NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
483083 |
1v5k   |
10107 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1v5k
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 1683
_Distance_constraint_stats_list.Viol_count 3194
_Distance_constraint_stats_list.Viol_total 3380.771
_Distance_constraint_stats_list.Viol_max 0.957
_Distance_constraint_stats_list.Viol_rms 0.0274
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0050
_Distance_constraint_stats_list.Viol_average_violations_only 0.0529
_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 6 SER 0.471 0.177 5 0 "[ . 1 . 2]"
1 7 GLY 0.471 0.177 5 0 "[ . 1 . 2]"
1 8 GLN 0.032 0.018 12 0 "[ . 1 . 2]"
1 9 ARG 4.627 0.584 4 2 "[ +.- 1 . 2]"
1 10 ARG 8.352 0.618 16 1 "[ . 1 .+ 2]"
1 11 HIS 0.379 0.088 13 0 "[ . 1 . 2]"
1 12 ASP 1.707 0.108 13 0 "[ . 1 . 2]"
1 13 MET 1.001 0.089 16 0 "[ . 1 . 2]"
1 14 LEU 2.450 0.092 6 0 "[ . 1 . 2]"
1 15 ALA 1.990 0.081 9 0 "[ . 1 . 2]"
1 16 TRP 0.972 0.037 20 0 "[ . 1 . 2]"
1 17 ILE 0.741 0.037 20 0 "[ . 1 . 2]"
1 18 ASN 2.227 0.116 19 0 "[ . 1 . 2]"
1 19 GLU 2.202 0.098 11 0 "[ . 1 . 2]"
1 20 SER 0.160 0.037 14 0 "[ . 1 . 2]"
1 21 LEU 2.854 0.114 2 0 "[ . 1 . 2]"
1 22 GLN 0.274 0.036 14 0 "[ . 1 . 2]"
1 23 LEU 4.921 0.223 2 0 "[ . 1 . 2]"
1 24 ASN 2.985 0.223 2 0 "[ . 1 . 2]"
1 25 LEU 0.512 0.060 11 0 "[ . 1 . 2]"
1 26 THR 1.965 0.158 7 0 "[ . 1 . 2]"
1 27 LYS 1.283 0.106 7 0 "[ . 1 . 2]"
1 28 ILE 8.166 0.249 20 0 "[ . 1 . 2]"
1 29 GLU 2.866 0.648 14 1 "[ . 1 +. 2]"
1 30 GLN 2.653 0.108 12 0 "[ . 1 . 2]"
1 31 LEU 2.685 0.158 20 0 "[ . 1 . 2]"
1 32 CYS 2.501 0.158 20 0 "[ . 1 . 2]"
1 33 SER 0.868 0.077 18 0 "[ . 1 . 2]"
1 34 GLY 0.303 0.039 16 0 "[ . 1 . 2]"
1 35 ALA 2.036 0.367 6 0 "[ . 1 . 2]"
1 36 ALA 0.662 0.072 13 0 "[ . 1 . 2]"
1 37 TYR 1.548 0.116 20 0 "[ . 1 . 2]"
1 38 CYS 3.851 0.111 10 0 "[ . 1 . 2]"
1 39 GLN 3.522 0.252 15 0 "[ . 1 . 2]"
1 40 PHE 0.278 0.024 10 0 "[ . 1 . 2]"
1 41 MET 6.300 0.144 20 0 "[ . 1 . 2]"
1 42 ASP 0.782 0.042 5 0 "[ . 1 . 2]"
1 43 MET 5.971 0.516 16 2 "[ . 1 - .+ 2]"
1 44 LEU 0.998 0.055 18 0 "[ . 1 . 2]"
1 45 PHE 0.960 0.134 14 0 "[ . 1 . 2]"
1 46 PRO 0.507 0.134 14 0 "[ . 1 . 2]"
1 47 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 SER 0.223 0.027 9 0 "[ . 1 . 2]"
1 49 ILE 8.552 0.144 20 0 "[ . 1 . 2]"
1 50 ALA 0.407 0.046 10 0 "[ . 1 . 2]"
1 51 LEU 4.814 0.172 17 0 "[ . 1 . 2]"
1 52 LYS 3.083 0.273 6 0 "[ . 1 . 2]"
1 53 LYS 0.552 0.046 10 0 "[ . 1 . 2]"
1 54 VAL 5.687 0.090 19 0 "[ . 1 . 2]"
1 55 LYS 2.272 0.123 13 0 "[ . 1 . 2]"
1 56 PHE 4.573 0.367 6 0 "[ . 1 . 2]"
1 57 GLN 0.557 0.125 1 0 "[ . 1 . 2]"
1 58 ALA 3.417 0.149 20 0 "[ . 1 . 2]"
1 59 LYS 1.844 0.431 5 0 "[ . 1 . 2]"
1 60 LEU 4.263 0.431 5 0 "[ . 1 . 2]"
1 61 GLU 0.881 0.075 16 0 "[ . 1 . 2]"
1 62 HIS 4.395 0.189 16 0 "[ . 1 . 2]"
1 63 GLU 3.998 0.149 20 0 "[ . 1 . 2]"
1 64 TYR 1.205 0.077 13 0 "[ . 1 . 2]"
1 65 ILE 1.782 0.081 14 0 "[ . 1 . 2]"
1 66 GLN 0.549 0.051 15 0 "[ . 1 . 2]"
1 67 ASN 0.894 0.060 7 0 "[ . 1 . 2]"
1 68 PHE 3.096 0.084 16 0 "[ . 1 . 2]"
1 69 LYS 4.722 0.957 9 2 "[ - . +1 . 2]"
1 70 ILE 5.039 0.157 19 0 "[ . 1 . 2]"
1 71 LEU 9.017 0.161 17 0 "[ . 1 . 2]"
1 72 GLN 4.904 0.290 1 0 "[ . 1 . 2]"
1 73 ALA 0.009 0.008 16 0 "[ . 1 . 2]"
1 74 GLY 0.849 0.081 20 0 "[ . 1 . 2]"
1 75 PHE 1.922 0.093 10 0 "[ . 1 . 2]"
1 76 LYS 3.070 0.807 9 4 "[ . +* *. - 2]"
1 77 ARG 3.138 0.807 9 4 "[ . +* *. - 2]"
1 78 MET 0.386 0.053 4 0 "[ . 1 . 2]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 VAL 0.438 0.046 13 0 "[ . 1 . 2]"
1 81 ASP 0.686 0.087 7 0 "[ . 1 . 2]"
1 82 LYS 1.399 0.138 5 0 "[ . 1 . 2]"
1 83 ILE 4.740 0.266 6 0 "[ . 1 . 2]"
1 84 ILE 7.116 0.174 20 0 "[ . 1 . 2]"
1 85 PRO 7.622 0.308 12 0 "[ . 1 . 2]"
1 86 VAL 8.220 0.260 19 0 "[ . 1 . 2]"
1 87 ASP 2.142 0.336 2 0 "[ . 1 . 2]"
1 88 LYS 4.095 0.336 2 0 "[ . 1 . 2]"
1 89 LEU 2.965 0.105 15 0 "[ . 1 . 2]"
1 90 VAL 2.587 0.085 14 0 "[ . 1 . 2]"
1 91 LYS 1.142 0.085 14 0 "[ . 1 . 2]"
1 92 GLY 1.168 0.328 7 0 "[ . 1 . 2]"
1 93 LYS 2.206 0.632 7 1 "[ . + 1 . 2]"
1 94 PHE 2.297 0.554 14 1 "[ . 1 +. 2]"
1 95 GLN 0.555 0.127 15 0 "[ . 1 . 2]"
1 96 ASP 0.339 0.047 17 0 "[ . 1 . 2]"
1 97 ASN 1.527 0.249 20 0 "[ . 1 . 2]"
1 98 PHE 9.833 0.584 4 2 "[ +.- 1 . 2]"
1 99 GLU 0.889 0.284 6 0 "[ . 1 . 2]"
1 100 PHE 1.956 0.096 18 0 "[ . 1 . 2]"
1 101 VAL 2.600 0.151 14 0 "[ . 1 . 2]"
1 102 GLN 6.759 0.284 6 0 "[ . 1 . 2]"
1 103 TRP 2.258 0.137 17 0 "[ . 1 . 2]"
1 104 PHE 3.762 0.138 5 0 "[ . 1 . 2]"
1 105 LYS 1.656 0.214 19 0 "[ . 1 . 2]"
1 106 LYS 1.720 0.348 12 0 "[ . 1 . 2]"
1 107 PHE 0.119 0.055 2 0 "[ . 1 . 2]"
1 108 PHE 0.198 0.051 18 0 "[ . 1 . 2]"
1 109 ASP 1.029 0.193 18 0 "[ . 1 . 2]"
1 110 SER 0.815 0.193 18 0 "[ . 1 . 2]"
1 111 GLY 0.060 0.022 10 0 "[ . 1 . 2]"
1 112 PRO 0.446 0.067 3 0 "[ . 1 . 2]"
1 113 SER 0.386 0.067 3 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 6 SER HB3 1 7 GLY H . . 3.920 3.188 2.157 4.097 0.177 5 0 "[ . 1 . 2]" 1
2 1 8 GLN H 1 8 GLN QB . . 3.420 2.780 2.162 3.389 . 0 0 "[ . 1 . 2]" 1
3 1 8 GLN H 1 8 GLN QG . . 4.440 3.618 2.614 4.229 . 0 0 "[ . 1 . 2]" 1
4 1 8 GLN H 1 9 ARG H . . 3.890 3.051 1.886 3.908 0.018 12 0 "[ . 1 . 2]" 1
5 1 8 GLN HA 1 8 GLN QG . . 3.370 2.240 1.966 3.343 . 0 0 "[ . 1 . 2]" 1
6 1 9 ARG H 1 9 ARG QB . . 3.200 2.372 2.000 3.194 . 0 0 "[ . 1 . 2]" 1
7 1 9 ARG H 1 9 ARG QD . . 4.810 4.631 4.103 4.900 0.090 14 0 "[ . 1 . 2]" 1
8 1 9 ARG H 1 9 ARG HG2 . . 4.150 3.491 2.045 3.976 . 0 0 "[ . 1 . 2]" 1
9 1 9 ARG H 1 9 ARG HG3 . . 3.820 3.522 2.948 4.292 0.472 14 0 "[ . 1 . 2]" 1
10 1 9 ARG HA 1 9 ARG QD . . 3.560 3.382 2.452 3.732 0.172 14 0 "[ . 1 . 2]" 1
11 1 9 ARG HA 1 9 ARG HG2 . . 3.460 2.176 1.992 3.773 0.313 14 0 "[ . 1 . 2]" 1
12 1 9 ARG HA 1 9 ARG HG3 . . 3.880 3.235 2.818 3.731 . 0 0 "[ . 1 . 2]" 1
13 1 9 ARG HA 1 10 ARG H . . 3.560 2.565 2.302 2.876 . 0 0 "[ . 1 . 2]" 1
14 1 9 ARG HA 1 12 ASP HB2 . . 3.560 2.926 2.502 3.608 0.048 4 0 "[ . 1 . 2]" 1
15 1 9 ARG HA 1 12 ASP HB3 . . 3.880 3.851 3.680 3.965 0.085 13 0 "[ . 1 . 2]" 1
16 1 9 ARG QB 1 9 ARG QD . . 2.980 2.038 1.939 2.273 . 0 0 "[ . 1 . 2]" 1
17 1 9 ARG QB 1 9 ARG HG2 . . 2.740 2.532 2.255 2.569 . 0 0 "[ . 1 . 2]" 1
18 1 9 ARG QB 1 10 ARG H . . 3.860 2.623 2.055 3.954 0.094 4 0 "[ . 1 . 2]" 1
19 1 9 ARG QB 1 98 PHE HZ . . 3.700 3.261 2.020 3.762 0.062 18 0 "[ . 1 . 2]" 1
20 1 9 ARG QD 1 9 ARG HG3 . . 2.760 2.494 2.183 2.573 . 0 0 "[ . 1 . 2]" 1
21 1 9 ARG QD 1 98 PHE HZ . . 4.000 2.390 1.844 2.653 . 0 0 "[ . 1 . 2]" 1
22 1 9 ARG HG2 1 98 PHE HZ . . 4.150 4.152 3.659 4.734 0.584 4 2 "[ +.- 1 . 2]" 1
23 1 10 ARG H 1 10 ARG QB . . 3.440 3.109 2.786 3.210 . 0 0 "[ . 1 . 2]" 1
24 1 10 ARG H 1 10 ARG HG2 . . 4.020 3.705 3.221 4.638 0.618 16 1 "[ . 1 .+ 2]" 1
25 1 10 ARG H 1 10 ARG HG3 . . 4.350 4.232 3.504 4.439 0.089 13 0 "[ . 1 . 2]" 1
26 1 10 ARG H 1 11 HIS H . . 4.330 3.671 2.287 4.195 . 0 0 "[ . 1 . 2]" 1
27 1 10 ARG H 1 12 ASP HB2 . . 3.700 3.696 3.388 3.808 0.108 13 0 "[ . 1 . 2]" 1
28 1 10 ARG H 1 12 ASP HB3 . . 3.700 3.682 3.282 3.800 0.100 3 0 "[ . 1 . 2]" 1
29 1 10 ARG H 1 98 PHE HZ . . 4.860 2.958 1.890 4.839 . 0 0 "[ . 1 . 2]" 1
30 1 10 ARG HA 1 10 ARG HG2 . . 3.150 2.083 1.978 2.765 . 0 0 "[ . 1 . 2]" 1
31 1 10 ARG HA 1 98 PHE QD . . 3.880 3.749 3.374 3.903 0.023 5 0 "[ . 1 . 2]" 1
32 1 10 ARG HA 1 98 PHE HZ . . 3.460 3.570 3.397 3.676 0.216 6 0 "[ . 1 . 2]" 1
33 1 10 ARG QB 1 10 ARG HD2 . . 3.330 2.530 2.197 3.336 0.006 16 0 "[ . 1 . 2]" 1
34 1 10 ARG QB 1 10 ARG HD3 . . 3.330 3.313 2.394 3.413 0.083 13 0 "[ . 1 . 2]" 1
35 1 10 ARG QB 1 11 HIS H . . 4.350 2.365 2.020 3.348 . 0 0 "[ . 1 . 2]" 1
36 1 10 ARG QB 1 98 PHE QE . . 4.150 3.543 2.781 3.779 . 0 0 "[ . 1 . 2]" 1
37 1 10 ARG HD2 1 98 PHE QD . . 4.000 4.037 3.839 4.113 0.113 2 0 "[ . 1 . 2]" 1
38 1 10 ARG HD2 1 98 PHE QE . . 4.350 4.067 3.562 4.325 . 0 0 "[ . 1 . 2]" 1
39 1 10 ARG HD3 1 98 PHE QD . . 3.780 3.671 3.188 4.042 0.262 16 0 "[ . 1 . 2]" 1
40 1 10 ARG HD3 1 98 PHE QE . . 4.350 4.073 3.496 4.261 . 0 0 "[ . 1 . 2]" 1
41 1 10 ARG HG2 1 98 PHE QD . . 4.350 2.897 2.154 3.902 . 0 0 "[ . 1 . 2]" 1
42 1 10 ARG HG2 1 98 PHE QE . . 4.350 2.024 1.880 3.518 . 0 0 "[ . 1 . 2]" 1
43 1 10 ARG HG3 1 11 HIS H . . 4.920 4.710 3.862 5.008 0.088 13 0 "[ . 1 . 2]" 1
44 1 10 ARG HG3 1 98 PHE QD . . 4.350 4.079 2.469 4.436 0.086 7 0 "[ . 1 . 2]" 1
45 1 11 HIS H 1 11 HIS QB . . 3.610 2.319 1.978 3.330 . 0 0 "[ . 1 . 2]" 1
46 1 11 HIS H 1 12 ASP H . . 4.060 2.670 2.583 2.800 . 0 0 "[ . 1 . 2]" 1
47 1 11 HIS HA 1 11 HIS HD2 . . 4.350 3.237 2.371 4.283 . 0 0 "[ . 1 . 2]" 1
48 1 11 HIS HA 1 14 LEU H . . 4.620 3.185 2.983 3.381 . 0 0 "[ . 1 . 2]" 1
49 1 11 HIS HA 1 14 LEU HB2 . . 4.000 2.507 2.330 2.748 . 0 0 "[ . 1 . 2]" 1
50 1 11 HIS HA 1 14 LEU HB3 . . 4.000 3.950 3.834 4.083 0.083 5 0 "[ . 1 . 2]" 1
51 1 11 HIS HA 1 14 LEU MD1 . . 3.410 2.557 2.133 2.926 . 0 0 "[ . 1 . 2]" 1
52 1 11 HIS HA 1 14 LEU MD2 . . 3.780 3.759 3.713 3.793 0.013 6 0 "[ . 1 . 2]" 1
53 1 11 HIS HA 1 15 ALA H . . 4.660 3.756 3.447 4.306 . 0 0 "[ . 1 . 2]" 1
54 1 11 HIS QB 1 11 HIS HD2 . . 3.560 2.889 2.649 3.241 . 0 0 "[ . 1 . 2]" 1
55 1 11 HIS QB 1 12 ASP H . . 3.780 3.303 3.102 3.656 . 0 0 "[ . 1 . 2]" 1
56 1 12 ASP H 1 12 ASP HB2 . . 3.690 2.328 2.195 2.636 . 0 0 "[ . 1 . 2]" 1
57 1 12 ASP HA 1 15 ALA H . . 4.260 4.064 3.914 4.282 0.022 15 0 "[ . 1 . 2]" 1
58 1 12 ASP HA 1 15 ALA MB . . 3.880 3.324 3.106 3.694 . 0 0 "[ . 1 . 2]" 1
59 1 12 ASP HB3 1 13 MET H . . 3.420 2.451 2.071 2.762 . 0 0 "[ . 1 . 2]" 1
60 1 12 ASP HB3 1 13 MET HG2 . . 3.200 2.744 2.516 2.908 . 0 0 "[ . 1 . 2]" 1
61 1 13 MET H 1 13 MET HB2 . . 4.000 2.573 2.512 2.749 . 0 0 "[ . 1 . 2]" 1
62 1 13 MET H 1 13 MET HB3 . . 3.780 3.544 3.519 3.588 . 0 0 "[ . 1 . 2]" 1
63 1 13 MET H 1 13 MET HG2 . . 3.640 1.977 1.939 2.177 . 0 0 "[ . 1 . 2]" 1
64 1 13 MET H 1 13 MET HG3 . . 4.000 3.311 2.348 3.521 . 0 0 "[ . 1 . 2]" 1
65 1 13 MET H 1 14 LEU H . . 3.740 2.563 2.258 2.795 . 0 0 "[ . 1 . 2]" 1
66 1 13 MET HA 1 13 MET ME . . 3.620 2.666 1.975 3.315 . 0 0 "[ . 1 . 2]" 1
67 1 13 MET HA 1 13 MET HG2 . . 4.150 3.161 2.709 3.352 . 0 0 "[ . 1 . 2]" 1
68 1 13 MET HB2 1 28 ILE MD . . 3.560 1.984 1.903 2.296 . 0 0 "[ . 1 . 2]" 1
69 1 13 MET HB2 1 101 VAL MG1 . . 3.620 3.501 3.050 3.627 0.007 9 0 "[ . 1 . 2]" 1
70 1 13 MET HB2 1 101 VAL MG2 . . 4.350 3.411 2.641 3.740 . 0 0 "[ . 1 . 2]" 1
71 1 13 MET HB3 1 13 MET ME . . 3.060 2.048 1.908 2.415 . 0 0 "[ . 1 . 2]" 1
72 1 13 MET HB3 1 28 ILE MD . . 4.350 3.010 2.548 3.541 . 0 0 "[ . 1 . 2]" 1
73 1 13 MET HB3 1 101 VAL MG1 . . 3.780 3.148 2.965 3.443 . 0 0 "[ . 1 . 2]" 1
74 1 13 MET ME 1 13 MET HG2 . . 3.560 3.240 2.508 3.378 . 0 0 "[ . 1 . 2]" 1
75 1 13 MET ME 1 101 VAL HA . . 4.150 4.120 3.992 4.188 0.038 13 0 "[ . 1 . 2]" 1
76 1 13 MET ME 1 101 VAL MG1 . . 3.150 2.432 1.977 3.226 0.076 11 0 "[ . 1 . 2]" 1
77 1 13 MET ME 1 101 VAL MG2 . . 3.290 1.940 1.762 2.067 . 0 0 "[ . 1 . 2]" 1
78 1 13 MET ME 1 102 GLN H . . 4.150 3.506 3.102 4.092 . 0 0 "[ . 1 . 2]" 1
79 1 13 MET ME 1 102 GLN HA . . 3.100 2.045 1.810 2.490 . 0 0 "[ . 1 . 2]" 1
80 1 13 MET ME 1 105 LYS HA . . 4.350 4.092 3.829 4.310 . 0 0 "[ . 1 . 2]" 1
81 1 13 MET ME 1 105 LYS HD2 . . 3.620 2.890 2.467 3.330 . 0 0 "[ . 1 . 2]" 1
82 1 13 MET ME 1 105 LYS QE . . 4.000 3.201 2.706 3.673 . 0 0 "[ . 1 . 2]" 1
83 1 13 MET HG2 1 14 LEU H . . 4.060 3.958 3.840 4.149 0.089 16 0 "[ . 1 . 2]" 1
84 1 13 MET HG2 1 28 ILE MD . . 3.510 3.238 2.731 3.559 0.049 14 0 "[ . 1 . 2]" 1
85 1 13 MET HG2 1 101 VAL MG1 . . 4.150 3.968 3.603 4.187 0.037 14 0 "[ . 1 . 2]" 1
86 1 13 MET HG3 1 14 LEU H . . 4.750 4.551 3.882 4.769 0.019 13 0 "[ . 1 . 2]" 1
87 1 13 MET HG3 1 14 LEU MD2 . . 4.350 4.271 3.849 4.415 0.065 13 0 "[ . 1 . 2]" 1
88 1 13 MET HG3 1 28 ILE MD . . 3.410 2.507 1.989 2.848 . 0 0 "[ . 1 . 2]" 1
89 1 13 MET HG3 1 101 VAL MG1 . . 3.200 2.512 2.099 3.166 . 0 0 "[ . 1 . 2]" 1
90 1 13 MET HG3 1 101 VAL MG2 . . 3.700 3.483 2.955 3.769 0.069 11 0 "[ . 1 . 2]" 1
91 1 14 LEU H 1 14 LEU HB2 . . 3.330 2.795 2.669 2.854 . 0 0 "[ . 1 . 2]" 1
92 1 14 LEU H 1 14 LEU HB3 . . 3.700 3.506 3.485 3.528 . 0 0 "[ . 1 . 2]" 1
93 1 14 LEU H 1 14 LEU MD1 . . 4.150 3.638 3.580 3.725 . 0 0 "[ . 1 . 2]" 1
94 1 14 LEU H 1 14 LEU MD2 . . 3.880 2.002 1.906 2.313 . 0 0 "[ . 1 . 2]" 1
95 1 14 LEU H 1 14 LEU HG . . 3.510 2.031 1.932 2.190 . 0 0 "[ . 1 . 2]" 1
96 1 14 LEU H 1 15 ALA H . . 3.520 2.933 2.826 3.005 . 0 0 "[ . 1 . 2]" 1
97 1 14 LEU H 1 28 ILE MD . . 4.000 3.198 2.846 3.518 . 0 0 "[ . 1 . 2]" 1
98 1 14 LEU HA 1 14 LEU MD1 . . 3.700 3.731 3.618 3.792 0.092 6 0 "[ . 1 . 2]" 1
99 1 14 LEU HA 1 14 LEU MD2 . . 2.930 2.070 1.949 2.211 . 0 0 "[ . 1 . 2]" 1
100 1 14 LEU HA 1 14 LEU HG . . 4.000 3.540 3.447 3.575 . 0 0 "[ . 1 . 2]" 1
101 1 14 LEU HA 1 17 ILE HB . . 3.780 3.281 3.016 3.583 . 0 0 "[ . 1 . 2]" 1
102 1 14 LEU HA 1 17 ILE MD . . 3.880 3.109 2.513 3.580 . 0 0 "[ . 1 . 2]" 1
103 1 14 LEU HB2 1 14 LEU MD1 . . 3.000 2.554 2.509 2.611 . 0 0 "[ . 1 . 2]" 1
104 1 14 LEU HB2 1 15 ALA H . . 3.780 2.666 2.541 2.753 . 0 0 "[ . 1 . 2]" 1
105 1 14 LEU HB2 1 18 ASN HD21 . . 4.750 4.036 2.984 4.423 . 0 0 "[ . 1 . 2]" 1
106 1 14 LEU HB2 1 18 ASN HD22 . . 4.150 3.791 3.363 4.130 . 0 0 "[ . 1 . 2]" 1
107 1 14 LEU HB3 1 14 LEU MD1 . . 3.120 2.192 2.107 2.265 . 0 0 "[ . 1 . 2]" 1
108 1 14 LEU HB3 1 14 LEU MD2 . . 2.790 2.579 2.548 2.664 . 0 0 "[ . 1 . 2]" 1
109 1 14 LEU HB3 1 15 ALA H . . 4.000 3.914 3.754 4.016 0.016 6 0 "[ . 1 . 2]" 1
110 1 14 LEU HB3 1 18 ASN HD21 . . 4.750 3.964 2.793 4.399 . 0 0 "[ . 1 . 2]" 1
111 1 14 LEU HB3 1 18 ASN HD22 . . 4.620 3.083 2.636 3.559 . 0 0 "[ . 1 . 2]" 1
112 1 14 LEU MD1 1 15 ALA H . . 4.660 4.703 4.672 4.741 0.081 9 0 "[ . 1 . 2]" 1
113 1 14 LEU MD1 1 26 THR HA . . 3.700 2.554 2.205 2.901 . 0 0 "[ . 1 . 2]" 1
114 1 14 LEU MD1 1 27 LYS H . . 4.150 2.968 2.513 3.519 . 0 0 "[ . 1 . 2]" 1
115 1 14 LEU MD1 1 27 LYS HA . . 3.620 2.470 2.080 2.941 . 0 0 "[ . 1 . 2]" 1
116 1 14 LEU MD1 1 28 ILE H . . 4.000 3.483 2.931 3.797 . 0 0 "[ . 1 . 2]" 1
117 1 14 LEU MD1 1 28 ILE HA . . 4.150 3.727 3.477 4.132 . 0 0 "[ . 1 . 2]" 1
118 1 14 LEU MD1 1 28 ILE MD . . 4.000 3.858 3.607 4.023 0.023 13 0 "[ . 1 . 2]" 1
119 1 14 LEU MD2 1 27 LYS HA . . 3.880 3.661 3.235 3.906 0.026 16 0 "[ . 1 . 2]" 1
120 1 14 LEU MD2 1 28 ILE H . . 4.150 3.323 2.883 3.739 . 0 0 "[ . 1 . 2]" 1
121 1 14 LEU MD2 1 28 ILE HA . . 3.290 2.156 1.959 2.419 . 0 0 "[ . 1 . 2]" 1
122 1 14 LEU MD2 1 28 ILE MD . . 3.260 1.872 1.762 2.133 . 0 0 "[ . 1 . 2]" 1
123 1 14 LEU HG 1 28 ILE MD . . 3.780 3.523 3.046 3.849 0.069 12 0 "[ . 1 . 2]" 1
124 1 15 ALA H 1 15 ALA MB . . 2.790 2.134 1.994 2.162 . 0 0 "[ . 1 . 2]" 1
125 1 15 ALA H 1 16 TRP H . . 3.700 2.699 2.582 2.835 . 0 0 "[ . 1 . 2]" 1
126 1 15 ALA H 1 18 ASN QB . . 4.750 4.239 4.115 4.361 . 0 0 "[ . 1 . 2]" 1
127 1 15 ALA HA 1 18 ASN H . . 3.620 3.632 3.515 3.689 0.069 9 0 "[ . 1 . 2]" 1
128 1 15 ALA HA 1 18 ASN QB . . 3.100 1.972 1.944 2.040 . 0 0 "[ . 1 . 2]" 1
129 1 15 ALA HA 1 18 ASN HD21 . . 4.000 2.776 2.194 3.418 . 0 0 "[ . 1 . 2]" 1
130 1 15 ALA MB 1 16 TRP H . . 3.230 2.511 2.435 2.603 . 0 0 "[ . 1 . 2]" 1
131 1 15 ALA MB 1 18 ASN QB . . 3.620 3.567 3.512 3.638 0.018 8 0 "[ . 1 . 2]" 1
132 1 15 ALA MB 1 19 GLU H . . 4.150 4.077 3.707 4.226 0.076 9 0 "[ . 1 . 2]" 1
133 1 15 ALA MB 1 19 GLU HG3 . . 4.150 3.964 3.745 4.148 . 0 0 "[ . 1 . 2]" 1
134 1 16 TRP H 1 16 TRP HB2 . . 3.290 2.365 2.291 2.432 . 0 0 "[ . 1 . 2]" 1
135 1 16 TRP H 1 16 TRP HB3 . . 3.330 2.573 2.500 2.656 . 0 0 "[ . 1 . 2]" 1
136 1 16 TRP H 1 17 ILE H . . 3.870 3.132 2.856 3.275 . 0 0 "[ . 1 . 2]" 1
137 1 16 TRP H 1 17 ILE HB . . 5.060 5.018 4.940 5.081 0.021 14 0 "[ . 1 . 2]" 1
138 1 16 TRP HA 1 16 TRP HD1 . . 3.410 2.635 2.542 2.761 . 0 0 "[ . 1 . 2]" 1
139 1 16 TRP HA 1 19 GLU HB2 . . 4.150 3.694 3.372 4.125 . 0 0 "[ . 1 . 2]" 1
140 1 16 TRP HB2 1 16 TRP HD1 . . 3.620 2.991 2.926 3.025 . 0 0 "[ . 1 . 2]" 1
141 1 16 TRP HB2 1 17 ILE H . . 4.150 3.647 3.505 3.879 . 0 0 "[ . 1 . 2]" 1
142 1 16 TRP HB2 1 105 LYS QE . . 4.150 2.920 2.569 3.645 . 0 0 "[ . 1 . 2]" 1
143 1 16 TRP HB3 1 16 TRP HE3 . . 3.780 2.334 2.330 2.347 . 0 0 "[ . 1 . 2]" 1
144 1 16 TRP HB3 1 17 ILE H . . 4.000 2.155 1.963 2.547 . 0 0 "[ . 1 . 2]" 1
145 1 16 TRP HD1 1 105 LYS QE . . 4.350 3.246 2.775 3.948 . 0 0 "[ . 1 . 2]" 1
146 1 16 TRP HE3 1 17 ILE HA . . 4.000 3.992 3.755 4.037 0.037 20 0 "[ . 1 . 2]" 1
147 1 16 TRP HE3 1 17 ILE MD . . 4.000 1.943 1.875 2.006 . 0 0 "[ . 1 . 2]" 1
148 1 16 TRP HE3 1 17 ILE HG12 . . 4.350 3.773 3.548 4.009 . 0 0 "[ . 1 . 2]" 1
149 1 16 TRP HE3 1 17 ILE HG13 . . 4.350 2.456 2.258 2.732 . 0 0 "[ . 1 . 2]" 1
150 1 16 TRP HE3 1 101 VAL MG2 . . 4.150 3.366 3.144 3.654 . 0 0 "[ . 1 . 2]" 1
151 1 16 TRP HH2 1 104 PHE HB3 . . 4.350 3.519 3.267 3.784 . 0 0 "[ . 1 . 2]" 1
152 1 16 TRP HH2 1 104 PHE QD . . 3.620 3.634 3.616 3.652 0.032 13 0 "[ . 1 . 2]" 1
153 1 16 TRP HH2 1 105 LYS HA . . 3.700 2.877 2.506 3.211 . 0 0 "[ . 1 . 2]" 1
154 1 16 TRP HH2 1 105 LYS HB2 . . 4.350 4.286 4.009 4.374 0.024 20 0 "[ . 1 . 2]" 1
155 1 16 TRP HZ2 1 105 LYS HA . . 4.150 3.110 2.727 3.462 . 0 0 "[ . 1 . 2]" 1
