NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
617506 |
5ghc   |
36007 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5ghc
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 2386
_Distance_constraint_stats_list.Viol_count 4158
_Distance_constraint_stats_list.Viol_total 6222.022
_Distance_constraint_stats_list.Viol_max 0.557
_Distance_constraint_stats_list.Viol_rms 0.0301
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0065
_Distance_constraint_stats_list.Viol_average_violations_only 0.0748
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 15 MET 1.321 0.310 2 0 "[ . 1 . 2]"
1 16 ALA 2.647 0.310 2 0 "[ . 1 . 2]"
1 17 ASP 1.562 0.246 20 0 "[ . 1 . 2]"
1 18 GLU 1.100 0.239 3 0 "[ . 1 . 2]"
1 19 LYS 2.750 0.246 20 0 "[ . 1 . 2]"
1 20 PRO 4.863 0.260 5 0 "[ . 1 . 2]"
1 21 LYS 4.600 0.280 9 0 "[ . 1 . 2]"
1 22 GLU 3.900 0.327 9 0 "[ . 1 . 2]"
1 23 GLY 1.776 0.327 9 0 "[ . 1 . 2]"
1 24 VAL 3.440 0.379 5 0 "[ . 1 . 2]"
1 25 LYS 3.964 0.259 14 0 "[ . 1 . 2]"
1 26 THR 3.449 0.385 8 0 "[ . 1 . 2]"
1 27 GLU 4.948 0.409 11 0 "[ . 1 . 2]"
1 28 ASN 4.112 0.336 11 0 "[ . 1 . 2]"
1 29 ASN 1.942 0.409 11 0 "[ . 1 . 2]"
1 30 ASP 1.205 0.290 17 0 "[ . 1 . 2]"
1 31 HIS 4.378 0.534 19 1 "[ . 1 . +2]"
1 32 ILE 5.559 0.534 19 1 "[ . 1 . +2]"
1 33 ASN 5.711 0.235 6 0 "[ . 1 . 2]"
1 34 LEU 4.350 0.175 4 0 "[ . 1 . 2]"
1 35 LYS 7.087 0.188 12 0 "[ . 1 . 2]"
1 36 VAL 25.909 0.422 1 0 "[ . 1 . 2]"
1 37 ALA 3.800 0.244 14 0 "[ . 1 . 2]"
1 38 GLY 3.744 0.309 1 0 "[ . 1 . 2]"
1 39 GLN 5.372 0.309 1 0 "[ . 1 . 2]"
1 40 ASP 1.393 0.197 10 0 "[ . 1 . 2]"
1 41 GLY 1.368 0.336 7 0 "[ . 1 . 2]"
1 42 SER 2.271 0.336 7 0 "[ . 1 . 2]"
1 43 VAL 7.425 0.308 5 0 "[ . 1 . 2]"
1 44 VAL 12.408 0.191 3 0 "[ . 1 . 2]"
1 45 GLN 8.163 0.137 10 0 "[ . 1 . 2]"
1 46 PHE 8.311 0.188 12 0 "[ . 1 . 2]"
1 48 ILE 4.828 0.203 5 0 "[ . 1 . 2]"
1 49 LYS 6.468 0.443 7 0 "[ . 1 . 2]"
1 50 ARG 12.025 0.238 16 0 "[ . 1 . 2]"
1 51 HIS 6.900 0.254 20 0 "[ . 1 . 2]"
1 52 THR 13.310 0.443 7 0 "[ . 1 . 2]"
1 53 PRO 2.125 0.203 18 0 "[ . 1 . 2]"
1 54 LEU 7.234 0.293 8 0 "[ . 1 . 2]"
1 55 SER 2.207 0.183 6 0 "[ . 1 . 2]"
1 56 LYS 3.215 0.341 6 0 "[ . 1 . 2]"
1 57 LEU 8.884 0.347 7 0 "[ . 1 . 2]"
1 58 MET 2.998 0.293 8 0 "[ . 1 . 2]"
1 59 LYS 7.473 0.258 7 0 "[ . 1 . 2]"
1 60 ALA 3.959 0.169 14 0 "[ . 1 . 2]"
1 61 TYR 17.557 0.200 16 0 "[ . 1 . 2]"
1 62 CYS 4.876 0.176 9 0 "[ . 1 . 2]"
1 63 GLU 3.502 0.145 14 0 "[ . 1 . 2]"
1 64 ARG 6.909 0.200 16 0 "[ . 1 . 2]"
1 65 GLN 13.891 0.396 8 0 "[ . 1 . 2]"
1 66 GLY 1.995 0.231 14 0 "[ . 1 . 2]"
1 67 LEU 14.823 0.396 8 0 "[ . 1 . 2]"
1 68 SER 6.420 0.192 14 0 "[ . 1 . 2]"
1 69 MET 11.454 0.229 18 0 "[ . 1 . 2]"
1 70 ARG 6.979 0.167 9 0 "[ . 1 . 2]"
1 71 GLN 12.204 0.356 17 0 "[ . 1 . 2]"
1 72 ILE 11.594 0.356 17 0 "[ . 1 . 2]"
1 73 ARG 7.222 0.181 2 0 "[ . 1 . 2]"
1 74 PHE 9.551 0.313 11 0 "[ . 1 . 2]"
1 75 ARG 8.695 0.320 18 0 "[ . 1 . 2]"
1 76 PHE 10.208 0.371 11 0 "[ . 1 . 2]"
1 77 ASP 13.618 0.441 18 0 "[ . 1 . 2]"
1 78 GLY 9.411 0.441 18 0 "[ . 1 . 2]"
1 79 GLN 9.809 0.242 4 0 "[ . 1 . 2]"
1 80 PRO 2.003 0.242 4 0 "[ . 1 . 2]"
1 81 ILE 5.107 0.139 19 0 "[ . 1 . 2]"
1 82 ASN 11.914 0.557 16 3 "[ . 1- .+ *]"
1 83 GLU 4.918 0.504 15 1 "[ . 1 + 2]"
1 84 THR 10.346 0.504 15 1 "[ . 1 + 2]"
1 85 ASP 11.639 0.557 16 3 "[ . 1- .+ *]"
1 86 THR 4.372 0.209 6 0 "[ . 1 . 2]"
1 87 PRO 9.281 0.304 17 0 "[ . 1 . 2]"
1 88 ALA 11.345 0.304 17 0 "[ . 1 . 2]"
1 89 GLN 5.555 0.280 20 0 "[ . 1 . 2]"
1 90 LEU 13.754 0.290 5 0 "[ . 1 . 2]"
1 91 GLU 1.004 0.290 5 0 "[ . 1 . 2]"
1 92 MET 6.379 0.159 4 0 "[ . 1 . 2]"
1 93 GLU 4.178 0.194 8 0 "[ . 1 . 2]"
1 94 ASP 1.931 0.279 20 0 "[ . 1 . 2]"
1 95 GLU 5.369 0.320 2 0 "[ . 1 . 2]"
1 96 ASP 8.078 0.371 11 0 "[ . 1 . 2]"
1 97 THR 0.804 0.090 4 0 "[ . 1 . 2]"
1 98 ILE 21.004 0.422 1 0 "[ . 1 . 2]"
1 99 ASP 3.343 0.217 14 0 "[ . 1 . 2]"
1 100 VAL 7.649 0.181 8 0 "[ . 1 . 2]"
1 101 PHE 5.396 0.182 5 0 "[ . 1 . 2]"
1 102 GLN 5.290 0.304 6 0 "[ . 1 . 2]"
1 103 GLN 1.800 0.181 2 0 "[ . 1 . 2]"
1 104 GLN 2.534 0.173 5 0 "[ . 1 . 2]"
1 105 THR 0.303 0.095 19 0 "[ . 1 . 2]"
1 106 GLY 0.182 0.071 13 0 "[ . 1 . 2]"
1 107 GLY 0.222 0.095 19 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 54 LEU HB2 1 57 LEU MD1 4.530 . 4.530 3.714 3.298 3.991 . 0 0 "[ . 1 . 2]" 1
2 1 57 LEU HB3 1 57 LEU MD1 3.320 . 3.320 3.169 3.151 3.189 . 0 0 "[ . 1 . 2]" 1
3 1 57 LEU MD1 1 98 ILE MG 4.130 . 4.130 3.734 3.401 3.973 . 0 0 "[ . 1 . 2]" 1
4 1 74 PHE QD 1 100 VAL MG2 4.740 . 4.740 2.602 2.526 2.687 . 0 0 "[ . 1 . 2]" 1
5 1 74 PHE QE 1 100 VAL MG2 4.150 . 4.150 2.823 2.726 2.939 . 0 0 "[ . 1 . 2]" 1
6 1 74 PHE HA 1 100 VAL MG2 4.150 . 4.150 2.344 2.167 2.547 . 0 0 "[ . 1 . 2]" 1
7 1 100 VAL HA 1 100 VAL MG2 3.410 . 3.410 2.316 2.249 2.368 . 0 0 "[ . 1 . 2]" 1
8 1 72 ILE HB 1 100 VAL MG2 4.470 . 4.470 4.212 4.001 4.402 . 0 0 "[ . 1 . 2]" 1
9 1 46 PHE HB2 1 57 LEU MD2 4.110 . 4.110 2.734 2.464 3.079 . 0 0 "[ . 1 . 2]" 1
10 1 34 LEU HB2 1 57 LEU MD2 3.520 . 3.520 2.166 2.056 2.337 . 0 0 "[ . 1 . 2]" 1
11 1 100 VAL MG1 1 101 PHE H 3.880 . 3.880 2.396 2.320 2.459 . 0 0 "[ . 1 . 2]" 1
12 1 100 VAL H 1 100 VAL MG1 3.930 . 3.930 3.816 3.772 3.856 . 0 0 "[ . 1 . 2]" 1
13 1 74 PHE HA 1 100 VAL MG1 4.150 . 4.150 3.602 3.455 3.837 . 0 0 "[ . 1 . 2]" 1
14 1 100 VAL HA 1 100 VAL MG1 3.410 . 3.410 2.461 2.406 2.521 . 0 0 "[ . 1 . 2]" 1
15 1 72 ILE HB 1 100 VAL MG1 4.470 . 4.470 2.111 1.974 2.251 . 0 0 "[ . 1 . 2]" 1
16 1 72 ILE HG13 1 100 VAL MG1 5.210 . 5.210 3.018 2.887 3.133 . 0 0 "[ . 1 . 2]" 1
17 1 98 ILE MG 1 100 VAL MG1 4.730 . 4.730 4.691 4.565 4.817 0.087 11 0 "[ . 1 . 2]" 1
18 1 32 ILE MD 1 33 ASN H 4.200 . 4.200 4.008 3.843 4.223 0.023 1 0 "[ . 1 . 2]" 1
19 1 32 ILE MD 1 94 ASP HA 3.580 . 3.580 3.335 3.044 3.574 . 0 0 "[ . 1 . 2]" 1
20 1 32 ILE MD 1 87 PRO HB2 3.600 . 3.600 2.185 1.962 2.447 . 0 0 "[ . 1 . 2]" 1
21 1 32 ILE HB 1 32 ILE MD 3.290 . 3.290 2.375 2.267 2.410 . 0 0 "[ . 1 . 2]" 1
22 1 32 ILE MD 1 34 LEU MD2 2.980 . 2.980 2.182 2.061 2.472 . 0 0 "[ . 1 . 2]" 1
23 1 54 LEU H 1 54 LEU MD1 4.000 . 4.000 2.903 1.773 3.817 0.027 17 0 "[ . 1 . 2]" 1
24 1 54 LEU HB2 1 54 LEU MD1 3.380 . 3.380 2.398 2.336 3.136 . 0 0 "[ . 1 . 2]" 1
25 1 98 ILE H 1 98 ILE MD 4.090 . 4.090 3.437 3.347 3.532 . 0 0 "[ . 1 . 2]" 1
26 1 74 PHE QD 1 98 ILE MD 4.220 . 4.220 4.177 4.070 4.257 0.037 8 0 "[ . 1 . 2]" 1
27 1 98 ILE HA 1 98 ILE MD 3.930 . 3.930 2.180 2.123 2.247 . 0 0 "[ . 1 . 2]" 1
28 1 57 LEU MD2 1 98 ILE MD 4.140 . 4.140 3.880 3.589 4.145 0.005 18 0 "[ . 1 . 2]" 1
29 1 54 LEU HB2 1 54 LEU MD2 3.380 . 3.380 2.592 2.375 3.220 . 0 0 "[ . 1 . 2]" 1
30 1 34 LEU HB3 1 34 LEU MD1 3.450 . 3.450 2.492 2.474 2.512 . 0 0 "[ . 1 . 2]" 1
31 1 61 TYR QD 1 72 ILE MG 5.140 . 5.140 4.769 4.524 4.968 . 0 0 "[ . 1 . 2]" 1
32 1 72 ILE HA 1 72 ILE MG 3.340 . 3.340 2.418 2.378 2.447 . 0 0 "[ . 1 . 2]" 1
33 1 72 ILE MG 1 102 GLN HA 3.420 . 3.420 2.474 2.308 2.664 . 0 0 "[ . 1 . 2]" 1
34 1 71 GLN HB2 1 72 ILE MG 3.470 . 3.470 3.242 3.142 3.364 . 0 0 "[ . 1 . 2]" 1
35 1 72 ILE HG12 1 72 ILE MG 3.260 . 3.260 2.454 2.420 2.493 . 0 0 "[ . 1 . 2]" 1
36 1 75 ARG H 1 81 ILE MD 4.250 . 4.250 3.242 3.043 3.322 . 0 0 "[ . 1 . 2]" 1
37 1 76 PHE H 1 81 ILE MD 4.000 . 4.000 3.433 3.232 3.621 . 0 0 "[ . 1 . 2]" 1
38 1 81 ILE MD 1 99 ASP H 4.520 . 4.520 3.970 3.824 4.101 . 0 0 "[ . 1 . 2]" 1
39 1 76 PHE QD 1 81 ILE MD 4.090 . 4.090 3.658 3.572 3.748 . 0 0 "[ . 1 . 2]" 1
40 1 74 PHE HB2 1 81 ILE MD 3.370 . 3.370 2.922 2.727 3.133 . 0 0 "[ . 1 . 2]" 1
41 1 74 PHE HB3 1 81 ILE MD 3.580 . 3.580 2.020 1.970 2.066 . 0 0 "[ . 1 . 2]" 1
42 1 81 ILE HB 1 81 ILE MD 3.190 . 3.190 2.405 2.373 2.429 . 0 0 "[ . 1 . 2]" 1
43 1 81 ILE MD 1 81 ILE MG 2.750 . 2.750 1.938 1.902 1.966 . 0 0 "[ . 1 . 2]" 1
44 1 48 ILE MD 1 57 LEU MD1 4.820 . 4.820 4.386 4.208 4.537 . 0 0 "[ . 1 . 2]" 1
45 1 57 LEU MD1 1 81 ILE MD 5.230 . 5.230 4.518 4.351 4.697 . 0 0 "[ . 1 . 2]" 1
46 1 72 ILE MD 1 73 ARG H 3.990 . 3.990 3.804 3.684 3.910 . 0 0 "[ . 1 . 2]" 1
47 1 48 ILE MD 1 49 LYS H 4.480 . 4.480 3.938 3.590 4.161 . 0 0 "[ . 1 . 2]" 1
48 1 72 ILE MD 1 74 PHE HZ 3.570 . 3.570 2.799 2.569 2.982 . 0 0 "[ . 1 . 2]" 1
49 1 61 TYR QD 1 72 ILE MD 3.370 . 3.370 2.481 2.332 2.630 . 0 0 "[ . 1 . 2]" 1
50 1 48 ILE HA 1 48 ILE MD 4.330 . 4.330 4.187 4.163 4.211 . 0 0 "[ . 1 . 2]" 1
51 1 48 ILE MD 1 52 THR HB 4.610 . 4.610 3.532 3.251 4.310 . 0 0 "[ . 1 . 2]" 1
52 1 72 ILE HB 1 72 ILE MD 3.190 . 3.190 2.497 2.462 2.520 . 0 0 "[ . 1 . 2]" 1
53 1 48 ILE MD 1 52 THR MG 2.710 . 2.710 2.327 2.008 2.666 . 0 0 "[ . 1 . 2]" 1
54 1 48 ILE MD 1 57 LEU MD2 3.150 . 3.150 1.977 1.826 2.160 . 0 0 "[ . 1 . 2]" 1
55 1 32 ILE MG 1 94 ASP QB 3.710 . 3.710 2.735 2.370 3.989 0.279 20 0 "[ . 1 . 2]" 1
56 1 32 ILE MG 1 50 ARG HB2 4.330 . 4.330 4.303 3.838 4.476 0.146 20 0 "[ . 1 . 2]" 1
57 1 32 ILE MD 1 32 ILE MG 3.100 . 3.100 2.015 1.982 2.063 . 0 0 "[ . 1 . 2]" 1
58 1 44 VAL MG1 1 46 PHE QD 4.120 . 4.120 3.692 3.583 3.785 . 0 0 "[ . 1 . 2]" 1
59 1 44 VAL MG1 1 61 TYR QD 4.420 . 4.420 3.655 3.476 3.807 . 0 0 "[ . 1 . 2]" 1
60 1 48 ILE HA 1 48 ILE MG 3.420 . 3.420 2.440 2.404 2.467 . 0 0 "[ . 1 . 2]" 1
61 1 44 VAL MG1 1 45 GLN H 3.240 . 3.240 2.384 2.251 2.498 . 0 0 "[ . 1 . 2]" 1
62 1 67 LEU H 1 67 LEU MD2 4.060 . 4.060 2.817 2.268 4.124 0.064 14 0 "[ . 1 . 2]" 1
63 1 90 LEU H 1 90 LEU MD2 3.900 . 3.900 3.894 3.771 3.956 0.056 7 0 "[ . 1 . 2]" 1
64 1 67 LEU HA 1 67 LEU MD1 4.160 . 4.160 1.968 1.930 2.044 . 0 0 "[ . 1 . 2]" 1
65 1 90 LEU HA 1 90 LEU MD2 4.250 . 4.250 3.462 3.378 3.673 . 0 0 "[ . 1 . 2]" 1
66 1 90 LEU HB2 1 90 LEU MD1 2.880 . 2.880 2.169 2.139 2.206 . 0 0 "[ . 1 . 2]" 1
67 1 81 ILE H 1 81 ILE MG 3.980 . 3.980 3.810 3.786 3.833 . 0 0 "[ . 1 . 2]" 1
68 1 54 LEU MD2 1 81 ILE MG 3.100 . 3.100 2.224 2.041 2.517 . 0 0 "[ . 1 . 2]" 1
69 1 90 LEU H 1 90 LEU MD1 3.410 . 3.410 1.780 1.712 1.857 0.088 5 0 "[ . 1 . 2]" 1
70 1 76 PHE HB3 1 90 LEU MD1 4.080 . 4.080 4.018 3.852 4.182 0.102 17 0 "[ . 1 . 2]" 1
71 1 43 VAL HA 1 43 VAL MG2 3.180 . 3.180 2.493 2.449 2.524 . 0 0 "[ . 1 . 2]" 1
72 1 23 GLY QA 1 24 VAL QG 4.020 . 4.020 3.713 3.050 4.114 0.094 8 0 "[ . 1 . 2]" 1
73 1 98 ILE MG 1 99 ASP H 3.540 . 3.540 2.407 2.259 2.573 . 0 0 "[ . 1 . 2]" 1
74 1 88 ALA MB 1 90 LEU H 4.910 . 4.910 4.704 4.565 4.876 . 0 0 "[ . 1 . 2]" 1
75 1 98 ILE MD 1 98 ILE MG 2.870 . 2.870 1.994 1.928 2.067 . 0 0 "[ . 1 . 2]" 1
76 1 98 ILE MG 1 100 VAL H 4.010 . 4.010 4.106 4.040 4.172 0.162 19 0 "[ . 1 . 2]" 1
77 1 44 VAL MG2 1 64 ARG HD2 4.140 . 4.140 3.409 2.079 3.724 . 0 0 "[ . 1 . 2]" 1
78 1 36 VAL MG1 1 44 VAL MG2 4.510 . 4.510 3.305 2.431 4.407 . 0 0 "[ . 1 . 2]" 1
79 1 97 THR MG 1 98 ILE H 3.400 . 3.400 2.727 2.380 3.087 . 0 0 "[ . 1 . 2]" 1
80 1 92 MET H 1 92 MET ME 4.280 . 4.280 4.274 4.210 4.323 0.043 1 0 "[ . 1 . 2]" 1
81 1 92 MET ME 1 98 ILE HA 5.150 . 5.150 4.573 4.351 4.779 . 0 0 "[ . 1 . 2]" 1
82 1 87 PRO HA 1 92 MET ME 3.810 . 3.810 3.716 3.631 3.816 0.006 10 0 "[ . 1 . 2]" 1
83 1 92 MET ME 1 92 MET HG3 3.290 . 3.290 2.610 2.540 2.656 . 0 0 "[ . 1 . 2]" 1
84 1 92 MET ME 1 98 ILE MD 2.580 . 2.580 2.023 1.878 2.221 . 0 0 "[ . 1 . 2]" 1
85 1 84 THR H 1 84 THR MG 3.120 . 3.120 2.394 1.808 2.902 . 0 0 "[ . 1 . 2]" 1
86 1 48 ILE HG13 1 49 LYS HB2 5.440 . 5.440 4.948 4.765 5.141 . 0 0 "[ . 1 . 2]" 1
87 1 75 ARG HB3 1 81 ILE HG13 5.920 . 5.920 4.881 4.761 5.029 . 0 0 "[ . 1 . 2]" 1
88 1 76 PHE H 1 81 ILE HG13 4.110 . 4.110 2.802 2.645 2.970 . 0 0 "[ . 1 . 2]" 1
89 1 16 ALA MB 1 17 ASP H 3.830 . 3.830 3.480 3.133 3.721 . 0 0 "[ . 1 . 2]" 1
90 1 37 ALA H 1 37 ALA MB 3.140 . 3.140 2.444 2.405 2.470 . 0 0 "[ . 1 . 2]" 1
91 1 37 ALA MB 1 100 VAL H 4.370 . 4.370 3.987 3.767 4.281 . 0 0 "[ . 1 . 2]" 1
92 1 48 ILE HA 1 52 THR MG 3.860 . 3.860 3.719 3.502 3.983 0.123 11 0 "[ . 1 . 2]" 1
93 1 52 THR MG 1 53 PRO HG3 4.560 . 4.560 4.190 3.914 4.612 0.052 19 0 "[ . 1 . 2]" 1
94 1 77 ASP H 1 77 ASP HB3 4.160 . 4.160 3.738 3.616 4.012 . 0 0 "[ . 1 . 2]" 1
95 1 21 LYS QD 1 21 LYS QG 2.400 . 2.400 2.070 1.997 2.096 . 0 0 "[ . 1 . 2]" 1
96 1 58 MET ME 1 83 GLU H 3.500 . 3.500 3.384 3.224 3.568 0.068 12 0 "[ . 1 . 2]" 1
97 1 58 MET HA 1 58 MET ME 4.460 . 4.460 4.419 4.265 4.454 . 0 0 "[ . 1 . 2]" 1
98 1 58 MET ME 1 74 PHE HB2 3.890 . 3.890 3.805 2.889 3.943 0.053 11 0 "[ . 1 . 2]" 1
99 1 58 MET ME 1 58 MET HG3 3.480 . 3.480 2.613 2.529 3.411 . 0 0 "[ . 1 . 2]" 1
100 1 58 MET ME 1 81 ILE MG 2.760 . 2.760 2.646 2.429 2.777 0.017 16 0 "[ . 1 . 2]" 1
101 1 58 MET ME 1 58 MET HG2 3.480 . 3.480 3.371 2.604 3.418 . 0 0 "[ . 1 . 2]" 1
102 1 56 LYS QE 1 56 LYS HG3 3.840 . 3.840 3.096 2.322 3.523 . 0 0 "[ . 1 . 2]" 1
103 1 60 ALA MB 1 63 GLU H 4.820 . 4.820 4.681 4.589 4.759 . 0 0 "[ . 1 . 2]" 1
104 1 59 LYS QB 1 60 ALA MB 3.900 . 3.900 3.942 3.884 3.989 0.089 10 0 "[ . 1 . 2]" 1
105 1 70 ARG HA 1 70 ARG QG 3.550 . 3.550 3.445 3.381 3.501 . 0 0 "[ . 1 . 2]" 1
106 1 89 GLN HB2 1 90 LEU HG 3.940 . 3.940 3.662 3.025 4.187 0.247 13 0 "[ . 1 . 2]" 1
107 1 72 ILE H 1 72 ILE HB 4.030 . 4.030 3.919 3.875 3.957 . 0 0 "[ . 1 . 2]" 1
108 1 25 LYS QD 1 26 THR H 4.600 . 4.600 3.717 2.532 4.825 0.225 4 0 "[ . 1 . 2]" 1
109 1 53 PRO HD2 1 56 LYS QD 4.430 . 4.430 3.420 2.867 4.457 0.027 16 0 "[ . 1 . 2]" 1
110 1 53 PRO HG3 1 56 LYS QD 4.560 . 4.560 4.001 3.487 4.763 0.203 18 0 "[ . 1 . 2]" 1
111 1 59 LYS QD 1 69 MET ME 4.700 . 4.700 3.390 1.888 3.891 . 0 0 "[ . 1 . 2]" 1
112 1 70 ARG QG 1 71 GLN HB2 4.140 . 4.140 3.572 3.351 3.721 . 0 0 "[ . 1 . 2]" 1
113 1 49 LYS HB2 1 52 THR HA 4.500 . 4.500 4.041 3.808 4.556 0.056 19 0 "[ . 1 . 2]" 1
114 1 56 LYS HB2 1 57 LEU HA 5.080 . 5.080 4.273 4.146 4.470 . 0 0 "[ . 1 . 2]" 1
115 1 73 ARG H 1 73 ARG HB2 3.460 . 3.460 2.860 2.775 2.968 . 0 0 "[ . 1 . 2]" 1
116 1 70 ARG H 1 70 ARG HB2 3.940 . 3.940 3.648 3.596 3.677 . 0 0 "[ . 1 . 2]" 1
117 1 64 ARG QG 1 65 GLN HA 4.170 . 4.170 3.316 3.179 3.526 . 0 0 "[ . 1 . 2]" 1
118 1 21 LYS H 1 21 LYS HB3 3.660 . 3.660 2.839 2.271 3.390 . 0 0 "[ . 1 . 2]" 1
119 1 49 LYS H 1 49 LYS HB3 3.710 . 3.710 3.586 3.549 3.626 . 0 0 "[ . 1 . 2]" 1
120 1 21 LYS HB3 1 21 LYS QG 2.670 . 2.670 2.255 2.158 2.447 . 0 0 "[ . 1 . 2]" 1
121 1 27 GLU QB 1 27 GLU QG 2.500 . 2.500 2.046 1.985 2.089 . 0 0 "[ . 1 . 2]" 1
122 1 79 GLN HA 1 80 PRO HG2 4.730 . 4.730 4.516 4.455 4.644 . 0 0 "[ . 1 . 2]" 1
123 1 65 GLN HA 1 65 GLN HB3 2.870 . 2.870 2.498 2.473 2.555 . 0 0 "[ . 1 . 2]" 1
124 1 20 PRO QG 1 21 LYS QD 5.020 . 5.020 4.626 3.649 5.250 0.230 17 0 "[ . 1 . 2]" 1
125 1 55 SER HA 1 83 GLU HB3 4.910 . 4.910 4.299 3.702 4.846 . 0 0 "[ . 1 . 2]" 1
126 1 65 GLN HB3 1 66 GLY QA 5.410 . 5.410 4.535 4.451 4.610 . 0 0 "[ . 1 . 2]" 1
127 1 71 GLN HA 1 104 GLN QB 3.480 . 3.480 2.573 1.867 3.545 0.065 5 0 "[ . 1 . 2]" 1
128 1 45 GLN HB2 1 46 PHE H 4.260 . 4.260 3.907 3.846 3.968 . 0 0 "[ . 1 . 2]" 1
129 1 63 GLU HB3 1 64 ARG H 3.800 . 3.800 3.610 3.361 3.856 0.056 6 0 "[ . 1 . 2]" 1
130 1 63 GLU H 1 63 GLU HB3 3.590 . 3.590 3.574 3.544 3.593 0.003 13 0 "[ . 1 . 2]" 1
131 1 69 MET H 1 69 MET ME 4.370 . 4.370 4.435 4.367 4.510 0.140 16 0 "[ . 1 . 2]" 1
132 1 69 MET HA 1 69 MET ME 3.430 . 3.430 3.560 3.511 3.633 0.203 10 0 "[ . 1 . 2]" 1
133 1 59 LYS HA 1 69 MET ME 3.080 . 3.080 2.138 2.045 2.206 . 0 0 "[ . 1 . 2]" 1
134 1 62 CYS HB3 1 69 MET ME 4.380 . 4.380 3.529 3.001 4.220 . 0 0 "[ . 1 . 2]" 1
135 1 69 MET ME 1 69 MET QG 2.780 . 2.780 2.189 2.177 2.199 . 0 0 "[ . 1 . 2]" 1
136 1 15 MET ME 1 15 MET HG2 3.500 . 3.500 2.692 2.489 3.412 . 0 0 "[ . 1 . 2]" 1
137 1 58 MET QB 1 69 MET ME 2.780 . 2.780 1.989 1.876 2.113 . 0 0 "[ . 1 . 2]" 1
138 1 44 VAL HB 1 61 TYR QE 4.200 . 4.200 4.010 3.657 4.217 0.017 9 0 "[ . 1 . 2]" 1
139 1 45 GLN H 1 45 GLN HG3 3.750 . 3.750 3.347 3.251 3.406 . 0 0 "[ . 1 . 2]" 1
140 1 91 GLU H 1 91 GLU QG 3.870 . 3.870 2.991 2.641 4.009 0.139 5 0 "[ . 1 . 2]" 1
141 1 91 GLU HA 1 91 GLU QG 3.520 . 3.520 2.833 2.325 3.379 . 0 0 "[ . 1 . 2]" 1
142 1 79 GLN HB3 1 79 GLN HG2 2.960 . 2.960 2.427 2.329 2.485 . 0 0 "[ . 1 . 2]" 1
143 1 27 GLU HA 1 27 GLU QG 3.370 . 3.370 2.809 2.360 3.443 0.073 2 0 "[ . 1 . 2]" 1
144 1 21 LYS QG 1 22 GLU QG 4.160 . 4.160 3.596 1.888 4.249 0.089 3 0 "[ . 1 . 2]" 1
145 1 79 GLN HA 1 80 PRO HG3 4.730 . 4.730 4.417 4.053 4.519 . 0 0 "[ . 1 . 2]" 1
146 1 63 GLU H 1 63 GLU HG2 3.510 . 3.510 3.220 2.147 3.582 0.072 17 0 "[ . 1 . 2]" 1
147 1 73 ARG HG3 1 103 GLN QG 4.080 . 4.080 2.307 2.022 2.643 . 0 0 "[ . 1 . 2]" 1
148 1 63 GLU HG2 1 64 ARG H 5.350 . 5.350 4.902 4.231 5.190 . 0 0 "[ . 1 . 2]" 1
149 1 94 ASP QB 1 95 GLU HG2 4.090 . 4.090 3.769 2.720 4.192 0.102 5 0 "[ . 1 . 2]" 1
150 1 83 GLU HA 1 83 GLU HG2 4.250 . 4.250 3.749 3.646 4.233 . 0 0 "[ . 1 . 2]" 1
151 1 93 GLU H 1 93 GLU HG3 4.070 . 4.070 3.359 3.153 3.654 . 0 0 "[ . 1 . 2]" 1
152 1 93 GLU HA 1 93 GLU HG3 3.930 . 3.930 3.754 3.670 3.840 . 0 0 "[ . 1 . 2]" 1
153 1 71 GLN H 1 71 GLN HG3 4.760 . 4.760 4.351 4.207 4.565 . 0 0 "[ . 1 . 2]" 1
154 1 102 GLN HA 1 102 GLN HG3 3.560 . 3.560 2.545 2.338 2.774 . 0 0 "[ . 1 . 2]" 1
155 1 102 GLN HB2 1 102 GLN HG2 2.710 . 2.710 2.637 2.517 2.717 0.007 1 0 "[ . 1 . 2]" 1
156 1 72 ILE MG 1 102 GLN HG3 3.630 . 3.630 3.693 3.210 3.797 0.167 5 0 "[ . 1 . 2]" 1
157 1 71 GLN HA 1 71 GLN HG3 3.600 . 3.600 2.512 2.422 2.690 . 0 0 "[ . 1 . 2]" 1
158 1 71 GLN H 1 71 GLN HG2 4.370 . 4.370 4.246 4.115 4.371 0.001 11 0 "[ . 1 . 2]" 1
159 1 39 GLN QG 1 101 PHE HB3 4.510 . 4.510 3.579 2.954 4.335 . 0 0 "[ . 1 . 2]" 1
160 1 71 GLN HB3 1 71 GLN HG2 2.970 . 2.970 2.457 2.400 2.549 . 0 0 "[ . 1 . 2]" 1
161 1 75 ARG HE 1 99 ASP QB 5.320 . 5.320 4.378 1.827 5.463 0.143 9 0 "[ . 1 . 2]" 1
162 1 75 ARG HD3 1 99 ASP QB 4.150 . 4.150 3.153 2.382 4.169 0.019 19 0 "[ . 1 . 2]" 1
163 1 94 ASP QB 1 95 GLU HG3 4.090 . 4.090 3.338 2.728 4.232 0.142 2 0 "[ . 1 . 2]" 1
164 1 15 MET ME 1 15 MET HG3 3.500 . 3.500 2.671 2.441 3.410 . 0 0 "[ . 1 . 2]" 1
165 1 96 ASP HB3 1 97 THR H 4.380 . 4.380 3.541 2.853 4.366 . 0 0 "[ . 1 . 2]" 1
166 1 75 ARG HD2 1 101 PHE QE 4.200 . 4.200 3.367 2.392 4.265 0.065 19 0 "[ . 1 . 2]" 1
167 1 49 LYS HB2 1 49 LYS HE2 4.240 . 4.240 3.145 2.054 4.456 0.216 4 0 "[ . 1 . 2]" 1
168 1 49 LYS HB2 1 49 LYS HE3 4.240 . 4.240 3.400 2.109 4.433 0.193 16 0 "[ . 1 . 2]" 1
169 1 35 LYS HE2 1 35 LYS HG3 3.340 . 3.340 2.510 2.334 3.445 0.105 12 0 "[ . 1 . 2]" 1
170 1 76 PHE HB3 1 81 ILE HG12 3.430 . 3.430 2.700 2.511 2.875 . 0 0 "[ . 1 . 2]" 1
171 1 53 PRO HD2 1 56 LYS QE 4.890 . 4.890 4.402 2.523 5.087 0.197 12 0 "[ . 1 . 2]" 1
172 1 19 LYS QE 1 19 LYS QG 3.030 . 3.030 2.355 2.092 2.734 . 0 0 "[ . 1 . 2]" 1
173 1 21 LYS QE 1 21 LYS QG 3.250 . 3.250 2.334 2.111 2.759 . 0 0 "[ . 1 . 2]" 1
174 1 50 ARG HB2 1 50 ARG HD2 3.810 . 3.810 2.434 2.159 2.757 . 0 0 "[ . 1 . 2]" 1
175 1 70 ARG HB2 1 70 ARG QD 3.490 . 3.490 3.483 3.399 3.560 0.070 9 0 "[ . 1 . 2]" 1
176 1 73 ARG HA 1 73 ARG HD3 3.740 . 3.740 1.922 1.814 2.032 . 0 0 "[ . 1 . 2]" 1
177 1 58 MET HA 1 74 PHE HZ 4.260 . 4.260 3.064 2.929 3.188 . 0 0 "[ . 1 . 2]" 1
178 1 106 GLY QA 1 107 GLY QA 3.700 . 3.700 3.612 3.523 3.751 0.051 15 0 "[ . 1 . 2]" 1
179 1 95 GLU HA 1 95 GLU HG3 4.000 . 4.000 3.351 3.077 3.754 . 0 0 "[ . 1 . 2]" 1
180 1 52 THR HA 1 53 PRO HD3 3.850 . 3.850 2.460 2.326 2.553 . 0 0 "[ . 1 . 2]" 1
181 1 55 SER H 1 83 GLU HA 4.140 . 4.140 3.864 3.658 4.111 . 0 0 "[ . 1 . 2]" 1
182 1 55 SER HA 1 83 GLU HA 3.800 . 3.800 3.223 3.041 3.456 . 0 0 "[ . 1 . 2]" 1
183 1 54 LEU HA 1 54 LEU MD2 4.320 . 4.320 3.947 3.466 4.094 . 0 0 "[ . 1 . 2]" 1
184 1 59 LYS HA 1 59 LYS HG3 3.770 . 3.770 3.314 2.986 3.757 . 0 0 "[ . 1 . 2]" 1
185 1 56 LYS HA 1 56 LYS HG2 3.580 . 3.580 2.569 2.427 2.672 . 0 0 "[ . 1 . 2]" 1
186 1 88 ALA HA 1 91 GLU H 4.200 . 4.200 3.340 3.028 3.553 . 0 0 "[ . 1 . 2]" 1
187 1 88 ALA HA 1 91 GLU HA 4.010 . 4.010 3.216 2.810 3.746 . 0 0 "[ . 1 . 2]" 1
188 1 63 GLU HA 1 66 GLY H 4.410 . 4.410 3.841 3.560 4.041 . 0 0 "[ . 1 . 2]" 1
189 1 63 GLU HA 1 63 GLU HB3 2.970 . 2.970 2.521 2.474 2.549 . 0 0 "[ . 1 . 2]" 1
190 1 64 ARG HA 1 64 ARG QG 3.370 . 3.370 3.350 3.338 3.359 . 0 0 "[ . 1 . 2]" 1
191 1 24 VAL HA 1 25 LYS HA 4.530 . 4.530 4.381 4.296 4.626 0.096 15 0 "[ . 1 . 2]" 1
192 1 24 VAL HA 1 24 VAL QG 2.800 . 2.800 2.233 2.125 2.364 . 0 0 "[ . 1 . 2]" 1
193 1 39 GLN HA 1 41 GLY H 4.130 . 4.130 3.666 3.240 3.840 . 0 0 "[ . 1 . 2]" 1
194 1 39 GLN HA 1 41 GLY HA2 5.220 . 5.220 4.973 4.618 5.243 0.023 7 0 "[ . 1 . 2]" 1
195 1 39 GLN HA 1 39 GLN QG 3.480 . 3.480 3.155 2.474 3.443 . 0 0 "[ . 1 . 2]" 1
196 1 26 THR HB 1 27 GLU H 4.120 . 4.120 3.833 1.864 4.505 0.385 8 0 "[ . 1 . 2]" 1
197 1 26 THR HA 1 26 THR MG 3.310 . 3.310 3.062 2.138 3.229 . 0 0 "[ . 1 . 2]" 1
198 1 22 GLU HA 1 22 GLU QG 3.700 . 3.700 2.882 2.310 3.473 . 0 0 "[ . 1 . 2]" 1
199 1 65 GLN HA 1 65 GLN HE21 4.260 . 4.260 2.183 2.122 2.286 . 0 0 "[ . 1 . 2]" 1
200 1 60 ALA HA 1 61 TYR HA 5.350 . 5.350 4.830 4.792 4.861 . 0 0 "[ . 1 . 2]" 1
201 1 64 ARG HA 1 65 GLN HA 5.710 . 5.710 4.696 4.641 4.768 . 0 0 "[ . 1 . 2]" 1
202 1 69 MET HA 1 71 GLN H 4.470 . 4.470 3.807 3.655 3.880 . 0 0 "[ . 1 . 2]" 1
203 1 69 MET HA 1 72 ILE HG12 4.050 . 4.050 3.007 2.863 3.087 . 0 0 "[ . 1 . 2]" 1
204 1 90 LEU HA 1 90 LEU MD1 3.970 . 3.970 3.678 3.633 3.733 . 0 0 "[ . 1 . 2]" 1
205 1 44 VAL HA 1 45 GLN HG3 4.310 . 4.310 4.389 4.322 4.420 0.110 13 0 "[ . 1 . 2]" 1
206 1 37 ALA H 1 99 ASP HA 4.190 . 4.190 3.657 3.352 3.923 . 0 0 "[ . 1 . 2]" 1
207 1 74 PHE HA 1 101 PHE QD 5.050 . 5.050 4.921 4.657 5.089 0.039 3 0 "[ . 1 . 2]" 1
208 1 21 LYS HA 1 21 LYS QD 4.350 . 4.350 3.730 3.633 3.903 . 0 0 "[ . 1 . 2]" 1
209 1 21 LYS QD 1 22 GLU HA 4.730 . 4.730 3.754 2.811 4.834 0.104 4 0 "[ . 1 . 2]" 1
210 1 36 VAL HB 1 98 ILE HG13 4.390 . 4.390 3.769 2.905 4.594 0.204 1 0 "[ . 1 . 2]" 1
211 1 24 VAL HB 1 25 LYS H 4.400 . 4.400 4.242 3.773 4.535 0.135 5 0 "[ . 1 . 2]" 1
212 1 79 GLN H 1 79 GLN HG3 3.790 . 3.790 2.909 2.740 3.007 . 0 0 "[ . 1 . 2]" 1
213 1 35 LYS HE2 1 95 GLU HB3 3.680 . 3.680 2.497 1.970 3.086 . 0 0 "[ . 1 . 2]" 1
214 1 73 ARG H 1 100 VAL MG2 5.000 . 5.000 4.278 4.009 4.499 . 0 0 "[ . 1 . 2]" 1
215 1 74 PHE HZ 1 100 VAL MG2 5.110 . 5.110 3.711 3.594 3.857 . 0 0 "[ . 1 . 2]" 1
216 1 38 GLY HA3 1 100 VAL MG2 4.950 . 4.950 4.328 3.946 4.827 . 0 0 "[ . 1 . 2]" 1
217 1 72 ILE HG13 1 100 VAL MG2 5.210 . 5.210 4.250 4.049 4.451 . 0 0 "[ . 1 . 2]" 1
218 1 46 PHE H 1 57 LEU MD2 5.340 . 5.340 4.691 4.534 4.883 . 0 0 "[ . 1 . 2]" 1
219 1 36 VAL HB 1 57 LEU MD2 6.000 . 6.000 5.188 4.428 6.053 0.053 5 0 "[ . 1 . 2]" 1
220 1 57 LEU MD2 1 87 PRO HG3 6.000 . 6.000 4.681 4.305 5.055 . 0 0 "[ . 1 . 2]" 1
221 1 39 GLN H 1 100 VAL MG1 5.690 . 5.690 3.683 3.119 4.085 . 0 0 "[ . 1 . 2]" 1
222 1 38 GLY HA3 1 100 VAL MG1 4.950 . 4.950 3.777 3.182 4.324 . 0 0 "[ . 1 . 2]" 1
223 1 32 ILE MD 1 92 MET H 4.910 . 4.910 4.546 4.144 4.834 . 0 0 "[ . 1 . 2]" 1
224 1 32 ILE MD 1 50 ARG HA 4.630 . 4.630 3.149 2.619 3.568 . 0 0 "[ . 1 . 2]" 1
225 1 32 ILE MD 1 94 ASP QB 4.410 . 4.410 4.067 3.802 4.689 0.279 20 0 "[ . 1 . 2]" 1
226 1 54 LEU MD1 1 86 THR H 5.390 . 5.390 4.818 3.578 5.188 . 0 0 "[ . 1 . 2]" 1
227 1 36 VAL HA 1 98 ILE MD 4.630 . 4.630 4.360 4.265 4.440 . 0 0 "[ . 1 . 2]" 1
228 1 34 LEU H 1 34 LEU MD1 4.510 . 4.510 3.733 3.589 3.839 . 0 0 "[ . 1 . 2]" 1
229 1 72 ILE MG 1 102 GLN HB2 4.290 . 4.290 3.859 3.646 4.474 0.184 11 0 "[ . 1 . 2]" 1
230 1 48 ILE MG 1 57 LEU HA 4.650 . 4.650 4.420 4.087 4.637 . 0 0 "[ . 1 . 2]" 1
231 1 48 ILE MG 1 57 LEU MD1 4.950 . 4.950 4.779 4.392 5.003 0.053 10 0 "[ . 1 . 2]" 1
232 1 89 GLN HB2 1 90 LEU MD2 5.280 . 5.280 4.913 4.372 5.346 0.066 13 0 "[ . 1 . 2]" 1
233 1 67 LEU MD1 1 68 SER H 4.880 . 4.880 3.104 2.878 3.931 . 0 0 "[ . 1 . 2]" 1
234 1 75 ARG HA 1 81 ILE MG 5.190 . 5.190 4.926 4.762 5.107 . 0 0 "[ . 1 . 2]" 1
235 1 36 VAL HA 1 98 ILE MG 4.440 . 4.440 3.613 3.559 3.711 . 0 0 "[ . 1 . 2]" 1
236 1 36 VAL H 1 44 VAL MG2 4.910 . 4.910 4.407 4.311 4.488 . 0 0 "[ . 1 . 2]" 1
237 1 72 ILE HG13 1 101 PHE H 5.110 . 5.110 5.067 5.025 5.138 0.028 13 0 "[ . 1 . 2]" 1
238 1 72 ILE HG12 1 102 GLN HA 6.000 . 6.000 5.599 5.506 5.755 . 0 0 "[ . 1 . 2]" 1
239 1 72 ILE HG13 1 102 GLN HA 6.000 . 6.000 5.663 5.547 5.797 . 0 0 "[ . 1 . 2]" 1
240 1 35 LYS HG2 1 45 GLN HG3 4.630 . 4.630 1.984 1.876 2.094 . 0 0 "[ . 1 . 2]" 1
241 1 76 PHE HZ 1 92 MET HG2 5.160 . 5.160 5.222 5.118 5.277 0.117 19 0 "[ . 1 . 2]" 1
242 1 75 ARG H 1 81 ILE HG13 4.860 . 4.860 3.607 3.488 3.712 . 0 0 "[ . 1 . 2]" 1
243 1 15 MET HA 1 16 ALA MB 5.000 . 5.000 4.727 3.931 5.006 0.006 11 0 "[ . 1 . 2]" 1
244 1 37 ALA MB 1 39 GLN H 6.000 . 6.000 5.520 5.276 5.743 . 0 0 "[ . 1 . 2]" 1
245 1 37 ALA MB 1 99 ASP QB 5.600 . 5.600 4.888 4.508 5.450 . 0 0 "[ . 1 . 2]" 1
246 1 75 ARG HG3 1 101 PHE QD 5.750 . 5.750 5.184 4.778 5.676 . 0 0 "[ . 1 . 2]" 1
247 1 20 PRO HB3 1 21 LYS QG 4.910 . 4.910 4.698 3.696 5.170 0.260 5 0 "[ . 1 . 2]" 1
248 1 73 ARG HG2 1 74 PHE H 4.710 . 4.710 4.532 4.354 4.713 0.003 8 0 "[ . 1 . 2]" 1
249 1 34 LEU HG 1 57 LEU MD2 4.830 . 4.830 2.834 2.504 3.126 . 0 0 "[ . 1 . 2]" 1
250 1 50 ARG HG3 1 88 ALA MB 5.690 . 5.690 3.821 3.337 4.483 . 0 0 "[ . 1 . 2]" 1
251 1 58 MET ME 1 81 ILE H 5.510 . 5.510 5.427 5.075 5.532 0.022 6 0 "[ . 1 . 2]" 1
252 1 61 TYR QD 1 100 VAL HB 6.000 . 6.000 5.444 5.330 5.635 . 0 0 "[ . 1 . 2]" 1
253 1 74 PHE QD 1 100 VAL HB 6.000 . 6.000 5.276 5.160 5.378 . 0 0 "[ . 1 . 2]" 1
254 1 73 ARG HG3 1 74 PHE H 5.400 . 5.400 4.762 4.589 4.887 . 0 0 "[ . 1 . 2]" 1
255 1 35 LYS HB3 1 43 VAL HB 5.340 . 5.340 4.921 4.554 5.251 . 0 0 "[ . 1 . 2]" 1
256 1 58 MET HA 1 60 ALA MB 5.310 . 5.310 4.879 4.777 4.970 . 0 0 "[ . 1 . 2]" 1
257 1 60 ALA MB 1 61 TYR HB3 4.690 . 4.690 4.644 4.561 4.705 0.015 2 0 "[ . 1 . 2]" 1
258 1 35 LYS QD 1 45 GLN HA 4.520 . 4.520 3.937 3.843 4.034 . 0 0 "[ . 1 . 2]" 1
259 1 50 ARG H 1 50 ARG HG2 4.770 . 4.770 2.616 2.021 3.335 . 0 0 "[ . 1 . 2]" 1
260 1 70 ARG QG 1 71 GLN HA 4.460 . 4.460 3.823 3.658 4.041 . 0 0 "[ . 1 . 2]" 1
261 1 56 LYS H 1 56 LYS QD 4.710 . 4.710 3.840 3.577 4.317 . 0 0 "[ . 1 . 2]" 1
262 1 61 TYR QD 1 64 ARG QG 4.910 . 4.910 4.162 3.970 4.248 . 0 0 "[ . 1 . 2]" 1
263 1 48 ILE HB 1 52 THR MG 4.370 . 4.370 2.159 1.935 2.440 . 0 0 "[ . 1 . 2]" 1
264 1 59 LYS QB 1 69 MET QG 4.640 . 4.640 4.510 4.247 4.785 0.145 14 0 "[ . 1 . 2]" 1
265 1 44 VAL MG1 1 45 GLN HB3 5.300 . 5.300 5.196 5.031 5.304 0.004 19 0 "[ . 1 . 2]" 1
