 LYS HA 1 116 GLU HG2 2.760 . 3.710 2.903 1.838 3.755 0.045 7 0 "[ . 1 . 2]" 1
1124 1 50 ASP HB2 1 53 SER H 3.040 . 4.280 4.208 3.135 4.364 0.084 1 0 "[ . 1 . 2]" 1
1125 1 20 HIS HA 1 20 HIS HD2 2.900 . 4.000 3.324 2.641 4.114 0.114 14 0 "[ . 1 . 2]" 1
1126 1 64 GLU HA 1 67 ALA H 2.740 . 3.680 3.036 2.823 3.200 . 0 0 "[ . 1 . 2]" 1
1127 1 82 ASP QB 1 121 LEU MD1 2.870 . 3.940 3.927 3.523 4.096 0.156 1 0 "[ . 1 . 2]" 1
1128 1 63 ILE MD 1 94 THR MG 2.570 . 3.350 1.944 1.776 2.275 0.024 6 0 "[ . 1 . 2]" 1
1129 1 32 LEU MD2 1 94 THR MG 2.540 . 3.270 1.975 1.642 2.334 0.158 9 0 "[ . 1 . 2]" 1
1130 1 63 ILE HA 1 66 ILE MD 2.640 . 3.470 2.579 2.022 3.211 . 0 0 "[ . 1 . 2]" 1
1131 1 125 GLU QG 1 126 TYR QE 2.950 . 4.110 3.927 3.282 4.195 0.085 11 0 "[ . 1 . 2]" 1
1132 1 57 LEU HA 1 60 ASN H 2.950 . 4.110 3.491 3.271 3.896 . 0 0 "[ . 1 . 2]" 1
1133 1 32 LEU HA 1 34 ASP H 2.970 . 4.140 4.263 4.116 4.326 0.186 8 0 "[ . 1 . 2]" 1
1134 1 103 ILE MG 1 108 LEU MD2 2.700 . 3.600 2.403 1.791 2.913 0.009 17 0 "[ . 1 . 2]" 1
1135 1 82 ASP HA 1 82 ASP QB 2.260 . 2.720 2.477 2.163 2.558 . 0 0 "[ . 1 . 2]" 1
1136 1 38 ALA MB 1 39 THR HA 2.940 . 4.090 3.829 3.742 3.874 . 0 0 "[ . 1 . 2]" 1
1137 1 114 THR HA 1 117 ARG HD2 2.890 . 3.970 3.438 2.086 4.203 0.233 8 0 "[ . 1 . 2]" 1
1138 1 25 LEU MD2 1 73 PHE QD 3.060 . 4.320 2.616 2.161 2.926 . 0 0 "[ . 1 . 2]" 1
1139 1 40 LEU MD1 1 103 ILE MD 3.280 . 4.760 4.204 3.920 4.509 . 0 0 "[ . 1 . 2]" 1
1140 1 40 LEU H 1 98 PHE QE 3.020 . 4.240 3.371 2.678 4.214 . 0 0 "[ . 1 . 2]" 1
1141 1 114 THR HA 1 117 ARG HB2 2.780 . 3.760 2.690 1.941 3.408 . 0 0 "[ . 1 . 2]" 1
1142 1 60 ASN H 1 63 ILE MD 2.940 . 4.080 3.640 3.422 3.797 . 0 0 "[ . 1 . 2]" 1
1143 1 58 GLN HA 1 61 ASP H 2.830 . 3.850 3.632 3.373 3.817 . 0 0 "[ . 1 . 2]" 1
1144 1 57 LEU MD2 1 60 ASN HD21 3.040 . 4.280 3.692 2.787 4.076 . 0 0 "[ . 1 . 2]" 1
1145 1 59 LEU QD 1 63 ILE H 3.540 . 5.280 4.874 4.572 5.173 . 0 0 "[ . 1 . 2]" 1
1146 1 99 SER H 1 100 SER HA 3.500 . 5.210 5.124 4.999 5.216 0.006 18 0 "[ . 1 . 2]" 1
1147 1 22 VAL MG2 1 130 LEU MD1 2.780 . 3.760 3.604 2.768 3.835 0.075 11 0 "[ . 1 . 2]" 1
1148 1 50 ASP H 1 50 ASP HB2 2.890 . 3.970 2.516 2.173 3.095 . 0 0 "[ . 1 . 2]" 1
1149 1 117 ARG HA 1 120 ARG H 2.980 . 4.170 3.462 3.191 3.751 . 0 0 "[ . 1 . 2]" 1
1150 1 128 SER HA 1 128 SER HB2 2.310 . 2.820 2.903 2.738 2.992 0.172 15 0 "[ . 1 . 2]" 1
1151 1 128 SER HA 1 128 SER HB3 2.310 . 2.830 2.262 2.219 2.335 . 0 0 "[ . 1 . 2]" 1
1152 1 42 ASP H 1 42 ASP QB 2.660 . 3.520 2.508 2.247 2.884 . 0 0 "[ . 1 . 2]" 1
1153 1 114 THR HA 1 114 THR MG 2.570 . 3.340 2.351 2.235 2.431 . 0 0 "[ . 1 . 2]" 1
1154 1 25 LEU MD1 1 87 VAL MG1 2.450 . 3.110 2.105 1.729 2.738 0.071 8 0 "[ . 1 . 2]" 1
1155 1 59 LEU HA 1 62 LEU QB 2.880 . 3.960 2.457 1.763 3.996 0.037 1 0 "[ . 1 . 2]" 1
1156 1 73 PHE HA 1 73 PHE QD 3.090 . 4.380 2.855 2.474 3.151 . 0 0 "[ . 1 . 2]" 1
1157 1 118 LEU HA 1 118 LEU MD1 2.710 . 3.620 2.260 1.753 3.398 0.047 9 0 "[ . 1 . 2]" 1
1158 1 40 LEU MD2 1 97 LEU MD2 3.060 . 4.310 3.102 1.980 3.878 . 0 0 "[ . 1 . 2]" 1
1159 1 108 LEU MD1 1 111 TRP HE3 2.780 . 3.760 2.523 2.088 3.068 . 0 0 "[ . 1 . 2]" 1
1160 1 108 LEU MD1 1 111 TRP HZ3 3.070 . 4.340 3.557 2.688 4.276 . 0 0 "[ . 1 . 2]" 1
1161 1 89 GLU HG3 1 114 THR MG 2.920 . 4.030 3.951 3.577 4.117 0.087 8 0 "[ . 1 . 2]" 1
1162 1 89 GLU HG2 1 114 THR MG 2.980 . 4.160 3.926 2.694 4.258 0.098 20 0 "[ . 1 . 2]" 1
1163 1 129 THR H 1 130 LEU HB3 3.360 . 4.910 4.950 4.624 5.079 0.169 19 0 "[ . 1 . 2]" 1