156 1 16 TRP HZ2 1 108 PHE HB3 . . 4.150 2.152 1.989 2.531 . 0 0 "[ . 1 . 2]" 1
157 1 16 TRP HZ2 1 108 PHE QD . . 4.350 2.121 1.990 2.826 . 0 0 "[ . 1 . 2]" 1
158 1 16 TRP HZ3 1 17 ILE MD . . 4.350 2.918 2.381 3.371 . 0 0 "[ . 1 . 2]" 1
159 1 16 TRP HZ3 1 101 VAL MG2 . . 4.150 3.215 2.973 3.411 . 0 0 "[ . 1 . 2]" 1
160 1 16 TRP HZ3 1 104 PHE QD . . 4.150 4.148 4.084 4.186 0.036 18 0 "[ . 1 . 2]" 1
161 1 16 TRP HZ3 1 105 LYS HA . . 4.150 3.808 3.608 4.133 . 0 0 "[ . 1 . 2]" 1
162 1 17 ILE H 1 17 ILE HB . . 3.510 2.298 2.180 2.387 . 0 0 "[ . 1 . 2]" 1
163 1 17 ILE H 1 17 ILE MD . . 4.750 2.104 1.917 2.438 . 0 0 "[ . 1 . 2]" 1
164 1 17 ILE H 1 17 ILE HG12 . . 4.350 3.897 3.770 4.053 . 0 0 "[ . 1 . 2]" 1
165 1 17 ILE H 1 17 ILE HG13 . . 4.150 2.814 2.664 3.043 . 0 0 "[ . 1 . 2]" 1
166 1 17 ILE H 1 17 ILE MG . . 3.700 3.674 3.618 3.700 . 10 0 "[ . 1 . 2]" 1
167 1 17 ILE H 1 18 ASN H . . 3.990 2.918 2.711 2.987 . 0 0 "[ . 1 . 2]" 1
168 1 17 ILE HA 1 17 ILE MD . . 3.510 3.494 3.421 3.545 0.035 20 0 "[ . 1 . 2]" 1
169 1 17 ILE HA 1 17 ILE HG12 . . 3.780 3.241 3.106 3.337 . 0 0 "[ . 1 . 2]" 1
170 1 17 ILE HA 1 17 ILE HG13 . . 4.150 2.208 2.095 2.303 . 0 0 "[ . 1 . 2]" 1
171 1 17 ILE HA 1 17 ILE MG . . 3.150 2.526 2.404 2.613 . 0 0 "[ . 1 . 2]" 1
172 1 17 ILE HA 1 20 SER H . . 4.540 4.410 4.204 4.544 0.004 17 0 "[ . 1 . 2]" 1
173 1 17 ILE HA 1 20 SER HB2 . . 4.000 2.512 2.299 2.739 . 0 0 "[ . 1 . 2]" 1
174 1 17 ILE HA 1 20 SER HB3 . . 4.150 3.916 3.720 4.163 0.013 2 0 "[ . 1 . 2]" 1
175 1 17 ILE HA 1 21 LEU H . . 4.350 4.114 3.553 4.378 0.028 10 0 "[ . 1 . 2]" 1
176 1 17 ILE HA 1 40 PHE QE . . 4.150 2.489 2.163 2.744 . 0 0 "[ . 1 . 2]" 1
177 1 17 ILE HA 1 40 PHE HZ . . 3.880 3.783 3.336 3.891 0.011 6 0 "[ . 1 . 2]" 1
178 1 17 ILE HB 1 17 ILE MD . . 3.620 2.088 1.984 2.138 . 0 0 "[ . 1 . 2]" 1
179 1 17 ILE HB 1 18 ASN H . . 3.560 2.456 2.349 2.557 . 0 0 "[ . 1 . 2]" 1
180 1 17 ILE MD 1 40 PHE QE . . 3.620 3.605 3.512 3.635 0.015 19 0 "[ . 1 . 2]" 1
181 1 17 ILE MD 1 101 VAL MG2 . . 3.200 2.312 1.955 2.466 . 0 0 "[ . 1 . 2]" 1
182 1 17 ILE HG12 1 17 ILE MG . . 2.900 2.120 1.963 2.196 . 0 0 "[ . 1 . 2]" 1
183 1 17 ILE MG 1 18 ASN H . . 3.510 2.877 2.577 3.094 . 0 0 "[ . 1 . 2]" 1
184 1 17 ILE MG 1 18 ASN HA . . 3.700 3.103 2.944 3.304 . 0 0 "[ . 1 . 2]" 1
185 1 17 ILE MG 1 23 LEU HB2 . . 2.580 2.423 1.958 2.603 0.023 9 0 "[ . 1 . 2]" 1
186 1 17 ILE MG 1 36 ALA HA . . 3.700 3.651 3.460 3.718 0.018 16 0 "[ . 1 . 2]" 1
187 1 17 ILE MG 1 36 ALA MB . . 2.900 2.020 1.784 2.165 . 0 0 "[ . 1 . 2]" 1
188 1 17 ILE MG 1 40 PHE QE . . 4.150 4.008 3.703 4.160 0.010 20 0 "[ . 1 . 2]" 1
189 1 18 ASN H 1 18 ASN QB . . 3.200 2.396 2.248 2.538 . 0 0 "[ . 1 . 2]" 1
190 1 18 ASN HA 1 22 GLN H . . 4.030 3.976 3.449 4.066 0.036 14 0 "[ . 1 . 2]" 1
191 1 18 ASN HA 1 23 LEU H . . 3.200 1.961 1.907 2.529 . 0 0 "[ . 1 . 2]" 1
192 1 18 ASN HA 1 23 LEU HB2 . . 3.170 2.021 1.952 2.679 . 0 0 "[ . 1 . 2]" 1
193 1 18 ASN HA 1 23 LEU HB3 . . 3.560 3.613 3.387 3.676 0.116 19 0 "[ . 1 . 2]" 1
194 1 18 ASN HA 1 24 ASN H . . 4.810 4.209 3.881 4.833 0.023 10 0 "[ . 1 . 2]" 1
195 1 18 ASN QB 1 18 ASN HD22 . . 3.780 3.233 3.232 3.246 . 0 0 "[ . 1 . 2]" 1
196 1 18 ASN QB 1 19 GLU H . . 3.640 2.355 1.888 2.571 . 0 0 "[ . 1 . 2]" 1
197 1 18 ASN QB 1 23 LEU H . . 4.540 3.650 3.389 4.558 0.018 8 0 "[ . 1 . 2]" 1
198 1 18 ASN HD21 1 25 LEU H . . 4.410 4.115 3.880 4.410 . 13 0 "[ . 1 . 2]" 1
199 1 18 ASN HD22 1 25 LEU H . . 3.860 2.614 2.400 2.931 . 0 0 "[ . 1 . 2]" 1
200 1 19 GLU H 1 19 GLU HB2 . . 3.230 2.155 2.049 2.201 . 0 0 "[ . 1 . 2]" 1
201 1 19 GLU H 1 19 GLU HB3 . . 3.330 3.344 3.244 3.370 0.040 14 0 "[ . 1 . 2]" 1
202 1 19 GLU H 1 19 GLU HG2 . . 3.880 3.812 3.482 3.890 0.010 6 0 "[ . 1 . 2]" 1
203 1 19 GLU H 1 19 GLU HG3 . . 3.780 3.745 3.538 3.796 0.016 15 0 "[ . 1 . 2]" 1
204 1 19 GLU H 1 20 SER H . . 3.520 3.444 3.246 3.557 0.037 14 0 "[ . 1 . 2]" 1
205 1 19 GLU H 1 21 LEU H . . 4.750 4.692 4.141 4.848 0.098 11 0 "[ . 1 . 2]" 1
206 1 19 GLU HA 1 19 GLU HB2 . . 3.000 2.930 2.815 2.959 . 0 0 "[ . 1 . 2]" 1
207 1 19 GLU HA 1 19 GLU HG2 . . 3.100 1.984 1.970 2.003 . 0 0 "[ . 1 . 2]" 1
208 1 19 GLU HA 1 19 GLU HG3 . . 3.510 3.232 3.011 3.352 . 0 0 "[ . 1 . 2]" 1
209 1 19 GLU HB2 1 19 GLU HG3 . . 3.040 2.271 2.264 2.285 . 0 0 "[ . 1 . 2]" 1
210 1 19 GLU HB3 1 19 GLU HG2 . . 3.000 2.871 2.810 2.971 . 0 0 "[ . 1 . 2]" 1
211 1 20 SER H 1 20 SER HB2 . . 3.670 2.893 2.456 3.103 . 0 0 "[ . 1 . 2]" 1
212 1 20 SER H 1 20 SER HB3 . . 4.000 3.860 3.569 3.991 . 0 0 "[ . 1 . 2]" 1
213 1 20 SER H 1 21 LEU H . . 3.650 2.114 1.867 3.092 . 0 0 "[ . 1 . 2]" 1
214 1 20 SER HB2 1 21 LEU H . . 3.880 2.620 2.476 2.739 . 0 0 "[ . 1 . 2]" 1
215 1 20 SER HB2 1 21 LEU MD2 . . 4.000 3.907 3.623 4.014 0.014 15 0 "[ . 1 . 2]" 1
216 1 20 SER HB2 1 40 PHE QE . . 4.350 3.449 3.110 3.657 . 0 0 "[ . 1 . 2]" 1
217 1 20 SER HB3 1 21 LEU H . . 3.880 3.664 3.459 3.875 . 0 0 "[ . 1 . 2]" 1
218 1 20 SER HB3 1 21 LEU MD2 . . 4.000 3.365 3.127 3.705 . 0 0 "[ . 1 . 2]" 1
219 1 20 SER HB3 1 21 LEU HG . . 4.150 2.907 2.612 3.368 . 0 0 "[ . 1 . 2]" 1
220 1 20 SER HB3 1 40 PHE QE . . 4.350 2.858 2.501 3.309 . 0 0 "[ . 1 . 2]" 1
221 1 20 SER HB3 1 43 MET ME . . 3.620 3.310 2.785 3.642 0.022 18 0 "[ . 1 . 2]" 1
222 1 21 LEU H 1 21 LEU HB2 . . 3.640 2.823 2.461 3.004 . 0 0 "[ . 1 . 2]" 1
223 1 21 LEU H 1 21 LEU HB3 . . 3.880 3.801 3.633 3.865 . 0 0 "[ . 1 . 2]" 1
224 1 21 LEU H 1 21 LEU MD1 . . 4.620 3.627 3.445 4.003 . 0 0 "[ . 1 . 2]" 1
225 1 21 LEU H 1 21 LEU MD2 . . 4.000 3.841 3.595 4.000 0.000 12 0 "[ . 1 . 2]" 1
226 1 21 LEU H 1 21 LEU HG . . 3.670 2.630 2.498 2.884 . 0 0 "[ . 1 . 2]" 1
227 1 21 LEU H 1 23 LEU MD2 . . 4.660 2.590 2.080 3.809 . 0 0 "[ . 1 . 2]" 1
228 1 21 LEU HA 1 21 LEU MD1 . . 4.000 3.989 3.869 4.046 0.046 10 0 "[ . 1 . 2]" 1
229 1 21 LEU HA 1 21 LEU MD2 . . 2.880 2.525 1.955 2.767 . 0 0 "[ . 1 . 2]" 1
230 1 21 LEU HA 1 21 LEU HG . . 3.780 3.092 3.006 3.150 . 0 0 "[ . 1 . 2]" 1
231 1 21 LEU HA 1 23 LEU MD2 . . 4.000 3.719 3.526 4.114 0.114 2 0 "[ . 1 . 2]" 1
232 1 21 LEU HB2 1 21 LEU MD1 . . 3.230 2.201 2.000 2.380 . 0 0 "[ . 1 . 2]" 1
233 1 21 LEU HB2 1 22 GLN H . . 4.280 3.475 2.123 3.896 . 0 0 "[ . 1 . 2]" 1
234 1 21 LEU HB2 1 23 LEU MD2 . . 3.880 1.868 1.775 1.991 . 0 0 "[ . 1 . 2]" 1
235 1 21 LEU HB3 1 21 LEU MD1 . . 3.560 2.578 2.318 2.740 . 0 0 "[ . 1 . 2]" 1
236 1 21 LEU HB3 1 21 LEU MD2 . . 3.230 2.169 2.040 2.413 . 0 0 "[ . 1 . 2]" 1
237 1 21 LEU HB3 1 23 LEU MD2 . . 3.780 3.032 1.945 3.377 . 0 0 "[ . 1 . 2]" 1
238 1 21 LEU HB3 1 39 GLN HE21 . . 5.060 3.491 3.153 4.451 . 0 0 "[ . 1 . 2]" 1
239 1 21 LEU MD1 1 23 LEU MD2 . . 3.020 2.135 1.769 2.442 . 0 0 "[ . 1 . 2]" 1
240 1 21 LEU MD1 1 23 LEU HG . . 4.350 3.569 3.256 3.859 . 0 0 "[ . 1 . 2]" 1
241 1 21 LEU MD1 1 36 ALA H . . 4.580 4.554 4.380 4.652 0.072 13 0 "[ . 1 . 2]" 1
242 1 21 LEU MD1 1 36 ALA HA . . 3.410 2.377 2.152 2.500 . 0 0 "[ . 1 . 2]" 1
243 1 21 LEU MD1 1 36 ALA MB . . 3.120 2.743 2.384 2.906 . 0 0 "[ . 1 . 2]" 1
244 1 21 LEU MD1 1 37 TYR H . . 4.810 4.541 4.036 4.759 . 0 0 "[ . 1 . 2]" 1
245 1 21 LEU MD1 1 39 GLN HB2 . . 3.880 2.620 2.460 2.836 . 0 0 "[ . 1 . 2]" 1
246 1 21 LEU MD1 1 39 GLN HB3 . . 3.880 1.906 1.806 2.315 . 0 0 "[ . 1 . 2]" 1
247 1 21 LEU MD1 1 40 PHE H . . 4.280 2.238 1.951 2.685 . 0 0 "[ . 1 . 2]" 1
248 1 21 LEU MD1 1 40 PHE HB2 . . 4.000 2.786 2.499 3.463 . 0 0 "[ . 1 . 2]" 1
249 1 21 LEU MD1 1 40 PHE QD . . 4.000 3.239 2.474 3.514 . 0 0 "[ . 1 . 2]" 1
250 1 21 LEU MD2 1 23 LEU MD2 . . 4.090 3.828 3.484 4.002 . 0 0 "[ . 1 . 2]" 1
251 1 21 LEU MD2 1 39 GLN HB3 . . 3.460 1.917 1.823 1.966 . 0 0 "[ . 1 . 2]" 1
252 1 21 LEU MD2 1 39 GLN HE21 . . 4.350 2.733 2.239 4.212 . 0 0 "[ . 1 . 2]" 1
253 1 21 LEU MD2 1 39 GLN HG2 . . 3.290 3.125 2.954 3.313 0.023 8 0 "[ . 1 . 2]" 1
254 1 21 LEU MD2 1 39 GLN HG3 . . 3.880 3.906 3.862 3.987 0.107 19 0 "[ . 1 . 2]" 1
255 1 21 LEU MD2 1 40 PHE H . . 4.150 2.855 2.391 3.408 . 0 0 "[ . 1 . 2]" 1
256 1 21 LEU MD2 1 40 PHE HA . . 3.560 2.108 1.959 2.879 . 0 0 "[ . 1 . 2]" 1
257 1 21 LEU MD2 1 40 PHE QD . . 4.000 3.523 3.166 3.915 . 0 0 "[ . 1 . 2]" 1
258 1 21 LEU MD2 1 43 MET ME . . 3.120 3.027 2.019 3.147 0.027 10 0 "[ . 1 . 2]" 1
259 1 21 LEU HG 1 40 PHE QD . . 4.350 4.200 3.744 4.367 0.017 13 0 "[ . 1 . 2]" 1
260 1 22 GLN H 1 22 GLN HA . . 2.880 2.316 2.170 2.884 0.004 15 0 "[ . 1 . 2]" 1
261 1 22 GLN H 1 22 GLN HB2 . . 4.150 3.203 2.723 3.509 . 0 0 "[ . 1 . 2]" 1
262 1 22 GLN H 1 22 GLN QG . . 3.620 3.333 2.710 3.623 0.003 6 0 "[ . 1 . 2]" 1
263 1 22 GLN HA 1 22 GLN QG . . 2.950 2.113 1.950 2.288 . 0 0 "[ . 1 . 2]" 1
264 1 22 GLN HA 1 23 LEU H . . 3.620 2.612 2.423 3.182 . 0 0 "[ . 1 . 2]" 1
265 1 22 GLN HB3 1 23 LEU H . . 5.060 4.383 4.284 4.482 . 0 0 "[ . 1 . 2]" 1
266 1 22 GLN QG 1 23 LEU H . . 4.620 4.381 4.150 4.597 . 0 0 "[ . 1 . 2]" 1
267 1 23 LEU H 1 23 LEU HB2 . . 3.780 2.467 2.063 2.615 . 0 0 "[ . 1 . 2]" 1
268 1 23 LEU H 1 23 LEU MD1 . . 3.620 3.461 3.240 3.754 0.134 13 0 "[ . 1 . 2]" 1
269 1 23 LEU H 1 23 LEU MD2 . . 4.150 2.024 1.899 2.258 . 0 0 "[ . 1 . 2]" 1
270 1 23 LEU H 1 23 LEU HG . . 4.120 4.096 3.955 4.189 0.069 18 0 "[ . 1 . 2]" 1
271 1 23 LEU HA 1 23 LEU MD1 . . 2.750 2.078 1.898 2.205 . 0 0 "[ . 1 . 2]" 1
272 1 23 LEU HA 1 23 LEU MD2 . . 4.000 3.132 2.761 3.360 . 0 0 "[ . 1 . 2]" 1
273 1 23 LEU HA 1 24 ASN H . . 3.320 2.882 2.684 2.959 . 0 0 "[ . 1 . 2]" 1
274 1 23 LEU HB2 1 23 LEU MD2 . . 3.000 2.228 2.110 2.322 . 0 0 "[ . 1 . 2]" 1
275 1 23 LEU HB2 1 24 ASN H . . 3.600 2.891 2.609 3.645 0.045 13 0 "[ . 1 . 2]" 1
276 1 23 LEU HB3 1 23 LEU MD1 . . 3.330 2.438 2.370 2.503 . 0 0 "[ . 1 . 2]" 1
277 1 23 LEU HB3 1 24 ASN H . . 3.300 1.937 1.881 2.137 . 0 0 "[ . 1 . 2]" 1
278 1 23 LEU MD1 1 24 ASN H . . 3.750 3.518 2.293 3.827 0.077 11 0 "[ . 1 . 2]" 1
279 1 23 LEU MD2 1 24 ASN H . . 4.310 4.397 4.333 4.533 0.223 2 0 "[ . 1 . 2]" 1
280 1 24 ASN H 1 24 ASN HB2 . . 3.560 3.385 3.205 3.692 0.132 13 0 "[ . 1 . 2]" 1
281 1 24 ASN H 1 24 ASN HB3 . . 3.560 3.269 3.035 3.674 0.114 13 0 "[ . 1 . 2]" 1
282 1 24 ASN H 1 25 LEU H . . 3.960 2.464 2.033 3.050 . 0 0 "[ . 1 . 2]" 1
283 1 25 LEU H 1 25 LEU HB2 . . 3.240 2.569 2.426 2.710 . 0 0 "[ . 1 . 2]" 1
284 1 25 LEU H 1 25 LEU HB3 . . 3.780 3.601 3.524 3.737 . 0 0 "[ . 1 . 2]" 1
285 1 25 LEU H 1 25 LEU MD1 . . 3.880 3.719 3.502 3.849 . 0 0 "[ . 1 . 2]" 1
286 1 25 LEU H 1 25 LEU MD2 . . 3.620 3.121 2.514 3.503 . 0 0 "[ . 1 . 2]" 1
287 1 25 LEU H 1 25 LEU HG . . 3.330 2.276 1.947 2.530 . 0 0 "[ . 1 . 2]" 1
288 1 25 LEU HA 1 25 LEU MD2 . . 2.840 2.083 1.955 2.293 . 0 0 "[ . 1 . 2]" 1
289 1 25 LEU HA 1 26 THR H . . 2.880 2.300 2.254 2.357 . 0 0 "[ . 1 . 2]" 1
290 1 25 LEU HA 1 26 THR MG . . 4.150 3.513 3.162 3.970 . 0 0 "[ . 1 . 2]" 1
291 1 25 LEU HA 1 27 LYS H . . 3.780 3.799 3.766 3.840 0.060 11 0 "[ . 1 . 2]" 1
292 1 25 LEU HA 1 30 GLN HE21 . . 5.230 3.289 2.575 4.080 . 0 0 "[ . 1 . 2]" 1
293 1 25 LEU HB2 1 26 THR H . . 4.440 3.877 3.721 4.064 . 0 0 "[ . 1 . 2]" 1
294 1 25 LEU HB3 1 25 LEU MD1 . . 3.020 2.304 2.222 2.375 . 0 0 "[ . 1 . 2]" 1
295 1 25 LEU HB3 1 25 LEU MD2 . . 2.650 2.411 2.298 2.496 . 0 0 "[ . 1 . 2]" 1
296 1 25 LEU HB3 1 26 THR H . . 3.880 2.922 2.761 3.055 . 0 0 "[ . 1 . 2]" 1
297 1 25 LEU HB3 1 27 LYS H . . 4.000 3.039 2.838 3.365 . 0 0 "[ . 1 . 2]" 1
298 1 25 LEU MD1 1 30 GLN H . . 4.660 3.981 3.687 4.242 . 0 0 "[ . 1 . 2]" 1
299 1 25 LEU MD1 1 30 GLN HB2 . . 4.000 2.270 2.031 2.493 . 0 0 "[ . 1 . 2]" 1
300 1 25 LEU MD1 1 30 GLN HB3 . . 3.780 2.309 2.013 2.632 . 0 0 "[ . 1 . 2]" 1
301 1 25 LEU MD1 1 30 GLN HG3 . . 4.150 3.944 3.631 4.142 . 0 0 "[ . 1 . 2]" 1
302 1 25 LEU MD1 1 31 LEU H . . 4.410 3.691 3.570 3.881 . 0 0 "[ . 1 . 2]" 1
303 1 25 LEU MD1 1 31 LEU HA . . 4.150 3.455 3.250 3.599 . 0 0 "[ . 1 . 2]" 1
304 1 25 LEU MD1 1 31 LEU MD2 . . 2.760 1.895 1.769 2.043 . 0 0 "[ . 1 . 2]" 1
305 1 25 LEU MD1 1 31 LEU HG . . 3.780 2.486 2.339 2.639 . 0 0 "[ . 1 . 2]" 1
306 1 25 LEU MD2 1 26 THR H . . 3.780 3.641 3.388 3.804 0.024 19 0 "[ . 1 . 2]" 1
307 1 25 LEU MD2 1 30 GLN HB2 . . 3.290 3.061 2.861 3.308 0.018 19 0 "[ . 1 . 2]" 1
308 1 25 LEU MD2 1 30 GLN HB3 . . 3.370 1.969 1.861 2.115 . 0 0 "[ . 1 . 2]" 1
309 1 25 LEU MD2 1 30 GLN HE21 . . 5.060 3.536 2.789 3.940 . 0 0 "[ . 1 . 2]" 1
310 1 25 LEU MD2 1 30 GLN HG2 . . 4.150 3.966 3.810 4.152 0.002 4 0 "[ . 1 . 2]" 1
311 1 25 LEU HG 1 31 LEU MD2 . . 4.150 4.104 3.920 4.167 0.017 13 0 "[ . 1 . 2]" 1
312 1 26 THR H 1 26 THR HB . . 4.150 3.409 2.816 3.689 . 0 0 "[ . 1 . 2]" 1
313 1 26 THR H 1 26 THR MG . . 3.460 2.474 1.920 2.879 . 0 0 "[ . 1 . 2]" 1
314 1 26 THR H 1 27 LYS H . . 3.090 1.950 1.864 2.065 . 0 0 "[ . 1 . 2]" 1
315 1 26 THR H 1 30 GLN HE22 . . 4.860 3.981 3.591 4.386 . 0 0 "[ . 1 . 2]" 1
316 1 26 THR H 1 30 GLN HG2 . . 5.140 3.856 3.367 4.210 . 0 0 "[ . 1 . 2]" 1
317 1 26 THR HA 1 26 THR MG . . 3.080 2.699 2.306 3.238 0.158 7 0 "[ . 1 . 2]" 1
318 1 26 THR HB 1 27 LYS H . . 4.150 4.177 4.120 4.256 0.106 7 0 "[ . 1 . 2]" 1
319 1 26 THR HB 1 27 LYS QG . . 4.150 3.667 3.148 4.209 0.059 7 0 "[ . 1 . 2]" 1
320 1 26 THR MG 1 27 LYS H . . 4.150 3.399 2.078 4.155 0.005 19 0 "[ . 1 . 2]" 1
321 1 27 LYS H 1 27 LYS HB2 . . 3.820 2.743 2.635 2.830 . 0 0 "[ . 1 . 2]" 1
322 1 27 LYS H 1 27 LYS QG . . 3.580 2.978 2.544 3.248 . 0 0 "[ . 1 . 2]" 1
323 1 27 LYS H 1 30 GLN H . . 5.060 3.879 3.694 3.988 . 0 0 "[ . 1 . 2]" 1
324 1 27 LYS H 1 30 GLN HG2 . . 4.280 3.158 2.512 3.541 . 0 0 "[ . 1 . 2]" 1
325 1 27 LYS H 1 30 GLN HG3 . . 4.000 2.009 1.940 2.128 . 0 0 "[ . 1 . 2]" 1
326 1 27 LYS HA 1 27 LYS QG . . 3.510 2.444 2.173 2.879 . 0 0 "[ . 1 . 2]" 1
327 1 27 LYS HA 1 28 ILE H . . 3.530 2.408 2.217 2.581 . 0 0 "[ . 1 . 2]" 1
328 1 27 LYS HB2 1 27 LYS QG . . 2.440 2.251 2.180 2.428 . 0 0 "[ . 1 . 2]" 1
329 1 27 LYS HB2 1 29 GLU H . . 4.150 3.365 2.835 3.725 . 0 0 "[ . 1 . 2]" 1
330 1 27 LYS HB2 1 30 GLN H . . 3.880 3.332 3.013 3.756 . 0 0 "[ . 1 . 2]" 1
331 1 27 LYS HB2 1 30 GLN HE21 . . 4.990 4.420 3.817 4.839 . 0 0 "[ . 1 . 2]" 1
332 1 27 LYS HB2 1 30 GLN HG2 . . 3.780 2.882 2.374 3.266 . 0 0 "[ . 1 . 2]" 1
333 1 27 LYS HB3 1 27 LYS QD . . 3.230 2.226 1.993 2.924 . 0 0 "[ . 1 . 2]" 1
334 1 27 LYS HB3 1 27 LYS QE . . 4.350 3.519 1.978 4.017 . 0 0 "[ . 1 . 2]" 1
335 1 27 LYS HB3 1 28 ILE H . . 3.880 2.688 2.298 3.234 . 0 0 "[ . 1 . 2]" 1
336 1 27 LYS HB3 1 29 GLU H . . 3.700 2.747 2.361 3.186 . 0 0 "[ . 1 . 2]" 1
337 1 27 LYS HB3 1 29 GLU HB2 . . 3.880 3.279 2.897 3.650 . 0 0 "[ . 1 . 2]" 1
338 1 27 LYS QE 1 27 LYS QG . . 2.750 2.114 1.978 2.348 . 0 0 "[ . 1 . 2]" 1
339 1 27 LYS QG 1 28 ILE H . . 5.230 4.190 3.932 4.562 . 0 0 "[ . 1 . 2]" 1
340 1 27 LYS QG 1 30 GLN HE21 . . 5.230 4.401 3.936 4.856 . 0 0 "[ . 1 . 2]" 1
341 1 27 LYS QG 1 30 GLN HG2 . . 4.950 4.257 4.019 4.690 . 0 0 "[ . 1 . 2]" 1
342 1 28 ILE H 1 28 ILE HB . . 3.170 2.188 2.107 2.291 . 0 0 "[ . 1 . 2]" 1
343 1 28 ILE H 1 28 ILE MD . . 3.880 3.938 3.819 3.999 0.119 9 0 "[ . 1 . 2]" 1
344 1 28 ILE H 1 28 ILE HG12 . . 3.560 2.664 2.536 2.858 . 0 0 "[ . 1 . 2]" 1
345 1 28 ILE H 1 28 ILE HG13 . . 3.780 3.585 3.356 3.799 0.019 16 0 "[ . 1 . 2]" 1
346 1 28 ILE H 1 28 ILE MG . . 4.000 3.614 3.551 3.679 . 0 0 "[ . 1 . 2]" 1
347 1 28 ILE H 1 29 GLU H . . 4.050 2.513 2.343 2.922 . 0 0 "[ . 1 . 2]" 1
348 1 28 ILE H 1 98 PHE QD . . 4.710 4.757 4.692 4.821 0.111 2 0 "[ . 1 . 2]" 1
349 1 28 ILE HA 1 28 ILE MD . . 2.950 2.241 2.135 2.396 . 0 0 "[ . 1 . 2]" 1
350 1 28 ILE HA 1 28 ILE HG12 . . 3.560 2.560 2.474 2.626 . 0 0 "[ . 1 . 2]" 1
351 1 28 ILE HA 1 28 ILE HG13 . . 3.460 3.634 3.590 3.693 0.233 15 0 "[ . 1 . 2]" 1
352 1 28 ILE HA 1 28 ILE MG . . 3.150 2.579 2.500 2.663 . 0 0 "[ . 1 . 2]" 1
353 1 28 ILE HA 1 30 GLN H . . 4.620 3.450 3.266 3.655 . 0 0 "[ . 1 . 2]" 1
354 1 28 ILE HA 1 31 LEU H . . 4.580 4.017 3.803 4.244 . 0 0 "[ . 1 . 2]" 1
355 1 28 ILE HA 1 31 LEU MD1 . . 3.510 2.139 1.980 2.297 . 0 0 "[ . 1 . 2]" 1
356 1 28 ILE HA 1 31 LEU HG . . 4.000 3.455 3.255 3.646 . 0 0 "[ . 1 . 2]" 1
357 1 28 ILE HB 1 28 ILE MD . . 3.560 3.177 3.138 3.194 . 0 0 "[ . 1 . 2]" 1
358 1 28 ILE HB 1 29 GLU H . . 3.720 3.075 2.727 3.432 . 0 0 "[ . 1 . 2]" 1
359 1 28 ILE HB 1 31 LEU MD1 . . 4.150 4.081 3.881 4.192 0.042 16 0 "[ . 1 . 2]" 1
360 1 28 ILE HB 1 94 PHE QD . . 3.620 3.157 2.380 3.634 0.014 4 0 "[ . 1 . 2]" 1
361 1 28 ILE HB 1 98 PHE QD . . 3.370 3.086 2.924 3.225 . 0 0 "[ . 1 . 2]" 1
362 1 28 ILE MD 1 28 ILE MG . . 2.780 1.855 1.775 1.927 . 0 0 "[ . 1 . 2]" 1
363 1 28 ILE MD 1 98 PHE HA . . 4.000 2.800 2.306 3.173 . 0 0 "[ . 1 . 2]" 1
364 1 28 ILE MD 1 98 PHE QD . . 3.260 3.287 3.018 3.396 0.136 12 0 "[ . 1 . 2]" 1
365 1 28 ILE MD 1 101 VAL MG1 . . 3.100 1.984 1.783 2.190 . 0 0 "[ . 1 . 2]" 1
366 1 28 ILE MD 1 101 VAL MG2 . . 3.620 2.931 2.485 3.165 . 0 0 "[ . 1 . 2]" 1
367 1 28 ILE HG12 1 28 ILE MG . . 3.560 3.214 3.182 3.235 . 0 0 "[ . 1 . 2]" 1
368 1 28 ILE HG12 1 31 LEU MD1 . . 4.150 3.939 3.599 4.156 0.006 20 0 "[ . 1 . 2]" 1
369 1 28 ILE HG12 1 98 PHE QD . . 3.880 3.625 3.532 3.713 . 0 0 "[ . 1 . 2]" 1
370 1 28 ILE HG13 1 98 PHE HB2 . . 3.510 3.481 3.234 3.582 0.072 7 0 "[ . 1 . 2]" 1
371 1 28 ILE HG13 1 98 PHE QD . . 3.460 1.972 1.918 2.027 . 0 0 "[ . 1 . 2]" 1