266 1 21 LYS QG 1 22 GLU QB 4.810 . 4.810 4.479 2.984 5.090 0.280 9 0 "[ . 1 . 2]" 1
267 1 58 MET ME 1 83 GLU HB2 5.200 . 5.200 3.853 3.509 4.157 . 0 0 "[ . 1 . 2]" 1
268 1 37 ALA HA 1 43 VAL HB 4.880 . 4.880 2.981 2.621 4.719 . 0 0 "[ . 1 . 2]" 1
269 1 42 SER HA 1 43 VAL HB 5.050 . 5.050 4.595 4.481 4.754 . 0 0 "[ . 1 . 2]" 1
270 1 43 VAL HB 1 44 VAL HA 5.670 . 5.670 5.580 4.520 5.770 0.100 11 0 "[ . 1 . 2]" 1
271 1 83 GLU HB2 1 84 THR MG 5.100 . 5.100 4.510 3.959 5.223 0.123 4 0 "[ . 1 . 2]" 1
272 1 83 GLU HB3 1 84 THR MG 5.740 . 5.740 4.979 4.685 5.444 . 0 0 "[ . 1 . 2]" 1
273 1 64 ARG HB3 1 65 GLN H 4.460 . 4.460 3.994 3.919 4.047 . 0 0 "[ . 1 . 2]" 1
274 1 50 ARG HB3 1 87 PRO HB2 4.920 . 4.920 4.481 3.803 4.961 0.041 15 0 "[ . 1 . 2]" 1
275 1 90 LEU MD1 1 91 GLU QG 5.760 . 5.760 5.573 5.352 6.050 0.290 5 0 "[ . 1 . 2]" 1
276 1 88 ALA MB 1 89 GLN HB2 4.630 . 4.630 4.567 4.319 4.832 0.202 5 0 "[ . 1 . 2]" 1
277 1 26 THR MG 1 27 GLU QG 5.380 . 5.380 4.560 2.022 5.382 0.002 5 0 "[ . 1 . 2]" 1
278 1 72 ILE HA 1 103 GLN QG 4.700 . 4.700 3.487 2.832 3.898 . 0 0 "[ . 1 . 2]" 1
279 1 88 ALA MB 1 89 GLN HB3 5.730 . 5.730 5.464 5.174 5.579 . 0 0 "[ . 1 . 2]" 1
280 1 68 SER HB2 1 71 GLN HG3 4.550 . 4.550 4.165 4.077 4.347 . 0 0 "[ . 1 . 2]" 1
281 1 71 GLN HE22 1 104 GLN QG 4.620 . 4.620 4.015 3.110 4.780 0.160 11 0 "[ . 1 . 2]" 1
282 1 63 GLU HG3 1 64 ARG H 5.150 . 5.150 4.588 4.310 5.029 . 0 0 "[ . 1 . 2]" 1
283 1 75 ARG HD3 1 79 GLN H 4.870 . 4.870 4.230 3.254 4.943 0.073 9 0 "[ . 1 . 2]" 1
284 1 75 ARG HD3 1 78 GLY HA2 4.590 . 4.590 2.794 1.836 3.440 . 0 0 "[ . 1 . 2]" 1
285 1 75 ARG HD3 1 76 PHE HB2 5.940 . 5.940 5.705 4.829 6.189 0.249 15 0 "[ . 1 . 2]" 1
286 1 69 MET HB3 1 70 ARG H 5.080 . 5.080 3.662 3.558 3.754 . 0 0 "[ . 1 . 2]" 1
287 1 81 ILE HA 1 82 ASN HB3 5.480 . 5.480 5.547 5.440 5.619 0.139 19 0 "[ . 1 . 2]" 1
288 1 35 LYS H 1 35 LYS HE2 5.570 . 5.570 4.472 4.087 5.320 . 0 0 "[ . 1 . 2]" 1
289 1 76 PHE HB3 1 79 GLN HE21 4.770 . 4.770 4.349 4.039 4.718 . 0 0 "[ . 1 . 2]" 1
290 1 73 ARG HA 1 74 PHE HB2 4.780 . 4.780 4.515 4.395 4.594 . 0 0 "[ . 1 . 2]" 1
291 1 25 LYS QE 1 26 THR H 5.460 . 5.460 4.705 3.130 5.682 0.222 20 0 "[ . 1 . 2]" 1
292 1 59 LYS H 1 59 LYS QE 5.770 . 5.770 4.802 4.372 5.238 . 0 0 "[ . 1 . 2]" 1
293 1 34 LEU H 1 46 PHE HB2 5.140 . 5.140 3.229 3.116 3.370 . 0 0 "[ . 1 . 2]" 1
294 1 58 MET HA 1 61 TYR HB3 4.710 . 4.710 2.876 2.778 2.979 . 0 0 "[ . 1 . 2]" 1
295 1 64 ARG HD3 1 65 GLN HE21 4.490 . 4.490 3.817 3.411 4.322 . 0 0 "[ . 1 . 2]" 1
296 1 50 ARG HD2 1 51 HIS HB3 5.720 . 5.720 5.149 3.809 5.894 0.174 20 0 "[ . 1 . 2]" 1
297 1 73 ARG HD2 1 74 PHE HB2 6.000 . 6.000 5.075 4.749 5.391 . 0 0 "[ . 1 . 2]" 1
298 1 69 MET QG 1 70 ARG QD 4.900 . 4.900 4.839 4.661 5.023 0.123 14 0 "[ . 1 . 2]" 1
299 1 70 ARG QD 1 71 GLN HB2 4.920 . 4.920 4.643 4.442 4.851 . 0 0 "[ . 1 . 2]" 1
300 1 73 ARG HD3 1 74 PHE H 4.560 . 4.560 2.924 2.429 3.177 . 0 0 "[ . 1 . 2]" 1
301 1 58 MET HA 1 61 TYR QD 5.060 . 5.060 4.519 4.429 4.624 . 0 0 "[ . 1 . 2]" 1
302 1 58 MET HA 1 74 PHE QD 5.300 . 5.300 4.038 3.894 4.204 . 0 0 "[ . 1 . 2]" 1
303 1 51 HIS HB2 1 88 ALA MB 5.200 . 5.200 4.424 3.924 4.860 . 0 0 "[ . 1 . 2]" 1
304 1 19 LYS QG 1 20 PRO HD2 4.810 . 4.810 3.442 2.011 4.859 0.049 17 0 "[ . 1 . 2]" 1
305 1 40 ASP HA 1 41 GLY HA3 4.620 . 4.620 4.479 4.388 4.538 . 0 0 "[ . 1 . 2]" 1
306 1 94 ASP HA 1 95 GLU HA 4.590 . 4.590 4.320 4.271 4.364 . 0 0 "[ . 1 . 2]" 1
307 1 35 LYS HG2 1 95 GLU HA 4.600 . 4.600 4.081 3.725 4.386 . 0 0 "[ . 1 . 2]" 1
308 1 62 CYS HA 1 69 MET ME 5.550 . 5.550 5.082 4.964 5.217 . 0 0 "[ . 1 . 2]" 1
309 1 62 CYS HA 1 65 GLN QG 4.770 . 4.770 3.845 3.574 4.277 . 0 0 "[ . 1 . 2]" 1
310 1 48 ILE MG 1 54 LEU HA 4.890 . 4.890 3.928 3.624 4.228 . 0 0 "[ . 1 . 2]" 1
311 1 19 LYS H 1 20 PRO HD3 4.920 . 4.920 3.980 2.564 4.998 0.078 5 0 "[ . 1 . 2]" 1
312 1 19 LYS QG 1 20 PRO HD3 4.810 . 4.810 4.145 3.332 4.925 0.115 15 0 "[ . 1 . 2]" 1
313 1 68 SER HB3 1 70 ARG HB3 4.800 . 4.800 4.823 4.652 4.894 0.094 10 0 "[ . 1 . 2]" 1
314 1 23 GLY QA 1 24 VAL HB 5.130 . 5.130 4.643 3.973 5.002 . 0 0 "[ . 1 . 2]" 1
315 1 68 SER HB3 1 69 MET HB2 4.540 . 4.540 4.422 4.252 4.570 0.030 1 0 "[ . 1 . 2]" 1
316 1 76 PHE QD 1 77 ASP HA 4.310 . 4.310 4.369 4.254 4.472 0.162 11 0 "[ . 1 . 2]" 1
317 1 48 ILE HB 1 52 THR HB 5.110 . 5.110 3.157 2.895 3.728 . 0 0 "[ . 1 . 2]" 1
318 1 49 LYS HB3 1 52 THR HB 5.480 . 5.480 3.450 3.221 3.630 . 0 0 "[ . 1 . 2]" 1
319 1 78 GLY HA3 1 79 GLN HA 4.930 . 4.930 4.452 4.374 4.569 . 0 0 "[ . 1 . 2]" 1
320 1 22 GLU HA 1 24 VAL H 5.210 . 5.210 4.254 3.028 5.390 0.180 2 0 "[ . 1 . 2]" 1
321 1 76 PHE QE 1 92 MET HA 4.990 . 4.990 3.627 3.282 3.805 . 0 0 "[ . 1 . 2]" 1
322 1 91 GLU HA 1 92 MET HA 4.710 . 4.710 4.614 4.551 4.671 . 0 0 "[ . 1 . 2]" 1
323 1 26 THR MG 1 27 GLU HA 4.890 . 4.890 4.323 3.706 5.200 0.310 13 0 "[ . 1 . 2]" 1
324 1 92 MET HA 1 92 MET ME 5.160 . 5.160 4.149 4.060 4.275 . 0 0 "[ . 1 . 2]" 1
325 1 70 ARG HA 1 72 ILE H 4.370 . 4.370 4.129 3.934 4.345 . 0 0 "[ . 1 . 2]" 1
326 1 68 SER HB2 1 69 MET HA 6.000 . 6.000 5.272 5.062 5.464 . 0 0 "[ . 1 . 2]" 1
327 1 68 SER HB2 1 70 ARG HA 6.000 . 6.000 5.509 5.135 5.838 . 0 0 "[ . 1 . 2]" 1
328 1 90 LEU HA 1 92 MET HB3 5.500 . 5.500 5.339 5.226 5.535 0.035 5 0 "[ . 1 . 2]" 1
329 1 97 THR MG 1 99 ASP HA 4.630 . 4.630 3.977 3.762 4.213 . 0 0 "[ . 1 . 2]" 1
330 1 76 PHE HA 1 98 ILE HA 4.580 . 4.580 3.888 3.773 4.023 . 0 0 "[ . 1 . 2]" 1
331 1 74 PHE HA 1 100 VAL HB 4.910 . 4.910 4.889 4.750 4.989 0.079 19 0 "[ . 1 . 2]" 1
332 1 74 PHE HA 1 81 ILE MD 4.540 . 4.540 3.976 3.905 4.031 . 0 0 "[ . 1 . 2]" 1
333 1 76 PHE HA 1 98 ILE MD 4.510 . 4.510 4.058 3.903 4.200 . 0 0 "[ . 1 . 2]" 1
334 1 52 THR MG 1 54 LEU HA 3.740 . 3.740 3.793 3.736 3.872 0.132 18 0 "[ . 1 . 2]" 1
335 1 102 GLN HB3 1 102 GLN HG2 2.400 . 2.400 2.275 2.231 2.355 . 0 0 "[ . 1 . 2]" 1
336 1 59 LYS QB 1 69 MET ME 3.520 . 3.520 3.491 3.396 3.571 0.051 14 0 "[ . 1 . 2]" 1
337 1 34 LEU MD1 1 57 LEU MD2 4.130 . 4.130 3.906 3.704 4.145 0.015 16 0 "[ . 1 . 2]" 1
338 1 57 LEU H 1 58 MET H 3.400 . 3.400 2.528 2.479 2.575 . 0 0 "[ . 1 . 2]" 1
339 1 54 LEU HA 1 57 LEU H 3.860 . 3.860 3.367 3.253 3.481 . 0 0 "[ . 1 . 2]" 1
340 1 57 LEU H 1 58 MET HA 5.130 . 5.130 5.135 5.101 5.173 0.043 5 0 "[ . 1 . 2]" 1
341 1 56 LYS HB3 1 57 LEU H 3.700 . 3.700 3.593 3.409 3.714 0.014 12 0 "[ . 1 . 2]" 1
342 1 57 LEU H 1 57 LEU HB3 3.190 . 3.190 2.459 2.407 2.494 . 0 0 "[ . 1 . 2]" 1
343 1 54 LEU HB3 1 57 LEU H 5.500 . 5.500 5.394 5.262 5.595 0.095 9 0 "[ . 1 . 2]" 1
344 1 57 LEU H 1 57 LEU HG 3.630 . 3.630 2.632 2.514 2.784 . 0 0 "[ . 1 . 2]" 1
345 1 57 LEU H 1 57 LEU MD2 4.000 . 4.000 3.340 3.219 3.485 . 0 0 "[ . 1 . 2]" 1
346 1 57 LEU H 1 57 LEU MD1 4.190 . 4.190 3.934 3.867 4.017 . 0 0 "[ . 1 . 2]" 1
347 1 83 GLU H 1 84 THR H 3.680 . 3.680 2.459 2.345 2.565 . 0 0 "[ . 1 . 2]" 1
348 1 82 ASN HB3 1 84 THR H 3.680 . 3.680 3.023 2.757 3.456 . 0 0 "[ . 1 . 2]" 1
349 1 82 ASN HB2 1 84 THR H 3.830 . 3.830 2.191 2.049 2.378 . 0 0 "[ . 1 . 2]" 1
350 1 83 GLU HB3 1 84 THR H 4.300 . 4.300 4.228 4.103 4.337 0.037 8 0 "[ . 1 . 2]" 1
351 1 71 GLN H 1 72 ILE H 3.050 . 3.050 2.244 2.167 2.301 . 0 0 "[ . 1 . 2]" 1
352 1 71 GLN HE21 1 72 ILE H 5.170 . 5.170 5.302 5.186 5.526 0.356 17 0 "[ . 1 . 2]" 1
353 1 72 ILE H 1 73 ARG HA 5.300 . 5.300 4.843 4.754 4.950 . 0 0 "[ . 1 . 2]" 1
354 1 72 ILE H 1 102 GLN HA 5.660 . 5.660 4.918 4.798 5.060 . 0 0 "[ . 1 . 2]" 1
355 1 71 GLN HA 1 72 ILE H 3.530 . 3.530 3.440 3.404 3.483 . 0 0 "[ . 1 . 2]" 1
356 1 69 MET HA 1 72 ILE H 3.750 . 3.750 3.453 3.344 3.586 . 0 0 "[ . 1 . 2]" 1
357 1 71 GLN HB2 1 72 ILE H 3.570 . 3.570 3.236 3.058 3.420 . 0 0 "[ . 1 . 2]" 1
358 1 71 GLN HB3 1 72 ILE H 3.730 . 3.730 3.558 3.325 3.736 0.006 18 0 "[ . 1 . 2]" 1
359 1 72 ILE H 1 73 ARG HG2 5.010 . 5.010 4.657 4.494 5.007 . 0 0 "[ . 1 . 2]" 1
360 1 72 ILE H 1 72 ILE HG12 3.160 . 3.160 2.393 2.317 2.464 . 0 0 "[ . 1 . 2]" 1
361 1 88 ALA HA 1 90 LEU H 4.430 . 4.430 4.202 4.082 4.368 . 0 0 "[ . 1 . 2]" 1
362 1 90 LEU H 1 91 GLU HA 4.670 . 4.670 4.544 4.406 4.735 0.065 13 0 "[ . 1 . 2]" 1
363 1 89 GLN HB2 1 90 LEU H 3.600 . 3.600 3.042 2.641 3.581 . 0 0 "[ . 1 . 2]" 1
364 1 90 LEU H 1 90 LEU HG 3.250 . 3.250 2.536 2.299 2.695 . 0 0 "[ . 1 . 2]" 1
365 1 86 THR H 1 89 GLN H 4.880 . 4.880 3.886 3.665 4.075 . 0 0 "[ . 1 . 2]" 1
366 1 53 PRO HA 1 86 THR H 6.000 . 6.000 5.222 4.938 5.596 . 0 0 "[ . 1 . 2]" 1
367 1 86 THR H 1 87 PRO HA 6.000 . 6.000 5.341 5.213 5.421 . 0 0 "[ . 1 . 2]" 1
368 1 85 ASP HB2 1 86 THR H 4.770 . 4.770 4.109 3.888 4.350 . 0 0 "[ . 1 . 2]" 1
369 1 85 ASP HB3 1 86 THR H 3.880 . 3.880 3.095 2.688 3.545 . 0 0 "[ . 1 . 2]" 1
370 1 86 THR H 1 89 GLN QG 4.040 . 4.040 3.026 2.207 3.821 . 0 0 "[ . 1 . 2]" 1
371 1 52 THR H 1 52 THR HB 3.250 . 3.250 2.147 2.085 2.404 . 0 0 "[ . 1 . 2]" 1
372 1 51 HIS HB2 1 52 THR H 4.490 . 4.490 4.205 4.074 4.335 . 0 0 "[ . 1 . 2]" 1
373 1 49 LYS HB3 1 52 THR H 3.950 . 3.950 3.261 3.023 3.656 . 0 0 "[ . 1 . 2]" 1
374 1 52 THR H 1 52 THR MG 3.570 . 3.570 3.488 2.848 3.570 . 20 0 "[ . 1 . 2]" 1
375 1 60 ALA H 1 61 TYR H 3.460 . 3.460 2.592 2.524 2.664 . 0 0 "[ . 1 . 2]" 1
376 1 59 LYS H 1 60 ALA H 3.350 . 3.350 2.578 2.509 2.618 . 0 0 "[ . 1 . 2]" 1
377 1 57 LEU HA 1 60 ALA H 4.000 . 4.000 3.336 3.218 3.433 . 0 0 "[ . 1 . 2]" 1
378 1 60 ALA H 1 69 MET ME 4.870 . 4.870 4.661 4.597 4.720 . 0 0 "[ . 1 . 2]" 1
379 1 59 LYS QB 1 60 ALA H 3.220 . 3.220 2.728 2.627 2.805 . 0 0 "[ . 1 . 2]" 1
380 1 60 ALA H 1 60 ALA MB 2.820 . 2.820 2.241 2.220 2.253 . 0 0 "[ . 1 . 2]" 1
381 1 82 ASN H 1 85 ASP H 4.160 . 4.160 3.737 3.469 4.052 . 0 0 "[ . 1 . 2]" 1
382 1 83 GLU H 1 85 ASP H 4.390 . 4.390 4.159 3.983 4.269 . 0 0 "[ . 1 . 2]" 1
383 1 84 THR H 1 85 ASP H 3.270 . 3.270 2.510 2.353 2.658 . 0 0 "[ . 1 . 2]" 1
384 1 82 ASN HA 1 85 ASP H 4.710 . 4.710 4.781 4.716 4.867 0.157 4 0 "[ . 1 . 2]" 1
385 1 84 THR HB 1 85 ASP H 4.520 . 4.520 4.276 3.943 4.550 0.030 3 0 "[ . 1 . 2]" 1
386 1 83 GLU HA 1 85 ASP H 4.280 . 4.280 3.587 3.397 3.996 . 0 0 "[ . 1 . 2]" 1
387 1 85 ASP H 1 85 ASP HB2 3.300 . 3.300 2.320 2.013 2.651 . 0 0 "[ . 1 . 2]" 1
388 1 82 ASN HB2 1 85 ASP H 3.840 . 3.840 2.960 2.702 3.258 . 0 0 "[ . 1 . 2]" 1
389 1 85 ASP H 1 85 ASP HB3 3.500 . 3.500 3.214 2.640 3.547 0.047 16 0 "[ . 1 . 2]" 1
390 1 89 GLN H 1 91 GLU H 4.510 . 4.510 3.689 3.513 3.886 . 0 0 "[ . 1 . 2]" 1
391 1 90 LEU H 1 91 GLU H 3.470 . 3.470 2.430 2.308 2.608 . 0 0 "[ . 1 . 2]" 1
392 1 89 GLN HA 1 91 GLU H 3.830 . 3.830 3.707 3.524 3.846 0.016 3 0 "[ . 1 . 2]" 1
393 1 90 LEU HB3 1 91 GLU H 5.070 . 5.070 4.450 4.335 4.528 . 0 0 "[ . 1 . 2]" 1
394 1 90 LEU HG 1 91 GLU H 5.420 . 5.420 4.567 4.389 4.695 . 0 0 "[ . 1 . 2]" 1
395 1 91 GLU H 1 92 MET HB3 5.280 . 5.280 4.845 4.666 5.008 . 0 0 "[ . 1 . 2]" 1
396 1 91 GLU H 1 92 MET HG2 5.770 . 5.770 4.519 4.325 4.751 . 0 0 "[ . 1 . 2]" 1
397 1 55 SER H 1 56 LYS H 3.740 . 3.740 2.767 2.698 2.834 . 0 0 "[ . 1 . 2]" 1
398 1 56 LYS H 1 57 LEU H 3.540 . 3.540 2.710 2.628 2.815 . 0 0 "[ . 1 . 2]" 1
399 1 56 LYS H 1 57 LEU HA 5.490 . 5.490 5.305 5.247 5.392 . 0 0 "[ . 1 . 2]" 1
400 1 56 LYS H 1 56 LYS QE 4.920 . 4.920 4.500 3.582 4.916 . 0 0 "[ . 1 . 2]" 1
401 1 53 PRO HG2 1 56 LYS H 3.920 . 3.920 3.908 3.789 4.004 0.084 7 0 "[ . 1 . 2]" 1
402 1 56 LYS H 1 57 LEU HG 4.980 . 4.980 4.614 4.495 4.756 . 0 0 "[ . 1 . 2]" 1
403 1 63 GLU H 1 66 GLY H 4.970 . 4.970 4.754 4.661 4.946 . 0 0 "[ . 1 . 2]" 1
404 1 66 GLY H 1 67 LEU HA 5.490 . 5.490 4.993 4.914 5.091 . 0 0 "[ . 1 . 2]" 1
405 1 65 GLN HB3 1 66 GLY H 4.320 . 4.320 3.949 3.892 4.102 . 0 0 "[ . 1 . 2]" 1
406 1 65 GLN QG 1 66 GLY H 4.720 . 4.720 4.286 4.124 4.523 . 0 0 "[ . 1 . 2]" 1
407 1 65 GLN HB2 1 66 GLY H 3.870 . 3.870 3.129 2.975 3.412 . 0 0 "[ . 1 . 2]" 1
408 1 61 TYR QD 1 65 GLN H 4.990 . 4.990 4.875 4.812 4.969 . 0 0 "[ . 1 . 2]" 1
409 1 65 GLN H 1 65 GLN HE21 4.740 . 4.740 3.388 3.021 3.730 . 0 0 "[ . 1 . 2]" 1
410 1 65 GLN H 1 65 GLN QG 3.360 . 3.360 2.406 2.286 2.713 . 0 0 "[ . 1 . 2]" 1
411 1 65 GLN H 1 65 GLN HB2 3.440 . 3.440 2.377 2.307 2.434 . 0 0 "[ . 1 . 2]" 1
412 1 92 MET H 1 93 GLU H 4.660 . 4.660 4.561 4.099 4.617 . 0 0 "[ . 1 . 2]" 1
413 1 88 ALA H 1 92 MET H 5.630 . 5.630 5.472 5.308 5.681 0.051 15 0 "[ . 1 . 2]" 1
414 1 90 LEU H 1 92 MET H 4.030 . 4.030 3.790 3.659 4.058 0.028 15 0 "[ . 1 . 2]" 1
415 1 88 ALA HA 1 92 MET H 4.170 . 4.170 3.818 3.550 4.018 . 0 0 "[ . 1 . 2]" 1
416 1 91 GLU HA 1 92 MET H 3.510 . 3.510 2.742 2.618 2.863 . 0 0 "[ . 1 . 2]" 1
417 1 92 MET H 1 92 MET HB2 3.620 . 3.620 3.594 3.573 3.617 . 0 0 "[ . 1 . 2]" 1
418 1 92 MET H 1 92 MET HB3 3.490 . 3.490 2.553 2.503 2.613 . 0 0 "[ . 1 . 2]" 1
419 1 92 MET H 1 92 MET HG2 3.810 . 3.810 2.142 2.042 2.227 . 0 0 "[ . 1 . 2]" 1
420 1 37 ALA H 1 100 VAL H 4.300 . 4.300 3.930 3.742 4.113 . 0 0 "[ . 1 . 2]" 1
421 1 99 ASP H 1 100 VAL H 4.480 . 4.480 4.347 4.306 4.399 . 0 0 "[ . 1 . 2]" 1
422 1 74 PHE QD 1 100 VAL H 5.940 . 5.940 5.758 5.655 5.862 . 0 0 "[ . 1 . 2]" 1
423 1 99 ASP HA 1 100 VAL H 2.880 . 2.880 2.140 2.090 2.188 . 0 0 "[ . 1 . 2]" 1
424 1 36 VAL HA 1 100 VAL H 5.750 . 5.750 5.620 5.498 5.769 0.019 19 0 "[ . 1 . 2]" 1
425 1 38 GLY HA2 1 100 VAL H 4.230 . 4.230 3.008 2.666 3.547 . 0 0 "[ . 1 . 2]" 1
426 1 38 GLY HA3 1 100 VAL H 5.160 . 5.160 4.701 4.327 5.241 0.081 15 0 "[ . 1 . 2]" 1
427 1 100 VAL H 1 100 VAL HB 3.420 . 3.420 2.570 2.516 2.627 . 0 0 "[ . 1 . 2]" 1
428 1 100 VAL H 1 100 VAL MG2 3.930 . 3.930 2.748 2.629 2.920 . 0 0 "[ . 1 . 2]" 1
429 1 68 SER HB2 1 71 GLN H 4.280 . 4.280 2.688 2.299 3.022 . 0 0 "[ . 1 . 2]" 1
430 1 71 GLN H 1 71 GLN HB2 3.160 . 3.160 2.196 2.146 2.241 . 0 0 "[ . 1 . 2]" 1
431 1 70 ARG QG 1 71 GLN H 3.850 . 3.850 2.642 2.397 2.820 . 0 0 "[ . 1 . 2]" 1
432 1 71 GLN H 1 72 ILE HG12 4.090 . 4.090 3.943 3.823 4.058 . 0 0 "[ . 1 . 2]" 1
433 1 71 GLN H 1 72 ILE MG 4.200 . 4.200 4.008 3.916 4.063 . 0 0 "[ . 1 . 2]" 1
434 1 50 ARG H 1 51 HIS H 4.000 . 4.000 2.589 2.510 2.697 . 0 0 "[ . 1 . 2]" 1
435 1 51 HIS H 1 52 THR H 3.390 . 3.390 2.037 1.910 2.195 . 0 0 "[ . 1 . 2]" 1
436 1 49 LYS HA 1 51 HIS H 4.450 . 4.450 3.856 3.647 4.043 . 0 0 "[ . 1 . 2]" 1
437 1 51 HIS H 1 51 HIS HB2 3.770 . 3.770 2.791 2.652 2.896 . 0 0 "[ . 1 . 2]" 1
438 1 50 ARG HD2 1 51 HIS H 4.900 . 4.900 4.120 2.788 4.916 0.016 8 0 "[ . 1 . 2]" 1
439 1 49 LYS QD 1 51 HIS H 5.000 . 5.000 4.728 4.124 5.254 0.254 20 0 "[ . 1 . 2]" 1
440 1 50 ARG HB3 1 51 HIS H 5.280 . 5.280 4.264 4.110 4.382 . 0 0 "[ . 1 . 2]" 1
441 1 50 ARG HB2 1 51 HIS H 4.470 . 4.470 4.101 3.950 4.250 . 0 0 "[ . 1 . 2]" 1
442 1 51 HIS H 1 88 ALA MB 4.960 . 4.960 4.500 4.228 4.762 . 0 0 "[ . 1 . 2]" 1
443 1 77 ASP H 1 79 GLN H 4.530 . 4.530 4.308 4.169 4.438 . 0 0 "[ . 1 . 2]" 1
444 1 76 PHE H 1 79 GLN H 3.930 . 3.930 3.382 2.967 3.669 . 0 0 "[ . 1 . 2]" 1
445 1 78 GLY H 1 79 GLN H 3.470 . 3.470 2.718 2.541 3.193 . 0 0 "[ . 1 . 2]" 1
446 1 79 GLN H 1 79 GLN HE21 4.870 . 4.870 4.646 4.268 4.770 . 0 0 "[ . 1 . 2]" 1
447 1 76 PHE QD 1 79 GLN H 5.130 . 5.130 5.123 5.002 5.246 0.116 11 0 "[ . 1 . 2]" 1
448 1 79 GLN H 1 80 PRO HA 5.620 . 5.620 5.334 5.052 5.501 . 0 0 "[ . 1 . 2]" 1
449 1 79 GLN H 1 80 PRO HD2 4.890 . 4.890 4.913 4.816 5.132 0.242 4 0 "[ . 1 . 2]" 1
450 1 77 ASP HB2 1 79 GLN H 4.220 . 4.220 4.275 3.930 4.451 0.231 20 0 "[ . 1 . 2]" 1
451 1 79 GLN H 1 79 GLN HG2 3.270 . 3.270 2.042 1.865 2.279 . 0 0 "[ . 1 . 2]" 1
452 1 79 GLN H 1 79 GLN HB3 3.340 . 3.340 3.028 2.853 3.234 . 0 0 "[ . 1 . 2]" 1
453 1 77 ASP HB3 1 79 GLN H 4.090 . 4.090 3.035 2.829 3.410 . 0 0 "[ . 1 . 2]" 1
454 1 38 GLY H 1 41 GLY H 4.540 . 4.540 3.884 3.614 4.441 . 0 0 "[ . 1 . 2]" 1
455 1 39 GLN QG 1 41 GLY H 5.740 . 5.740 5.444 5.310 5.583 . 0 0 "[ . 1 . 2]" 1
456 1 76 PHE H 1 81 ILE H 4.280 . 4.280 4.060 3.879 4.227 . 0 0 "[ . 1 . 2]" 1
457 1 75 ARG HA 1 81 ILE H 3.790 . 3.790 2.551 2.376 2.796 . 0 0 "[ . 1 . 2]" 1
458 1 80 PRO HA 1 81 ILE H 3.190 . 3.190 2.204 2.177 2.227 . 0 0 "[ . 1 . 2]" 1
459 1 74 PHE HB2 1 81 ILE H 4.500 . 4.500 3.726 3.516 3.906 . 0 0 "[ . 1 . 2]" 1
460 1 80 PRO HB2 1 81 ILE H 3.800 . 3.800 3.322 3.209 3.644 . 0 0 "[ . 1 . 2]" 1
461 1 80 PRO HB3 1 81 ILE H 3.950 . 3.950 3.776 3.394 3.898 . 0 0 "[ . 1 . 2]" 1
462 1 81 ILE H 1 81 ILE HB 3.640 . 3.640 2.605 2.548 2.684 . 0 0 "[ . 1 . 2]" 1
463 1 81 ILE H 1 81 ILE HG13 3.590 . 3.590 2.271 2.188 2.338 . 0 0 "[ . 1 . 2]" 1
464 1 81 ILE H 1 81 ILE MD 3.870 . 3.870 3.721 3.671 3.756 . 0 0 "[ . 1 . 2]" 1
465 1 23 GLY H 1 24 VAL H 3.710 . 3.710 2.663 1.759 3.844 0.134 3 0 "[ . 1 . 2]" 1
466 1 88 ALA H 1 89 GLN H 4.240 . 4.240 2.543 2.475 2.600 . 0 0 "[ . 1 . 2]" 1
467 1 64 ARG H 1 65 GLN H 3.280 . 3.280 2.434 2.320 2.578 . 0 0 "[ . 1 . 2]" 1
468 1 89 GLN H 1 90 LEU H 3.330 . 3.330 2.516 2.403 2.630 . 0 0 "[ . 1 . 2]" 1
469 1 23 GLY QA 1 24 VAL H 2.800 . 2.800 2.586 2.216 2.878 0.078 10 0 "[ . 1 . 2]" 1
470 1 89 GLN H 1 91 GLU HA 5.800 . 5.800 5.304 5.075 5.672 . 0 0 "[ . 1 . 2]" 1
471 1 89 GLN H 1 89 GLN HB3 3.560 . 3.560 3.292 2.665 3.571 0.011 5 0 "[ . 1 . 2]" 1
472 1 88 ALA MB 1 89 GLN H 3.160 . 3.160 2.990 2.810 3.135 . 0 0 "[ . 1 . 2]" 1
473 1 24 VAL H 1 24 VAL QG 2.910 . 2.910 2.201 1.884 2.763 . 0 0 "[ . 1 . 2]" 1
474 1 63 GLU H 1 64 ARG H 3.320 . 3.320 2.701 2.592 2.830 . 0 0 "[ . 1 . 2]" 1
475 1 60 ALA HA 1 64 ARG H 4.090 . 4.090 4.006 3.914 4.080 . 0 0 "[ . 1 . 2]" 1
476 1 64 ARG H 1 64 ARG HD2 4.300 . 4.300 4.127 3.902 4.279 . 0 0 "[ . 1 . 2]" 1
477 1 16 ALA H 1 16 ALA MB 2.900 . 2.900 2.466 2.247 3.065 0.165 16 0 "[ . 1 . 2]" 1
478 1 39 GLN H 1 42 SER H 5.870 . 5.870 5.434 5.004 5.970 0.100 18 0 "[ . 1 . 2]" 1
479 1 38 GLY H 1 42 SER H 3.910 . 3.910 3.308 2.766 3.904 . 0 0 "[ . 1 . 2]" 1
480 1 40 ASP H 1 42 SER H 4.040 . 4.040 3.622 3.360 3.870 . 0 0 "[ . 1 . 2]" 1
481 1 37 ALA HA 1 42 SER H 5.620 . 5.620 4.915 4.408 5.367 . 0 0 "[ . 1 . 2]" 1
482 1 40 ASP HA 1 42 SER H 4.930 . 4.930 4.678 4.263 5.035 0.105 2 0 "[ . 1 . 2]" 1
483 1 42 SER H 1 42 SER HB3 3.710 . 3.710 2.850 2.455 3.647 . 0 0 "[ . 1 . 2]" 1
484 1 82 ASN HB2 1 82 ASN HD22 3.500 . 3.500 3.428 3.410 3.457 . 0 0 "[ . 1 . 2]" 1
485 1 95 GLU H 1 96 ASP H 3.440 . 3.440 2.485 2.336 2.607 . 0 0 "[ . 1 . 2]" 1
486 1 34 LEU H 1 96 ASP H 5.780 . 5.780 5.597 5.484 5.714 . 0 0 "[ . 1 . 2]" 1
487 1 34 LEU HA 1 96 ASP H 4.340 . 4.340 3.183 2.945 3.387 . 0 0 "[ . 1 . 2]" 1
488 1 94 ASP HA 1 96 ASP H 3.840 . 3.840 3.231 3.113 3.434 . 0 0 "[ . 1 . 2]" 1
489 1 96 ASP H 1 96 ASP HB2 3.510 . 3.510 2.590 2.153 3.461 . 0 0 "[ . 1 . 2]" 1
490 1 34 LEU MD2 1 96 ASP H 4.780 . 4.780 4.851 4.751 4.955 0.175 4 0 "[ . 1 . 2]" 1
491 1 61 TYR QD 1 64 ARG H 5.500 . 5.500 5.551 5.483 5.611 0.111 14 0 "[ . 1 . 2]" 1
492 1 65 GLN HA 1 67 LEU H 5.030 . 5.030 5.005 4.534 5.160 0.130 20 0 "[ . 1 . 2]" 1
493 1 64 ARG H 1 65 GLN QG 4.440 . 4.440 4.115 3.958 4.356 . 0 0 "[ . 1 . 2]" 1
494 1 69 MET H 1 70 ARG H 3.570 . 3.570 2.653 2.602 2.712 . 0 0 "[ . 1 . 2]" 1
495 1 70 ARG H 1 71 GLN H 3.400 . 3.400 2.307 2.268 2.392 . 0 0 "[ . 1 . 2]" 1
496 1 70 ARG H 1 71 GLN HA 5.050 . 5.050 4.939 4.901 4.994 . 0 0 "[ . 1 . 2]" 1
497 1 68 SER HB2 1 70 ARG H 4.430 . 4.430 3.310 3.005 3.547 . 0 0 "[ . 1 . 2]" 1
498 1 69 MET QG 1 70 ARG H 4.490 . 4.490 4.432 4.391 4.480 . 0 0 "[ . 1 . 2]" 1
499 1 70 ARG H 1 71 GLN HB2 4.310 . 4.310 4.068 4.000 4.131 . 0 0 "[ . 1 . 2]" 1
500 1 69 MET HB2 1 70 ARG H 3.310 . 3.310 3.073 3.015 3.143 . 0 0 "[ . 1 . 2]" 1
501 1 70 ARG H 1 70 ARG QG 3.160 . 3.160 2.392 2.064 2.554 . 0 0 "[ . 1 . 2]" 1
502 1 66 GLY H 1 67 LEU H 3.190 . 3.190 2.338 2.232 2.469 . 0 0 "[ . 1 . 2]" 1
503 1 66 GLY QA 1 67 LEU H 3.280 . 3.280 2.723 2.644 2.926 . 0 0 "[ . 1 . 2]" 1
504 1 62 CYS HA 1 67 LEU H 3.510 . 3.510 2.970 2.864 3.239 . 0 0 "[ . 1 . 2]" 1
505 1 67 LEU H 1 67 LEU HB2 3.280 . 3.280 2.545 2.411 2.627 . 0 0 "[ . 1 . 2]" 1
506 1 50 ARG H 1 50 ARG HD2 4.480 . 4.480 4.323 3.679 4.718 0.238 16 0 "[ . 1 . 2]" 1
507 1 31 HIS HB2 1 50 ARG H 5.200 . 5.200 4.820 4.287 5.235 0.035 14 0 "[ . 1 . 2]" 1
508 1 50 ARG H 1 51 HIS HB3 5.760 . 5.760 4.809 4.482 5.065 . 0 0 "[ . 1 . 2]" 1
509 1 49 LYS HB3 1 50 ARG H 3.870 . 3.870 2.751 2.627 3.022 . 0 0 "[ . 1 . 2]" 1
510 1 50 ARG H 1 50 ARG HG3 3.580 . 3.580 2.463 1.819 2.957 . 0 0 "[ . 1 . 2]" 1
511 1 50 ARG H 1 50 ARG HB2 3.950 . 3.950 3.592 3.545 3.646 . 0 0 "[ . 1 . 2]" 1
512 1 31 HIS H 1 32 ILE H 4.510 . 4.510 4.363 3.309 4.492 . 0 0 "[ . 1 . 2]" 1
513 1 31 HIS H 1 32 ILE MG 4.710 . 4.710 4.213 3.210 4.486 . 0 0 "[ . 1 . 2]" 1
514 1 17 ASP HA 1 18 GLU H 3.560 . 3.560 3.329 2.708 3.568 0.008 17 0 "[ . 1 . 2]" 1
515 1 16 ALA MB 1 18 GLU H 4.720 . 4.720 4.340 2.828 4.916 0.196 8 0 "[ . 1 . 2]" 1
516 1 59 LYS H 1 61 TYR H 4.820 . 4.820 4.071 3.970 4.200 . 0 0 "[ . 1 . 2]" 1
517 1 16 ALA H 1 17 ASP H 3.540 . 3.540 2.610 1.645 3.645 0.155 14 0 "[ . 1 . 2]" 1
518 1 16 ALA HA 1 17 ASP H 3.140 . 3.140 2.899 2.067 3.285 0.145 1 0 "[ . 1 . 2]" 1
519 1 17 ASP H 1 17 ASP HB2 3.640 . 3.640 3.005 2.404 3.715 0.075 9 0 "[ . 1 . 2]" 1
520 1 59 LYS H 1 59 LYS QB 3.030 . 3.030 2.383 2.271 2.516 . 0 0 "[ . 1 . 2]" 1
521 1 57 LEU HG 1 58 MET H 4.070 . 4.070 2.264 2.149 2.340 . 0 0 "[ . 1 . 2]" 1
522 1 63 GLU H 1 65 GLN H 4.180 . 4.180 4.065 3.909 4.187 0.007 16 0 "[ . 1 . 2]" 1
523 1 63 GLU H 1 63 GLU HG3 3.500 . 3.500 2.699 2.277 3.645 0.145 14 0 "[ . 1 . 2]" 1
524 1 39 GLN H 1 40 ASP H 3.630 . 3.630 2.733 2.452 2.936 . 0 0 "[ . 1 . 2]" 1
525 1 40 ASP H 1 41 GLY H 3.230 . 3.230 2.468 2.249 2.812 . 0 0 "[ . 1 . 2]" 1
526 1 88 ALA H 1 91 GLU H 5.340 . 5.340 5.034 4.768 5.263 . 0 0 "[ . 1 . 2]" 1
527 1 88 ALA H 1 90 LEU H 4.590 . 4.590 4.375 4.252 4.562 . 0 0 "[ . 1 . 2]" 1
528 1 25 LYS HA 1 26 THR H 2.940 . 2.940 2.249 2.095 2.721 . 0 0 "[ . 1 . 2]" 1
529 1 86 THR HB 1 88 ALA H 3.200 . 3.200 2.622 2.338 3.218 0.018 11 0 "[ . 1 . 2]" 1
530 1 38 GLY HA3 1 40 ASP H 3.600 . 3.600 3.103 2.946 3.303 . 0 0 "[ . 1 . 2]" 1
531 1 26 THR H 1 26 THR MG 3.640 . 3.640 2.426 1.923 3.610 . 0 0 "[ . 1 . 2]" 1
532 1 88 ALA H 1 88 ALA MB 3.010 . 3.010 2.221 2.194 2.246 . 0 0 "[ . 1 . 2]" 1
533 1 32 ILE MD 1 88 ALA H 4.920 . 4.920 4.769 4.522 4.929 0.009 3 0 "[ . 1 . 2]" 1
534 1 19 LYS H 1 20 PRO HD2 4.920 . 4.920 4.607 3.435 5.096 0.176 14 0 "[ . 1 . 2]" 1
535 1 18 GLU HB3 1 19 LYS H 5.020 . 5.020 4.056 3.049 4.618 . 0 0 "[ . 1 . 2]" 1
536 1 49 LYS H 1 49 LYS HB2 3.640 . 3.640 2.385 2.292 2.544 . 0 0 "[ . 1 . 2]" 1
537 1 19 LYS H 1 19 LYS QG 4.230 . 4.230 3.496 2.209 4.258 0.028 8 0 "[ . 1 . 2]" 1
538 1 102 GLN HG3 1 103 GLN H 4.350 . 4.350 2.929 2.527 3.343 . 0 0 "[ . 1 . 2]" 1
539 1 102 GLN HB3 1 103 GLN H 4.180 . 4.180 4.063 2.818 4.230 0.050 17 0 "[ . 1 . 2]" 1
540 1 30 ASP H 1 30 ASP QB 3.630 . 3.630 2.647 2.265 3.108 . 0 0 "[ . 1 . 2]" 1
541 1 54 LEU H 1 55 SER H 3.760 . 3.760 2.581 2.454 2.647 . 0 0 "[ . 1 . 2]" 1
542 1 55 SER H 1 57 LEU H 4.910 . 4.910 4.535 4.448 4.628 . 0 0 "[ . 1 . 2]" 1
543 1 53 PRO HA 1 55 SER H 4.010 . 4.010 3.556 3.407 3.738 . 0 0 "[ . 1 . 2]" 1
544 1 53 PRO HB2 1 55 SER H 3.690 . 3.690 2.736 2.591 2.894 . 0 0 "[ . 1 . 2]" 1
545 1 62 CYS H 1 64 ARG H 4.740 . 4.740 4.283 4.140 4.471 . 0 0 "[ . 1 . 2]" 1
546 1 62 CYS H 1 62 CYS HB2 3.800 . 3.800 3.225 2.622 3.629 . 0 0 "[ . 1 . 2]" 1
547 1 59 LYS QB 1 62 CYS H 5.210 . 5.210 4.930 4.834 4.999 . 0 0 "[ . 1 . 2]" 1
548 1 60 ALA MB 1 62 CYS H 4.870 . 4.870 4.785 4.685 4.860 . 0 0 "[ . 1 . 2]" 1
549 1 97 THR H 1 98 ILE H 4.720 . 4.720 4.344 4.166 4.450 . 0 0 "[ . 1 . 2]" 1
550 1 96 ASP H 1 97 THR H 4.640 . 4.640 4.657 4.631 4.694 0.054 6 0 "[ . 1 . 2]" 1
551 1 97 THR H 1 97 THR HB 3.580 . 3.580 2.650 2.579 2.735 . 0 0 "[ . 1 . 2]" 1
552 1 96 ASP HB2 1 97 THR H 4.380 . 4.380 3.852 3.115 4.177 . 0 0 "[ . 1 . 2]" 1
553 1 97 THR H 1 97 THR MG 4.010 . 4.010 3.851 3.813 3.890 . 0 0 "[ . 1 . 2]" 1
554 1 93 GLU HA 1 94 ASP H 3.060 . 3.060 2.473 2.373 2.609 . 0 0 "[ . 1 . 2]" 1
555 1 94 ASP H 1 94 ASP QB 2.930 . 2.930 2.457 2.273 2.553 . 0 0 "[ . 1 . 2]" 1
556 1 72 ILE H 1 73 ARG H 4.520 . 4.520 4.391 4.353 4.433 . 0 0 "[ . 1 . 2]" 1
557 1 72 ILE HA 1 73 ARG H 3.160 . 3.160 2.524 2.476 2.587 . 0 0 "[ . 1 . 2]" 1
558 1 73 ARG H 1 101 PHE HB3 5.890 . 5.890 5.720 5.625 5.784 . 0 0 "[ . 1 . 2]" 1
559 1 72 ILE HB 1 73 ARG H 3.470 . 3.470 2.055 1.977 2.128 . 0 0 "[ . 1 . 2]" 1
560 1 73 ARG H 1 73 ARG HG2 4.270 . 4.270 3.955 3.716 4.153 . 0 0 "[ . 1 . 2]" 1
561 1 73 ARG H 1 73 ARG HB3 3.970 . 3.970 3.772 3.686 3.862 . 0 0 "[ . 1 . 2]" 1
562 1 20 PRO HB3 1 21 LYS H 3.600 . 3.600 3.200 2.674 3.667 0.067 17 0 "[ . 1 . 2]" 1
563 1 22 GLU H 1 22 GLU QB 3.190 . 3.190 2.691 2.332 3.319 0.129 4 0 "[ . 1 . 2]" 1
564 1 35 LYS HA 1 45 GLN H 4.920 . 4.920 4.750 4.672 4.841 . 0 0 "[ . 1 . 2]" 1
565 1 44 VAL HA 1 45 GLN H 2.880 . 2.880 2.222 2.188 2.242 . 0 0 "[ . 1 . 2]" 1
566 1 45 GLN H 1 45 GLN HB3 3.860 . 3.860 3.720 3.705 3.735 . 0 0 "[ . 1 . 2]" 1
567 1 26 THR HA 1 27 GLU H 3.210 . 3.210 2.397 2.161 3.167 . 0 0 "[ . 1 . 2]" 1
568 1 68 SER H 1 71 GLN H 4.980 . 4.980 3.574 3.493 3.696 . 0 0 "[ . 1 . 2]" 1
569 1 67 LEU HA 1 68 SER H 3.080 . 3.080 2.440 2.361 2.533 . 0 0 "[ . 1 . 2]" 1
570 1 68 SER H 1 71 GLN HA 5.000 . 5.000 4.877 4.765 5.099 0.099 1 0 "[ . 1 . 2]" 1
571 1 68 SER H 1 69 MET HA 5.290 . 5.290 5.153 5.056 5.242 . 0 0 "[ . 1 . 2]" 1
572 1 68 SER H 1 68 SER HB3 3.700 . 3.700 3.705 3.667 3.731 0.031 9 0 "[ . 1 . 2]" 1
573 1 68 SER H 1 68 SER HB2 3.380 . 3.380 2.547 2.494 2.650 . 0 0 "[ . 1 . 2]" 1
574 1 68 SER H 1 71 GLN HB2 4.070 . 4.070 1.999 1.896 2.297 . 0 0 "[ . 1 . 2]" 1
575 1 68 SER H 1 72 ILE HG12 4.720 . 4.720 4.004 3.721 4.201 . 0 0 "[ . 1 . 2]" 1
576 1 68 SER H 1 72 ILE MG 4.410 . 4.410 3.165 3.005 3.375 . 0 0 "[ . 1 . 2]" 1
577 1 25 LYS H 1 26 THR H 4.730 . 4.730 4.156 2.956 4.604 . 0 0 "[ . 1 . 2]" 1
578 1 24 VAL H 1 25 LYS H 4.840 . 4.840 4.156 2.364 4.756 . 0 0 "[ . 1 . 2]" 1
579 1 24 VAL HA 1 25 LYS H 2.740 . 2.740 2.265 2.099 2.902 0.162 15 0 "[ . 1 . 2]" 1
580 1 27 GLU QG 1 28 ASN H 4.720 . 4.720 4.009 1.655 4.781 0.145 8 0 "[ . 1 . 2]" 1
581 1 42 SER H 1 43 VAL H 4.770 . 4.770 4.494 4.354 4.606 . 0 0 "[ . 1 . 2]" 1
582 1 37 ALA HA 1 43 VAL H 5.090 . 5.090 4.686 4.496 4.908 . 0 0 "[ . 1 . 2]" 1
583 1 42 SER HA 1 43 VAL H 2.870 . 2.870 2.275 2.126 2.389 . 0 0 "[ . 1 . 2]" 1
584 1 44 VAL H 1 44 VAL HB 3.570 . 3.570 2.845 2.794 2.899 . 0 0 "[ . 1 . 2]" 1