1164 1 25 LEU MD1 1 70 VAL MG2 2.580 . 3.360 2.491 1.715 3.127 0.085 11 0 "[ . 1 . 2]" 1
1165 1 125 GLU HA 1 125 GLU QG 2.320 . 2.840 2.700 2.193 3.179 0.339 4 0 "[ . 1 . 2]" 1
1166 1 100 SER HA 1 100 SER QB 2.240 . 2.680 2.303 2.175 2.457 . 0 0 "[ . 1 . 2]" 1
1167 1 37 ILE H 1 40 LEU H 3.650 . 5.500 4.592 4.456 4.720 . 0 0 "[ . 1 . 2]" 1
1168 1 107 GLU HA 1 107 GLU HG2 2.810 . 3.810 3.529 3.080 3.756 . 0 0 "[ . 1 . 2]" 1
1169 1 37 ILE MD 1 111 TRP HZ3 2.840 . 3.880 2.252 1.858 3.078 . 0 0 "[ . 1 . 2]" 1
1170 1 50 ASP H 1 50 ASP HB3 2.920 . 4.040 2.729 2.355 3.586 . 0 0 "[ . 1 . 2]" 1
1171 1 37 ILE H 1 59 LEU QD 3.650 . 5.500 4.392 4.253 4.778 . 0 0 "[ . 1 . 2]" 1
1172 1 39 THR MG 1 55 VAL MG2 2.100 . 2.400 2.135 1.675 2.449 0.125 18 0 "[ . 1 . 2]" 1
1173 1 87 VAL MG1 1 90 TYR QD 3.120 . 4.440 3.543 2.604 4.241 . 0 0 "[ . 1 . 2]" 1
1174 1 58 GLN HA 1 61 ASP HB3 2.830 . 3.850 2.745 2.357 3.115 . 0 0 "[ . 1 . 2]" 1
1175 1 59 LEU HA 1 62 LEU HG 2.840 . 3.870 3.294 1.842 3.990 0.120 6 0 "[ . 1 . 2]" 1
1176 1 85 GLU HA 1 88 GLU HB2 2.840 . 3.880 2.705 2.210 3.809 . 0 0 "[ . 1 . 2]" 1
1177 1 26 LYS QB 1 27 PHE H 3.060 . 4.320 2.738 2.087 3.385 . 0 0 "[ . 1 . 2]" 1
1178 1 25 LEU MD1 1 87 VAL MG2 2.960 . 4.120 2.169 1.658 3.131 0.142 14 0 "[ . 1 . 2]" 1
1179 1 72 SER H 1 73 PHE QB 3.020 . 4.240 4.329 4.195 4.394 0.154 4 0 "[ . 1 . 2]" 1
1180 1 41 GLY HA2 1 42 ASP H 2.570 . 3.340 3.121 2.499 3.527 0.187 1 0 "[ . 1 . 2]" 1
1181 1 80 ASP HA 1 83 LEU H 3.070 . 4.340 3.504 3.109 4.351 0.011 4 0 "[ . 1 . 2]" 1
1182 1 22 VAL MG1 1 127 ILE MD 2.880 . 3.950 2.164 1.657 3.303 0.143 17 0 "[ . 1 . 2]" 1
1183 1 40 LEU MD1 1 97 LEU MD2 3.020 . 4.240 3.348 1.923 4.332 0.092 10 0 "[ . 1 . 2]" 1
1184 1 71 MET HA 1 74 LYS QE 2.730 . 3.670 3.127 1.799 3.791 0.121 10 0 "[ . 1 . 2]" 1
1185 1 57 LEU MD2 1 60 ASN HD22 3.140 . 4.480 4.090 2.011 4.556 0.076 20 0 "[ . 1 . 2]" 1
1186 1 122 PHE HA 1 127 ILE MD 2.690 . 3.580 3.002 1.892 3.650 0.070 7 0 "[ . 1 . 2]" 1
1187 1 83 LEU MD2 1 122 PHE QE 2.970 . 4.140 2.752 2.122 3.339 . 0 0 "[ . 1 . 2]" 1
1188 1 83 LEU MD2 1 122 PHE HZ 3.020 . 4.250 3.117 2.178 4.137 . 0 0 "[ . 1 . 2]" 1
1189 1 49 ASN H 1 102 GLY HA3 3.110 . 4.420 4.298 3.093 4.570 0.150 3 0 "[ . 1 . 2]" 1
1190 1 21 ASP HA 1 24 GLN HE21 2.760 . 3.720 3.531 2.574 3.773 0.053 10 0 "[ . 1 . 2]" 1
1191 1 59 LEU QB 1 63 ILE H 3.160 . 4.510 4.252 4.015 4.534 0.024 14 0 "[ . 1 . 2]" 1
1192 1 39 THR HA 1 55 VAL MG1 3.020 . 4.250 3.399 2.329 4.213 . 0 0 "[ . 1 . 2]" 1
1193 1 111 TRP HA 1 111 TRP HD1 2.920 . 4.040 2.826 2.356 3.116 . 0 0 "[ . 1 . 2]" 1
1194 1 61 ASP H 1 63 ILE MD 3.360 . 4.920 4.809 4.536 4.987 0.067 15 0 "[ . 1 . 2]" 1
1195 1 87 VAL MG2 1 118 LEU MD1 2.510 . 3.210 2.305 1.733 3.368 0.158 1 0 "[ . 1 . 2]" 1
1196 1 21 ASP HA 1 24 GLN HB3 2.760 . 3.720 3.787 3.625 3.863 0.143 3 0 "[ . 1 . 2]" 1
1197 1 92 ASP HA 1 95 TYR H 2.960 . 4.120 3.607 3.469 3.926 . 0 0 "[ . 1 . 2]" 1
1198 1 70 VAL MG2 1 87 VAL MG2 2.600 . 3.400 2.980 2.597 3.431 0.031 5 0 "[ . 1 . 2]" 1
1199 1 25 LEU MD2 1 122 PHE QE 3.100 . 4.390 3.865 2.417 4.460 0.070 5 0 "[ . 1 . 2]" 1
1200 1 42 ASP HA 1 42 ASP HB3 2.340 . 2.890 3.008 2.930 3.028 0.138 7 0 "[ . 1 . 2]" 1
1201 1 99 SER HA 1 99 SER HB2 2.340 . 2.890 3.000 2.930 3.015 0.125 13 0 "[ . 1 . 2]" 1
1202 1 106 PRO HD3 1 107 GLU H 3.060 . 4.320 4.263 4.004 4.432 0.112 14 0 "[ . 1 . 2]" 1
1203 1 84 SER HA 1 84 SER QB 2.400 . 3.000 2.336 2.159 2.557 . 0 0 "[ . 1 . 2]" 1