372 1 28 ILE MG 1 29 GLU H . . 4.150 3.425 2.928 3.685 . 0 0 "[ . 1 . 2]" 1
373 1 28 ILE MG 1 29 GLU HA . . 4.000 3.372 3.126 3.569 . 0 0 "[ . 1 . 2]" 1
374 1 28 ILE MG 1 31 LEU MD1 . . 2.920 1.984 1.796 2.163 . 0 0 "[ . 1 . 2]" 1
375 1 28 ILE MG 1 94 PHE HA . . 3.880 3.266 2.776 3.925 0.045 15 0 "[ . 1 . 2]" 1
376 1 28 ILE MG 1 94 PHE QD . . 4.000 3.498 2.818 4.007 0.007 14 0 "[ . 1 . 2]" 1
377 1 28 ILE MG 1 97 ASN HB2 . . 3.230 3.008 2.341 3.479 0.249 20 0 "[ . 1 . 2]" 1
378 1 28 ILE MG 1 97 ASN HB3 . . 3.560 1.889 1.790 1.950 . 0 0 "[ . 1 . 2]" 1
379 1 28 ILE MG 1 98 PHE H . . 3.780 2.823 2.332 3.156 . 0 0 "[ . 1 . 2]" 1
380 1 28 ILE MG 1 98 PHE HA . . 3.230 1.974 1.916 2.094 . 0 0 "[ . 1 . 2]" 1
381 1 28 ILE MG 1 98 PHE HB2 . . 3.200 2.310 1.988 2.669 . 0 0 "[ . 1 . 2]" 1
382 1 28 ILE MG 1 98 PHE HB3 . . 4.150 3.599 3.353 3.866 . 0 0 "[ . 1 . 2]" 1
383 1 28 ILE MG 1 98 PHE QD . . 3.260 2.938 2.549 3.247 . 0 0 "[ . 1 . 2]" 1
384 1 28 ILE MG 1 101 VAL MG1 . . 3.460 2.296 1.905 2.749 . 0 0 "[ . 1 . 2]" 1
385 1 29 GLU H 1 29 GLU HB2 . . 3.700 2.053 2.022 2.150 . 0 0 "[ . 1 . 2]" 1
386 1 29 GLU H 1 29 GLU HB3 . . 3.860 3.228 3.074 3.449 . 0 0 "[ . 1 . 2]" 1
387 1 29 GLU H 1 29 GLU HG2 . . 4.350 4.114 3.575 4.351 0.001 16 0 "[ . 1 . 2]" 1
388 1 29 GLU H 1 29 GLU HG3 . . 4.000 3.570 2.908 4.373 0.373 14 0 "[ . 1 . 2]" 1
389 1 29 GLU H 1 30 GLN H . . 4.030 2.675 2.472 2.922 . 0 0 "[ . 1 . 2]" 1
390 1 29 GLU H 1 94 PHE QD . . 4.990 3.442 2.402 4.965 . 0 0 "[ . 1 . 2]" 1
391 1 29 GLU HA 1 29 GLU HG2 . . 3.510 2.247 2.082 2.745 . 0 0 "[ . 1 . 2]" 1
392 1 29 GLU HA 1 29 GLU HG3 . . 2.890 2.735 2.166 3.538 0.648 14 1 "[ . 1 +. 2]" 1
393 1 29 GLU HA 1 31 LEU H . . 4.150 3.281 3.167 3.415 . 0 0 "[ . 1 . 2]" 1
394 1 29 GLU HA 1 97 ASN HB2 . . 4.150 3.392 3.059 3.641 . 0 0 "[ . 1 . 2]" 1
395 1 29 GLU HA 1 97 ASN HB3 . . 3.880 3.252 2.892 3.660 . 0 0 "[ . 1 . 2]" 1
396 1 29 GLU HB2 1 30 GLN H . . 4.410 3.697 3.454 3.980 . 0 0 "[ . 1 . 2]" 1
397 1 29 GLU HB2 1 94 PHE HA . . 4.000 3.954 3.686 4.059 0.059 12 0 "[ . 1 . 2]" 1
398 1 29 GLU HG2 1 94 PHE HA . . 3.700 3.159 1.975 3.702 0.002 9 0 "[ . 1 . 2]" 1
399 1 29 GLU HG3 1 94 PHE H . . 3.730 2.520 1.944 2.987 . 0 0 "[ . 1 . 2]" 1
400 1 29 GLU HG3 1 94 PHE HA . . 3.120 2.252 1.960 3.617 0.497 14 0 "[ . 1 . 2]" 1
401 1 29 GLU HG3 1 94 PHE HB2 . . 4.000 2.522 1.951 3.137 . 0 0 "[ . 1 . 2]" 1
402 1 29 GLU HG3 1 94 PHE HB3 . . 4.150 3.815 2.536 4.704 0.554 14 1 "[ . 1 +. 2]" 1
403 1 29 GLU HG3 1 94 PHE QD . . 3.780 3.408 2.390 3.977 0.197 19 0 "[ . 1 . 2]" 1
404 1 30 GLN H 1 30 GLN HB2 . . 3.230 2.240 2.172 2.395 . 0 0 "[ . 1 . 2]" 1
405 1 30 GLN H 1 30 GLN HB3 . . 3.460 3.497 3.464 3.543 0.083 13 0 "[ . 1 . 2]" 1
406 1 30 GLN H 1 30 GLN HG2 . . 3.230 2.751 2.260 2.957 . 0 0 "[ . 1 . 2]" 1
407 1 30 GLN H 1 30 GLN HG3 . . 3.450 3.407 3.305 3.472 0.022 10 0 "[ . 1 . 2]" 1
408 1 30 GLN H 1 31 LEU H . . 3.550 2.663 2.506 2.810 . 0 0 "[ . 1 . 2]" 1
409 1 30 GLN HA 1 30 GLN HB2 . . 2.930 3.020 2.991 3.038 0.108 12 0 "[ . 1 . 2]" 1
410 1 30 GLN HA 1 30 GLN HG2 . . 2.880 2.361 2.178 2.633 . 0 0 "[ . 1 . 2]" 1
411 1 30 GLN HA 1 32 CYS H . . 3.700 3.316 3.251 3.380 . 0 0 "[ . 1 . 2]" 1
412 1 30 GLN HB2 1 30 GLN HG2 . . 3.040 2.726 2.627 2.805 . 0 0 "[ . 1 . 2]" 1
413 1 30 GLN HB2 1 30 GLN HG3 . . 2.450 2.300 2.271 2.353 . 0 0 "[ . 1 . 2]" 1
414 1 30 GLN HB3 1 31 LEU H . . 4.330 3.997 3.805 4.193 . 0 0 "[ . 1 . 2]" 1
415 1 30 GLN HE21 1 30 GLN HG3 . . 3.370 2.237 2.102 2.407 . 0 0 "[ . 1 . 2]" 1
416 1 30 GLN HE22 1 30 GLN HG2 . . 4.150 3.807 3.690 3.977 . 0 0 "[ . 1 . 2]" 1
417 1 31 LEU H 1 31 LEU HB2 . . 3.430 2.775 2.746 2.809 . 0 0 "[ . 1 . 2]" 1
418 1 31 LEU H 1 31 LEU HB3 . . 4.000 3.633 3.617 3.674 . 0 0 "[ . 1 . 2]" 1
419 1 31 LEU H 1 31 LEU MD1 . . 3.700 2.873 2.767 2.963 . 0 0 "[ . 1 . 2]" 1
420 1 31 LEU H 1 31 LEU MD2 . . 4.000 3.716 3.673 3.829 . 0 0 "[ . 1 . 2]" 1
421 1 31 LEU H 1 31 LEU HG . . 3.260 2.109 2.058 2.248 . 0 0 "[ . 1 . 2]" 1
422 1 31 LEU H 1 32 CYS H . . 3.530 2.876 2.679 3.009 . 0 0 "[ . 1 . 2]" 1
423 1 31 LEU HA 1 31 LEU MD1 . . 4.000 3.991 3.972 4.005 0.005 6 0 "[ . 1 . 2]" 1
424 1 31 LEU HA 1 31 LEU MD2 . . 2.900 2.846 2.756 2.897 . 0 0 "[ . 1 . 2]" 1
425 1 31 LEU HA 1 31 LEU HG . . 3.780 2.969 2.929 2.999 . 0 0 "[ . 1 . 2]" 1
426 1 31 LEU HA 1 33 SER H . . 4.240 3.015 2.862 3.192 . 0 0 "[ . 1 . 2]" 1
427 1 31 LEU HA 1 34 GLY H . . 4.990 3.633 3.135 4.006 . 0 0 "[ . 1 . 2]" 1
428 1 31 LEU HA 1 37 TYR QE . . 4.150 4.051 3.592 4.158 0.008 7 0 "[ . 1 . 2]" 1
429 1 31 LEU HB2 1 31 LEU MD1 . . 3.120 1.980 1.941 2.035 . 0 0 "[ . 1 . 2]" 1
430 1 31 LEU HB2 1 31 LEU MD2 . . 3.510 3.070 3.048 3.094 . 0 0 "[ . 1 . 2]" 1
431 1 31 LEU HB2 1 32 CYS H . . 4.240 4.213 4.139 4.271 0.031 20 0 "[ . 1 . 2]" 1
432 1 31 LEU HB2 1 37 TYR QE . . 4.000 3.560 3.299 3.792 . 0 0 "[ . 1 . 2]" 1
433 1 31 LEU HB2 1 37 TYR HH . . 4.350 2.981 2.376 3.379 . 0 0 "[ . 1 . 2]" 1
434 1 31 LEU HB3 1 31 LEU MD1 . . 3.510 2.876 2.842 2.906 . 0 0 "[ . 1 . 2]" 1
435 1 31 LEU HB3 1 31 LEU MD2 . . 3.560 2.093 1.999 2.184 . 0 0 "[ . 1 . 2]" 1
436 1 31 LEU HB3 1 37 TYR QE . . 3.780 2.806 2.400 3.018 . 0 0 "[ . 1 . 2]" 1
437 1 31 LEU MD1 1 32 CYS H . . 5.060 5.021 4.884 5.088 0.028 15 0 "[ . 1 . 2]" 1
438 1 31 LEU MD1 1 37 TYR QE . . 3.880 3.802 3.349 3.915 0.035 18 0 "[ . 1 . 2]" 1
439 1 31 LEU MD1 1 37 TYR HH . . 3.880 2.931 2.479 3.584 . 0 0 "[ . 1 . 2]" 1
440 1 31 LEU MD1 1 101 VAL HB . . 3.230 2.604 2.147 2.797 . 0 0 "[ . 1 . 2]" 1
441 1 31 LEU MD1 1 101 VAL MG1 . . 3.120 2.749 2.413 3.067 . 0 0 "[ . 1 . 2]" 1
442 1 31 LEU MD1 1 101 VAL MG2 . . 2.980 2.375 2.053 2.725 . 0 0 "[ . 1 . 2]" 1
443 1 31 LEU MD2 1 36 ALA MB . . 2.790 2.646 2.295 2.823 0.033 16 0 "[ . 1 . 2]" 1
444 1 31 LEU MD2 1 37 TYR QD . . 4.660 4.518 4.293 4.666 0.006 4 0 "[ . 1 . 2]" 1
445 1 31 LEU MD2 1 37 TYR QE . . 4.000 3.439 3.075 3.689 . 0 0 "[ . 1 . 2]" 1
446 1 31 LEU MD2 1 101 VAL MG2 . . 3.620 2.965 2.469 3.255 . 0 0 "[ . 1 . 2]" 1
447 1 31 LEU HG 1 32 CYS H . . 4.440 4.551 4.487 4.598 0.158 20 0 "[ . 1 . 2]" 1
448 1 32 CYS H 1 32 CYS HB2 . . 3.770 3.625 3.567 3.656 . 0 0 "[ . 1 . 2]" 1
449 1 32 CYS H 1 32 CYS HB3 . . 3.420 2.784 2.642 2.915 . 0 0 "[ . 1 . 2]" 1
450 1 32 CYS H 1 33 SER H . . 3.770 2.663 2.206 3.101 . 0 0 "[ . 1 . 2]" 1
451 1 32 CYS HA 1 34 GLY H . . 4.990 4.867 4.083 5.016 0.026 18 0 "[ . 1 . 2]" 1
452 1 32 CYS HB2 1 92 GLY H . . 3.880 3.380 2.800 3.695 . 0 0 "[ . 1 . 2]" 1
453 1 32 CYS HB2 1 92 GLY HA3 . . 4.350 3.731 2.739 4.124 . 0 0 "[ . 1 . 2]" 1
454 1 32 CYS HB3 1 92 GLY H . . 4.150 3.926 3.635 4.140 . 0 0 "[ . 1 . 2]" 1
455 1 32 CYS HB3 1 92 GLY HA2 . . 3.780 2.783 2.410 3.220 . 0 0 "[ . 1 . 2]" 1
456 1 32 CYS HB3 1 92 GLY HA3 . . 3.880 3.611 2.809 3.902 0.022 13 0 "[ . 1 . 2]" 1
457 1 33 SER H 1 33 SER HB2 . . 3.850 3.593 3.509 3.704 . 0 0 "[ . 1 . 2]" 1
458 1 33 SER H 1 33 SER HB3 . . 3.290 3.143 2.757 3.367 0.077 18 0 "[ . 1 . 2]" 1
459 1 33 SER H 1 34 GLY H . . 3.260 2.383 2.066 2.761 . 0 0 "[ . 1 . 2]" 1
460 1 33 SER H 1 35 ALA H . . 4.860 4.440 4.244 4.872 0.012 14 0 "[ . 1 . 2]" 1
461 1 33 SER HA 1 33 SER HB2 . . 2.980 2.618 2.539 2.669 . 0 0 "[ . 1 . 2]" 1
462 1 33 SER HA 1 58 ALA MB . . 4.150 4.008 3.730 4.172 0.022 13 0 "[ . 1 . 2]" 1
463 1 33 SER HA 1 64 TYR HA . . 3.700 2.887 2.678 3.095 . 0 0 "[ . 1 . 2]" 1
464 1 33 SER HA 1 64 TYR QD . . 3.290 2.667 2.472 2.771 . 0 0 "[ . 1 . 2]" 1
465 1 33 SER HA 1 64 TYR QE . . 3.880 3.751 3.568 3.888 0.008 19 0 "[ . 1 . 2]" 1
466 1 33 SER HB2 1 35 ALA H . . 4.360 3.832 3.602 4.176 . 0 0 "[ . 1 . 2]" 1
467 1 33 SER HB2 1 58 ALA MB . . 3.510 3.480 3.085 3.533 0.023 2 0 "[ . 1 . 2]" 1
468 1 33 SER HB3 1 34 GLY H . . 4.750 3.881 3.775 4.257 . 0 0 "[ . 1 . 2]" 1
469 1 33 SER HB3 1 58 ALA MB . . 3.780 3.773 3.666 3.826 0.046 18 0 "[ . 1 . 2]" 1
470 1 33 SER HB3 1 64 TYR QD . . 3.780 3.694 3.524 3.812 0.032 9 0 "[ . 1 . 2]" 1
471 1 33 SER HB3 1 64 TYR QE . . 3.560 3.520 3.365 3.593 0.033 5 0 "[ . 1 . 2]" 1
472 1 34 GLY H 1 35 ALA H . . 3.870 2.261 2.117 2.661 . 0 0 "[ . 1 . 2]" 1
473 1 34 GLY H 1 37 TYR QD . . 5.140 3.917 3.606 4.274 . 0 0 "[ . 1 . 2]" 1
474 1 34 GLY H 1 68 PHE QE . . 4.100 4.025 3.813 4.128 0.028 6 0 "[ . 1 . 2]" 1
475 1 34 GLY H 1 68 PHE HZ . . 3.880 3.788 3.362 3.919 0.039 16 0 "[ . 1 . 2]" 1
476 1 34 GLY QA 1 37 TYR H . . 4.750 3.999 3.808 4.125 . 0 0 "[ . 1 . 2]" 1
477 1 34 GLY QA 1 37 TYR QD . . 3.560 1.990 1.959 2.076 . 0 0 "[ . 1 . 2]" 1
478 1 34 GLY QA 1 67 ASN HB2 . . 3.880 2.890 2.519 3.401 . 0 0 "[ . 1 . 2]" 1
479 1 34 GLY QA 1 67 ASN HB3 . . 3.880 3.060 2.655 3.450 . 0 0 "[ . 1 . 2]" 1
480 1 34 GLY QA 1 68 PHE QE . . 3.700 2.807 2.453 3.088 . 0 0 "[ . 1 . 2]" 1
481 1 35 ALA H 1 35 ALA MB . . 2.930 2.404 2.315 2.463 . 0 0 "[ . 1 . 2]" 1
482 1 35 ALA H 1 36 ALA H . . 3.600 2.083 1.966 2.175 . 0 0 "[ . 1 . 2]" 1
483 1 35 ALA H 1 67 ASN HD21 . . 4.310 4.309 4.245 4.341 0.031 17 0 "[ . 1 . 2]" 1
484 1 35 ALA HA 1 38 CYS H . . 3.880 3.361 3.161 3.517 . 0 0 "[ . 1 . 2]" 1
485 1 35 ALA HA 1 38 CYS HB2 . . 3.620 2.489 2.428 2.550 . 0 0 "[ . 1 . 2]" 1
486 1 35 ALA HA 1 38 CYS HB3 . . 4.000 4.026 4.001 4.052 0.052 10 0 "[ . 1 . 2]" 1
487 1 35 ALA HA 1 38 CYS HG . . 3.780 3.506 3.343 3.704 . 0 0 "[ . 1 . 2]" 1
488 1 35 ALA HA 1 54 VAL MG2 . . 3.170 2.106 1.943 2.338 . 0 0 "[ . 1 . 2]" 1
489 1 35 ALA MB 1 36 ALA H . . 3.260 2.431 2.318 2.538 . 0 0 "[ . 1 . 2]" 1
490 1 35 ALA MB 1 54 VAL MG1 . . 3.700 3.585 3.445 3.744 0.044 13 0 "[ . 1 . 2]" 1
491 1 35 ALA MB 1 54 VAL MG2 . . 3.150 2.385 2.156 2.666 . 0 0 "[ . 1 . 2]" 1
492 1 35 ALA MB 1 56 PHE HA . . 2.970 2.406 1.999 2.819 . 0 0 "[ . 1 . 2]" 1
493 1 35 ALA MB 1 56 PHE HB2 . . 4.350 4.362 4.043 4.717 0.367 6 0 "[ . 1 . 2]" 1
494 1 35 ALA MB 1 56 PHE QD . . 3.370 2.249 1.967 2.626 . 0 0 "[ . 1 . 2]" 1
495 1 35 ALA MB 1 67 ASN HD21 . . 3.780 2.942 2.703 3.167 . 0 0 "[ . 1 . 2]" 1
496 1 35 ALA MB 1 67 ASN HD22 . . 4.710 3.958 3.656 4.181 . 0 0 "[ . 1 . 2]" 1
497 1 36 ALA H 1 36 ALA MB . . 3.020 2.095 2.000 2.171 . 0 0 "[ . 1 . 2]" 1
498 1 36 ALA H 1 37 TYR H . . 3.710 3.103 2.993 3.204 . 0 0 "[ . 1 . 2]" 1
499 1 36 ALA HA 1 39 GLN H . . 4.000 3.765 3.481 3.980 . 0 0 "[ . 1 . 2]" 1
500 1 36 ALA HA 1 39 GLN HB2 . . 3.460 3.008 2.676 3.242 . 0 0 "[ . 1 . 2]" 1
501 1 36 ALA HA 1 39 GLN HB3 . . 3.700 3.672 3.463 3.747 0.047 16 0 "[ . 1 . 2]" 1
502 1 36 ALA MB 1 37 TYR H . . 3.410 2.423 2.300 2.624 . 0 0 "[ . 1 . 2]" 1
503 1 36 ALA MB 1 37 TYR HA . . 4.000 3.721 3.619 3.778 . 0 0 "[ . 1 . 2]" 1
504 1 37 TYR H 1 37 TYR HB2 . . 3.680 2.601 2.538 2.688 . 0 0 "[ . 1 . 2]" 1
505 1 37 TYR H 1 37 TYR HB3 . . 3.780 3.441 3.432 3.452 . 0 0 "[ . 1 . 2]" 1
506 1 37 TYR H 1 37 TYR QD . . 4.150 2.607 2.260 2.853 . 0 0 "[ . 1 . 2]" 1
507 1 37 TYR HA 1 37 TYR QD . . 3.170 2.618 2.335 2.904 . 0 0 "[ . 1 . 2]" 1
508 1 37 TYR HA 1 40 PHE H . . 4.000 3.527 3.374 3.689 . 0 0 "[ . 1 . 2]" 1
509 1 37 TYR HA 1 40 PHE HB2 . . 3.780 2.508 2.395 2.643 . 0 0 "[ . 1 . 2]" 1
510 1 37 TYR HA 1 40 PHE HB3 . . 3.700 3.140 2.787 3.612 . 0 0 "[ . 1 . 2]" 1
511 1 37 TYR HA 1 40 PHE QD . . 3.780 3.196 2.956 3.367 . 0 0 "[ . 1 . 2]" 1
512 1 37 TYR HB2 1 38 CYS H . . 4.000 2.142 1.990 2.273 . 0 0 "[ . 1 . 2]" 1
513 1 37 TYR HB2 1 71 LEU MD1 . . 3.290 3.352 3.285 3.406 0.116 20 0 "[ . 1 . 2]" 1
514 1 37 TYR HB2 1 71 LEU MD2 . . 3.460 3.147 3.034 3.254 . 0 0 "[ . 1 . 2]" 1
515 1 37 TYR HB2 1 71 LEU HG . . 3.290 1.998 1.958 2.069 . 0 0 "[ . 1 . 2]" 1
516 1 37 TYR HB3 1 71 LEU MD1 . . 3.330 2.984 2.772 3.146 . 0 0 "[ . 1 . 2]" 1
517 1 37 TYR HB3 1 71 LEU HG . . 3.170 2.384 2.224 2.573 . 0 0 "[ . 1 . 2]" 1
518 1 37 TYR QD 1 38 CYS H . . 4.920 3.653 3.517 3.922 . 0 0 "[ . 1 . 2]" 1
519 1 37 TYR QD 1 68 PHE QE . . 3.780 3.227 2.748 3.746 . 0 0 "[ . 1 . 2]" 1
520 1 37 TYR QD 1 71 LEU MD1 . . 4.150 3.738 3.532 3.859 . 0 0 "[ . 1 . 2]" 1
521 1 37 TYR QD 1 71 LEU HG . . 4.350 3.458 3.227 3.680 . 0 0 "[ . 1 . 2]" 1
522 1 37 TYR QD 1 100 PHE QE . . 4.000 3.635 3.496 3.859 . 0 0 "[ . 1 . 2]" 1
523 1 37 TYR QE 1 37 TYR HH . . 3.200 2.257 2.137 2.616 . 0 0 "[ . 1 . 2]" 1
524 1 37 TYR QE 1 100 PHE QE . . 3.200 2.639 2.460 2.858 . 0 0 "[ . 1 . 2]" 1
525 1 37 TYR QE 1 100 PHE HZ . . 4.350 4.329 4.216 4.380 0.030 18 0 "[ . 1 . 2]" 1
526 1 37 TYR QE 1 101 VAL HA . . 3.880 3.112 2.803 3.418 . 0 0 "[ . 1 . 2]" 1
527 1 37 TYR QE 1 101 VAL HB . . 3.700 3.467 3.213 3.724 0.024 17 0 "[ . 1 . 2]" 1
528 1 37 TYR QE 1 101 VAL MG2 . . 3.170 2.524 2.263 2.796 . 0 0 "[ . 1 . 2]" 1
529 1 37 TYR HH 1 100 PHE QD . . 3.510 2.636 2.020 3.360 . 0 0 "[ . 1 . 2]" 1
530 1 37 TYR HH 1 101 VAL H . . 4.990 4.456 3.916 4.943 . 0 0 "[ . 1 . 2]" 1
531 1 37 TYR HH 1 101 VAL HB . . 4.000 2.685 2.254 3.674 . 0 0 "[ . 1 . 2]" 1
532 1 38 CYS H 1 38 CYS HB2 . . 3.340 2.170 2.104 2.249 . 0 0 "[ . 1 . 2]" 1
533 1 38 CYS H 1 38 CYS HB3 . . 3.670 3.459 3.398 3.511 . 0 0 "[ . 1 . 2]" 1
534 1 38 CYS H 1 38 CYS HG . . 3.260 3.112 2.948 3.252 . 0 0 "[ . 1 . 2]" 1
535 1 38 CYS H 1 39 GLN H . . 3.560 3.043 2.876 3.165 . 0 0 "[ . 1 . 2]" 1
536 1 38 CYS H 1 40 PHE H . . 4.860 4.319 4.058 4.624 . 0 0 "[ . 1 . 2]" 1
537 1 38 CYS HA 1 38 CYS HG . . 3.410 3.339 3.201 3.413 0.003 17 0 "[ . 1 . 2]" 1
538 1 38 CYS HA 1 41 MET H . . 3.880 3.493 3.225 3.744 . 0 0 "[ . 1 . 2]" 1
539 1 38 CYS HA 1 41 MET HB2 . . 3.880 2.611 2.461 2.758 . 0 0 "[ . 1 . 2]" 1
540 1 38 CYS HA 1 49 ILE MD . . 3.170 3.257 3.230 3.281 0.111 10 0 "[ . 1 . 2]" 1
541 1 38 CYS HA 1 71 LEU HB2 . . 4.000 3.668 3.489 3.802 . 0 0 "[ . 1 . 2]" 1
542 1 38 CYS HA 1 71 LEU MD2 . . 3.170 2.360 2.274 2.450 . 0 0 "[ . 1 . 2]" 1
543 1 38 CYS HB2 1 39 GLN H . . 3.780 2.640 2.518 2.825 . 0 0 "[ . 1 . 2]" 1
544 1 38 CYS HB2 1 49 ILE MG . . 4.000 4.021 3.975 4.054 0.054 10 0 "[ . 1 . 2]" 1
545 1 38 CYS HB2 1 54 VAL MG1 . . 3.410 3.426 3.400 3.452 0.042 18 0 "[ . 1 . 2]" 1
546 1 38 CYS HB2 1 54 VAL MG2 . . 3.620 2.525 2.323 2.717 . 0 0 "[ . 1 . 2]" 1
547 1 38 CYS HB3 1 39 GLN H . . 4.350 2.794 2.642 3.138 . 0 0 "[ . 1 . 2]" 1
548 1 38 CYS HB3 1 49 ILE MG . . 3.370 3.282 3.137 3.381 0.011 10 0 "[ . 1 . 2]" 1
549 1 38 CYS HB3 1 54 VAL MG1 . . 3.150 2.755 2.570 2.895 . 0 0 "[ . 1 . 2]" 1
550 1 38 CYS HB3 1 54 VAL MG2 . . 3.780 3.177 2.934 3.446 . 0 0 "[ . 1 . 2]" 1
551 1 38 CYS HG 1 49 ILE MG . . 3.780 3.288 3.201 3.409 . 0 0 "[ . 1 . 2]" 1
552 1 38 CYS HG 1 71 LEU HB2 . . 4.150 1.986 1.961 2.024 . 0 0 "[ . 1 . 2]" 1
553 1 38 CYS HG 1 71 LEU MD2 . . 3.510 3.549 3.511 3.591 0.081 14 0 "[ . 1 . 2]" 1
554 1 39 GLN H 1 39 GLN HB2 . . 3.280 2.032 2.018 2.050 . 0 0 "[ . 1 . 2]" 1
555 1 39 GLN H 1 39 GLN HB3 . . 3.620 3.201 3.139 3.258 . 0 0 "[ . 1 . 2]" 1
556 1 39 GLN H 1 39 GLN HG2 . . 4.000 4.062 3.973 4.129 0.129 9 0 "[ . 1 . 2]" 1
557 1 39 GLN H 1 39 GLN HG3 . . 3.700 3.634 3.537 3.758 0.058 13 0 "[ . 1 . 2]" 1
558 1 39 GLN H 1 40 PHE H . . 3.710 2.985 2.903 3.088 . 0 0 "[ . 1 . 2]" 1
559 1 39 GLN H 1 51 LEU MD2 . . 4.580 3.547 3.185 3.839 . 0 0 "[ . 1 . 2]" 1
560 1 39 GLN HA 1 39 GLN HG2 . . 2.980 2.113 2.052 2.176 . 0 0 "[ . 1 . 2]" 1
561 1 39 GLN HA 1 39 GLN HG3 . . 3.510 2.845 2.748 2.947 . 0 0 "[ . 1 . 2]" 1
562 1 39 GLN HA 1 42 ASP H . . 4.580 3.707 3.555 3.804 . 0 0 "[ . 1 . 2]" 1
563 1 39 GLN HA 1 42 ASP HB2 . . 4.000 3.668 3.092 4.013 0.013 3 0 "[ . 1 . 2]" 1
564 1 39 GLN HA 1 42 ASP HB3 . . 3.880 3.085 2.728 3.633 . 0 0 "[ . 1 . 2]" 1
565 1 39 GLN HA 1 51 LEU MD2 . . 3.290 3.053 2.830 3.216 . 0 0 "[ . 1 . 2]" 1
566 1 39 GLN HA 1 56 PHE HZ . . 4.150 3.152 2.938 3.300 . 0 0 "[ . 1 . 2]" 1
567 1 39 GLN HB2 1 40 PHE H . . 3.920 3.205 3.066 3.329 . 0 0 "[ . 1 . 2]" 1
568 1 39 GLN HB2 1 56 PHE QE . . 4.150 3.317 2.551 3.712 . 0 0 "[ . 1 . 2]" 1
569 1 39 GLN HB3 1 40 PHE H . . 3.960 2.642 2.360 2.949 . 0 0 "[ . 1 . 2]" 1
570 1 39 GLN HE21 1 39 GLN HG2 . . 3.370 2.328 2.102 3.520 0.150 15 0 "[ . 1 . 2]" 1
571 1 39 GLN HE22 1 39 GLN HG2 . . 3.880 3.552 3.445 4.132 0.252 15 0 "[ . 1 . 2]" 1
572 1 39 GLN HG2 1 51 LEU MD1 . . 4.000 2.123 1.969 2.702 . 0 0 "[ . 1 . 2]" 1
573 1 39 GLN HG2 1 51 LEU MD2 . . 3.560 3.062 2.820 3.372 . 0 0 "[ . 1 . 2]" 1
574 1 39 GLN HG2 1 56 PHE QE . . 3.560 3.542 3.440 3.618 0.058 13 0 "[ . 1 . 2]" 1
575 1 39 GLN HG2 1 56 PHE HZ . . 3.880 3.297 3.021 3.491 . 0 0 "[ . 1 . 2]" 1
576 1 39 GLN HG3 1 51 LEU MD1 . . 4.150 2.848 2.432 3.479 . 0 0 "[ . 1 . 2]" 1
577 1 39 GLN HG3 1 56 PHE QE . . 4.000 1.991 1.965 2.033 . 0 0 "[ . 1 . 2]" 1
578 1 40 PHE H 1 40 PHE HB2 . . 3.260 1.900 1.877 1.917 . 0 0 "[ . 1 . 2]" 1
579 1 40 PHE H 1 40 PHE HB3 . . 3.410 3.051 2.933 3.204 . 0 0 "[ . 1 . 2]" 1
580 1 40 PHE H 1 40 PHE QD . . 4.350 3.764 3.486 3.871 . 0 0 "[ . 1 . 2]" 1
581 1 40 PHE HA 1 40 PHE QD . . 3.510 2.249 2.009 2.452 . 0 0 "[ . 1 . 2]" 1
582 1 40 PHE HA 1 40 PHE QE . . 4.660 4.259 4.166 4.328 . 0 0 "[ . 1 . 2]" 1
583 1 40 PHE HA 1 43 MET H . . 4.280 3.650 3.519 3.808 . 0 0 "[ . 1 . 2]" 1
584 1 40 PHE HA 1 43 MET HB2 . . 3.780 2.699 2.440 2.927 . 0 0 "[ . 1 . 2]" 1
585 1 40 PHE HA 1 43 MET HB3 . . 3.780 3.583 3.332 3.804 0.024 10 0 "[ . 1 . 2]" 1
586 1 40 PHE HB2 1 41 MET H . . 4.060 3.187 2.949 3.393 . 0 0 "[ . 1 . 2]" 1
587 1 40 PHE HB2 1 108 PHE HZ . . 4.150 4.034 3.722 4.166 0.016 19 0 "[ . 1 . 2]" 1