585 1 37 ALA MB 1 44 VAL H 5.270 . 5.270 4.926 4.690 5.157 . 0 0 "[ . 1 . 2]" 1
586 1 36 VAL MG1 1 44 VAL H 4.710 . 4.710 3.141 2.136 4.323 . 0 0 "[ . 1 . 2]" 1
587 1 38 GLY H 1 39 GLN H 4.690 . 4.690 4.505 4.446 4.549 . 0 0 "[ . 1 . 2]" 1
588 1 37 ALA HA 1 38 GLY H 3.010 . 3.010 2.146 2.106 2.200 . 0 0 "[ . 1 . 2]" 1
589 1 38 GLY H 1 43 VAL HA 4.060 . 4.060 3.487 3.249 3.707 . 0 0 "[ . 1 . 2]" 1
590 1 34 LEU HA 1 35 LYS H 3.270 . 3.270 2.184 2.123 2.269 . 0 0 "[ . 1 . 2]" 1
591 1 29 ASN H 1 29 ASN QB 3.870 . 3.870 2.621 2.100 3.383 . 0 0 "[ . 1 . 2]" 1
592 1 35 LYS H 1 35 LYS HB3 3.920 . 3.920 3.775 3.717 3.830 . 0 0 "[ . 1 . 2]" 1
593 1 34 LEU HB2 1 35 LYS H 4.220 . 4.220 4.078 3.927 4.154 . 0 0 "[ . 1 . 2]" 1
594 1 34 LEU HB3 1 35 LYS H 3.560 . 3.560 3.000 2.844 3.089 . 0 0 "[ . 1 . 2]" 1
595 1 34 LEU MD2 1 35 LYS H 4.830 . 4.830 4.792 4.750 4.817 . 0 0 "[ . 1 . 2]" 1
596 1 34 LEU MD1 1 35 LYS H 4.830 . 4.830 3.374 3.215 3.556 . 0 0 "[ . 1 . 2]" 1
597 1 101 PHE QD 1 102 GLN H 4.250 . 4.250 4.001 3.799 4.181 . 0 0 "[ . 1 . 2]" 1
598 1 101 PHE HA 1 102 GLN H 2.870 . 2.870 2.353 2.264 2.573 . 0 0 "[ . 1 . 2]" 1
599 1 101 PHE HB3 1 102 GLN H 3.930 . 3.930 3.721 3.547 3.839 . 0 0 "[ . 1 . 2]" 1
600 1 102 GLN H 1 102 GLN HB3 3.410 . 3.410 2.689 2.583 3.234 . 0 0 "[ . 1 . 2]" 1
601 1 102 GLN H 1 102 GLN HB2 3.270 . 3.270 2.393 2.020 2.546 . 0 0 "[ . 1 . 2]" 1
602 1 72 ILE MG 1 102 GLN H 4.870 . 4.870 4.541 4.286 4.873 0.003 3 0 "[ . 1 . 2]" 1
603 1 75 ARG H 1 101 PHE H 5.660 . 5.660 5.326 5.140 5.438 . 0 0 "[ . 1 . 2]" 1
604 1 73 ARG H 1 101 PHE H 3.780 . 3.780 2.616 2.482 2.725 . 0 0 "[ . 1 . 2]" 1
605 1 72 ILE HA 1 101 PHE H 4.600 . 4.600 4.458 4.303 4.603 0.003 8 0 "[ . 1 . 2]" 1
606 1 100 VAL HA 1 101 PHE H 3.000 . 3.000 2.159 2.113 2.200 . 0 0 "[ . 1 . 2]" 1
607 1 101 PHE H 1 101 PHE HB2 3.970 . 3.970 3.788 3.750 3.827 . 0 0 "[ . 1 . 2]" 1
608 1 101 PHE H 1 101 PHE HB3 3.770 . 3.770 3.483 3.407 3.533 . 0 0 "[ . 1 . 2]" 1
609 1 39 GLN QG 1 101 PHE H 5.230 . 5.230 4.314 3.919 4.800 . 0 0 "[ . 1 . 2]" 1
610 1 100 VAL HB 1 101 PHE H 4.080 . 4.080 4.063 3.995 4.139 0.059 17 0 "[ . 1 . 2]" 1
611 1 72 ILE MG 1 101 PHE H 5.080 . 5.080 4.723 4.570 4.829 . 0 0 "[ . 1 . 2]" 1
612 1 72 ILE H 1 104 GLN H 5.930 . 5.930 5.621 5.191 6.103 0.173 5 0 "[ . 1 . 2]" 1
613 1 102 GLN HA 1 104 GLN H 4.420 . 4.420 3.505 3.357 4.020 . 0 0 "[ . 1 . 2]" 1
614 1 102 GLN HG2 1 104 GLN H 4.040 . 4.040 3.304 2.981 4.175 0.135 11 0 "[ . 1 . 2]" 1
615 1 104 GLN H 1 104 GLN QB 3.400 . 3.400 2.340 2.174 2.968 . 0 0 "[ . 1 . 2]" 1
616 1 77 ASP H 1 78 GLY H 3.600 . 3.600 2.728 2.625 2.992 . 0 0 "[ . 1 . 2]" 1
617 1 61 TYR H 1 62 CYS H 3.590 . 3.590 2.844 2.783 2.913 . 0 0 "[ . 1 . 2]" 1
618 1 61 TYR H 1 62 CYS HA 5.510 . 5.510 5.377 5.313 5.449 . 0 0 "[ . 1 . 2]" 1
619 1 57 LEU HA 1 61 TYR H 4.560 . 4.560 3.939 3.765 4.041 . 0 0 "[ . 1 . 2]" 1
620 1 61 TYR H 1 61 TYR HB2 3.520 . 3.520 2.590 2.560 2.630 . 0 0 "[ . 1 . 2]" 1
621 1 61 TYR H 1 61 TYR HB3 3.520 . 3.520 2.427 2.356 2.515 . 0 0 "[ . 1 . 2]" 1
622 1 59 LYS QB 1 61 TYR H 4.710 . 4.710 4.690 4.612 4.733 0.023 13 0 "[ . 1 . 2]" 1
623 1 60 ALA MB 1 61 TYR H 3.320 . 3.320 2.589 2.398 2.723 . 0 0 "[ . 1 . 2]" 1
624 1 57 LEU MD1 1 61 TYR H 4.550 . 4.550 4.023 3.882 4.125 . 0 0 "[ . 1 . 2]" 1
625 1 33 ASN H 1 94 ASP H 5.200 . 5.200 4.211 3.979 4.555 . 0 0 "[ . 1 . 2]" 1
626 1 48 ILE H 1 49 LYS H 4.760 . 4.760 4.432 4.401 4.466 . 0 0 "[ . 1 . 2]" 1
627 1 33 ASN HB3 1 34 LEU H 4.300 . 4.300 4.094 3.076 4.288 . 0 0 "[ . 1 . 2]" 1
628 1 53 PRO HB2 1 54 LEU H 4.170 . 4.170 3.617 3.412 3.779 . 0 0 "[ . 1 . 2]" 1
629 1 48 ILE H 1 48 ILE HB 4.140 . 4.140 3.910 3.874 3.954 . 0 0 "[ . 1 . 2]" 1
630 1 32 ILE HB 1 33 ASN H 3.450 . 3.450 2.225 2.152 2.394 . 0 0 "[ . 1 . 2]" 1
631 1 48 ILE H 1 48 ILE HG12 3.930 . 3.930 2.497 2.336 2.624 . 0 0 "[ . 1 . 2]" 1
632 1 34 LEU H 1 34 LEU HB2 3.510 . 3.510 2.635 2.575 2.693 . 0 0 "[ . 1 . 2]" 1
633 1 48 ILE H 1 48 ILE MG 3.390 . 3.390 2.846 2.728 2.966 . 0 0 "[ . 1 . 2]" 1
634 1 39 GLN H 1 102 GLN H 5.360 . 5.360 5.199 4.596 5.461 0.101 10 0 "[ . 1 . 2]" 1
635 1 76 PHE H 1 76 PHE QD 4.590 . 4.590 4.373 4.319 4.414 . 0 0 "[ . 1 . 2]" 1
636 1 75 ARG HA 1 76 PHE H 3.330 . 3.330 2.192 2.068 2.264 . 0 0 "[ . 1 . 2]" 1
637 1 76 PHE H 1 80 PRO HA 4.580 . 4.580 3.676 3.591 3.777 . 0 0 "[ . 1 . 2]" 1
638 1 76 PHE H 1 76 PHE HB3 3.960 . 3.960 2.873 2.794 2.952 . 0 0 "[ . 1 . 2]" 1
639 1 39 GLN H 1 39 GLN QG 3.470 . 3.470 2.039 1.768 2.629 0.032 12 0 "[ . 1 . 2]" 1
640 1 39 GLN H 1 39 GLN HB2 3.610 . 3.610 3.205 2.507 3.565 . 0 0 "[ . 1 . 2]" 1
641 1 39 GLN H 1 39 GLN HB3 3.610 . 3.610 3.158 2.829 3.607 . 0 0 "[ . 1 . 2]" 1
642 1 75 ARG HB3 1 76 PHE H 4.330 . 4.330 4.076 3.892 4.233 . 0 0 "[ . 1 . 2]" 1
643 1 75 ARG HB2 1 76 PHE H 4.140 . 4.140 3.983 3.837 4.062 . 0 0 "[ . 1 . 2]" 1
644 1 39 GLN H 1 100 VAL MG2 5.690 . 5.690 5.124 4.793 5.459 . 0 0 "[ . 1 . 2]" 1
645 1 33 ASN H 1 95 GLU H 4.380 . 4.380 3.183 2.851 3.498 . 0 0 "[ . 1 . 2]" 1
646 1 32 ILE HA 1 33 ASN H 3.240 . 3.240 2.445 2.330 2.487 . 0 0 "[ . 1 . 2]" 1
647 1 33 ASN H 1 33 ASN HB2 3.800 . 3.800 2.909 2.426 3.052 . 0 0 "[ . 1 . 2]" 1
648 1 68 SER H 1 69 MET H 4.690 . 4.690 4.482 4.456 4.510 . 0 0 "[ . 1 . 2]" 1
649 1 76 PHE QD 1 99 ASP H 4.600 . 4.600 4.167 3.966 4.441 . 0 0 "[ . 1 . 2]" 1
650 1 74 PHE QD 1 99 ASP H 5.580 . 5.580 5.314 5.101 5.429 . 0 0 "[ . 1 . 2]" 1
651 1 98 ILE HA 1 99 ASP H 3.280 . 3.280 2.241 2.189 2.289 . 0 0 "[ . 1 . 2]" 1
652 1 68 SER HB2 1 69 MET H 4.540 . 4.540 3.835 3.688 3.909 . 0 0 "[ . 1 . 2]" 1
653 1 99 ASP H 1 99 ASP QB 3.420 . 3.420 2.364 2.301 2.434 . 0 0 "[ . 1 . 2]" 1
654 1 69 MET H 1 69 MET HB2 3.300 . 3.300 2.274 2.220 2.313 . 0 0 "[ . 1 . 2]" 1
655 1 37 ALA MB 1 99 ASP H 6.000 . 6.000 5.360 5.195 5.620 . 0 0 "[ . 1 . 2]" 1
656 1 81 ILE HG13 1 99 ASP H 6.000 . 6.000 5.379 5.195 5.589 . 0 0 "[ . 1 . 2]" 1
657 1 98 ILE MD 1 99 ASP H 4.390 . 4.390 3.799 3.710 3.892 . 0 0 "[ . 1 . 2]" 1
658 1 34 LEU H 1 35 LYS H 4.550 . 4.550 4.366 4.320 4.433 . 0 0 "[ . 1 . 2]" 1
659 1 33 ASN HA 1 34 LEU H 3.220 . 3.220 2.162 2.116 2.203 . 0 0 "[ . 1 . 2]" 1
660 1 54 LEU H 1 86 THR HA 4.620 . 4.620 2.662 2.436 2.996 . 0 0 "[ . 1 . 2]" 1
661 1 53 PRO HA 1 54 LEU H 3.460 . 3.460 2.139 2.122 2.164 . 0 0 "[ . 1 . 2]" 1
662 1 33 ASN HB2 1 34 LEU H 4.300 . 4.300 4.157 4.073 4.305 0.005 12 0 "[ . 1 . 2]" 1
663 1 74 PHE H 1 75 ARG H 4.600 . 4.600 4.499 4.459 4.536 . 0 0 "[ . 1 . 2]" 1
664 1 82 ASN HA 1 83 GLU H 3.270 . 3.270 2.400 2.305 2.498 . 0 0 "[ . 1 . 2]" 1
665 1 73 ARG HA 1 74 PHE H 3.160 . 3.160 2.179 2.115 2.211 . 0 0 "[ . 1 . 2]" 1
666 1 82 ASN HB2 1 83 GLU H 3.610 . 3.610 3.052 2.778 3.149 . 0 0 "[ . 1 . 2]" 1
667 1 83 GLU H 1 83 GLU HB3 3.460 . 3.460 2.690 2.558 2.856 . 0 0 "[ . 1 . 2]" 1
668 1 73 ARG HB2 1 74 PHE H 4.500 . 4.500 4.189 4.064 4.375 . 0 0 "[ . 1 . 2]" 1
669 1 74 PHE H 1 81 ILE MD 5.110 . 5.110 4.864 4.753 4.981 . 0 0 "[ . 1 . 2]" 1
670 1 45 GLN H 1 46 PHE H 4.660 . 4.660 4.516 4.470 4.555 . 0 0 "[ . 1 . 2]" 1
671 1 46 PHE H 1 46 PHE QE 4.580 . 4.580 4.593 4.533 4.645 0.065 8 0 "[ . 1 . 2]" 1
672 1 45 GLN HA 1 46 PHE H 3.090 . 3.090 2.233 2.194 2.260 . 0 0 "[ . 1 . 2]" 1
673 1 46 PHE H 1 46 PHE HB2 4.060 . 4.060 2.883 2.793 2.949 . 0 0 "[ . 1 . 2]" 1
674 1 45 GLN HB3 1 46 PHE H 4.110 . 4.110 2.935 2.853 2.997 . 0 0 "[ . 1 . 2]" 1
675 1 35 LYS QD 1 46 PHE H 5.080 . 5.080 5.111 5.015 5.255 0.175 1 0 "[ . 1 . 2]" 1
676 1 35 LYS HG2 1 46 PHE H 4.750 . 4.750 3.523 3.404 3.670 . 0 0 "[ . 1 . 2]" 1
677 1 31 HIS HA 1 32 ILE H 3.520 . 3.520 2.236 2.049 2.362 . 0 0 "[ . 1 . 2]" 1
678 1 32 ILE H 1 49 LYS HA 4.080 . 4.080 3.149 2.912 3.383 . 0 0 "[ . 1 . 2]" 1
679 1 31 HIS HB3 1 32 ILE H 4.150 . 4.150 3.953 3.706 4.306 0.156 19 0 "[ . 1 . 2]" 1
680 1 32 ILE H 1 32 ILE HB 4.140 . 4.140 3.825 3.733 3.890 . 0 0 "[ . 1 . 2]" 1
681 1 32 ILE H 1 32 ILE MD 4.640 . 4.640 3.957 3.814 4.089 . 0 0 "[ . 1 . 2]" 1
682 1 36 VAL H 1 44 VAL H 3.690 . 3.690 2.596 2.488 2.707 . 0 0 "[ . 1 . 2]" 1
683 1 36 VAL H 1 45 GLN HA 3.900 . 3.900 3.751 3.660 3.852 . 0 0 "[ . 1 . 2]" 1
684 1 35 LYS HA 1 36 VAL H 3.190 . 3.190 2.202 2.152 2.230 . 0 0 "[ . 1 . 2]" 1
685 1 36 VAL H 1 36 VAL HB 3.580 . 3.580 2.993 2.702 3.235 . 0 0 "[ . 1 . 2]" 1
686 1 35 LYS HB3 1 36 VAL H 4.030 . 4.030 2.842 2.731 2.936 . 0 0 "[ . 1 . 2]" 1
687 1 36 VAL H 1 97 THR MG 5.340 . 5.340 4.688 4.143 5.106 . 0 0 "[ . 1 . 2]" 1
688 1 36 VAL H 1 36 VAL MG2 4.170 . 4.170 3.357 2.769 3.853 . 0 0 "[ . 1 . 2]" 1
689 1 36 VAL H 1 36 VAL MG1 4.170 . 4.170 2.790 1.846 3.903 . 0 0 "[ . 1 . 2]" 1
690 1 81 ILE HA 1 82 ASN H 3.020 . 3.020 2.272 2.192 2.344 . 0 0 "[ . 1 . 2]" 1
691 1 82 ASN H 1 82 ASN HB3 3.910 . 3.910 3.781 3.716 3.843 . 0 0 "[ . 1 . 2]" 1
692 1 82 ASN H 1 82 ASN HB2 3.610 . 3.610 3.009 2.858 3.195 . 0 0 "[ . 1 . 2]" 1
693 1 82 ASN H 1 85 ASP HB3 4.300 . 4.300 3.575 2.848 4.000 . 0 0 "[ . 1 . 2]" 1
694 1 81 ILE HB 1 82 ASN H 3.950 . 3.950 3.800 3.706 3.886 . 0 0 "[ . 1 . 2]" 1
695 1 81 ILE MG 1 82 ASN H 3.360 . 3.360 2.180 2.055 2.340 . 0 0 "[ . 1 . 2]" 1
696 1 54 LEU MD2 1 82 ASN H 5.290 . 5.290 4.318 3.655 4.645 . 0 0 "[ . 1 . 2]" 1
697 1 37 ALA H 1 38 GLY H 4.560 . 4.560 4.326 4.198 4.426 . 0 0 "[ . 1 . 2]" 1
698 1 36 VAL HA 1 37 ALA H 3.260 . 3.260 2.165 2.135 2.200 . 0 0 "[ . 1 . 2]" 1
699 1 36 VAL HB 1 37 ALA H 4.590 . 4.590 4.087 3.990 4.153 . 0 0 "[ . 1 . 2]" 1
700 1 36 VAL MG1 1 37 ALA H 4.210 . 4.210 3.343 2.446 4.081 . 0 0 "[ . 1 . 2]" 1
701 1 93 GLU H 1 94 ASP H 4.560 . 4.560 4.524 4.260 4.617 0.057 11 0 "[ . 1 . 2]" 1
702 1 93 GLU H 1 96 ASP H 5.270 . 5.270 4.615 4.380 4.810 . 0 0 "[ . 1 . 2]" 1
703 1 92 MET HA 1 93 GLU H 3.320 . 3.320 2.446 2.314 3.188 . 0 0 "[ . 1 . 2]" 1
704 1 93 GLU H 1 96 ASP HB2 4.970 . 4.970 2.964 2.459 3.726 . 0 0 "[ . 1 . 2]" 1
705 1 93 GLU H 1 96 ASP HB3 4.970 . 4.970 3.863 3.393 4.134 . 0 0 "[ . 1 . 2]" 1
706 1 92 MET HG3 1 93 GLU H 3.680 . 3.680 3.525 1.921 3.728 0.048 7 0 "[ . 1 . 2]" 1
707 1 92 MET HB2 1 93 GLU H 3.490 . 3.490 2.488 1.949 2.708 . 0 0 "[ . 1 . 2]" 1
708 1 92 MET HB3 1 93 GLU H 4.410 . 4.410 3.841 3.395 3.985 . 0 0 "[ . 1 . 2]" 1
709 1 92 MET HG2 1 93 GLU H 4.750 . 4.750 4.197 3.059 4.378 . 0 0 "[ . 1 . 2]" 1
710 1 32 ILE MD 1 93 GLU H 5.070 . 5.070 4.392 3.588 4.880 . 0 0 "[ . 1 . 2]" 1
711 1 37 ALA H 1 98 ILE H 4.320 . 4.320 3.248 2.976 3.431 . 0 0 "[ . 1 . 2]" 1
712 1 98 ILE H 1 99 ASP H 4.770 . 4.770 4.550 4.484 4.609 . 0 0 "[ . 1 . 2]" 1
713 1 97 THR HA 1 98 ILE H 3.420 . 3.420 2.111 2.041 2.165 . 0 0 "[ . 1 . 2]" 1
714 1 36 VAL HA 1 98 ILE H 4.150 . 4.150 2.175 2.030 2.282 . 0 0 "[ . 1 . 2]" 1
715 1 98 ILE H 1 98 ILE HB 3.810 . 3.810 2.559 2.507 2.616 . 0 0 "[ . 1 . 2]" 1
716 1 98 ILE H 1 98 ILE HG13 4.140 . 4.140 3.679 3.503 3.821 . 0 0 "[ . 1 . 2]" 1
717 1 98 ILE H 1 98 ILE HG12 4.060 . 4.060 2.287 2.114 2.433 . 0 0 "[ . 1 . 2]" 1
718 1 36 VAL MG1 1 98 ILE H 4.790 . 4.790 4.420 3.895 4.884 0.094 6 0 "[ . 1 . 2]" 1
719 1 76 PHE H 1 77 ASP H 4.570 . 4.570 4.277 4.226 4.308 . 0 0 "[ . 1 . 2]" 1
720 1 76 PHE HA 1 77 ASP H 3.320 . 3.320 2.235 2.181 2.272 . 0 0 "[ . 1 . 2]" 1
721 1 77 ASP H 1 98 ILE HA 5.510 . 5.510 5.531 5.346 5.680 0.170 18 0 "[ . 1 . 2]" 1
722 1 76 PHE HB2 1 77 ASP H 4.500 . 4.500 3.946 3.864 4.002 . 0 0 "[ . 1 . 2]" 1
723 1 77 ASP H 1 77 ASP HB2 4.180 . 4.180 2.997 2.920 3.079 . 0 0 "[ . 1 . 2]" 1
724 1 94 ASP H 1 95 GLU H 4.910 . 4.910 4.512 4.484 4.554 . 0 0 "[ . 1 . 2]" 1
725 1 34 LEU HA 1 95 GLU H 4.890 . 4.890 3.339 3.058 3.580 . 0 0 "[ . 1 . 2]" 1
726 1 94 ASP HA 1 95 GLU H 3.470 . 3.470 2.126 2.068 2.182 . 0 0 "[ . 1 . 2]" 1
727 1 94 ASP QB 1 95 GLU H 3.810 . 3.810 2.806 2.663 2.994 . 0 0 "[ . 1 . 2]" 1
728 1 95 GLU H 1 95 GLU HB2 4.200 . 4.200 3.580 3.447 3.668 . 0 0 "[ . 1 . 2]" 1
729 1 95 GLU H 1 95 GLU HG2 4.120 . 4.120 3.286 2.868 3.643 . 0 0 "[ . 1 . 2]" 1
730 1 32 ILE HB 1 95 GLU H 4.770 . 4.770 4.314 4.052 4.616 . 0 0 "[ . 1 . 2]" 1
731 1 75 ARG H 1 99 ASP H 3.840 . 3.840 2.988 2.844 3.150 . 0 0 "[ . 1 . 2]" 1
732 1 74 PHE QD 1 75 ARG H 4.150 . 4.150 4.203 4.138 4.293 0.143 11 0 "[ . 1 . 2]" 1
733 1 74 PHE HA 1 75 ARG H 3.200 . 3.200 2.221 2.175 2.276 . 0 0 "[ . 1 . 2]" 1
734 1 75 ARG H 1 100 VAL HA 4.100 . 4.100 3.648 3.534 3.736 . 0 0 "[ . 1 . 2]" 1
735 1 74 PHE HB2 1 75 ARG H 4.290 . 4.290 3.986 3.862 4.065 . 0 0 "[ . 1 . 2]" 1
736 1 75 ARG H 1 75 ARG HB3 3.950 . 3.950 2.714 2.617 2.847 . 0 0 "[ . 1 . 2]" 1
737 1 75 ARG H 1 98 ILE MG 3.850 . 3.850 2.547 2.363 2.720 . 0 0 "[ . 1 . 2]" 1
738 1 70 ARG HE 1 71 GLN HE22 5.300 . 5.300 4.949 4.392 5.362 0.062 12 0 "[ . 1 . 2]" 1
739 1 71 GLN H 1 71 GLN HE21 4.000 . 4.000 3.794 3.453 3.945 . 0 0 "[ . 1 . 2]" 1
740 1 27 GLU QB 1 28 ASN HD22 5.540 . 5.540 4.747 3.569 5.624 0.084 2 0 "[ . 1 . 2]" 1
741 1 70 ARG QG 1 71 GLN HE21 4.980 . 4.980 2.969 2.411 3.294 . 0 0 "[ . 1 . 2]" 1
742 1 77 ASP HB3 1 79 GLN HE21 4.930 . 4.930 3.611 2.675 4.396 . 0 0 "[ . 1 . 2]" 1
743 1 38 GLY H 1 39 GLN HE22 6.000 . 6.000 6.020 5.707 6.227 0.227 17 0 "[ . 1 . 2]" 1
744 1 39 GLN HE22 1 102 GLN H 6.000 . 6.000 5.365 4.428 6.304 0.304 6 0 "[ . 1 . 2]" 1
745 1 39 GLN HE22 1 39 GLN QG 3.540 . 3.540 3.278 3.249 3.301 . 0 0 "[ . 1 . 2]" 1
746 1 45 GLN H 1 45 GLN HE21 4.650 . 4.650 2.544 2.399 2.646 . 0 0 "[ . 1 . 2]" 1
747 1 71 GLN H 1 71 GLN HE22 4.200 . 4.200 4.129 3.965 4.260 0.060 11 0 "[ . 1 . 2]" 1
748 1 45 GLN HB3 1 45 GLN HE21 4.670 . 4.670 4.271 4.256 4.294 . 0 0 "[ . 1 . 2]" 1
749 1 35 LYS QD 1 45 GLN HE21 4.770 . 4.770 3.744 3.420 3.898 . 0 0 "[ . 1 . 2]" 1
750 1 43 VAL MG1 1 45 GLN HE21 5.000 . 5.000 3.124 2.494 3.491 . 0 0 "[ . 1 . 2]" 1
751 1 45 GLN H 1 45 GLN HE22 4.800 . 4.800 3.118 2.972 3.185 . 0 0 "[ . 1 . 2]" 1
752 1 103 GLN HE22 1 103 GLN QG 3.530 . 3.530 3.236 3.209 3.303 . 0 0 "[ . 1 . 2]" 1
753 1 43 VAL HB 1 45 GLN HE22 5.550 . 5.550 5.335 3.897 5.642 0.092 14 0 "[ . 1 . 2]" 1
754 1 45 GLN HB3 1 45 GLN HE22 5.330 . 5.330 5.181 5.159 5.210 . 0 0 "[ . 1 . 2]" 1
755 1 65 GLN HB2 1 65 GLN HE22 5.240 . 5.240 5.067 5.050 5.088 . 0 0 "[ . 1 . 2]" 1
756 1 44 VAL MG2 1 65 GLN HE22 4.230 . 4.230 3.529 3.153 3.981 . 0 0 "[ . 1 . 2]" 1
757 1 72 ILE MG 1 102 GLN HE21 4.570 . 4.570 2.122 1.663 2.798 0.137 11 0 "[ . 1 . 2]" 1
758 1 50 ARG HB2 1 50 ARG HE 4.670 . 4.670 4.361 4.207 4.465 . 0 0 "[ . 1 . 2]" 1
759 1 32 ILE H 1 32 ILE MG 3.640 . 3.640 3.048 2.893 3.121 . 0 0 "[ . 1 . 2]" 1
760 1 32 ILE H 1 32 ILE HG13 4.110 . 4.110 2.828 2.747 2.920 . 0 0 "[ . 1 . 2]" 1
761 1 81 ILE MG 1 85 ASP H 4.620 . 4.620 4.032 3.829 4.251 . 0 0 "[ . 1 . 2]" 1
762 1 89 GLN H 1 90 LEU HG 4.580 . 4.580 4.461 4.161 4.597 0.017 7 0 "[ . 1 . 2]" 1
763 1 32 ILE MD 1 94 ASP H 4.390 . 4.390 3.824 3.512 4.095 . 0 0 "[ . 1 . 2]" 1
764 1 20 PRO HA 1 21 LYS H 2.780 . 2.780 2.540 2.042 2.924 0.144 7 0 "[ . 1 . 2]" 1
765 1 45 GLN HE22 1 45 GLN HG3 3.470 . 3.470 3.468 3.456 3.476 0.006 5 0 "[ . 1 . 2]" 1
766 1 28 ASN HD21 1 29 ASN H 5.780 . 5.780 4.780 4.277 5.739 . 0 0 "[ . 1 . 2]" 1
767 1 37 ALA H 1 99 ASP QB 6.000 . 6.000 5.434 5.169 5.749 . 0 0 "[ . 1 . 2]" 1
768 1 37 ALA H 1 97 THR HB 6.000 . 6.000 5.744 5.431 6.032 0.032 5 0 "[ . 1 . 2]" 1
769 1 37 ALA H 1 74 PHE QD 5.770 . 5.770 5.668 5.445 5.809 0.039 7 0 "[ . 1 . 2]" 1
770 1 36 VAL H 1 61 TYR QE 5.380 . 5.380 5.007 4.728 5.308 . 0 0 "[ . 1 . 2]" 1
771 1 50 ARG H 1 50 ARG HE 5.730 . 5.730 4.447 4.021 4.891 . 0 0 "[ . 1 . 2]" 1
772 1 77 ASP H 1 78 GLY HA2 5.150 . 5.150 4.981 4.865 5.118 . 0 0 "[ . 1 . 2]" 1
773 1 77 ASP H 1 79 GLN HG3 5.610 . 5.610 5.642 5.461 5.701 0.091 6 0 "[ . 1 . 2]" 1
774 1 77 ASP H 1 90 LEU HB3 6.000 . 6.000 5.810 5.498 6.047 0.047 5 0 "[ . 1 . 2]" 1
775 1 77 ASP H 1 92 MET ME 5.630 . 5.630 5.291 5.090 5.453 . 0 0 "[ . 1 . 2]" 1
776 1 77 ASP H 1 81 ILE MD 5.430 . 5.430 5.351 5.249 5.438 0.008 5 0 "[ . 1 . 2]" 1
777 1 38 GLY H 1 42 SER HA 5.100 . 5.100 4.794 4.618 5.004 . 0 0 "[ . 1 . 2]" 1
778 1 38 GLY H 1 40 ASP H 5.180 . 5.180 4.522 4.122 4.848 . 0 0 "[ . 1 . 2]" 1
779 1 35 LYS HE3 1 36 VAL H 5.830 . 5.830 5.642 5.456 5.909 0.079 12 0 "[ . 1 . 2]" 1
780 1 37 ALA MB 1 42 SER H 5.700 . 5.700 5.017 4.453 5.444 . 0 0 "[ . 1 . 2]" 1
781 1 35 LYS QD 1 44 VAL H 6.000 . 6.000 5.726 5.511 5.967 . 0 0 "[ . 1 . 2]" 1
782 1 44 VAL H 1 46 PHE QE 5.090 . 5.090 4.038 3.877 4.225 . 0 0 "[ . 1 . 2]" 1
783 1 34 LEU HB2 1 46 PHE H 4.740 . 4.740 4.107 3.840 4.364 . 0 0 "[ . 1 . 2]" 1
784 1 32 ILE H 1 50 ARG H 5.070 . 5.070 3.956 3.445 4.368 . 0 0 "[ . 1 . 2]" 1
785 1 54 LEU HB3 1 56 LYS H 5.800 . 5.800 5.629 5.537 5.720 . 0 0 "[ . 1 . 2]" 1
786 1 54 LEU H 1 56 LYS H 5.210 . 5.210 4.520 4.391 4.641 . 0 0 "[ . 1 . 2]" 1
787 1 54 LEU H 1 57 LEU H 6.000 . 6.000 5.668 5.568 5.756 . 0 0 "[ . 1 . 2]" 1
788 1 56 LYS QE 1 57 LEU H 5.560 . 5.560 5.066 4.238 5.901 0.341 6 0 "[ . 1 . 2]" 1
789 1 60 ALA H 1 63 GLU HG3 5.220 . 5.220 5.023 4.707 5.291 0.071 11 0 "[ . 1 . 2]" 1
790 1 44 VAL MG2 1 61 TYR H 5.640 . 5.640 5.297 5.147 5.544 . 0 0 "[ . 1 . 2]" 1
791 1 70 ARG H 1 72 ILE HG12 5.160 . 5.160 5.146 5.030 5.235 0.075 12 0 "[ . 1 . 2]" 1
792 1 70 ARG H 1 72 ILE MG 5.660 . 5.660 5.742 5.681 5.821 0.161 11 0 "[ . 1 . 2]" 1
793 1 68 SER H 1 70 ARG H 5.100 . 5.100 4.882 4.821 4.983 . 0 0 "[ . 1 . 2]" 1
794 1 69 MET QG 1 72 ILE H 5.990 . 5.990 5.737 5.640 5.836 . 0 0 "[ . 1 . 2]" 1
795 1 68 SER HB3 1 72 ILE H 5.840 . 5.840 5.282 5.089 5.456 . 0 0 "[ . 1 . 2]" 1
796 1 68 SER HB2 1 72 ILE H 5.300 . 5.300 4.526 4.174 4.837 . 0 0 "[ . 1 . 2]" 1
797 1 72 ILE H 1 74 PHE QE 5.980 . 5.980 5.705 5.544 5.907 . 0 0 "[ . 1 . 2]" 1
798 1 73 ARG H 1 103 GLN HE21 6.000 . 6.000 5.609 4.719 6.015 0.015 11 0 "[ . 1 . 2]" 1
799 1 73 ARG H 1 101 PHE HB2 5.380 . 5.380 5.336 5.271 5.392 0.012 14 0 "[ . 1 . 2]" 1
800 1 74 PHE H 1 101 PHE H 5.170 . 5.170 5.217 5.186 5.262 0.092 16 0 "[ . 1 . 2]" 1
801 1 75 ARG H 1 100 VAL MG2 5.450 . 5.450 3.663 3.515 3.835 . 0 0 "[ . 1 . 2]" 1
802 1 76 PHE H 1 79 GLN HE21 5.890 . 5.890 5.137 4.961 5.495 . 0 0 "[ . 1 . 2]" 1
803 1 89 GLN QG 1 90 LEU H 4.570 . 4.570 4.285 3.803 4.635 0.065 11 0 "[ . 1 . 2]" 1
804 1 93 GLU H 1 96 ASP HA 5.170 . 5.170 4.906 4.545 5.359 0.189 1 0 "[ . 1 . 2]" 1
805 1 35 LYS H 1 95 GLU H 5.650 . 5.650 4.664 4.459 4.843 . 0 0 "[ . 1 . 2]" 1
806 1 35 LYS HE3 1 98 ILE H 5.810 . 5.810 5.734 5.428 5.912 0.102 17 0 "[ . 1 . 2]" 1
807 1 98 ILE H 1 99 ASP QB 6.000 . 6.000 5.906 5.669 6.217 0.217 14 0 "[ . 1 . 2]" 1
808 1 76 PHE QD 1 98 ILE H 5.720 . 5.720 4.826 4.543 5.363 . 0 0 "[ . 1 . 2]" 1
809 1 35 LYS QD 1 45 GLN HE22 4.820 . 4.820 4.760 4.524 4.882 0.062 1 0 "[ . 1 . 2]" 1
810 1 35 LYS HG2 1 45 GLN HE22 5.990 . 5.990 5.405 5.255 5.542 . 0 0 "[ . 1 . 2]" 1
811 1 59 LYS H 1 69 MET ME 3.210 . 3.210 3.181 3.091 3.260 0.050 10 0 "[ . 1 . 2]" 1
812 1 53 PRO HB3 1 55 SER H 4.220 . 4.220 3.995 3.917 4.060 . 0 0 "[ . 1 . 2]" 1
813 1 96 ASP HA 1 97 THR H 3.130 . 3.130 2.362 2.274 2.499 . 0 0 "[ . 1 . 2]" 1
814 1 46 PHE QE 1 60 ALA MB 3.250 . 3.250 2.454 2.306 2.630 . 0 0 "[ . 1 . 2]" 1
815 1 36 VAL H 1 44 VAL HB 4.240 . 4.240 3.796 3.649 3.987 . 0 0 "[ . 1 . 2]" 1
816 1 64 ARG QG 1 65 GLN HE22 4.410 . 4.410 3.643 3.198 4.156 . 0 0 "[ . 1 . 2]" 1
817 1 44 VAL HB 1 61 TYR QD 3.460 . 3.460 2.550 2.258 2.735 . 0 0 "[ . 1 . 2]" 1
818 1 72 ILE HB 1 101 PHE H 4.480 . 4.480 3.577 3.441 3.664 . 0 0 "[ . 1 . 2]" 1
819 1 75 ARG HB3 1 78 GLY H 5.590 . 5.590 5.500 5.249 5.680 0.090 18 0 "[ . 1 . 2]" 1
820 1 99 ASP QB 1 100 VAL H 3.830 . 3.830 3.617 3.235 3.891 0.061 4 0 "[ . 1 . 2]" 1
821 1 72 ILE HG12 1 73 ARG H 4.040 . 4.040 4.109 4.051 4.179 0.139 2 0 "[ . 1 . 2]" 1
822 1 18 GLU H 1 18 GLU QG 4.620 . 4.620 2.491 1.787 4.002 0.013 15 0 "[ . 1 . 2]" 1
823 1 86 THR H 1 89 GLN HB2 3.530 . 3.530 2.706 2.322 3.053 . 0 0 "[ . 1 . 2]" 1
824 1 35 LYS HB2 1 36 VAL H 4.370 . 4.370 3.865 3.728 3.954 . 0 0 "[ . 1 . 2]" 1
825 1 70 ARG HB3 1 71 GLN HE21 5.370 . 5.370 5.423 5.377 5.460 0.090 7 0 "[ . 1 . 2]" 1
826 1 61 TYR QE 1 67 LEU HB3 5.160 . 5.160 4.624 4.323 5.134 . 0 0 "[ . 1 . 2]" 1
827 1 15 MET HG2 1 16 ALA H 3.850 . 3.850 3.044 2.354 3.905 0.055 19 0 "[ . 1 . 2]" 1
828 1 65 GLN H 1 65 GLN HB3 3.630 . 3.630 3.585 3.556 3.605 . 0 0 "[ . 1 . 2]" 1
829 1 36 VAL HB 1 61 TYR QD 4.130 . 4.130 3.577 2.587 4.320 0.190 8 0 "[ . 1 . 2]" 1
830 1 36 VAL HB 1 74 PHE QD 4.320 . 4.320 4.252 3.828 4.633 0.313 11 0 "[ . 1 . 2]" 1
831 1 37 ALA MB 1 38 GLY H 3.170 . 3.170 3.057 2.885 3.211 0.041 7 0 "[ . 1 . 2]" 1
832 1 79 GLN H 1 79 GLN HB2 3.650 . 3.650 3.691 3.648 3.773 0.123 20 0 "[ . 1 . 2]" 1
833 1 83 GLU HB2 1 84 THR H 5.310 . 5.310 4.084 3.893 4.232 . 0 0 "[ . 1 . 2]" 1
834 1 34 LEU H 1 34 LEU HB3 4.140 . 4.140 3.762 3.730 3.799 . 0 0 "[ . 1 . 2]" 1
835 1 83 GLU H 1 84 THR MG 4.460 . 4.460 3.834 3.365 4.488 0.028 15 0 "[ . 1 . 2]" 1
836 1 46 PHE QD 1 60 ALA MB 4.090 . 4.090 3.555 3.272 3.809 . 0 0 "[ . 1 . 2]" 1
837 1 58 MET QB 1 74 PHE QD 4.500 . 4.500 3.500 3.383 3.626 . 0 0 "[ . 1 . 2]" 1
838 1 79 GLN HE21 1 90 LEU HG 4.790 . 4.790 3.606 3.157 4.307 . 0 0 "[ . 1 . 2]" 1
839 1 89 GLN HE22 1 89 GLN QG 3.540 . 3.540 3.305 3.209 3.477 . 0 0 "[ . 1 . 2]" 1
840 1 59 LYS H 1 59 LYS HG2 3.330 . 3.330 3.130 2.270 3.420 0.090 15 0 "[ . 1 . 2]" 1
841 1 50 ARG HG3 1 51 HIS H 3.830 . 3.830 2.692 2.356 3.013 . 0 0 "[ . 1 . 2]" 1
842 1 93 GLU H 1 93 GLU HG2 4.210 . 4.210 2.134 1.976 2.859 . 0 0 "[ . 1 . 2]" 1
843 1 26 THR MG 1 27 GLU H 3.840 . 3.840 3.519 2.599 3.955 0.115 5 0 "[ . 1 . 2]" 1
844 1 102 GLN HB2 1 103 GLN H 4.710 . 4.710 4.376 3.965 4.511 . 0 0 "[ . 1 . 2]" 1
845 1 20 PRO HB3 1 22 GLU H 4.400 . 4.400 3.938 3.364 4.625 0.225 15 0 "[ . 1 . 2]" 1
846 1 35 LYS H 1 35 LYS HB2 3.320 . 3.320 2.660 2.575 2.740 . 0 0 "[ . 1 . 2]" 1
847 1 43 VAL H 1 43 VAL HB 3.780 . 3.780 3.319 2.700 3.511 . 0 0 "[ . 1 . 2]" 1
848 1 22 GLU H 1 22 GLU QG 3.730 . 3.730 2.434 1.889 3.395 . 0 0 "[ . 1 . 2]" 1
849 1 91 GLU QG 1 92 MET H 4.520 . 4.520 4.297 3.910 4.646 0.126 2 0 "[ . 1 . 2]" 1
850 1 92 MET H 1 92 MET HG3 4.740 . 4.740 3.637 3.543 3.714 . 0 0 "[ . 1 . 2]" 1
851 1 65 GLN HB2 1 67 LEU H 3.920 . 3.920 3.340 2.965 3.504 . 0 0 "[ . 1 . 2]" 1
852 1 67 LEU H 1 67 LEU HG 4.310 . 4.310 4.530 4.209 4.633 0.323 20 0 "[ . 1 . 2]" 1
853 1 87 PRO HG2 1 88 ALA H 4.470 . 4.470 2.510 2.334 2.619 . 0 0 "[ . 1 . 2]" 1
854 1 87 PRO HG3 1 88 ALA H 4.620 . 4.620 4.035 3.909 4.108 . 0 0 "[ . 1 . 2]" 1
855 1 76 PHE QE 1 92 MET HG3 5.130 . 5.130 4.958 4.853 5.038 . 0 0 "[ . 1 . 2]" 1
856 1 76 PHE HZ 1 92 MET HG3 5.430 . 5.430 4.893 4.629 5.052 . 0 0 "[ . 1 . 2]" 1
857 1 64 ARG QG 1 65 GLN H 3.910 . 3.910 2.310 2.216 2.427 . 0 0 "[ . 1 . 2]" 1
858 1 57 LEU H 1 57 LEU HB2 4.190 . 4.190 3.629 3.611 3.654 . 0 0 "[ . 1 . 2]" 1
859 1 73 ARG HB3 1 101 PHE QD 4.670 . 4.670 4.375 4.084 4.563 . 0 0 "[ . 1 . 2]" 1
860 1 73 ARG HB3 1 74 PHE H 4.130 . 4.130 3.024 2.818 3.358 . 0 0 "[ . 1 . 2]" 1
861 1 50 ARG H 1 87 PRO HG2 4.990 . 4.990 4.764 4.590 4.975 . 0 0 "[ . 1 . 2]" 1
862 1 32 ILE HG13 1 33 ASN H 4.670 . 4.670 3.628 3.493 3.794 . 0 0 "[ . 1 . 2]" 1
863 1 48 ILE H 1 48 ILE HG13 5.080 . 5.080 3.190 3.081 3.282 . 0 0 "[ . 1 . 2]" 1
864 1 46 PHE QE 1 57 LEU HB3 5.280 . 5.280 4.667 4.380 4.939 . 0 0 "[ . 1 . 2]" 1
865 1 75 ARG HG3 1 101 PHE HZ 5.510 . 5.510 4.051 3.534 4.524 . 0 0 "[ . 1 . 2]" 1
866 1 54 LEU H 1 54 LEU HG 4.090 . 4.090 2.335 1.818 3.834 . 0 0 "[ . 1 . 2]" 1
867 1 55 SER H 1 56 LYS HG3 4.920 . 4.920 4.220 4.003 4.539 . 0 0 "[ . 1 . 2]" 1
868 1 83 GLU H 1 83 GLU HB2 4.050 . 4.050 3.594 3.562 3.630 . 0 0 "[ . 1 . 2]" 1
869 1 35 LYS H 1 35 LYS QD 4.820 . 4.820 4.697 4.497 4.806 . 0 0 "[ . 1 . 2]" 1
870 1 35 LYS HB3 1 45 GLN H 5.440 . 5.440 5.364 5.208 5.476 0.036 10 0 "[ . 1 . 2]" 1
871 1 76 PHE QD 1 90 LEU HB2 4.150 . 4.150 3.230 2.873 3.545 . 0 0 "[ . 1 . 2]" 1
872 1 45 GLN HG2 1 46 PHE H 5.140 . 5.140 4.986 4.874 5.069 . 0 0 "[ . 1 . 2]" 1
873 1 75 ARG HG3 1 78 GLY H 4.750 . 4.750 4.574 4.196 4.766 0.016 13 0 "[ . 1 . 2]" 1
874 1 77 ASP HB3 1 78 GLY H 5.030 . 5.030 3.958 3.863 4.241 . 0 0 "[ . 1 . 2]" 1
875 1 68 SER H 1 71 GLN HG3 4.880 . 4.880 4.550 4.325 4.727 . 0 0 "[ . 1 . 2]" 1
876 1 49 LYS HB3 1 51 HIS H 3.800 . 3.800 2.401 2.222 2.825 . 0 0 "[ . 1 . 2]" 1
877 1 83 GLU H 1 83 GLU HG2 4.140 . 4.140 2.197 1.814 3.374 . 0 0 "[ . 1 . 2]" 1
878 1 35 LYS HG3 1 36 VAL H 5.390 . 5.390 5.016 4.960 5.071 . 0 0 "[ . 1 . 2]" 1
879 1 25 LYS H 1 25 LYS QG 4.000 . 4.000 3.606 1.917 4.253 0.253 3 0 "[ . 1 . 2]" 1
880 1 67 LEU HB2 1 68 SER H 4.410 . 4.410 3.700 3.409 3.909 . 0 0 "[ . 1 . 2]" 1
881 1 62 CYS H 1 65 GLN HB2 4.750 . 4.750 4.835 4.721 4.926 0.176 9 0 "[ . 1 . 2]" 1
882 1 52 THR H 1 87 PRO HG3 5.240 . 5.240 4.193 4.027 4.326 . 0 0 "[ . 1 . 2]" 1
883 1 72 ILE HB 1 103 GLN H 4.770 . 4.770 4.308 3.991 4.923 0.153 11 0 "[ . 1 . 2]" 1
884 1 50 ARG H 1 52 THR MG 5.670 . 5.670 5.766 5.204 5.857 0.187 3 0 "[ . 1 . 2]" 1
885 1 18 GLU QG 1 19 LYS H 5.020 . 5.020 4.194 2.424 4.944 . 0 0 "[ . 1 . 2]" 1
886 1 32 ILE HB 1 96 ASP H 5.830 . 5.830 5.424 5.070 5.813 . 0 0 "[ . 1 . 2]" 1
887 1 59 LYS HG3 1 60 ALA H 5.270 . 5.270 4.584 4.290 5.007 . 0 0 "[ . 1 . 2]" 1
888 1 79 GLN HE21 1 90 LEU HB2 5.860 . 5.860 5.126 4.685 5.393 . 0 0 "[ . 1 . 2]" 1
889 1 54 LEU H 1 54 LEU HB2 4.040 . 4.040 3.586 3.538 3.661 . 0 0 "[ . 1 . 2]" 1
890 1 36 VAL H 1 45 GLN HG3 4.870 . 4.870 4.524 4.286 4.730 . 0 0 "[ . 1 . 2]" 1
891 1 67 LEU HB3 1 102 GLN HE22 4.810 . 4.810 4.514 3.769 4.954 0.144 11 0 "[ . 1 . 2]" 1
892 1 60 ALA MB 1 64 ARG H 4.680 . 4.680 4.534 4.443 4.612 . 0 0 "[ . 1 . 2]" 1
893 1 102 GLN H 1 103 GLN QG 6.000 . 6.000 5.001 4.762 5.291 . 0 0 "[ . 1 . 2]" 1
894 1 73 ARG HB3 1 101 PHE HZ 4.940 . 4.940 3.053 2.822 3.345 . 0 0 "[ . 1 . 2]" 1
895 1 74 PHE QE 1 98 ILE HB 4.900 . 4.900 4.685 4.537 4.805 . 0 0 "[ . 1 . 2]" 1
896 1 35 LYS HG3 1 96 ASP H 5.310 . 5.310 4.435 4.148 4.649 . 0 0 "[ . 1 . 2]" 1
897 1 73 ARG HG3 1 103 GLN HE21 5.130 . 5.130 4.231 2.266 5.186 0.056 14 0 "[ . 1 . 2]" 1
898 1 93 GLU HG2 1 95 GLU H 6.000 . 6.000 6.120 6.045 6.194 0.194 8 0 "[ . 1 . 2]" 1
899 1 76 PHE QD 1 77 ASP H 3.450 . 3.450 3.129 2.813 3.217 . 0 0 "[ . 1 . 2]" 1
900 1 76 PHE HZ 1 93 GLU H 3.980 . 3.980 3.879 3.677 4.081 0.101 8 0 "[ . 1 . 2]" 1
901 1 37 ALA H 1 97 THR MG 3.630 . 3.630 3.072 2.715 3.345 . 0 0 "[ . 1 . 2]" 1