1204 1 133 THR HA 1 133 THR HB 2.100 . 2.400 2.430 2.323 2.598 0.198 18 0 "[ . 1 . 2]" 1
1205 1 94 THR MG 1 111 TRP HE1 3.000 . 4.210 2.513 2.146 2.740 . 0 0 "[ . 1 . 2]" 1
1206 1 94 THR HB 1 111 TRP HE1 3.010 . 4.220 3.477 3.312 3.608 . 0 0 "[ . 1 . 2]" 1
1207 1 97 LEU MD1 1 104 ASN HD22 3.540 . 5.290 4.427 3.426 5.318 0.028 13 0 "[ . 1 . 2]" 1
1208 1 109 GLN HA 1 112 GLN HB2 2.890 . 3.980 2.600 1.898 3.350 . 0 0 "[ . 1 . 2]" 1
1209 1 34 ASP HA 1 37 ILE HB 2.760 . 3.720 3.104 2.727 3.535 . 0 0 "[ . 1 . 2]" 1
1210 1 52 THR HA 1 57 LEU QD 2.550 . 3.300 2.099 1.716 2.621 0.084 11 0 "[ . 1 . 2]" 1
1211 1 28 LEU MD1 1 66 ILE MG 3.030 . 4.270 3.457 1.679 4.163 0.121 3 0 "[ . 1 . 2]" 1
1212 1 45 HIS HA 1 45 HIS HD2 2.880 . 3.950 3.328 2.374 4.288 0.338 6 0 "[ . 1 . 2]" 1
1213 1 32 LEU MD2 1 111 TRP HH2 2.850 . 3.890 3.954 3.344 4.098 0.208 10 0 "[ . 1 . 2]" 1
1214 1 13 ASP QB 1 14 GLU H 3.090 . 4.370 2.922 1.804 3.898 . 0 0 "[ . 1 . 2]" 1
1215 1 70 VAL MG1 1 88 GLU HG2 2.560 . 3.320 2.691 1.740 3.334 0.060 14 0 "[ . 1 . 2]" 1
1216 1 40 LEU MD2 1 97 LEU MD1 2.990 . 4.190 3.150 2.265 4.249 0.059 3 0 "[ . 1 . 2]" 1
1217 1 70 VAL MG1 1 88 GLU HG3 3.010 . 4.220 2.589 1.734 4.267 0.066 1 0 "[ . 1 . 2]" 1
1218 1 129 THR HA 1 129 THR MG 2.510 . 3.210 2.335 2.184 3.254 0.044 19 0 "[ . 1 . 2]" 1
1219 1 34 ASP HA 1 37 ILE HG12 2.910 . 4.010 4.008 3.718 4.098 0.088 2 0 "[ . 1 . 2]" 1
1220 1 33 TYR HA 1 33 TYR QD 2.760 . 3.720 2.469 1.994 3.208 . 0 0 "[ . 1 . 2]" 1
1221 1 66 ILE HB 1 91 LEU MD1 2.760 . 3.710 2.708 2.008 3.451 . 0 0 "[ . 1 . 2]" 1
1222 1 35 GLU HG3 1 62 LEU MD2 2.950 . 4.110 2.803 2.153 3.084 . 0 0 "[ . 1 . 2]" 1
1223 1 63 ILE MG 1 67 ALA MB 2.850 . 3.890 3.194 2.877 3.572 . 0 0 "[ . 1 . 2]" 1
1224 1 89 GLU HA 1 93 ASP H 3.020 . 4.240 3.850 3.631 4.124 . 0 0 "[ . 1 . 2]" 1
1225 1 28 LEU H 1 30 GLU H 3.210 . 4.630 4.243 4.023 4.434 . 0 0 "[ . 1 . 2]" 1
1226 1 77 TYR QD 1 80 ASP H 3.160 . 4.520 3.512 1.976 4.586 0.066 6 0 "[ . 1 . 2]" 1
1227 1 77 TYR QB 1 80 ASP H 3.180 . 4.560 3.487 2.287 4.492 . 0 0 "[ . 1 . 2]" 1
1228 1 49 ASN H 1 49 ASN QB 2.750 . 3.700 2.390 2.179 2.820 . 0 0 "[ . 1 . 2]" 1
1229 1 24 GLN HE21 1 28 LEU MD2 3.220 . 4.640 4.340 3.888 4.697 0.057 8 0 "[ . 1 . 2]" 1
1230 1 74 LYS HA 1 77 TYR H 2.840 . 3.880 3.435 2.958 3.921 0.041 7 0 "[ . 1 . 2]" 1
1231 1 24 GLN HE22 1 28 LEU MD2 3.650 . 5.500 4.902 4.016 5.564 0.064 4 0 "[ . 1 . 2]" 1
1232 1 36 GLY H 1 59 LEU MD2 3.020 . 4.240 2.655 2.066 3.699 . 0 0 "[ . 1 . 2]" 1
1233 1 33 TYR H 1 35 GLU H 3.160 . 4.510 4.467 4.215 4.580 0.070 7 0 "[ . 1 . 2]" 1
1234 1 97 LEU MD2 1 111 TRP H 3.170 . 4.530 3.289 2.912 3.847 . 0 0 "[ . 1 . 2]" 1
1235 1 35 GLU H 1 59 LEU MD2 3.180 . 4.570 4.006 3.485 4.535 . 0 0 "[ . 1 . 2]" 1
1236 1 97 LEU MD2 1 103 ILE MG 3.020 . 4.250 3.575 3.142 3.909 . 0 0 "[ . 1 . 2]" 1
1237 1 87 VAL MG1 1 118 LEU MD2 3.160 . 4.520 3.081 2.417 4.121 . 0 0 "[ . 1 . 2]" 1
1238 1 40 LEU MD2 1 108 LEU MD2 2.770 . 3.730 3.507 2.642 3.810 0.080 13 0 "[ . 1 . 2]" 1
1239 1 40 LEU MD2 1 108 LEU MD1 2.870 . 3.930 2.076 1.646 2.382 0.154 15 0 "[ . 1 . 2]" 1
1240 1 40 LEU MD1 1 108 LEU MD1 2.590 . 3.380 1.884 1.746 2.034 0.054 17 0 "[ . 1 . 2]" 1
1241 1 25 LEU MD2 1 122 PHE HZ 3.140 . 4.470 3.553 2.043 4.502 0.032 14 0 "[ . 1 . 2]" 1
1242 1 93 ASP HA 1 93 ASP QB 2.310 . 2.830 2.473 2.369 2.551 . 0 0 "[ . 1 . 2]" 1
1243 1 32 LEU MD1 1 35 GLU HG3 3.150 . 4.490 4.335 3.590 4.554 0.064 19 0 "[ . 1 . 2]" 1