588 1 40 PHE HB3 1 41 MET H . . 3.990 2.598 2.362 2.819 . 0 0 "[ . 1 . 2]" 1
589 1 40 PHE HB3 1 44 LEU MD1 . . 4.150 3.694 3.419 4.034 . 0 0 "[ . 1 . 2]" 1
590 1 40 PHE HB3 1 108 PHE HZ . . 3.880 2.561 2.216 2.746 . 0 0 "[ . 1 . 2]" 1
591 1 40 PHE QD 1 43 MET ME . . 3.700 3.063 2.533 3.543 . 0 0 "[ . 1 . 2]" 1
592 1 40 PHE QD 1 44 LEU MD1 . . 3.620 3.013 2.642 3.341 . 0 0 "[ . 1 . 2]" 1
593 1 40 PHE QD 1 44 LEU MD2 . . 3.880 3.751 3.617 3.894 0.014 18 0 "[ . 1 . 2]" 1
594 1 40 PHE QD 1 44 LEU HG . . 4.000 2.876 2.624 3.094 . 0 0 "[ . 1 . 2]" 1
595 1 40 PHE QE 1 43 MET ME . . 3.780 3.161 2.673 3.634 . 0 0 "[ . 1 . 2]" 1
596 1 40 PHE QE 1 44 LEU MD1 . . 4.150 3.670 2.976 4.043 . 0 0 "[ . 1 . 2]" 1
597 1 41 MET H 1 41 MET HB2 . . 3.460 2.097 2.055 2.177 . 0 0 "[ . 1 . 2]" 1
598 1 41 MET H 1 41 MET HB3 . . 3.620 3.410 3.375 3.459 . 0 0 "[ . 1 . 2]" 1
599 1 41 MET H 1 41 MET HG2 . . 4.150 2.829 2.605 2.991 . 0 0 "[ . 1 . 2]" 1
600 1 41 MET H 1 41 MET HG3 . . 3.880 3.859 3.736 3.941 0.061 12 0 "[ . 1 . 2]" 1
601 1 41 MET H 1 42 ASP H . . 3.890 2.946 2.818 3.114 . 0 0 "[ . 1 . 2]" 1
602 1 41 MET H 1 71 LEU MD2 . . 4.710 4.064 3.972 4.173 . 0 0 "[ . 1 . 2]" 1
603 1 41 MET HA 1 41 MET ME . . 4.000 3.832 3.678 3.975 . 0 0 "[ . 1 . 2]" 1
604 1 41 MET HA 1 41 MET HG2 . . 4.000 2.655 2.584 2.714 . 0 0 "[ . 1 . 2]" 1
605 1 41 MET HA 1 41 MET HG3 . . 3.880 3.626 3.613 3.647 . 0 0 "[ . 1 . 2]" 1
606 1 41 MET HA 1 44 LEU H . . 4.470 3.092 2.980 3.232 . 0 0 "[ . 1 . 2]" 1
607 1 41 MET HA 1 44 LEU HB2 . . 4.150 2.668 2.637 2.700 . 0 0 "[ . 1 . 2]" 1
608 1 41 MET HA 1 44 LEU HB3 . . 4.350 4.383 4.368 4.405 0.055 18 0 "[ . 1 . 2]" 1
609 1 41 MET HA 1 44 LEU MD1 . . 4.000 3.158 2.738 3.477 . 0 0 "[ . 1 . 2]" 1
610 1 41 MET HA 1 45 PHE H . . 4.170 3.225 2.838 3.547 . 0 0 "[ . 1 . 2]" 1
611 1 41 MET HA 1 45 PHE QD . . 3.780 3.200 2.866 3.453 . 0 0 "[ . 1 . 2]" 1
612 1 41 MET HB2 1 41 MET ME . . 3.700 3.726 3.668 3.760 0.060 3 0 "[ . 1 . 2]" 1
613 1 41 MET HB2 1 42 ASP H . . 4.150 2.491 2.413 2.586 . 0 0 "[ . 1 . 2]" 1
614 1 41 MET HB2 1 49 ILE MD . . 3.230 2.581 2.506 2.663 . 0 0 "[ . 1 . 2]" 1
615 1 41 MET HB2 1 49 ILE HG12 . . 4.000 3.351 3.277 3.421 . 0 0 "[ . 1 . 2]" 1
616 1 41 MET HB2 1 49 ILE HG13 . . 4.350 1.979 1.960 2.030 . 0 0 "[ . 1 . 2]" 1
617 1 41 MET HB2 1 71 LEU MD2 . . 3.410 3.174 3.104 3.248 . 0 0 "[ . 1 . 2]" 1
618 1 41 MET HB3 1 41 MET ME . . 3.170 2.766 2.566 2.925 . 0 0 "[ . 1 . 2]" 1
619 1 41 MET HB3 1 45 PHE QD . . 4.350 4.182 3.948 4.352 0.002 4 0 "[ . 1 . 2]" 1
620 1 41 MET HB3 1 49 ILE MD . . 3.370 1.935 1.911 1.987 . 0 0 "[ . 1 . 2]" 1
621 1 41 MET HB3 1 49 ILE HG12 . . 4.000 2.380 2.327 2.430 . 0 0 "[ . 1 . 2]" 1
622 1 41 MET HB3 1 49 ILE HG13 . . 3.880 2.056 1.986 2.145 . 0 0 "[ . 1 . 2]" 1
623 1 41 MET HB3 1 71 LEU MD2 . . 3.880 3.928 3.882 3.974 0.094 19 0 "[ . 1 . 2]" 1
624 1 41 MET ME 1 41 MET HG2 . . 3.510 3.229 3.184 3.284 . 0 0 "[ . 1 . 2]" 1
625 1 41 MET ME 1 41 MET HG3 . . 3.020 2.039 1.998 2.126 . 0 0 "[ . 1 . 2]" 1
626 1 41 MET ME 1 45 PHE HB2 . . 3.880 2.759 2.095 3.242 . 0 0 "[ . 1 . 2]" 1
627 1 41 MET ME 1 45 PHE HB3 . . 4.350 3.772 2.927 4.273 . 0 0 "[ . 1 . 2]" 1
628 1 41 MET ME 1 45 PHE QD . . 3.120 3.036 2.917 3.138 0.018 14 0 "[ . 1 . 2]" 1
629 1 41 MET ME 1 45 PHE QE . . 4.000 3.990 3.884 4.043 0.043 9 0 "[ . 1 . 2]" 1
630 1 41 MET ME 1 48 SER HB2 . . 3.560 2.236 1.949 2.720 . 0 0 "[ . 1 . 2]" 1
631 1 41 MET ME 1 48 SER HG . . 4.150 3.209 2.278 3.731 . 0 0 "[ . 1 . 2]" 1
632 1 41 MET ME 1 49 ILE MD . . 3.880 1.768 1.731 1.825 . 0 0 "[ . 1 . 2]" 1
633 1 41 MET ME 1 49 ILE MG . . 4.000 4.030 3.972 4.096 0.096 4 0 "[ . 1 . 2]" 1
634 1 41 MET ME 1 71 LEU MD2 . . 3.780 3.179 3.078 3.394 . 0 0 "[ . 1 . 2]" 1
635 1 41 MET ME 1 74 GLY HA2 . . 3.620 3.245 2.738 3.632 0.012 16 0 "[ . 1 . 2]" 1
636 1 41 MET ME 1 74 GLY HA3 . . 3.780 2.423 2.002 2.678 . 0 0 "[ . 1 . 2]" 1
637 1 41 MET ME 1 75 PHE H . . 4.150 4.007 3.768 4.171 0.021 9 0 "[ . 1 . 2]" 1
638 1 41 MET ME 1 75 PHE HA . . 3.460 3.292 3.136 3.463 0.003 10 0 "[ . 1 . 2]" 1
639 1 41 MET ME 1 75 PHE QD . . 3.020 2.614 2.275 2.959 . 0 0 "[ . 1 . 2]" 1
640 1 41 MET ME 1 75 PHE QE . . 4.150 3.207 2.687 3.669 . 0 0 "[ . 1 . 2]" 1
641 1 41 MET ME 1 78 MET HB2 . . 3.700 3.465 2.977 3.728 0.028 9 0 "[ . 1 . 2]" 1
642 1 41 MET ME 1 78 MET ME . . 3.880 3.828 3.626 3.933 0.053 4 0 "[ . 1 . 2]" 1
643 1 41 MET ME 1 78 MET HG3 . . 3.120 2.669 2.231 2.936 . 0 0 "[ . 1 . 2]" 1
644 1 41 MET HG2 1 49 ILE MD . . 3.700 3.306 3.251 3.342 . 0 0 "[ . 1 . 2]" 1
645 1 41 MET HG2 1 49 ILE HG13 . . 4.300 4.233 4.192 4.272 . 0 0 "[ . 1 . 2]" 1
646 1 41 MET HG2 1 71 LEU MD2 . . 3.460 2.774 2.682 2.895 . 0 0 "[ . 1 . 2]" 1
647 1 41 MET HG2 1 75 PHE QE . . 4.350 3.616 3.356 4.039 . 0 0 "[ . 1 . 2]" 1
648 1 41 MET HG3 1 49 ILE MD . . 3.560 1.930 1.893 1.962 . 0 0 "[ . 1 . 2]" 1
649 1 41 MET HG3 1 49 ILE HG12 . . 4.150 4.229 4.196 4.294 0.144 20 0 "[ . 1 . 2]" 1
650 1 41 MET HG3 1 49 ILE MG . . 3.700 3.758 3.720 3.805 0.105 12 0 "[ . 1 . 2]" 1
651 1 41 MET HG3 1 71 LEU MD2 . . 3.200 2.300 2.263 2.380 . 0 0 "[ . 1 . 2]" 1
652 1 41 MET HG3 1 75 PHE QD . . 4.150 4.085 3.972 4.176 0.026 20 0 "[ . 1 . 2]" 1
653 1 41 MET HG3 1 75 PHE QE . . 4.350 3.449 3.141 3.827 . 0 0 "[ . 1 . 2]" 1
654 1 42 ASP H 1 42 ASP HB2 . . 3.330 2.426 2.047 2.679 . 0 0 "[ . 1 . 2]" 1
655 1 42 ASP H 1 42 ASP HB3 . . 3.330 2.604 2.301 3.152 . 0 0 "[ . 1 . 2]" 1
656 1 42 ASP H 1 43 MET H . . 3.560 2.898 2.794 2.980 . 0 0 "[ . 1 . 2]" 1
657 1 42 ASP H 1 49 ILE HG13 . . 3.410 2.592 2.411 2.763 . 0 0 "[ . 1 . 2]" 1
658 1 42 ASP H 1 49 ILE MG . . 4.750 4.548 4.337 4.682 . 0 0 "[ . 1 . 2]" 1
659 1 42 ASP H 1 51 LEU MD1 . . 4.750 4.236 4.003 4.543 . 0 0 "[ . 1 . 2]" 1
660 1 42 ASP HB2 1 43 MET H . . 4.000 3.865 3.439 4.031 0.031 14 0 "[ . 1 . 2]" 1
661 1 42 ASP HB2 1 49 ILE HB . . 3.780 3.775 3.517 3.822 0.042 5 0 "[ . 1 . 2]" 1
662 1 42 ASP HB2 1 51 LEU HB2 . . 4.000 3.385 2.980 3.780 . 0 0 "[ . 1 . 2]" 1
663 1 42 ASP HB2 1 51 LEU MD1 . . 3.700 2.575 2.350 2.845 . 0 0 "[ . 1 . 2]" 1
664 1 42 ASP HB2 1 51 LEU HG . . 3.780 2.928 2.457 3.255 . 0 0 "[ . 1 . 2]" 1
665 1 42 ASP HB3 1 43 MET H . . 3.510 2.740 2.613 2.998 . 0 0 "[ . 1 . 2]" 1
666 1 42 ASP HB3 1 51 LEU HB2 . . 4.350 4.344 4.147 4.374 0.024 11 0 "[ . 1 . 2]" 1
667 1 42 ASP HB3 1 51 LEU MD1 . . 3.700 2.390 2.203 2.627 . 0 0 "[ . 1 . 2]" 1
668 1 42 ASP HB3 1 51 LEU HG . . 4.150 3.469 3.222 3.858 . 0 0 "[ . 1 . 2]" 1
669 1 43 MET H 1 43 MET HB2 . . 3.380 1.990 1.970 2.028 . 0 0 "[ . 1 . 2]" 1
670 1 43 MET H 1 43 MET HB3 . . 3.350 3.116 2.982 3.201 . 0 0 "[ . 1 . 2]" 1
671 1 43 MET H 1 43 MET ME . . 4.860 4.458 3.662 4.682 . 0 0 "[ . 1 . 2]" 1
672 1 43 MET H 1 43 MET HG2 . . 3.880 4.050 3.610 4.396 0.516 16 2 "[ . 1 - .+ 2]" 1
673 1 43 MET H 1 44 LEU H . . 3.490 2.628 2.511 2.739 . 0 0 "[ . 1 . 2]" 1
674 1 43 MET H 1 44 LEU HB2 . . 4.920 4.800 4.641 4.942 0.022 8 0 "[ . 1 . 2]" 1
675 1 43 MET H 1 44 LEU HG . . 4.510 4.505 4.396 4.537 0.027 20 0 "[ . 1 . 2]" 1
676 1 43 MET H 1 45 PHE H . . 4.990 4.409 3.999 4.727 . 0 0 "[ . 1 . 2]" 1
677 1 43 MET HA 1 43 MET HB3 . . 3.060 2.940 2.891 2.997 . 0 0 "[ . 1 . 2]" 1
678 1 43 MET HA 1 43 MET ME . . 4.000 4.012 3.919 4.127 0.127 8 0 "[ . 1 . 2]" 1
679 1 43 MET HA 1 43 MET HG2 . . 3.330 2.311 2.062 2.532 . 0 0 "[ . 1 . 2]" 1
680 1 43 MET HA 1 43 MET HG3 . . 3.560 2.929 2.441 3.492 . 0 0 "[ . 1 . 2]" 1
681 1 43 MET HB2 1 43 MET ME . . 4.150 2.936 1.944 3.147 . 0 0 "[ . 1 . 2]" 1
682 1 43 MET HB2 1 44 LEU H . . 4.000 3.262 3.046 3.467 . 0 0 "[ . 1 . 2]" 1
683 1 43 MET HB3 1 43 MET ME . . 3.020 1.949 1.875 2.321 . 0 0 "[ . 1 . 2]" 1
684 1 43 MET HB3 1 44 LEU H . . 3.780 2.911 2.567 3.350 . 0 0 "[ . 1 . 2]" 1
685 1 43 MET HB3 1 44 LEU MD2 . . 4.150 3.438 3.034 3.805 . 0 0 "[ . 1 . 2]" 1
686 1 43 MET ME 1 43 MET HG2 . . 3.880 2.900 2.394 3.380 . 0 0 "[ . 1 . 2]" 1
687 1 43 MET ME 1 44 LEU MD2 . . 3.620 3.006 2.576 3.564 . 0 0 "[ . 1 . 2]" 1
688 1 44 LEU H 1 44 LEU HB2 . . 3.460 2.374 2.327 2.429 . 0 0 "[ . 1 . 2]" 1
689 1 44 LEU H 1 44 LEU HB3 . . 3.620 3.560 3.539 3.601 . 0 0 "[ . 1 . 2]" 1
690 1 44 LEU H 1 44 LEU MD1 . . 4.350 3.676 3.497 3.832 . 0 0 "[ . 1 . 2]" 1
691 1 44 LEU H 1 44 LEU MD2 . . 3.880 3.564 3.267 3.864 . 0 0 "[ . 1 . 2]" 1
692 1 44 LEU H 1 44 LEU HG . . 3.510 2.530 2.302 2.828 . 0 0 "[ . 1 . 2]" 1
693 1 44 LEU H 1 45 PHE H . . 3.490 2.596 2.357 2.771 . 0 0 "[ . 1 . 2]" 1
694 1 44 LEU HA 1 44 LEU MD2 . . 2.930 2.043 1.956 2.227 . 0 0 "[ . 1 . 2]" 1
695 1 44 LEU HA 1 44 LEU HG . . 3.700 3.033 2.910 3.177 . 0 0 "[ . 1 . 2]" 1
696 1 44 LEU HA 1 45 PHE QD . . 4.890 4.753 4.415 4.905 0.015 11 0 "[ . 1 . 2]" 1
697 1 44 LEU HB2 1 44 LEU MD1 . . 3.260 2.266 2.140 2.393 . 0 0 "[ . 1 . 2]" 1
698 1 44 LEU HB2 1 45 PHE H . . 3.700 2.341 2.169 2.582 . 0 0 "[ . 1 . 2]" 1
699 1 44 LEU HB2 1 45 PHE QD . . 3.700 2.444 2.018 2.673 . 0 0 "[ . 1 . 2]" 1
700 1 44 LEU HB3 1 44 LEU MD1 . . 3.170 2.433 2.299 2.557 . 0 0 "[ . 1 . 2]" 1
701 1 44 LEU HB3 1 45 PHE H . . 3.780 3.321 3.085 3.555 . 0 0 "[ . 1 . 2]" 1
702 1 44 LEU HB3 1 45 PHE QD . . 3.700 3.120 2.800 3.337 . 0 0 "[ . 1 . 2]" 1
703 1 44 LEU HB3 1 45 PHE QE . . 4.000 3.254 2.905 3.546 . 0 0 "[ . 1 . 2]" 1
704 1 44 LEU MD1 1 45 PHE QD . . 3.880 3.515 3.249 3.671 . 0 0 "[ . 1 . 2]" 1
705 1 44 LEU MD1 1 45 PHE QE . . 3.700 3.052 2.645 3.504 . 0 0 "[ . 1 . 2]" 1
706 1 44 LEU MD1 1 108 PHE HA . . 3.620 3.568 3.398 3.633 0.013 3 0 "[ . 1 . 2]" 1
707 1 44 LEU MD1 1 108 PHE HB3 . . 4.150 3.476 3.199 3.782 . 0 0 "[ . 1 . 2]" 1
708 1 44 LEU MD1 1 108 PHE QD . . 3.560 2.187 1.939 2.525 . 0 0 "[ . 1 . 2]" 1
709 1 44 LEU MD2 1 45 PHE H . . 4.750 4.637 4.565 4.719 . 0 0 "[ . 1 . 2]" 1
710 1 45 PHE H 1 45 PHE HB2 . . 3.870 2.414 2.239 2.614 . 0 0 "[ . 1 . 2]" 1
711 1 45 PHE H 1 45 PHE HB3 . . 4.000 3.597 3.484 3.714 . 0 0 "[ . 1 . 2]" 1
712 1 45 PHE H 1 45 PHE QD . . 3.780 2.437 2.006 2.832 . 0 0 "[ . 1 . 2]" 1
713 1 45 PHE H 1 46 PRO HD2 . . 4.990 4.907 4.838 4.975 . 0 0 "[ . 1 . 2]" 1
714 1 45 PHE H 1 46 PRO HD3 . . 4.150 4.136 3.996 4.284 0.134 14 0 "[ . 1 . 2]" 1
715 1 45 PHE HA 1 45 PHE QD . . 3.260 3.015 2.850 3.203 . 0 0 "[ . 1 . 2]" 1
716 1 45 PHE HA 1 46 PRO HD2 . . 3.040 2.212 2.195 2.233 . 0 0 "[ . 1 . 2]" 1
717 1 45 PHE HA 1 46 PRO HD3 . . 3.150 2.066 2.023 2.124 . 0 0 "[ . 1 . 2]" 1
718 1 45 PHE HA 1 46 PRO QG . . 4.150 3.846 3.832 3.867 . 0 0 "[ . 1 . 2]" 1
719 1 45 PHE HB2 1 48 SER H . . 4.540 4.149 3.450 4.556 0.016 4 0 "[ . 1 . 2]" 1
720 1 45 PHE HB2 1 48 SER HB2 . . 4.150 3.224 3.069 3.356 . 0 0 "[ . 1 . 2]" 1
721 1 45 PHE HB2 1 48 SER HB3 . . 3.700 2.488 2.036 3.033 . 0 0 "[ . 1 . 2]" 1
722 1 45 PHE HB2 1 48 SER HG . . 3.620 2.515 2.180 3.021 . 0 0 "[ . 1 . 2]" 1
723 1 45 PHE HB2 1 49 ILE MD . . 3.880 3.772 3.391 3.908 0.028 6 0 "[ . 1 . 2]" 1
724 1 45 PHE HB3 1 48 SER H . . 4.580 4.236 3.452 4.607 0.027 9 0 "[ . 1 . 2]" 1
725 1 45 PHE HB3 1 48 SER HB2 . . 4.150 3.561 3.125 3.814 . 0 0 "[ . 1 . 2]" 1
726 1 45 PHE HB3 1 48 SER HB3 . . 3.700 2.212 1.994 2.429 . 0 0 "[ . 1 . 2]" 1
727 1 45 PHE HB3 1 78 MET ME . . 3.700 2.038 1.847 2.547 . 0 0 "[ . 1 . 2]" 1
728 1 45 PHE QD 1 48 SER HB3 . . 4.350 3.932 3.574 4.125 . 0 0 "[ . 1 . 2]" 1
729 1 45 PHE QD 1 78 MET ME . . 3.370 2.048 1.785 2.266 . 0 0 "[ . 1 . 2]" 1
730 1 45 PHE QD 1 78 MET HG3 . . 4.150 3.248 2.022 3.877 . 0 0 "[ . 1 . 2]" 1
731 1 45 PHE QE 1 78 MET ME . . 3.700 3.446 2.901 3.706 0.006 19 0 "[ . 1 . 2]" 1
732 1 46 PRO HB2 1 47 GLY H . . 4.150 3.785 3.456 3.997 . 0 0 "[ . 1 . 2]" 1
733 1 46 PRO HB3 1 47 GLY H . . 4.710 4.071 3.834 4.233 . 0 0 "[ . 1 . 2]" 1
734 1 46 PRO QG 1 47 GLY H . . 5.060 4.948 4.822 5.008 . 0 0 "[ . 1 . 2]" 1
735 1 47 GLY H 1 48 SER H . . 3.500 2.464 2.075 2.800 . 0 0 "[ . 1 . 2]" 1
736 1 47 GLY H 1 49 ILE H . . 4.440 3.606 2.933 4.236 . 0 0 "[ . 1 . 2]" 1
737 1 48 SER H 1 48 SER HB2 . . 3.740 3.639 3.532 3.721 . 0 0 "[ . 1 . 2]" 1
738 1 48 SER H 1 48 SER HB3 . . 3.620 2.867 2.356 3.370 . 0 0 "[ . 1 . 2]" 1
739 1 48 SER H 1 48 SER HG . . 3.320 2.244 1.918 3.340 0.020 17 0 "[ . 1 . 2]" 1
740 1 48 SER H 1 49 ILE H . . 3.430 2.148 1.842 2.785 . 0 0 "[ . 1 . 2]" 1
741 1 48 SER HA 1 48 SER HB2 . . 2.970 2.496 2.419 2.648 . 0 0 "[ . 1 . 2]" 1
742 1 48 SER HA 1 48 SER HB3 . . 3.000 2.448 2.324 2.522 . 0 0 "[ . 1 . 2]" 1
743 1 48 SER HA 1 77 ARG HD2 . . 3.510 3.371 3.099 3.531 0.021 9 0 "[ . 1 . 2]" 1
744 1 48 SER HA 1 77 ARG HD3 . . 3.880 3.702 2.563 3.896 0.016 12 0 "[ . 1 . 2]" 1
745 1 48 SER HB2 1 49 ILE H . . 4.410 3.919 3.622 4.100 . 0 0 "[ . 1 . 2]" 1
746 1 48 SER HB2 1 78 MET H . . 4.750 4.619 4.364 4.761 0.011 12 0 "[ . 1 . 2]" 1
747 1 48 SER HB2 1 78 MET ME . . 4.000 3.485 2.653 4.007 0.007 3 0 "[ . 1 . 2]" 1
748 1 48 SER HB2 1 78 MET HG2 . . 4.000 2.812 2.488 3.201 . 0 0 "[ . 1 . 2]" 1
749 1 48 SER HB2 1 78 MET HG3 . . 3.880 3.315 2.698 3.864 . 0 0 "[ . 1 . 2]" 1
750 1 48 SER HB3 1 49 ILE H . . 4.710 4.070 3.946 4.234 . 0 0 "[ . 1 . 2]" 1
751 1 48 SER HB3 1 78 MET ME . . 4.150 2.598 2.042 3.680 . 0 0 "[ . 1 . 2]" 1
752 1 48 SER HB3 1 78 MET HG2 . . 4.150 3.425 2.795 3.877 . 0 0 "[ . 1 . 2]" 1
753 1 48 SER HG 1 49 ILE H . . 4.310 2.692 2.085 3.459 . 0 0 "[ . 1 . 2]" 1
754 1 49 ILE H 1 49 ILE HB . . 3.490 2.998 2.861 3.096 . 0 0 "[ . 1 . 2]" 1
755 1 49 ILE H 1 49 ILE MD . . 3.700 3.117 2.985 3.305 . 0 0 "[ . 1 . 2]" 1
756 1 49 ILE H 1 49 ILE HG12 . . 3.620 1.936 1.890 1.952 . 0 0 "[ . 1 . 2]" 1
757 1 49 ILE H 1 49 ILE HG13 . . 3.550 3.530 3.463 3.565 0.015 9 0 "[ . 1 . 2]" 1
758 1 49 ILE H 1 49 ILE MG . . 3.820 3.844 3.825 3.856 0.036 8 0 "[ . 1 . 2]" 1
759 1 49 ILE HA 1 49 ILE MD . . 3.260 2.427 2.346 2.502 . 0 0 "[ . 1 . 2]" 1
760 1 49 ILE HA 1 49 ILE MG . . 3.150 1.998 1.974 2.023 . 0 0 "[ . 1 . 2]" 1
761 1 49 ILE HA 1 50 ALA H . . 3.200 2.781 2.683 2.891 . 0 0 "[ . 1 . 2]" 1
762 1 49 ILE HA 1 70 ILE MG . . 3.780 3.356 3.176 3.497 . 0 0 "[ . 1 . 2]" 1
763 1 49 ILE HB 1 49 ILE MD . . 3.260 3.198 3.190 3.202 . 0 0 "[ . 1 . 2]" 1
764 1 49 ILE HB 1 50 ALA H . . 3.620 2.475 2.318 2.645 . 0 0 "[ . 1 . 2]" 1
765 1 49 ILE MD 1 71 LEU MD2 . . 3.230 2.288 2.198 2.370 . 0 0 "[ . 1 . 2]" 1
766 1 49 ILE MD 1 74 GLY H . . 4.000 3.257 2.694 3.482 . 0 0 "[ . 1 . 2]" 1
767 1 49 ILE MD 1 74 GLY HA2 . . 3.780 2.352 2.038 2.608 . 0 0 "[ . 1 . 2]" 1
768 1 49 ILE MD 1 74 GLY HA3 . . 3.700 1.879 1.825 1.951 . 0 0 "[ . 1 . 2]" 1
769 1 49 ILE HG12 1 49 ILE MG . . 3.170 3.225 3.216 3.229 0.059 14 0 "[ . 1 . 2]" 1
770 1 49 ILE HG12 1 50 ALA H . . 4.990 4.644 4.546 4.747 . 0 0 "[ . 1 . 2]" 1
771 1 49 ILE HG13 1 50 ALA H . . 4.920 4.628 4.476 4.780 . 0 0 "[ . 1 . 2]" 1
772 1 49 ILE MG 1 50 ALA H . . 3.510 1.947 1.850 2.111 . 0 0 "[ . 1 . 2]" 1
773 1 49 ILE MG 1 51 LEU H . . 4.310 4.111 3.783 4.309 . 0 0 "[ . 1 . 2]" 1
774 1 49 ILE MG 1 74 GLY H . . 3.880 3.293 2.763 3.411 . 0 0 "[ . 1 . 2]" 1
775 1 49 ILE MG 1 74 GLY HA2 . . 3.700 3.742 3.695 3.781 0.081 20 0 "[ . 1 . 2]" 1
776 1 49 ILE MG 1 74 GLY HA3 . . 3.460 3.210 3.100 3.361 . 0 0 "[ . 1 . 2]" 1
777 1 50 ALA H 1 50 ALA MB . . 2.950 2.418 2.311 2.551 . 0 0 "[ . 1 . 2]" 1
778 1 50 ALA H 1 70 ILE MG . . 3.640 2.323 2.075 2.544 . 0 0 "[ . 1 . 2]" 1
779 1 50 ALA HA 1 51 LEU H . . 3.160 2.568 2.501 2.653 . 0 0 "[ . 1 . 2]" 1
780 1 50 ALA MB 1 51 LEU H . . 4.000 3.788 3.779 3.792 . 0 0 "[ . 1 . 2]" 1
781 1 50 ALA MB 1 52 LYS H . . 4.440 3.514 3.429 3.615 . 0 0 "[ . 1 . 2]" 1
782 1 50 ALA MB 1 53 LYS H . . 3.700 3.717 3.655 3.746 0.046 10 0 "[ . 1 . 2]" 1
783 1 50 ALA MB 1 53 LYS HB2 . . 3.330 2.079 1.971 2.191 . 0 0 "[ . 1 . 2]" 1
784 1 50 ALA MB 1 53 LYS HB3 . . 3.290 2.266 2.120 2.474 . 0 0 "[ . 1 . 2]" 1
785 1 50 ALA MB 1 53 LYS QD . . 3.330 3.061 2.850 3.332 0.002 4 0 "[ . 1 . 2]" 1
786 1 50 ALA MB 1 53 LYS QE . . 3.150 2.439 1.879 2.779 . 0 0 "[ . 1 . 2]" 1
787 1 50 ALA MB 1 54 VAL H . . 4.810 3.536 3.439 3.613 . 0 0 "[ . 1 . 2]" 1
788 1 50 ALA MB 1 70 ILE MG . . 3.260 2.056 1.778 2.239 . 0 0 "[ . 1 . 2]" 1
789 1 51 LEU H 1 51 LEU HB2 . . 3.170 1.997 1.985 2.013 . 0 0 "[ . 1 . 2]" 1
790 1 51 LEU H 1 51 LEU HB3 . . 3.260 3.251 3.177 3.301 0.041 12 0 "[ . 1 . 2]" 1
791 1 51 LEU H 1 51 LEU MD1 . . 4.000 4.040 3.993 4.076 0.076 20 0 "[ . 1 . 2]" 1
792 1 51 LEU H 1 51 LEU MD2 . . 4.000 3.986 3.923 4.055 0.055 17 0 "[ . 1 . 2]" 1
793 1 51 LEU H 1 51 LEU HG . . 3.620 3.406 3.286 3.567 . 0 0 "[ . 1 . 2]" 1
794 1 51 LEU H 1 52 LYS H . . 3.700 2.822 2.745 2.893 . 0 0 "[ . 1 . 2]" 1
795 1 51 LEU HA 1 51 LEU MD2 . . 2.890 2.063 1.992 2.134 . 0 0 "[ . 1 . 2]" 1
796 1 51 LEU HA 1 51 LEU HG . . 3.100 2.644 2.572 2.697 . 0 0 "[ . 1 . 2]" 1
797 1 51 LEU HA 1 53 LYS H . . 4.150 3.466 3.399 3.530 . 0 0 "[ . 1 . 2]" 1
798 1 51 LEU HA 1 54 VAL H . . 4.000 3.337 3.274 3.396 . 0 0 "[ . 1 . 2]" 1
799 1 51 LEU HA 1 54 VAL HB . . 4.150 3.597 3.513 3.706 . 0 0 "[ . 1 . 2]" 1
800 1 51 LEU HA 1 54 VAL MG1 . . 2.650 1.975 1.868 2.157 . 0 0 "[ . 1 . 2]" 1
801 1 51 LEU HB2 1 51 LEU MD1 . . 3.120 2.460 2.405 2.506 . 0 0 "[ . 1 . 2]" 1
802 1 51 LEU HB2 1 51 LEU MD2 . . 3.040 3.203 3.200 3.212 0.172 17 0 "[ . 1 . 2]" 1
803 1 51 LEU HB2 1 52 LYS H . . 4.150 3.515 3.456 3.606 . 0 0 "[ . 1 . 2]" 1