902 1 72 ILE MG 1 103 GLN H 5.030 . 5.030 3.467 3.268 3.632 . 0 0 "[ . 1 . 2]" 1
903 1 37 ALA H 1 98 ILE MG 4.270 . 4.270 3.978 3.904 4.082 . 0 0 "[ . 1 . 2]" 1
904 1 54 LEU MD1 1 82 ASN H 5.290 . 5.290 3.862 3.460 4.645 . 0 0 "[ . 1 . 2]" 1
905 1 81 ILE MD 1 82 ASN H 5.000 . 5.000 4.834 4.747 4.948 . 0 0 "[ . 1 . 2]" 1
906 1 36 VAL MG2 1 37 ALA H 4.210 . 4.210 3.248 2.506 4.067 . 0 0 "[ . 1 . 2]" 1
907 1 72 ILE MD 1 101 PHE H 4.920 . 4.920 4.871 4.738 4.952 0.032 18 0 "[ . 1 . 2]" 1
908 1 32 ILE MG 1 33 ASN H 3.690 . 3.690 3.529 3.458 3.583 . 0 0 "[ . 1 . 2]" 1
909 1 37 ALA H 1 98 ILE MD 5.620 . 5.620 5.471 5.375 5.567 . 0 0 "[ . 1 . 2]" 1
910 1 90 LEU MD1 1 92 MET H 4.340 . 4.340 3.825 3.226 3.987 . 0 0 "[ . 1 . 2]" 1
911 1 36 VAL MG2 1 61 TYR H 6.000 . 6.000 5.419 5.036 5.719 . 0 0 "[ . 1 . 2]" 1
912 1 72 ILE MG 1 73 ARG H 3.750 . 3.750 3.626 3.579 3.673 . 0 0 "[ . 1 . 2]" 1
913 1 44 VAL MG1 1 46 PHE QE 3.530 . 3.530 2.802 2.723 2.875 . 0 0 "[ . 1 . 2]" 1
914 1 90 LEU MD1 1 91 GLU H 4.030 . 4.030 3.757 3.282 3.959 . 0 0 "[ . 1 . 2]" 1
915 1 72 ILE H 1 72 ILE MD 3.990 . 3.990 3.983 3.911 4.049 0.059 17 0 "[ . 1 . 2]" 1
916 1 67 LEU MD1 1 102 GLN HE22 4.040 . 4.040 2.320 1.928 3.641 . 0 0 "[ . 1 . 2]" 1
917 1 76 PHE QD 1 90 LEU MD2 3.490 . 3.490 1.938 1.794 2.295 0.006 8 0 "[ . 1 . 2]" 1
918 1 76 PHE QD 1 90 LEU MD1 3.620 . 3.620 3.581 3.217 3.720 0.100 9 0 "[ . 1 . 2]" 1
919 1 76 PHE H 1 81 ILE HG12 3.710 . 3.710 3.306 3.119 3.508 . 0 0 "[ . 1 . 2]" 1
920 1 67 LEU MD2 1 68 SER H 4.880 . 4.880 4.561 4.349 4.624 . 0 0 "[ . 1 . 2]" 1
921 1 36 VAL MG2 1 61 TYR QE 4.500 . 4.500 3.629 2.825 4.565 0.065 17 0 "[ . 1 . 2]" 1
922 1 36 VAL MG2 1 74 PHE QE 4.310 . 4.310 2.316 1.944 2.774 . 0 0 "[ . 1 . 2]" 1
923 1 74 PHE QD 1 81 ILE MG 4.700 . 4.700 4.716 4.626 4.779 0.079 5 0 "[ . 1 . 2]" 1
924 1 36 VAL H 1 44 VAL MG1 5.450 . 5.450 4.809 4.662 4.967 . 0 0 "[ . 1 . 2]" 1
925 1 36 VAL H 1 98 ILE HG12 5.900 . 5.900 4.837 4.723 4.937 . 0 0 "[ . 1 . 2]" 1
926 1 72 ILE MD 1 102 GLN HE22 4.900 . 4.900 4.668 4.267 4.874 . 0 0 "[ . 1 . 2]" 1
927 1 48 ILE MG 1 56 LYS H 5.170 . 5.170 5.121 4.958 5.253 0.083 2 0 "[ . 1 . 2]" 1
928 1 23 GLY H 1 24 VAL QG 4.550 . 4.550 3.828 3.185 4.852 0.302 3 0 "[ . 1 . 2]" 1
929 1 67 LEU H 1 72 ILE MD 4.840 . 4.840 4.606 4.280 4.884 0.044 14 0 "[ . 1 . 2]" 1
930 1 81 ILE MG 1 84 THR H 5.510 . 5.510 5.125 4.981 5.323 . 0 0 "[ . 1 . 2]" 1
931 1 36 VAL H 1 98 ILE MD 6.000 . 6.000 6.008 5.897 6.099 0.099 20 0 "[ . 1 . 2]" 1
932 1 72 ILE MD 1 102 GLN HE21 5.180 . 5.180 4.927 4.505 5.272 0.092 12 0 "[ . 1 . 2]" 1
933 1 75 ARG H 1 98 ILE MD 5.420 . 5.420 4.601 4.467 4.790 . 0 0 "[ . 1 . 2]" 1
934 1 75 ARG H 1 100 VAL MG1 5.450 . 5.450 5.205 5.042 5.394 . 0 0 "[ . 1 . 2]" 1
935 1 32 ILE MD 1 95 GLU H 5.010 . 5.010 4.856 4.594 5.023 0.013 4 0 "[ . 1 . 2]" 1
936 1 31 HIS HB2 1 32 ILE H 4.320 . 4.320 2.786 2.427 4.344 0.024 19 0 "[ . 1 . 2]" 1
937 1 82 ASN HB3 1 83 GLU H 3.820 . 3.820 2.644 2.396 3.052 . 0 0 "[ . 1 . 2]" 1
938 1 69 MET H 1 69 MET HB3 3.860 . 3.860 3.548 3.522 3.568 . 0 0 "[ . 1 . 2]" 1
939 1 33 ASN HA 1 95 GLU H 5.720 . 5.720 4.193 3.995 4.428 . 0 0 "[ . 1 . 2]" 1
940 1 36 VAL H 1 98 ILE H 5.610 . 5.610 4.336 4.266 4.394 . 0 0 "[ . 1 . 2]" 1
941 1 74 PHE H 1 74 PHE QD 3.400 . 3.400 2.147 2.013 2.232 . 0 0 "[ . 1 . 2]" 1
942 1 61 TYR H 1 61 TYR QD 4.110 . 4.110 4.174 4.143 4.209 0.099 7 0 "[ . 1 . 2]" 1
943 1 35 LYS H 1 46 PHE H 5.500 . 5.500 4.883 4.812 4.987 . 0 0 "[ . 1 . 2]" 1
944 1 82 ASN H 1 84 THR H 4.640 . 4.640 4.511 4.199 4.765 0.125 4 0 "[ . 1 . 2]" 1
945 1 36 VAL H 1 46 PHE QE 4.250 . 4.250 3.153 2.815 3.375 . 0 0 "[ . 1 . 2]" 1
946 1 74 PHE H 1 74 PHE QE 4.420 . 4.420 4.387 4.220 4.458 0.038 15 0 "[ . 1 . 2]" 1
947 1 37 ALA H 1 97 THR HA 5.520 . 5.520 4.627 4.289 4.927 . 0 0 "[ . 1 . 2]" 1
948 1 82 ASN H 1 82 ASN HD22 4.250 . 4.250 3.464 3.267 3.664 . 0 0 "[ . 1 . 2]" 1
949 1 81 ILE H 1 82 ASN H 4.650 . 4.650 4.571 4.502 4.620 . 0 0 "[ . 1 . 2]" 1
950 1 82 ASN H 1 82 ASN HD21 4.380 . 4.380 2.664 2.526 2.849 . 0 0 "[ . 1 . 2]" 1
951 1 33 ASN H 1 33 ASN HB3 3.800 . 3.800 2.540 2.419 3.635 . 0 0 "[ . 1 . 2]" 1
952 1 36 VAL H 1 45 GLN H 5.340 . 5.340 5.033 4.977 5.104 . 0 0 "[ . 1 . 2]" 1
953 1 54 LEU H 1 86 THR H 5.900 . 5.900 5.230 5.005 5.528 . 0 0 "[ . 1 . 2]" 1
954 1 36 VAL H 1 44 VAL HA 5.530 . 5.530 4.677 4.634 4.741 . 0 0 "[ . 1 . 2]" 1
955 1 31 HIS HD2 1 48 ILE H 4.400 . 4.400 4.391 3.569 4.527 0.127 18 0 "[ . 1 . 2]" 1
956 1 31 HIS HD2 1 32 ILE H 4.200 . 4.200 3.856 2.887 4.283 0.083 1 0 "[ . 1 . 2]" 1
957 1 69 MET H 1 71 GLN H 4.580 . 4.580 3.888 3.822 3.957 . 0 0 "[ . 1 . 2]" 1
958 1 73 ARG HD2 1 74 PHE H 4.750 . 4.750 3.138 2.818 3.473 . 0 0 "[ . 1 . 2]" 1
959 1 68 SER HB3 1 69 MET H 3.960 . 3.960 2.725 2.581 2.875 . 0 0 "[ . 1 . 2]" 1
960 1 83 GLU H 1 83 GLU HG3 4.140 . 4.140 3.143 1.760 3.673 0.040 15 0 "[ . 1 . 2]" 1
961 1 33 ASN H 1 33 ASN HD21 5.170 . 5.170 4.907 4.616 5.004 . 0 0 "[ . 1 . 2]" 1
962 1 76 PHE H 1 78 GLY H 4.830 . 4.830 3.922 3.776 4.467 . 0 0 "[ . 1 . 2]" 1
963 1 61 TYR H 1 64 ARG HD3 6.000 . 6.000 5.376 4.939 6.092 0.092 14 0 "[ . 1 . 2]" 1
964 1 46 PHE HZ 1 61 TYR H 4.530 . 4.530 3.711 3.563 3.861 . 0 0 "[ . 1 . 2]" 1
965 1 61 TYR H 1 74 PHE HZ 4.900 . 4.900 4.318 4.149 4.475 . 0 0 "[ . 1 . 2]" 1
966 1 39 GLN HA 1 42 SER H 6.000 . 6.000 5.638 5.248 6.020 0.020 3 0 "[ . 1 . 2]" 1
967 1 61 TYR HA 1 74 PHE QE 5.650 . 5.650 5.283 5.064 5.486 . 0 0 "[ . 1 . 2]" 1
968 1 59 LYS HA 1 61 TYR H 4.770 . 4.770 4.188 4.012 4.334 . 0 0 "[ . 1 . 2]" 1
969 1 61 TYR HA 1 61 TYR QE 4.940 . 4.940 4.775 4.708 4.825 . 0 0 "[ . 1 . 2]" 1
970 1 59 LYS HA 1 74 PHE HZ 5.170 . 5.170 4.695 4.532 4.884 . 0 0 "[ . 1 . 2]" 1
971 1 79 GLN HE21 1 80 PRO HD2 6.000 . 6.000 6.048 5.997 6.172 0.172 3 0 "[ . 1 . 2]" 1
972 1 42 SER HB2 1 43 VAL H 4.320 . 4.320 3.950 2.571 4.345 0.025 1 0 "[ . 1 . 2]" 1
973 1 35 LYS H 1 95 GLU HA 5.200 . 5.200 4.161 3.755 4.665 . 0 0 "[ . 1 . 2]" 1
974 1 68 SER HB3 1 71 GLN H 4.220 . 4.220 3.370 3.239 3.489 . 0 0 "[ . 1 . 2]" 1
975 1 56 LYS HA 1 60 ALA H 4.730 . 4.730 4.199 4.015 4.459 . 0 0 "[ . 1 . 2]" 1
976 1 86 THR H 1 87 PRO QD 4.920 . 4.920 4.382 4.320 4.414 . 0 0 "[ . 1 . 2]" 1
977 1 41 GLY H 1 42 SER HB2 5.380 . 5.380 4.764 4.135 5.510 0.130 20 0 "[ . 1 . 2]" 1
978 1 55 SER HA 1 58 MET H 3.790 . 3.790 3.250 3.139 3.378 . 0 0 "[ . 1 . 2]" 1
979 1 55 SER HA 1 59 LYS H 4.260 . 4.260 3.795 3.587 3.946 . 0 0 "[ . 1 . 2]" 1
980 1 59 LYS HA 1 62 CYS H 3.980 . 3.980 3.387 3.285 3.485 . 0 0 "[ . 1 . 2]" 1
981 1 55 SER H 1 87 PRO QD 5.460 . 5.460 4.742 4.363 4.998 . 0 0 "[ . 1 . 2]" 1
982 1 53 PRO HA 1 56 LYS H 5.910 . 5.910 5.076 4.853 5.297 . 0 0 "[ . 1 . 2]" 1
983 1 87 PRO HA 1 91 GLU H 6.000 . 6.000 5.209 4.958 5.527 . 0 0 "[ . 1 . 2]" 1
984 1 91 GLU H 1 92 MET HA 6.000 . 6.000 5.249 5.109 5.353 . 0 0 "[ . 1 . 2]" 1
985 1 54 LEU HA 1 56 LYS H 3.930 . 3.930 3.590 3.488 3.679 . 0 0 "[ . 1 . 2]" 1
986 1 62 CYS HA 1 66 GLY H 4.460 . 4.460 3.897 3.728 4.336 . 0 0 "[ . 1 . 2]" 1
987 1 87 PRO QD 1 88 ALA H 4.750 . 4.750 2.918 2.811 3.066 . 0 0 "[ . 1 . 2]" 1
988 1 27 GLU HA 1 29 ASN H 5.370 . 5.370 4.031 2.909 5.779 0.409 11 0 "[ . 1 . 2]" 1
989 1 38 GLY H 1 41 GLY HA2 5.700 . 5.700 4.711 4.140 5.149 . 0 0 "[ . 1 . 2]" 1
990 1 41 GLY H 1 42 SER HA 5.450 . 5.450 4.907 4.706 5.279 . 0 0 "[ . 1 . 2]" 1
991 1 76 PHE QD 1 78 GLY H 5.200 . 5.200 4.984 4.844 5.308 0.108 18 0 "[ . 1 . 2]" 1
992 1 28 ASN HB3 1 29 ASN H 4.700 . 4.700 4.279 3.119 4.636 . 0 0 "[ . 1 . 2]" 1
993 1 35 LYS H 1 35 LYS HE3 5.150 . 5.150 4.415 3.628 4.677 . 0 0 "[ . 1 . 2]" 1
994 1 77 ASP HB2 1 78 GLY H 4.650 . 4.650 4.371 4.211 4.608 . 0 0 "[ . 1 . 2]" 1
995 1 73 ARG H 1 73 ARG HD2 5.320 . 5.320 5.381 5.277 5.495 0.175 9 0 "[ . 1 . 2]" 1
996 1 31 HIS H 1 31 HIS HB2 3.830 . 3.830 3.800 3.248 3.947 0.117 2 0 "[ . 1 . 2]" 1
997 1 76 PHE HB3 1 79 GLN H 5.860 . 5.860 4.898 4.688 5.065 . 0 0 "[ . 1 . 2]" 1
998 1 76 PHE HB3 1 81 ILE H 6.000 . 6.000 5.581 5.432 5.781 . 0 0 "[ . 1 . 2]" 1
999 1 75 ARG HD3 1 78 GLY H 4.890 . 4.890 2.826 2.319 3.308 . 0 0 "[ . 1 . 2]" 1
1000 1 35 LYS HE3 1 96 ASP H 5.400 . 5.400 5.365 4.241 5.482 0.082 20 0 "[ . 1 . 2]" 1
1001 1 35 LYS HE2 1 97 THR H 6.000 . 6.000 5.672 5.247 6.084 0.084 12 0 "[ . 1 . 2]" 1
1002 1 61 TYR HB3 1 62 CYS H 4.520 . 4.520 2.365 2.305 2.459 . 0 0 "[ . 1 . 2]" 1
1003 1 102 GLN H 1 102 GLN HG2 4.740 . 4.740 4.616 4.390 4.702 . 0 0 "[ . 1 . 2]" 1
1004 1 102 GLN H 1 102 GLN HG3 4.530 . 4.530 4.426 4.256 4.497 . 0 0 "[ . 1 . 2]" 1
1005 1 102 GLN HG3 1 104 GLN H 5.190 . 5.190 2.006 1.790 3.232 0.010 20 0 "[ . 1 . 2]" 1
1006 1 67 LEU H 1 68 SER H 4.570 . 4.570 4.445 4.379 4.551 . 0 0 "[ . 1 . 2]" 1
1007 1 35 LYS H 1 96 ASP H 4.280 . 4.280 3.891 3.681 4.132 . 0 0 "[ . 1 . 2]" 1
1008 1 106 GLY H 1 107 GLY H 4.630 . 4.630 3.370 2.131 4.350 . 0 0 "[ . 1 . 2]" 1
1009 1 62 CYS H 1 74 PHE HZ 4.210 . 4.210 3.142 2.947 3.330 . 0 0 "[ . 1 . 2]" 1
1010 1 44 VAL H 1 46 PHE HZ 4.970 . 4.970 4.987 4.797 5.080 0.110 10 0 "[ . 1 . 2]" 1
1011 1 100 VAL H 1 101 PHE H 4.520 . 4.520 4.437 4.383 4.458 . 0 0 "[ . 1 . 2]" 1
1012 1 68 SER H 1 71 GLN HE21 5.660 . 5.660 5.193 3.781 5.769 0.109 16 0 "[ . 1 . 2]" 1
1013 1 102 GLN H 1 102 GLN HE21 5.320 . 5.320 3.748 3.266 4.938 . 0 0 "[ . 1 . 2]" 1
1014 1 101 PHE HB2 1 102 GLN H 3.480 . 3.480 2.669 2.375 2.836 . 0 0 "[ . 1 . 2]" 1
1015 1 99 ASP QB 1 101 PHE H 5.830 . 5.830 5.526 5.090 5.860 0.030 1 0 "[ . 1 . 2]" 1
1016 1 35 LYS H 1 98 ILE MD 5.390 . 5.390 4.461 4.322 4.609 . 0 0 "[ . 1 . 2]" 1
1017 1 37 ALA H 1 44 VAL H 6.000 . 6.000 5.098 4.993 5.201 . 0 0 "[ . 1 . 2]" 1
1018 1 44 VAL H 1 61 TYR QE 4.330 . 4.330 3.389 3.077 3.593 . 0 0 "[ . 1 . 2]" 1
1019 1 44 VAL H 1 44 VAL MG2 3.290 . 3.290 2.499 2.422 2.613 . 0 0 "[ . 1 . 2]" 1
1020 1 44 VAL MG2 1 45 GLN H 4.180 . 4.180 4.155 4.083 4.202 0.022 6 0 "[ . 1 . 2]" 1
1021 1 68 SER H 1 71 GLN HG2 5.310 . 5.310 3.389 3.192 3.649 . 0 0 "[ . 1 . 2]" 1
1022 1 73 ARG H 1 73 ARG HD3 4.990 . 4.990 4.616 4.416 4.710 . 0 0 "[ . 1 . 2]" 1
1023 1 49 LYS H 1 51 HIS H 4.830 . 4.830 4.840 4.642 4.941 0.111 6 0 "[ . 1 . 2]" 1
1024 1 60 ALA H 1 62 CYS H 4.530 . 4.530 4.392 4.299 4.474 . 0 0 "[ . 1 . 2]" 1
1025 1 62 CYS H 1 74 PHE QE 4.570 . 4.570 4.288 4.131 4.424 . 0 0 "[ . 1 . 2]" 1
1026 1 71 GLN HA 1 103 GLN H 4.210 . 4.210 3.938 3.576 4.275 0.065 15 0 "[ . 1 . 2]" 1
1027 1 102 GLN HG2 1 103 GLN H 4.950 . 4.950 4.542 3.848 4.909 . 0 0 "[ . 1 . 2]" 1
1028 1 17 ASP HA 1 19 LYS H 5.630 . 5.630 4.725 3.462 5.876 0.246 20 0 "[ . 1 . 2]" 1
1029 1 39 GLN QG 1 40 ASP H 4.130 . 4.130 3.860 3.503 4.327 0.197 10 0 "[ . 1 . 2]" 1
1030 1 50 ARG H 1 52 THR H 5.140 . 5.140 3.895 3.823 4.089 . 0 0 "[ . 1 . 2]" 1
1031 1 69 MET QG 1 71 GLN H 5.580 . 5.580 5.577 5.485 5.617 0.037 16 0 "[ . 1 . 2]" 1
1032 1 70 ARG H 1 72 ILE H 4.010 . 4.010 3.988 3.900 4.037 0.027 6 0 "[ . 1 . 2]" 1
1033 1 82 ASN HD22 1 84 THR H 5.470 . 5.470 5.545 5.421 5.643 0.173 4 0 "[ . 1 . 2]" 1
1034 1 82 ASN HD22 1 85 ASP H 5.010 . 5.010 5.306 5.096 5.567 0.557 16 3 "[ . 1- .+ *]" 1
1035 1 33 ASN HA 1 96 ASP H 6.000 . 6.000 6.138 6.056 6.235 0.235 6 0 "[ . 1 . 2]" 1
1036 1 81 ILE H 1 98 ILE MG 5.180 . 5.180 5.222 5.066 5.309 0.129 14 0 "[ . 1 . 2]" 1
1037 1 38 GLY H 1 100 VAL H 5.330 . 5.330 4.995 4.801 5.277 . 0 0 "[ . 1 . 2]" 1
1038 1 74 PHE HA 1 81 ILE H 5.140 . 5.140 4.933 4.844 5.051 . 0 0 "[ . 1 . 2]" 1
1039 1 61 TYR QE 1 65 GLN H 5.850 . 5.850 5.593 5.455 5.674 . 0 0 "[ . 1 . 2]" 1
1040 1 64 ARG HD3 1 65 GLN H 5.150 . 5.150 4.661 4.484 4.878 . 0 0 "[ . 1 . 2]" 1
1041 1 64 ARG HD2 1 65 GLN H 5.140 . 5.140 4.886 4.479 5.061 . 0 0 "[ . 1 . 2]" 1
1042 1 75 ARG HD3 1 101 PHE QE 5.170 . 5.170 4.551 3.857 5.097 . 0 0 "[ . 1 . 2]" 1
1043 1 82 ASN HB3 1 85 ASP H 4.820 . 4.820 4.530 4.264 4.807 . 0 0 "[ . 1 . 2]" 1
1044 1 84 THR H 1 85 ASP HB2 4.210 . 4.210 4.176 4.048 4.301 0.091 19 0 "[ . 1 . 2]" 1
1045 1 61 TYR QD 1 62 CYS HB3 4.850 . 4.850 3.582 2.982 4.472 . 0 0 "[ . 1 . 2]" 1
1046 1 61 TYR QD 1 64 ARG HD3 5.140 . 5.140 4.138 3.661 4.939 . 0 0 "[ . 1 . 2]" 1
1047 1 76 PHE QD 1 77 ASP HB2 4.040 . 4.040 2.428 2.227 2.838 . 0 0 "[ . 1 . 2]" 1
1048 1 64 ARG HD3 1 65 GLN HE22 5.540 . 5.540 4.851 4.212 5.560 0.020 14 0 "[ . 1 . 2]" 1
1049 1 61 TYR QD 1 62 CYS HB2 4.850 . 4.850 4.480 4.366 4.664 . 0 0 "[ . 1 . 2]" 1
1050 1 61 TYR QD 1 64 ARG HD2 5.590 . 5.590 5.012 3.598 5.461 . 0 0 "[ . 1 . 2]" 1
1051 1 46 PHE QE 1 64 ARG HD3 4.870 . 4.870 3.988 3.367 4.410 . 0 0 "[ . 1 . 2]" 1
1052 1 46 PHE HZ 1 64 ARG HD3 5.250 . 5.250 3.765 3.383 4.593 . 0 0 "[ . 1 . 2]" 1
1053 1 61 TYR QE 1 64 ARG HD3 6.000 . 6.000 5.540 5.175 6.200 0.200 16 0 "[ . 1 . 2]" 1
1054 1 50 ARG HE 1 51 HIS HB3 5.000 . 5.000 4.887 4.437 5.203 0.203 8 0 "[ . 1 . 2]" 1
1055 1 39 GLN HE21 1 102 GLN H 6.000 . 6.000 4.894 4.265 5.381 . 0 0 "[ . 1 . 2]" 1
1056 1 38 GLY H 1 39 GLN HE21 6.000 . 6.000 5.111 4.975 5.277 . 0 0 "[ . 1 . 2]" 1
1057 1 76 PHE QD 1 98 ILE MD 4.500 . 4.500 2.286 1.999 2.935 . 0 0 "[ . 1 . 2]" 1
1058 1 54 LEU MD2 1 86 THR H 5.390 . 5.390 4.206 3.838 4.896 . 0 0 "[ . 1 . 2]" 1
1059 1 84 THR MG 1 85 ASP H 4.280 . 4.280 3.997 2.985 4.389 0.109 15 0 "[ . 1 . 2]" 1
1060 1 50 ARG HE 1 88 ALA MB 4.980 . 4.980 4.753 4.189 5.042 0.062 13 0 "[ . 1 . 2]" 1
1061 1 73 ARG H 1 102 GLN HE21 6.000 . 6.000 5.398 4.928 6.080 0.080 5 0 "[ . 1 . 2]" 1
1062 1 76 PHE QD 1 97 THR H 5.360 . 5.360 4.634 4.345 5.010 . 0 0 "[ . 1 . 2]" 1
1063 1 76 PHE HZ 1 97 THR H 5.890 . 5.890 5.388 4.827 5.942 0.052 14 0 "[ . 1 . 2]" 1
1064 1 72 ILE HG13 1 74 PHE HZ 4.830 . 4.830 4.449 4.256 4.641 . 0 0 "[ . 1 . 2]" 1
1065 1 76 PHE QD 1 92 MET ME 3.310 . 3.310 3.043 2.942 3.181 . 0 0 "[ . 1 . 2]" 1
1066 1 76 PHE HZ 1 92 MET ME 3.550 . 3.550 3.151 2.953 3.432 . 0 0 "[ . 1 . 2]" 1
1067 1 68 SER HB3 1 70 ARG HE 5.310 . 5.310 4.943 4.580 5.311 0.001 14 0 "[ . 1 . 2]" 1
1068 1 61 TYR QD 1 62 CYS HA 4.010 . 4.010 2.889 2.766 2.966 . 0 0 "[ . 1 . 2]" 1
1069 1 34 LEU H 1 46 PHE QD 5.170 . 5.170 4.010 3.895 4.164 . 0 0 "[ . 1 . 2]" 1
1070 1 68 SER H 1 71 GLN HE22 6.000 . 6.000 5.912 5.361 6.140 0.140 16 0 "[ . 1 . 2]" 1
1071 1 73 ARG H 1 74 PHE QE 5.330 . 5.330 5.250 5.037 5.375 0.045 11 0 "[ . 1 . 2]" 1
1072 1 45 GLN H 1 46 PHE QE 5.130 . 5.130 4.808 4.692 4.926 . 0 0 "[ . 1 . 2]" 1
1073 1 45 GLN H 1 46 PHE HZ 5.730 . 5.730 5.535 5.389 5.698 . 0 0 "[ . 1 . 2]" 1
1074 1 75 ARG HE 1 76 PHE HA 6.000 . 6.000 5.721 4.608 6.177 0.177 15 0 "[ . 1 . 2]" 1
1075 1 74 PHE HA 1 101 PHE HZ 6.000 . 6.000 5.718 5.412 6.000 0.000 11 0 "[ . 1 . 2]" 1
1076 1 69 MET HB2 1 70 ARG HE 6.000 . 6.000 5.430 3.919 6.081 0.081 20 0 "[ . 1 . 2]" 1
1077 1 44 VAL H 1 61 TYR QD 5.010 . 5.010 3.777 3.588 3.933 . 0 0 "[ . 1 . 2]" 1
1078 1 61 TYR QE 1 74 PHE HZ 4.040 . 4.040 4.075 4.044 4.106 0.066 20 0 "[ . 1 . 2]" 1
1079 1 46 PHE QE 1 57 LEU MD2 4.400 . 4.400 4.177 3.839 4.439 0.039 16 0 "[ . 1 . 2]" 1
1080 1 72 ILE HG12 1 74 PHE QD 6.000 . 6.000 5.091 4.896 5.225 . 0 0 "[ . 1 . 2]" 1
1081 1 61 TYR QD 1 62 CYS H 3.810 . 3.810 2.841 2.704 2.950 . 0 0 "[ . 1 . 2]" 1
1082 1 61 TYR QD 1 63 GLU H 5.090 . 5.090 5.074 4.974 5.151 0.061 16 0 "[ . 1 . 2]" 1
1083 1 61 TYR QD 1 65 GLN HA 6.000 . 6.000 6.099 6.005 6.157 0.157 7 0 "[ . 1 . 2]" 1
1084 1 59 LYS HA 1 61 TYR QD 5.830 . 5.830 5.610 5.473 5.717 . 0 0 "[ . 1 . 2]" 1
1085 1 44 VAL MG2 1 61 TYR QD 3.360 . 3.360 2.146 2.051 2.279 . 0 0 "[ . 1 . 2]" 1
1086 1 69 MET ME 1 74 PHE QE 3.610 . 3.610 2.309 2.052 2.546 . 0 0 "[ . 1 . 2]" 1
1087 1 36 VAL HB 1 61 TYR QE 4.900 . 4.900 4.224 3.158 5.059 0.159 7 0 "[ . 1 . 2]" 1
1088 1 61 TYR QE 1 65 GLN HB3 5.190 . 5.190 4.313 4.177 4.383 . 0 0 "[ . 1 . 2]" 1
1089 1 43 VAL HB 1 61 TYR QE 6.000 . 6.000 5.646 5.257 6.142 0.142 1 0 "[ . 1 . 2]" 1
1090 1 102 GLN HB2 1 102 GLN HE22 5.090 . 5.090 3.456 3.267 4.304 . 0 0 "[ . 1 . 2]" 1
1091 1 82 ASN HD21 1 84 THR HA 6.000 . 6.000 5.951 5.631 6.137 0.137 8 0 "[ . 1 . 2]" 1
1092 1 61 TYR H 1 74 PHE QE 4.950 . 4.950 4.741 4.550 4.875 . 0 0 "[ . 1 . 2]" 1
1093 1 44 VAL HA 1 61 TYR QE 5.360 . 5.360 5.337 5.074 5.467 0.107 20 0 "[ . 1 . 2]" 1
1094 1 72 ILE HG12 1 74 PHE QE 4.850 . 4.850 3.832 3.666 4.049 . 0 0 "[ . 1 . 2]" 1
1095 1 74 PHE QE 1 98 ILE MD 5.680 . 5.680 5.712 5.657 5.754 0.074 12 0 "[ . 1 . 2]" 1
1096 1 65 GLN H 1 65 GLN HE22 5.550 . 5.550 5.001 4.669 5.288 . 0 0 "[ . 1 . 2]" 1
1097 1 61 TYR QE 1 72 ILE HG13 4.970 . 4.970 4.789 4.628 4.909 . 0 0 "[ . 1 . 2]" 1
1098 1 61 TYR QE 1 73 ARG H 6.000 . 6.000 6.063 5.980 6.139 0.139 1 0 "[ . 1 . 2]" 1
1099 1 61 TYR QE 1 62 CYS H 5.210 . 5.210 5.058 4.954 5.142 . 0 0 "[ . 1 . 2]" 1
1100 1 61 TYR QE 1 100 VAL H 6.000 . 6.000 5.971 5.850 6.073 0.073 15 0 "[ . 1 . 2]" 1
1101 1 61 TYR QE 1 72 ILE MG 4.290 . 4.290 3.551 3.259 3.853 . 0 0 "[ . 1 . 2]" 1
1102 1 31 HIS H 1 31 HIS HD2 4.960 . 4.960 4.626 4.263 5.249 0.289 2 0 "[ . 1 . 2]" 1
1103 1 33 ASN HA 1 48 ILE H 4.580 . 4.580 3.443 3.290 3.730 . 0 0 "[ . 1 . 2]" 1
1104 1 75 ARG HA 1 99 ASP H 5.200 . 5.200 4.882 4.707 5.005 . 0 0 "[ . 1 . 2]" 1
1105 1 36 VAL HA 1 99 ASP H 5.540 . 5.540 5.229 5.122 5.321 . 0 0 "[ . 1 . 2]" 1
1106 1 76 PHE H 1 79 GLN HA 5.870 . 5.870 4.803 4.686 4.913 . 0 0 "[ . 1 . 2]" 1
1107 1 32 ILE H 1 33 ASN HA 6.000 . 6.000 4.848 4.748 4.968 . 0 0 "[ . 1 . 2]" 1
1108 1 33 ASN HA 1 46 PHE H 6.000 . 6.000 4.234 4.091 4.376 . 0 0 "[ . 1 . 2]" 1
1109 1 76 PHE HA 1 78 GLY H 4.440 . 4.440 3.274 3.146 3.670 . 0 0 "[ . 1 . 2]" 1
1110 1 75 ARG HA 1 78 GLY H 5.550 . 5.550 5.596 5.424 5.870 0.320 18 0 "[ . 1 . 2]" 1
1111 1 50 ARG HA 1 88 ALA H 4.210 . 4.210 3.911 3.720 4.062 . 0 0 "[ . 1 . 2]" 1
1112 1 23 GLY H 1 24 VAL HA 5.330 . 5.330 4.796 4.047 5.326 . 0 0 "[ . 1 . 2]" 1
1113 1 50 ARG H 1 52 THR HB 5.570 . 5.570 4.635 4.503 5.208 . 0 0 "[ . 1 . 2]" 1
1114 1 74 PHE HA 1 101 PHE H 4.250 . 4.250 4.106 3.985 4.223 . 0 0 "[ . 1 . 2]" 1
1115 1 42 SER H 1 43 VAL HA 5.690 . 5.690 5.151 4.896 5.396 . 0 0 "[ . 1 . 2]" 1
1116 1 30 ASP HA 1 31 HIS H 3.050 . 3.050 2.486 2.071 3.254 0.204 9 0 "[ . 1 . 2]" 1
1117 1 22 GLU HA 1 23 GLY H 2.650 . 2.650 2.435 2.128 2.977 0.327 9 0 "[ . 1 . 2]" 1
1118 1 73 ARG H 1 73 ARG HA 2.920 . 2.920 2.875 2.835 2.895 . 0 0 "[ . 1 . 2]" 1
1119 1 49 LYS H 1 52 THR HB 3.500 . 3.500 2.396 2.195 2.913 . 0 0 "[ . 1 . 2]" 1
1120 1 68 SER HB3 1 70 ARG H 3.510 . 3.510 2.679 2.553 2.783 . 0 0 "[ . 1 . 2]" 1
1121 1 105 THR HA 1 106 GLY H 3.480 . 3.480 2.381 2.136 3.551 0.071 13 0 "[ . 1 . 2]" 1
1122 1 26 THR H 1 26 THR HB 3.700 . 3.700 3.166 2.537 3.637 . 0 0 "[ . 1 . 2]" 1
1123 1 42 SER H 1 42 SER HB2 3.710 . 3.710 2.766 2.322 3.693 . 0 0 "[ . 1 . 2]" 1
1124 1 60 ALA HA 1 62 CYS H 4.780 . 4.780 4.693 4.635 4.769 . 0 0 "[ . 1 . 2]" 1
1125 1 63 GLU HA 1 67 LEU H 4.840 . 4.840 4.248 3.982 4.910 0.070 12 0 "[ . 1 . 2]" 1
1126 1 98 ILE HA 1 99 ASP HA 6.000 . 6.000 4.399 4.372 4.424 . 0 0 "[ . 1 . 2]" 1
1127 1 32 ILE HG13 1 33 ASN HA 5.530 . 5.530 4.212 4.034 4.293 . 0 0 "[ . 1 . 2]" 1
1128 1 97 THR HA 1 97 THR MG 3.220 . 3.220 2.329 2.274 2.393 . 0 0 "[ . 1 . 2]" 1
1129 1 76 PHE HA 1 81 ILE MD 4.690 . 4.690 3.774 3.674 3.865 . 0 0 "[ . 1 . 2]" 1
1130 1 97 THR HA 1 98 ILE MD 5.060 . 5.060 4.476 4.218 4.713 . 0 0 "[ . 1 . 2]" 1
1131 1 33 ASN HA 1 34 LEU MD1 4.980 . 4.980 4.492 4.389 4.652 . 0 0 "[ . 1 . 2]" 1
1132 1 54 LEU MD1 1 86 THR HA 4.500 . 4.500 3.941 2.315 4.414 . 0 0 "[ . 1 . 2]" 1
1133 1 32 ILE MD 1 33 ASN HA 5.830 . 5.830 5.186 5.008 5.287 . 0 0 "[ . 1 . 2]" 1
1134 1 76 PHE HA 1 76 PHE QD 2.990 . 2.990 2.774 2.357 2.909 . 0 0 "[ . 1 . 2]" 1
1135 1 31 HIS HD2 1 33 ASN HA 5.280 . 5.280 5.029 4.522 5.285 0.005 17 0 "[ . 1 . 2]" 1
1136 1 75 ARG HA 1 75 ARG HD2 4.360 . 4.360 4.276 3.592 4.526 0.166 2 0 "[ . 1 . 2]" 1
1137 1 33 ASN HA 1 94 ASP QB 5.600 . 5.600 4.342 4.081 5.152 . 0 0 "[ . 1 . 2]" 1
1138 1 74 PHE HB3 1 75 ARG HA 5.410 . 5.410 4.444 4.340 4.492 . 0 0 "[ . 1 . 2]" 1
1139 1 35 LYS HE3 1 97 THR HA 4.980 . 4.980 3.945 3.578 4.158 . 0 0 "[ . 1 . 2]" 1
1140 1 75 ARG HA 1 76 PHE HB3 4.840 . 4.840 4.500 4.378 4.591 . 0 0 "[ . 1 . 2]" 1
1141 1 75 ARG HD3 1 76 PHE HA 5.310 . 5.310 3.654 2.756 4.146 . 0 0 "[ . 1 . 2]" 1
1142 1 75 ARG HA 1 75 ARG HD3 4.600 . 4.600 4.376 3.910 4.759 0.159 15 0 "[ . 1 . 2]" 1
1143 1 37 ALA HA 1 43 VAL MG2 4.010 . 4.010 2.998 2.083 3.306 . 0 0 "[ . 1 . 2]" 1
1144 1 74 PHE HA 1 98 ILE MG 3.540 . 3.540 3.078 2.943 3.186 . 0 0 "[ . 1 . 2]" 1
1145 1 76 PHE HA 1 79 GLN H 4.890 . 4.890 4.577 4.251 4.818 . 0 0 "[ . 1 . 2]" 1
1146 1 75 ARG HA 1 79 GLN H 5.560 . 5.560 5.068 4.591 5.384 . 0 0 "[ . 1 . 2]" 1
1147 1 37 ALA HA 1 38 GLY HA3 4.530 . 4.530 4.346 4.327 4.364 . 0 0 "[ . 1 . 2]" 1
1148 1 74 PHE HA 1 101 PHE QE 4.730 . 4.730 4.549 4.331 4.747 0.017 13 0 "[ . 1 . 2]" 1
1149 1 74 PHE HA 1 74 PHE QD 3.480 . 3.480 3.173 3.138 3.213 . 0 0 "[ . 1 . 2]" 1
1150 1 74 PHE HA 1 74 PHE QE 4.760 . 4.760 4.738 4.688 4.779 0.019 14 0 "[ . 1 . 2]" 1
1151 1 45 GLN HA 1 46 PHE HZ 5.740 . 5.740 5.816 5.760 5.853 0.113 13 0 "[ . 1 . 2]" 1
1152 1 45 GLN HA 1 46 PHE QE 4.070 . 4.070 4.129 4.080 4.176 0.106 17 0 "[ . 1 . 2]" 1
1153 1 74 PHE HA 1 74 PHE HZ 6.000 . 6.000 6.009 5.948 6.059 0.059 14 0 "[ . 1 . 2]" 1
1154 1 45 GLN HA 1 45 GLN HG3 3.880 . 3.880 2.531 2.476 2.592 . 0 0 "[ . 1 . 2]" 1
1155 1 45 GLN HA 1 45 GLN HG2 3.840 . 3.840 3.640 3.595 3.678 . 0 0 "[ . 1 . 2]" 1
1156 1 75 ARG HA 1 80 PRO HB2 5.100 . 5.100 4.924 4.771 5.162 0.062 14 0 "[ . 1 . 2]" 1
1157 1 44 VAL HA 1 45 GLN HA 5.000 . 5.000 4.373 4.344 4.386 . 0 0 "[ . 1 . 2]" 1
1158 1 45 GLN HA 1 45 GLN HE22 5.120 . 5.120 4.963 4.885 5.029 . 0 0 "[ . 1 . 2]" 1
1159 1 77 ASP HA 1 79 GLN H 4.530 . 4.530 4.270 4.115 4.377 . 0 0 "[ . 1 . 2]" 1
1160 1 64 ARG HA 1 66 GLY H 4.800 . 4.800 4.091 3.847 4.185 . 0 0 "[ . 1 . 2]" 1
1161 1 51 HIS H 1 52 THR HB 4.370 . 4.370 3.654 3.562 3.796 . 0 0 "[ . 1 . 2]" 1
1162 1 90 LEU HA 1 92 MET H 4.950 . 4.950 4.723 4.541 4.977 0.027 5 0 "[ . 1 . 2]" 1
1163 1 76 PHE QD 1 98 ILE HA 3.490 . 3.490 2.756 2.524 3.084 . 0 0 "[ . 1 . 2]" 1
1164 1 76 PHE HZ 1 92 MET HA 3.390 . 3.390 3.009 2.843 3.305 . 0 0 "[ . 1 . 2]" 1
1165 1 76 PHE QE 1 77 ASP HA 5.120 . 5.120 4.677 4.568 4.790 . 0 0 "[ . 1 . 2]" 1
1166 1 34 LEU HA 1 95 GLU HA 4.690 . 4.690 3.938 3.462 4.403 . 0 0 "[ . 1 . 2]" 1
1167 1 34 LEU HA 1 35 LYS HE3 6.000 . 6.000 5.849 4.843 6.046 0.046 2 0 "[ . 1 . 2]" 1
1168 1 85 ASP HB2 1 86 THR HA 6.000 . 6.000 5.410 5.127 5.778 . 0 0 "[ . 1 . 2]" 1
1169 1 32 ILE MD 1 34 LEU HA 5.120 . 5.120 4.701 4.598 4.780 . 0 0 "[ . 1 . 2]" 1
1170 1 43 VAL HA 1 45 GLN HE22 5.670 . 5.670 5.427 5.323 5.664 . 0 0 "[ . 1 . 2]" 1
1171 1 53 PRO HA 1 86 THR HA 4.450 . 4.450 2.784 2.433 3.098 . 0 0 "[ . 1 . 2]" 1
1172 1 85 ASP HB3 1 86 THR HA 5.500 . 5.500 4.329 4.025 4.559 . 0 0 "[ . 1 . 2]" 1
1173 1 86 THR HA 1 89 GLN QG 6.000 . 6.000 5.334 4.300 6.129 0.129 13 0 "[ . 1 . 2]" 1
1174 1 73 ARG HA 1 74 PHE QD 3.320 . 3.320 2.935 2.757 3.114 . 0 0 "[ . 1 . 2]" 1
1175 1 61 TYR HA 1 61 TYR QD 3.130 . 3.130 2.973 2.916 3.060 . 0 0 "[ . 1 . 2]" 1
1176 1 44 VAL HA 1 61 TYR QD 5.020 . 5.020 5.044 4.904 5.129 0.109 12 0 "[ . 1 . 2]" 1
1177 1 68 SER HB3 1 71 GLN HE22 5.370 . 5.370 4.602 3.739 4.993 . 0 0 "[ . 1 . 2]" 1
1178 1 75 ARG HD3 1 78 GLY HA3 4.850 . 4.850 4.414 3.309 4.940 0.090 7 0 "[ . 1 . 2]" 1
1179 1 55 SER HA 1 58 MET HA 5.060 . 5.060 5.033 4.915 5.173 0.113 16 0 "[ . 1 . 2]" 1
1180 1 61 TYR HA 1 64 ARG HD2 3.830 . 3.830 3.180 2.109 3.545 . 0 0 "[ . 1 . 2]" 1
1181 1 59 LYS HA 1 59 LYS QE 4.190 . 4.190 3.800 2.366 4.375 0.185 15 0 "[ . 1 . 2]" 1
1182 1 70 ARG HA 1 70 ARG QD 3.790 . 3.790 3.823 3.767 3.884 0.094 9 0 "[ . 1 . 2]" 1
1183 1 61 TYR HA 1 64 ARG HD3 3.750 . 3.750 2.992 2.559 3.777 0.027 16 0 "[ . 1 . 2]" 1
1184 1 69 MET HA 1 69 MET QG 3.680 . 3.680 2.676 2.626 2.744 . 0 0 "[ . 1 . 2]" 1
1185 1 15 MET HA 1 15 MET HG3 4.250 . 4.250 3.512 2.571 4.263 0.013 16 0 "[ . 1 . 2]" 1
1186 1 60 ALA HA 1 61 TYR HB3 5.960 . 5.960 5.699 5.671 5.734 . 0 0 "[ . 1 . 2]" 1
1187 1 61 TYR HB3 1 62 CYS HA 5.410 . 5.410 4.307 4.273 4.364 . 0 0 "[ . 1 . 2]" 1
1188 1 60 ALA HA 1 64 ARG HD2 5.530 . 5.530 5.218 4.820 5.586 0.056 16 0 "[ . 1 . 2]" 1
1189 1 42 SER HA 1 43 VAL HA 5.150 . 5.150 4.449 4.381 4.507 . 0 0 "[ . 1 . 2]" 1
1190 1 43 VAL HA 1 44 VAL HA 5.710 . 5.710 4.395 4.360 4.436 . 0 0 "[ . 1 . 2]" 1
1191 1 72 ILE HA 1 103 GLN HA 5.860 . 5.860 4.706 4.457 4.973 . 0 0 "[ . 1 . 2]" 1
1192 1 79 GLN HA 1 79 GLN HG3 3.990 . 3.990 3.773 3.671 3.853 . 0 0 "[ . 1 . 2]" 1
1193 1 73 ARG HA 1 73 ARG HD2 3.430 . 3.430 2.971 2.808 3.155 . 0 0 "[ . 1 . 2]" 1
1194 1 69 MET HA 1 72 ILE MG 4.850 . 4.850 4.853 4.767 4.911 0.061 8 0 "[ . 1 . 2]" 1
1195 1 32 ILE HA 1 33 ASN HA 5.010 . 5.010 4.386 4.347 4.412 . 0 0 "[ . 1 . 2]" 1
1196 1 44 VAL HA 1 45 GLN HE22 3.950 . 3.950 2.861 2.752 2.933 . 0 0 "[ . 1 . 2]" 1
1197 1 52 THR H 1 87 PRO QD 4.000 . 4.000 3.898 3.653 4.075 0.075 9 0 "[ . 1 . 2]" 1
1198 1 87 PRO HA 1 90 LEU H 4.060 . 4.060 3.744 3.571 3.986 . 0 0 "[ . 1 . 2]" 1
1199 1 37 ALA HA 1 38 GLY HA2 5.200 . 5.200 4.368 4.352 4.401 . 0 0 "[ . 1 . 2]" 1
1200 1 38 GLY HA2 1 100 VAL MG2 5.860 . 5.860 3.591 3.342 3.789 . 0 0 "[ . 1 . 2]" 1
1201 1 71 GLN HA 1 71 GLN HE21 4.490 . 4.490 2.651 2.017 4.099 . 0 0 "[ . 1 . 2]" 1
1202 1 84 THR H 1 84 THR HB 4.090 . 4.090 3.383 2.785 3.599 . 0 0 "[ . 1 . 2]" 1
1203 1 71 GLN HA 1 71 GLN HE22 4.730 . 4.730 3.648 3.421 4.176 . 0 0 "[ . 1 . 2]" 1
1204 1 70 ARG HA 1 71 GLN HE22 5.840 . 5.840 5.145 4.899 5.527 . 0 0 "[ . 1 . 2]" 1
1205 1 71 GLN HE22 1 104 GLN HA 6.000 . 6.000 4.690 3.513 6.073 0.073 3 0 "[ . 1 . 2]" 1
1206 1 71 GLN HA 1 104 GLN H 4.210 . 4.210 3.678 3.054 4.265 0.055 5 0 "[ . 1 . 2]" 1
1207 1 54 LEU MD1 1 81 ILE HA 5.760 . 5.760 4.638 4.487 5.194 . 0 0 "[ . 1 . 2]" 1
1208 1 65 GLN HA 1 65 GLN HE22 4.160 . 4.160 3.081 2.978 3.234 . 0 0 "[ . 1 . 2]" 1
1209 1 103 GLN HA 1 104 GLN H 3.150 . 3.150 3.007 2.909 3.127 . 0 0 "[ . 1 . 2]" 1
1210 1 46 PHE QE 1 61 TYR HA 4.110 . 4.110 3.765 3.318 4.096 . 0 0 "[ . 1 . 2]" 1
1211 1 44 VAL HA 1 46 PHE QE 4.960 . 4.960 4.845 4.763 4.950 . 0 0 "[ . 1 . 2]" 1
1212 1 75 ARG HE 1 78 GLY HA3 5.400 . 5.400 4.230 3.300 5.713 0.313 13 0 "[ . 1 . 2]" 1
1213 1 61 TYR QE 1 65 GLN HA 5.910 . 5.910 5.928 5.700 6.040 0.130 7 0 "[ . 1 . 2]" 1
1214 1 69 MET HA 1 73 ARG HD3 5.900 . 5.900 5.145 4.620 5.736 . 0 0 "[ . 1 . 2]" 1