1244 1 19 ARG HA 1 21 ASP H 3.200 . 4.600 4.639 4.471 4.767 0.167 20 0 "[ . 1 . 2]" 1
1245 1 88 GLU HA 1 91 LEU MD1 2.780 . 3.760 2.357 1.986 2.982 . 0 0 "[ . 1 . 2]" 1
1246 1 80 ASP HB2 1 84 SER H 3.150 . 4.500 3.823 3.016 4.661 0.161 4 0 "[ . 1 . 2]" 1
1247 1 59 LEU QD 1 98 PHE H 3.650 . 5.500 5.056 4.557 5.603 0.103 13 0 "[ . 1 . 2]" 1
1248 1 91 LEU HA 1 95 TYR H 3.140 . 4.470 3.881 3.778 4.171 . 0 0 "[ . 1 . 2]" 1
1249 1 122 PHE HA 1 127 ILE HG12 2.930 . 4.070 3.026 2.016 3.909 . 0 0 "[ . 1 . 2]" 1
1250 1 30 GLU HG3 1 119 PHE QE 2.900 . 3.990 3.660 2.264 4.156 0.166 1 0 "[ . 1 . 2]" 1
1251 1 36 GLY HA3 1 40 LEU H 3.250 . 4.700 4.506 4.163 4.732 0.032 3 0 "[ . 1 . 2]" 1
1252 1 63 ILE H 1 66 ILE MD 2.840 . 3.870 3.942 3.849 3.988 0.118 20 0 "[ . 1 . 2]" 1
1253 1 73 PHE QB 1 75 ILE H 3.270 . 4.740 4.481 4.352 4.715 . 0 0 "[ . 1 . 2]" 1
1254 1 95 TYR QE 1 96 THR HA 3.010 . 4.230 4.095 3.650 4.302 0.072 13 0 "[ . 1 . 2]" 1
1255 1 77 TYR HA 1 77 TYR QD 3.080 . 4.360 2.670 1.982 3.712 . 0 0 "[ . 1 . 2]" 1
1256 1 123 SER HA 1 123 SER HB3 2.350 . 2.910 2.434 2.255 2.559 . 0 0 "[ . 1 . 2]" 1
1257 1 113 LYS HA 1 117 ARG H 2.950 . 4.110 3.934 3.681 4.173 0.063 11 0 "[ . 1 . 2]" 1
1258 1 97 LEU MD1 1 104 ASN HD21 3.620 . 5.430 3.562 2.485 5.064 . 0 0 "[ . 1 . 2]" 1
1259 1 86 LEU MD1 1 114 THR MG 2.780 . 3.760 1.845 1.687 2.543 0.113 9 0 "[ . 1 . 2]" 1
1260 1 52 THR MG 1 57 LEU QD 2.680 . 3.560 2.702 1.728 3.530 0.072 11 0 "[ . 1 . 2]" 1
1261 1 87 VAL HA 1 118 LEU MD2 3.000 . 4.200 2.314 1.713 3.552 0.087 1 0 "[ . 1 . 2]" 1
1262 1 60 ASN HA 1 63 ILE HB 2.780 . 3.760 2.685 2.112 3.057 . 0 0 "[ . 1 . 2]" 1
1263 1 59 LEU QD 1 62 LEU MD2 2.900 . 3.990 3.122 2.010 3.908 . 0 0 "[ . 1 . 2]" 1
1264 1 118 LEU QB 1 118 LEU MD1 2.940 . 4.090 2.337 2.043 2.664 . 0 0 "[ . 1 . 2]" 1
1265 1 54 ALA MB 1 58 GLN HE21 3.120 . 4.430 3.930 2.648 4.607 0.177 16 0 "[ . 1 . 2]" 1
1266 1 48 VAL MG2 1 50 ASP H 3.650 . 5.500 4.509 3.731 5.196 . 0 0 "[ . 1 . 2]" 1
1267 1 27 PHE HA 1 27 PHE QD 2.820 . 3.840 2.467 1.805 3.525 . 0 0 "[ . 1 . 2]" 1
1268 1 97 LEU HG 1 103 ILE MD 3.090 . 4.370 3.051 2.472 3.520 . 0 0 "[ . 1 . 2]" 1
1269 1 33 TYR HA 1 111 TRP HZ2 2.870 . 3.940 3.199 2.623 3.858 . 0 0 "[ . 1 . 2]" 1
1270 1 83 LEU MD2 1 87 VAL MG2 2.890 . 3.980 3.503 2.757 4.083 0.103 6 0 "[ . 1 . 2]" 1
1271 1 32 LEU MD2 1 111 TRP HZ2 2.990 . 4.180 2.098 1.746 2.376 0.054 13 0 "[ . 1 . 2]" 1
1272 1 32 LEU MD1 1 59 LEU HA 3.060 . 4.310 2.625 2.195 3.029 . 0 0 "[ . 1 . 2]" 1
1273 1 122 PHE HA 1 122 PHE QD 2.900 . 4.000 2.458 2.005 2.861 . 0 0 "[ . 1 . 2]" 1
1274 1 39 THR H 1 59 LEU QD 3.500 . 5.200 3.626 3.203 4.055 . 0 0 "[ . 1 . 2]" 1
1275 1 39 THR H 1 55 VAL MG1 3.500 . 5.210 3.728 2.976 4.639 . 0 0 "[ . 1 . 2]" 1
1276 1 35 GLU H 1 62 LEU MD2 3.410 . 5.020 4.848 4.165 5.108 0.088 13 0 "[ . 1 . 2]" 1
1277 1 59 LEU QB 1 61 ASP H 3.230 . 4.660 4.627 4.425 4.756 0.096 15 0 "[ . 1 . 2]" 1
1278 1 39 THR MG 1 56 ASN H 3.490 . 5.190 3.151 2.365 4.521 . 0 0 "[ . 1 . 2]" 1
1279 1 103 ILE MG 1 108 LEU H 3.320 . 4.840 3.811 3.291 4.390 . 0 0 "[ . 1 . 2]" 1
1280 1 39 THR MG 1 59 LEU QD 2.650 . 3.490 2.232 1.654 2.846 0.146 18 0 "[ . 1 . 2]" 1
1281 1 86 LEU MD2 1 114 THR MG 3.170 . 4.540 3.870 3.565 4.229 . 0 0 "[ . 1 . 2]" 1
1282 1 97 LEU HG 1 108 LEU MD1 3.010 . 4.220 2.715 2.180 3.228 . 0 0 "[ . 1 . 2]" 1
1283 1 121 LEU MD1 1 125 GLU QG 2.610 . 3.420 3.510 3.167 3.619 0.199 9 0 "[ . 1 . 2]" 1