804 1 51 LEU HB3 1 51 LEU MD1 . . 3.020 2.261 2.196 2.339 . 0 0 "[ . 1 . 2]" 1
805 1 51 LEU HB3 1 52 LYS H . . 3.880 3.403 3.295 3.551 . 0 0 "[ . 1 . 2]" 1
806 1 51 LEU MD1 1 56 PHE HZ . . 3.460 3.463 3.361 3.528 0.068 10 0 "[ . 1 . 2]" 1
807 1 51 LEU MD2 1 53 LYS H . . 4.350 4.157 3.941 4.217 . 0 0 "[ . 1 . 2]" 1
808 1 51 LEU MD2 1 54 VAL MG2 . . 4.150 3.567 3.403 3.747 . 0 0 "[ . 1 . 2]" 1
809 1 51 LEU MD2 1 56 PHE QE . . 3.620 2.334 2.174 2.430 . 0 0 "[ . 1 . 2]" 1
810 1 51 LEU MD2 1 56 PHE HZ . . 3.230 1.886 1.766 2.109 . 0 0 "[ . 1 . 2]" 1
811 1 51 LEU HG 1 56 PHE HZ . . 3.880 3.686 3.394 3.877 . 0 0 "[ . 1 . 2]" 1
812 1 52 LYS H 1 52 LYS QB . . 2.990 2.263 2.111 2.453 . 0 0 "[ . 1 . 2]" 1
813 1 52 LYS H 1 52 LYS QG . . 3.470 3.016 2.436 3.480 0.010 17 0 "[ . 1 . 2]" 1
814 1 52 LYS H 1 53 LYS H . . 3.530 3.170 3.101 3.245 . 0 0 "[ . 1 . 2]" 1
815 1 52 LYS H 1 54 VAL H . . 4.990 4.364 4.293 4.444 . 0 0 "[ . 1 . 2]" 1
816 1 52 LYS H 1 54 VAL MG1 . . 4.540 4.217 4.125 4.394 . 0 0 "[ . 1 . 2]" 1
817 1 52 LYS HA 1 52 LYS QB . . 2.690 2.370 2.159 2.544 . 0 0 "[ . 1 . 2]" 1
818 1 52 LYS HA 1 52 LYS HD2 . . 3.780 3.497 1.991 4.053 0.273 6 0 "[ . 1 . 2]" 1
819 1 52 LYS HA 1 52 LYS QG . . 3.260 2.712 2.027 3.362 0.102 9 0 "[ . 1 . 2]" 1
820 1 52 LYS HA 1 54 VAL MG1 . . 4.150 4.198 4.166 4.238 0.088 14 0 "[ . 1 . 2]" 1
821 1 52 LYS HD2 1 52 LYS QE . . 2.520 2.322 2.184 2.539 0.019 3 0 "[ . 1 . 2]" 1
822 1 52 LYS QE 1 53 LYS HA . . 4.150 4.056 3.917 4.150 0.000 8 0 "[ . 1 . 2]" 1
823 1 53 LYS H 1 53 LYS HB2 . . 3.170 3.140 3.076 3.204 0.034 13 0 "[ . 1 . 2]" 1
824 1 53 LYS H 1 53 LYS HB3 . . 3.620 3.294 3.238 3.359 . 0 0 "[ . 1 . 2]" 1
825 1 53 LYS H 1 54 VAL H . . 3.180 1.893 1.877 1.921 . 0 0 "[ . 1 . 2]" 1
826 1 53 LYS H 1 54 VAL MG1 . . 3.780 2.458 2.407 2.563 . 0 0 "[ . 1 . 2]" 1
827 1 53 LYS HA 1 53 LYS HG2 . . 3.510 2.829 2.376 2.986 . 0 0 "[ . 1 . 2]" 1
828 1 53 LYS HA 1 53 LYS HG3 . . 3.200 2.194 2.068 2.564 . 0 0 "[ . 1 . 2]" 1
829 1 53 LYS HB2 1 53 LYS QD . . 3.620 2.402 2.190 3.166 . 0 0 "[ . 1 . 2]" 1
830 1 53 LYS HB2 1 53 LYS QE . . 4.000 2.782 2.206 3.132 . 0 0 "[ . 1 . 2]" 1
831 1 53 LYS HB2 1 70 ILE MD . . 3.560 3.381 3.228 3.562 0.002 8 0 "[ . 1 . 2]" 1
832 1 53 LYS HB3 1 53 LYS QD . . 3.620 2.942 2.355 3.153 . 0 0 "[ . 1 . 2]" 1
833 1 53 LYS HB3 1 70 ILE MD . . 3.150 1.940 1.812 2.142 . 0 0 "[ . 1 . 2]" 1
834 1 53 LYS HB3 1 70 ILE MG . . 4.150 3.151 2.816 3.361 . 0 0 "[ . 1 . 2]" 1
835 1 53 LYS QD 1 53 LYS QE . . 2.470 2.100 2.052 2.136 . 0 0 "[ . 1 . 2]" 1
836 1 53 LYS QE 1 53 LYS HG3 . . 3.780 3.226 2.319 3.507 . 0 0 "[ . 1 . 2]" 1
837 1 53 LYS QE 1 70 ILE MG . . 2.980 2.932 2.764 2.999 0.019 19 0 "[ . 1 . 2]" 1
838 1 53 LYS HG2 1 54 VAL H . . 4.810 4.585 4.482 4.715 . 0 0 "[ . 1 . 2]" 1
839 1 53 LYS HG2 1 70 ILE MD . . 3.880 2.460 2.091 2.878 . 0 0 "[ . 1 . 2]" 1
840 1 54 VAL H 1 54 VAL HB . . 2.980 2.433 2.368 2.456 . 0 0 "[ . 1 . 2]" 1
841 1 54 VAL H 1 54 VAL MG1 . . 2.980 1.930 1.904 2.041 . 0 0 "[ . 1 . 2]" 1
842 1 54 VAL H 1 54 VAL MG2 . . 3.620 3.702 3.694 3.705 0.085 10 0 "[ . 1 . 2]" 1
843 1 54 VAL H 1 55 LYS H . . 4.920 4.670 4.660 4.674 . 0 0 "[ . 1 . 2]" 1
844 1 54 VAL H 1 70 ILE MD . . 4.000 2.851 2.575 3.157 . 0 0 "[ . 1 . 2]" 1
845 1 54 VAL HA 1 54 VAL MG1 . . 3.150 3.212 3.205 3.218 0.068 3 0 "[ . 1 . 2]" 1
846 1 54 VAL HA 1 54 VAL MG2 . . 2.930 2.388 2.268 2.457 . 0 0 "[ . 1 . 2]" 1
847 1 54 VAL HA 1 55 LYS H . . 2.760 2.358 2.297 2.445 . 0 0 "[ . 1 . 2]" 1
848 1 54 VAL HA 1 55 LYS HB2 . . 4.400 4.291 4.211 4.345 . 0 0 "[ . 1 . 2]" 1
849 1 54 VAL HA 1 55 LYS QG . . 4.150 4.041 3.897 4.159 0.009 12 0 "[ . 1 . 2]" 1
850 1 54 VAL HA 1 67 ASN HA . . 4.150 2.965 2.585 3.185 . 0 0 "[ . 1 . 2]" 1
851 1 54 VAL HA 1 70 ILE MD . . 3.260 2.312 2.152 2.463 . 0 0 "[ . 1 . 2]" 1
852 1 54 VAL HB 1 56 PHE QE . . 3.460 3.509 3.480 3.550 0.090 19 0 "[ . 1 . 2]" 1
853 1 54 VAL HB 1 70 ILE MD . . 3.120 3.085 2.880 3.154 0.034 14 0 "[ . 1 . 2]" 1
854 1 54 VAL MG1 1 55 LYS H . . 4.000 3.795 3.659 3.916 . 0 0 "[ . 1 . 2]" 1
855 1 54 VAL MG1 1 56 PHE QE . . 3.460 1.825 1.782 1.868 . 0 0 "[ . 1 . 2]" 1
856 1 54 VAL MG2 1 55 LYS H . . 3.260 2.091 1.915 2.307 . 0 0 "[ . 1 . 2]" 1
857 1 54 VAL MG2 1 56 PHE H . . 4.510 3.687 3.258 3.978 . 0 0 "[ . 1 . 2]" 1
858 1 54 VAL MG2 1 56 PHE HA . . 3.780 3.589 3.413 3.720 . 0 0 "[ . 1 . 2]" 1
859 1 54 VAL MG2 1 56 PHE QE . . 3.510 1.935 1.899 1.995 . 0 0 "[ . 1 . 2]" 1
860 1 54 VAL MG2 1 56 PHE HZ . . 4.000 3.994 3.902 4.080 0.080 3 0 "[ . 1 . 2]" 1
861 1 55 LYS H 1 55 LYS HB2 . . 3.500 2.339 2.274 2.405 . 0 0 "[ . 1 . 2]" 1
862 1 55 LYS H 1 55 LYS HB3 . . 3.560 3.536 3.499 3.581 0.021 15 0 "[ . 1 . 2]" 1
863 1 55 LYS H 1 55 LYS QG . . 3.700 3.214 3.097 3.395 . 0 0 "[ . 1 . 2]" 1
864 1 55 LYS H 1 67 ASN HD21 . . 4.710 3.591 3.192 3.914 . 0 0 "[ . 1 . 2]" 1
865 1 55 LYS H 1 67 ASN HD22 . . 4.000 3.316 2.894 3.774 . 0 0 "[ . 1 . 2]" 1
866 1 55 LYS H 1 70 ILE MD . . 4.150 4.047 3.810 4.190 0.040 2 0 "[ . 1 . 2]" 1
867 1 55 LYS HA 1 55 LYS QD . . 3.510 2.671 2.164 3.436 . 0 0 "[ . 1 . 2]" 1
868 1 55 LYS HA 1 55 LYS QE . . 4.150 3.251 2.251 4.019 . 0 0 "[ . 1 . 2]" 1
869 1 55 LYS HA 1 55 LYS QG . . 3.510 2.295 2.056 2.425 . 0 0 "[ . 1 . 2]" 1
870 1 55 LYS HA 1 56 PHE H . . 2.980 2.232 2.199 2.298 . 0 0 "[ . 1 . 2]" 1
871 1 55 LYS HA 1 56 PHE HA . . 4.350 4.418 4.388 4.473 0.123 13 0 "[ . 1 . 2]" 1
872 1 55 LYS HB2 1 67 ASN HD22 . . 4.150 2.617 2.099 2.993 . 0 0 "[ . 1 . 2]" 1
873 1 55 LYS HB3 1 56 PHE H . . 4.360 4.021 3.907 4.187 . 0 0 "[ . 1 . 2]" 1
874 1 55 LYS HB3 1 58 ALA H . . 4.150 3.353 2.936 3.767 . 0 0 "[ . 1 . 2]" 1
875 1 55 LYS HB3 1 58 ALA HA . . 3.410 3.448 3.425 3.475 0.065 2 0 "[ . 1 . 2]" 1
876 1 55 LYS HB3 1 67 ASN HD21 . . 4.710 4.579 4.260 4.728 0.018 12 0 "[ . 1 . 2]" 1
877 1 55 LYS HB3 1 67 ASN HD22 . . 4.000 3.027 2.625 3.261 . 0 0 "[ . 1 . 2]" 1
878 1 55 LYS QD 1 58 ALA HA . . 3.880 3.640 3.293 3.859 . 0 0 "[ . 1 . 2]" 1
879 1 55 LYS QE 1 55 LYS QG . . 2.900 2.112 1.980 2.348 . 0 0 "[ . 1 . 2]" 1
880 1 55 LYS QG 1 56 PHE H . . 4.710 4.372 4.094 4.520 . 0 0 "[ . 1 . 2]" 1
881 1 56 PHE H 1 56 PHE HB2 . . 3.370 2.075 2.031 2.136 . 0 0 "[ . 1 . 2]" 1
882 1 56 PHE H 1 56 PHE HB3 . . 3.700 3.393 3.355 3.423 . 0 0 "[ . 1 . 2]" 1
883 1 56 PHE H 1 56 PHE QD . . 3.620 2.566 2.267 2.732 . 0 0 "[ . 1 . 2]" 1
884 1 56 PHE H 1 57 GLN H . . 3.910 2.725 2.371 3.155 . 0 0 "[ . 1 . 2]" 1
885 1 56 PHE HA 1 56 PHE QD . . 3.460 2.398 2.117 2.681 . 0 0 "[ . 1 . 2]" 1
886 1 56 PHE HB2 1 57 GLN H . . 4.750 3.438 2.643 4.268 . 0 0 "[ . 1 . 2]" 1
887 1 56 PHE HB3 1 57 GLN H . . 4.920 3.933 3.322 4.394 . 0 0 "[ . 1 . 2]" 1
888 1 56 PHE HB3 1 57 GLN QG . . 4.150 3.978 3.467 4.267 0.117 6 0 "[ . 1 . 2]" 1
889 1 57 GLN H 1 57 GLN HB2 . . 4.130 2.770 2.144 3.890 . 0 0 "[ . 1 . 2]" 1
890 1 57 GLN H 1 57 GLN HB3 . . 4.190 3.527 3.280 3.736 . 0 0 "[ . 1 . 2]" 1
891 1 57 GLN H 1 57 GLN QG . . 4.150 3.315 2.237 4.108 . 0 0 "[ . 1 . 2]" 1
892 1 57 GLN H 1 58 ALA H . . 4.170 2.515 1.879 3.253 . 0 0 "[ . 1 . 2]" 1
893 1 57 GLN HA 1 57 GLN QG . . 3.170 2.382 2.031 3.295 0.125 1 0 "[ . 1 . 2]" 1
894 1 58 ALA H 1 58 ALA MB . . 2.700 2.051 1.957 2.193 . 0 0 "[ . 1 . 2]" 1
895 1 58 ALA H 1 59 LYS H . . 4.860 4.563 4.527 4.605 . 0 0 "[ . 1 . 2]" 1
896 1 58 ALA HA 1 59 LYS H . . 2.740 2.209 2.193 2.233 . 0 0 "[ . 1 . 2]" 1
897 1 58 ALA HA 1 60 LEU H . . 3.620 3.585 3.360 3.717 0.097 8 0 "[ . 1 . 2]" 1
898 1 58 ALA HA 1 64 TYR QE . . 4.350 4.208 4.067 4.290 . 0 0 "[ . 1 . 2]" 1
899 1 58 ALA MB 1 59 LYS H . . 3.410 3.186 3.061 3.275 . 0 0 "[ . 1 . 2]" 1
900 1 58 ALA MB 1 63 GLU HB2 . . 3.170 1.924 1.877 1.950 . 0 0 "[ . 1 . 2]" 1
901 1 58 ALA MB 1 63 GLU HB3 . . 2.790 2.029 1.923 2.377 . 0 0 "[ . 1 . 2]" 1
902 1 58 ALA MB 1 63 GLU HG2 . . 4.000 4.075 3.992 4.149 0.149 20 0 "[ . 1 . 2]" 1
903 1 58 ALA MB 1 63 GLU HG3 . . 4.000 3.204 3.013 3.295 . 0 0 "[ . 1 . 2]" 1
904 1 58 ALA MB 1 64 TYR H . . 4.410 3.227 2.990 3.394 . 0 0 "[ . 1 . 2]" 1
905 1 58 ALA MB 1 64 TYR QD . . 3.120 2.213 2.070 2.376 . 0 0 "[ . 1 . 2]" 1
906 1 58 ALA MB 1 64 TYR QE . . 3.000 2.266 1.977 2.632 . 0 0 "[ . 1 . 2]" 1
907 1 58 ALA MB 1 67 ASN HD21 . . 4.510 3.243 2.987 3.588 . 0 0 "[ . 1 . 2]" 1
908 1 58 ALA MB 1 67 ASN HD22 . . 3.460 1.981 1.787 2.314 . 0 0 "[ . 1 . 2]" 1
909 1 59 LYS H 1 59 LYS HB2 . . 3.880 2.574 2.327 3.273 . 0 0 "[ . 1 . 2]" 1
910 1 59 LYS H 1 59 LYS HB3 . . 3.670 3.221 2.395 3.681 0.011 18 0 "[ . 1 . 2]" 1
911 1 59 LYS H 1 59 LYS QG . . 3.780 3.591 2.815 3.815 0.035 1 0 "[ . 1 . 2]" 1
912 1 59 LYS H 1 60 LEU H . . 2.990 1.901 1.831 2.037 . 0 0 "[ . 1 . 2]" 1
913 1 59 LYS HA 1 59 LYS QG . . 3.460 2.225 1.964 2.624 . 0 0 "[ . 1 . 2]" 1
914 1 59 LYS HB2 1 59 LYS QE . . 3.700 2.874 2.006 3.689 . 0 0 "[ . 1 . 2]" 1
915 1 59 LYS HB2 1 60 LEU H . . 4.240 3.616 2.988 4.287 0.047 1 0 "[ . 1 . 2]" 1
916 1 59 LYS HB2 1 60 LEU QD . . 3.880 2.918 2.024 3.860 . 0 0 "[ . 1 . 2]" 1
917 1 59 LYS HB3 1 60 LEU H . . 3.770 3.626 3.059 4.201 0.431 5 0 "[ . 1 . 2]" 1
918 1 59 LYS HB3 1 60 LEU QD . . 3.780 2.418 2.164 3.010 . 0 0 "[ . 1 . 2]" 1
919 1 59 LYS HD2 1 59 LYS QG . . 2.520 2.332 2.180 2.559 0.039 14 0 "[ . 1 . 2]" 1
920 1 59 LYS QE 1 60 LEU QD . . 4.150 3.590 3.097 4.095 . 0 0 "[ . 1 . 2]" 1
921 1 59 LYS QG 1 60 LEU QD . . 4.150 3.542 1.988 4.114 . 0 0 "[ . 1 . 2]" 1
922 1 60 LEU H 1 60 LEU QB . . 3.510 2.658 2.614 2.743 . 0 0 "[ . 1 . 2]" 1
923 1 60 LEU H 1 60 LEU QD . . 3.880 2.315 1.770 3.171 . 0 0 "[ . 1 . 2]" 1
924 1 60 LEU H 1 60 LEU HG . . 3.560 3.141 2.265 3.729 0.169 16 0 "[ . 1 . 2]" 1
925 1 60 LEU H 1 63 GLU H . . 4.380 4.311 4.071 4.434 0.054 7 0 "[ . 1 . 2]" 1
926 1 60 LEU H 1 63 GLU HB2 . . 3.920 3.461 3.087 3.694 . 0 0 "[ . 1 . 2]" 1
927 1 60 LEU H 1 63 GLU HG3 . . 4.150 2.296 2.064 2.531 . 0 0 "[ . 1 . 2]" 1
928 1 60 LEU H 1 64 TYR QE . . 4.620 3.943 3.576 4.223 . 0 0 "[ . 1 . 2]" 1
929 1 60 LEU HA 1 60 LEU QD . . 2.800 2.011 1.950 2.184 . 0 0 "[ . 1 . 2]" 1
930 1 60 LEU HA 1 60 LEU HG . . 3.700 3.559 3.387 3.644 . 0 0 "[ . 1 . 2]" 1
931 1 60 LEU HA 1 61 GLU H . . 3.240 2.423 2.360 2.509 . 0 0 "[ . 1 . 2]" 1
932 1 60 LEU HA 1 62 HIS H . . 4.810 4.638 4.419 4.761 . 0 0 "[ . 1 . 2]" 1
933 1 60 LEU QB 1 60 LEU QD . . 2.900 1.935 1.903 1.955 . 0 0 "[ . 1 . 2]" 1
934 1 60 LEU QB 1 61 GLU H . . 3.850 2.599 2.456 2.723 . 0 0 "[ . 1 . 2]" 1
935 1 60 LEU QB 1 62 HIS H . . 4.000 3.250 2.943 3.364 . 0 0 "[ . 1 . 2]" 1
936 1 60 LEU QB 1 62 HIS HD2 . . 4.150 2.174 1.844 3.948 . 0 0 "[ . 1 . 2]" 1
937 1 60 LEU QB 1 62 HIS HE1 . . 4.350 3.748 2.316 4.146 . 0 0 "[ . 1 . 2]" 1
938 1 60 LEU QB 1 63 GLU H . . 4.130 2.741 2.655 2.837 . 0 0 "[ . 1 . 2]" 1
939 1 60 LEU QB 1 63 GLU HG2 . . 4.000 2.415 2.371 2.512 . 0 0 "[ . 1 . 2]" 1
940 1 60 LEU QB 1 63 GLU HG3 . . 3.700 2.012 1.966 2.133 . 0 0 "[ . 1 . 2]" 1
941 1 60 LEU QD 1 61 GLU H . . 3.880 3.760 3.619 3.843 . 0 0 "[ . 1 . 2]" 1
942 1 60 LEU QD 1 62 HIS HD2 . . 3.880 3.143 2.550 3.878 . 0 0 "[ . 1 . 2]" 1
943 1 60 LEU QD 1 62 HIS HE1 . . 3.200 3.109 2.611 3.210 0.010 20 0 "[ . 1 . 2]" 1
944 1 61 GLU H 1 61 GLU HB2 . . 3.490 2.059 2.027 2.137 . 0 0 "[ . 1 . 2]" 1
945 1 61 GLU H 1 61 GLU HB3 . . 3.560 3.150 3.065 3.212 . 0 0 "[ . 1 . 2]" 1
946 1 61 GLU H 1 61 GLU QG . . 4.150 3.618 3.443 3.965 . 0 0 "[ . 1 . 2]" 1
947 1 61 GLU H 1 62 HIS H . . 4.060 2.651 2.392 2.760 . 0 0 "[ . 1 . 2]" 1
948 1 61 GLU HA 1 61 GLU QG . . 3.080 2.082 2.002 2.245 . 0 0 "[ . 1 . 2]" 1
949 1 61 GLU HA 1 64 TYR H . . 3.780 3.168 3.082 3.319 . 0 0 "[ . 1 . 2]" 1
950 1 61 GLU HA 1 64 TYR HB2 . . 4.000 3.122 3.015 3.321 . 0 0 "[ . 1 . 2]" 1
951 1 61 GLU HA 1 64 TYR QD . . 3.200 2.524 2.370 2.678 . 0 0 "[ . 1 . 2]" 1
952 1 61 GLU HA 1 64 TYR QE . . 4.150 3.133 2.920 3.291 . 0 0 "[ . 1 . 2]" 1
953 1 61 GLU HA 1 90 VAL HB . . 4.000 3.778 3.633 3.932 . 0 0 "[ . 1 . 2]" 1
954 1 61 GLU HB2 1 62 HIS H . . 4.100 3.111 2.999 3.374 . 0 0 "[ . 1 . 2]" 1
955 1 61 GLU HB3 1 62 HIS H . . 3.550 2.662 2.512 2.925 . 0 0 "[ . 1 . 2]" 1
956 1 61 GLU HB3 1 90 VAL HB . . 4.000 4.018 3.951 4.039 0.039 13 0 "[ . 1 . 2]" 1
957 1 61 GLU QG 1 62 HIS H . . 4.350 4.304 4.213 4.425 0.075 16 0 "[ . 1 . 2]" 1
958 1 61 GLU QG 1 64 TYR QD . . 4.000 2.210 1.992 2.384 . 0 0 "[ . 1 . 2]" 1
959 1 61 GLU QG 1 65 ILE MD . . 3.260 3.256 3.158 3.279 0.019 16 0 "[ . 1 . 2]" 1
960 1 61 GLU QG 1 90 VAL HA . . 4.150 3.479 3.140 3.661 . 0 0 "[ . 1 . 2]" 1
961 1 61 GLU QG 1 90 VAL HB . . 3.780 2.401 2.184 2.664 . 0 0 "[ . 1 . 2]" 1
962 1 61 GLU QG 1 90 VAL MG1 . . 4.000 3.879 3.680 4.025 0.025 13 0 "[ . 1 . 2]" 1
963 1 61 GLU QG 1 90 VAL MG2 . . 3.100 2.990 2.789 3.124 0.024 7 0 "[ . 1 . 2]" 1
964 1 62 HIS H 1 62 HIS HB2 . . 3.460 3.529 3.521 3.540 0.080 17 0 "[ . 1 . 2]" 1
965 1 62 HIS H 1 62 HIS HB3 . . 3.620 2.333 2.293 2.454 . 0 0 "[ . 1 . 2]" 1
966 1 62 HIS H 1 62 HIS HD2 . . 4.350 2.806 2.365 4.510 0.160 11 0 "[ . 1 . 2]" 1
967 1 62 HIS H 1 63 GLU H . . 3.670 2.913 2.738 2.972 . 0 0 "[ . 1 . 2]" 1
968 1 62 HIS H 1 64 TYR H . . 4.860 4.725 4.612 4.839 . 0 0 "[ . 1 . 2]" 1
969 1 62 HIS H 1 65 ILE MD . . 4.280 3.713 3.431 3.862 . 0 0 "[ . 1 . 2]" 1
970 1 62 HIS HA 1 62 HIS HB3 . . 3.000 2.469 2.423 2.489 . 0 0 "[ . 1 . 2]" 1
971 1 62 HIS HA 1 65 ILE H . . 4.120 3.772 3.619 3.905 . 0 0 "[ . 1 . 2]" 1
972 1 62 HIS HA 1 65 ILE HB . . 3.510 3.201 3.017 3.470 . 0 0 "[ . 1 . 2]" 1
973 1 62 HIS HA 1 65 ILE MD . . 3.020 1.972 1.888 2.040 . 0 0 "[ . 1 . 2]" 1
974 1 62 HIS HB2 1 62 HIS HD2 . . 4.000 3.810 2.915 3.985 . 0 0 "[ . 1 . 2]" 1
975 1 62 HIS HB2 1 63 GLU H . . 4.750 4.030 3.944 4.102 . 0 0 "[ . 1 . 2]" 1
976 1 62 HIS HB2 1 63 GLU HG2 . . 4.570 4.553 4.466 4.614 0.044 15 0 "[ . 1 . 2]" 1
977 1 62 HIS HB2 1 65 ILE MD . . 4.150 3.943 3.772 4.090 . 0 0 "[ . 1 . 2]" 1
978 1 62 HIS HB3 1 62 HIS HD2 . . 3.780 3.083 2.883 3.969 0.189 16 0 "[ . 1 . 2]" 1
979 1 62 HIS HB3 1 65 ILE MD . . 4.150 4.057 3.856 4.142 . 0 0 "[ . 1 . 2]" 1
980 1 62 HIS HD2 1 63 GLU HG2 . . 4.350 3.289 2.310 3.551 . 0 0 "[ . 1 . 2]" 1
981 1 62 HIS HD2 1 63 GLU HG3 . . 4.000 4.037 4.008 4.069 0.069 10 0 "[ . 1 . 2]" 1
982 1 62 HIS HE1 1 63 GLU HG3 . . 4.150 4.191 4.119 4.265 0.115 17 0 "[ . 1 . 2]" 1
983 1 63 GLU H 1 63 GLU HB2 . . 3.620 2.650 2.595 2.701 . 0 0 "[ . 1 . 2]" 1
984 1 63 GLU H 1 63 GLU HB3 . . 3.780 3.549 3.538 3.571 . 0 0 "[ . 1 . 2]" 1
985 1 63 GLU H 1 63 GLU HG2 . . 3.890 1.993 1.933 2.220 . 0 0 "[ . 1 . 2]" 1
986 1 63 GLU H 1 63 GLU HG3 . . 3.580 2.714 2.596 2.880 . 0 0 "[ . 1 . 2]" 1
987 1 63 GLU H 1 64 TYR H . . 3.050 2.783 2.643 2.946 . 0 0 "[ . 1 . 2]" 1
988 1 63 GLU H 1 65 ILE MD . . 4.710 4.191 3.862 4.533 . 0 0 "[ . 1 . 2]" 1
989 1 63 GLU HA 1 63 GLU HG2 . . 3.230 2.649 2.581 2.690 . 0 0 "[ . 1 . 2]" 1
990 1 63 GLU HA 1 63 GLU HG3 . . 3.780 3.797 3.753 3.822 0.042 6 0 "[ . 1 . 2]" 1
991 1 63 GLU HB2 1 64 TYR H . . 3.770 2.282 2.181 2.391 . 0 0 "[ . 1 . 2]" 1
992 1 63 GLU HG2 1 64 TYR H . . 4.240 4.198 4.147 4.281 0.041 16 0 "[ . 1 . 2]" 1
993 1 63 GLU HG3 1 64 TYR H . . 4.150 4.105 3.934 4.195 0.045 2 0 "[ . 1 . 2]" 1
994 1 64 TYR H 1 64 TYR HB2 . . 3.990 2.590 2.534 2.667 . 0 0 "[ . 1 . 2]" 1
995 1 64 TYR H 1 64 TYR HB3 . . 3.670 3.476 3.459 3.491 . 0 0 "[ . 1 . 2]" 1
996 1 64 TYR H 1 64 TYR QD . . 3.460 2.200 2.098 2.300 . 0 0 "[ . 1 . 2]" 1
997 1 64 TYR H 1 64 TYR QE . . 3.880 3.885 3.794 3.931 0.051 5 0 "[ . 1 . 2]" 1
998 1 64 TYR H 1 65 ILE H . . 3.700 3.075 2.953 3.176 . 0 0 "[ . 1 . 2]" 1
999 1 64 TYR H 1 65 ILE MD . . 4.710 4.063 3.682 4.345 . 0 0 "[ . 1 . 2]" 1
1000 1 64 TYR HA 1 64 TYR QD . . 3.120 2.073 2.042 2.125 . 0 0 "[ . 1 . 2]" 1
1001 1 64 TYR HB2 1 65 ILE H . . 4.000 2.300 2.119 2.460 . 0 0 "[ . 1 . 2]" 1
1002 1 64 TYR HB2 1 90 VAL HB . . 4.000 2.377 2.246 2.615 . 0 0 "[ . 1 . 2]" 1
1003 1 64 TYR HB2 1 90 VAL MG1 . . 3.170 2.037 1.932 2.319 . 0 0 "[ . 1 . 2]" 1
1004 1 64 TYR HB3 1 65 ILE H . . 3.780 3.496 3.285 3.637 . 0 0 "[ . 1 . 2]" 1
1005 1 64 TYR HB3 1 90 VAL HA . . 3.700 2.873 2.532 3.392 . 0 0 "[ . 1 . 2]" 1
1006 1 64 TYR HB3 1 90 VAL HB . . 3.620 3.250 3.103 3.464 . 0 0 "[ . 1 . 2]" 1
1007 1 64 TYR HB3 1 90 VAL MG1 . . 2.930 2.025 1.914 2.275 . 0 0 "[ . 1 . 2]" 1
1008 1 64 TYR QD 1 65 ILE H . . 4.260 4.237 4.125 4.296 0.036 5 0 "[ . 1 . 2]" 1
1009 1 64 TYR QD 1 67 ASN HD21 . . 4.660 4.034 3.629 4.548 . 0 0 "[ . 1 . 2]" 1
1010 1 64 TYR QD 1 67 ASN HD22 . . 4.750 3.501 2.883 4.258 . 0 0 "[ . 1 . 2]" 1
1011 1 64 TYR QD 1 90 VAL HA . . 3.510 2.427 2.230 2.639 . 0 0 "[ . 1 . 2]" 1
1012 1 64 TYR QD 1 90 VAL HB . . 3.200 2.746 2.596 2.866 . 0 0 "[ . 1 . 2]" 1
1013 1 64 TYR QD 1 90 VAL MG1 . . 3.780 3.366 3.069 3.551 . 0 0 "[ . 1 . 2]" 1
1014 1 64 TYR QD 1 90 VAL MG2 . . 4.150 4.173 4.119 4.227 0.077 13 0 "[ . 1 . 2]" 1
1015 1 65 ILE H 1 65 ILE HB . . 3.110 2.251 2.144 2.352 . 0 0 "[ . 1 . 2]" 1
1016 1 65 ILE H 1 65 ILE MD . . 3.360 2.165 1.848 2.579 . 0 0 "[ . 1 . 2]" 1
1017 1 65 ILE H 1 65 ILE HG12 . . 4.150 3.950 3.786 4.108 . 0 0 "[ . 1 . 2]" 1
1018 1 65 ILE H 1 65 ILE MG . . 3.780 3.654 3.591 3.696 . 0 0 "[ . 1 . 2]" 1
1019 1 65 ILE H 1 66 GLN H . . 3.630 3.124 3.046 3.213 . 0 0 "[ . 1 . 2]" 1
1020 1 65 ILE H 1 90 VAL MG1 . . 3.700 2.411 2.224 2.734 . 0 0 "[ . 1 . 2]" 1