1215 1 44 VAL HA 1 44 VAL MG2 3.010 . 3.010 2.544 2.507 2.572 . 0 0 "[ . 1 . 2]" 1
1216 1 69 MET HA 1 74 PHE QE 5.090 . 5.090 3.908 3.778 4.088 . 0 0 "[ . 1 . 2]" 1
1217 1 103 GLN HA 1 103 GLN HE21 5.330 . 5.330 3.602 2.273 4.692 . 0 0 "[ . 1 . 2]" 1
1218 1 77 ASP HA 1 78 GLY H 3.560 . 3.560 2.982 2.784 3.020 . 0 0 "[ . 1 . 2]" 1
1219 1 44 VAL MG2 1 61 TYR HA 4.270 . 4.270 3.061 2.898 3.306 . 0 0 "[ . 1 . 2]" 1
1220 1 35 LYS HE2 1 95 GLU HA 4.380 . 4.380 2.346 1.927 3.323 . 0 0 "[ . 1 . 2]" 1
1221 1 61 TYR HA 1 65 GLN HE21 5.760 . 5.760 4.995 4.529 5.404 . 0 0 "[ . 1 . 2]" 1
1222 1 64 ARG HA 1 65 GLN HE21 6.000 . 6.000 4.843 4.461 5.364 . 0 0 "[ . 1 . 2]" 1
1223 1 42 SER HB3 1 43 VAL H 4.320 . 4.320 3.685 2.897 4.215 . 0 0 "[ . 1 . 2]" 1
1224 1 76 PHE HA 1 77 ASP HA 4.430 . 4.430 4.427 4.368 4.463 0.033 20 0 "[ . 1 . 2]" 1
1225 1 55 SER HA 1 83 GLU H 6.000 . 6.000 5.780 5.455 6.025 0.025 3 0 "[ . 1 . 2]" 1
1226 1 33 ASN H 1 95 GLU HA 5.830 . 5.830 5.204 4.861 5.533 . 0 0 "[ . 1 . 2]" 1
1227 1 65 GLN HE21 1 66 GLY QA 5.940 . 5.940 6.038 5.982 6.171 0.231 14 0 "[ . 1 . 2]" 1
1228 1 63 GLU HA 1 66 GLY QA 4.750 . 4.750 4.312 4.183 4.545 . 0 0 "[ . 1 . 2]" 1
1229 1 94 ASP QB 1 95 GLU HA 4.430 . 4.430 4.388 4.286 4.467 0.037 5 0 "[ . 1 . 2]" 1
1230 1 62 CYS HA 1 74 PHE QE 5.350 . 5.350 5.246 5.078 5.361 0.011 10 0 "[ . 1 . 2]" 1
1231 1 38 GLY HA3 1 61 TYR QE 4.820 . 4.820 3.984 3.780 4.295 . 0 0 "[ . 1 . 2]" 1
1232 1 61 TYR QE 1 62 CYS HA 5.060 . 5.060 4.020 3.884 4.094 . 0 0 "[ . 1 . 2]" 1
1233 1 61 TYR HB2 1 62 CYS HA 5.620 . 5.620 5.525 5.499 5.564 . 0 0 "[ . 1 . 2]" 1
1234 1 75 ARG HB2 1 101 PHE QE 3.710 . 3.710 1.894 1.828 2.013 . 0 0 "[ . 1 . 2]" 1
1235 1 75 ARG HG3 1 101 PHE QE 3.770 . 3.770 3.181 2.665 3.527 . 0 0 "[ . 1 . 2]" 1
1236 1 99 ASP QB 1 101 PHE QE 4.040 . 4.040 3.826 3.540 4.074 0.034 11 0 "[ . 1 . 2]" 1
1237 1 46 PHE QD 1 57 LEU HA 4.610 . 4.610 3.469 3.314 3.612 . 0 0 "[ . 1 . 2]" 1
1238 1 74 PHE QD 1 98 ILE MG 2.970 . 2.970 1.888 1.811 2.028 . 0 0 "[ . 1 . 2]" 1
1239 1 73 ARG HB2 1 101 PHE QE 4.100 . 4.100 2.760 2.565 2.982 . 0 0 "[ . 1 . 2]" 1
1240 1 75 ARG HB3 1 101 PHE QE 4.220 . 4.220 2.118 1.900 2.487 . 0 0 "[ . 1 . 2]" 1
1241 1 72 ILE HG13 1 74 PHE QD 4.020 . 4.020 3.644 3.486 3.788 . 0 0 "[ . 1 . 2]" 1
1242 1 56 LYS HB2 1 57 LEU H 3.700 . 3.700 2.470 2.279 2.670 . 0 0 "[ . 1 . 2]" 1
1243 1 74 PHE QD 1 100 VAL MG1 4.740 . 4.740 4.040 3.813 4.248 . 0 0 "[ . 1 . 2]" 1
1244 1 61 TYR QD 1 65 GLN QG 3.430 . 3.430 3.191 3.070 3.347 . 0 0 "[ . 1 . 2]" 1
1245 1 74 PHE QD 1 98 ILE HB 3.570 . 3.570 3.557 3.428 3.645 0.075 2 0 "[ . 1 . 2]" 1
1246 1 27 GLU QB 1 28 ASN HD21 4.520 . 4.520 4.002 3.109 4.802 0.282 10 0 "[ . 1 . 2]" 1
1247 1 75 ARG HG2 1 101 PHE QE 4.740 . 4.740 4.166 3.874 4.426 . 0 0 "[ . 1 . 2]" 1
1248 1 50 ARG HA 1 52 THR H 4.940 . 4.940 3.700 3.458 3.857 . 0 0 "[ . 1 . 2]" 1
1249 1 50 ARG HA 1 50 ARG HD3 5.710 . 5.710 4.729 4.451 4.897 . 0 0 "[ . 1 . 2]" 1
1250 1 57 LEU HA 1 58 MET HA 6.000 . 6.000 4.764 4.750 4.823 . 0 0 "[ . 1 . 2]" 1
1251 1 57 LEU HA 1 61 TYR HB2 6.000 . 6.000 5.102 5.017 5.173 . 0 0 "[ . 1 . 2]" 1
1252 1 57 LEU HA 1 61 TYR HB3 6.000 . 6.000 5.742 5.659 5.796 . 0 0 "[ . 1 . 2]" 1
1253 1 50 ARG HA 1 50 ARG HE 6.000 . 6.000 5.851 5.587 6.014 0.014 20 0 "[ . 1 . 2]" 1
1254 1 46 PHE HZ 1 57 LEU HA 5.120 . 5.120 4.657 4.190 5.129 0.009 16 0 "[ . 1 . 2]" 1
1255 1 46 PHE QE 1 57 LEU HA 4.270 . 4.270 3.478 3.240 3.710 . 0 0 "[ . 1 . 2]" 1
1256 1 57 LEU HA 1 60 ALA HA 5.290 . 5.290 5.085 4.945 5.209 . 0 0 "[ . 1 . 2]" 1
1257 1 59 LYS HA 1 69 MET QG 4.390 . 4.390 3.710 3.559 3.916 . 0 0 "[ . 1 . 2]" 1
1258 1 63 GLU HA 1 63 GLU HG3 3.640 . 3.640 3.201 2.882 3.774 0.134 20 0 "[ . 1 . 2]" 1
1259 1 76 PHE HB3 1 77 ASP HA 5.600 . 5.600 5.547 5.481 5.602 0.002 15 0 "[ . 1 . 2]" 1
1260 1 56 LYS HA 1 56 LYS HG3 3.280 . 3.280 3.174 2.966 3.358 0.078 12 0 "[ . 1 . 2]" 1
1261 1 68 SER HB3 1 69 MET QG 5.300 . 5.300 5.142 4.965 5.305 0.005 17 0 "[ . 1 . 2]" 1
1262 1 63 GLU HA 1 63 GLU HG2 3.210 . 3.210 2.563 2.369 3.073 . 0 0 "[ . 1 . 2]" 1
1263 1 89 GLN HA 1 89 GLN QG 3.040 . 3.040 2.678 2.437 2.925 . 0 0 "[ . 1 . 2]" 1
1264 1 77 ASP HA 1 78 GLY HA2 4.980 . 4.980 4.787 4.750 4.842 . 0 0 "[ . 1 . 2]" 1
1265 1 52 THR MG 1 53 PRO HD2 3.300 . 3.300 2.153 2.013 2.751 . 0 0 "[ . 1 . 2]" 1
1266 1 50 ARG HB2 1 88 ALA HA 4.390 . 4.390 3.520 3.098 4.061 . 0 0 "[ . 1 . 2]" 1
1267 1 88 ALA HA 1 92 MET HG2 4.990 . 4.990 4.151 3.886 4.419 . 0 0 "[ . 1 . 2]" 1
1268 1 35 LYS HG3 1 95 GLU HA 4.670 . 4.670 2.496 2.080 2.862 . 0 0 "[ . 1 . 2]" 1
1269 1 61 TYR HA 1 64 ARG QG 3.120 . 3.120 2.236 2.165 2.359 . 0 0 "[ . 1 . 2]" 1
1270 1 33 ASN HB2 1 95 GLU HA 5.260 . 5.260 4.860 3.365 5.325 0.065 4 0 "[ . 1 . 2]" 1
1271 1 88 ALA MB 1 89 GLN HA 3.980 . 3.980 3.929 3.861 3.981 0.001 9 0 "[ . 1 . 2]" 1
1272 1 83 GLU HA 1 83 GLU HG3 4.250 . 4.250 3.844 3.616 4.274 0.024 6 0 "[ . 1 . 2]" 1
1273 1 58 MET QB 1 59 LYS HA 4.320 . 4.320 3.877 3.821 3.946 . 0 0 "[ . 1 . 2]" 1
1274 1 59 LYS HA 1 59 LYS QD 4.550 . 4.550 3.587 2.058 4.183 . 0 0 "[ . 1 . 2]" 1
1275 1 83 GLU HA 1 83 GLU HB3 3.000 . 3.000 2.419 2.326 2.479 . 0 0 "[ . 1 . 2]" 1
1276 1 32 ILE MD 1 87 PRO HA 4.710 . 4.710 4.381 4.005 4.732 0.022 6 0 "[ . 1 . 2]" 1
1277 1 68 SER HB2 1 71 GLN HG2 3.890 . 3.890 3.052 2.921 3.135 . 0 0 "[ . 1 . 2]" 1
1278 1 48 ILE MD 1 54 LEU HA 3.550 . 3.550 2.250 2.130 2.463 . 0 0 "[ . 1 . 2]" 1
1279 1 58 MET HA 1 59 LYS HA 4.990 . 4.990 4.691 4.658 4.753 . 0 0 "[ . 1 . 2]" 1
1280 1 62 CYS HA 1 65 GLN HB2 3.430 . 3.430 2.716 2.518 2.923 . 0 0 "[ . 1 . 2]" 1
1281 1 49 LYS QD 1 52 THR HB 4.280 . 4.280 3.988 3.079 4.524 0.244 9 0 "[ . 1 . 2]" 1
1282 1 68 SER HB3 1 71 GLN HG2 4.750 . 4.750 4.738 4.508 4.832 0.082 2 0 "[ . 1 . 2]" 1
1283 1 69 MET HA 1 72 ILE HG13 4.300 . 4.300 3.667 3.451 3.824 . 0 0 "[ . 1 . 2]" 1
1284 1 51 HIS HB2 1 52 THR HB 6.000 . 6.000 6.029 5.722 6.125 0.125 15 0 "[ . 1 . 2]" 1
1285 1 51 HIS HB3 1 52 THR HB 4.860 . 4.860 4.901 4.383 5.007 0.147 8 0 "[ . 1 . 2]" 1
1286 1 66 GLY QA 1 67 LEU MD1 5.020 . 5.020 4.242 3.281 4.459 . 0 0 "[ . 1 . 2]" 1
1287 1 64 ARG HD3 1 65 GLN HA 6.000 . 6.000 5.599 5.397 5.832 . 0 0 "[ . 1 . 2]" 1
1288 1 24 VAL QG 1 26 THR HA 5.490 . 5.490 4.853 4.074 5.869 0.379 5 0 "[ . 1 . 2]" 1
1289 1 60 ALA HA 1 61 TYR HB2 6.000 . 6.000 5.922 5.886 5.954 . 0 0 "[ . 1 . 2]" 1
1290 1 87 PRO QD 1 92 MET ME 5.830 . 5.830 5.428 5.164 5.687 . 0 0 "[ . 1 . 2]" 1
1291 1 75 ARG HD2 1 78 GLY HA2 4.770 . 4.770 4.059 3.348 4.354 . 0 0 "[ . 1 . 2]" 1
1292 1 77 ASP HB2 1 78 GLY HA2 6.000 . 6.000 6.334 6.167 6.441 0.441 18 0 "[ . 1 . 2]" 1
1293 1 75 ARG HG2 1 78 GLY HA2 5.520 . 5.520 3.614 3.264 4.023 . 0 0 "[ . 1 . 2]" 1
1294 1 61 TYR H 1 64 ARG HD2 5.100 . 5.100 4.991 4.382 5.251 0.151 11 0 "[ . 1 . 2]" 1
1295 1 17 ASP H 1 17 ASP HB3 3.640 . 3.640 3.151 2.458 3.686 0.046 16 0 "[ . 1 . 2]" 1
1296 1 19 LYS H 1 19 LYS QB 3.200 . 3.200 2.841 2.239 3.376 0.176 17 0 "[ . 1 . 2]" 1
1297 1 105 THR MG 1 106 GLY H 4.500 . 4.500 3.401 2.385 4.113 . 0 0 "[ . 1 . 2]" 1
1298 1 40 ASP H 1 40 ASP HB3 3.630 . 3.630 2.821 2.255 3.614 . 0 0 "[ . 1 . 2]" 1
1299 1 21 LYS QG 1 22 GLU H 4.250 . 4.250 3.340 2.312 4.150 . 0 0 "[ . 1 . 2]" 1
1300 1 49 LYS H 1 49 LYS HG2 4.070 . 4.070 3.875 3.324 4.131 0.061 1 0 "[ . 1 . 2]" 1
1301 1 20 PRO HB2 1 22 GLU H 3.260 . 3.260 2.320 1.970 2.958 . 0 0 "[ . 1 . 2]" 1
1302 1 48 ILE HB 1 49 LYS H 3.160 . 3.160 2.329 2.116 2.448 . 0 0 "[ . 1 . 2]" 1
1303 1 21 LYS H 1 21 LYS QG 3.450 . 3.450 2.387 1.746 3.560 0.110 12 0 "[ . 1 . 2]" 1
1304 1 67 LEU HB3 1 68 SER H 3.840 . 3.840 2.358 2.081 2.546 . 0 0 "[ . 1 . 2]" 1
1305 1 49 LYS H 1 49 LYS HG3 4.070 . 4.070 2.903 2.204 3.817 . 0 0 "[ . 1 . 2]" 1
1306 1 40 ASP H 1 40 ASP HB2 3.630 . 3.630 2.879 2.243 3.648 0.018 7 0 "[ . 1 . 2]" 1
1307 1 87 PRO HB2 1 88 ALA H 3.270 . 3.270 3.227 3.122 3.287 0.017 5 0 "[ . 1 . 2]" 1
1308 1 27 GLU H 1 27 GLU QG 3.630 . 3.630 2.667 1.844 3.674 0.044 12 0 "[ . 1 . 2]" 1
1309 1 68 SER H 1 71 GLN HB3 3.780 . 3.780 2.879 2.734 3.017 . 0 0 "[ . 1 . 2]" 1
1310 1 20 PRO QG 1 22 GLU H 3.740 . 3.740 3.161 2.051 3.910 0.170 10 0 "[ . 1 . 2]" 1
1311 1 93 GLU HG3 1 94 ASP H 3.820 . 3.820 3.496 3.060 3.780 . 0 0 "[ . 1 . 2]" 1
1312 1 63 GLU H 1 63 GLU HB2 3.360 . 3.360 2.395 2.326 2.512 . 0 0 "[ . 1 . 2]" 1
1313 1 20 PRO HB2 1 21 LYS H 3.230 . 3.230 2.389 1.661 3.297 0.139 7 0 "[ . 1 . 2]" 1
1314 1 22 GLU QB 1 23 GLY H 3.670 . 3.670 2.741 2.105 3.841 0.171 15 0 "[ . 1 . 2]" 1
1315 1 73 ARG H 1 103 GLN QG 4.920 . 4.920 3.709 3.284 4.000 . 0 0 "[ . 1 . 2]" 1
1316 1 58 MET H 1 58 MET QB 3.320 . 3.320 2.481 2.329 2.524 . 0 0 "[ . 1 . 2]" 1
1317 1 58 MET QB 1 59 LYS H 3.650 . 3.650 2.462 2.383 2.583 . 0 0 "[ . 1 . 2]" 1
1318 1 45 GLN H 1 45 GLN HB2 3.250 . 3.250 2.618 2.587 2.676 . 0 0 "[ . 1 . 2]" 1
1319 1 61 TYR HB2 1 62 CYS H 4.040 . 4.040 3.798 3.742 3.875 . 0 0 "[ . 1 . 2]" 1
1320 1 63 GLU H 1 64 ARG QG 4.210 . 4.210 4.137 3.965 4.285 0.075 7 0 "[ . 1 . 2]" 1
1321 1 18 GLU HB2 1 19 LYS H 5.020 . 5.020 4.053 2.089 4.470 . 0 0 "[ . 1 . 2]" 1
1322 1 53 PRO HG2 1 55 SER H 5.600 . 5.600 4.585 4.309 4.808 . 0 0 "[ . 1 . 2]" 1
1323 1 72 ILE HG13 1 73 ARG H 4.300 . 4.300 2.930 2.836 3.041 . 0 0 "[ . 1 . 2]" 1
1324 1 54 LEU HB2 1 55 SER H 4.070 . 4.070 4.021 3.856 4.253 0.183 6 0 "[ . 1 . 2]" 1
1325 1 21 LYS H 1 21 LYS QD 4.380 . 4.380 2.526 1.679 3.691 0.121 19 0 "[ . 1 . 2]" 1
1326 1 75 ARG HB2 1 101 PHE HZ 4.000 . 4.000 2.975 2.599 3.439 . 0 0 "[ . 1 . 2]" 1
1327 1 75 ARG HE 1 75 ARG HG3 3.850 . 3.850 2.356 2.178 3.303 . 0 0 "[ . 1 . 2]" 1
1328 1 44 VAL MG2 1 46 PHE HZ 3.580 . 3.580 3.172 3.078 3.244 . 0 0 "[ . 1 . 2]" 1
1329 1 44 VAL HB 1 46 PHE HZ 3.400 . 3.400 2.347 2.234 2.408 . 0 0 "[ . 1 . 2]" 1
1330 1 46 PHE HZ 1 61 TYR HB2 3.430 . 3.430 2.357 2.045 2.678 . 0 0 "[ . 1 . 2]" 1
1331 1 83 GLU HG3 1 84 THR H 4.450 . 4.450 3.228 2.728 4.308 . 0 0 "[ . 1 . 2]" 1
1332 1 70 ARG HE 1 70 ARG QG 3.810 . 3.810 2.573 2.341 3.038 . 0 0 "[ . 1 . 2]" 1
1333 1 61 TYR HB3 1 74 PHE HZ 3.580 . 3.580 2.233 2.124 2.389 . 0 0 "[ . 1 . 2]" 1
1334 1 36 VAL HB 1 46 PHE QE 4.210 . 4.210 2.920 2.530 3.362 . 0 0 "[ . 1 . 2]" 1
1335 1 44 VAL MG2 1 46 PHE QE 3.950 . 3.950 3.780 3.710 3.871 . 0 0 "[ . 1 . 2]" 1
1336 1 58 MET HA 1 74 PHE QE 3.550 . 3.550 2.806 2.659 3.009 . 0 0 "[ . 1 . 2]" 1
1337 1 61 TYR HB3 1 74 PHE QE 4.230 . 4.230 2.865 2.609 3.067 . 0 0 "[ . 1 . 2]" 1
1338 1 76 PHE QD 1 77 ASP HB3 4.080 . 4.080 3.523 3.274 4.040 . 0 0 "[ . 1 . 2]" 1
1339 1 76 PHE QD 1 90 LEU HB3 3.100 . 3.100 2.503 2.188 2.896 . 0 0 "[ . 1 . 2]" 1
1340 1 72 ILE H 1 72 ILE MG 3.110 . 3.110 2.835 2.723 2.951 . 0 0 "[ . 1 . 2]" 1
1341 1 50 ARG HE 1 50 ARG HG3 3.940 . 3.940 2.454 2.283 2.619 . 0 0 "[ . 1 . 2]" 1
1342 1 76 PHE QE 1 90 LEU HB2 4.300 . 4.300 2.816 2.365 3.069 . 0 0 "[ . 1 . 2]" 1
1343 1 24 VAL H 1 24 VAL HB 3.200 . 3.200 2.766 2.496 3.497 0.297 18 0 "[ . 1 . 2]" 1
1344 1 89 GLN H 1 89 GLN QG 3.990 . 3.990 3.365 2.410 4.058 0.068 20 0 "[ . 1 . 2]" 1
1345 1 89 GLN H 1 89 GLN HB2 3.570 . 3.570 2.222 2.123 2.328 . 0 0 "[ . 1 . 2]" 1
1346 1 64 ARG H 1 64 ARG QG 3.170 . 3.170 2.149 1.938 2.322 . 0 0 "[ . 1 . 2]" 1
1347 1 70 ARG H 1 70 ARG HB3 3.180 . 3.180 2.898 2.838 2.985 . 0 0 "[ . 1 . 2]" 1
1348 1 31 HIS H 1 31 HIS HB3 3.720 . 3.720 3.099 2.909 3.652 . 0 0 "[ . 1 . 2]" 1
1349 1 15 MET HG3 1 16 ALA H 3.850 . 3.850 3.220 1.820 4.160 0.310 2 0 "[ . 1 . 2]" 1
1350 1 63 GLU HB2 1 64 ARG H 3.600 . 3.600 2.723 2.406 3.004 . 0 0 "[ . 1 . 2]" 1
1351 1 96 ASP H 1 96 ASP HB3 3.510 . 3.510 2.746 2.079 3.375 . 0 0 "[ . 1 . 2]" 1
1352 1 95 GLU HB3 1 96 ASP H 4.910 . 4.910 4.387 4.278 4.446 . 0 0 "[ . 1 . 2]" 1
1353 1 70 ARG H 1 70 ARG QD 4.020 . 4.020 1.808 1.633 2.132 0.167 9 0 "[ . 1 . 2]" 1
1354 1 95 GLU HB2 1 96 ASP H 3.980 . 3.980 3.942 3.847 4.032 0.052 6 0 "[ . 1 . 2]" 1
1355 1 30 ASP QB 1 31 HIS H 3.900 . 3.900 3.531 2.082 4.005 0.105 6 0 "[ . 1 . 2]" 1
1356 1 17 ASP HB2 1 18 GLU H 4.540 . 4.540 3.661 2.421 4.534 . 0 0 "[ . 1 . 2]" 1
1357 1 65 GLN HB3 1 67 LEU H 4.560 . 4.560 4.277 3.552 4.587 0.027 9 0 "[ . 1 . 2]" 1
1358 1 22 GLU QB 1 24 VAL H 5.250 . 5.250 4.207 3.195 5.517 0.267 17 0 "[ . 1 . 2]" 1
1359 1 82 ASN HD22 1 85 ASP HB2 5.030 . 5.030 3.951 2.993 4.967 . 0 0 "[ . 1 . 2]" 1
1360 1 58 MET HA 1 60 ALA H 4.460 . 4.460 4.355 4.272 4.432 . 0 0 "[ . 1 . 2]" 1
1361 1 62 CYS HB2 1 69 MET HA 4.990 . 4.990 4.876 4.478 5.159 0.169 20 0 "[ . 1 . 2]" 1
1362 1 50 ARG HD2 1 88 ALA MB 4.210 . 4.210 2.733 2.155 3.258 . 0 0 "[ . 1 . 2]" 1
1363 1 69 MET H 1 69 MET QG 3.450 . 3.450 2.631 2.561 2.704 . 0 0 "[ . 1 . 2]" 1
1364 1 54 LEU H 1 54 LEU MD2 4.000 . 4.000 3.134 1.948 3.554 . 0 0 "[ . 1 . 2]" 1
1365 1 74 PHE H 1 74 PHE HB2 4.150 . 4.150 2.465 2.392 2.514 . 0 0 "[ . 1 . 2]" 1
1366 1 54 LEU H 1 54 LEU HB3 4.190 . 4.190 2.799 2.427 2.997 . 0 0 "[ . 1 . 2]" 1
1367 1 34 LEU H 1 57 LEU MD2 5.070 . 5.070 4.166 3.887 4.433 . 0 0 "[ . 1 . 2]" 1
1368 1 48 ILE H 1 57 LEU MD2 5.780 . 5.780 5.068 4.686 5.294 . 0 0 "[ . 1 . 2]" 1
1369 1 34 LEU H 1 34 LEU MD2 4.510 . 4.510 2.635 2.387 2.795 . 0 0 "[ . 1 . 2]" 1
1370 1 40 ASP HB2 1 41 GLY H 4.540 . 4.540 3.952 3.008 4.400 . 0 0 "[ . 1 . 2]" 1
1371 1 101 PHE H 1 103 GLN QG 6.000 . 6.000 4.679 4.491 4.965 . 0 0 "[ . 1 . 2]" 1
1372 1 104 GLN H 1 104 GLN QG 4.070 . 4.070 3.832 1.995 4.206 0.136 13 0 "[ . 1 . 2]" 1
1373 1 103 GLN QG 1 104 GLN H 5.110 . 5.110 4.689 4.609 4.883 . 0 0 "[ . 1 . 2]" 1
1374 1 28 ASN HB2 1 29 ASN H 4.700 . 4.700 4.014 2.996 4.506 . 0 0 "[ . 1 . 2]" 1
1375 1 39 GLN QG 1 102 GLN H 4.420 . 4.420 2.523 2.094 3.008 . 0 0 "[ . 1 . 2]" 1
1376 1 38 GLY H 1 39 GLN QG 6.000 . 6.000 6.084 5.979 6.309 0.309 1 0 "[ . 1 . 2]" 1
1377 1 60 ALA H 1 61 TYR HB3 4.740 . 4.740 4.661 4.602 4.743 0.003 7 0 "[ . 1 . 2]" 1
1378 1 31 HIS HB2 1 31 HIS HD2 3.480 . 3.480 2.870 2.718 3.776 0.296 19 0 "[ . 1 . 2]" 1
1379 1 51 HIS H 1 87 PRO HG3 5.450 . 5.450 5.224 4.932 5.388 . 0 0 "[ . 1 . 2]" 1
1380 1 71 GLN H 1 104 GLN QB 6.000 . 6.000 5.186 4.524 6.091 0.091 5 0 "[ . 1 . 2]" 1
1381 1 71 GLN H 1 71 GLN HB3 3.600 . 3.600 3.438 3.371 3.466 . 0 0 "[ . 1 . 2]" 1
1382 1 56 LYS H 1 56 LYS HG3 3.600 . 3.600 2.127 1.923 2.355 . 0 0 "[ . 1 . 2]" 1
1383 1 89 GLN QG 1 91 GLU H 5.800 . 5.800 5.401 5.071 5.717 . 0 0 "[ . 1 . 2]" 1
1384 1 53 PRO HB2 1 56 LYS H 3.800 . 3.800 3.418 3.176 3.715 . 0 0 "[ . 1 . 2]" 1
1385 1 40 ASP HB3 1 41 GLY H 4.540 . 4.540 3.729 3.007 4.501 . 0 0 "[ . 1 . 2]" 1
1386 1 51 HIS H 1 51 HIS HB3 3.250 . 3.250 2.526 2.376 2.702 . 0 0 "[ . 1 . 2]" 1
1387 1 56 LYS H 1 56 LYS HG2 3.430 . 3.430 3.238 2.933 3.459 0.029 19 0 "[ . 1 . 2]" 1
1388 1 48 ILE MD 1 56 LYS H 4.810 . 4.810 4.571 4.356 4.802 . 0 0 "[ . 1 . 2]" 1
1389 1 70 ARG HB3 1 71 GLN H 4.320 . 4.320 4.293 4.239 4.360 0.040 17 0 "[ . 1 . 2]" 1
1390 1 64 ARG HB2 1 65 GLN H 4.170 . 4.170 3.939 3.784 4.091 . 0 0 "[ . 1 . 2]" 1
1391 1 50 ARG HG2 1 51 HIS H 4.530 . 4.530 3.905 3.126 4.632 0.102 3 0 "[ . 1 . 2]" 1
1392 1 88 ALA MB 1 91 GLU H 4.430 . 4.430 4.352 4.166 4.451 0.021 9 0 "[ . 1 . 2]" 1
1393 1 51 HIS H 1 52 THR MG 5.340 . 5.340 5.004 4.459 5.118 . 0 0 "[ . 1 . 2]" 1
1394 1 76 PHE HB2 1 79 GLN H 6.000 . 6.000 5.906 5.621 6.116 0.116 12 0 "[ . 1 . 2]" 1
1395 1 77 ASP HB2 1 79 GLN HE22 5.070 . 5.070 5.135 5.069 5.193 0.123 13 0 "[ . 1 . 2]" 1
1396 1 81 ILE HA 1 85 ASP HB2 5.070 . 5.070 4.128 3.624 4.794 . 0 0 "[ . 1 . 2]" 1
1397 1 73 ARG HD3 1 74 PHE HB2 5.140 . 5.140 5.012 4.494 5.244 0.104 8 0 "[ . 1 . 2]" 1
1398 1 51 HIS HB3 1 52 THR H 4.010 . 4.010 3.447 3.301 3.600 . 0 0 "[ . 1 . 2]" 1
1399 1 74 PHE HB2 1 98 ILE MG 3.860 . 3.860 3.734 3.543 3.920 0.060 8 0 "[ . 1 . 2]" 1
1400 1 69 MET HB3 1 70 ARG HA 5.270 . 5.270 4.305 4.233 4.385 . 0 0 "[ . 1 . 2]" 1
1401 1 89 GLN HB3 1 90 LEU H 3.780 . 3.780 3.143 2.325 3.605 . 0 0 "[ . 1 . 2]" 1
1402 1 98 ILE MD 1 99 ASP QB 5.480 . 5.480 5.330 5.138 5.500 0.020 17 0 "[ . 1 . 2]" 1
1403 1 74 PHE HB3 1 98 ILE MD 5.360 . 5.360 4.008 3.825 4.253 . 0 0 "[ . 1 . 2]" 1
1404 1 65 GLN HB3 1 65 GLN HE22 4.470 . 4.470 4.275 4.123 4.378 . 0 0 "[ . 1 . 2]" 1
1405 1 71 GLN HB3 1 71 GLN HE21 4.410 . 4.410 3.980 3.947 4.041 . 0 0 "[ . 1 . 2]" 1
1406 1 79 GLN HB2 1 79 GLN HE21 4.180 . 4.180 4.040 3.994 4.303 0.123 3 0 "[ . 1 . 2]" 1
1407 1 79 GLN HE21 1 79 GLN HG2 3.300 . 3.300 2.857 2.161 2.927 . 0 0 "[ . 1 . 2]" 1
1408 1 59 LYS HG2 1 60 ALA H 5.270 . 5.270 4.843 4.387 5.008 . 0 0 "[ . 1 . 2]" 1
1409 1 45 GLN HA 1 46 PHE HB3 6.000 . 6.000 5.618 5.598 5.644 . 0 0 "[ . 1 . 2]" 1
1410 1 71 GLN HB2 1 71 GLN HE22 4.540 . 4.540 4.246 3.958 4.423 . 0 0 "[ . 1 . 2]" 1
1411 1 45 GLN HB2 1 45 GLN HE21 4.670 . 4.670 3.710 3.636 3.778 . 0 0 "[ . 1 . 2]" 1
1412 1 79 GLN HB2 1 79 GLN HE22 5.190 . 5.190 4.474 4.411 4.532 . 0 0 "[ . 1 . 2]" 1
1413 1 58 MET QB 1 74 PHE QE 3.660 . 3.660 3.108 2.986 3.249 . 0 0 "[ . 1 . 2]" 1
1414 1 74 PHE QE 1 98 ILE MG 4.050 . 4.050 3.763 3.598 3.913 . 0 0 "[ . 1 . 2]" 1
1415 1 74 PHE QE 1 100 VAL MG1 4.150 . 4.150 3.944 3.715 4.140 . 0 0 "[ . 1 . 2]" 1
1416 1 72 ILE HG13 1 74 PHE QE 3.980 . 3.980 2.937 2.777 3.152 . 0 0 "[ . 1 . 2]" 1
1417 1 72 ILE MD 1 74 PHE QE 3.310 . 3.310 2.626 2.445 2.773 . 0 0 "[ . 1 . 2]" 1
1418 1 58 MET HA 1 58 MET HG3 3.670 . 3.670 3.268 2.610 3.343 . 0 0 "[ . 1 . 2]" 1
1419 1 70 ARG HB3 1 70 ARG QD 3.590 . 3.590 2.560 2.346 2.846 . 0 0 "[ . 1 . 2]" 1
1420 1 64 ARG HB2 1 64 ARG HD2 4.070 . 4.070 3.235 3.035 3.825 . 0 0 "[ . 1 . 2]" 1
1421 1 73 ARG HB3 1 73 ARG HD2 3.840 . 3.840 2.466 2.398 2.586 . 0 0 "[ . 1 . 2]" 1
1422 1 73 ARG HB3 1 73 ARG HD3 4.120 . 4.120 3.110 2.978 3.252 . 0 0 "[ . 1 . 2]" 1
1423 1 73 ARG HD2 1 103 GLN QG 5.350 . 5.350 4.443 4.159 4.677 . 0 0 "[ . 1 . 2]" 1
1424 1 57 LEU HA 1 57 LEU MD2 4.240 . 4.240 4.135 4.115 4.157 . 0 0 "[ . 1 . 2]" 1
1425 1 57 LEU HA 1 57 LEU HG 3.710 . 3.710 3.757 3.729 3.787 0.077 7 0 "[ . 1 . 2]" 1
1426 1 50 ARG HA 1 88 ALA MB 3.910 . 3.910 3.600 3.445 3.775 . 0 0 "[ . 1 . 2]" 1
1427 1 102 GLN HB3 1 102 GLN HE21 4.770 . 4.770 3.543 3.347 4.218 . 0 0 "[ . 1 . 2]" 1
1428 1 52 THR HA 1 53 PRO HG3 4.850 . 4.850 4.472 4.413 4.528 . 0 0 "[ . 1 . 2]" 1
1429 1 65 GLN HB3 1 65 GLN HE21 4.350 . 4.350 3.764 3.620 3.841 . 0 0 "[ . 1 . 2]" 1
1430 1 19 LYS HA 1 20 PRO QG 4.380 . 4.380 3.911 3.706 4.211 . 0 0 "[ . 1 . 2]" 1
1431 1 19 LYS HA 1 19 LYS QD 4.550 . 4.550 3.522 1.976 4.493 . 0 0 "[ . 1 . 2]" 1
1432 1 35 LYS HB2 1 45 GLN HE21 5.910 . 5.910 5.538 5.307 5.703 . 0 0 "[ . 1 . 2]" 1
1433 1 70 ARG HB3 1 71 GLN HE22 6.000 . 6.000 4.542 4.402 4.742 . 0 0 "[ . 1 . 2]" 1
1434 1 65 GLN HE22 1 65 GLN QG 3.560 . 3.560 3.314 3.290 3.322 . 0 0 "[ . 1 . 2]" 1
1435 1 61 TYR QE 1 65 GLN QG 3.730 . 3.730 2.927 2.682 3.011 . 0 0 "[ . 1 . 2]" 1
1436 1 61 TYR QE 1 64 ARG QG 5.390 . 5.390 5.128 4.882 5.267 . 0 0 "[ . 1 . 2]" 1
1437 1 37 ALA MB 1 99 ASP HA 3.910 . 3.910 3.454 3.178 3.887 . 0 0 "[ . 1 . 2]" 1
1438 1 70 ARG QG 1 71 GLN HG2 4.990 . 4.990 4.314 4.173 4.429 . 0 0 "[ . 1 . 2]" 1
1439 1 54 LEU HG 1 85 ASP HB3 5.320 . 5.320 4.173 3.026 5.505 0.185 8 0 "[ . 1 . 2]" 1
1440 1 67 LEU H 1 67 LEU MD1 4.060 . 4.060 3.887 3.154 4.078 0.018 20 0 "[ . 1 . 2]" 1
1441 1 105 THR MG 1 107 GLY H 6.000 . 6.000 5.154 3.173 6.095 0.095 19 0 "[ . 1 . 2]" 1
1442 1 67 LEU H 1 67 LEU HB3 3.990 . 3.990 3.680 3.485 3.735 . 0 0 "[ . 1 . 2]" 1
1443 1 34 LEU MD1 1 96 ASP H 4.780 . 4.780 2.995 2.817 3.153 . 0 0 "[ . 1 . 2]" 1
1444 1 34 LEU HB3 1 96 ASP H 5.890 . 5.890 5.354 4.962 5.631 . 0 0 "[ . 1 . 2]" 1
1445 1 61 TYR QE 1 65 GLN HB2 4.430 . 4.430 3.962 3.891 4.052 . 0 0 "[ . 1 . 2]" 1
1446 1 61 TYR QE 1 67 LEU HB2 4.880 . 4.880 3.883 3.598 4.138 . 0 0 "[ . 1 . 2]" 1
1447 1 61 TYR QE 1 100 VAL HB 4.360 . 4.360 3.930 3.777 4.097 . 0 0 "[ . 1 . 2]" 1
1448 1 33 ASN HA 1 34 LEU HB2 4.560 . 4.560 4.509 4.464 4.574 0.014 4 0 "[ . 1 . 2]" 1
1449 1 46 PHE HB3 1 57 LEU HB3 4.880 . 4.880 3.423 3.128 3.700 . 0 0 "[ . 1 . 2]" 1
1450 1 44 VAL MG2 1 65 GLN HE21 3.990 . 3.990 3.423 3.193 3.722 . 0 0 "[ . 1 . 2]" 1
1451 1 67 LEU HG 1 102 GLN HE22 4.890 . 4.890 3.238 2.602 3.747 . 0 0 "[ . 1 . 2]" 1
1452 1 67 LEU MD2 1 102 GLN HE22 4.040 . 4.040 4.016 3.360 4.194 0.154 1 0 "[ . 1 . 2]" 1
1453 1 72 ILE MG 1 102 GLN HE22 4.700 . 4.700 2.328 2.100 2.568 . 0 0 "[ . 1 . 2]" 1
1454 1 65 GLN HB2 1 65 GLN HE21 4.590 . 4.590 3.993 3.926 4.047 . 0 0 "[ . 1 . 2]" 1
1455 1 75 ARG HG2 1 99 ASP QB 4.650 . 4.650 4.166 3.423 4.732 0.082 6 0 "[ . 1 . 2]" 1
1456 1 105 THR H 1 105 THR MG 4.200 . 4.200 3.181 1.916 3.962 . 0 0 "[ . 1 . 2]" 1
1457 1 44 VAL MG2 1 61 TYR QE 3.120 . 3.120 2.276 2.058 2.358 . 0 0 "[ . 1 . 2]" 1
1458 1 37 ALA HA 1 44 VAL MG2 5.850 . 5.850 5.003 4.844 5.230 . 0 0 "[ . 1 . 2]" 1
1459 1 37 ALA HA 1 97 THR MG 6.000 . 6.000 4.166 3.912 4.480 . 0 0 "[ . 1 . 2]" 1
1460 1 44 VAL MG1 1 45 GLN HE22 4.480 . 4.480 4.364 4.242 4.432 . 0 0 "[ . 1 . 2]" 1
1461 1 48 ILE MD 1 52 THR H 4.940 . 4.940 4.366 4.154 4.644 . 0 0 "[ . 1 . 2]" 1
1462 1 97 THR MG 1 99 ASP QB 6.000 . 6.000 4.712 4.078 5.350 . 0 0 "[ . 1 . 2]" 1
1463 1 79 GLN HE21 1 90 LEU MD1 5.160 . 5.160 4.459 4.281 5.011 . 0 0 "[ . 1 . 2]" 1
1464 1 79 GLN HE21 1 90 LEU MD2 4.240 . 4.240 1.825 1.723 2.197 0.077 9 0 "[ . 1 . 2]" 1
1465 1 44 VAL MG2 1 64 ARG HD3 4.390 . 4.390 2.186 1.993 2.986 . 0 0 "[ . 1 . 2]" 1
1466 1 54 LEU HB3 1 57 LEU MD2 5.230 . 5.230 3.124 2.789 3.603 . 0 0 "[ . 1 . 2]" 1
1467 1 81 ILE H 1 81 ILE HG12 3.660 . 3.660 3.464 3.378 3.526 . 0 0 "[ . 1 . 2]" 1
1468 1 100 VAL MG2 1 101 PHE H 3.880 . 3.880 3.786 3.639 3.885 0.005 2 0 "[ . 1 . 2]" 1
1469 1 36 VAL MG2 1 44 VAL H 4.710 . 4.710 4.190 3.965 4.476 . 0 0 "[ . 1 . 2]" 1
1470 1 38 GLY H 1 100 VAL MG2 5.930 . 5.930 4.863 4.649 5.150 . 0 0 "[ . 1 . 2]" 1
1471 1 38 GLY H 1 100 VAL MG1 5.930 . 5.930 5.322 4.893 5.615 . 0 0 "[ . 1 . 2]" 1
1472 1 24 VAL QG 1 25 LYS H 3.380 . 3.380 2.805 2.092 3.497 0.117 18 0 "[ . 1 . 2]" 1
1473 1 32 ILE MG 1 94 ASP H 3.950 . 3.950 3.156 2.705 3.649 . 0 0 "[ . 1 . 2]" 1
1474 1 97 THR H 1 98 ILE HG12 6.000 . 6.000 5.215 5.036 5.351 . 0 0 "[ . 1 . 2]" 1
1475 1 68 SER H 1 72 ILE MD 4.580 . 4.580 4.047 3.820 4.232 . 0 0 "[ . 1 . 2]" 1
1476 1 79 GLN HE22 1 90 LEU MD1 5.030 . 5.030 5.062 4.744 5.181 0.151 5 0 "[ . 1 . 2]" 1
1477 1 44 VAL MG1 1 65 GLN HE21 4.970 . 4.970 4.831 4.533 5.083 0.113 14 0 "[ . 1 . 2]" 1
1478 1 44 VAL MG1 1 64 ARG HD3 3.930 . 3.930 2.020 1.841 2.357 . 0 0 "[ . 1 . 2]" 1
1479 1 44 VAL MG1 1 64 ARG HD2 3.910 . 3.910 2.604 2.010 2.788 . 0 0 "[ . 1 . 2]" 1
1480 1 81 ILE MD 1 99 ASP QB 5.500 . 5.500 5.128 4.914 5.335 . 0 0 "[ . 1 . 2]" 1
1481 1 57 LEU MD1 1 98 ILE MD 4.080 . 4.080 3.876 3.678 4.076 . 0 0 "[ . 1 . 2]" 1
1482 1 32 ILE MG 1 50 ARG H 4.600 . 4.600 4.120 3.738 4.413 . 0 0 "[ . 1 . 2]" 1
1483 1 69 MET QG 1 72 ILE MD 4.850 . 4.850 4.764 4.570 4.869 0.019 20 0 "[ . 1 . 2]" 1
1484 1 62 CYS H 1 72 ILE MD 4.620 . 4.620 3.889 3.730 4.050 . 0 0 "[ . 1 . 2]" 1
1485 1 54 LEU MD2 1 81 ILE HA 5.760 . 5.760 4.724 4.503 5.138 . 0 0 "[ . 1 . 2]" 1
1486 1 73 ARG H 1 100 VAL MG1 5.000 . 5.000 2.529 2.312 2.648 . 0 0 "[ . 1 . 2]" 1
1487 1 32 ILE MD 1 50 ARG H 5.180 . 5.180 4.671 4.229 5.101 . 0 0 "[ . 1 . 2]" 1
1488 1 61 TYR QE 1 100 VAL MG1 3.490 . 3.490 2.390 2.219 2.644 . 0 0 "[ . 1 . 2]" 1
1489 1 38 GLY HA2 1 100 VAL MG1 5.860 . 5.860 3.301 2.941 3.600 . 0 0 "[ . 1 . 2]" 1
1490 1 46 PHE HB3 1 57 LEU MD2 4.510 . 4.510 3.753 3.440 4.144 . 0 0 "[ . 1 . 2]" 1
1491 1 32 ILE MD 1 93 GLU HA 4.890 . 4.890 3.443 2.491 3.916 . 0 0 "[ . 1 . 2]" 1
1492 1 57 LEU MD1 1 58 MET HA 3.560 . 3.560 2.382 2.313 2.437 . 0 0 "[ . 1 . 2]" 1
1493 1 58 MET HA 1 58 MET HG2 3.670 . 3.670 2.439 2.373 2.753 . 0 0 "[ . 1 . 2]" 1
1494 1 61 TYR QE 1 100 VAL MG2 3.490 . 3.490 3.149 2.959 3.310 . 0 0 "[ . 1 . 2]" 1
1495 1 57 LEU HA 1 57 LEU MD1 3.710 . 3.710 3.519 3.469 3.557 . 0 0 "[ . 1 . 2]" 1
1496 1 36 VAL MG1 1 61 TYR QE 4.500 . 4.500 2.701 2.377 3.135 . 0 0 "[ . 1 . 2]" 1
1497 1 61 TYR H 1 63 GLU H 4.760 . 4.760 4.095 4.002 4.204 . 0 0 "[ . 1 . 2]" 1
1498 1 101 PHE H 1 101 PHE QE 4.170 . 4.170 4.187 4.122 4.240 0.070 12 0 "[ . 1 . 2]" 1
1499 1 73 ARG H 1 101 PHE QD 4.330 . 4.330 4.361 4.270 4.433 0.103 13 0 "[ . 1 . 2]" 1
1500 1 101 PHE H 1 101 PHE QD 3.210 . 3.210 3.019 2.820 3.111 . 0 0 "[ . 1 . 2]" 1
1501 1 39 GLN H 1 41 GLY H 4.640 . 4.640 4.259 3.963 4.456 . 0 0 "[ . 1 . 2]" 1
1502 1 70 ARG H 1 71 GLN HE22 4.920 . 4.920 4.717 4.378 4.872 . 0 0 "[ . 1 . 2]" 1
1503 1 49 LYS H 1 52 THR H 4.530 . 4.530 4.103 3.960 4.314 . 0 0 "[ . 1 . 2]" 1
1504 1 56 LYS H 1 58 MET H 4.330 . 4.330 3.904 3.849 3.970 . 0 0 "[ . 1 . 2]" 1
1505 1 32 ILE HB 1 33 ASN HA 4.930 . 4.930 4.523 4.475 4.588 . 0 0 "[ . 1 . 2]" 1
1506 1 75 ARG HB3 1 78 GLY HA2 5.870 . 5.870 5.535 5.272 5.853 . 0 0 "[ . 1 . 2]" 1
1507 1 15 MET HA 1 15 MET HG2 4.250 . 4.250 3.680 3.201 3.790 . 0 0 "[ . 1 . 2]" 1
1508 1 83 GLU HA 1 84 THR MG 4.790 . 4.790 4.838 4.739 4.912 0.122 15 0 "[ . 1 . 2]" 1
1509 1 71 GLN HA 1 71 GLN HG2 3.620 . 3.620 3.604 3.569 3.634 0.014 5 0 "[ . 1 . 2]" 1
1510 1 52 THR HA 1 52 THR MG 3.140 . 3.140 2.724 2.649 3.085 . 0 0 "[ . 1 . 2]" 1
1511 1 57 LEU HA 1 60 ALA MB 3.320 . 3.320 2.281 2.140 2.380 . 0 0 "[ . 1 . 2]" 1
1512 1 55 SER HA 1 58 MET ME 3.360 . 3.360 1.963 1.870 2.511 . 0 0 "[ . 1 . 2]" 1
1513 1 74 PHE HA 1 75 ARG HB3 4.370 . 4.370 4.286 4.157 4.406 0.036 19 0 "[ . 1 . 2]" 1
1514 1 58 MET ME 1 83 GLU HA 3.040 . 3.040 2.285 2.028 2.598 . 0 0 "[ . 1 . 2]" 1
1515 1 60 ALA MB 1 61 TYR HA 4.050 . 4.050 3.857 3.817 3.882 . 0 0 "[ . 1 . 2]" 1
1516 1 105 THR HA 1 105 THR MG 3.340 . 3.340 2.532 2.227 3.225 . 0 0 "[ . 1 . 2]" 1
1517 1 65 GLN HA 1 65 GLN QG 2.990 . 2.990 2.804 2.722 2.915 . 0 0 "[ . 1 . 2]" 1
1518 1 79 GLN HB2 1 80 PRO HD3 3.650 . 3.650 3.556 3.236 3.673 0.023 6 0 "[ . 1 . 2]" 1
1519 1 35 LYS QD 1 95 GLU HA 4.360 . 4.360 3.351 3.108 3.579 . 0 0 "[ . 1 . 2]" 1
1520 1 68 SER HB2 1 71 GLN HB2 3.260 . 3.260 2.023 1.865 2.265 . 0 0 "[ . 1 . 2]" 1
1521 1 84 THR HA 1 84 THR MG 2.810 . 2.810 2.480 2.131 3.169 0.359 3 0 "[ . 1 . 2]" 1
1522 1 62 CYS HA 1 67 LEU HB2 3.230 . 3.230 2.358 2.109 2.765 . 0 0 "[ . 1 . 2]" 1
1523 1 60 ALA HA 1 63 GLU HB2 3.330 . 3.330 2.583 2.424 2.701 . 0 0 "[ . 1 . 2]" 1
1524 1 71 GLN HA 1 104 GLN QG 3.870 . 3.870 3.424 1.795 4.041 0.171 11 0 "[ . 1 . 2]" 1
1525 1 103 GLN HA 1 103 GLN QG 3.510 . 3.510 2.759 2.596 2.866 . 0 0 "[ . 1 . 2]" 1