1284 1 39 THR HB 1 59 LEU QD 2.580 . 3.360 2.621 2.105 3.503 0.143 6 0 "[ . 1 . 2]" 1
1285 1 32 LEU MD2 1 59 LEU QD 3.100 . 4.390 3.420 2.585 4.398 0.008 14 0 "[ . 1 . 2]" 1
1286 1 82 ASP HA 1 85 GLU HB3 2.700 . 3.600 2.904 2.306 3.685 0.085 9 0 "[ . 1 . 2]" 1
1287 1 82 ASP HA 1 85 GLU HG2 2.880 . 3.950 3.496 2.203 4.063 0.113 13 0 "[ . 1 . 2]" 1
1288 1 32 LEU HA 1 59 LEU QD 3.090 . 4.370 2.866 2.075 3.533 . 0 0 "[ . 1 . 2]" 1
1289 1 40 LEU MD2 1 103 ILE HA 3.020 . 4.250 4.091 3.822 4.283 0.033 13 0 "[ . 1 . 2]" 1
1290 1 27 PHE HA 1 30 GLU HB3 2.850 . 3.900 3.910 3.388 4.013 0.113 5 0 "[ . 1 . 2]" 1
1291 1 37 ILE MD 1 40 LEU HB2 2.860 . 3.910 3.643 3.201 3.955 0.045 18 0 "[ . 1 . 2]" 1
1292 1 22 VAL MG1 1 131 MET HG3 3.130 . 4.450 4.192 3.480 4.593 0.143 4 0 "[ . 1 . 2]" 1
1293 1 113 LYS HA 1 116 GLU HG3 2.750 . 3.700 2.770 1.793 3.621 0.007 17 0 "[ . 1 . 2]" 1
1294 1 121 LEU MD1 1 123 SER H 3.650 . 5.500 4.993 4.191 5.499 . 0 0 "[ . 1 . 2]" 1
1295 1 111 TRP HA 1 114 THR HB 2.750 . 3.690 2.743 2.314 3.590 . 0 0 "[ . 1 . 2]" 1
1296 1 40 LEU MD1 1 111 TRP HH2 2.800 . 3.790 3.218 2.759 3.835 0.045 16 0 "[ . 1 . 2]" 1
1297 1 32 LEU MD1 1 35 GLU QB 2.930 . 4.060 3.896 2.960 4.134 0.074 3 0 "[ . 1 . 2]" 1
1298 1 37 ILE HA 1 40 LEU MD1 2.930 . 4.070 2.727 1.712 4.092 0.088 10 0 "[ . 1 . 2]" 1
1299 1 20 HIS HA 1 23 ALA H 3.070 . 4.330 3.617 3.140 4.360 0.030 19 0 "[ . 1 . 2]" 1
1300 1 100 SER QB 1 104 ASN HD22 3.130 . 4.460 2.678 2.081 3.820 . 0 0 "[ . 1 . 2]" 1
1301 1 59 LEU QD 1 98 PHE QD 2.790 . 3.770 2.973 2.546 3.664 . 0 0 "[ . 1 . 2]" 1
1302 1 37 ILE MD 1 112 GLN HE22 3.190 . 4.590 3.053 1.892 4.511 . 0 0 "[ . 1 . 2]" 1
1303 1 37 ILE MD 1 112 GLN HE21 2.940 . 4.080 3.722 3.007 4.125 0.045 2 0 "[ . 1 . 2]" 1
1304 1 37 ILE MD 1 111 TRP HH2 2.920 . 4.040 3.721 3.040 4.161 0.121 9 0 "[ . 1 . 2]" 1
1305 1 22 VAL MG1 1 127 ILE MG 2.100 . 2.400 1.759 1.617 2.063 0.183 4 0 "[ . 1 . 2]" 1
1306 1 93 ASP HA 1 97 LEU H 3.130 . 4.460 3.924 3.655 4.171 . 0 0 "[ . 1 . 2]" 1
1307 1 44 HIS HA 1 44 HIS QB 2.170 . 2.540 2.421 2.211 2.542 0.002 16 0 "[ . 1 . 2]" 1
1308 1 43 SER HA 1 43 SER HB3 2.300 . 2.790 2.362 2.234 3.022 0.232 4 0 "[ . 1 . 2]" 1
1309 1 43 SER HA 1 43 SER HB2 2.300 . 2.790 2.857 2.393 3.027 0.237 1 0 "[ . 1 . 2]" 1
1310 1 44 HIS HA 1 44 HIS HD2 2.620 . 3.430 3.163 2.366 3.537 0.107 14 0 "[ . 1 . 2]" 1
1311 1 44 HIS QB 1 44 HIS HD2 2.430 . 3.070 2.846 2.646 3.231 0.161 15 0 "[ . 1 . 2]" 1
1312 1 68 SER HB2 1 71 MET ME 2.970 . 4.140 4.233 4.159 4.303 0.163 5 0 "[ . 1 . 2]" 1
1313 1 29 CYS HA 1 66 ILE MD 2.910 . 4.020 3.151 2.739 3.652 . 0 0 "[ . 1 . 2]" 1
1314 1 25 LEU HB2 1 122 PHE QE 2.940 . 4.080 3.734 3.285 4.124 0.044 1 0 "[ . 1 . 2]" 1
1315 1 54 ALA HA 1 57 LEU HB2 2.690 . 3.590 2.708 2.348 3.128 . 0 0 "[ . 1 . 2]" 1
1316 1 119 PHE HA 1 122 PHE QD 2.850 . 3.900 2.810 2.046 3.732 . 0 0 "[ . 1 . 2]" 1
1317 1 49 ASN QB 1 103 ILE H 3.240 . 4.680 3.787 2.799 4.693 0.013 15 0 "[ . 1 . 2]" 1
1318 1 17 PRO HG2 1 20 HIS HD2 2.780 . 3.760 3.473 2.597 3.888 0.128 13 0 "[ . 1 . 2]" 1
1319 1 56 ASN HD22 1 103 ILE MD 3.650 . 5.500 4.132 2.326 4.810 . 0 0 "[ . 1 . 2]" 1
1320 1 49 ASN QB 1 56 ASN HD22 2.880 . 3.950 3.335 2.053 4.025 0.075 20 0 "[ . 1 . 2]" 1
1321 1 56 ASN HD21 1 103 ILE MD 3.650 . 5.500 4.751 3.385 5.561 0.061 19 0 "[ . 1 . 2]" 1
1322 1 49 ASN QB 1 56 ASN HD21 2.790 . 3.780 3.488 2.790 3.867 0.087 9 0 "[ . 1 . 2]" 1
1323 1 97 LEU MD2 1 112 GLN H 3.410 . 5.020 4.409 3.983 4.997 . 0 0 "[ . 1 . 2]" 1