1021 1 65 ILE HA 1 65 ILE MD . . 3.460 3.304 3.046 3.433 . 0 0 "[ . 1 . 2]" 1
1022 1 65 ILE HA 1 65 ILE HG12 . . 3.620 3.308 3.160 3.480 . 0 0 "[ . 1 . 2]" 1
1023 1 65 ILE HA 1 65 ILE HG13 . . 3.150 2.126 2.067 2.220 . 0 0 "[ . 1 . 2]" 1
1024 1 65 ILE HA 1 65 ILE MG . . 2.730 2.579 2.498 2.643 . 0 0 "[ . 1 . 2]" 1
1025 1 65 ILE HA 1 68 PHE QB . . 3.330 2.858 2.738 3.011 . 0 0 "[ . 1 . 2]" 1
1026 1 65 ILE HA 1 68 PHE QD . . 3.780 2.724 2.471 3.056 . 0 0 "[ . 1 . 2]" 1
1027 1 65 ILE HA 1 69 LYS H . . 4.810 4.053 3.927 4.206 . 0 0 "[ . 1 . 2]" 1
1028 1 65 ILE HA 1 86 VAL MG1 . . 3.260 1.980 1.847 2.105 . 0 0 "[ . 1 . 2]" 1
1029 1 65 ILE HA 1 86 VAL MG2 . . 4.150 4.033 3.889 4.129 . 0 0 "[ . 1 . 2]" 1
1030 1 65 ILE HA 1 90 VAL MG1 . . 3.370 2.218 2.043 2.434 . 0 0 "[ . 1 . 2]" 1
1031 1 65 ILE HA 1 90 VAL MG2 . . 3.700 3.745 3.706 3.781 0.081 14 0 "[ . 1 . 2]" 1
1032 1 65 ILE HB 1 65 ILE MD . . 2.780 1.993 1.926 2.074 . 0 0 "[ . 1 . 2]" 1
1033 1 65 ILE HB 1 66 GLN H . . 3.470 2.416 2.300 2.499 . 0 0 "[ . 1 . 2]" 1
1034 1 65 ILE MD 1 90 VAL MG1 . . 3.620 2.447 2.150 2.752 . 0 0 "[ . 1 . 2]" 1
1035 1 65 ILE HG12 1 90 VAL MG1 . . 3.880 3.522 3.411 3.618 . 0 0 "[ . 1 . 2]" 1
1036 1 65 ILE HG13 1 86 VAL MG1 . . 3.780 2.192 2.004 2.385 . 0 0 "[ . 1 . 2]" 1
1037 1 65 ILE HG13 1 90 VAL MG1 . . 3.150 2.024 1.915 2.150 . 0 0 "[ . 1 . 2]" 1
1038 1 65 ILE HG13 1 90 VAL MG2 . . 3.200 2.200 2.038 2.415 . 0 0 "[ . 1 . 2]" 1
1039 1 65 ILE MG 1 66 GLN H . . 3.780 2.486 2.222 2.820 . 0 0 "[ . 1 . 2]" 1
1040 1 65 ILE MG 1 66 GLN HA . . 3.780 2.975 2.841 3.188 . 0 0 "[ . 1 . 2]" 1
1041 1 65 ILE MG 1 66 GLN HG2 . . 4.350 3.185 2.820 4.056 . 0 0 "[ . 1 . 2]" 1
1042 1 65 ILE MG 1 68 PHE H . . 4.580 4.609 4.558 4.629 0.049 2 0 "[ . 1 . 2]" 1
1043 1 65 ILE MG 1 69 LYS H . . 4.440 3.651 3.547 3.791 . 0 0 "[ . 1 . 2]" 1
1044 1 65 ILE MG 1 69 LYS QD . . 3.410 2.306 2.142 2.647 . 0 0 "[ . 1 . 2]" 1
1045 1 65 ILE MG 1 69 LYS HG2 . . 4.000 2.791 2.588 2.983 . 0 0 "[ . 1 . 2]" 1
1046 1 65 ILE MG 1 69 LYS HG3 . . 3.170 2.164 1.934 2.330 . 0 0 "[ . 1 . 2]" 1
1047 1 65 ILE MG 1 90 VAL MG1 . . 4.000 3.819 3.704 3.979 . 0 0 "[ . 1 . 2]" 1
1048 1 66 GLN H 1 66 GLN HB2 . . 3.170 2.445 2.325 2.509 . 0 0 "[ . 1 . 2]" 1
1049 1 66 GLN H 1 66 GLN HG2 . . 3.700 2.970 2.720 3.654 . 0 0 "[ . 1 . 2]" 1
1050 1 66 GLN H 1 66 GLN HG3 . . 3.620 2.478 2.164 2.660 . 0 0 "[ . 1 . 2]" 1
1051 1 66 GLN H 1 67 ASN H . . 3.630 3.044 2.943 3.112 . 0 0 "[ . 1 . 2]" 1
1052 1 66 GLN HA 1 66 GLN HB3 . . 2.980 2.593 2.543 2.645 . 0 0 "[ . 1 . 2]" 1
1053 1 66 GLN HA 1 66 GLN HG2 . . 3.460 2.290 2.125 2.959 . 0 0 "[ . 1 . 2]" 1
1054 1 66 GLN HA 1 66 GLN HG3 . . 3.620 3.216 2.469 3.395 . 0 0 "[ . 1 . 2]" 1
1055 1 66 GLN HA 1 69 LYS H . . 3.700 3.130 3.008 3.194 . 0 0 "[ . 1 . 2]" 1
1056 1 66 GLN HA 1 69 LYS HB2 . . 3.290 2.212 2.099 2.265 . 0 0 "[ . 1 . 2]" 1
1057 1 66 GLN HA 1 69 LYS HB3 . . 3.620 3.642 3.590 3.671 0.051 15 0 "[ . 1 . 2]" 1
1058 1 66 GLN HA 1 69 LYS QD . . 3.700 2.754 2.511 3.003 . 0 0 "[ . 1 . 2]" 1
1059 1 66 GLN HA 1 69 LYS HG3 . . 3.510 2.130 1.998 2.403 . 0 0 "[ . 1 . 2]" 1
1060 1 66 GLN HA 1 70 ILE H . . 4.990 4.108 3.891 4.236 . 0 0 "[ . 1 . 2]" 1
1061 1 66 GLN HB2 1 66 GLN HG2 . . 2.980 2.980 2.963 3.003 0.023 9 0 "[ . 1 . 2]" 1
1062 1 66 GLN HB2 1 66 GLN HG3 . . 2.830 2.371 2.297 2.792 . 0 0 "[ . 1 . 2]" 1
1063 1 66 GLN HB2 1 67 ASN H . . 3.500 2.460 2.374 2.539 . 0 0 "[ . 1 . 2]" 1
1064 1 66 GLN HB2 1 68 PHE H . . 5.250 5.123 4.992 5.203 . 0 0 "[ . 1 . 2]" 1
1065 1 66 GLN HB3 1 66 GLN HG2 . . 2.780 2.699 2.292 2.784 0.004 17 0 "[ . 1 . 2]" 1
1066 1 66 GLN HB3 1 67 ASN H . . 3.880 3.316 3.223 3.418 . 0 0 "[ . 1 . 2]" 1
1067 1 67 ASN H 1 67 ASN HB2 . . 3.360 2.695 2.520 2.829 . 0 0 "[ . 1 . 2]" 1
1068 1 67 ASN H 1 67 ASN HB3 . . 3.740 3.566 3.541 3.583 . 0 0 "[ . 1 . 2]" 1
1069 1 67 ASN H 1 67 ASN HD21 . . 4.580 4.441 4.316 4.600 0.020 14 0 "[ . 1 . 2]" 1
1070 1 67 ASN H 1 68 PHE H . . 3.580 3.033 2.981 3.091 . 0 0 "[ . 1 . 2]" 1
1071 1 67 ASN HA 1 70 ILE H . . 4.150 3.933 3.862 4.031 . 0 0 "[ . 1 . 2]" 1
1072 1 67 ASN HA 1 70 ILE HB . . 3.560 3.577 3.458 3.620 0.060 7 0 "[ . 1 . 2]" 1
1073 1 67 ASN HA 1 70 ILE MD . . 3.260 3.016 2.656 3.212 . 0 0 "[ . 1 . 2]" 1
1074 1 67 ASN HA 1 70 ILE HG13 . . 4.150 4.150 4.072 4.184 0.034 19 0 "[ . 1 . 2]" 1
1075 1 67 ASN HB2 1 67 ASN HD21 . . 3.560 2.878 2.745 3.015 . 0 0 "[ . 1 . 2]" 1
1076 1 67 ASN HB2 1 67 ASN HD22 . . 3.880 3.794 3.729 3.862 . 0 0 "[ . 1 . 2]" 1
1077 1 67 ASN HB2 1 68 PHE H . . 3.550 2.319 2.215 2.444 . 0 0 "[ . 1 . 2]" 1
1078 1 67 ASN HB3 1 67 ASN HD22 . . 4.150 3.504 3.469 3.544 . 0 0 "[ . 1 . 2]" 1
1079 1 67 ASN HB3 1 68 PHE H . . 3.940 3.514 3.327 3.673 . 0 0 "[ . 1 . 2]" 1
1080 1 68 PHE H 1 68 PHE QB . . 3.140 2.098 2.026 2.197 . 0 0 "[ . 1 . 2]" 1
1081 1 68 PHE H 1 68 PHE QD . . 3.780 2.721 2.378 2.939 . 0 0 "[ . 1 . 2]" 1
1082 1 68 PHE H 1 69 LYS H . . 3.550 2.654 2.593 2.719 . 0 0 "[ . 1 . 2]" 1
1083 1 68 PHE H 1 70 ILE H . . 4.540 4.250 4.150 4.325 . 0 0 "[ . 1 . 2]" 1
1084 1 68 PHE H 1 86 VAL MG1 . . 4.150 3.635 3.407 3.835 . 0 0 "[ . 1 . 2]" 1
1085 1 68 PHE H 1 86 VAL MG2 . . 4.380 4.297 4.219 4.387 0.007 5 0 "[ . 1 . 2]" 1
1086 1 68 PHE HA 1 68 PHE QD . . 3.150 2.585 2.381 2.796 . 0 0 "[ . 1 . 2]" 1
1087 1 68 PHE HA 1 71 LEU H . . 3.510 3.150 3.072 3.257 . 0 0 "[ . 1 . 2]" 1
1088 1 68 PHE HA 1 71 LEU HB2 . . 3.560 3.269 3.098 3.419 . 0 0 "[ . 1 . 2]" 1
1089 1 68 PHE HA 1 71 LEU HB3 . . 3.230 2.317 2.237 2.434 . 0 0 "[ . 1 . 2]" 1
1090 1 68 PHE HA 1 71 LEU MD1 . . 3.560 3.570 3.525 3.635 0.075 19 0 "[ . 1 . 2]" 1
1091 1 68 PHE HA 1 72 GLN H . . 3.850 3.605 3.456 3.727 . 0 0 "[ . 1 . 2]" 1
1092 1 68 PHE HA 1 84 ILE MD . . 4.150 4.114 3.968 4.194 0.044 4 0 "[ . 1 . 2]" 1
1093 1 68 PHE HA 1 84 ILE MG . . 4.350 4.180 3.873 4.324 . 0 0 "[ . 1 . 2]" 1
1094 1 68 PHE HA 1 86 VAL MG2 . . 3.880 3.925 3.892 3.964 0.084 16 0 "[ . 1 . 2]" 1
1095 1 68 PHE QB 1 69 LYS H . . 3.780 2.438 2.393 2.504 . 0 0 "[ . 1 . 2]" 1
1096 1 68 PHE QB 1 69 LYS HA . . 4.150 3.724 3.693 3.745 . 0 0 "[ . 1 . 2]" 1
1097 1 68 PHE QB 1 69 LYS HG3 . . 3.880 3.722 3.655 3.792 . 0 0 "[ . 1 . 2]" 1
1098 1 68 PHE QB 1 71 LEU MD1 . . 4.150 4.173 4.105 4.208 0.058 16 0 "[ . 1 . 2]" 1
1099 1 68 PHE QB 1 84 ILE MD . . 4.000 3.662 3.502 3.758 . 0 0 "[ . 1 . 2]" 1
1100 1 68 PHE QB 1 84 ILE MG . . 4.150 2.732 2.543 2.907 . 0 0 "[ . 1 . 2]" 1
1101 1 68 PHE QB 1 86 VAL MG1 . . 3.080 2.040 1.838 2.270 . 0 0 "[ . 1 . 2]" 1
1102 1 68 PHE QB 1 86 VAL MG2 . . 2.900 1.727 1.715 1.737 . 0 0 "[ . 1 . 2]" 1
1103 1 68 PHE QB 1 90 VAL MG1 . . 3.880 3.535 3.369 3.738 . 0 0 "[ . 1 . 2]" 1
1104 1 68 PHE QD 1 71 LEU HB3 . . 4.150 3.440 3.210 3.730 . 0 0 "[ . 1 . 2]" 1
1105 1 68 PHE QD 1 71 LEU MD1 . . 3.330 3.104 2.893 3.266 . 0 0 "[ . 1 . 2]" 1
1106 1 68 PHE QD 1 84 ILE MD . . 4.000 3.042 2.892 3.429 . 0 0 "[ . 1 . 2]" 1
1107 1 68 PHE QD 1 84 ILE MG . . 3.230 2.483 2.066 3.011 . 0 0 "[ . 1 . 2]" 1
1108 1 68 PHE QD 1 86 VAL MG1 . . 3.620 2.160 1.957 2.539 . 0 0 "[ . 1 . 2]" 1
1109 1 68 PHE QD 1 86 VAL MG2 . . 3.620 2.804 2.588 2.961 . 0 0 "[ . 1 . 2]" 1
1110 1 68 PHE QD 1 90 VAL MG1 . . 3.100 2.263 2.142 2.485 . 0 0 "[ . 1 . 2]" 1
1111 1 68 PHE QE 1 89 LEU HB2 . . 3.700 3.039 2.589 3.478 . 0 0 "[ . 1 . 2]" 1
1112 1 68 PHE QE 1 89 LEU HB3 . . 4.350 3.098 2.632 3.545 . 0 0 "[ . 1 . 2]" 1
1113 1 68 PHE QE 1 89 LEU MD1 . . 3.330 2.128 1.947 2.423 . 0 0 "[ . 1 . 2]" 1
1114 1 68 PHE QE 1 89 LEU HG . . 4.660 4.660 4.543 4.705 0.045 9 0 "[ . 1 . 2]" 1
1115 1 68 PHE QE 1 90 VAL HA . . 4.150 3.315 3.055 3.676 . 0 0 "[ . 1 . 2]" 1
1116 1 68 PHE QE 1 90 VAL MG1 . . 3.370 2.166 1.962 2.433 . 0 0 "[ . 1 . 2]" 1
1117 1 69 LYS H 1 69 LYS HB2 . . 3.200 2.563 2.505 2.597 . 0 0 "[ . 1 . 2]" 1
1118 1 69 LYS H 1 69 LYS HB3 . . 3.560 3.546 3.543 3.550 . 0 0 "[ . 1 . 2]" 1
1119 1 69 LYS H 1 69 LYS QD . . 4.000 3.994 3.947 4.028 0.028 7 0 "[ . 1 . 2]" 1
1120 1 69 LYS H 1 69 LYS HG2 . . 4.150 2.683 2.539 2.852 . 0 0 "[ . 1 . 2]" 1
1121 1 69 LYS H 1 69 LYS HG3 . . 3.470 2.208 2.140 2.264 . 0 0 "[ . 1 . 2]" 1
1122 1 69 LYS H 1 70 ILE H . . 3.520 2.943 2.898 2.990 . 0 0 "[ . 1 . 2]" 1
1123 1 69 LYS H 1 70 ILE HB . . 5.140 5.043 4.996 5.089 . 0 0 "[ . 1 . 2]" 1
1124 1 69 LYS HA 1 69 LYS QD . . 3.880 3.798 3.702 3.881 0.001 9 0 "[ . 1 . 2]" 1
1125 1 69 LYS HA 1 69 LYS HE2 . . 4.150 4.076 3.474 5.107 0.957 9 2 "[ - . +1 . 2]" 1
1126 1 69 LYS HA 1 69 LYS HG2 . . 3.290 2.302 2.256 2.333 . 0 0 "[ . 1 . 2]" 1
1127 1 69 LYS HA 1 69 LYS HG3 . . 3.880 3.357 3.270 3.435 . 0 0 "[ . 1 . 2]" 1
1128 1 69 LYS HA 1 72 GLN H . . 3.880 3.776 3.672 3.861 . 0 0 "[ . 1 . 2]" 1
1129 1 69 LYS HA 1 72 GLN QB . . 3.170 2.747 2.589 2.931 . 0 0 "[ . 1 . 2]" 1
1130 1 69 LYS HB2 1 69 LYS QD . . 2.770 2.727 2.675 2.781 0.011 7 0 "[ . 1 . 2]" 1
1131 1 69 LYS HB2 1 70 ILE H . . 3.780 2.691 2.603 2.773 . 0 0 "[ . 1 . 2]" 1
1132 1 69 LYS HB2 1 70 ILE HA . . 4.350 4.388 4.360 4.423 0.073 1 0 "[ . 1 . 2]" 1
1133 1 69 LYS HB3 1 69 LYS QD . . 3.000 2.068 2.026 2.117 . 0 0 "[ . 1 . 2]" 1
1134 1 69 LYS HB3 1 70 ILE H . . 3.880 3.729 3.572 3.823 . 0 0 "[ . 1 . 2]" 1
1135 1 69 LYS HE3 1 69 LYS HG2 . . 3.880 2.595 1.969 3.113 . 0 0 "[ . 1 . 2]" 1
1136 1 69 LYS HG2 1 86 VAL MG1 . . 4.150 3.441 3.220 3.735 . 0 0 "[ . 1 . 2]" 1
1137 1 70 ILE H 1 70 ILE HB . . 2.930 2.342 2.308 2.360 . 0 0 "[ . 1 . 2]" 1
1138 1 70 ILE H 1 70 ILE MD . . 3.460 3.470 3.299 3.510 0.050 11 0 "[ . 1 . 2]" 1
1139 1 70 ILE H 1 70 ILE HG12 . . 3.620 3.498 3.403 3.598 . 0 0 "[ . 1 . 2]" 1
1140 1 70 ILE H 1 70 ILE HG13 . . 3.330 2.195 2.121 2.264 . 0 0 "[ . 1 . 2]" 1
1141 1 70 ILE H 1 70 ILE MG . . 4.120 3.694 3.684 3.703 . 0 0 "[ . 1 . 2]" 1
1142 1 70 ILE HA 1 70 ILE MD . . 3.700 3.819 3.802 3.857 0.157 19 0 "[ . 1 . 2]" 1
1143 1 70 ILE HA 1 70 ILE HG12 . . 3.120 2.522 2.484 2.639 . 0 0 "[ . 1 . 2]" 1
1144 1 70 ILE HA 1 70 ILE HG13 . . 3.230 2.890 2.803 2.925 . 0 0 "[ . 1 . 2]" 1
1145 1 70 ILE HA 1 70 ILE MG . . 3.040 2.491 2.377 2.532 . 0 0 "[ . 1 . 2]" 1
1146 1 70 ILE HA 1 73 ALA H . . 4.000 3.402 3.238 3.687 . 0 0 "[ . 1 . 2]" 1
1147 1 70 ILE HA 1 73 ALA MB . . 3.200 2.725 2.512 2.983 . 0 0 "[ . 1 . 2]" 1
1148 1 70 ILE HB 1 70 ILE MD . . 3.100 2.353 2.197 2.405 . 0 0 "[ . 1 . 2]" 1
1149 1 70 ILE HB 1 71 LEU H . . 3.650 2.437 2.398 2.486 . 0 0 "[ . 1 . 2]" 1
1150 1 70 ILE HG12 1 70 ILE MG . . 3.170 2.343 2.280 2.456 . 0 0 "[ . 1 . 2]" 1
1151 1 70 ILE HG13 1 70 ILE MG . . 3.260 3.228 3.223 3.233 . 0 0 "[ . 1 . 2]" 1
1152 1 70 ILE MG 1 71 LEU H . . 3.150 3.175 3.150 3.203 0.053 7 0 "[ . 1 . 2]" 1
1153 1 70 ILE MG 1 71 LEU HA . . 3.880 3.373 3.312 3.423 . 0 0 "[ . 1 . 2]" 1
1154 1 71 LEU H 1 71 LEU HB2 . . 3.370 2.412 2.368 2.449 . 0 0 "[ . 1 . 2]" 1
1155 1 71 LEU H 1 71 LEU HB3 . . 3.460 2.464 2.426 2.523 . 0 0 "[ . 1 . 2]" 1
1156 1 71 LEU H 1 71 LEU MD1 . . 4.150 4.053 4.005 4.132 . 0 0 "[ . 1 . 2]" 1
1157 1 71 LEU H 1 71 LEU MD2 . . 3.880 3.969 3.943 3.990 0.110 16 0 "[ . 1 . 2]" 1
1158 1 71 LEU H 1 72 GLN H . . 3.810 2.952 2.881 3.042 . 0 0 "[ . 1 . 2]" 1
1159 1 71 LEU HA 1 71 LEU MD1 . . 3.780 3.495 3.452 3.565 . 0 0 "[ . 1 . 2]" 1
1160 1 71 LEU HA 1 71 LEU MD2 . . 2.710 1.951 1.925 2.005 . 0 0 "[ . 1 . 2]" 1
1161 1 71 LEU HA 1 74 GLY H . . 4.000 3.179 2.977 3.353 . 0 0 "[ . 1 . 2]" 1
1162 1 71 LEU HB2 1 71 LEU MD1 . . 3.290 3.131 3.084 3.151 . 0 0 "[ . 1 . 2]" 1
1163 1 71 LEU HB2 1 71 LEU MD2 . . 3.200 2.594 2.560 2.681 . 0 0 "[ . 1 . 2]" 1
1164 1 71 LEU HB2 1 72 GLN H . . 4.000 3.889 3.793 3.969 . 0 0 "[ . 1 . 2]" 1
1165 1 71 LEU HB3 1 71 LEU MD1 . . 3.040 2.064 1.987 2.177 . 0 0 "[ . 1 . 2]" 1
1166 1 71 LEU HB3 1 71 LEU MD2 . . 3.370 3.184 3.158 3.192 . 0 0 "[ . 1 . 2]" 1
1167 1 71 LEU HB3 1 72 GLN H . . 3.680 2.519 2.372 2.644 . 0 0 "[ . 1 . 2]" 1
1168 1 71 LEU HB3 1 84 ILE MD . . 3.620 3.342 3.201 3.394 . 0 0 "[ . 1 . 2]" 1
1169 1 71 LEU MD1 1 72 GLN H . . 4.050 2.746 2.531 2.941 . 0 0 "[ . 1 . 2]" 1
1170 1 71 LEU MD1 1 74 GLY H . . 4.810 4.463 4.311 4.779 . 0 0 "[ . 1 . 2]" 1
1171 1 71 LEU MD1 1 75 PHE H . . 4.750 4.453 4.184 4.634 . 0 0 "[ . 1 . 2]" 1
1172 1 71 LEU MD1 1 75 PHE QE . . 3.290 3.278 3.144 3.331 0.041 4 0 "[ . 1 . 2]" 1
1173 1 71 LEU MD1 1 75 PHE HZ . . 3.780 3.476 3.164 3.764 . 0 0 "[ . 1 . 2]" 1
1174 1 71 LEU MD1 1 84 ILE MD . . 2.760 1.644 1.618 1.666 . 0 0 "[ . 1 . 2]" 1
1175 1 71 LEU MD1 1 84 ILE MG . . 3.700 3.188 3.015 3.354 . 0 0 "[ . 1 . 2]" 1
1176 1 71 LEU MD1 1 100 PHE QE . . 4.000 3.990 3.816 4.057 0.057 3 0 "[ . 1 . 2]" 1
1177 1 71 LEU MD1 1 100 PHE HZ . . 3.780 3.047 2.873 3.143 . 0 0 "[ . 1 . 2]" 1
1178 1 71 LEU MD1 1 104 PHE QE . . 3.700 2.684 2.573 2.867 . 0 0 "[ . 1 . 2]" 1
1179 1 71 LEU MD1 1 104 PHE HZ . . 3.100 1.878 1.791 1.974 . 0 0 "[ . 1 . 2]" 1
1180 1 71 LEU MD2 1 75 PHE QD . . 3.510 3.529 3.419 3.603 0.093 10 0 "[ . 1 . 2]" 1
1181 1 71 LEU MD2 1 75 PHE QE . . 3.330 3.078 2.873 3.307 . 0 0 "[ . 1 . 2]" 1
1182 1 71 LEU MD2 1 84 ILE MD . . 4.000 3.533 3.446 3.586 . 0 0 "[ . 1 . 2]" 1
1183 1 71 LEU MD2 1 104 PHE HZ . . 3.700 3.658 3.518 3.733 0.033 18 0 "[ . 1 . 2]" 1
1184 1 71 LEU HG 1 84 ILE MD . . 3.700 3.782 3.714 3.861 0.161 17 0 "[ . 1 . 2]" 1
1185 1 71 LEU HG 1 104 PHE HZ . . 4.660 3.981 3.817 4.154 . 0 0 "[ . 1 . 2]" 1
1186 1 72 GLN H 1 72 GLN QB . . 3.230 2.095 2.005 2.217 . 0 0 "[ . 1 . 2]" 1
1187 1 72 GLN H 1 72 GLN HG3 . . 4.130 4.281 4.002 4.420 0.290 1 0 "[ . 1 . 2]" 1
1188 1 72 GLN H 1 73 ALA H . . 3.600 2.917 2.821 3.151 . 0 0 "[ . 1 . 2]" 1
1189 1 72 GLN H 1 84 ILE MD . . 3.560 3.117 2.847 3.349 . 0 0 "[ . 1 . 2]" 1
1190 1 72 GLN HA 1 72 GLN HE21 . . 3.620 2.727 2.506 2.915 . 0 0 "[ . 1 . 2]" 1
1191 1 72 GLN HA 1 72 GLN HE22 . . 4.510 3.877 3.709 4.036 . 0 0 "[ . 1 . 2]" 1
1192 1 72 GLN HA 1 72 GLN HG2 . . 4.000 2.858 2.113 3.841 . 0 0 "[ . 1 . 2]" 1
1193 1 72 GLN HA 1 72 GLN HG3 . . 3.460 3.184 2.589 3.580 0.120 1 0 "[ . 1 . 2]" 1
1194 1 72 GLN HA 1 84 ILE MD . . 3.170 2.252 2.022 2.526 . 0 0 "[ . 1 . 2]" 1
1195 1 72 GLN HA 1 84 ILE HG13 . . 4.150 3.609 3.278 3.881 . 0 0 "[ . 1 . 2]" 1
1196 1 72 GLN QB 1 73 ALA H . . 3.530 2.661 2.243 2.912 . 0 0 "[ . 1 . 2]" 1
1197 1 72 GLN QB 1 73 ALA MB . . 3.880 3.803 3.687 3.881 0.001 3 0 "[ . 1 . 2]" 1
1198 1 72 GLN QB 1 84 ILE MD . . 3.200 2.853 2.159 3.215 0.015 6 0 "[ . 1 . 2]" 1
1199 1 72 GLN HE21 1 72 GLN HG2 . . 3.510 2.637 2.103 3.459 . 0 0 "[ . 1 . 2]" 1
1200 1 72 GLN HE21 1 72 GLN HG3 . . 3.560 2.859 2.128 3.401 . 0 0 "[ . 1 . 2]" 1
1201 1 72 GLN HE21 1 75 PHE H . . 5.230 4.639 4.124 4.968 . 0 0 "[ . 1 . 2]" 1
1202 1 72 GLN HE21 1 75 PHE HB2 . . 4.350 3.071 2.486 3.494 . 0 0 "[ . 1 . 2]" 1
1203 1 72 GLN HE21 1 75 PHE QD . . 2.850 2.869 2.813 2.913 0.063 10 0 "[ . 1 . 2]" 1
1204 1 72 GLN HE22 1 75 PHE QD . . 3.880 3.325 3.057 3.679 . 0 0 "[ . 1 . 2]" 1
1205 1 72 GLN HE22 1 83 ILE HA . . 3.460 3.196 2.743 3.485 0.025 5 0 "[ . 1 . 2]" 1
1206 1 72 GLN HE22 1 84 ILE H . . 4.620 2.949 1.883 3.786 . 0 0 "[ . 1 . 2]" 1
1207 1 72 GLN HG3 1 84 ILE MD . . 3.880 3.672 3.132 3.988 0.108 13 0 "[ . 1 . 2]" 1
1208 1 73 ALA H 1 73 ALA MB . . 2.740 2.045 1.935 2.164 . 0 0 "[ . 1 . 2]" 1
1209 1 73 ALA H 1 74 GLY H . . 3.550 2.657 2.493 2.947 . 0 0 "[ . 1 . 2]" 1
1210 1 73 ALA H 1 75 PHE H . . 5.140 4.195 3.991 4.489 . 0 0 "[ . 1 . 2]" 1
1211 1 73 ALA MB 1 74 GLY H . . 3.170 2.816 2.504 3.035 . 0 0 "[ . 1 . 2]" 1
1212 1 73 ALA MB 1 74 GLY HA2 . . 4.000 3.833 3.698 3.938 . 0 0 "[ . 1 . 2]" 1
1213 1 73 ALA MB 1 75 PHE H . . 4.540 4.401 4.203 4.548 0.008 16 0 "[ . 1 . 2]" 1
1214 1 74 GLY H 1 75 PHE H . . 3.560 2.745 2.549 3.045 . 0 0 "[ . 1 . 2]" 1
1215 1 74 GLY HA2 1 77 ARG HB2 . . 3.620 2.779 2.495 3.284 . 0 0 "[ . 1 . 2]" 1
1216 1 75 PHE H 1 75 PHE HB2 . . 3.340 2.117 2.056 2.171 . 0 0 "[ . 1 . 2]" 1
1217 1 75 PHE H 1 75 PHE HB3 . . 3.790 3.420 3.384 3.444 . 0 0 "[ . 1 . 2]" 1
1218 1 75 PHE H 1 75 PHE QD . . 3.460 2.736 2.368 2.941 . 0 0 "[ . 1 . 2]" 1
1219 1 75 PHE H 1 76 LYS H . . 3.750 2.536 2.346 2.815 . 0 0 "[ . 1 . 2]" 1
1220 1 75 PHE HA 1 75 PHE QD . . 3.020 2.097 2.028 2.242 . 0 0 "[ . 1 . 2]" 1
1221 1 75 PHE HA 1 77 ARG H . . 4.350 3.843 3.591 4.375 0.025 9 0 "[ . 1 . 2]" 1
1222 1 75 PHE HA 1 80 VAL H . . 3.880 3.477 3.052 3.888 0.008 10 0 "[ . 1 . 2]" 1
1223 1 75 PHE HA 1 80 VAL HB . . 3.330 2.488 2.225 2.703 . 0 0 "[ . 1 . 2]" 1
1224 1 75 PHE HA 1 80 VAL MG1 . . 4.000 3.882 3.595 4.043 0.043 6 0 "[ . 1 . 2]" 1
1225 1 75 PHE HA 1 80 VAL MG2 . . 3.460 2.820 2.377 3.204 . 0 0 "[ . 1 . 2]" 1
1226 1 75 PHE HB2 1 76 LYS H . . 3.580 2.352 2.159 2.514 . 0 0 "[ . 1 . 2]" 1
1227 1 75 PHE HB2 1 80 VAL HB . . 3.880 3.553 3.471 3.647 . 0 0 "[ . 1 . 2]" 1
1228 1 75 PHE HB3 1 76 LYS H . . 3.780 3.096 2.728 3.397 . 0 0 "[ . 1 . 2]" 1
1229 1 75 PHE HB3 1 80 VAL H . . 4.710 3.204 2.867 3.820 . 0 0 "[ . 1 . 2]" 1
1230 1 75 PHE HB3 1 80 VAL HB . . 3.410 2.038 1.987 2.248 . 0 0 "[ . 1 . 2]" 1
1231 1 75 PHE HB3 1 80 VAL MG1 . . 3.880 2.974 2.472 3.318 . 0 0 "[ . 1 . 2]" 1
1232 1 75 PHE HB3 1 80 VAL MG2 . . 4.350 3.706 3.515 3.844 . 0 0 "[ . 1 . 2]" 1
1233 1 75 PHE QD 1 80 VAL HB . . 3.510 3.064 2.834 3.185 . 0 0 "[ . 1 . 2]" 1
1234 1 75 PHE QD 1 80 VAL MG1 . . 3.700 2.467 2.054 2.670 . 0 0 "[ . 1 . 2]" 1