1526 1 95 GLU HA 1 95 GLU HG2 4.000 . 4.000 2.458 2.229 2.919 . 0 0 "[ . 1 . 2]" 1
1527 1 38 GLY HA3 1 100 VAL HB 4.660 . 4.660 3.185 2.811 3.844 . 0 0 "[ . 1 . 2]" 1
1528 1 62 CYS HA 1 67 LEU HB3 5.290 . 5.290 3.805 3.146 4.346 . 0 0 "[ . 1 . 2]" 1
1529 1 68 SER HB3 1 71 GLN HB2 3.440 . 3.440 3.585 3.522 3.632 0.192 14 0 "[ . 1 . 2]" 1
1530 1 55 SER HA 1 58 MET QB 3.540 . 3.540 2.318 2.085 2.441 . 0 0 "[ . 1 . 2]" 1
1531 1 68 SER HB3 1 70 ARG QG 3.910 . 3.910 2.778 2.491 3.014 . 0 0 "[ . 1 . 2]" 1
1532 1 21 LYS HA 1 21 LYS QG 3.830 . 3.830 3.439 3.301 3.505 . 0 0 "[ . 1 . 2]" 1
1533 1 52 THR MG 1 53 PRO HA 4.060 . 4.060 4.062 3.983 4.120 0.060 6 0 "[ . 1 . 2]" 1
1534 1 56 LYS HB3 1 57 LEU HA 5.080 . 5.080 4.460 4.305 4.598 . 0 0 "[ . 1 . 2]" 1
1535 1 52 THR HA 1 53 PRO HG2 4.580 . 4.580 4.330 4.251 4.491 . 0 0 "[ . 1 . 2]" 1
1536 1 50 ARG HA 1 87 PRO HG2 4.030 . 4.030 2.114 1.954 2.431 . 0 0 "[ . 1 . 2]" 1
1537 1 52 THR MG 1 87 PRO QD 4.020 . 4.020 4.142 3.760 4.247 0.227 7 0 "[ . 1 . 2]" 1
1538 1 74 PHE HA 1 75 ARG HB2 4.900 . 4.900 4.446 4.259 4.580 . 0 0 "[ . 1 . 2]" 1
1539 1 75 ARG HG2 1 76 PHE HA 4.550 . 4.550 3.813 3.076 4.423 . 0 0 "[ . 1 . 2]" 1
1540 1 61 TYR HA 1 65 GLN QG 3.840 . 3.840 3.213 2.962 3.527 . 0 0 "[ . 1 . 2]" 1
1541 1 48 ILE HG13 1 52 THR HB 4.570 . 4.570 3.838 3.439 4.616 0.046 19 0 "[ . 1 . 2]" 1
1542 1 67 LEU HG 1 72 ILE HA 6.000 . 6.000 5.740 5.544 5.870 . 0 0 "[ . 1 . 2]" 1
1543 1 72 ILE HA 1 73 ARG HB3 6.000 . 6.000 5.557 5.492 5.620 . 0 0 "[ . 1 . 2]" 1
1544 1 49 LYS HA 1 50 ARG HB2 6.000 . 6.000 5.743 5.706 5.800 . 0 0 "[ . 1 . 2]" 1
1545 1 92 MET HB3 1 93 GLU HA 6.000 . 6.000 5.833 5.725 5.918 . 0 0 "[ . 1 . 2]" 1
1546 1 35 LYS HG2 1 45 GLN HA 4.050 . 4.050 2.267 2.156 2.373 . 0 0 "[ . 1 . 2]" 1
1547 1 33 ASN HB3 1 95 GLU HA 5.260 . 5.260 3.412 2.968 3.792 . 0 0 "[ . 1 . 2]" 1
1548 1 75 ARG HA 1 81 ILE HB 4.540 . 4.540 4.126 3.844 4.376 . 0 0 "[ . 1 . 2]" 1
1549 1 33 ASN HA 1 34 LEU MD2 4.980 . 4.980 3.044 2.904 3.190 . 0 0 "[ . 1 . 2]" 1
1550 1 44 VAL MG1 1 45 GLN HA 4.500 . 4.500 3.950 3.793 4.051 . 0 0 "[ . 1 . 2]" 1
1551 1 97 THR HA 1 98 ILE HG12 4.700 . 4.700 3.666 3.474 3.863 . 0 0 "[ . 1 . 2]" 1
1552 1 44 VAL MG1 1 61 TYR HA 3.910 . 3.910 3.624 3.429 3.796 . 0 0 "[ . 1 . 2]" 1
1553 1 69 MET HA 1 72 ILE MD 4.000 . 4.000 3.910 3.736 4.026 0.026 12 0 "[ . 1 . 2]" 1
1554 1 98 ILE HA 1 98 ILE MG 3.490 . 3.490 2.350 2.305 2.389 . 0 0 "[ . 1 . 2]" 1
1555 1 87 PRO QD 1 88 ALA MB 3.940 . 3.940 4.122 4.041 4.244 0.304 17 0 "[ . 1 . 2]" 1
1556 1 44 VAL HA 1 44 VAL MG1 3.000 . 3.000 2.292 2.262 2.327 . 0 0 "[ . 1 . 2]" 1
1557 1 32 ILE HA 1 32 ILE MG 3.300 . 3.300 2.326 2.289 2.371 . 0 0 "[ . 1 . 2]" 1
1558 1 81 ILE HA 1 81 ILE MG 3.280 . 3.280 2.339 2.284 2.385 . 0 0 "[ . 1 . 2]" 1
1559 1 81 ILE HA 1 81 ILE HG12 3.710 . 3.710 2.639 2.588 2.714 . 0 0 "[ . 1 . 2]" 1
1560 1 75 ARG HA 1 81 ILE HG12 4.170 . 4.170 3.659 3.518 3.814 . 0 0 "[ . 1 . 2]" 1
1561 1 32 ILE MG 1 50 ARG HA 4.400 . 4.400 4.327 3.980 4.480 0.080 10 0 "[ . 1 . 2]" 1
1562 1 88 ALA HA 1 90 LEU MD1 4.570 . 4.570 4.696 4.525 4.778 0.208 14 0 "[ . 1 . 2]" 1
1563 1 72 ILE MD 1 74 PHE HA 6.000 . 6.000 5.220 4.997 5.395 . 0 0 "[ . 1 . 2]" 1
1564 1 48 ILE MD 1 53 PRO HA 5.700 . 5.700 4.628 4.310 4.791 . 0 0 "[ . 1 . 2]" 1
1565 1 48 ILE MD 1 87 PRO HA 5.340 . 5.340 5.011 4.631 5.298 . 0 0 "[ . 1 . 2]" 1
1566 1 33 ASN HA 1 48 ILE MG 4.900 . 4.900 5.024 4.908 5.103 0.203 5 0 "[ . 1 . 2]" 1
1567 1 32 ILE MG 1 33 ASN HA 6.000 . 6.000 5.506 5.476 5.547 . 0 0 "[ . 1 . 2]" 1
1568 1 33 ASN HA 1 48 ILE MD 6.000 . 6.000 5.849 5.506 6.054 0.054 5 0 "[ . 1 . 2]" 1
1569 1 54 LEU HB3 1 87 PRO HA 4.390 . 4.390 4.007 3.434 4.465 0.075 17 0 "[ . 1 . 2]" 1
1570 1 54 LEU HA 1 54 LEU MD1 4.320 . 4.320 3.703 3.561 4.124 . 0 0 "[ . 1 . 2]" 1
1571 1 55 SER HA 1 57 LEU HG 4.800 . 4.800 4.588 4.454 4.709 . 0 0 "[ . 1 . 2]" 1
1572 1 91 GLU HA 1 92 MET HG2 4.980 . 4.980 4.452 4.253 4.655 . 0 0 "[ . 1 . 2]" 1
1573 1 57 LEU HG 1 58 MET HA 4.560 . 4.560 3.851 3.737 3.954 . 0 0 "[ . 1 . 2]" 1
1574 1 20 PRO HB3 1 21 LYS QE 5.770 . 5.770 5.084 4.087 5.911 0.141 3 0 "[ . 1 . 2]" 1
1575 1 61 TYR HB3 1 69 MET ME 4.660 . 4.660 4.300 4.183 4.426 . 0 0 "[ . 1 . 2]" 1
1576 1 19 LYS QE 1 20 PRO QG 6.000 . 6.000 5.525 3.612 6.174 0.174 12 0 "[ . 1 . 2]" 1
1577 1 73 ARG H 1 74 PHE H 4.330 . 4.330 4.243 4.124 4.293 . 0 0 "[ . 1 . 2]" 1
1578 1 105 THR H 1 106 GLY H 4.670 . 4.670 4.014 2.500 4.620 . 0 0 "[ . 1 . 2]" 1
1579 1 74 PHE HB3 1 98 ILE MG 3.730 . 3.730 2.304 2.120 2.475 . 0 0 "[ . 1 . 2]" 1
1580 1 98 ILE MG 1 99 ASP QB 4.120 . 4.120 3.934 3.809 4.079 . 0 0 "[ . 1 . 2]" 1
1581 1 39 GLN QG 1 101 PHE HB2 4.560 . 4.560 3.749 3.188 4.348 . 0 0 "[ . 1 . 2]" 1
1582 1 39 GLN QG 1 102 GLN HB2 4.310 . 4.310 3.277 2.481 4.245 . 0 0 "[ . 1 . 2]" 1
1583 1 59 LYS QE 1 59 LYS HG2 3.880 . 3.880 2.488 2.247 3.518 . 0 0 "[ . 1 . 2]" 1
1584 1 29 ASN H 1 30 ASP H 4.440 . 4.440 3.325 1.937 4.513 0.073 16 0 "[ . 1 . 2]" 1
1585 1 30 ASP H 1 31 HIS H 4.260 . 4.260 3.752 2.335 4.550 0.290 17 0 "[ . 1 . 2]" 1
1586 1 65 GLN HA 1 66 GLY QA 4.280 . 4.280 4.195 4.161 4.242 . 0 0 "[ . 1 . 2]" 1
1587 1 53 PRO HA 1 87 PRO QD 4.470 . 4.470 3.141 2.878 3.331 . 0 0 "[ . 1 . 2]" 1
1588 1 36 VAL MG2 1 61 TYR HB2 5.280 . 5.280 3.440 3.199 3.636 . 0 0 "[ . 1 . 2]" 1
1589 1 69 MET HB2 1 70 ARG QD 4.280 . 4.280 3.422 3.231 3.631 . 0 0 "[ . 1 . 2]" 1
1590 1 53 PRO HG2 1 56 LYS QE 4.880 . 4.880 3.828 1.809 4.702 . 0 0 "[ . 1 . 2]" 1
1591 1 59 LYS QB 1 59 LYS QE 4.310 . 4.310 2.815 1.876 3.805 . 0 0 "[ . 1 . 2]" 1
1592 1 35 LYS HE3 1 35 LYS HG3 3.370 . 3.370 3.015 2.320 3.195 . 0 0 "[ . 1 . 2]" 1
1593 1 74 PHE HB2 1 81 ILE MG 4.000 . 4.000 3.662 3.548 3.859 . 0 0 "[ . 1 . 2]" 1
1594 1 81 ILE MG 1 85 ASP HB2 4.280 . 4.280 3.060 2.289 4.047 . 0 0 "[ . 1 . 2]" 1
1595 1 59 LYS QE 1 59 LYS HG3 3.880 . 3.880 2.941 2.347 3.391 . 0 0 "[ . 1 . 2]" 1
1596 1 74 PHE HB2 1 81 ILE HB 3.620 . 3.620 2.345 2.188 2.441 . 0 0 "[ . 1 . 2]" 1
1597 1 35 LYS HE3 1 97 THR MG 4.520 . 4.520 4.084 3.752 4.529 0.009 12 0 "[ . 1 . 2]" 1
1598 1 76 PHE HB3 1 81 ILE MD 4.040 . 4.040 2.672 2.457 2.877 . 0 0 "[ . 1 . 2]" 1
1599 1 75 ARG HB3 1 75 ARG HD2 3.840 . 3.840 2.168 1.953 2.600 . 0 0 "[ . 1 . 2]" 1
1600 1 59 LYS HG3 1 69 MET QG 4.530 . 4.530 4.457 4.163 4.723 0.193 13 0 "[ . 1 . 2]" 1
1601 1 32 ILE MD 1 87 PRO HG2 4.120 . 4.120 3.649 3.363 3.950 . 0 0 "[ . 1 . 2]" 1
1602 1 76 PHE HB2 1 92 MET ME 4.560 . 4.560 3.519 3.252 3.774 . 0 0 "[ . 1 . 2]" 1
1603 1 76 PHE HB2 1 81 ILE HG12 4.470 . 4.470 3.360 3.098 3.537 . 0 0 "[ . 1 . 2]" 1
1604 1 26 THR H 1 27 GLU H 5.350 . 5.350 4.186 1.837 4.643 . 0 0 "[ . 1 . 2]" 1
1605 1 52 THR HA 1 53 PRO HD2 3.410 . 3.410 2.158 2.064 2.385 . 0 0 "[ . 1 . 2]" 1
1606 1 76 PHE HB3 1 90 LEU MD2 3.610 . 3.610 2.285 2.029 2.499 . 0 0 "[ . 1 . 2]" 1
1607 1 76 PHE HB3 1 92 MET ME 4.110 . 4.110 3.871 3.649 4.047 . 0 0 "[ . 1 . 2]" 1
1608 1 76 PHE HB2 1 81 ILE MD 3.690 . 3.690 1.886 1.837 1.938 . 0 0 "[ . 1 . 2]" 1
1609 1 35 LYS HE3 1 35 LYS HG2 3.830 . 3.830 3.746 3.544 3.822 . 0 0 "[ . 1 . 2]" 1
1610 1 35 LYS HB2 1 97 THR MG 4.050 . 4.050 3.641 3.276 4.080 0.030 5 0 "[ . 1 . 2]" 1
1611 1 75 ARG HB2 1 75 ARG HD2 3.780 . 3.780 3.260 2.785 3.669 . 0 0 "[ . 1 . 2]" 1
1612 1 74 PHE HB3 1 81 ILE MG 4.030 . 4.030 3.902 3.814 4.034 0.004 1 0 "[ . 1 . 2]" 1
1613 1 61 TYR QE 1 74 PHE QE 4.320 . 4.320 4.210 4.089 4.349 0.029 7 0 "[ . 1 . 2]" 1
1614 1 56 LYS QE 1 56 LYS HG2 3.470 . 3.470 2.687 2.209 3.322 . 0 0 "[ . 1 . 2]" 1
1615 1 81 ILE MG 1 85 ASP HB3 3.350 . 3.350 3.038 2.489 3.488 0.138 7 0 "[ . 1 . 2]" 1
1616 1 79 GLN HG3 1 90 LEU MD2 3.550 . 3.550 3.180 2.906 3.382 . 0 0 "[ . 1 . 2]" 1
1617 1 89 GLN HB2 1 90 LEU MD1 3.730 . 3.730 3.264 2.743 3.798 0.068 9 0 "[ . 1 . 2]" 1
1618 1 81 ILE HG13 1 98 ILE MG 4.380 . 4.380 3.781 3.661 3.844 . 0 0 "[ . 1 . 2]" 1
1619 1 32 ILE MD 1 92 MET HB2 5.190 . 5.190 4.359 3.971 4.698 . 0 0 "[ . 1 . 2]" 1
1620 1 32 ILE MD 1 92 MET HG2 3.830 . 3.830 3.059 2.701 3.353 . 0 0 "[ . 1 . 2]" 1
1621 1 89 GLN HB3 1 90 LEU HG 3.510 . 3.510 3.156 2.415 3.600 0.090 18 0 "[ . 1 . 2]" 1
1622 1 72 ILE HB 1 72 ILE HG13 3.020 . 3.020 2.413 2.391 2.435 . 0 0 "[ . 1 . 2]" 1
1623 1 67 LEU HB3 1 72 ILE MG 3.380 . 3.380 2.239 2.078 2.658 . 0 0 "[ . 1 . 2]" 1
1624 1 50 ARG HB3 1 88 ALA MB 3.710 . 3.710 3.803 3.618 3.920 0.210 18 0 "[ . 1 . 2]" 1
1625 1 54 LEU HB3 1 54 LEU MD1 3.590 . 3.590 2.973 2.210 3.217 . 0 0 "[ . 1 . 2]" 1
1626 1 37 ALA MB 1 97 THR MG 2.710 . 2.710 2.192 2.057 2.422 . 0 0 "[ . 1 . 2]" 1
1627 1 72 ILE MD 1 100 VAL MG1 3.520 . 3.520 1.970 1.895 2.075 . 0 0 "[ . 1 . 2]" 1
1628 1 32 ILE MD 1 34 LEU MD1 2.980 . 2.980 2.263 2.026 2.430 . 0 0 "[ . 1 . 2]" 1
1629 1 61 TYR QD 1 74 PHE HZ 2.670 . 2.670 2.208 2.023 2.337 . 0 0 "[ . 1 . 2]" 1
1630 1 74 PHE HB3 1 75 ARG H 4.180 . 4.180 2.942 2.807 3.027 . 0 0 "[ . 1 . 2]" 1
1631 1 75 ARG H 1 75 ARG HD2 5.220 . 5.220 4.439 4.171 4.953 . 0 0 "[ . 1 . 2]" 1
1632 1 33 ASN HB2 1 95 GLU H 4.790 . 4.790 3.913 2.090 4.450 . 0 0 "[ . 1 . 2]" 1
1633 1 46 PHE H 1 46 PHE HB3 3.970 . 3.970 3.893 3.836 3.934 . 0 0 "[ . 1 . 2]" 1
1634 1 32 ILE MD 1 34 LEU H 5.970 . 5.970 5.335 5.193 5.436 . 0 0 "[ . 1 . 2]" 1
1635 1 46 PHE QE 1 61 TYR H 4.860 . 4.860 3.831 3.421 4.158 . 0 0 "[ . 1 . 2]" 1
1636 1 68 SER H 1 72 ILE H 4.700 . 4.700 4.151 3.904 4.431 . 0 0 "[ . 1 . 2]" 1
1637 1 86 THR HB 1 89 GLN H 4.960 . 4.960 3.201 2.795 3.503 . 0 0 "[ . 1 . 2]" 1
1638 1 63 GLU H 1 74 PHE HZ 6.000 . 6.000 5.798 5.538 5.936 . 0 0 "[ . 1 . 2]" 1
1639 1 69 MET HA 1 74 PHE QD 6.000 . 6.000 5.093 4.784 5.307 . 0 0 "[ . 1 . 2]" 1
1640 1 31 HIS HD2 1 49 LYS HA 6.000 . 6.000 5.498 4.357 5.911 . 0 0 "[ . 1 . 2]" 1
1641 1 75 ARG HD2 1 76 PHE HA 5.770 . 5.770 4.395 2.781 5.554 . 0 0 "[ . 1 . 2]" 1
1642 1 38 GLY H 1 39 GLN HA 5.580 . 5.580 5.429 5.250 5.586 0.006 7 0 "[ . 1 . 2]" 1
1643 1 76 PHE H 1 78 GLY HA2 5.730 . 5.730 5.112 4.941 5.316 . 0 0 "[ . 1 . 2]" 1
1644 1 44 VAL HA 1 64 ARG HD2 6.000 . 6.000 6.028 5.188 6.172 0.172 15 0 "[ . 1 . 2]" 1
1645 1 76 PHE HB3 1 98 ILE MG 4.860 . 4.860 4.494 4.303 4.637 . 0 0 "[ . 1 . 2]" 1
1646 1 90 LEU H 1 92 MET HB3 4.810 . 4.810 4.867 4.740 4.916 0.106 15 0 "[ . 1 . 2]" 1
1647 1 48 ILE HG13 1 52 THR H 4.750 . 4.750 4.725 4.533 4.798 0.048 7 0 "[ . 1 . 2]" 1
1648 1 36 VAL H 1 37 ALA H 5.270 . 5.270 4.341 4.303 4.367 . 0 0 "[ . 1 . 2]" 1
1649 1 36 VAL MG1 1 61 TYR H 6.000 . 6.000 5.231 4.666 5.877 . 0 0 "[ . 1 . 2]" 1
1650 1 75 ARG HA 1 101 PHE QE 4.590 . 4.590 4.138 3.991 4.261 . 0 0 "[ . 1 . 2]" 1
1651 1 45 GLN HA 1 46 PHE QD 4.520 . 4.520 3.224 3.155 3.274 . 0 0 "[ . 1 . 2]" 1
1652 1 35 LYS H 1 97 THR HA 3.930 . 3.930 3.458 3.100 3.796 . 0 0 "[ . 1 . 2]" 1
1653 1 86 THR HA 1 88 ALA H 4.510 . 4.510 4.164 4.043 4.293 . 0 0 "[ . 1 . 2]" 1
1654 1 71 GLN H 1 72 ILE HA 5.040 . 5.040 4.959 4.888 5.006 . 0 0 "[ . 1 . 2]" 1
1655 1 82 ASN HA 1 84 THR H 4.100 . 4.100 3.938 3.888 4.115 0.015 11 0 "[ . 1 . 2]" 1
1656 1 72 ILE HA 1 101 PHE QD 5.120 . 5.120 4.945 4.820 5.083 . 0 0 "[ . 1 . 2]" 1
1657 1 43 VAL HA 1 44 VAL H 3.150 . 3.150 2.190 2.150 2.228 . 0 0 "[ . 1 . 2]" 1
1658 1 43 VAL HA 1 61 TYR QD 4.980 . 4.980 4.900 4.722 5.043 0.063 16 0 "[ . 1 . 2]" 1
1659 1 43 VAL HA 1 61 TYR QE 4.620 . 4.620 3.314 2.983 3.563 . 0 0 "[ . 1 . 2]" 1
1660 1 35 LYS HA 1 46 PHE H 4.300 . 4.300 3.440 3.312 3.567 . 0 0 "[ . 1 . 2]" 1
1661 1 35 LYS HA 1 46 PHE QE 4.060 . 4.060 3.635 3.456 3.841 . 0 0 "[ . 1 . 2]" 1
1662 1 48 ILE HA 1 49 LYS H 3.520 . 3.520 2.453 2.385 2.607 . 0 0 "[ . 1 . 2]" 1
1663 1 68 SER HA 1 70 ARG H 4.250 . 4.250 4.083 3.977 4.210 . 0 0 "[ . 1 . 2]" 1
1664 1 68 SER HA 1 69 MET H 3.300 . 3.300 2.337 2.273 2.381 . 0 0 "[ . 1 . 2]" 1
1665 1 84 THR H 1 85 ASP HA 4.890 . 4.890 4.897 4.729 5.005 0.115 19 0 "[ . 1 . 2]" 1
1666 1 100 VAL HA 1 101 PHE QE 4.290 . 4.290 4.321 4.281 4.359 0.069 17 0 "[ . 1 . 2]" 1
1667 1 46 PHE HA 1 46 PHE QD 3.830 . 3.830 3.116 3.058 3.162 . 0 0 "[ . 1 . 2]" 1
1668 1 100 VAL HA 1 101 PHE QD 3.420 . 3.420 3.416 3.221 3.520 0.100 9 0 "[ . 1 . 2]" 1
1669 1 102 GLN HA 1 102 GLN HE22 4.660 . 4.660 3.615 3.424 3.848 . 0 0 "[ . 1 . 2]" 1
1670 1 73 ARG HA 1 74 PHE QE 4.820 . 4.820 4.320 4.119 4.495 . 0 0 "[ . 1 . 2]" 1
1671 1 38 GLY HA2 1 40 ASP H 4.270 . 4.270 4.016 3.854 4.280 0.010 1 0 "[ . 1 . 2]" 1
1672 1 81 ILE HA 1 82 ASN HD21 5.110 . 5.110 4.142 3.747 4.587 . 0 0 "[ . 1 . 2]" 1
1673 1 27 GLU HA 1 28 ASN HD21 5.010 . 5.010 4.216 3.046 5.279 0.269 14 0 "[ . 1 . 2]" 1
1674 1 70 ARG QD 1 72 ILE H 5.650 . 5.650 5.437 5.218 5.684 0.034 3 0 "[ . 1 . 2]" 1
1675 1 62 CYS H 1 62 CYS HB3 3.800 . 3.800 3.016 2.598 3.584 . 0 0 "[ . 1 . 2]" 1
1676 1 46 PHE QE 1 64 ARG HD2 4.480 . 4.480 3.484 3.022 3.872 . 0 0 "[ . 1 . 2]" 1
1677 1 69 MET QG 1 74 PHE QE 4.560 . 4.560 4.314 4.191 4.432 . 0 0 "[ . 1 . 2]" 1
1678 1 99 ASP QB 1 101 PHE QD 3.700 . 3.700 3.589 3.193 3.882 0.182 5 0 "[ . 1 . 2]" 1
1679 1 84 THR H 1 85 ASP HB3 5.550 . 5.550 5.499 4.873 5.845 0.295 19 0 "[ . 1 . 2]" 1
1680 1 76 PHE H 1 79 GLN HG2 4.670 . 4.670 4.214 4.061 4.418 . 0 0 "[ . 1 . 2]" 1
1681 1 71 GLN HB2 1 71 GLN HE21 4.130 . 4.130 3.499 2.681 3.889 . 0 0 "[ . 1 . 2]" 1
1682 1 83 GLU HG2 1 84 THR H 4.450 . 4.450 3.139 2.629 4.411 . 0 0 "[ . 1 . 2]" 1
1683 1 22 GLU QG 1 23 GLY H 4.710 . 4.710 3.991 3.302 4.861 0.151 5 0 "[ . 1 . 2]" 1
1684 1 93 GLU HG2 1 94 ASP H 5.360 . 5.360 4.491 4.132 4.776 . 0 0 "[ . 1 . 2]" 1
1685 1 101 PHE QD 1 103 GLN QG 4.270 . 4.270 2.548 1.975 3.320 . 0 0 "[ . 1 . 2]" 1
1686 1 45 GLN H 1 45 GLN HG2 4.200 . 4.200 4.182 4.114 4.227 0.027 8 0 "[ . 1 . 2]" 1
1687 1 45 GLN HG3 1 46 PHE H 4.500 . 4.500 4.449 4.385 4.533 0.033 5 0 "[ . 1 . 2]" 1
1688 1 27 GLU H 1 27 GLU QB 3.370 . 3.370 2.731 2.295 3.422 0.052 8 0 "[ . 1 . 2]" 1
1689 1 27 GLU QB 1 28 ASN H 3.670 . 3.670 2.997 1.766 3.957 0.287 2 0 "[ . 1 . 2]" 1
1690 1 70 ARG HB3 1 70 ARG HE 4.150 . 4.150 2.200 1.830 2.606 . 0 0 "[ . 1 . 2]" 1
1691 1 70 ARG HB2 1 70 ARG HE 3.970 . 3.970 3.251 2.959 3.540 . 0 0 "[ . 1 . 2]" 1
1692 1 75 ARG HB3 1 99 ASP H 4.870 . 4.870 3.874 3.533 4.154 . 0 0 "[ . 1 . 2]" 1
1693 1 98 ILE HB 1 99 ASP H 5.130 . 5.130 3.961 3.870 4.056 . 0 0 "[ . 1 . 2]" 1
1694 1 73 ARG HB2 1 101 PHE HZ 4.500 . 4.500 3.724 3.292 4.270 . 0 0 "[ . 1 . 2]" 1
1695 1 75 ARG HB3 1 75 ARG HE 4.950 . 4.950 3.810 2.392 4.354 . 0 0 "[ . 1 . 2]" 1
1696 1 65 GLN QG 1 67 LEU H 4.710 . 4.710 4.979 4.717 5.106 0.396 8 0 "[ . 1 . 2]" 1
1697 1 98 ILE HG13 1 99 ASP H 6.000 . 6.000 5.335 5.217 5.438 . 0 0 "[ . 1 . 2]" 1
1698 1 59 LYS H 1 59 LYS HG3 3.330 . 3.330 2.713 2.269 3.588 0.258 7 0 "[ . 1 . 2]" 1
1699 1 55 SER H 1 58 MET ME 4.270 . 4.270 3.509 3.215 4.338 0.068 13 0 "[ . 1 . 2]" 1
1700 1 49 LYS H 1 52 THR MG 3.240 . 3.240 2.717 2.472 2.912 . 0 0 "[ . 1 . 2]" 1
1701 1 46 PHE QD 1 57 LEU HB2 3.770 . 3.770 2.894 2.776 2.960 . 0 0 "[ . 1 . 2]" 1
1702 1 73 ARG HB3 1 103 GLN HE21 5.120 . 5.120 4.749 3.675 5.301 0.181 2 0 "[ . 1 . 2]" 1
1703 1 46 PHE HZ 1 57 LEU HB2 4.460 . 4.460 4.011 3.567 4.419 . 0 0 "[ . 1 . 2]" 1
1704 1 75 ARG HG2 1 76 PHE H 4.060 . 4.060 2.282 1.943 2.590 . 0 0 "[ . 1 . 2]" 1
1705 1 35 LYS HG2 1 46 PHE QD 4.680 . 4.680 4.791 4.708 4.868 0.188 12 0 "[ . 1 . 2]" 1
1706 1 90 LEU H 1 92 MET ME 5.210 . 5.210 5.321 5.277 5.369 0.159 4 0 "[ . 1 . 2]" 1
1707 1 97 THR MG 1 99 ASP H 5.480 . 5.480 4.631 4.410 4.881 . 0 0 "[ . 1 . 2]" 1
1708 1 44 VAL MG2 1 45 GLN HE22 4.710 . 4.710 4.726 4.664 4.785 0.075 8 0 "[ . 1 . 2]" 1
1709 1 76 PHE QD 1 98 ILE MG 3.820 . 3.820 3.908 3.822 4.048 0.228 11 0 "[ . 1 . 2]" 1
1710 1 86 THR MG 1 88 ALA H 3.900 . 3.900 3.657 2.346 3.991 0.091 8 0 "[ . 1 . 2]" 1
1711 1 81 ILE MG 1 82 ASN HD21 5.050 . 5.050 4.245 4.079 4.425 . 0 0 "[ . 1 . 2]" 1
1712 1 48 ILE MG 1 49 LYS H 3.980 . 3.980 3.757 3.627 3.819 . 0 0 "[ . 1 . 2]" 1
1713 1 44 VAL MG1 1 46 PHE H 5.920 . 5.920 4.787 4.573 4.944 . 0 0 "[ . 1 . 2]" 1
1714 1 46 PHE H 1 48 ILE MG 6.000 . 6.000 5.338 5.111 5.518 . 0 0 "[ . 1 . 2]" 1
1715 1 44 VAL MG1 1 46 PHE HZ 2.930 . 2.930 2.610 2.466 2.839 . 0 0 "[ . 1 . 2]" 1
1716 1 71 GLN H 1 72 ILE MD 5.880 . 5.880 5.177 5.066 5.283 . 0 0 "[ . 1 . 2]" 1
1717 1 57 LEU HG 1 60 ALA H 5.580 . 5.580 5.633 5.595 5.676 0.096 2 0 "[ . 1 . 2]" 1
1718 1 74 PHE QD 1 81 ILE MD 3.460 . 3.460 3.461 3.326 3.531 0.071 4 0 "[ . 1 . 2]" 1
1719 1 74 PHE HZ 1 100 VAL MG1 5.110 . 5.110 4.334 4.075 4.581 . 0 0 "[ . 1 . 2]" 1
1720 1 32 ILE MD 1 96 ASP H 4.870 . 4.870 4.870 4.654 4.967 0.097 14 0 "[ . 1 . 2]" 1
1721 1 57 LEU MD2 1 58 MET H 4.170 . 4.170 3.947 3.849 4.012 . 0 0 "[ . 1 . 2]" 1
1722 1 57 LEU MD1 1 58 MET H 3.810 . 3.810 2.882 2.791 2.952 . 0 0 "[ . 1 . 2]" 1
1723 1 46 PHE QE 1 57 LEU MD1 3.710 . 3.710 2.604 2.332 2.835 . 0 0 "[ . 1 . 2]" 1
1724 1 46 PHE QD 1 57 LEU MD1 3.660 . 3.660 2.802 2.634 2.993 . 0 0 "[ . 1 . 2]" 1
1725 1 57 LEU MD1 1 74 PHE QE 3.630 . 3.630 3.364 3.115 3.601 . 0 0 "[ . 1 . 2]" 1
1726 1 36 VAL MG1 1 74 PHE QE 4.310 . 4.310 2.707 1.919 3.405 . 0 0 "[ . 1 . 2]" 1
1727 1 37 ALA HA 1 43 VAL HA 4.050 . 4.050 2.405 2.255 2.553 . 0 0 "[ . 1 . 2]" 1
1728 1 35 LYS HA 1 45 GLN HA 4.300 . 4.300 2.309 2.258 2.361 . 0 0 "[ . 1 . 2]" 1
1729 1 74 PHE HA 1 100 VAL HA 3.840 . 3.840 2.593 2.516 2.665 . 0 0 "[ . 1 . 2]" 1
1730 1 75 ARG HA 1 80 PRO HA 4.600 . 4.600 2.333 2.229 2.473 . 0 0 "[ . 1 . 2]" 1
1731 1 76 PHE HA 1 81 ILE HG12 4.960 . 4.960 4.984 4.776 5.038 0.078 6 0 "[ . 1 . 2]" 1
1732 1 69 MET HB2 1 70 ARG HA 4.860 . 4.860 4.802 4.747 4.893 0.033 18 0 "[ . 1 . 2]" 1
1733 1 54 LEU HG 1 87 PRO QD 4.840 . 4.840 3.094 2.311 4.683 . 0 0 "[ . 1 . 2]" 1
1734 1 24 VAL QG 1 26 THR HB 5.660 . 5.660 4.384 3.006 5.700 0.040 6 0 "[ . 1 . 2]" 1
1735 1 48 ILE MD 1 87 PRO QD 4.580 . 4.580 3.070 2.789 3.311 . 0 0 "[ . 1 . 2]" 1
1736 1 54 LEU MD2 1 55 SER HA 5.280 . 5.280 4.817 2.876 5.365 0.085 16 0 "[ . 1 . 2]" 1
1737 1 54 LEU MD1 1 55 SER HA 5.280 . 5.280 3.381 2.779 5.354 0.074 17 0 "[ . 1 . 2]" 1
1738 1 33 ASN HA 1 34 LEU HB3 5.780 . 5.780 5.684 5.660 5.724 . 0 0 "[ . 1 . 2]" 1
1739 1 98 ILE HB 1 99 ASP HA 4.940 . 4.940 4.791 4.653 4.928 . 0 0 "[ . 1 . 2]" 1
1740 1 74 PHE HA 1 81 ILE HB 4.950 . 4.950 4.793 4.744 4.849 . 0 0 "[ . 1 . 2]" 1
1741 1 99 ASP HA 1 100 VAL HB 5.610 . 5.610 4.603 4.537 4.716 . 0 0 "[ . 1 . 2]" 1
1742 1 37 ALA HA 1 43 VAL MG1 4.010 . 4.010 4.027 2.864 4.254 0.244 14 0 "[ . 1 . 2]" 1
1743 1 75 ARG HA 1 76 PHE HB2 4.530 . 4.530 4.446 4.372 4.512 . 0 0 "[ . 1 . 2]" 1
1744 1 75 ARG HA 1 75 ARG HG2 3.860 . 3.860 2.646 2.489 2.804 . 0 0 "[ . 1 . 2]" 1
1745 1 75 ARG HA 1 81 ILE MD 4.160 . 4.160 3.431 3.302 3.537 . 0 0 "[ . 1 . 2]" 1
1746 1 75 ARG HA 1 99 ASP QB 5.010 . 5.010 4.672 4.408 4.979 . 0 0 "[ . 1 . 2]" 1
1747 1 35 LYS HB2 1 97 THR HA 3.980 . 3.980 2.805 2.604 3.035 . 0 0 "[ . 1 . 2]" 1
1748 1 97 THR HA 1 98 ILE HB 4.930 . 4.930 4.629 4.579 4.681 . 0 0 "[ . 1 . 2]" 1
1749 1 53 PRO HB3 1 86 THR HA 5.380 . 5.380 4.698 4.198 5.029 . 0 0 "[ . 1 . 2]" 1
1750 1 34 LEU HA 1 35 LYS HB2 4.930 . 4.930 4.527 4.486 4.564 . 0 0 "[ . 1 . 2]" 1
1751 1 34 LEU HA 1 35 LYS HG3 4.640 . 4.640 3.622 3.514 3.718 . 0 0 "[ . 1 . 2]" 1
1752 1 34 LEU HA 1 34 LEU MD2 3.880 . 3.880 3.071 3.019 3.120 . 0 0 "[ . 1 . 2]" 1
1753 1 34 LEU HA 1 34 LEU MD1 3.880 . 3.880 1.999 1.939 2.093 . 0 0 "[ . 1 . 2]" 1
1754 1 86 THR HA 1 87 PRO HG2 4.620 . 4.620 4.400 4.242 4.531 . 0 0 "[ . 1 . 2]" 1
1755 1 54 LEU HG 1 86 THR HA 5.310 . 5.310 3.325 2.374 5.519 0.209 6 0 "[ . 1 . 2]" 1
1756 1 54 LEU MD2 1 86 THR HA 4.500 . 4.500 3.357 2.423 4.029 . 0 0 "[ . 1 . 2]" 1
1757 1 82 ASN HA 1 83 GLU HB3 4.710 . 4.710 4.612 4.516 4.769 0.059 15 0 "[ . 1 . 2]" 1
1758 1 72 ILE HA 1 102 GLN HG3 4.750 . 4.750 4.147 3.977 4.472 . 0 0 "[ . 1 . 2]" 1
1759 1 58 MET ME 1 82 ASN HA 3.530 . 3.530 3.309 2.883 3.551 0.021 15 0 "[ . 1 . 2]" 1
1760 1 81 ILE MG 1 82 ASN HA 4.520 . 4.520 3.686 3.576 3.756 . 0 0 "[ . 1 . 2]" 1
1761 1 37 ALA MB 1 43 VAL HA 4.010 . 4.010 3.775 3.552 3.994 . 0 0 "[ . 1 . 2]" 1
1762 1 72 ILE HA 1 72 ILE HG12 4.070 . 4.070 3.732 3.709 3.758 . 0 0 "[ . 1 . 2]" 1
1763 1 43 VAL HA 1 44 VAL MG2 3.740 . 3.740 3.310 3.210 3.405 . 0 0 "[ . 1 . 2]" 1
1764 1 43 VAL HA 1 43 VAL MG1 3.180 . 3.180 3.069 2.340 3.200 0.020 11 0 "[ . 1 . 2]" 1
1765 1 72 ILE HA 1 72 ILE MD 4.230 . 4.230 4.199 4.181 4.208 . 0 0 "[ . 1 . 2]" 1
1766 1 79 GLN HA 1 79 GLN HG2 3.810 . 3.810 3.718 3.667 3.826 0.016 3 0 "[ . 1 . 2]" 1
1767 1 35 LYS HA 1 45 GLN HG3 4.600 . 4.600 3.596 3.485 3.694 . 0 0 "[ . 1 . 2]" 1
1768 1 31 HIS HA 1 49 LYS HB3 4.590 . 4.590 4.004 3.627 4.253 . 0 0 "[ . 1 . 2]" 1
1769 1 35 LYS HA 1 45 GLN HB3 5.140 . 5.140 4.359 4.262 4.445 . 0 0 "[ . 1 . 2]" 1
1770 1 36 VAL HA 1 98 ILE HB 3.860 . 3.860 1.890 1.802 2.024 . 0 0 "[ . 1 . 2]" 1
1771 1 36 VAL HA 1 37 ALA MB 3.970 . 3.970 3.928 3.903 3.966 . 0 0 "[ . 1 . 2]" 1
1772 1 35 LYS HA 1 35 LYS HG3 3.910 . 3.910 3.172 3.108 3.234 . 0 0 "[ . 1 . 2]" 1
1773 1 36 VAL HA 1 97 THR MG 3.900 . 3.900 3.557 3.057 3.904 0.004 4 0 "[ . 1 . 2]" 1
1774 1 48 ILE HA 1 48 ILE HG12 3.990 . 3.990 3.802 3.752 3.846 . 0 0 "[ . 1 . 2]" 1
1775 1 35 LYS HA 1 35 LYS HG2 3.660 . 3.660 2.525 2.471 2.583 . 0 0 "[ . 1 . 2]" 1
1776 1 92 MET ME 1 96 ASP HA 5.820 . 5.820 5.180 4.915 5.677 . 0 0 "[ . 1 . 2]" 1
1777 1 50 ARG HG3 1 51 HIS HA 4.700 . 4.700 4.118 3.525 4.889 0.189 13 0 "[ . 1 . 2]" 1
1778 1 68 SER HA 1 69 MET ME 5.840 . 5.840 5.330 5.100 5.534 . 0 0 "[ . 1 . 2]" 1
1779 1 79 GLN HB2 1 80 PRO HA 6.000 . 6.000 4.972 4.897 5.072 . 0 0 "[ . 1 . 2]" 1
1780 1 101 PHE HA 1 102 GLN HB3 6.000 . 6.000 5.001 4.906 5.470 . 0 0 "[ . 1 . 2]" 1
1781 1 45 GLN HB2 1 46 PHE HA 4.990 . 4.990 4.646 4.551 4.718 . 0 0 "[ . 1 . 2]" 1
1782 1 80 PRO HA 1 81 ILE HB 5.550 . 5.550 4.763 4.690 4.823 . 0 0 "[ . 1 . 2]" 1
1783 1 72 ILE HB 1 100 VAL HA 6.000 . 6.000 4.605 4.485 4.752 . 0 0 "[ . 1 . 2]" 1
1784 1 72 ILE HB 1 101 PHE HA 6.000 . 6.000 4.910 4.797 4.993 . 0 0 "[ . 1 . 2]" 1
1785 1 75 ARG HB2 1 80 PRO HA 4.370 . 4.370 2.882 2.664 3.208 . 0 0 "[ . 1 . 2]" 1
1786 1 75 ARG HG2 1 80 PRO HA 4.000 . 4.000 3.524 2.717 4.005 0.005 15 0 "[ . 1 . 2]" 1
1787 1 72 ILE HG13 1 100 VAL HA 5.370 . 5.370 5.460 5.427 5.500 0.130 1 0 "[ . 1 . 2]" 1
1788 1 98 ILE MG 1 100 VAL HA 4.400 . 4.400 4.062 3.995 4.131 . 0 0 "[ . 1 . 2]" 1
1789 1 72 ILE MD 1 100 VAL HA 5.290 . 5.290 4.859 4.728 5.034 . 0 0 "[ . 1 . 2]" 1
1790 1 80 PRO HA 1 81 ILE HG13 4.190 . 4.190 3.552 3.441 3.666 . 0 0 "[ . 1 . 2]" 1
1791 1 67 LEU HA 1 67 LEU MD2 4.160 . 4.160 2.936 2.765 3.803 . 0 0 "[ . 1 . 2]" 1
1792 1 73 ARG HA 1 103 GLN QG 4.480 . 4.480 4.249 3.836 4.607 0.127 7 0 "[ . 1 . 2]" 1
1793 1 72 ILE HB 1 102 GLN HA 3.770 . 3.770 3.606 3.453 3.735 . 0 0 "[ . 1 . 2]" 1
1794 1 73 ARG HA 1 73 ARG HG3 3.970 . 3.970 3.627 3.584 3.658 . 0 0 "[ . 1 . 2]" 1
1795 1 72 ILE HG12 1 73 ARG HA 5.220 . 5.220 4.607 4.547 4.676 . 0 0 "[ . 1 . 2]" 1
1796 1 72 ILE HG13 1 73 ARG HA 4.440 . 4.440 3.244 3.154 3.375 . 0 0 "[ . 1 . 2]" 1
1797 1 31 HIS HB2 1 32 ILE HA 5.130 . 5.130 4.681 4.410 5.664 0.534 19 1 "[ . 1 . +2]" 1
1798 1 73 ARG HA 1 73 ARG HG2 3.470 . 3.470 2.733 2.594 2.880 . 0 0 "[ . 1 . 2]" 1
1799 1 32 ILE HA 1 32 ILE HG12 4.070 . 4.070 3.760 3.728 3.817 . 0 0 "[ . 1 . 2]" 1
1800 1 32 ILE HA 1 32 ILE MD 4.470 . 4.470 4.197 4.155 4.209 . 0 0 "[ . 1 . 2]" 1
1801 1 98 ILE HA 1 99 ASP QB 4.700 . 4.700 4.189 4.005 4.428 . 0 0 "[ . 1 . 2]" 1
1802 1 38 GLY HA2 1 100 VAL HB 4.650 . 4.650 2.064 1.850 2.321 . 0 0 "[ . 1 . 2]" 1
1803 1 97 THR MG 1 98 ILE HA 4.170 . 4.170 4.039 3.850 4.260 0.090 4 0 "[ . 1 . 2]" 1
1804 1 34 LEU MD2 1 94 ASP HA 4.650 . 4.650 3.819 3.618 3.981 . 0 0 "[ . 1 . 2]" 1
1805 1 98 ILE HA 1 98 ILE HG12 4.030 . 4.030 3.094 2.999 3.181 . 0 0 "[ . 1 . 2]" 1
1806 1 38 GLY HA2 1 39 GLN QG 4.480 . 4.480 3.809 3.632 4.156 . 0 0 "[ . 1 . 2]" 1
1807 1 34 LEU MD1 1 94 ASP HA 4.650 . 4.650 3.200 3.019 3.419 . 0 0 "[ . 1 . 2]" 1
1808 1 81 ILE MD 1 98 ILE HA 5.020 . 5.020 3.728 3.566 3.875 . 0 0 "[ . 1 . 2]" 1
1809 1 32 ILE MG 1 93 GLU HA 4.200 . 4.200 3.539 2.796 4.223 0.023 5 0 "[ . 1 . 2]" 1
1810 1 93 GLU HA 1 93 GLU HG2 3.670 . 3.670 3.707 3.643 3.764 0.094 15 0 "[ . 1 . 2]" 1
1811 1 31 HIS HB2 1 49 LYS HA 4.300 . 4.300 2.929 2.487 3.525 . 0 0 "[ . 1 . 2]" 1
1812 1 49 LYS HA 1 52 THR MG 5.030 . 5.030 4.960 4.636 5.051 0.021 3 0 "[ . 1 . 2]" 1
1813 1 31 HIS HB3 1 49 LYS HA 4.370 . 4.370 2.947 2.121 4.647 0.277 19 0 "[ . 1 . 2]" 1
1814 1 25 LYS HA 1 25 LYS QD 3.690 . 3.690 2.701 1.847 3.949 0.259 14 0 "[ . 1 . 2]" 1
1815 1 86 THR HB 1 87 PRO HG2 4.530 . 4.530 3.905 3.473 4.713 0.183 2 0 "[ . 1 . 2]" 1
1816 1 19 LYS HA 1 19 LYS QG 3.640 . 3.640 2.790 2.307 3.364 . 0 0 "[ . 1 . 2]" 1
1817 1 81 ILE HA 1 81 ILE MD 3.930 . 3.930 3.873 3.851 3.904 . 0 0 "[ . 1 . 2]" 1
1818 1 25 LYS HA 1 25 LYS QG 3.650 . 3.650 2.656 2.284 3.386 . 0 0 "[ . 1 . 2]" 1
1819 1 81 ILE HA 1 81 ILE HG13 4.050 . 4.050 3.181 3.131 3.239 . 0 0 "[ . 1 . 2]" 1
1820 1 25 LYS HA 1 26 THR MG 4.580 . 4.580 3.899 3.508 4.594 0.014 6 0 "[ . 1 . 2]" 1
1821 1 62 CYS HB3 1 69 MET HA 4.990 . 4.990 4.429 4.140 4.619 . 0 0 "[ . 1 . 2]" 1
1822 1 60 ALA HA 1 63 GLU HG3 4.200 . 4.200 3.611 2.814 4.058 . 0 0 "[ . 1 . 2]" 1
1823 1 21 LYS HA 1 21 LYS QE 6.000 . 6.000 5.121 3.873 5.561 . 0 0 "[ . 1 . 2]" 1
1824 1 21 LYS QE 1 22 GLU HA 6.000 . 6.000 5.217 4.119 6.173 0.173 19 0 "[ . 1 . 2]" 1
1825 1 87 PRO HA 1 90 LEU MD1 3.740 . 3.740 2.220 2.089 2.462 . 0 0 "[ . 1 . 2]" 1
1826 1 61 TYR HA 1 65 GLN HB2 4.880 . 4.880 4.728 4.441 4.917 0.037 14 0 "[ . 1 . 2]" 1
1827 1 36 VAL MG2 1 61 TYR HA 5.870 . 5.870 5.282 5.114 5.368 . 0 0 "[ . 1 . 2]" 1
1828 1 59 LYS HA 1 59 LYS HG2 3.770 . 3.770 2.437 2.256 2.826 . 0 0 "[ . 1 . 2]" 1
1829 1 22 GLU QG 1 23 GLY QA 5.480 . 5.480 4.777 3.585 5.518 0.038 14 0 "[ . 1 . 2]" 1
1830 1 68 SER HB3 1 71 GLN HB3 5.820 . 5.820 5.335 5.269 5.377 . 0 0 "[ . 1 . 2]" 1
1831 1 66 GLY QA 1 67 LEU MD2 5.020 . 5.020 3.269 3.095 5.048 0.028 14 0 "[ . 1 . 2]" 1
1832 1 81 ILE MG 1 83 GLU HA 4.750 . 4.750 4.178 3.941 4.384 . 0 0 "[ . 1 . 2]" 1
1833 1 50 ARG HA 1 50 ARG HD2 4.450 . 4.450 4.326 3.918 4.650 0.200 12 0 "[ . 1 . 2]" 1
1834 1 46 PHE HB2 1 57 LEU HA 5.120 . 5.120 5.132 5.021 5.197 0.077 16 0 "[ . 1 . 2]" 1
1835 1 50 ARG HA 1 87 PRO HB2 4.390 . 4.390 3.107 2.874 3.298 . 0 0 "[ . 1 . 2]" 1