1324 1 100 SER QB 1 104 ASN HD21 3.200 . 4.600 3.425 2.450 4.619 0.019 4 0 "[ . 1 . 2]" 1
1325 1 97 LEU MD1 1 111 TRP H 3.500 . 5.210 4.733 3.764 5.188 . 0 0 "[ . 1 . 2]" 1
1326 1 24 GLN HA 1 28 LEU H 3.210 . 4.630 3.661 3.352 3.998 . 0 0 "[ . 1 . 2]" 1
1327 1 35 GLU QB 1 59 LEU H 3.260 . 4.720 4.367 3.924 4.827 0.107 20 0 "[ . 1 . 2]" 1
1328 1 50 ASP H 1 53 SER HB3 3.200 . 4.610 3.673 2.859 4.488 . 0 0 "[ . 1 . 2]" 1
1329 1 20 HIS HA 1 23 ALA MB 2.840 . 3.870 2.471 1.995 3.367 . 0 0 "[ . 1 . 2]" 1
1330 1 122 PHE QD 1 127 ILE MG 3.020 . 4.250 2.917 1.700 4.212 0.100 3 0 "[ . 1 . 2]" 1
1331 1 35 GLU QB 1 38 ALA MB 3.010 . 4.230 3.973 3.698 4.240 0.010 2 0 "[ . 1 . 2]" 1
1332 1 94 THR MG 1 98 PHE QD 2.820 . 3.840 2.102 1.795 2.652 0.005 2 0 "[ . 1 . 2]" 1
1333 1 94 THR MG 1 98 PHE QE 2.970 . 4.150 1.921 1.707 2.293 0.093 15 0 "[ . 1 . 2]" 1
1334 1 22 VAL MG1 1 122 PHE QD 2.930 . 4.070 3.132 2.272 4.109 0.039 19 0 "[ . 1 . 2]" 1
1335 1 22 VAL MG1 1 122 PHE QE 2.910 . 4.010 2.842 1.941 4.085 0.075 1 0 "[ . 1 . 2]" 1
1336 1 32 LEU MD1 1 94 THR MG 2.940 . 4.090 1.836 1.649 2.405 0.151 6 0 "[ . 1 . 2]" 1
1337 1 57 LEU QD 1 60 ASN QB 3.070 . 4.330 3.685 3.255 4.345 0.015 16 0 "[ . 1 . 2]" 1
1338 1 35 GLU HA 1 38 ALA MB 2.520 . 3.240 2.524 2.180 2.758 . 0 0 "[ . 1 . 2]" 1
1339 1 51 PRO HA 1 56 ASN HB2 2.760 . 3.710 3.596 3.263 3.790 0.080 17 0 "[ . 1 . 2]" 1
1340 1 51 PRO HA 1 56 ASN HB3 2.900 . 3.990 3.070 2.155 3.837 . 0 0 "[ . 1 . 2]" 1
1341 1 40 LEU MD1 1 111 TRP HZ3 2.920 . 4.030 2.759 2.272 3.235 . 0 0 "[ . 1 . 2]" 1
1342 1 25 LEU MD2 1 73 PHE H 3.650 . 5.500 4.934 4.024 5.581 0.081 17 0 "[ . 1 . 2]" 1
1343 1 122 PHE QE 1 127 ILE MD 3.170 . 4.550 2.956 2.378 3.678 . 0 0 "[ . 1 . 2]" 1
1344 1 108 LEU HA 1 111 TRP H 3.090 . 4.380 3.321 3.141 3.491 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 72
_Distance_constraint_stats_list.Viol_count 257
_Distance_constraint_stats_list.Viol_total 203.571
_Distance_constraint_stats_list.Viol_max 0.187
_Distance_constraint_stats_list.Viol_rms 0.0205
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0071
_Distance_constraint_stats_list.Viol_average_violations_only 0.0396
_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 22 VAL 1.212 0.109 3 0 "[ . 1 . 2]"
1 23 ALA 0.104 0.041 20 0 "[ . 1 . 2]"
1 25 LEU 1.212 0.109 3 0 "[ . 1 . 2]"
1 26 LYS 0.847 0.075 6 0 "[ . 1 . 2]"
1 27 PHE 0.207 0.041 20 0 "[ . 1 . 2]"
1 28 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 CYS 0.983 0.075 6 0 "[ . 1 . 2]"
1 31 SER 0.145 0.042 2 0 "[ . 1 . 2]"
1 32 LEU 0.436 0.058 14 0 "[ . 1 . 2]"
1 33 TYR 0.136 0.045 4 0 "[ . 1 . 2]"
1 34 ASP 0.042 0.042 2 0 "[ . 1 . 2]"
1 36 GLY 0.436 0.058 14 0 "[ . 1 . 2]"
1 58 GLN 0.111 0.034 5 0 "[ . 1 . 2]"
1 59 LEU 0.163 0.052 7 0 "[ . 1 . 2]"
1 60 ASN 0.021 0.021 1 0 "[ . 1 . 2]"
1 62 LEU 0.521 0.056 17 0 "[ . 1 . 2]"
1 63 ILE 0.163 0.052 7 0 "[ . 1 . 2]"
1 64 GLU 1.130 0.080 12 0 "[ . 1 . 2]"
1 66 ILE 0.862 0.056 17 0 "[ . 1 . 2]"
1 67 ALA 1.148 0.080 12 0 "[ . 1 . 2]"
1 70 VAL 0.494 0.046 5 0 "[ . 1 . 2]"
1 71 MET 0.039 0.022 11 0 "[ . 1 . 2]"
1 72 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 PHE 0.296 0.049 3 0 "[ . 1 . 2]"
1 74 LYS 0.041 0.028 14 0 "[ . 1 . 2]"
1 75 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 TYR 0.296 0.049 3 0 "[ . 1 . 2]"
1 83 LEU 0.125 0.042 7 0 "[ . 1 . 2]"
1 84 SER 0.169 0.045 8 0 "[ . 1 . 2]"
1 86 LEU 0.025 0.019 18 0 "[ . 1 . 2]"
1 87 VAL 0.256 0.042 7 0 "[ . 1 . 2]"