1235 1 75 PHE QD 1 80 VAL MG2 . . 3.620 3.427 3.069 3.627 0.007 15 0 "[ . 1 . 2]" 1
1236 1 75 PHE QD 1 82 LYS HB3 . . 3.780 2.322 1.996 2.684 . 0 0 "[ . 1 . 2]" 1
1237 1 75 PHE QD 1 84 ILE MD . . 3.880 3.565 3.337 3.886 0.006 12 0 "[ . 1 . 2]" 1
1238 1 75 PHE QE 1 80 VAL MG1 . . 4.350 2.904 2.563 3.249 . 0 0 "[ . 1 . 2]" 1
1239 1 75 PHE QE 1 80 VAL MG2 . . 4.150 3.947 3.505 4.163 0.013 19 0 "[ . 1 . 2]" 1
1240 1 75 PHE QE 1 82 LYS HB3 . . 3.880 2.594 1.996 3.055 . 0 0 "[ . 1 . 2]" 1
1241 1 75 PHE QE 1 82 LYS HG2 . . 4.150 2.245 2.020 2.646 . 0 0 "[ . 1 . 2]" 1
1242 1 75 PHE QE 1 84 ILE MD . . 3.700 3.267 3.080 3.530 . 0 0 "[ . 1 . 2]" 1
1243 1 75 PHE QE 1 84 ILE HG12 . . 3.700 3.396 3.094 3.552 . 0 0 "[ . 1 . 2]" 1
1244 1 75 PHE QE 1 84 ILE HG13 . . 4.150 3.495 3.228 3.682 . 0 0 "[ . 1 . 2]" 1
1245 1 75 PHE QE 1 103 TRP HH2 . . 4.150 2.741 2.468 3.015 . 0 0 "[ . 1 . 2]" 1
1246 1 75 PHE QE 1 103 TRP HZ3 . . 3.780 2.447 2.156 2.667 . 0 0 "[ . 1 . 2]" 1
1247 1 75 PHE QE 1 104 PHE QE . . 4.000 2.773 2.703 2.862 . 0 0 "[ . 1 . 2]" 1
1248 1 75 PHE QE 1 104 PHE HZ . . 3.370 3.107 2.935 3.275 . 0 0 "[ . 1 . 2]" 1
1249 1 75 PHE HZ 1 103 TRP HH2 . . 4.150 4.001 3.536 4.166 0.016 13 0 "[ . 1 . 2]" 1
1250 1 75 PHE HZ 1 103 TRP HZ3 . . 3.330 2.879 2.248 3.194 . 0 0 "[ . 1 . 2]" 1
1251 1 75 PHE HZ 1 104 PHE QD . . 3.560 3.576 3.485 3.614 0.054 9 0 "[ . 1 . 2]" 1
1252 1 75 PHE HZ 1 104 PHE QE . . 4.150 2.620 2.480 2.808 . 0 0 "[ . 1 . 2]" 1
1253 1 75 PHE HZ 1 104 PHE HZ . . 3.410 2.587 2.520 2.655 . 0 0 "[ . 1 . 2]" 1
1254 1 76 LYS H 1 76 LYS QB . . 3.050 2.243 2.070 2.542 . 0 0 "[ . 1 . 2]" 1
1255 1 76 LYS H 1 76 LYS HG2 . . 4.350 3.017 2.350 3.442 . 0 0 "[ . 1 . 2]" 1
1256 1 76 LYS H 1 76 LYS HG3 . . 4.020 3.014 2.469 4.060 0.040 17 0 "[ . 1 . 2]" 1
1257 1 76 LYS H 1 77 ARG H . . 3.890 2.852 2.548 3.688 . 0 0 "[ . 1 . 2]" 1
1258 1 76 LYS H 1 77 ARG QG . . 4.750 4.454 3.980 4.628 . 0 0 "[ . 1 . 2]" 1
1259 1 76 LYS HA 1 76 LYS QB . . 2.790 2.161 2.145 2.173 . 0 0 "[ . 1 . 2]" 1
1260 1 76 LYS HA 1 76 LYS HG3 . . 3.700 3.568 3.499 3.899 0.199 10 0 "[ . 1 . 2]" 1
1261 1 76 LYS HA 1 80 VAL H . . 4.410 3.475 2.831 3.859 . 0 0 "[ . 1 . 2]" 1
1262 1 76 LYS HG3 1 77 ARG QG . . 2.790 2.843 2.522 3.597 0.807 9 4 "[ . +* *. - 2]" 1
1263 1 77 ARG H 1 77 ARG HB2 . . 2.870 2.349 2.169 2.958 0.088 10 0 "[ . 1 . 2]" 1
1264 1 77 ARG H 1 77 ARG QG . . 3.890 2.921 2.557 3.587 . 0 0 "[ . 1 . 2]" 1
1265 1 77 ARG H 1 78 MET H . . 3.560 2.440 1.891 2.831 . 0 0 "[ . 1 . 2]" 1
1266 1 77 ARG HA 1 77 ARG HB3 . . 2.790 2.680 2.623 2.724 . 0 0 "[ . 1 . 2]" 1
1267 1 77 ARG HA 1 77 ARG HD3 . . 4.660 4.128 3.286 4.388 . 0 0 "[ . 1 . 2]" 1
1268 1 77 ARG HA 1 77 ARG QG . . 3.370 2.188 2.131 2.261 . 0 0 "[ . 1 . 2]" 1
1269 1 77 ARG HB2 1 77 ARG HD3 . . 3.460 3.342 2.890 3.466 0.006 6 0 "[ . 1 . 2]" 1
1270 1 77 ARG HB2 1 77 ARG QG . . 2.790 2.322 2.185 2.391 . 0 0 "[ . 1 . 2]" 1
1271 1 77 ARG HB2 1 78 MET H . . 3.540 2.603 2.360 2.834 . 0 0 "[ . 1 . 2]" 1
1272 1 77 ARG HB3 1 77 ARG HD3 . . 3.700 2.507 2.119 2.781 . 0 0 "[ . 1 . 2]" 1
1273 1 77 ARG HB3 1 78 MET H . . 3.880 3.266 2.989 3.531 . 0 0 "[ . 1 . 2]" 1
1274 1 78 MET H 1 78 MET HB2 . . 3.450 2.330 2.035 2.618 . 0 0 "[ . 1 . 2]" 1
1275 1 78 MET H 1 78 MET HB3 . . 4.000 3.498 3.351 3.608 . 0 0 "[ . 1 . 2]" 1
1276 1 78 MET H 1 78 MET HG2 . . 3.410 2.490 1.988 3.237 . 0 0 "[ . 1 . 2]" 1
1277 1 78 MET H 1 78 MET HG3 . . 4.150 3.741 3.503 4.052 . 0 0 "[ . 1 . 2]" 1
1278 1 78 MET H 1 79 GLY H . . 3.730 2.667 2.200 2.973 . 0 0 "[ . 1 . 2]" 1
1279 1 78 MET H 1 80 VAL H . . 4.440 4.331 4.164 4.457 0.017 13 0 "[ . 1 . 2]" 1
1280 1 78 MET H 1 80 VAL MG2 . . 4.750 4.359 3.724 4.753 0.003 17 0 "[ . 1 . 2]" 1
1281 1 78 MET HA 1 78 MET ME . . 3.410 3.119 2.855 3.376 . 0 0 "[ . 1 . 2]" 1
1282 1 78 MET HA 1 78 MET HG3 . . 4.150 3.714 3.609 3.794 . 0 0 "[ . 1 . 2]" 1
1283 1 78 MET HB2 1 80 VAL MG2 . . 4.000 2.936 2.526 3.318 . 0 0 "[ . 1 . 2]" 1
1284 1 78 MET HB3 1 80 VAL MG2 . . 4.150 3.634 2.944 4.172 0.022 12 0 "[ . 1 . 2]" 1
1285 1 78 MET ME 1 78 MET HG2 . . 3.780 2.824 2.118 3.358 . 0 0 "[ . 1 . 2]" 1
1286 1 78 MET ME 1 78 MET HG3 . . 3.700 2.488 2.109 2.848 . 0 0 "[ . 1 . 2]" 1
1287 1 79 GLY H 1 80 VAL H . . 3.440 2.235 1.902 2.500 . 0 0 "[ . 1 . 2]" 1
1288 1 79 GLY H 1 80 VAL HB . . 4.660 3.767 3.532 4.043 . 0 0 "[ . 1 . 2]" 1
1289 1 79 GLY H 1 80 VAL MG2 . . 4.660 2.777 2.193 3.109 . 0 0 "[ . 1 . 2]" 1
1290 1 80 VAL H 1 80 VAL HB . . 3.290 2.576 2.295 2.962 . 0 0 "[ . 1 . 2]" 1
1291 1 80 VAL H 1 80 VAL MG1 . . 4.000 3.794 3.651 3.981 . 0 0 "[ . 1 . 2]" 1
1292 1 80 VAL H 1 80 VAL MG2 . . 3.120 2.844 2.509 3.123 0.003 14 0 "[ . 1 . 2]" 1
1293 1 80 VAL H 1 81 ASP H . . 4.330 4.168 3.884 4.364 0.034 8 0 "[ . 1 . 2]" 1
1294 1 80 VAL HA 1 80 VAL MG1 . . 3.060 2.449 2.199 2.571 . 0 0 "[ . 1 . 2]" 1
1295 1 80 VAL HA 1 80 VAL MG2 . . 3.020 2.325 2.164 2.533 . 0 0 "[ . 1 . 2]" 1
1296 1 80 VAL HA 1 81 ASP H . . 2.840 2.193 2.182 2.239 . 0 0 "[ . 1 . 2]" 1
1297 1 80 VAL HA 1 82 LYS H . . 4.540 4.488 4.367 4.586 0.046 13 0 "[ . 1 . 2]" 1
1298 1 80 VAL HA 1 107 PHE HZ . . 4.000 3.179 2.487 3.938 . 0 0 "[ . 1 . 2]" 1
1299 1 80 VAL MG1 1 81 ASP H . . 3.700 3.067 2.792 3.413 . 0 0 "[ . 1 . 2]" 1
1300 1 80 VAL MG1 1 82 LYS H . . 3.150 2.626 2.343 3.159 0.009 6 0 "[ . 1 . 2]" 1
1301 1 80 VAL MG1 1 82 LYS HB2 . . 3.880 2.795 2.569 3.261 . 0 0 "[ . 1 . 2]" 1
1302 1 80 VAL MG1 1 82 LYS HB3 . . 3.410 2.036 1.900 2.419 . 0 0 "[ . 1 . 2]" 1
1303 1 80 VAL MG1 1 103 TRP HH2 . . 3.260 2.318 1.989 2.455 . 0 0 "[ . 1 . 2]" 1
1304 1 80 VAL MG1 1 103 TRP HZ2 . . 3.620 3.398 2.980 3.630 0.010 4 0 "[ . 1 . 2]" 1
1305 1 80 VAL MG1 1 107 PHE QE . . 4.000 2.811 2.148 3.388 . 0 0 "[ . 1 . 2]" 1
1306 1 80 VAL MG1 1 107 PHE HZ . . 4.000 2.825 1.922 3.366 . 0 0 "[ . 1 . 2]" 1
1307 1 80 VAL MG2 1 81 ASP H . . 4.350 4.144 3.987 4.314 . 0 0 "[ . 1 . 2]" 1
1308 1 80 VAL MG2 1 107 PHE QE . . 3.290 2.250 1.894 2.870 . 0 0 "[ . 1 . 2]" 1
1309 1 80 VAL MG2 1 107 PHE HZ . . 3.200 2.579 1.975 3.208 0.008 12 0 "[ . 1 . 2]" 1
1310 1 81 ASP H 1 81 ASP HB2 . . 3.410 2.624 2.036 3.497 0.087 7 0 "[ . 1 . 2]" 1
1311 1 81 ASP H 1 81 ASP HB3 . . 3.370 2.977 2.572 3.435 0.065 20 0 "[ . 1 . 2]" 1
1312 1 81 ASP H 1 82 LYS H . . 4.020 3.681 3.385 3.867 . 0 0 "[ . 1 . 2]" 1
1313 1 81 ASP HA 1 82 LYS H . . 3.230 2.557 2.508 2.614 . 0 0 "[ . 1 . 2]" 1
1314 1 81 ASP HB2 1 82 LYS H . . 4.750 4.577 4.297 4.726 . 0 0 "[ . 1 . 2]" 1
1315 1 81 ASP HB3 1 82 LYS H . . 4.750 4.439 4.288 4.678 . 0 0 "[ . 1 . 2]" 1
1316 1 82 LYS H 1 82 LYS HB2 . . 3.470 3.345 3.192 3.480 0.010 1 0 "[ . 1 . 2]" 1
1317 1 82 LYS H 1 82 LYS HB3 . . 3.460 2.547 2.391 2.802 . 0 0 "[ . 1 . 2]" 1
1318 1 82 LYS HA 1 82 LYS HD2 . . 2.950 2.506 2.356 2.690 . 0 0 "[ . 1 . 2]" 1
1319 1 82 LYS HA 1 82 LYS HD3 . . 3.560 3.003 2.776 3.296 . 0 0 "[ . 1 . 2]" 1
1320 1 82 LYS HA 1 82 LYS HG2 . . 4.150 3.890 3.833 3.931 . 0 0 "[ . 1 . 2]" 1
1321 1 82 LYS HA 1 83 ILE H . . 2.840 2.206 2.178 2.248 . 0 0 "[ . 1 . 2]" 1
1322 1 82 LYS HB2 1 82 LYS HD3 . . 4.000 2.324 2.235 2.401 . 0 0 "[ . 1 . 2]" 1
1323 1 82 LYS HB2 1 103 TRP HH2 . . 4.350 2.242 1.995 2.713 . 0 0 "[ . 1 . 2]" 1
1324 1 82 LYS HB2 1 103 TRP HZ2 . . 3.780 2.401 2.072 2.785 . 0 0 "[ . 1 . 2]" 1
1325 1 82 LYS HD2 1 83 ILE H . . 3.450 2.226 1.946 2.767 . 0 0 "[ . 1 . 2]" 1
1326 1 82 LYS HD3 1 83 ILE H . . 4.330 3.751 3.450 4.068 . 0 0 "[ . 1 . 2]" 1
1327 1 82 LYS HD3 1 103 TRP HE1 . . 4.440 4.033 3.683 4.440 0.000 12 0 "[ . 1 . 2]" 1
1328 1 82 LYS HE2 1 82 LYS HG2 . . 3.620 2.429 2.181 2.631 . 0 0 "[ . 1 . 2]" 1
1329 1 82 LYS HE2 1 100 PHE QD . . 4.150 3.846 3.296 4.147 . 0 0 "[ . 1 . 2]" 1
1330 1 82 LYS HE2 1 104 PHE QE . . 4.000 3.741 3.159 4.023 0.023 10 0 "[ . 1 . 2]" 1
1331 1 82 LYS HE3 1 82 LYS HG2 . . 3.780 2.899 2.676 3.120 . 0 0 "[ . 1 . 2]" 1
1332 1 82 LYS HE3 1 82 LYS HG3 . . 3.560 2.680 2.472 2.970 . 0 0 "[ . 1 . 2]" 1
1333 1 82 LYS HE3 1 100 PHE QD . . 4.150 3.181 2.662 3.580 . 0 0 "[ . 1 . 2]" 1
1334 1 82 LYS HE3 1 104 PHE QE . . 3.880 3.915 3.687 4.018 0.138 5 0 "[ . 1 . 2]" 1
1335 1 82 LYS HG2 1 104 PHE QE . . 3.700 3.343 3.190 3.548 . 0 0 "[ . 1 . 2]" 1
1336 1 82 LYS HG3 1 83 ILE H . . 4.380 3.131 2.661 3.556 . 0 0 "[ . 1 . 2]" 1
1337 1 83 ILE H 1 83 ILE HB . . 3.200 2.422 2.342 2.554 . 0 0 "[ . 1 . 2]" 1
1338 1 83 ILE H 1 83 ILE HG12 . . 3.880 2.679 2.056 3.861 . 0 0 "[ . 1 . 2]" 1
1339 1 83 ILE H 1 83 ILE HG13 . . 3.700 3.495 2.872 3.695 . 0 0 "[ . 1 . 2]" 1
1340 1 83 ILE H 1 83 ILE MG . . 4.130 3.736 3.698 3.790 . 0 0 "[ . 1 . 2]" 1
1341 1 83 ILE H 1 84 ILE H . . 4.920 4.211 3.927 4.451 . 0 0 "[ . 1 . 2]" 1
1342 1 83 ILE HA 1 83 ILE MD . . 3.330 2.431 1.973 3.575 0.245 6 0 "[ . 1 . 2]" 1
1343 1 83 ILE HA 1 83 ILE HG12 . . 3.560 2.840 2.224 3.558 . 0 0 "[ . 1 . 2]" 1
1344 1 83 ILE HA 1 83 ILE HG13 . . 4.000 3.606 2.350 3.823 . 0 0 "[ . 1 . 2]" 1
1345 1 83 ILE HA 1 83 ILE MG . . 2.950 2.397 2.226 2.545 . 0 0 "[ . 1 . 2]" 1
1346 1 83 ILE HA 1 84 ILE H . . 2.840 2.226 2.177 2.322 . 0 0 "[ . 1 . 2]" 1
1347 1 83 ILE HA 1 84 ILE HB . . 4.350 4.475 4.438 4.524 0.174 20 0 "[ . 1 . 2]" 1
1348 1 83 ILE HA 1 84 ILE HG13 . . 4.000 4.045 4.013 4.077 0.077 5 0 "[ . 1 . 2]" 1
1349 1 83 ILE HB 1 83 ILE MD . . 3.290 3.039 2.066 3.215 . 0 0 "[ . 1 . 2]" 1
1350 1 83 ILE HG13 1 83 ILE MG . . 2.920 2.616 2.336 3.186 0.266 6 0 "[ . 1 . 2]" 1
1351 1 83 ILE MG 1 84 ILE H . . 3.510 3.236 2.817 3.541 0.031 13 0 "[ . 1 . 2]" 1
1352 1 84 ILE H 1 84 ILE HB . . 3.370 2.359 2.286 2.494 . 0 0 "[ . 1 . 2]" 1
1353 1 84 ILE H 1 84 ILE MD . . 4.260 3.723 3.506 3.922 . 0 0 "[ . 1 . 2]" 1
1354 1 84 ILE H 1 84 ILE HG12 . . 3.880 3.375 3.022 3.661 . 0 0 "[ . 1 . 2]" 1
1355 1 84 ILE H 1 84 ILE HG13 . . 3.460 2.286 1.933 2.617 . 0 0 "[ . 1 . 2]" 1
1356 1 84 ILE H 1 84 ILE MG . . 4.000 3.694 3.673 3.716 . 0 0 "[ . 1 . 2]" 1
1357 1 84 ILE HA 1 84 ILE MD . . 4.000 3.739 3.678 3.790 . 0 0 "[ . 1 . 2]" 1
1358 1 84 ILE HA 1 84 ILE HG12 . . 3.620 2.391 2.322 2.464 . 0 0 "[ . 1 . 2]" 1
1359 1 84 ILE HA 1 84 ILE HG13 . . 3.620 3.050 2.952 3.157 . 0 0 "[ . 1 . 2]" 1
1360 1 84 ILE HA 1 84 ILE MG . . 3.060 2.531 2.493 2.557 . 0 0 "[ . 1 . 2]" 1
1361 1 84 ILE HA 1 85 PRO HD2 . . 3.150 2.437 2.242 2.558 . 0 0 "[ . 1 . 2]" 1
1362 1 84 ILE HA 1 85 PRO HG3 . . 4.150 4.197 4.182 4.217 0.067 15 0 "[ . 1 . 2]" 1
1363 1 84 ILE HA 1 89 LEU MD1 . . 4.350 3.992 3.562 4.363 0.013 18 0 "[ . 1 . 2]" 1
1364 1 84 ILE HA 1 104 PHE QE . . 4.000 4.021 3.947 4.066 0.066 20 0 "[ . 1 . 2]" 1
1365 1 84 ILE HB 1 84 ILE MD . . 3.060 2.370 2.286 2.450 . 0 0 "[ . 1 . 2]" 1
1366 1 84 ILE HB 1 86 VAL MG2 . . 3.290 2.744 2.675 2.793 . 0 0 "[ . 1 . 2]" 1
1367 1 84 ILE MD 1 84 ILE MG . . 2.920 1.982 1.853 2.110 . 0 0 "[ . 1 . 2]" 1
1368 1 84 ILE MD 1 104 PHE QE . . 3.780 2.770 2.427 3.011 . 0 0 "[ . 1 . 2]" 1
1369 1 84 ILE MD 1 104 PHE HZ . . 3.230 1.990 1.823 2.176 . 0 0 "[ . 1 . 2]" 1
1370 1 84 ILE HG12 1 84 ILE MG . . 3.620 2.474 2.387 2.593 . 0 0 "[ . 1 . 2]" 1
1371 1 84 ILE HG12 1 104 PHE QE . . 3.700 2.268 2.007 2.466 . 0 0 "[ . 1 . 2]" 1
1372 1 84 ILE HG12 1 104 PHE HZ . . 3.780 3.253 3.117 3.383 . 0 0 "[ . 1 . 2]" 1
1373 1 84 ILE HG13 1 84 ILE MG . . 3.410 3.231 3.220 3.237 . 0 0 "[ . 1 . 2]" 1
1374 1 84 ILE HG13 1 104 PHE QE . . 4.000 3.736 3.390 3.992 . 0 0 "[ . 1 . 2]" 1
1375 1 84 ILE HG13 1 104 PHE HZ . . 4.660 4.023 3.714 4.302 . 0 0 "[ . 1 . 2]" 1
1376 1 84 ILE MG 1 85 PRO HD2 . . 3.260 2.072 1.765 2.713 . 0 0 "[ . 1 . 2]" 1
1377 1 84 ILE MG 1 85 PRO HD3 . . 3.700 3.143 2.873 3.657 . 0 0 "[ . 1 . 2]" 1
1378 1 84 ILE MG 1 86 VAL H . . 3.700 2.450 2.089 2.958 . 0 0 "[ . 1 . 2]" 1
1379 1 84 ILE MG 1 86 VAL HA . . 3.510 3.213 3.084 3.346 . 0 0 "[ . 1 . 2]" 1
1380 1 84 ILE MG 1 86 VAL HB . . 4.150 3.810 3.622 4.106 . 0 0 "[ . 1 . 2]" 1
1381 1 84 ILE MG 1 86 VAL MG2 . . 2.890 1.746 1.646 1.846 . 0 0 "[ . 1 . 2]" 1
1382 1 84 ILE MG 1 89 LEU MD1 . . 2.930 2.194 1.883 2.480 . 0 0 "[ . 1 . 2]" 1
1383 1 84 ILE MG 1 89 LEU HG . . 4.150 3.895 3.566 4.085 . 0 0 "[ . 1 . 2]" 1
1384 1 84 ILE MG 1 104 PHE QE . . 3.780 3.516 3.386 3.658 . 0 0 "[ . 1 . 2]" 1
1385 1 84 ILE MG 1 104 PHE HZ . . 4.150 4.005 3.835 4.166 0.016 11 0 "[ . 1 . 2]" 1
1386 1 85 PRO HA 1 86 VAL H . . 3.280 3.175 2.477 3.540 0.260 19 0 "[ . 1 . 2]" 1
1387 1 85 PRO HA 1 86 VAL MG2 . . 4.000 4.024 3.968 4.050 0.050 11 0 "[ . 1 . 2]" 1
1388 1 85 PRO HB2 1 88 LYS H . . 4.310 2.838 2.359 3.498 . 0 0 "[ . 1 . 2]" 1
1389 1 85 PRO HB2 1 88 LYS QB . . 3.780 2.010 1.953 2.163 . 0 0 "[ . 1 . 2]" 1
1390 1 85 PRO HB2 1 88 LYS QE . . 4.000 4.034 3.588 4.308 0.308 12 0 "[ . 1 . 2]" 1
1391 1 85 PRO HB2 1 89 LEU H . . 4.660 3.028 2.867 3.424 . 0 0 "[ . 1 . 2]" 1
1392 1 85 PRO HB2 1 89 LEU HG . . 4.150 2.974 2.765 3.540 . 0 0 "[ . 1 . 2]" 1
1393 1 85 PRO HD2 1 89 LEU MD1 . . 3.560 2.064 1.951 2.256 . 0 0 "[ . 1 . 2]" 1
1394 1 85 PRO HD2 1 100 PHE QD . . 4.350 2.534 1.991 2.896 . 0 0 "[ . 1 . 2]" 1
1395 1 85 PRO HD3 1 89 LEU MD1 . . 3.880 3.509 3.419 3.571 . 0 0 "[ . 1 . 2]" 1
1396 1 85 PRO HD3 1 100 PHE QD . . 4.000 2.205 1.981 2.536 . 0 0 "[ . 1 . 2]" 1
1397 1 85 PRO HG2 1 89 LEU MD1 . . 3.620 2.504 2.165 2.755 . 0 0 "[ . 1 . 2]" 1
1398 1 85 PRO HG2 1 89 LEU HG . . 3.880 2.123 1.914 2.421 . 0 0 "[ . 1 . 2]" 1
1399 1 85 PRO HG3 1 88 LYS HD3 . . 4.350 3.733 2.921 4.347 . 0 0 "[ . 1 . 2]" 1
1400 1 85 PRO HG3 1 89 LEU MD1 . . 3.880 3.738 3.456 3.943 0.063 10 0 "[ . 1 . 2]" 1
1401 1 85 PRO HG3 1 89 LEU HG . . 4.000 3.819 3.578 4.105 0.105 15 0 "[ . 1 . 2]" 1
1402 1 86 VAL H 1 86 VAL HB . . 3.340 3.187 2.455 3.594 0.254 19 0 "[ . 1 . 2]" 1
1403 1 86 VAL H 1 86 VAL MG2 . . 2.790 2.440 1.890 2.757 . 0 0 "[ . 1 . 2]" 1
1404 1 86 VAL HA 1 86 VAL MG1 . . 3.100 2.357 2.284 2.497 . 0 0 "[ . 1 . 2]" 1
1405 1 86 VAL HA 1 86 VAL MG2 . . 2.850 2.343 2.262 2.412 . 0 0 "[ . 1 . 2]" 1
1406 1 86 VAL HA 1 88 LYS H . . 4.150 3.917 3.723 4.214 0.064 18 0 "[ . 1 . 2]" 1
1407 1 86 VAL HA 1 89 LEU H . . 3.700 3.103 2.867 3.332 . 0 0 "[ . 1 . 2]" 1
1408 1 86 VAL HA 1 89 LEU HB2 . . 3.510 2.246 2.056 2.470 . 0 0 "[ . 1 . 2]" 1
1409 1 86 VAL HA 1 89 LEU HB3 . . 4.350 3.911 3.702 4.148 . 0 0 "[ . 1 . 2]" 1
1410 1 86 VAL HA 1 89 LEU MD1 . . 3.510 2.493 2.187 2.842 . 0 0 "[ . 1 . 2]" 1
1411 1 86 VAL HA 1 89 LEU HG . . 3.780 3.403 2.915 3.859 0.079 2 0 "[ . 1 . 2]" 1
1412 1 86 VAL HA 1 90 VAL H . . 4.860 3.158 2.957 3.828 . 0 0 "[ . 1 . 2]" 1
1413 1 86 VAL HA 1 90 VAL MG1 . . 4.000 2.924 2.692 3.071 . 0 0 "[ . 1 . 2]" 1
1414 1 86 VAL HA 1 90 VAL MG2 . . 4.150 4.003 3.826 4.191 0.041 13 0 "[ . 1 . 2]" 1
1415 1 86 VAL HB 1 87 ASP H . . 2.980 2.074 1.938 2.283 . 0 0 "[ . 1 . 2]" 1
1416 1 86 VAL MG1 1 87 ASP H . . 3.510 2.886 2.624 3.263 . 0 0 "[ . 1 . 2]" 1
1417 1 86 VAL MG1 1 87 ASP HA . . 3.700 3.260 3.088 3.517 . 0 0 "[ . 1 . 2]" 1
1418 1 86 VAL MG1 1 90 VAL H . . 4.150 3.502 3.307 3.999 . 0 0 "[ . 1 . 2]" 1
1419 1 86 VAL MG1 1 90 VAL MG1 . . 2.980 1.826 1.655 2.129 . 0 0 "[ . 1 . 2]" 1
1420 1 86 VAL MG1 1 90 VAL MG2 . . 3.000 2.646 2.410 2.847 . 0 0 "[ . 1 . 2]" 1
1421 1 86 VAL MG2 1 89 LEU MD1 . . 4.150 2.888 2.621 3.152 . 0 0 "[ . 1 . 2]" 1
1422 1 87 ASP H 1 87 ASP HB2 . . 3.290 2.170 2.031 2.954 . 0 0 "[ . 1 . 2]" 1
1423 1 87 ASP H 1 87 ASP HB3 . . 3.370 3.046 2.577 3.498 0.128 12 0 "[ . 1 . 2]" 1
1424 1 87 ASP H 1 88 LYS H . . 3.450 2.886 2.776 3.016 . 0 0 "[ . 1 . 2]" 1
1425 1 87 ASP H 1 89 LEU H . . 4.810 4.413 4.019 4.722 . 0 0 "[ . 1 . 2]" 1
1426 1 87 ASP HA 1 87 ASP HB3 . . 2.980 2.970 2.385 3.056 0.076 20 0 "[ . 1 . 2]" 1
1427 1 87 ASP HA 1 90 VAL H . . 4.150 3.996 3.571 4.187 0.037 10 0 "[ . 1 . 2]" 1
1428 1 87 ASP HA 1 90 VAL MG1 . . 4.150 3.572 3.327 3.837 . 0 0 "[ . 1 . 2]" 1
1429 1 87 ASP HA 1 90 VAL MG2 . . 3.100 2.012 1.889 2.139 . 0 0 "[ . 1 . 2]" 1
1430 1 87 ASP HB2 1 88 LYS H . . 3.700 3.588 2.738 4.036 0.336 2 0 "[ . 1 . 2]" 1
1431 1 87 ASP HB3 1 88 LYS H . . 4.000 3.000 2.642 4.029 0.029 12 0 "[ . 1 . 2]" 1
1432 1 88 LYS H 1 88 LYS QB . . 3.140 2.549 2.352 2.668 . 0 0 "[ . 1 . 2]" 1
1433 1 88 LYS H 1 88 LYS HG2 . . 3.730 3.329 2.942 3.977 0.247 11 0 "[ . 1 . 2]" 1
1434 1 88 LYS H 1 88 LYS HG3 . . 3.730 2.175 1.933 3.043 . 0 0 "[ . 1 . 2]" 1
1435 1 88 LYS H 1 89 LEU H . . 3.150 2.378 2.125 2.596 . 0 0 "[ . 1 . 2]" 1
1436 1 88 LYS H 1 90 VAL MG2 . . 4.620 3.752 3.537 3.953 . 0 0 "[ . 1 . 2]" 1
1437 1 88 LYS HA 1 88 LYS QE . . 4.000 3.886 3.673 4.051 0.051 11 0 "[ . 1 . 2]" 1
1438 1 88 LYS HA 1 88 LYS HG2 . . 3.330 2.716 2.514 3.366 0.036 11 0 "[ . 1 . 2]" 1
1439 1 88 LYS HA 1 88 LYS HG3 . . 3.700 3.107 2.271 3.373 . 0 0 "[ . 1 . 2]" 1
1440 1 88 LYS HA 1 91 LYS H . . 4.470 3.309 2.954 3.571 . 0 0 "[ . 1 . 2]" 1
1441 1 88 LYS HA 1 91 LYS QG . . 3.780 3.392 2.352 3.819 0.039 20 0 "[ . 1 . 2]" 1
1442 1 88 LYS QB 1 89 LEU H . . 3.560 2.560 2.262 2.968 . 0 0 "[ . 1 . 2]" 1
1443 1 88 LYS QE 1 88 LYS HG2 . . 3.780 2.423 2.169 2.993 . 0 0 "[ . 1 . 2]" 1
1444 1 89 LEU H 1 89 LEU HB2 . . 3.410 2.510 2.385 2.628 . 0 0 "[ . 1 . 2]" 1
1445 1 89 LEU H 1 89 LEU HB3 . . 3.620 3.541 3.530 3.575 . 0 0 "[ . 1 . 2]" 1
1446 1 89 LEU H 1 89 LEU MD1 . . 3.460 3.438 3.324 3.502 0.042 2 0 "[ . 1 . 2]" 1
1447 1 89 LEU H 1 89 LEU MD2 . . 3.510 3.274 2.961 3.514 0.004 13 0 "[ . 1 . 2]" 1