1836 1 32 ILE HG12 1 50 ARG HA 4.600 . 4.600 3.161 2.918 3.359 . 0 0 "[ . 1 . 2]" 1
1837 1 75 ARG HG3 1 78 GLY HA2 4.680 . 4.680 3.878 3.387 4.222 . 0 0 "[ . 1 . 2]" 1
1838 1 50 ARG HD2 1 51 HIS HB2 4.430 . 4.430 3.733 2.438 4.463 0.033 8 0 "[ . 1 . 2]" 1
1839 1 50 ARG HG3 1 51 HIS HB2 4.650 . 4.650 3.213 2.570 4.033 . 0 0 "[ . 1 . 2]" 1
1840 1 44 VAL MG1 1 61 TYR HB2 4.670 . 4.670 4.354 4.162 4.501 . 0 0 "[ . 1 . 2]" 1
1841 1 36 VAL HB 1 61 TYR HB2 5.040 . 5.040 4.187 3.655 4.591 . 0 0 "[ . 1 . 2]" 1
1842 1 61 TYR HB2 1 64 ARG QG 4.540 . 4.540 4.465 4.364 4.578 0.038 4 0 "[ . 1 . 2]" 1
1843 1 57 LEU HB2 1 58 MET HA 5.470 . 5.470 4.825 4.757 4.880 . 0 0 "[ . 1 . 2]" 1
1844 1 57 LEU HB2 1 61 TYR HB2 5.790 . 5.790 4.876 4.815 4.992 . 0 0 "[ . 1 . 2]" 1
1845 1 58 MET HA 1 69 MET ME 4.310 . 4.310 3.654 3.519 3.775 . 0 0 "[ . 1 . 2]" 1
1846 1 44 VAL HB 1 61 TYR HB2 4.630 . 4.630 3.936 3.777 4.035 . 0 0 "[ . 1 . 2]" 1
1847 1 62 CYS HB3 1 69 MET QG 4.550 . 4.550 4.169 4.031 4.331 . 0 0 "[ . 1 . 2]" 1
1848 1 44 VAL HB 1 64 ARG HD3 5.090 . 5.090 3.806 3.501 4.593 . 0 0 "[ . 1 . 2]" 1
1849 1 62 CYS HB2 1 69 MET QG 4.550 . 4.550 4.120 3.732 4.528 . 0 0 "[ . 1 . 2]" 1
1850 1 62 CYS HB2 1 69 MET ME 4.380 . 4.380 3.764 3.150 4.234 . 0 0 "[ . 1 . 2]" 1
1851 1 58 MET QB 1 61 TYR HB3 5.090 . 5.090 4.355 4.266 4.520 . 0 0 "[ . 1 . 2]" 1
1852 1 61 TYR HB3 1 65 GLN QG 5.490 . 5.490 4.634 4.490 4.869 . 0 0 "[ . 1 . 2]" 1
1853 1 36 VAL HB 1 61 TYR HB3 5.720 . 5.720 5.242 4.766 5.594 . 0 0 "[ . 1 . 2]" 1
1854 1 61 TYR HB3 1 72 ILE MD 4.760 . 4.760 4.171 3.998 4.371 . 0 0 "[ . 1 . 2]" 1
1855 1 46 PHE HB2 1 48 ILE MG 3.790 . 3.790 3.119 2.789 3.352 . 0 0 "[ . 1 . 2]" 1
1856 1 59 LYS QE 1 69 MET HB2 4.670 . 4.670 4.655 3.690 4.899 0.229 18 0 "[ . 1 . 2]" 1
1857 1 59 LYS QE 1 69 MET ME 3.510 . 3.510 3.270 2.145 3.590 0.080 16 0 "[ . 1 . 2]" 1
1858 1 35 LYS HE3 1 95 GLU HB3 4.450 . 4.450 3.974 3.428 4.426 . 0 0 "[ . 1 . 2]" 1
1859 1 49 LYS HB3 1 51 HIS HB3 4.770 . 4.770 3.445 3.024 4.059 . 0 0 "[ . 1 . 2]" 1
1860 1 35 LYS HE2 1 45 GLN HG3 5.220 . 5.220 4.879 4.705 4.983 . 0 0 "[ . 1 . 2]" 1
1861 1 35 LYS HE3 1 45 GLN HG3 5.510 . 5.510 4.596 4.478 4.844 . 0 0 "[ . 1 . 2]" 1
1862 1 74 PHE HB2 1 81 ILE HG13 4.420 . 4.420 3.820 3.580 3.981 . 0 0 "[ . 1 . 2]" 1
1863 1 76 PHE HB3 1 81 ILE HG13 4.580 . 4.580 3.562 3.417 3.791 . 0 0 "[ . 1 . 2]" 1
1864 1 35 LYS HB2 1 35 LYS HE2 4.530 . 4.530 2.982 2.703 3.644 . 0 0 "[ . 1 . 2]" 1
1865 1 35 LYS HE2 1 45 GLN HG2 4.970 . 4.970 5.002 4.923 5.048 0.078 4 0 "[ . 1 . 2]" 1
1866 1 59 LYS QD 1 69 MET QG 4.160 . 4.160 3.740 2.064 4.270 0.110 11 0 "[ . 1 . 2]" 1
1867 1 94 ASP QB 1 95 GLU HB2 5.080 . 5.080 4.182 3.564 4.426 . 0 0 "[ . 1 . 2]" 1
1868 1 92 MET HB2 1 96 ASP HB3 4.550 . 4.550 3.199 3.003 3.509 . 0 0 "[ . 1 . 2]" 1
1869 1 77 ASP HB2 1 79 GLN HB3 5.970 . 5.970 5.908 5.712 6.020 0.050 9 0 "[ . 1 . 2]" 1
1870 1 32 ILE HB 1 94 ASP QB 4.020 . 4.020 2.452 2.108 3.794 . 0 0 "[ . 1 . 2]" 1
1871 1 77 ASP HB2 1 79 GLN HG3 4.660 . 4.660 4.564 4.119 4.715 0.055 3 0 "[ . 1 . 2]" 1
1872 1 77 ASP HB2 1 90 LEU MD2 4.500 . 4.500 3.454 3.048 4.027 . 0 0 "[ . 1 . 2]" 1
1873 1 77 ASP HB2 1 79 GLN HG2 4.180 . 4.180 3.607 3.385 3.716 . 0 0 "[ . 1 . 2]" 1
1874 1 74 PHE HB3 1 81 ILE HB 4.040 . 4.040 3.064 2.887 3.211 . 0 0 "[ . 1 . 2]" 1
1875 1 77 ASP HB2 1 90 LEU HB3 4.610 . 4.610 3.543 3.279 3.749 . 0 0 "[ . 1 . 2]" 1
1876 1 75 ARG HB2 1 99 ASP QB 4.410 . 4.410 4.054 3.664 4.410 . 0 0 "[ . 1 . 2]" 1
1877 1 46 PHE HB3 1 57 LEU HB2 4.550 . 4.550 3.298 2.957 3.737 . 0 0 "[ . 1 . 2]" 1
1878 1 46 PHE HB3 1 48 ILE MG 3.910 . 3.910 2.746 2.544 2.991 . 0 0 "[ . 1 . 2]" 1
1879 1 75 ARG HB3 1 99 ASP QB 4.150 . 4.150 2.416 2.079 2.818 . 0 0 "[ . 1 . 2]" 1
1880 1 60 ALA MB 1 63 GLU HG3 5.300 . 5.300 5.007 4.279 5.370 0.070 3 0 "[ . 1 . 2]" 1
1881 1 77 ASP HB3 1 79 GLN HG3 4.630 . 4.630 3.508 3.236 4.195 . 0 0 "[ . 1 . 2]" 1
1882 1 79 GLN HG2 1 90 LEU MD2 4.600 . 4.600 3.739 3.522 4.055 . 0 0 "[ . 1 . 2]" 1
1883 1 77 ASP HB3 1 79 GLN HG2 3.960 . 3.960 2.135 1.955 2.803 . 0 0 "[ . 1 . 2]" 1
1884 1 53 PRO HB2 1 56 LYS HG3 4.090 . 4.090 3.294 2.824 3.620 . 0 0 "[ . 1 . 2]" 1
1885 1 73 ARG HG2 1 103 GLN QG 3.550 . 3.550 2.345 1.890 3.017 . 0 0 "[ . 1 . 2]" 1
1886 1 21 LYS QD 1 22 GLU QG 3.890 . 3.890 2.568 1.771 3.607 0.029 15 0 "[ . 1 . 2]" 1
1887 1 71 GLN HB3 1 72 ILE MD 5.040 . 5.040 4.840 4.684 4.982 . 0 0 "[ . 1 . 2]" 1
1888 1 71 GLN HB3 1 72 ILE MG 3.960 . 3.960 2.571 2.468 2.658 . 0 0 "[ . 1 . 2]" 1
1889 1 35 LYS HB3 1 45 GLN HG3 3.530 . 3.530 2.988 2.838 3.142 . 0 0 "[ . 1 . 2]" 1
1890 1 34 LEU MD2 1 92 MET HG3 4.370 . 4.370 3.871 3.522 4.267 . 0 0 "[ . 1 . 2]" 1
1891 1 58 MET ME 1 69 MET ME 3.440 . 3.440 3.014 2.844 3.203 . 0 0 "[ . 1 . 2]" 1
1892 1 59 LYS HG2 1 69 MET ME 3.650 . 3.650 2.045 1.886 2.364 . 0 0 "[ . 1 . 2]" 1
1893 1 69 MET ME 1 72 ILE MD 3.810 . 3.810 3.740 3.530 3.884 0.074 14 0 "[ . 1 . 2]" 1
1894 1 35 LYS HG3 1 45 GLN HB2 5.800 . 5.800 5.470 5.387 5.531 . 0 0 "[ . 1 . 2]" 1
1895 1 50 ARG HB2 1 87 PRO HG3 6.000 . 6.000 5.138 4.634 5.511 . 0 0 "[ . 1 . 2]" 1
1896 1 36 VAL HB 1 98 ILE MD 5.480 . 5.480 5.110 4.440 5.801 0.321 1 0 "[ . 1 . 2]" 1
1897 1 36 VAL HB 1 98 ILE HB 3.360 . 3.360 3.102 2.503 3.782 0.422 1 0 "[ . 1 . 2]" 1
1898 1 48 ILE MD 1 87 PRO HG3 3.990 . 3.990 2.407 2.175 2.640 . 0 0 "[ . 1 . 2]" 1
1899 1 35 LYS HB2 1 35 LYS HE3 4.090 . 4.090 2.120 1.944 2.263 . 0 0 "[ . 1 . 2]" 1
1900 1 64 ARG QG 1 65 GLN QG 2.860 . 2.860 2.144 2.046 2.366 . 0 0 "[ . 1 . 2]" 1
1901 1 70 ARG HB2 1 70 ARG QG 2.800 . 2.800 2.135 2.118 2.143 . 0 0 "[ . 1 . 2]" 1
1902 1 35 LYS HG2 1 45 GLN HB3 3.640 . 3.640 2.666 2.563 2.760 . 0 0 "[ . 1 . 2]" 1
1903 1 92 MET HB2 1 96 ASP HB2 4.550 . 4.550 3.053 2.779 3.438 . 0 0 "[ . 1 . 2]" 1
1904 1 54 LEU HB3 1 87 PRO HB3 4.260 . 4.260 3.263 2.797 3.695 . 0 0 "[ . 1 . 2]" 1
1905 1 75 ARG HB3 1 75 ARG HD3 4.110 . 4.110 3.089 2.592 3.590 . 0 0 "[ . 1 . 2]" 1
1906 1 89 GLN QG 1 90 LEU HG 4.870 . 4.870 4.577 3.446 5.032 0.162 15 0 "[ . 1 . 2]" 1
1907 1 53 PRO HG2 1 56 LYS QD 3.540 . 3.540 2.692 2.079 3.458 . 0 0 "[ . 1 . 2]" 1
1908 1 81 ILE HB 1 98 ILE MG 4.510 . 4.510 4.302 4.219 4.388 . 0 0 "[ . 1 . 2]" 1
1909 1 90 LEU HB3 1 90 LEU MD2 3.060 . 3.060 2.132 2.099 2.148 . 0 0 "[ . 1 . 2]" 1
1910 1 64 ARG HD2 1 65 GLN QG 4.690 . 4.690 4.431 3.526 4.711 0.021 13 0 "[ . 1 . 2]" 1
1911 1 98 ILE HG13 1 98 ILE MG 3.430 . 3.430 2.390 2.309 2.475 . 0 0 "[ . 1 . 2]" 1
1912 1 86 THR MG 1 87 PRO HG2 3.910 . 3.910 3.766 2.666 4.082 0.172 19 0 "[ . 1 . 2]" 1
1913 1 35 LYS QD 1 45 GLN HG2 4.230 . 4.230 2.428 2.341 2.603 . 0 0 "[ . 1 . 2]" 1
1914 1 87 PRO HG2 1 88 ALA MB 3.750 . 3.750 3.511 3.391 3.622 . 0 0 "[ . 1 . 2]" 1
1915 1 59 LYS HG3 1 69 MET ME 3.650 . 3.650 2.974 2.535 3.700 0.050 18 0 "[ . 1 . 2]" 1
1916 1 77 ASP HB2 1 90 LEU HB2 4.930 . 4.930 4.864 4.508 4.981 0.051 2 0 "[ . 1 . 2]" 1
1917 1 35 LYS QD 1 45 GLN HG3 3.800 . 3.800 2.282 2.153 2.394 . 0 0 "[ . 1 . 2]" 1
1918 1 60 ALA MB 1 64 ARG HB3 4.380 . 4.380 4.331 4.140 4.549 0.169 14 0 "[ . 1 . 2]" 1
1919 1 54 LEU HG 1 81 ILE MG 3.980 . 3.980 3.606 2.363 3.954 . 0 0 "[ . 1 . 2]" 1
1920 1 50 ARG HB3 1 50 ARG HD3 4.060 . 4.060 3.055 2.607 3.641 . 0 0 "[ . 1 . 2]" 1
1921 1 58 MET ME 1 83 GLU HB3 3.780 . 3.780 3.099 2.712 3.360 . 0 0 "[ . 1 . 2]" 1
1922 1 58 MET QB 1 58 MET ME 2.920 . 2.920 2.077 2.037 2.121 . 0 0 "[ . 1 . 2]" 1
1923 1 32 ILE HG12 1 50 ARG HB3 3.410 . 3.410 3.048 2.219 3.443 0.033 1 0 "[ . 1 . 2]" 1
1924 1 56 LYS QD 1 56 LYS HG2 2.600 . 2.600 2.340 2.168 2.435 . 0 0 "[ . 1 . 2]" 1
1925 1 48 ILE MG 1 52 THR MG 3.310 . 3.310 3.069 2.795 3.391 0.081 6 0 "[ . 1 . 2]" 1
1926 1 48 ILE MG 1 57 LEU HB3 3.520 . 3.520 2.784 2.447 3.020 . 0 0 "[ . 1 . 2]" 1
1927 1 34 LEU HG 1 92 MET ME 3.730 . 3.730 3.259 2.822 3.591 . 0 0 "[ . 1 . 2]" 1
1928 1 64 ARG QG 1 65 GLN HB2 3.780 . 3.780 3.779 3.649 3.852 0.072 2 0 "[ . 1 . 2]" 1
1929 1 48 ILE HG13 1 48 ILE MG 3.390 . 3.390 3.199 3.188 3.208 . 0 0 "[ . 1 . 2]" 1
1930 1 92 MET HB3 1 92 MET ME 2.810 . 2.810 2.265 2.175 2.355 . 0 0 "[ . 1 . 2]" 1
1931 1 50 ARG HB2 1 88 ALA MB 3.700 . 3.700 2.201 2.031 2.320 . 0 0 "[ . 1 . 2]" 1
1932 1 90 LEU MD1 1 92 MET HB3 3.630 . 3.630 3.537 2.842 3.704 0.074 8 0 "[ . 1 . 2]" 1
1933 1 35 LYS HG2 1 45 GLN HB2 3.840 . 3.840 3.924 3.877 3.977 0.137 10 0 "[ . 1 . 2]" 1
1934 1 34 LEU HB3 1 34 LEU MD2 3.450 . 3.450 3.171 3.164 3.180 . 0 0 "[ . 1 . 2]" 1
1935 1 92 MET ME 1 98 ILE MG 4.770 . 4.770 4.338 4.163 4.538 . 0 0 "[ . 1 . 2]" 1
1936 1 69 MET ME 1 72 ILE HG13 4.850 . 4.850 4.566 4.354 4.775 . 0 0 "[ . 1 . 2]" 1
1937 1 87 PRO HB2 1 92 MET ME 5.200 . 5.200 4.613 4.438 4.820 . 0 0 "[ . 1 . 2]" 1
1938 1 92 MET HB2 1 92 MET ME 4.620 . 4.620 2.343 2.278 2.471 . 0 0 "[ . 1 . 2]" 1
1939 1 90 LEU MD2 1 92 MET ME 3.590 . 3.590 3.510 3.325 3.639 0.049 11 0 "[ . 1 . 2]" 1
1940 1 90 LEU MD1 1 92 MET ME 3.250 . 3.250 2.901 2.659 3.036 . 0 0 "[ . 1 . 2]" 1
1941 1 44 VAL MG2 1 64 ARG QG 3.680 . 3.680 2.978 2.679 3.128 . 0 0 "[ . 1 . 2]" 1
1942 1 36 VAL HB 1 44 VAL MG2 4.930 . 4.930 4.522 3.793 5.121 0.191 3 0 "[ . 1 . 2]" 1
1943 1 36 VAL MG2 1 44 VAL MG2 4.510 . 4.510 4.287 3.906 4.697 0.187 4 0 "[ . 1 . 2]" 1
1944 1 48 ILE MD 1 54 LEU HB3 3.750 . 3.750 2.848 2.620 3.161 . 0 0 "[ . 1 . 2]" 1
1945 1 54 LEU HB3 1 54 LEU MD2 3.590 . 3.590 2.363 2.266 3.197 . 0 0 "[ . 1 . 2]" 1
1946 1 54 LEU HB3 1 87 PRO HG3 4.310 . 4.310 3.531 3.167 4.006 . 0 0 "[ . 1 . 2]" 1
1947 1 76 PHE HB2 1 98 ILE MG 4.400 . 4.400 3.097 2.932 3.210 . 0 0 "[ . 1 . 2]" 1
1948 1 98 ILE HG12 1 98 ILE MG 3.240 . 3.240 3.201 3.191 3.210 . 0 0 "[ . 1 . 2]" 1
1949 1 81 ILE MD 1 98 ILE MG 3.120 . 3.120 2.049 1.995 2.100 . 0 0 "[ . 1 . 2]" 1
1950 1 36 VAL MG2 1 98 ILE MG 4.300 . 4.300 2.477 2.360 2.678 . 0 0 "[ . 1 . 2]" 1
1951 1 54 LEU HB3 1 81 ILE MG 4.730 . 4.730 4.704 4.574 4.785 0.055 8 0 "[ . 1 . 2]" 1
1952 1 48 ILE MD 1 48 ILE MG 2.770 . 2.770 1.942 1.907 1.985 . 0 0 "[ . 1 . 2]" 1
1953 1 36 VAL MG2 1 98 ILE HB 3.960 . 3.960 2.053 1.949 2.207 . 0 0 "[ . 1 . 2]" 1
1954 1 44 VAL MG1 1 64 ARG QG 4.190 . 4.190 3.587 3.450 3.682 . 0 0 "[ . 1 . 2]" 1
1955 1 48 ILE HB 1 48 ILE MD 3.520 . 3.520 2.410 2.372 2.474 . 0 0 "[ . 1 . 2]" 1
1956 1 34 LEU MD1 1 92 MET HG3 4.370 . 4.370 2.068 1.918 2.446 . 0 0 "[ . 1 . 2]" 1
1957 1 98 ILE HB 1 98 ILE MD 3.340 . 3.340 3.225 3.213 3.234 . 0 0 "[ . 1 . 2]" 1
1958 1 54 LEU MD1 1 81 ILE MG 3.100 . 3.100 2.008 1.794 2.838 0.006 4 0 "[ . 1 . 2]" 1
1959 1 81 ILE MD 1 98 ILE MD 2.640 . 2.640 2.048 1.943 2.188 . 0 0 "[ . 1 . 2]" 1
1960 1 32 ILE MD 1 87 PRO HG3 4.290 . 4.290 3.596 3.244 3.878 . 0 0 "[ . 1 . 2]" 1
1961 1 32 ILE MD 1 87 PRO HB3 3.970 . 3.970 2.995 2.452 3.352 . 0 0 "[ . 1 . 2]" 1
1962 1 32 ILE MD 1 34 LEU HG 3.640 . 3.640 3.743 3.702 3.803 0.163 5 0 "[ . 1 . 2]" 1
1963 1 32 ILE MD 1 88 ALA MB 4.640 . 4.640 4.579 4.299 4.680 0.040 1 0 "[ . 1 . 2]" 1
1964 1 34 LEU HB3 1 57 LEU MD2 4.100 . 4.100 2.748 2.540 3.053 . 0 0 "[ . 1 . 2]" 1
1965 1 57 LEU MD2 1 58 MET HA 4.960 . 4.960 4.927 4.842 4.989 0.029 17 0 "[ . 1 . 2]" 1
1966 1 48 ILE HB 1 57 LEU MD2 5.230 . 5.230 4.704 4.283 5.069 . 0 0 "[ . 1 . 2]" 1
1967 1 57 LEU MD2 1 87 PRO HB3 5.520 . 5.520 4.480 4.211 4.883 . 0 0 "[ . 1 . 2]" 1
1968 1 57 LEU MD2 1 98 ILE HG13 4.350 . 4.350 3.839 3.349 4.250 . 0 0 "[ . 1 . 2]" 1
1969 1 57 LEU MD2 1 92 MET ME 4.480 . 4.480 4.409 4.112 4.530 0.050 1 0 "[ . 1 . 2]" 1
1970 1 48 ILE MG 1 57 LEU MD2 3.350 . 3.350 2.968 2.487 3.285 . 0 0 "[ . 1 . 2]" 1
1971 1 34 LEU MD2 1 57 LEU MD2 4.130 . 4.130 2.929 2.684 3.132 . 0 0 "[ . 1 . 2]" 1
1972 1 98 ILE MG 1 100 VAL MG2 4.730 . 4.730 2.536 2.411 2.673 . 0 0 "[ . 1 . 2]" 1
1973 1 72 ILE MD 1 100 VAL MG2 3.520 . 3.520 3.108 2.911 3.319 . 0 0 "[ . 1 . 2]" 1
1974 1 57 LEU MD1 1 61 TYR HB3 4.620 . 4.620 3.947 3.868 4.023 . 0 0 "[ . 1 . 2]" 1
1975 1 36 VAL HB 1 57 LEU MD1 4.390 . 4.390 3.330 2.670 3.986 . 0 0 "[ . 1 . 2]" 1
1976 1 57 LEU MD1 1 98 ILE HB 4.650 . 4.650 4.340 4.007 4.628 . 0 0 "[ . 1 . 2]" 1
1977 1 57 LEU MD1 1 58 MET QB 4.210 . 4.210 3.788 3.749 3.849 . 0 0 "[ . 1 . 2]" 1
1978 1 57 LEU MD1 1 60 ALA MB 4.700 . 4.700 4.307 4.126 4.390 . 0 0 "[ . 1 . 2]" 1
1979 1 57 LEU MD1 1 92 MET ME 5.490 . 5.490 5.194 4.986 5.475 . 0 0 "[ . 1 . 2]" 1
1980 1 57 LEU MD1 1 98 ILE HG12 4.420 . 4.420 4.224 3.872 4.468 0.048 18 0 "[ . 1 . 2]" 1
1981 1 36 VAL MG1 1 61 TYR HB2 5.280 . 5.280 3.119 2.504 3.840 . 0 0 "[ . 1 . 2]" 1
1982 1 36 VAL MG1 1 98 ILE HB 3.960 . 3.960 3.037 1.843 4.040 0.080 8 0 "[ . 1 . 2]" 1
1983 1 36 VAL MG1 1 98 ILE MG 4.300 . 4.300 3.505 2.253 4.564 0.264 8 0 "[ . 1 . 2]" 1
1984 1 75 ARG H 1 81 ILE HB 4.760 . 4.760 4.734 4.517 4.830 0.070 7 0 "[ . 1 . 2]" 1
1985 1 75 ARG H 1 75 ARG HG2 4.700 . 4.700 4.514 4.268 4.669 . 0 0 "[ . 1 . 2]" 1
1986 1 75 ARG H 1 99 ASP QB 4.540 . 4.540 3.420 3.153 3.625 . 0 0 "[ . 1 . 2]" 1
1987 1 75 ARG HD3 1 77 ASP H 5.010 . 5.010 4.614 3.952 5.061 0.051 16 0 "[ . 1 . 2]" 1
1988 1 33 ASN HB3 1 95 GLU H 4.790 . 4.790 2.377 2.009 2.859 . 0 0 "[ . 1 . 2]" 1
1989 1 95 GLU H 1 95 GLU HG3 4.120 . 4.120 3.637 3.131 4.440 0.320 2 0 "[ . 1 . 2]" 1
1990 1 37 ALA MB 1 98 ILE H 4.280 . 4.280 4.206 3.962 4.334 0.054 6 0 "[ . 1 . 2]" 1
1991 1 35 LYS HB2 1 98 ILE H 4.730 . 4.730 4.114 3.998 4.221 . 0 0 "[ . 1 . 2]" 1
1992 1 35 LYS HB3 1 98 ILE H 5.030 . 5.030 4.811 4.706 4.860 . 0 0 "[ . 1 . 2]" 1
1993 1 98 ILE H 1 98 ILE MG 3.960 . 3.960 3.792 3.763 3.816 . 0 0 "[ . 1 . 2]" 1
1994 1 36 VAL MG2 1 98 ILE H 4.790 . 4.790 3.803 3.560 4.079 . 0 0 "[ . 1 . 2]" 1
1995 1 37 ALA H 1 98 ILE HB 4.380 . 4.380 3.077 2.938 3.249 . 0 0 "[ . 1 . 2]" 1
1996 1 82 ASN H 1 85 ASP HB2 4.570 . 4.570 2.512 2.222 3.089 . 0 0 "[ . 1 . 2]" 1
1997 1 58 MET ME 1 82 ASN H 4.070 . 4.070 3.978 3.668 4.116 0.046 14 0 "[ . 1 . 2]" 1
1998 1 35 LYS HG2 1 36 VAL H 4.510 . 4.510 4.234 4.161 4.320 . 0 0 "[ . 1 . 2]" 1
1999 1 36 VAL H 1 37 ALA MB 5.420 . 5.420 4.858 4.744 4.950 . 0 0 "[ . 1 . 2]" 1
2000 1 81 ILE HG13 1 82 ASN H 5.830 . 5.830 5.066 5.042 5.097 . 0 0 "[ . 1 . 2]" 1
2001 1 81 ILE MG 1 83 GLU H 4.820 . 4.820 4.723 4.534 4.862 0.042 1 0 "[ . 1 . 2]" 1
2002 1 33 ASN H 1 94 ASP QB 4.320 . 4.320 2.020 1.773 3.019 0.027 7 0 "[ . 1 . 2]" 1
2003 1 69 MET H 1 70 ARG QG 4.480 . 4.480 4.423 4.028 4.545 0.065 16 0 "[ . 1 . 2]" 1
2004 1 32 ILE HG12 1 33 ASN H 5.370 . 5.370 4.649 4.581 4.753 . 0 0 "[ . 1 . 2]" 1
2005 1 76 PHE H 1 81 ILE MG 5.810 . 5.810 5.135 4.994 5.294 . 0 0 "[ . 1 . 2]" 1
2006 1 61 TYR H 1 69 MET ME 4.810 . 4.810 4.793 4.631 4.927 0.117 20 0 "[ . 1 . 2]" 1
2007 1 102 GLN HB3 1 104 GLN H 4.720 . 4.720 3.625 3.264 3.872 . 0 0 "[ . 1 . 2]" 1
2008 1 35 LYS H 1 35 LYS HG3 4.330 . 4.330 2.902 2.651 3.029 . 0 0 "[ . 1 . 2]" 1
2009 1 55 SER H 1 58 MET HG3 6.000 . 6.000 4.277 4.142 4.988 . 0 0 "[ . 1 . 2]" 1
2010 1 55 SER H 1 81 ILE MG 5.320 . 5.320 5.109 4.933 5.285 . 0 0 "[ . 1 . 2]" 1
2011 1 88 ALA H 1 90 LEU MD1 4.750 . 4.750 4.124 4.004 4.266 . 0 0 "[ . 1 . 2]" 1
2012 1 48 ILE HG13 1 49 LYS H 4.710 . 4.710 3.307 2.884 3.471 . 0 0 "[ . 1 . 2]" 1
2013 1 24 VAL QG 1 26 THR H 4.810 . 4.810 4.309 3.283 4.862 0.052 19 0 "[ . 1 . 2]" 1
2014 1 17 ASP HB3 1 18 GLU H 4.540 . 4.540 4.050 3.002 4.462 . 0 0 "[ . 1 . 2]" 1
2015 1 75 ARG HB3 1 81 ILE H 5.360 . 5.360 5.218 5.066 5.421 0.061 18 0 "[ . 1 . 2]" 1
2016 1 56 LYS H 1 58 MET ME 5.380 . 5.380 4.889 4.713 5.477 0.097 13 0 "[ . 1 . 2]" 1
2017 1 70 ARG HB2 1 71 GLN HE21 4.770 . 4.770 4.268 3.915 4.855 0.085 3 0 "[ . 1 . 2]" 1
2018 1 60 ALA H 1 63 GLU HB2 4.930 . 4.930 4.992 4.928 5.069 0.139 8 0 "[ . 1 . 2]" 1
2019 1 45 GLN HB2 1 45 GLN HE22 4.530 . 4.530 4.148 4.088 4.207 . 0 0 "[ . 1 . 2]" 1
2020 1 50 ARG HG3 1 52 THR H 5.070 . 5.070 4.570 4.314 4.936 . 0 0 "[ . 1 . 2]" 1
2021 1 76 PHE QD 1 79 GLN HG3 4.630 . 4.630 4.523 4.291 4.651 0.021 8 0 "[ . 1 . 2]" 1
2022 1 46 PHE HZ 1 64 ARG HD2 5.480 . 5.480 4.041 2.925 4.538 . 0 0 "[ . 1 . 2]" 1
2023 1 46 PHE QE 1 64 ARG QG 4.720 . 4.720 4.560 4.164 4.778 0.058 8 0 "[ . 1 . 2]" 1
2024 1 34 LEU HB2 1 46 PHE QD 4.680 . 4.680 3.388 3.126 3.700 . 0 0 "[ . 1 . 2]" 1
2025 1 79 GLN HE22 1 90 LEU MD2 4.800 . 4.800 2.894 2.683 3.139 . 0 0 "[ . 1 . 2]" 1
2026 1 43 VAL MG2 1 45 GLN HE21 5.000 . 5.000 2.554 2.021 4.931 . 0 0 "[ . 1 . 2]" 1
2027 1 97 THR HB 1 98 ILE H 4.420 . 4.420 4.136 3.969 4.318 . 0 0 "[ . 1 . 2]" 1
2028 1 41 GLY H 1 42 SER HB3 5.380 . 5.380 4.827 4.360 5.716 0.336 7 0 "[ . 1 . 2]" 1
2029 1 75 ARG H 1 101 PHE QE 4.360 . 4.360 3.979 3.699 4.225 . 0 0 "[ . 1 . 2]" 1
2030 1 35 LYS H 1 98 ILE H 4.470 . 4.470 4.021 3.854 4.149 . 0 0 "[ . 1 . 2]" 1
2031 1 36 VAL H 1 46 PHE QD 4.880 . 4.880 4.099 3.880 4.258 . 0 0 "[ . 1 . 2]" 1
2032 1 36 VAL H 1 61 TYR QD 5.300 . 5.300 4.769 4.443 4.978 . 0 0 "[ . 1 . 2]" 1
2033 1 61 TYR QE 1 72 ILE MD 3.420 . 3.420 2.245 2.109 2.346 . 0 0 "[ . 1 . 2]" 1
2034 1 57 LEU HG 1 61 TYR H 6.000 . 6.000 5.794 5.716 5.849 . 0 0 "[ . 1 . 2]" 1
2035 1 61 TYR H 1 72 ILE MD 6.000 . 6.000 5.901 5.679 6.026 0.026 11 0 "[ . 1 . 2]" 1
2036 1 56 LYS H 1 57 LEU MD1 6.000 . 6.000 5.786 5.701 5.880 . 0 0 "[ . 1 . 2]" 1
2037 1 56 LYS H 1 57 LEU MD2 5.210 . 5.210 5.003 4.850 5.155 . 0 0 "[ . 1 . 2]" 1
2038 1 57 LEU MD1 1 60 ALA H 5.160 . 5.160 4.851 4.790 4.939 . 0 0 "[ . 1 . 2]" 1
2039 1 55 SER H 1 57 LEU MD2 5.620 . 5.620 5.244 5.081 5.390 . 0 0 "[ . 1 . 2]" 1
2040 1 55 SER H 1 58 MET HG2 6.000 . 6.000 5.994 5.892 6.077 0.077 13 0 "[ . 1 . 2]" 1
2041 1 57 LEU MD1 1 62 CYS H 5.950 . 5.950 5.699 5.570 5.800 . 0 0 "[ . 1 . 2]" 1
2042 1 37 ALA H 1 61 TYR QE 5.410 . 5.410 5.137 4.893 5.339 . 0 0 "[ . 1 . 2]" 1
2043 1 32 ILE MD 1 50 ARG HD2 6.000 . 6.000 5.652 4.994 6.045 0.045 20 0 "[ . 1 . 2]" 1
2044 1 35 LYS HA 1 35 LYS QD 4.100 . 4.100 3.994 3.922 4.045 . 0 0 "[ . 1 . 2]" 1
2045 1 18 GLU HA 1 19 LYS H 3.300 . 3.300 2.559 2.067 3.539 0.239 3 0 "[ . 1 . 2]" 1
2046 1 46 PHE HZ 1 61 TYR HA 3.490 . 3.490 2.932 2.655 3.174 . 0 0 "[ . 1 . 2]" 1
2047 1 79 GLN HE21 1 79 GLN HG3 3.540 . 3.540 2.238 2.175 2.839 . 0 0 "[ . 1 . 2]" 1
2048 1 101 PHE QE 1 103 GLN QG 4.490 . 4.490 2.754 2.279 3.619 . 0 0 "[ . 1 . 2]" 1
2049 1 80 PRO HB3 1 101 PHE HZ 4.330 . 4.330 3.685 3.173 4.102 . 0 0 "[ . 1 . 2]" 1
2050 1 80 PRO HB3 1 101 PHE QE 5.810 . 5.810 4.729 4.302 5.044 . 0 0 "[ . 1 . 2]" 1
2051 1 79 GLN HE21 1 90 LEU HB3 4.070 . 4.070 3.728 3.072 4.081 0.011 17 0 "[ . 1 . 2]" 1
2052 1 44 VAL MG2 1 64 ARG H 5.510 . 5.510 5.464 5.258 5.579 0.069 20 0 "[ . 1 . 2]" 1
2053 1 100 VAL H 1 101 PHE QD 4.520 . 4.520 4.456 4.314 4.545 0.025 14 0 "[ . 1 . 2]" 1
2054 1 75 ARG H 1 101 PHE QD 5.380 . 5.380 4.818 4.465 5.044 . 0 0 "[ . 1 . 2]" 1
2055 1 54 LEU H 1 55 SER HA 5.220 . 5.220 5.071 4.987 5.137 . 0 0 "[ . 1 . 2]" 1
2056 1 46 PHE QE 1 60 ALA HA 5.660 . 5.660 5.021 4.820 5.217 . 0 0 "[ . 1 . 2]" 1
2057 1 68 SER HB3 1 70 ARG QD 4.380 . 4.380 2.243 2.035 2.536 . 0 0 "[ . 1 . 2]" 1
2058 1 73 ARG HB2 1 101 PHE H 4.430 . 4.430 3.921 3.721 4.162 . 0 0 "[ . 1 . 2]" 1
2059 1 97 THR MG 1 100 VAL H 5.630 . 5.630 5.297 5.022 5.591 . 0 0 "[ . 1 . 2]" 1
2060 1 76 PHE HZ 1 92 MET HB2 4.070 . 4.070 2.669 2.364 2.842 . 0 0 "[ . 1 . 2]" 1
2061 1 86 THR HB 1 88 ALA MB 3.370 . 3.370 3.154 3.002 3.373 0.003 11 0 "[ . 1 . 2]" 1
2062 1 79 GLN HG3 1 80 PRO HD2 4.450 . 4.450 4.234 3.947 4.388 . 0 0 "[ . 1 . 2]" 1
2063 1 50 ARG HA 1 87 PRO HB3 4.500 . 4.500 4.260 4.004 4.484 . 0 0 "[ . 1 . 2]" 1
2064 1 64 ARG HB3 1 64 ARG HD3 3.870 . 3.870 3.610 2.994 3.757 . 0 0 "[ . 1 . 2]" 1
2065 1 59 LYS HG2 1 69 MET QG 4.530 . 4.530 3.260 2.897 4.037 . 0 0 "[ . 1 . 2]" 1
2066 1 52 THR MG 1 53 PRO HG2 3.440 . 3.440 3.096 2.817 3.447 0.007 19 0 "[ . 1 . 2]" 1
2067 1 82 ASN HB2 1 84 THR MG 4.410 . 4.410 3.512 1.957 4.443 0.033 15 0 "[ . 1 . 2]" 1
2068 1 46 PHE HB2 1 57 LEU MD1 4.700 . 4.700 3.870 3.512 4.325 . 0 0 "[ . 1 . 2]" 1
2069 1 46 PHE HB3 1 57 LEU MD1 5.250 . 5.250 4.638 4.228 5.106 . 0 0 "[ . 1 . 2]" 1
2070 1 35 LYS HG2 1 45 GLN HE21 4.950 . 4.950 3.936 3.726 4.103 . 0 0 "[ . 1 . 2]" 1
2071 1 38 GLY HA2 1 61 TYR QE 5.230 . 5.230 4.560 4.219 4.911 . 0 0 "[ . 1 . 2]" 1
2072 1 57 LEU MD1 1 61 TYR HA 5.090 . 5.090 5.161 5.068 5.235 0.145 14 0 "[ . 1 . 2]" 1
2073 1 36 VAL MG1 1 61 TYR HA 5.870 . 5.870 4.700 3.961 5.535 . 0 0 "[ . 1 . 2]" 1
2074 1 15 MET HA 1 15 MET QG 3.610 . 3.610 3.152 2.481 3.497 . 0 0 "[ . 1 . 2]" 1
2075 1 15 MET ME 1 15 MET QG 2.880 . 2.880 2.310 2.225 2.448 . 0 0 "[ . 1 . 2]" 1
2076 1 15 MET QG 1 16 ALA HA 5.370 . 5.370 3.777 3.329 4.388 . 0 0 "[ . 1 . 2]" 1
2077 1 15 MET QG 1 16 ALA MB 4.170 . 4.170 2.945 2.590 4.268 0.098 9 0 "[ . 1 . 2]" 1
2078 1 17 ASP H 1 17 ASP QB 3.000 . 3.000 2.576 2.303 3.023 0.023 18 0 "[ . 1 . 2]" 1
2079 1 17 ASP QB 1 18 GLU H 3.800 . 3.800 3.322 2.387 3.862 0.062 15 0 "[ . 1 . 2]" 1
2080 1 17 ASP QB 1 18 GLU HA 5.280 . 5.280 4.281 3.821 4.706 . 0 0 "[ . 1 . 2]" 1
2081 1 17 ASP QB 1 18 GLU QG 5.510 . 5.510 4.154 2.485 5.426 . 0 0 "[ . 1 . 2]" 1
2082 1 18 GLU H 1 18 GLU QB 3.180 . 3.180 2.631 2.253 3.108 . 0 0 "[ . 1 . 2]" 1
2083 1 18 GLU QB 1 19 LYS H 4.190 . 4.190 3.555 2.063 4.024 . 0 0 "[ . 1 . 2]" 1
2084 1 19 LYS HA 1 20 PRO QD 3.490 . 3.490 2.006 1.805 2.258 . 0 0 "[ . 1 . 2]" 1
2085 1 19 LYS QB 1 20 PRO QD 4.350 . 4.350 3.095 1.900 3.859 . 0 0 "[ . 1 . 2]" 1
2086 1 19 LYS QG 1 20 PRO QD 4.140 . 4.140 3.233 1.997 4.280 0.140 17 0 "[ . 1 . 2]" 1
2087 1 19 LYS QE 1 20 PRO QD 5.630 . 5.630 4.195 2.503 5.184 . 0 0 "[ . 1 . 2]" 1
2088 1 25 LYS H 1 25 LYS QB 2.950 . 2.950 2.522 2.138 3.148 0.198 20 0 "[ . 1 . 2]" 1
2089 1 25 LYS QB 1 25 LYS QD 3.320 . 3.320 2.379 2.069 2.722 . 0 0 "[ . 1 . 2]" 1
2090 1 25 LYS QB 1 25 LYS QE 4.060 . 4.060 3.134 1.927 3.869 . 0 0 "[ . 1 . 2]" 1
2091 1 25 LYS QB 1 26 THR H 4.370 . 4.370 3.510 1.882 4.062 . 0 0 "[ . 1 . 2]" 1
2092 1 28 ASN H 1 29 ASN QD 4.990 . 4.990 4.440 3.189 5.326 0.336 11 0 "[ . 1 . 2]" 1
2093 1 28 ASN QB 1 28 ASN HD21 2.900 . 2.900 2.417 2.066 2.825 . 0 0 "[ . 1 . 2]" 1
2094 1 28 ASN QB 1 28 ASN HD22 3.450 . 3.450 3.356 3.212 3.485 0.035 8 0 "[ . 1 . 2]" 1
2095 1 28 ASN QB 1 29 ASN H 4.080 . 4.080 3.643 2.918 4.022 . 0 0 "[ . 1 . 2]" 1
2096 1 29 ASN HA 1 29 ASN QD 4.230 . 4.230 3.455 1.732 4.326 0.096 6 0 "[ . 1 . 2]" 1
2097 1 31 HIS HA 1 49 LYS QG 5.160 . 5.160 3.340 2.828 3.802 . 0 0 "[ . 1 . 2]" 1
2098 1 31 HIS HB2 1 49 LYS QG 3.850 . 3.850 3.426 2.938 3.867 0.017 20 0 "[ . 1 . 2]" 1
2099 1 31 HIS HD2 1 33 ASN QB 5.810 . 5.810 4.927 4.535 5.898 0.088 5 0 "[ . 1 . 2]" 1
2100 1 32 ILE HB 1 33 ASN QB 5.180 . 5.180 4.263 4.194 4.372 . 0 0 "[ . 1 . 2]" 1
2101 1 32 ILE MD 1 33 ASN QB 5.810 . 5.810 5.306 5.113 5.461 . 0 0 "[ . 1 . 2]" 1
2102 1 32 ILE MD 1 96 ASP QB 4.480 . 4.480 4.335 4.093 4.510 0.030 9 0 "[ . 1 . 2]" 1
2103 1 33 ASN H 1 33 ASN QB 3.260 . 3.260 2.354 2.306 2.413 . 0 0 "[ . 1 . 2]" 1
2104 1 33 ASN HA 1 34 LEU QD 4.270 . 4.270 2.997 2.866 3.138 . 0 0 "[ . 1 . 2]" 1
2105 1 33 ASN QB 1 34 LEU QD 4.110 . 4.110 3.931 3.763 3.982 . 0 0 "[ . 1 . 2]" 1
2106 1 33 ASN QB 1 94 ASP HA 4.170 . 4.170 3.232 2.950 3.492 . 0 0 "[ . 1 . 2]" 1
2107 1 33 ASN QB 1 95 GLU H 4.150 . 4.150 2.321 2.000 2.827 . 0 0 "[ . 1 . 2]" 1
2108 1 33 ASN QB 1 95 GLU HA 4.390 . 4.390 3.341 2.903 3.707 . 0 0 "[ . 1 . 2]" 1
2109 1 33 ASN QB 1 95 GLU QG 4.320 . 4.320 2.698 2.381 3.145 . 0 0 "[ . 1 . 2]" 1
2110 1 33 ASN HD21 1 95 GLU QG 5.760 . 5.760 4.791 3.730 5.793 0.033 18 0 "[ . 1 . 2]" 1
2111 1 34 LEU H 1 34 LEU QD 3.880 . 3.880 2.583 2.355 2.730 . 0 0 "[ . 1 . 2]" 1
2112 1 34 LEU HA 1 34 LEU QD 3.010 . 3.010 1.975 1.917 2.063 . 0 0 "[ . 1 . 2]" 1
2113 1 34 LEU HB3 1 34 LEU QD 2.740 . 2.740 2.406 2.391 2.421 . 0 0 "[ . 1 . 2]" 1
2114 1 34 LEU QD 1 35 LYS H 3.520 . 3.520 3.309 3.166 3.467 . 0 0 "[ . 1 . 2]" 1
2115 1 34 LEU QD 1 46 PHE H 5.490 . 5.490 4.614 4.435 4.744 . 0 0 "[ . 1 . 2]" 1
2116 1 34 LEU QD 1 48 ILE H 4.170 . 4.170 3.159 2.827 3.380 . 0 0 "[ . 1 . 2]" 1
2117 1 34 LEU QD 1 48 ILE HG12 3.100 . 3.100 1.924 1.810 2.103 . 0 0 "[ . 1 . 2]" 1
2118 1 34 LEU QD 1 57 LEU MD2 3.330 . 3.330 2.847 2.640 3.004 . 0 0 "[ . 1 . 2]" 1
2119 1 34 LEU QD 1 87 PRO HA 4.800 . 4.800 4.212 4.030 4.440 . 0 0 "[ . 1 . 2]" 1
2120 1 34 LEU QD 1 87 PRO HB2 4.080 . 4.080 3.198 3.040 3.416 . 0 0 "[ . 1 . 2]" 1
2121 1 34 LEU QD 1 87 PRO HB3 3.940 . 3.940 2.855 2.721 3.038 . 0 0 "[ . 1 . 2]" 1
2122 1 34 LEU QD 1 87 PRO HG3 4.470 . 4.470 3.408 3.192 3.613 . 0 0 "[ . 1 . 2]" 1
2123 1 34 LEU QD 1 87 PRO QD 5.590 . 5.590 4.408 4.255 4.622 . 0 0 "[ . 1 . 2]" 1
2124 1 34 LEU QD 1 92 MET HB2 3.940 . 3.940 3.385 3.174 3.641 . 0 0 "[ . 1 . 2]" 1
2125 1 34 LEU QD 1 92 MET HG2 3.540 . 3.540 3.358 3.171 3.574 0.034 15 0 "[ . 1 . 2]" 1
2126 1 34 LEU QD 1 92 MET HG3 3.290 . 3.290 2.060 1.913 2.427 . 0 0 "[ . 1 . 2]" 1
2127 1 34 LEU QD 1 92 MET ME 2.520 . 2.520 1.984 1.873 2.132 . 0 0 "[ . 1 . 2]" 1
2128 1 34 LEU QD 1 93 GLU H 5.050 . 5.050 4.193 3.436 4.495 . 0 0 "[ . 1 . 2]" 1
2129 1 34 LEU QD 1 94 ASP H 5.700 . 5.700 4.598 4.408 4.840 . 0 0 "[ . 1 . 2]" 1
2130 1 34 LEU QD 1 94 ASP HA 3.630 . 3.630 3.043 2.915 3.228 . 0 0 "[ . 1 . 2]" 1
2131 1 34 LEU QD 1 95 GLU H 3.840 . 3.840 3.347 3.154 3.531 . 0 0 "[ . 1 . 2]" 1
2132 1 34 LEU QD 1 95 GLU HA 4.990 . 4.990 4.511 4.185 4.872 . 0 0 "[ . 1 . 2]" 1
2133 1 34 LEU QD 1 96 ASP H 3.300 . 3.300 2.968 2.798 3.119 . 0 0 "[ . 1 . 2]" 1
2134 1 34 LEU QD 1 96 ASP HA 4.610 . 4.610 4.622 4.516 4.691 0.081 5 0 "[ . 1 . 2]" 1
2135 1 34 LEU QD 1 96 ASP QB 3.260 . 3.260 2.500 2.254 2.684 . 0 0 "[ . 1 . 2]" 1
2136 1 34 LEU QD 1 97 THR H 5.920 . 5.920 5.223 4.886 5.602 . 0 0 "[ . 1 . 2]" 1
2137 1 35 LYS H 1 36 VAL QG 5.310 . 5.310 4.559 3.927 5.049 . 0 0 "[ . 1 . 2]" 1
2138 1 35 LYS H 1 96 ASP QB 5.120 . 5.120 4.002 3.659 4.224 . 0 0 "[ . 1 . 2]" 1
2139 1 35 LYS HA 1 36 VAL QG 3.710 . 3.710 3.307 3.223 3.369 . 0 0 "[ . 1 . 2]" 1
2140 1 35 LYS HB2 1 36 VAL QG 5.920 . 5.920 4.941 4.788 5.068 . 0 0 "[ . 1 . 2]" 1
2141 1 35 LYS HB3 1 43 VAL QG 3.200 . 3.200 2.349 2.103 2.635 . 0 0 "[ . 1 . 2]" 1
2142 1 35 LYS QD 1 43 VAL QG 3.350 . 3.350 2.961 2.744 3.194 . 0 0 "[ . 1 . 2]" 1
2143 1 35 LYS HE2 1 95 GLU QG 5.210 . 5.210 3.610 2.969 4.705 . 0 0 "[ . 1 . 2]" 1
2144 1 36 VAL H 1 36 VAL QG 3.320 . 3.320 2.269 1.842 2.751 . 0 0 "[ . 1 . 2]" 1
2145 1 36 VAL H 1 43 VAL QG 3.640 . 3.640 2.678 2.458 2.863 . 0 0 "[ . 1 . 2]" 1
2146 1 36 VAL HA 1 100 VAL QG 4.670 . 4.670 4.113 3.984 4.203 . 0 0 "[ . 1 . 2]" 1