1 88 GLU 0.169 0.045 8 0 "[ . 1 . 2]"
1 89 GLU 0.131 0.032 10 0 "[ . 1 . 2]"
1 90 TYR 0.025 0.019 18 0 "[ . 1 . 2]"
1 91 LEU 0.140 0.034 11 0 "[ . 1 . 2]"
1 92 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 ASP 0.131 0.032 10 0 "[ . 1 . 2]"
1 94 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 TYR 0.009 0.009 3 0 "[ . 1 . 2]"
1 97 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 LEU 0.007 0.007 15 0 "[ . 1 . 2]"
1 110 ARG 0.617 0.086 18 0 "[ . 1 . 2]"
1 111 TRP 0.028 0.024 11 0 "[ . 1 . 2]"
1 112 GLN 0.058 0.021 5 0 "[ . 1 . 2]"
1 113 LYS 0.626 0.086 18 0 "[ . 1 . 2]"
1 115 LYS 1.399 0.126 3 0 "[ . 1 . 2]"
1 116 GLU 0.270 0.076 8 0 "[ . 1 . 2]"
1 117 ARG 0.010 0.009 3 0 "[ . 1 . 2]"
1 118 LEU 3.136 0.187 4 0 "[ . 1 . 2]"
1 119 PHE 0.219 0.076 8 0 "[ . 1 . 2]"
1 121 LEU 1.765 0.187 4 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 22 VAL O 1 25 LEU H 2.300 . 2.500 2.561 2.519 2.609 0.109 3 0 "[ . 1 . 2]" 2
2 1 22 VAL O 1 25 LEU N 3.300 2.600 3.500 2.973 2.892 3.039 . 0 0 "[ . 1 . 2]" 2
3 1 23 ALA O 1 27 PHE H 2.300 . 2.500 1.715 1.609 2.111 . 0 0 "[ . 1 . 2]" 2
4 1 23 ALA O 1 27 PHE N 3.300 2.600 3.500 2.667 2.559 3.085 0.041 20 0 "[ . 1 . 2]" 2
5 1 26 LYS O 1 29 CYS H 2.300 . 2.500 2.526 2.337 2.575 0.075 6 0 "[ . 1 . 2]" 2
6 1 26 LYS O 1 29 CYS N 3.300 2.600 3.500 2.906 2.787 2.989 . 0 0 "[ . 1 . 2]" 2
7 1 27 PHE O 1 31 SER H 2.300 . 2.500 1.700 1.622 1.863 . 0 0 "[ . 1 . 2]" 2
8 1 27 PHE O 1 31 SER N 3.300 2.600 3.500 2.642 2.568 2.820 0.032 13 0 "[ . 1 . 2]" 2
9 1 28 LEU O 1 32 LEU H 2.300 . 2.500 1.824 1.688 1.977 . 0 0 "[ . 1 . 2]" 2
10 1 28 LEU O 1 32 LEU N 3.300 2.600 3.500 2.774 2.628 2.930 . 0 0 "[ . 1 . 2]" 2
11 1 29 CYS O 1 33 TYR H 2.300 . 2.500 1.812 1.606 2.502 0.002 7 0 "[ . 1 . 2]" 2
12 1 29 CYS O 1 33 TYR N 3.300 2.600 3.500 2.720 2.555 3.310 0.045 4 0 "[ . 1 . 2]" 2
13 1 31 SER O 1 34 ASP H 2.300 . 2.500 2.315 1.889 2.542 0.042 2 0 "[ . 1 . 2]" 2
14 1 31 SER O 1 34 ASP N 3.300 2.600 3.500 2.890 2.608 3.257 . 0 0 "[ . 1 . 2]" 2
15 1 32 LEU O 1 36 GLY H 2.300 . 2.500 1.675 1.606 1.913 . 0 0 "[ . 1 . 2]" 2
16 1 32 LEU O 1 36 GLY N 3.300 2.600 3.500 2.582 2.542 2.640 0.058 14 0 "[ . 1 . 2]" 2
17 1 58 GLN O 1 62 LEU H 2.300 . 2.500 1.689 1.598 1.946 0.002 5 0 "[ . 1 . 2]" 2
18 1 58 GLN O 1 62 LEU N 3.300 2.600 3.500 2.657 2.566 2.903 0.034 5 0 "[ . 1 . 2]" 2
19 1 59 LEU O 1 63 ILE H 2.300 . 2.500 1.643 1.596 1.758 0.004 7 0 "[ . 1 . 2]" 2
20 1 59 LEU O 1 63 ILE N 3.300 2.600 3.500 2.604 2.548 2.711 0.052 7 0 "[ . 1 . 2]" 2
21 1 60 ASN O 1 64 GLU H 2.300 . 2.500 2.240 1.986 2.521 0.021 1 0 "[ . 1 . 2]" 2
22 1 60 ASN O 1 64 GLU N 3.300 2.600 3.500 3.204 2.943 3.488 . 0 0 "[ . 1 . 2]" 2
23 1 62 LEU O 1 66 ILE H 2.300 . 2.500 1.644 1.596 1.730 0.004 14 0 "[ . 1 . 2]" 2
24 1 62 LEU O 1 66 ILE N 3.300 2.600 3.500 2.595 2.544 2.696 0.056 17 0 "[ . 1 . 2]" 2
25 1 64 GLU O 1 67 ALA H 2.300 . 2.500 2.555 2.517 2.580 0.080 12 0 "[ . 1 . 2]" 2
26 1 64 GLU O 1 67 ALA N 3.300 2.600 3.500 2.843 2.804 2.885 . 0 0 "[ . 1 . 2]" 2
27 1 66 ILE O 1 70 VAL H 2.300 . 2.500 1.624 1.598 1.701 0.002 16 0 "[ . 1 . 2]" 2
28 1 66 ILE O 1 70 VAL N 3.300 2.600 3.500 2.581 2.554 2.669 0.046 5 0 "[ . 1 . 2]" 2
29 1 67 ALA O 1 71 MET H 2.300 . 2.500 1.860 1.611 2.267 . 0 0 "[ . 1 . 2]" 2
30 1 67 ALA O 1 71 MET N 3.300 2.600 3.500 2.805 2.578 3.212 0.022 11 0 "[ . 1 . 2]" 2
31 1 70 VAL O 1 74 LYS H 2.300 . 2.500 1.761 1.610 2.082 . 0 0 "[ . 1 . 2]" 2
32 1 70 VAL O 1 74 LYS N 3.300 2.600 3.500 2.709 2.572 3.033 0.028 14 0 "[ . 1 . 2]" 2
33 1 72 SER O 1 75 ILE H 2.300 . 2.500 2.191 1.931 2.399 . 0 0 "[ . 1 . 2]" 2
34 1 72 SER O 1 75 ILE N 3.300 2.600 3.500 2.852 2.680 3.001 . 0 0 "[ . 1 . 2]" 2
35 1 73 PHE O 1 77 TYR H 2.300 . 2.500 1.776 1.591 2.518 0.018 1 0 "[ . 1 . 2]" 2
36 1 73 PHE O 1 77 TYR N 3.300 2.600 3.500 2.705 2.551 3.477 0.049 3 0 "[ . 1 . 2]" 2
37 1 83 LEU O 1 87 VAL H 2.300 . 2.500 1.715 1.601 2.056 . 0 0 "[ . 1 . 2]" 2
38 1 83 LEU O 1 87 VAL N 3.300 2.600 3.500 2.671 2.558 2.987 0.042 7 0 "[ . 1 . 2]" 2
39 1 84 SER O 1 88 GLU H 2.300 . 2.500 1.697 1.594 1.933 0.006 8 0 "[ . 1 . 2]" 2
40 1 84 SER O 1 88 GLU N 3.300 2.600 3.500 2.656 2.555 2.900 0.045 8 0 "[ . 1 . 2]" 2
41 1 86 LEU O 1 90 TYR H 2.300 . 2.500 1.717 1.615 1.831 . 0 0 "[ . 1 . 2]" 2
42 1 86 LEU O 1 90 TYR N 3.300 2.600 3.500 2.674 2.581 2.805 0.019 18 0 "[ . 1 . 2]" 2
43 1 87 VAL O 1 91 LEU H 2.300 . 2.500 1.710 1.597 1.967 0.003 11 0 "[ . 1 . 2]" 2
44 1 87 VAL O 1 91 LEU N 3.300 2.600 3.500 2.663 2.566 2.917 0.034 11 0 "[ . 1 . 2]" 2
45 1 88 GLU O 1 92 ASP H 2.300 . 2.500 1.782 1.643 2.071 . 0 0 "[ . 1 . 2]" 2
46 1 88 GLU O 1 92 ASP N 3.300 2.600 3.500 2.749 2.614 3.049 . 0 0 "[ . 1 . 2]" 2
47 1 89 GLU O 1 93 ASP H 2.300 . 2.500 1.715 1.612 1.909 . 0 0 "[ . 1 . 2]" 2
48 1 89 GLU O 1 93 ASP N 3.300 2.600 3.500 2.675 2.568 2.876 0.032 10 0 "[ . 1 . 2]" 2
49 1 90 TYR O 1 94 THR H 2.300 . 2.500 1.786 1.663 1.971 . 0 0 "[ . 1 . 2]" 2
50 1 90 TYR O 1 94 THR N 3.300 2.600 3.500 2.751 2.618 2.941 . 0 0 "[ . 1 . 2]" 2
51 1 91 LEU O 1 95 TYR H 2.300 . 2.500 1.730 1.627 1.903 . 0 0 "[ . 1 . 2]" 2
52 1 91 LEU O 1 95 TYR N 3.300 2.600 3.500 2.685 2.591 2.866 0.009 3 0 "[ . 1 . 2]" 2
53 1 93 ASP O 1 97 LEU H 2.300 . 2.500 1.829 1.670 2.127 . 0 0 "[ . 1 . 2]" 2
54 1 93 ASP O 1 97 LEU N 3.300 2.600 3.500 2.786 2.626 3.084 . 0 0 "[ . 1 . 2]" 2
55 1 94 THR O 1 98 PHE H 2.300 . 2.500 2.003 1.865 2.351 . 0 0 "[ . 1 . 2]" 2
56 1 94 THR O 1 98 PHE N 3.300 2.600 3.500 2.955 2.810 3.314 . 0 0 "[ . 1 . 2]" 2
57 1 108 LEU O 1 112 GLN H 2.300 . 2.500 1.787 1.626 2.062 . 0 0 "[ . 1 . 2]" 2
58 1 108 LEU O 1 112 GLN N 3.300 2.600 3.500 2.728 2.593 3.004 0.007 15 0 "[ . 1 . 2]" 2
59 1 110 ARG O 1 113 LYS H 2.300 . 2.500 2.453 1.973 2.586 0.086 18 0 "[ . 1 . 2]" 2
60 1 110 ARG O 1 113 LYS N 3.300 2.600 3.500 2.907 2.666 3.120 . 0 0 "[ . 1 . 2]" 2
61 1 111 TRP O 1 115 LYS H 2.300 . 2.500 1.865 1.619 2.222 . 0 0 "[ . 1 . 2]" 2
62 1 111 TRP O 1 115 LYS N 3.300 2.600 3.500 2.818 2.576 3.195 0.024 11 0 "[ . 1 . 2]" 2
63 1 112 GLN O 1 116 GLU H 2.300 . 2.500 2.171 1.676 2.521 0.021 5 0 "[ . 1 . 2]" 2
64 1 112 GLN O 1 116 GLU N 3.300 2.600 3.500 3.131 2.645 3.491 . 0 0 "[ . 1 . 2]" 2
65 1 113 LYS O 1 117 ARG H 2.300 . 2.500 1.850 1.643 2.205 . 0 0 "[ . 1 . 2]" 2
66 1 113 LYS O 1 117 ARG N 3.300 2.600 3.500 2.812 2.591 3.175 0.009 3 0 "[ . 1 . 2]" 2
67 1 115 LYS O 1 118 LEU H 2.300 . 2.500 2.569 2.502 2.626 0.126 3 0 "[ . 1 . 2]" 2
68 1 115 LYS O 1 118 LEU N 3.300 2.600 3.500 2.959 2.769 3.281 . 0 0 "[ . 1 . 2]" 2
69 1 116 GLU O 1 119 PHE H 2.300 . 2.500 2.382 2.000 2.576 0.076 8 0 "[ . 1 . 2]" 2
70 1 116 GLU O 1 119 PHE N 3.300 2.600 3.500 2.922 2.664 3.163 . 0 0 "[ . 1 . 2]" 2
71 1 118 LEU O 1 121 LEU H 2.300 . 2.500 2.588 2.500 2.687 0.187 4 0 "[ . 1 . 2]" 2
72 1 118 LEU O 1 121 LEU N 3.300 2.600 3.500 3.121 2.979 3.267 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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