2147 1 36 VAL HB 1 100 VAL QG 4.330 . 4.330 3.970 3.902 4.072 . 0 0 "[ . 1 . 2]" 1
2148 1 36 VAL QG 1 37 ALA H 3.510 . 3.510 2.535 2.425 2.658 . 0 0 "[ . 1 . 2]" 1
2149 1 36 VAL QG 1 37 ALA HA 4.620 . 4.620 3.521 3.375 3.758 . 0 0 "[ . 1 . 2]" 1
2150 1 36 VAL QG 1 37 ALA MB 4.090 . 4.090 3.876 3.824 3.930 . 0 0 "[ . 1 . 2]" 1
2151 1 36 VAL QG 1 38 GLY H 5.020 . 5.020 4.017 3.701 4.366 . 0 0 "[ . 1 . 2]" 1
2152 1 36 VAL QG 1 43 VAL HB 5.920 . 5.920 5.159 4.672 6.228 0.308 5 0 "[ . 1 . 2]" 1
2153 1 36 VAL QG 1 43 VAL QG 4.760 . 4.760 3.593 3.245 4.050 . 0 0 "[ . 1 . 2]" 1
2154 1 36 VAL QG 1 44 VAL H 3.940 . 3.940 2.953 2.127 3.906 . 0 0 "[ . 1 . 2]" 1
2155 1 36 VAL QG 1 44 VAL MG2 3.960 . 3.960 3.137 2.409 4.030 0.070 11 0 "[ . 1 . 2]" 1
2156 1 36 VAL QG 1 45 GLN HA 4.990 . 4.990 4.430 4.043 4.856 . 0 0 "[ . 1 . 2]" 1
2157 1 36 VAL QG 1 46 PHE QE 2.950 . 2.950 1.967 1.723 2.350 0.077 6 0 "[ . 1 . 2]" 1
2158 1 36 VAL QG 1 57 LEU MD1 3.230 . 3.230 2.432 2.053 2.858 . 0 0 "[ . 1 . 2]" 1
2159 1 36 VAL QG 1 57 LEU MD2 4.010 . 4.010 3.967 3.562 4.357 0.347 7 0 "[ . 1 . 2]" 1
2160 1 36 VAL QG 1 58 MET HA 5.040 . 5.040 3.737 3.430 4.083 . 0 0 "[ . 1 . 2]" 1
2161 1 36 VAL QG 1 61 TYR H 4.820 . 4.820 4.655 4.440 4.873 0.053 18 0 "[ . 1 . 2]" 1
2162 1 36 VAL QG 1 61 TYR HA 4.840 . 4.840 4.327 3.834 4.852 0.012 17 0 "[ . 1 . 2]" 1
2163 1 36 VAL QG 1 61 TYR HB2 4.380 . 4.380 2.780 2.442 3.160 . 0 0 "[ . 1 . 2]" 1
2164 1 36 VAL QG 1 61 TYR HB3 4.600 . 4.600 3.539 3.411 3.695 . 0 0 "[ . 1 . 2]" 1
2165 1 36 VAL QG 1 61 TYR QD 3.310 . 3.310 2.403 1.837 3.082 . 0 0 "[ . 1 . 2]" 1
2166 1 36 VAL QG 1 61 TYR QE 3.380 . 3.380 2.616 2.273 3.083 . 0 0 "[ . 1 . 2]" 1
2167 1 36 VAL QG 1 74 PHE HA 5.200 . 5.200 4.326 4.025 4.615 . 0 0 "[ . 1 . 2]" 1
2168 1 36 VAL QG 1 74 PHE QD 3.530 . 3.530 2.514 2.206 2.842 . 0 0 "[ . 1 . 2]" 1
2169 1 36 VAL QG 1 74 PHE QE 3.240 . 3.240 1.955 1.886 2.030 . 0 0 "[ . 1 . 2]" 1
2170 1 36 VAL QG 1 74 PHE HZ 3.860 . 3.860 3.754 3.623 3.812 . 0 0 "[ . 1 . 2]" 1
2171 1 36 VAL QG 1 97 THR HA 5.660 . 5.660 4.863 4.567 5.091 . 0 0 "[ . 1 . 2]" 1
2172 1 36 VAL QG 1 97 THR MG 5.200 . 5.200 4.289 3.985 4.527 . 0 0 "[ . 1 . 2]" 1
2173 1 36 VAL QG 1 98 ILE HB 3.480 . 3.480 1.918 1.713 2.197 0.087 14 0 "[ . 1 . 2]" 1
2174 1 36 VAL QG 1 98 ILE MG 3.430 . 3.430 2.323 2.070 2.661 . 0 0 "[ . 1 . 2]" 1
2175 1 36 VAL QG 1 98 ILE HG12 4.950 . 4.950 3.394 2.689 3.978 . 0 0 "[ . 1 . 2]" 1
2176 1 36 VAL QG 1 98 ILE MD 4.680 . 4.680 3.747 3.124 4.333 . 0 0 "[ . 1 . 2]" 1
2177 1 36 VAL QG 1 99 ASP H 5.290 . 5.290 4.445 4.143 4.739 . 0 0 "[ . 1 . 2]" 1
2178 1 36 VAL QG 1 99 ASP HA 4.610 . 4.610 4.329 4.081 4.598 . 0 0 "[ . 1 . 2]" 1
2179 1 36 VAL QG 1 100 VAL H 4.380 . 4.380 3.843 3.721 3.997 . 0 0 "[ . 1 . 2]" 1
2180 1 36 VAL QG 1 100 VAL HB 3.930 . 3.930 3.311 3.079 3.528 . 0 0 "[ . 1 . 2]" 1
2181 1 36 VAL QG 1 100 VAL QG 2.780 . 2.780 1.857 1.811 1.924 . 0 0 "[ . 1 . 2]" 1
2182 1 37 ALA H 1 43 VAL QG 4.610 . 4.610 3.949 3.550 4.247 . 0 0 "[ . 1 . 2]" 1
2183 1 37 ALA H 1 100 VAL QG 4.650 . 4.650 3.568 3.408 3.693 . 0 0 "[ . 1 . 2]" 1
2184 1 37 ALA HA 1 43 VAL QG 3.350 . 3.350 2.918 2.042 3.196 . 0 0 "[ . 1 . 2]" 1
2185 1 37 ALA MB 1 43 VAL QG 3.630 . 3.630 2.794 2.002 3.223 . 0 0 "[ . 1 . 2]" 1
2186 1 38 GLY H 1 43 VAL QG 4.890 . 4.890 4.251 3.160 4.531 . 0 0 "[ . 1 . 2]" 1
2187 1 38 GLY H 1 100 VAL QG 4.900 . 4.900 4.498 4.309 4.764 . 0 0 "[ . 1 . 2]" 1
2188 1 38 GLY HA2 1 39 GLN QE 5.230 . 5.230 2.927 2.217 3.563 . 0 0 "[ . 1 . 2]" 1
2189 1 38 GLY HA2 1 100 VAL QG 4.910 . 4.910 3.037 2.811 3.259 . 0 0 "[ . 1 . 2]" 1
2190 1 38 GLY HA3 1 40 ASP QB 4.880 . 4.880 4.197 3.561 4.964 0.084 15 0 "[ . 1 . 2]" 1
2191 1 38 GLY HA3 1 100 VAL QG 4.220 . 4.220 3.545 3.088 4.034 . 0 0 "[ . 1 . 2]" 1
2192 1 39 GLN H 1 39 GLN QB 3.140 . 3.140 2.700 2.463 2.789 . 0 0 "[ . 1 . 2]" 1
2193 1 39 GLN H 1 39 GLN QE 4.290 . 4.290 2.011 1.741 2.753 0.059 5 0 "[ . 1 . 2]" 1
2194 1 39 GLN H 1 100 VAL QG 4.640 . 4.640 3.598 3.082 3.962 . 0 0 "[ . 1 . 2]" 1
2195 1 39 GLN HA 1 39 GLN QE 4.490 . 4.490 3.716 2.556 4.060 . 0 0 "[ . 1 . 2]" 1
2196 1 39 GLN QB 1 40 ASP H 4.180 . 4.180 3.355 2.687 3.761 . 0 0 "[ . 1 . 2]" 1
2197 1 39 GLN QB 1 101 PHE HA 5.120 . 5.120 3.545 2.444 4.455 . 0 0 "[ . 1 . 2]" 1
2198 1 39 GLN QB 1 102 GLN H 5.690 . 5.690 4.138 3.356 4.640 . 0 0 "[ . 1 . 2]" 1
2199 1 39 GLN QE 1 39 GLN QG 3.050 . 3.050 2.140 2.101 2.190 . 0 0 "[ . 1 . 2]" 1
2200 1 39 GLN QG 1 40 ASP QB 5.710 . 5.710 5.149 4.586 5.786 0.076 17 0 "[ . 1 . 2]" 1
2201 1 39 GLN QG 1 100 VAL QG 4.660 . 4.660 3.529 2.730 4.066 . 0 0 "[ . 1 . 2]" 1
2202 1 39 GLN QE 1 40 ASP H 4.670 . 4.670 2.990 2.036 4.639 . 0 0 "[ . 1 . 2]" 1
2203 1 39 GLN QE 1 100 VAL QG 4.520 . 4.520 3.020 1.785 4.012 0.015 1 0 "[ . 1 . 2]" 1
2204 1 39 GLN QE 1 101 PHE H 5.810 . 5.810 4.837 3.596 5.792 . 0 0 "[ . 1 . 2]" 1
2205 1 39 GLN QE 1 101 PHE HA 4.940 . 4.940 3.494 2.508 4.560 . 0 0 "[ . 1 . 2]" 1
2206 1 40 ASP H 1 40 ASP QB 3.170 . 3.170 2.368 2.161 2.653 . 0 0 "[ . 1 . 2]" 1
2207 1 40 ASP QB 1 41 GLY H 3.920 . 3.920 3.305 2.898 3.839 . 0 0 "[ . 1 . 2]" 1
2208 1 40 ASP QB 1 42 SER H 4.590 . 4.590 3.293 2.478 4.350 . 0 0 "[ . 1 . 2]" 1
2209 1 40 ASP QB 1 42 SER QB 4.750 . 4.750 3.444 2.686 4.586 . 0 0 "[ . 1 . 2]" 1
2210 1 41 GLY HA2 1 43 VAL QG 5.900 . 5.900 5.085 3.843 5.708 . 0 0 "[ . 1 . 2]" 1
2211 1 42 SER H 1 42 SER QB 3.050 . 3.050 2.427 2.233 3.060 0.010 2 0 "[ . 1 . 2]" 1
2212 1 42 SER H 1 43 VAL QG 5.000 . 5.000 4.824 4.185 5.064 0.064 18 0 "[ . 1 . 2]" 1
2213 1 42 SER HA 1 43 VAL QG 3.400 . 3.400 3.335 3.238 3.441 0.041 16 0 "[ . 1 . 2]" 1
2214 1 42 SER QB 1 43 VAL H 3.700 . 3.700 3.336 2.527 3.782 0.082 4 0 "[ . 1 . 2]" 1
2215 1 42 SER QB 1 43 VAL QG 4.930 . 4.930 4.450 4.110 4.694 . 0 0 "[ . 1 . 2]" 1
2216 1 43 VAL H 1 43 VAL QG 3.020 . 3.020 2.314 1.984 2.876 . 0 0 "[ . 1 . 2]" 1
2217 1 43 VAL QG 1 44 VAL H 3.010 . 3.010 2.413 2.289 2.544 . 0 0 "[ . 1 . 2]" 1
2218 1 43 VAL QG 1 44 VAL HA 3.720 . 3.720 3.384 3.304 3.654 . 0 0 "[ . 1 . 2]" 1
2219 1 43 VAL QG 1 45 GLN H 4.530 . 4.530 4.087 3.973 4.355 . 0 0 "[ . 1 . 2]" 1
2220 1 43 VAL QG 1 45 GLN HG2 4.460 . 4.460 4.215 4.012 4.471 0.011 14 0 "[ . 1 . 2]" 1
2221 1 43 VAL QG 1 45 GLN HG3 3.370 . 3.370 3.052 2.872 3.330 . 0 0 "[ . 1 . 2]" 1
2222 1 43 VAL QG 1 45 GLN HE21 3.820 . 3.820 2.173 2.001 2.622 . 0 0 "[ . 1 . 2]" 1
2223 1 43 VAL QG 1 45 GLN HE22 4.360 . 4.360 2.885 2.668 3.756 . 0 0 "[ . 1 . 2]" 1
2224 1 48 ILE HA 1 49 LYS QG 5.350 . 5.350 4.092 3.301 4.908 . 0 0 "[ . 1 . 2]" 1
2225 1 49 LYS H 1 49 LYS QG 3.400 . 3.400 2.799 2.180 3.493 0.093 20 0 "[ . 1 . 2]" 1
2226 1 49 LYS HB2 1 49 LYS QE 3.620 . 3.620 2.629 2.044 3.733 0.113 4 0 "[ . 1 . 2]" 1
2227 1 49 LYS HB3 1 49 LYS QE 4.370 . 4.370 3.213 1.926 4.249 . 0 0 "[ . 1 . 2]" 1
2228 1 49 LYS QG 1 50 ARG H 4.930 . 4.930 3.810 3.581 4.110 . 0 0 "[ . 1 . 2]" 1
2229 1 49 LYS QG 1 51 HIS H 5.190 . 5.190 4.331 4.064 4.678 . 0 0 "[ . 1 . 2]" 1
2230 1 49 LYS QG 1 52 THR H 5.210 . 5.210 4.762 4.615 5.039 . 0 0 "[ . 1 . 2]" 1
2231 1 49 LYS QG 1 52 THR HB 4.320 . 4.320 4.005 3.461 4.403 0.083 1 0 "[ . 1 . 2]" 1
2232 1 49 LYS QE 1 52 THR HB 4.990 . 4.990 3.977 2.881 5.041 0.051 2 0 "[ . 1 . 2]" 1
2233 1 49 LYS QE 1 52 THR MG 4.420 . 4.420 4.152 2.899 4.863 0.443 7 0 "[ . 1 . 2]" 1
2234 1 53 PRO HA 1 54 LEU QD 4.200 . 4.200 3.822 3.006 4.089 . 0 0 "[ . 1 . 2]" 1
2235 1 53 PRO HB3 1 54 LEU QD 4.930 . 4.930 4.748 4.131 4.948 0.018 14 0 "[ . 1 . 2]" 1
2236 1 54 LEU H 1 54 LEU QD 3.480 . 3.480 2.469 1.698 2.740 0.102 17 0 "[ . 1 . 2]" 1
2237 1 54 LEU HA 1 54 LEU QD 3.530 . 3.530 3.359 3.147 3.388 . 0 0 "[ . 1 . 2]" 1
2238 1 54 LEU QD 1 55 SER H 4.170 . 4.170 2.067 1.843 2.173 . 0 0 "[ . 1 . 2]" 1
2239 1 54 LEU QD 1 55 SER HA 4.260 . 4.260 2.910 2.770 3.492 . 0 0 "[ . 1 . 2]" 1
2240 1 54 LEU QD 1 56 LYS H 5.480 . 5.480 4.262 4.173 4.382 . 0 0 "[ . 1 . 2]" 1
2241 1 54 LEU QD 1 57 LEU MD2 4.590 . 4.590 3.489 3.129 3.806 . 0 0 "[ . 1 . 2]" 1
2242 1 54 LEU QD 1 58 MET H 4.320 . 4.320 4.308 4.172 4.613 0.293 8 0 "[ . 1 . 2]" 1
2243 1 54 LEU QD 1 58 MET ME 2.800 . 2.800 2.277 2.034 2.934 0.134 13 0 "[ . 1 . 2]" 1
2244 1 54 LEU QD 1 81 ILE HA 4.690 . 4.690 4.162 4.055 4.354 . 0 0 "[ . 1 . 2]" 1
2245 1 54 LEU QD 1 81 ILE MG 2.620 . 2.620 1.842 1.740 1.997 0.060 6 0 "[ . 1 . 2]" 1
2246 1 54 LEU QD 1 82 ASN H 4.150 . 4.150 3.529 3.334 3.870 . 0 0 "[ . 1 . 2]" 1
2247 1 54 LEU QD 1 83 GLU HA 3.120 . 3.120 3.162 2.928 3.398 0.278 9 0 "[ . 1 . 2]" 1
2248 1 54 LEU QD 1 83 GLU HB3 5.500 . 5.500 4.994 4.686 5.283 . 0 0 "[ . 1 . 2]" 1
2249 1 54 LEU QD 1 84 THR H 5.920 . 5.920 4.680 4.553 4.924 . 0 0 "[ . 1 . 2]" 1
2250 1 54 LEU QD 1 85 ASP H 4.600 . 4.600 3.193 2.947 3.367 . 0 0 "[ . 1 . 2]" 1
2251 1 54 LEU QD 1 85 ASP HB2 4.600 . 4.600 3.055 2.015 3.973 . 0 0 "[ . 1 . 2]" 1
2252 1 54 LEU QD 1 85 ASP HB3 4.230 . 4.230 2.553 1.956 3.083 . 0 0 "[ . 1 . 2]" 1
2253 1 54 LEU QD 1 86 THR H 4.340 . 4.340 3.915 3.495 4.070 . 0 0 "[ . 1 . 2]" 1
2254 1 54 LEU QD 1 86 THR HA 3.910 . 3.910 3.098 2.302 3.656 . 0 0 "[ . 1 . 2]" 1
2255 1 54 LEU QD 1 86 THR HB 5.920 . 5.920 4.829 4.502 5.326 . 0 0 "[ . 1 . 2]" 1
2256 1 54 LEU QD 1 87 PRO HA 3.960 . 3.960 2.526 2.277 2.910 . 0 0 "[ . 1 . 2]" 1
2257 1 54 LEU QD 1 87 PRO HB2 4.970 . 4.970 4.397 4.129 4.758 . 0 0 "[ . 1 . 2]" 1
2258 1 54 LEU QD 1 87 PRO QD 3.900 . 3.900 2.729 2.026 3.006 . 0 0 "[ . 1 . 2]" 1
2259 1 54 LEU QD 1 89 GLN H 5.570 . 5.570 4.924 4.663 5.337 . 0 0 "[ . 1 . 2]" 1
2260 1 54 LEU QD 1 89 GLN HB3 5.920 . 5.920 5.509 4.634 6.044 0.124 14 0 "[ . 1 . 2]" 1
2261 1 54 LEU QD 1 90 LEU MD1 3.430 . 3.430 2.367 2.017 2.723 . 0 0 "[ . 1 . 2]" 1
2262 1 55 SER H 1 58 MET QG 5.270 . 5.270 4.187 4.064 4.771 . 0 0 "[ . 1 . 2]" 1
2263 1 55 SER HA 1 58 MET QG 4.250 . 4.250 2.715 2.533 3.333 . 0 0 "[ . 1 . 2]" 1
2264 1 56 LYS H 1 56 LYS QB 3.070 . 3.070 2.508 2.410 2.581 . 0 0 "[ . 1 . 2]" 1
2265 1 56 LYS QB 1 56 LYS QD 2.940 . 2.940 2.279 2.100 2.372 . 0 0 "[ . 1 . 2]" 1
2266 1 56 LYS QB 1 56 LYS QE 3.480 . 3.480 2.217 1.944 3.504 0.024 18 0 "[ . 1 . 2]" 1
2267 1 56 LYS QB 1 57 LEU H 3.210 . 3.210 2.428 2.249 2.610 . 0 0 "[ . 1 . 2]" 1
2268 1 56 LYS QB 1 57 LEU HA 4.460 . 4.460 3.882 3.779 3.968 . 0 0 "[ . 1 . 2]" 1
2269 1 57 LEU MD2 1 58 MET QG 4.760 . 4.760 3.663 3.536 3.786 . 0 0 "[ . 1 . 2]" 1
2270 1 58 MET H 1 58 MET QG 3.690 . 3.690 2.334 2.250 2.422 . 0 0 "[ . 1 . 2]" 1
2271 1 58 MET QG 1 69 MET ME 4.650 . 4.650 3.942 3.686 4.065 . 0 0 "[ . 1 . 2]" 1
2272 1 58 MET QG 1 74 PHE QE 4.690 . 4.690 3.459 3.225 3.587 . 0 0 "[ . 1 . 2]" 1
2273 1 58 MET ME 1 83 GLU QG 5.190 . 5.190 4.285 3.983 4.668 . 0 0 "[ . 1 . 2]" 1
2274 1 59 LYS HA 1 59 LYS QG 3.210 . 3.210 2.377 2.214 2.743 . 0 0 "[ . 1 . 2]" 1
2275 1 59 LYS HA 1 62 CYS QB 4.160 . 4.160 3.601 2.948 4.039 . 0 0 "[ . 1 . 2]" 1
2276 1 59 LYS QE 1 59 LYS QG 3.160 . 3.160 2.282 2.076 2.800 . 0 0 "[ . 1 . 2]" 1
2277 1 59 LYS QG 1 69 MET QG 3.750 . 3.750 3.171 2.848 3.812 0.062 16 0 "[ . 1 . 2]" 1
2278 1 59 LYS QG 1 69 MET ME 3.190 . 3.190 2.006 1.866 2.338 . 0 0 "[ . 1 . 2]" 1
2279 1 61 TYR H 1 62 CYS QB 5.140 . 5.140 5.053 4.862 5.179 0.039 9 0 "[ . 1 . 2]" 1
2280 1 61 TYR QD 1 62 CYS QB 4.270 . 4.270 3.388 2.934 4.054 . 0 0 "[ . 1 . 2]" 1
2281 1 61 TYR QD 1 67 LEU QD 4.530 . 4.530 4.341 3.678 4.454 . 0 0 "[ . 1 . 2]" 1
2282 1 61 TYR QD 1 100 VAL QG 4.390 . 4.390 3.359 3.252 3.512 . 0 0 "[ . 1 . 2]" 1
2283 1 61 TYR QE 1 62 CYS QB 5.250 . 5.250 4.745 4.305 5.357 0.107 14 0 "[ . 1 . 2]" 1
2284 1 61 TYR QE 1 67 LEU QD 3.530 . 3.530 3.453 2.418 3.583 0.053 19 0 "[ . 1 . 2]" 1
2285 1 62 CYS H 1 62 CYS QB 3.170 . 3.170 2.586 2.542 2.622 . 0 0 "[ . 1 . 2]" 1
2286 1 62 CYS HA 1 67 LEU QD 3.330 . 3.330 3.406 3.351 3.467 0.137 13 0 "[ . 1 . 2]" 1
2287 1 62 CYS QB 1 63 GLU H 4.120 . 4.120 3.129 2.469 3.529 . 0 0 "[ . 1 . 2]" 1
2288 1 62 CYS QB 1 63 GLU HB2 5.810 . 5.810 5.174 4.452 5.564 . 0 0 "[ . 1 . 2]" 1
2289 1 62 CYS QB 1 65 GLN H 5.740 . 5.740 4.975 4.886 5.080 . 0 0 "[ . 1 . 2]" 1
2290 1 62 CYS QB 1 67 LEU H 4.120 . 4.120 3.373 3.155 3.766 . 0 0 "[ . 1 . 2]" 1
2291 1 62 CYS QB 1 67 LEU HB2 3.950 . 3.950 2.967 2.664 3.416 . 0 0 "[ . 1 . 2]" 1
2292 1 62 CYS QB 1 67 LEU QD 4.370 . 4.370 4.131 3.924 4.379 0.009 7 0 "[ . 1 . 2]" 1
2293 1 62 CYS QB 1 68 SER H 4.630 . 4.630 3.937 3.732 4.247 . 0 0 "[ . 1 . 2]" 1
2294 1 62 CYS QB 1 69 MET H 4.850 . 4.850 3.912 3.732 4.100 . 0 0 "[ . 1 . 2]" 1
2295 1 62 CYS QB 1 69 MET HA 4.210 . 4.210 4.111 3.818 4.310 0.100 20 0 "[ . 1 . 2]" 1
2296 1 62 CYS QB 1 69 MET HB2 5.810 . 5.810 5.366 5.150 5.598 . 0 0 "[ . 1 . 2]" 1
2297 1 62 CYS QB 1 69 MET ME 3.700 . 3.700 3.099 2.922 3.325 . 0 0 "[ . 1 . 2]" 1
2298 1 62 CYS QB 1 72 ILE MD 4.460 . 4.460 2.546 1.985 3.362 . 0 0 "[ . 1 . 2]" 1
2299 1 62 CYS QB 1 74 PHE QE 4.980 . 4.980 3.891 3.285 4.549 . 0 0 "[ . 1 . 2]" 1
2300 1 62 CYS QB 1 74 PHE HZ 5.230 . 5.230 3.752 3.102 4.526 . 0 0 "[ . 1 . 2]" 1
2301 1 62 CYS QB 1 100 VAL QG 5.730 . 5.730 4.982 4.528 5.598 . 0 0 "[ . 1 . 2]" 1
2302 1 65 GLN H 1 67 LEU QD 4.370 . 4.370 4.102 3.991 4.217 . 0 0 "[ . 1 . 2]" 1
2303 1 65 GLN HA 1 67 LEU QD 4.340 . 4.340 3.743 3.636 3.834 . 0 0 "[ . 1 . 2]" 1
2304 1 65 GLN HB2 1 67 LEU QD 3.190 . 3.190 2.227 2.038 2.517 . 0 0 "[ . 1 . 2]" 1
2305 1 65 GLN HB3 1 67 LEU QD 4.040 . 4.040 1.954 1.833 2.077 . 0 0 "[ . 1 . 2]" 1
2306 1 65 GLN QG 1 67 LEU QD 4.090 . 4.090 3.243 2.708 3.342 . 0 0 "[ . 1 . 2]" 1
2307 1 66 GLY H 1 67 LEU QD 4.990 . 4.990 3.502 3.380 3.810 . 0 0 "[ . 1 . 2]" 1
2308 1 66 GLY QA 1 67 LEU QD 4.300 . 4.300 3.101 3.022 3.242 . 0 0 "[ . 1 . 2]" 1
2309 1 67 LEU H 1 67 LEU QD 3.300 . 3.300 2.714 2.244 3.059 . 0 0 "[ . 1 . 2]" 1
2310 1 67 LEU HA 1 67 LEU QD 2.910 . 2.910 1.938 1.899 2.036 . 0 0 "[ . 1 . 2]" 1
2311 1 67 LEU HB3 1 67 LEU QD 3.110 . 3.110 2.371 2.346 2.403 . 0 0 "[ . 1 . 2]" 1
2312 1 67 LEU QD 1 68 SER H 3.480 . 3.480 3.048 2.845 3.656 0.176 14 0 "[ . 1 . 2]" 1
2313 1 67 LEU QD 1 68 SER HB2 5.720 . 5.720 4.807 4.668 5.406 . 0 0 "[ . 1 . 2]" 1
2314 1 67 LEU QD 1 71 GLN HB2 4.390 . 4.390 3.698 3.436 4.522 0.132 14 0 "[ . 1 . 2]" 1
2315 1 67 LEU QD 1 72 ILE MG 2.910 . 2.910 2.289 1.806 2.728 . 0 0 "[ . 1 . 2]" 1
2316 1 67 LEU QD 1 102 GLN HE21 4.150 . 4.150 3.473 2.835 4.094 . 0 0 "[ . 1 . 2]" 1
2317 1 67 LEU QD 1 102 GLN HE22 3.470 . 3.470 2.281 1.925 3.101 . 0 0 "[ . 1 . 2]" 1
2318 1 71 GLN HA 1 103 GLN QB 4.700 . 4.700 4.019 3.262 4.643 . 0 0 "[ . 1 . 2]" 1
2319 1 71 GLN HA 1 104 GLN QE 4.710 . 4.710 4.535 3.334 4.863 0.153 19 0 "[ . 1 . 2]" 1
2320 1 72 ILE H 1 100 VAL QG 5.210 . 5.210 5.096 4.995 5.178 . 0 0 "[ . 1 . 2]" 1
2321 1 72 ILE H 1 103 GLN QB 4.580 . 4.580 3.854 3.311 4.327 . 0 0 "[ . 1 . 2]" 1
2322 1 72 ILE HA 1 100 VAL QG 4.570 . 4.570 3.844 3.662 3.985 . 0 0 "[ . 1 . 2]" 1
2323 1 72 ILE HB 1 100 VAL QG 3.400 . 3.400 2.105 1.970 2.244 . 0 0 "[ . 1 . 2]" 1
2324 1 72 ILE MG 1 100 VAL QG 3.030 . 3.030 2.817 2.682 2.994 . 0 0 "[ . 1 . 2]" 1
2325 1 72 ILE HG13 1 100 VAL QG 3.980 . 3.980 2.956 2.838 3.043 . 0 0 "[ . 1 . 2]" 1
2326 1 72 ILE MD 1 100 VAL QG 2.860 . 2.860 1.949 1.879 2.041 . 0 0 "[ . 1 . 2]" 1
2327 1 73 ARG H 1 100 VAL QG 3.920 . 3.920 2.511 2.299 2.630 . 0 0 "[ . 1 . 2]" 1
2328 1 73 ARG HA 1 100 VAL QG 4.770 . 4.770 3.965 3.877 4.084 . 0 0 "[ . 1 . 2]" 1
2329 1 73 ARG HB2 1 100 VAL QG 5.500 . 5.500 4.593 4.441 4.731 . 0 0 "[ . 1 . 2]" 1
2330 1 73 ARG HG3 1 103 GLN QB 4.450 . 4.450 3.792 3.209 4.462 0.012 13 0 "[ . 1 . 2]" 1
2331 1 73 ARG HD2 1 100 VAL QG 5.920 . 5.920 5.937 5.781 6.101 0.181 8 0 "[ . 1 . 2]" 1
2332 1 73 ARG HE 1 103 GLN QB 5.810 . 5.810 4.729 3.763 5.612 . 0 0 "[ . 1 . 2]" 1
2333 1 74 PHE H 1 100 VAL QG 5.920 . 5.920 3.906 3.736 4.048 . 0 0 "[ . 1 . 2]" 1
2334 1 74 PHE HA 1 100 VAL QG 3.490 . 3.490 2.313 2.148 2.495 . 0 0 "[ . 1 . 2]" 1
2335 1 74 PHE QD 1 100 VAL QG 3.260 . 3.260 2.571 2.497 2.648 . 0 0 "[ . 1 . 2]" 1
2336 1 74 PHE QE 1 100 VAL QG 3.610 . 3.610 2.763 2.667 2.879 . 0 0 "[ . 1 . 2]" 1
2337 1 74 PHE HZ 1 100 VAL QG 4.070 . 4.070 3.509 3.375 3.666 . 0 0 "[ . 1 . 2]" 1
2338 1 75 ARG H 1 100 VAL QG 4.780 . 4.780 3.593 3.459 3.741 . 0 0 "[ . 1 . 2]" 1
2339 1 76 PHE HZ 1 96 ASP QB 3.710 . 3.710 3.605 2.928 4.081 0.371 11 0 "[ . 1 . 2]" 1
2340 1 79 GLN HA 1 80 PRO QG 4.130 . 4.130 3.973 3.761 4.046 . 0 0 "[ . 1 . 2]" 1
2341 1 80 PRO QG 1 81 ILE H 4.820 . 4.820 4.585 4.509 4.793 . 0 0 "[ . 1 . 2]" 1
2342 1 82 ASN HA 1 83 GLU QG 4.810 . 4.810 4.208 3.783 5.067 0.257 12 0 "[ . 1 . 2]" 1
2343 1 82 ASN HB3 1 83 GLU QG 4.390 . 4.390 3.822 3.263 4.441 0.051 3 0 "[ . 1 . 2]" 1
2344 1 83 GLU H 1 83 GLU QG 3.480 . 3.480 2.080 1.754 2.864 0.046 15 0 "[ . 1 . 2]" 1
2345 1 83 GLU HA 1 83 GLU QG 3.450 . 3.450 3.367 3.330 3.502 0.052 6 0 "[ . 1 . 2]" 1
2346 1 83 GLU QG 1 84 THR H 3.830 . 3.830 2.729 2.580 3.125 . 0 0 "[ . 1 . 2]" 1
2347 1 83 GLU QG 1 84 THR HA 4.380 . 4.380 3.704 3.444 4.884 0.504 15 1 "[ . 1 + 2]" 1
2348 1 83 GLU QG 1 84 THR MG 3.290 . 3.290 2.629 2.021 3.648 0.358 15 0 "[ . 1 . 2]" 1
2349 1 88 ALA MB 1 89 GLN QE 4.550 . 4.550 3.733 2.762 4.830 0.280 20 0 "[ . 1 . 2]" 1
2350 1 89 GLN HA 1 89 GLN QE 4.950 . 4.950 2.593 1.942 3.533 . 0 0 "[ . 1 . 2]" 1
2351 1 89 GLN QE 1 89 GLN QG 3.040 . 3.040 2.245 2.116 2.657 . 0 0 "[ . 1 . 2]" 1
2352 1 91 GLU H 1 91 GLU QB 3.530 . 3.530 3.125 2.860 3.336 . 0 0 "[ . 1 . 2]" 1
2353 1 91 GLU QB 1 92 MET H 4.470 . 4.470 3.910 3.777 4.044 . 0 0 "[ . 1 . 2]" 1
2354 1 92 MET HA 1 96 ASP QB 5.070 . 5.070 4.336 4.116 4.793 . 0 0 "[ . 1 . 2]" 1
2355 1 92 MET HB2 1 96 ASP QB 3.740 . 3.740 2.772 2.564 3.042 . 0 0 "[ . 1 . 2]" 1
2356 1 92 MET HB3 1 96 ASP QB 5.590 . 5.590 4.190 3.968 4.463 . 0 0 "[ . 1 . 2]" 1
2357 1 92 MET HG2 1 96 ASP QB 5.440 . 5.440 4.848 4.535 5.203 . 0 0 "[ . 1 . 2]" 1
2358 1 92 MET ME 1 96 ASP QB 3.330 . 3.330 2.742 2.387 3.070 . 0 0 "[ . 1 . 2]" 1
2359 1 93 GLU H 1 96 ASP QB 4.110 . 4.110 2.827 2.433 3.246 . 0 0 "[ . 1 . 2]" 1
2360 1 93 GLU HG2 1 96 ASP QB 4.970 . 4.970 3.156 2.448 4.128 . 0 0 "[ . 1 . 2]" 1
2361 1 93 GLU HG3 1 96 ASP QB 5.120 . 5.120 3.642 2.723 4.559 . 0 0 "[ . 1 . 2]" 1
2362 1 94 ASP HA 1 95 GLU QG 5.460 . 5.460 4.217 3.928 4.493 . 0 0 "[ . 1 . 2]" 1
2363 1 94 ASP QB 1 95 GLU QG 3.290 . 3.290 2.919 2.681 3.296 0.006 14 0 "[ . 1 . 2]" 1
2364 1 95 GLU H 1 96 ASP QB 5.220 . 5.220 4.271 4.051 4.419 . 0 0 "[ . 1 . 2]" 1
2365 1 95 GLU HA 1 95 GLU QG 3.320 . 3.320 2.396 2.197 2.823 . 0 0 "[ . 1 . 2]" 1
2366 1 95 GLU QG 1 96 ASP H 5.200 . 5.200 4.485 4.442 4.542 . 0 0 "[ . 1 . 2]" 1
2367 1 96 ASP H 1 96 ASP QB 3.050 . 3.050 2.176 2.057 2.288 . 0 0 "[ . 1 . 2]" 1
2368 1 96 ASP QB 1 97 THR H 3.580 . 3.580 3.137 2.802 3.478 . 0 0 "[ . 1 . 2]" 1
2369 1 98 ILE HB 1 100 VAL QG 4.540 . 4.540 3.472 3.348 3.601 . 0 0 "[ . 1 . 2]" 1
2370 1 98 ILE MG 1 100 VAL QG 3.850 . 3.850 2.525 2.403 2.659 . 0 0 "[ . 1 . 2]" 1
2371 1 99 ASP H 1 100 VAL QG 5.370 . 5.370 4.228 4.131 4.299 . 0 0 "[ . 1 . 2]" 1
2372 1 99 ASP HA 1 100 VAL QG 4.690 . 4.690 3.763 3.611 3.943 . 0 0 "[ . 1 . 2]" 1
2373 1 99 ASP QB 1 100 VAL QG 5.920 . 5.920 4.477 4.320 4.617 . 0 0 "[ . 1 . 2]" 1
2374 1 100 VAL H 1 100 VAL QG 3.210 . 3.210 2.687 2.586 2.828 . 0 0 "[ . 1 . 2]" 1
2375 1 100 VAL QG 1 101 PHE H 3.200 . 3.200 2.371 2.299 2.425 . 0 0 "[ . 1 . 2]" 1
2376 1 100 VAL QG 1 101 PHE HB2 5.920 . 5.920 4.959 4.900 5.049 . 0 0 "[ . 1 . 2]" 1
2377 1 100 VAL QG 1 101 PHE QD 5.230 . 5.230 4.200 4.122 4.242 . 0 0 "[ . 1 . 2]" 1
2378 1 100 VAL QG 1 102 GLN H 4.790 . 4.790 4.488 4.321 4.730 . 0 0 "[ . 1 . 2]" 1
2379 1 100 VAL QG 1 102 GLN HA 5.920 . 5.920 4.232 4.073 4.314 . 0 0 "[ . 1 . 2]" 1
2380 1 100 VAL QG 1 102 GLN HE21 5.180 . 5.180 4.329 3.930 5.010 . 0 0 "[ . 1 . 2]" 1
2381 1 100 VAL QG 1 102 GLN HE22 4.960 . 4.960 4.736 4.278 4.993 0.033 4 0 "[ . 1 . 2]" 1
2382 1 101 PHE QE 1 103 GLN QB 5.810 . 5.810 4.629 4.168 5.484 . 0 0 "[ . 1 . 2]" 1
2383 1 102 GLN HA 1 103 GLN QB 4.250 . 4.250 4.250 3.934 4.299 0.049 6 0 "[ . 1 . 2]" 1
2384 1 103 GLN HA 1 103 GLN QB 2.580 . 2.580 2.433 2.392 2.486 . 0 0 "[ . 1 . 2]" 1
2385 1 103 GLN QB 1 104 GLN H 4.240 . 4.240 3.672 3.592 3.780 . 0 0 "[ . 1 . 2]" 1
2386 1 104 GLN QE 1 104 GLN QG 3.100 . 3.100 2.339 2.116 2.694 . 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 52
_Distance_constraint_stats_list.Viol_count 186
_Distance_constraint_stats_list.Viol_total 138.342
_Distance_constraint_stats_list.Viol_max 0.151
_Distance_constraint_stats_list.Viol_rms 0.0195
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0067
_Distance_constraint_stats_list.Viol_average_violations_only 0.0372
_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 32 ILE 0.688 0.100 6 0 "[ . 1 . 2]"
1 33 ASN 1.092 0.134 6 0 "[ . 1 . 2]"
1 34 LEU 0.012 0.009 5 0 "[ . 1 . 2]"
1 35 LYS 0.745 0.091 18 0 "[ . 1 . 2]"
1 36 VAL 0.168 0.049 1 0 "[ . 1 . 2]"
1 37 ALA 0.620 0.089 15 0 "[ . 1 . 2]"
1 38 GLY 0.801 0.136 11 0 "[ . 1 . 2]"
1 41 GLY 0.518 0.136 11 0 "[ . 1 . 2]"
1 42 SER 0.283 0.071 13 0 "[ . 1 . 2]"
1 44 VAL 0.168 0.049 1 0 "[ . 1 . 2]"
1 46 PHE 0.012 0.009 5 0 "[ . 1 . 2]"
1 48 ILE 0.688 0.100 6 0 "[ . 1 . 2]"
1 54 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 LYS 0.145 0.068 11 0 "[ . 1 . 2]"
1 57 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 LYS 0.025 0.022 20 0 "[ . 1 . 2]"
1 60 ALA 0.145 0.068 11 0 "[ . 1 . 2]"
1 61 TYR 0.013 0.008 3 0 "[ . 1 . 2]"
1 63 GLU 0.025 0.022 20 0 "[ . 1 . 2]"
1 64 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 GLN 0.013 0.008 3 0 "[ . 1 . 2]"
1 73 ARG 2.381 0.151 13 0 "[ . 1 . 2]"
1 74 PHE 0.052 0.016 11 0 "[ . 1 . 2]"
1 75 ARG 0.018 0.017 13 0 "[ . 1 . 2]"
1 76 PHE 0.157 0.030 3 0 "[ . 1 . 2]"
1 79 GLN 0.157 0.030 3 0 "[ . 1 . 2]"
1 81 ILE 0.052 0.016 11 0 "[ . 1 . 2]"
1 95 GLU 1.092 0.134 6 0 "[ . 1 . 2]"
1 96 ASP 0.105 0.062 2 0 "[ . 1 . 2]"
1 98 ILE 0.904 0.091 18 0 "[ . 1 . 2]"
1 99 ASP 0.018 0.017 13 0 "[ . 1 . 2]"
1 100 VAL 0.356 0.089 15 0 "[ . 1 . 2]"
1 101 PHE 2.381 0.151 13 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 54 LEU O 1 58 MET H 2.220 . 2.220 2.088 1.949 2.217 . 0 0 "[ . 1 . 2]" 2
2 1 54 LEU O 1 58 MET N 3.130 . 3.130 3.023 2.908 3.129 . 0 0 "[ . 1 . 2]" 2
3 1 55 SER O 1 59 LYS H 2.220 . 2.220 1.913 1.801 2.079 . 0 0 "[ . 1 . 2]" 2
4 1 55 SER O 1 59 LYS N 3.130 . 3.130 2.886 2.780 3.059 . 0 0 "[ . 1 . 2]" 2
5 1 56 LYS O 1 60 ALA H 2.220 . 2.220 2.154 1.998 2.288 0.068 11 0 "[ . 1 . 2]" 2
6 1 56 LYS O 1 60 ALA N 3.130 . 3.130 3.027 2.905 3.137 0.007 11 0 "[ . 1 . 2]" 2
7 1 57 LEU O 1 61 TYR H 2.220 . 2.220 1.921 1.850 2.037 . 0 0 "[ . 1 . 2]" 2
8 1 57 LEU O 1 61 TYR N 3.130 . 3.130 2.798 2.761 2.844 . 0 0 "[ . 1 . 2]" 2
9 1 59 LYS O 1 63 GLU H 2.220 . 2.220 1.980 1.778 2.076 0.022 20 0 "[ . 1 . 2]" 2
10 1 59 LYS O 1 63 GLU N 3.130 . 3.130 2.918 2.733 3.006 . 0 0 "[ . 1 . 2]" 2
11 1 60 ALA O 1 64 ARG H 2.220 . 2.220 2.040 1.918 2.149 . 0 0 "[ . 1 . 2]" 2
12 1 60 ALA O 1 64 ARG N 3.130 . 3.130 2.948 2.841 3.052 . 0 0 "[ . 1 . 2]" 2
13 1 61 TYR O 1 65 GLN H 2.220 . 2.220 1.852 1.792 1.959 0.008 3 0 "[ . 1 . 2]" 2
14 1 61 TYR O 1 65 GLN N 3.130 . 3.130 2.777 2.730 2.830 . 0 0 "[ . 1 . 2]" 2
15 1 32 ILE H 1 48 ILE O 2.120 . 2.120 1.810 1.700 1.902 0.100 6 0 "[ . 1 . 2]" 2
16 1 32 ILE N 1 48 ILE O 3.050 . 3.050 2.737 2.676 2.841 . 0 0 "[ . 1 . 2]" 2
17 1 34 LEU H 1 46 PHE O 2.120 . 2.120 1.964 1.849 2.052 . 0 0 "[ . 1 . 2]" 2
18 1 34 LEU N 1 46 PHE O 3.050 . 3.050 2.884 2.790 2.981 . 0 0 "[ . 1 . 2]" 2
19 1 36 VAL H 1 44 VAL O 2.120 . 2.120 1.993 1.931 2.081 . 0 0 "[ . 1 . 2]" 2
20 1 36 VAL N 1 44 VAL O 3.050 . 3.050 2.915 2.866 2.988 . 0 0 "[ . 1 . 2]" 2
21 1 38 GLY H 1 42 SER O 2.120 . 2.120 1.870 1.729 2.103 0.071 13 0 "[ . 1 . 2]" 2
22 1 38 GLY N 1 42 SER O 3.050 . 3.050 2.833 2.703 3.029 . 0 0 "[ . 1 . 2]" 2
23 1 38 GLY O 1 41 GLY H 2.120 . 2.120 1.966 1.789 2.256 0.136 11 0 "[ . 1 . 2]" 2
24 1 38 GLY O 1 41 GLY N 3.050 . 3.050 2.881 2.739 3.084 0.034 13 0 "[ . 1 . 2]" 2
25 1 36 VAL O 1 44 VAL H 2.120 . 2.120 2.070 1.964 2.169 0.049 1 0 "[ . 1 . 2]" 2
26 1 36 VAL O 1 44 VAL N 3.050 . 3.050 2.962 2.865 3.060 0.010 1 0 "[ . 1 . 2]" 2
27 1 34 LEU O 1 46 PHE H 2.120 . 2.120 1.902 1.791 2.108 0.009 5 0 "[ . 1 . 2]" 2
28 1 34 LEU O 1 46 PHE N 3.050 . 3.050 2.768 2.678 2.913 . 0 0 "[ . 1 . 2]" 2
29 1 32 ILE O 1 48 ILE H 2.120 . 2.120 2.095 1.968 2.193 0.073 3 0 "[ . 1 . 2]" 2
30 1 32 ILE O 1 48 ILE N 3.050 . 3.050 2.994 2.905 3.085 0.035 3 0 "[ . 1 . 2]" 2
31 1 35 LYS H 1 96 ASP O 2.120 . 2.120 1.991 1.852 2.182 0.062 2 0 "[ . 1 . 2]" 2
32 1 35 LYS N 1 96 ASP O 3.050 . 3.050 2.859 2.785 2.948 . 0 0 "[ . 1 . 2]" 2
33 1 37 ALA H 1 98 ILE O 2.120 . 2.120 1.822 1.729 1.952 0.071 6 0 "[ . 1 . 2]" 2
34 1 37 ALA N 1 98 ILE O 3.050 . 3.050 2.787 2.699 2.909 . 0 0 "[ . 1 . 2]" 2
35 1 33 ASN O 1 95 GLU H 2.120 . 2.120 1.748 1.666 1.851 0.134 6 0 "[ . 1 . 2]" 2
36 1 33 ASN O 1 95 GLU N 3.050 . 3.050 2.637 2.609 2.675 . 0 0 "[ . 1 . 2]" 2
37 1 35 LYS O 1 98 ILE H 2.120 . 2.120 1.776 1.709 1.856 0.091 18 0 "[ . 1 . 2]" 2
38 1 35 LYS O 1 98 ILE N 3.050 . 3.050 2.676 2.626 2.722 . 0 0 "[ . 1 . 2]" 2
39 1 37 ALA O 1 100 VAL H 2.120 . 2.120 2.086 1.930 2.209 0.089 15 0 "[ . 1 . 2]" 2
40 1 37 ALA O 1 100 VAL N 3.050 . 3.050 2.987 2.785 3.076 0.026 13 0 "[ . 1 . 2]" 2
41 1 76 PHE H 1 79 GLN O 2.120 . 2.120 1.818 1.770 1.924 0.030 3 0 "[ . 1 . 2]" 2
42 1 76 PHE N 1 79 GLN O 3.050 . 3.050 2.776 2.723 2.877 . 0 0 "[ . 1 . 2]" 2
43 1 74 PHE O 1 81 ILE H 2.120 . 2.120 1.869 1.784 2.009 0.016 11 0 "[ . 1 . 2]" 2
44 1 74 PHE O 1 81 ILE N 3.050 . 3.050 2.851 2.765 2.992 . 0 0 "[ . 1 . 2]" 2
45 1 75 ARG O 1 99 ASP H 2.120 . 2.120 1.918 1.799 2.014 0.001 5 0 "[ . 1 . 2]" 2
46 1 75 ARG O 1 99 ASP N 3.050 . 3.050 2.871 2.764 2.974 . 0 0 "[ . 1 . 2]" 2
47 1 73 ARG O 1 101 PHE H 2.120 . 2.120 2.146 2.097 2.199 0.079 16 0 "[ . 1 . 2]" 2
48 1 73 ARG O 1 101 PHE N 3.050 . 3.050 3.066 3.030 3.109 0.059 16 0 "[ . 1 . 2]" 2
49 1 73 ARG H 1 101 PHE O 2.120 . 2.120 2.191 2.099 2.271 0.151 13 0 "[ . 1 . 2]" 2
50 1 73 ARG N 1 101 PHE O 3.050 . 3.050 2.939 2.856 2.990 . 0 0 "[ . 1 . 2]" 2
51 1 75 ARG H 1 99 ASP O 2.120 . 2.120 1.981 1.858 2.137 0.017 13 0 "[ . 1 . 2]" 2
52 1 75 ARG N 1 99 ASP O 3.050 . 3.050 2.724 2.660 2.782 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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