1448 1 89 LEU H 1 89 LEU HG . . 3.270 2.097 1.914 2.315 . 0 0 "[ . 1 . 2]" 1
1449 1 89 LEU HA 1 89 LEU MD1 . . 4.150 3.908 3.854 3.956 . 0 0 "[ . 1 . 2]" 1
1450 1 89 LEU HA 1 89 LEU MD2 . . 2.900 2.225 2.045 2.383 . 0 0 "[ . 1 . 2]" 1
1451 1 89 LEU HA 1 89 LEU HG . . 4.150 3.046 2.874 3.240 . 0 0 "[ . 1 . 2]" 1
1452 1 89 LEU HA 1 97 ASN HD21 . . 3.780 2.669 2.042 3.492 . 0 0 "[ . 1 . 2]" 1
1453 1 89 LEU HA 1 97 ASN HD22 . . 3.510 2.233 1.953 2.789 . 0 0 "[ . 1 . 2]" 1
1454 1 89 LEU HB2 1 89 LEU MD1 . . 3.170 2.247 2.143 2.343 . 0 0 "[ . 1 . 2]" 1
1455 1 89 LEU HB3 1 89 LEU MD1 . . 3.460 2.491 2.405 2.530 . 0 0 "[ . 1 . 2]" 1
1456 1 89 LEU MD1 1 100 PHE QB . . 4.000 3.485 3.226 3.663 . 0 0 "[ . 1 . 2]" 1
1457 1 89 LEU MD1 1 100 PHE QD . . 3.700 2.989 2.737 3.183 . 0 0 "[ . 1 . 2]" 1
1458 1 89 LEU MD1 1 100 PHE QE . . 3.880 2.779 2.580 2.945 . 0 0 "[ . 1 . 2]" 1
1459 1 89 LEU MD2 1 96 ASP HB3 . . 3.120 3.035 2.708 3.150 0.030 13 0 "[ . 1 . 2]" 1
1460 1 89 LEU MD2 1 97 ASN HA . . 3.080 1.937 1.824 2.084 . 0 0 "[ . 1 . 2]" 1
1461 1 89 LEU MD2 1 97 ASN HD21 . . 5.060 2.917 2.097 3.870 . 0 0 "[ . 1 . 2]" 1
1462 1 89 LEU MD2 1 100 PHE H . . 4.150 4.195 4.158 4.246 0.096 18 0 "[ . 1 . 2]" 1
1463 1 89 LEU MD2 1 100 PHE QB . . 3.080 2.368 2.224 2.528 . 0 0 "[ . 1 . 2]" 1
1464 1 89 LEU MD2 1 100 PHE QD . . 3.510 2.935 2.708 3.196 . 0 0 "[ . 1 . 2]" 1
1465 1 89 LEU MD2 1 100 PHE QE . . 4.350 3.840 3.540 4.130 . 0 0 "[ . 1 . 2]" 1
1466 1 89 LEU HG 1 96 ASP HB3 . . 4.350 4.140 3.458 4.379 0.029 12 0 "[ . 1 . 2]" 1
1467 1 90 VAL H 1 90 VAL HB . . 4.150 3.536 3.508 3.660 . 0 0 "[ . 1 . 2]" 1
1468 1 90 VAL H 1 90 VAL MG1 . . 2.950 2.184 1.923 2.604 . 0 0 "[ . 1 . 2]" 1
1469 1 90 VAL H 1 90 VAL MG2 . . 2.930 2.149 1.935 2.369 . 0 0 "[ . 1 . 2]" 1
1470 1 90 VAL H 1 91 LYS H . . 3.690 2.628 2.416 2.768 . 0 0 "[ . 1 . 2]" 1
1471 1 90 VAL H 1 91 LYS QG . . 4.660 4.622 3.927 4.745 0.085 14 0 "[ . 1 . 2]" 1
1472 1 90 VAL HA 1 90 VAL HB . . 3.020 2.422 2.377 2.460 . 0 0 "[ . 1 . 2]" 1
1473 1 90 VAL HA 1 90 VAL MG1 . . 2.980 2.330 2.233 2.496 . 0 0 "[ . 1 . 2]" 1
1474 1 90 VAL HA 1 90 VAL MG2 . . 3.410 3.208 3.205 3.215 . 0 0 "[ . 1 . 2]" 1
1475 1 90 VAL HB 1 91 LYS H . . 4.860 4.084 3.887 4.553 . 0 0 "[ . 1 . 2]" 1
1476 1 90 VAL MG1 1 91 LYS H . . 4.620 4.003 3.864 4.269 . 0 0 "[ . 1 . 2]" 1
1477 1 90 VAL MG2 1 91 LYS H . . 3.330 2.190 1.911 3.220 . 0 0 "[ . 1 . 2]" 1
1478 1 90 VAL MG2 1 91 LYS QG . . 3.290 2.561 2.316 3.212 . 0 0 "[ . 1 . 2]" 1
1479 1 91 LYS H 1 91 LYS HB2 . . 3.240 2.195 2.143 2.373 . 0 0 "[ . 1 . 2]" 1
1480 1 91 LYS H 1 91 LYS HB3 . . 3.560 3.469 3.409 3.553 . 0 0 "[ . 1 . 2]" 1
1481 1 91 LYS H 1 91 LYS QG . . 3.240 2.853 2.630 3.245 0.005 13 0 "[ . 1 . 2]" 1
1482 1 91 LYS H 1 92 GLY H . . 3.500 2.428 1.927 2.758 . 0 0 "[ . 1 . 2]" 1
1483 1 91 LYS H 1 92 GLY HA2 . . 4.710 4.650 4.140 4.791 0.081 16 0 "[ . 1 . 2]" 1
1484 1 91 LYS HA 1 91 LYS HB3 . . 2.980 2.649 2.597 2.719 . 0 0 "[ . 1 . 2]" 1
1485 1 91 LYS HA 1 91 LYS QG . . 2.950 2.326 2.087 2.599 . 0 0 "[ . 1 . 2]" 1
1486 1 91 LYS HB2 1 92 GLY H . . 4.130 3.440 3.048 4.174 0.044 5 0 "[ . 1 . 2]" 1
1487 1 91 LYS HB3 1 91 LYS QE . . 3.620 2.948 2.145 3.620 0.000 16 0 "[ . 1 . 2]" 1
1488 1 91 LYS QE 1 91 LYS QG . . 3.410 2.134 1.962 2.350 . 0 0 "[ . 1 . 2]" 1
1489 1 91 LYS QG 1 92 GLY H . . 4.750 4.536 4.406 4.627 . 0 0 "[ . 1 . 2]" 1
1490 1 92 GLY H 1 93 LYS H . . 3.740 2.946 2.202 3.644 . 0 0 "[ . 1 . 2]" 1
1491 1 92 GLY H 1 93 LYS HG3 . . 4.990 4.807 3.605 5.318 0.328 7 0 "[ . 1 . 2]" 1
1492 1 92 GLY H 1 97 ASN HD22 . . 4.150 3.731 3.230 4.161 0.011 15 0 "[ . 1 . 2]" 1
1493 1 92 GLY HA2 1 97 ASN HD22 . . 4.150 3.062 2.314 3.788 . 0 0 "[ . 1 . 2]" 1
1494 1 93 LYS H 1 93 LYS HB2 . . 3.320 2.508 2.222 3.952 0.632 7 1 "[ . + 1 . 2]" 1
1495 1 93 LYS H 1 93 LYS HG2 . . 3.880 3.297 2.838 3.756 . 0 0 "[ . 1 . 2]" 1
1496 1 93 LYS H 1 93 LYS HG3 . . 3.850 3.370 2.524 3.850 0.000 14 0 "[ . 1 . 2]" 1
1497 1 93 LYS H 1 97 ASN HD21 . . 4.620 2.717 2.056 3.578 . 0 0 "[ . 1 . 2]" 1
1498 1 93 LYS H 1 97 ASN HD22 . . 4.330 3.697 2.574 4.334 0.004 14 0 "[ . 1 . 2]" 1
1499 1 93 LYS HA 1 93 LYS HG2 . . 3.880 2.440 2.027 4.110 0.230 7 0 "[ . 1 . 2]" 1
1500 1 93 LYS HA 1 94 PHE H . . 3.390 2.844 2.254 3.333 . 0 0 "[ . 1 . 2]" 1
1501 1 93 LYS HB2 1 93 LYS HG3 . . 3.020 2.345 2.264 2.881 . 0 0 "[ . 1 . 2]" 1
1502 1 94 PHE H 1 94 PHE HB2 . . 3.410 2.911 2.403 3.278 . 0 0 "[ . 1 . 2]" 1
1503 1 94 PHE H 1 94 PHE HB3 . . 3.660 2.976 1.967 3.734 0.074 3 0 "[ . 1 . 2]" 1
1504 1 94 PHE HA 1 94 PHE QD . . 3.200 2.831 2.605 3.118 . 0 0 "[ . 1 . 2]" 1
1505 1 94 PHE HB2 1 95 GLN H . . 4.020 3.718 3.349 4.057 0.037 16 0 "[ . 1 . 2]" 1
1506 1 94 PHE HB3 1 95 GLN H . . 3.370 2.448 1.928 3.240 . 0 0 "[ . 1 . 2]" 1
1507 1 94 PHE QD 1 95 GLN H . . 3.780 2.615 1.930 3.378 . 0 0 "[ . 1 . 2]" 1
1508 1 94 PHE QD 1 95 GLN HA . . 3.330 3.270 3.011 3.457 0.127 15 0 "[ . 1 . 2]" 1
1509 1 94 PHE QD 1 95 GLN QB . . 4.150 3.107 2.419 3.983 . 0 0 "[ . 1 . 2]" 1
1510 1 95 GLN H 1 95 GLN QB . . 3.330 2.326 2.009 3.007 . 0 0 "[ . 1 . 2]" 1
1511 1 95 GLN H 1 96 ASP H . . 3.970 3.040 2.641 3.883 . 0 0 "[ . 1 . 2]" 1
1512 1 95 GLN HA 1 95 GLN HG2 . . 3.780 3.258 2.364 3.870 0.090 18 0 "[ . 1 . 2]" 1
1513 1 95 GLN HA 1 95 GLN HG3 . . 4.000 2.630 1.995 3.546 . 0 0 "[ . 1 . 2]" 1
1514 1 95 GLN HA 1 97 ASN H . . 4.280 3.684 3.516 3.866 . 0 0 "[ . 1 . 2]" 1
1515 1 95 GLN HA 1 98 PHE H . . 4.210 3.234 2.833 3.577 . 0 0 "[ . 1 . 2]" 1
1516 1 95 GLN HA 1 98 PHE HB3 . . 3.460 2.865 2.234 3.468 0.008 20 0 "[ . 1 . 2]" 1
1517 1 95 GLN QB 1 96 ASP H . . 3.330 2.463 2.169 3.211 . 0 0 "[ . 1 . 2]" 1
1518 1 96 ASP H 1 96 ASP HB2 . . 3.370 2.121 2.009 2.353 . 0 0 "[ . 1 . 2]" 1
1519 1 96 ASP H 1 96 ASP HB3 . . 3.620 3.294 3.011 3.540 . 0 0 "[ . 1 . 2]" 1
1520 1 96 ASP H 1 97 ASN H . . 3.560 2.646 2.505 2.824 . 0 0 "[ . 1 . 2]" 1
1521 1 96 ASP HA 1 96 ASP HB3 . . 3.000 2.827 2.649 2.963 . 0 0 "[ . 1 . 2]" 1
1522 1 96 ASP HA 1 99 GLU H . . 4.150 3.593 3.296 3.927 . 0 0 "[ . 1 . 2]" 1
1523 1 96 ASP HA 1 99 GLU HB2 . . 3.560 2.884 2.538 3.276 . 0 0 "[ . 1 . 2]" 1
1524 1 96 ASP HB2 1 97 ASN H . . 4.000 3.564 3.016 4.014 0.014 15 0 "[ . 1 . 2]" 1
1525 1 96 ASP HB3 1 97 ASN H . . 4.000 3.747 3.270 4.047 0.047 17 0 "[ . 1 . 2]" 1
1526 1 97 ASN H 1 97 ASN HB2 . . 3.320 2.187 2.111 2.443 . 0 0 "[ . 1 . 2]" 1
1527 1 97 ASN H 1 97 ASN HB3 . . 3.360 3.206 3.034 3.383 0.023 1 0 "[ . 1 . 2]" 1
1528 1 97 ASN H 1 97 ASN HD21 . . 3.820 3.514 2.767 3.837 0.017 15 0 "[ . 1 . 2]" 1
1529 1 97 ASN H 1 98 PHE H . . 3.450 2.174 1.892 2.407 . 0 0 "[ . 1 . 2]" 1
1530 1 97 ASN H 1 98 PHE HB2 . . 4.610 4.306 4.105 4.531 . 0 0 "[ . 1 . 2]" 1
1531 1 97 ASN H 1 98 PHE HB3 . . 4.350 4.321 3.960 4.432 0.082 11 0 "[ . 1 . 2]" 1
1532 1 97 ASN H 1 99 GLU H . . 4.810 3.537 3.097 3.846 . 0 0 "[ . 1 . 2]" 1
1533 1 97 ASN HB2 1 97 ASN HD21 . . 3.620 2.203 2.122 2.471 . 0 0 "[ . 1 . 2]" 1
1534 1 97 ASN HB2 1 97 ASN HD22 . . 4.120 3.487 3.454 3.602 . 0 0 "[ . 1 . 2]" 1
1535 1 97 ASN HB2 1 98 PHE H . . 4.350 3.129 2.719 3.439 . 0 0 "[ . 1 . 2]" 1
1536 1 97 ASN HB3 1 98 PHE H . . 4.310 3.036 2.531 3.487 . 0 0 "[ . 1 . 2]" 1
1537 1 98 PHE H 1 98 PHE HB2 . . 3.330 2.354 2.167 2.544 . 0 0 "[ . 1 . 2]" 1
1538 1 98 PHE H 1 98 PHE HB3 . . 3.320 2.434 2.350 2.544 . 0 0 "[ . 1 . 2]" 1
1539 1 98 PHE H 1 98 PHE QD . . 4.470 4.088 4.038 4.132 . 0 0 "[ . 1 . 2]" 1
1540 1 98 PHE H 1 99 GLU H . . 3.660 2.432 2.185 2.760 . 0 0 "[ . 1 . 2]" 1
1541 1 98 PHE H 1 100 PHE H . . 4.860 3.685 3.465 3.868 . 0 0 "[ . 1 . 2]" 1
1542 1 98 PHE HA 1 98 PHE QD . . 3.260 3.164 3.118 3.217 . 0 0 "[ . 1 . 2]" 1
1543 1 98 PHE HA 1 101 VAL MG1 . . 2.820 1.851 1.780 1.928 . 0 0 "[ . 1 . 2]" 1
1544 1 98 PHE HB2 1 99 GLU H . . 4.000 3.797 3.662 3.908 . 0 0 "[ . 1 . 2]" 1
1545 1 98 PHE HB3 1 99 GLU H . . 3.700 2.604 2.422 2.751 . 0 0 "[ . 1 . 2]" 1
1546 1 98 PHE HB3 1 100 PHE H . . 4.750 4.595 4.462 4.728 . 0 0 "[ . 1 . 2]" 1
1547 1 98 PHE QD 1 99 GLU H . . 4.620 3.619 3.531 3.725 . 0 0 "[ . 1 . 2]" 1
1548 1 98 PHE QD 1 101 VAL MG1 . . 3.510 3.520 3.387 3.661 0.151 14 0 "[ . 1 . 2]" 1
1549 1 99 GLU H 1 99 GLU HB2 . . 3.220 2.483 2.456 2.544 . 0 0 "[ . 1 . 2]" 1
1550 1 99 GLU H 1 99 GLU QG . . 3.340 2.162 2.055 2.271 . 0 0 "[ . 1 . 2]" 1
1551 1 99 GLU H 1 100 PHE H . . 3.470 2.522 2.370 2.626 . 0 0 "[ . 1 . 2]" 1
1552 1 99 GLU H 1 100 PHE QB . . 4.860 3.984 3.882 4.099 . 0 0 "[ . 1 . 2]" 1
1553 1 99 GLU HA 1 99 GLU QG . . 3.460 2.655 2.356 2.812 . 0 0 "[ . 1 . 2]" 1
1554 1 99 GLU HA 1 102 GLN HE21 . . 4.150 2.423 1.946 2.956 . 0 0 "[ . 1 . 2]" 1
1555 1 99 GLU HA 1 102 GLN HE22 . . 3.880 3.735 3.272 4.164 0.284 6 0 "[ . 1 . 2]" 1
1556 1 99 GLU HA 1 102 GLN HG2 . . 3.510 1.995 1.962 2.205 . 0 0 "[ . 1 . 2]" 1
1557 1 99 GLU HB2 1 99 GLU QG . . 2.560 2.244 2.192 2.392 . 0 0 "[ . 1 . 2]" 1
1558 1 99 GLU HB2 1 100 PHE H . . 3.550 3.492 3.360 3.614 0.064 11 0 "[ . 1 . 2]" 1
1559 1 99 GLU QG 1 100 PHE H . . 4.470 4.254 4.146 4.298 . 0 0 "[ . 1 . 2]" 1
1560 1 100 PHE H 1 100 PHE QB . . 3.090 2.100 2.046 2.177 . 0 0 "[ . 1 . 2]" 1
1561 1 100 PHE H 1 100 PHE QD . . 4.150 3.801 3.712 3.880 . 0 0 "[ . 1 . 2]" 1
1562 1 100 PHE H 1 101 VAL H . . 3.870 2.126 2.005 2.310 . 0 0 "[ . 1 . 2]" 1
1563 1 100 PHE HA 1 100 PHE QD . . 3.230 3.198 3.088 3.262 0.032 20 0 "[ . 1 . 2]" 1
1564 1 100 PHE HA 1 103 TRP H . . 4.170 3.627 3.455 3.762 . 0 0 "[ . 1 . 2]" 1
1565 1 100 PHE HA 1 103 TRP HB2 . . 4.150 4.042 3.897 4.155 0.005 13 0 "[ . 1 . 2]" 1
1566 1 100 PHE HA 1 103 TRP HB3 . . 4.150 3.057 2.833 3.173 . 0 0 "[ . 1 . 2]" 1
1567 1 100 PHE QB 1 101 VAL H . . 3.800 2.673 2.391 2.965 . 0 0 "[ . 1 . 2]" 1
1568 1 100 PHE QB 1 102 GLN H . . 5.140 4.816 4.552 5.148 0.008 17 0 "[ . 1 . 2]" 1
1569 1 100 PHE QD 1 101 VAL H . . 4.150 2.816 2.377 3.195 . 0 0 "[ . 1 . 2]" 1
1570 1 100 PHE QD 1 101 VAL HA . . 4.150 2.830 2.571 3.021 . 0 0 "[ . 1 . 2]" 1
1571 1 100 PHE QD 1 101 VAL MG1 . . 4.150 3.925 3.616 4.166 0.016 17 0 "[ . 1 . 2]" 1
1572 1 100 PHE QD 1 101 VAL MG2 . . 4.000 4.004 3.952 4.061 0.061 11 0 "[ . 1 . 2]" 1
1573 1 100 PHE QE 1 101 VAL HA . . 4.350 3.796 3.394 4.013 . 0 0 "[ . 1 . 2]" 1
1574 1 101 VAL H 1 101 VAL HB . . 3.460 2.528 2.436 2.633 . 0 0 "[ . 1 . 2]" 1
1575 1 101 VAL H 1 101 VAL MG1 . . 3.150 1.889 1.851 1.925 . 0 0 "[ . 1 . 2]" 1
1576 1 101 VAL H 1 101 VAL MG2 . . 4.150 3.716 3.698 3.742 . 0 0 "[ . 1 . 2]" 1
1577 1 101 VAL H 1 102 GLN H . . 3.720 2.554 2.318 2.832 . 0 0 "[ . 1 . 2]" 1
1578 1 101 VAL HA 1 101 VAL MG2 . . 3.060 2.397 2.347 2.445 . 0 0 "[ . 1 . 2]" 1
1579 1 101 VAL HA 1 104 PHE H . . 4.000 3.146 2.854 3.510 . 0 0 "[ . 1 . 2]" 1
1580 1 101 VAL HA 1 104 PHE HB2 . . 3.780 2.102 2.005 2.288 . 0 0 "[ . 1 . 2]" 1
1581 1 101 VAL HA 1 104 PHE HB3 . . 3.370 3.335 3.225 3.392 0.022 14 0 "[ . 1 . 2]" 1
1582 1 101 VAL HB 1 102 GLN H . . 4.510 3.920 3.772 4.159 . 0 0 "[ . 1 . 2]" 1
1583 1 101 VAL MG1 1 102 GLN H . . 3.150 1.860 1.773 2.067 . 0 0 "[ . 1 . 2]" 1
1584 1 101 VAL MG1 1 102 GLN HA . . 3.700 3.276 3.026 3.556 . 0 0 "[ . 1 . 2]" 1
1585 1 101 VAL MG1 1 102 GLN HG2 . . 4.000 3.806 3.584 4.004 0.004 15 0 "[ . 1 . 2]" 1
1586 1 101 VAL MG2 1 102 GLN H . . 4.750 3.594 3.385 3.780 . 0 0 "[ . 1 . 2]" 1
1587 1 101 VAL MG2 1 102 GLN HA . . 3.620 3.674 3.577 3.743 0.123 20 0 "[ . 1 . 2]" 1
1588 1 101 VAL MG2 1 104 PHE HB3 . . 3.880 3.666 3.540 3.874 . 0 0 "[ . 1 . 2]" 1
1589 1 102 GLN H 1 102 GLN HB3 . . 3.170 2.440 2.312 2.600 . 0 0 "[ . 1 . 2]" 1
1590 1 102 GLN H 1 102 GLN HG2 . . 3.410 2.694 2.382 3.041 . 0 0 "[ . 1 . 2]" 1
1591 1 102 GLN H 1 102 GLN HG3 . . 3.780 2.699 1.937 3.328 . 0 0 "[ . 1 . 2]" 1
1592 1 102 GLN HA 1 102 GLN HB3 . . 2.710 2.472 2.374 2.543 . 0 0 "[ . 1 . 2]" 1
1593 1 102 GLN HA 1 102 GLN HG3 . . 3.330 3.563 3.521 3.601 0.271 16 0 "[ . 1 . 2]" 1
1594 1 102 GLN HA 1 105 LYS H . . 4.150 3.732 3.438 3.990 . 0 0 "[ . 1 . 2]" 1
1595 1 102 GLN HE22 1 102 GLN HG2 . . 3.700 3.526 3.447 3.624 . 0 0 "[ . 1 . 2]" 1
1596 1 102 GLN HE22 1 102 GLN HG3 . . 4.150 3.928 3.660 4.156 0.006 19 0 "[ . 1 . 2]" 1
1597 1 102 GLN HG2 1 103 TRP H . . 4.750 3.355 2.863 3.823 . 0 0 "[ . 1 . 2]" 1
1598 1 102 GLN HG3 1 103 TRP H . . 3.530 2.204 1.930 2.526 . 0 0 "[ . 1 . 2]" 1
1599 1 102 GLN HG3 1 103 TRP HA . . 4.350 3.699 3.150 4.384 0.034 4 0 "[ . 1 . 2]" 1
1600 1 103 TRP H 1 103 TRP HB2 . . 3.380 2.749 2.579 2.871 . 0 0 "[ . 1 . 2]" 1
1601 1 103 TRP H 1 103 TRP HB3 . . 3.350 2.303 2.264 2.350 . 0 0 "[ . 1 . 2]" 1
1602 1 103 TRP H 1 103 TRP HE3 . . 4.580 4.100 3.908 4.322 . 0 0 "[ . 1 . 2]" 1
1603 1 103 TRP H 1 104 PHE H . . 3.890 2.509 2.191 2.841 . 0 0 "[ . 1 . 2]" 1
1604 1 103 TRP H 1 104 PHE HB2 . . 4.860 3.989 3.793 4.249 . 0 0 "[ . 1 . 2]" 1
1605 1 103 TRP HA 1 103 TRP HD1 . . 3.620 3.374 3.248 3.580 . 0 0 "[ . 1 . 2]" 1
1606 1 103 TRP HA 1 106 LYS H . . 4.000 3.459 3.143 3.751 . 0 0 "[ . 1 . 2]" 1
1607 1 103 TRP HA 1 106 LYS QB . . 3.370 2.532 2.276 2.916 . 0 0 "[ . 1 . 2]" 1
1608 1 103 TRP HB2 1 103 TRP HD1 . . 3.460 2.689 2.638 2.726 . 0 0 "[ . 1 . 2]" 1
1609 1 103 TRP HB2 1 103 TRP HE3 . . 4.000 4.092 4.058 4.137 0.137 17 0 "[ . 1 . 2]" 1
1610 1 103 TRP HB2 1 104 PHE H . . 4.150 3.918 3.766 4.156 0.006 17 0 "[ . 1 . 2]" 1
1611 1 103 TRP HB3 1 103 TRP HD1 . . 3.880 3.812 3.749 3.843 . 0 0 "[ . 1 . 2]" 1
1612 1 103 TRP HB3 1 103 TRP HE3 . . 4.000 2.579 2.515 2.703 . 0 0 "[ . 1 . 2]" 1
1613 1 103 TRP HB3 1 104 PHE H . . 4.000 2.525 2.287 2.939 . 0 0 "[ . 1 . 2]" 1
1614 1 103 TRP HE3 1 104 PHE H . . 4.000 2.236 2.015 2.619 . 0 0 "[ . 1 . 2]" 1
1615 1 103 TRP HE3 1 104 PHE HA . . 3.460 2.408 2.324 2.481 . 0 0 "[ . 1 . 2]" 1
1616 1 103 TRP HE3 1 104 PHE HB2 . . 3.620 3.284 3.174 3.364 . 0 0 "[ . 1 . 2]" 1
1617 1 103 TRP HE3 1 104 PHE QD . . 3.100 2.004 1.981 2.194 . 0 0 "[ . 1 . 2]" 1
1618 1 103 TRP HZ3 1 104 PHE QD . . 3.880 2.836 2.613 3.031 . 0 0 "[ . 1 . 2]" 1
1619 1 103 TRP HZ3 1 104 PHE QE . . 3.510 3.000 2.852 3.160 . 0 0 "[ . 1 . 2]" 1
1620 1 103 TRP HZ3 1 104 PHE HZ . . 4.150 4.149 4.073 4.177 0.027 3 0 "[ . 1 . 2]" 1
1621 1 104 PHE H 1 104 PHE HB2 . . 3.460 1.937 1.883 1.993 . 0 0 "[ . 1 . 2]" 1
1622 1 104 PHE H 1 104 PHE HB3 . . 3.560 3.260 3.113 3.319 . 0 0 "[ . 1 . 2]" 1
1623 1 104 PHE H 1 104 PHE QD . . 4.920 2.750 2.588 3.157 . 0 0 "[ . 1 . 2]" 1
1624 1 104 PHE HA 1 104 PHE QD . . 3.700 2.966 2.935 3.007 . 0 0 "[ . 1 . 2]" 1
1625 1 104 PHE HA 1 107 PHE H . . 4.440 3.810 3.565 4.010 . 0 0 "[ . 1 . 2]" 1
1626 1 104 PHE HA 1 107 PHE HB2 . . 3.700 3.421 2.788 3.755 0.055 2 0 "[ . 1 . 2]" 1
1627 1 104 PHE HA 1 107 PHE HB3 . . 4.000 3.130 2.774 3.542 . 0 0 "[ . 1 . 2]" 1
1628 1 104 PHE HB3 1 105 LYS H . . 3.930 2.849 2.428 3.269 . 0 0 "[ . 1 . 2]" 1
1629 1 104 PHE HB3 1 105 LYS HB2 . . 4.150 4.168 4.049 4.218 0.068 15 0 "[ . 1 . 2]" 1
1630 1 104 PHE QD 1 105 LYS H . . 4.860 4.549 4.310 4.766 . 0 0 "[ . 1 . 2]" 1
1631 1 105 LYS H 1 105 LYS HB2 . . 3.490 2.443 2.237 2.659 . 0 0 "[ . 1 . 2]" 1
1632 1 105 LYS H 1 105 LYS HB3 . . 3.590 2.523 2.388 2.734 . 0 0 "[ . 1 . 2]" 1
1633 1 105 LYS H 1 105 LYS HG3 . . 5.060 4.465 4.307 4.657 . 0 0 "[ . 1 . 2]" 1
1634 1 105 LYS H 1 106 LYS H . . 3.870 2.777 2.450 3.111 . 0 0 "[ . 1 . 2]" 1
1635 1 105 LYS HA 1 105 LYS HD3 . . 4.150 4.105 3.787 4.364 0.214 19 0 "[ . 1 . 2]" 1
1636 1 105 LYS HA 1 105 LYS HG2 . . 3.370 2.652 2.247 3.513 0.143 11 0 "[ . 1 . 2]" 1
1637 1 105 LYS HA 1 105 LYS HG3 . . 3.510 2.944 2.258 3.375 . 0 0 "[ . 1 . 2]" 1
1638 1 105 LYS HA 1 108 PHE H . . 4.150 3.429 3.181 3.664 . 0 0 "[ . 1 . 2]" 1
1639 1 105 LYS HA 1 108 PHE HB2 . . 3.700 2.255 2.041 2.481 . 0 0 "[ . 1 . 2]" 1
1640 1 105 LYS HA 1 108 PHE HB3 . . 3.880 3.567 3.338 3.889 0.009 18 0 "[ . 1 . 2]" 1
1641 1 105 LYS HB2 1 105 LYS HD3 . . 4.000 3.388 2.170 4.003 0.003 8 0 "[ . 1 . 2]" 1
1642 1 105 LYS HB2 1 106 LYS H . . 3.870 3.771 3.625 3.867 . 0 0 "[ . 1 . 2]" 1
1643 1 105 LYS HB3 1 105 LYS HD2 . . 4.150 2.648 2.020 3.852 . 0 0 "[ . 1 . 2]" 1
1644 1 105 LYS HB3 1 105 LYS HD3 . . 4.000 2.871 2.592 3.040 . 0 0 "[ . 1 . 2]" 1
1645 1 105 LYS HB3 1 106 LYS H . . 3.990 2.411 2.235 2.681 . 0 0 "[ . 1 . 2]" 1
1646 1 105 LYS HB3 1 106 LYS QE . . 3.560 3.486 3.334 3.559 . 0 0 "[ . 1 . 2]" 1
1647 1 105 LYS QE 1 105 LYS HG3 . . 3.780 2.508 2.090 3.263 . 0 0 "[ . 1 . 2]" 1
1648 1 106 LYS H 1 106 LYS QB . . 3.180 2.207 1.987 2.413 . 0 0 "[ . 1 . 2]" 1
1649 1 106 LYS H 1 106 LYS HG2 . . 4.150 3.232 2.093 4.498 0.348 12 0 "[ . 1 . 2]" 1
1650 1 106 LYS H 1 107 PHE H . . 3.720 3.024 2.882 3.140 . 0 0 "[ . 1 . 2]" 1
1651 1 106 LYS HA 1 106 LYS HG2 . . 3.560 3.015 2.711 3.503 . 0 0 "[ . 1 . 2]" 1
1652 1 106 LYS HA 1 106 LYS HG3 . . 4.000 2.893 1.922 3.695 . 0 0 "[ . 1 . 2]" 1
1653 1 106 LYS HA 1 109 ASP H . . 4.860 3.819 3.441 4.480 . 0 0 "[ . 1 . 2]" 1
1654 1 106 LYS HA 1 109 ASP HB2 . . 3.780 3.356 2.935 3.970 0.190 18 0 "[ . 1 . 2]" 1
1655 1 106 LYS HA 1 109 ASP HB3 . . 4.000 3.607 2.898 4.049 0.049 19 0 "[ . 1 . 2]" 1
1656 1 106 LYS QB 1 107 PHE H . . 3.700 2.493 2.331 2.672 . 0 0 "[ . 1 . 2]" 1
1657 1 106 LYS HG3 1 107 PHE H . . 4.920 4.854 4.715 4.944 0.024 13 0 "[ . 1 . 2]" 1
1658 1 107 PHE H 1 107 PHE HB2 . . 3.510 2.073 1.941 2.252 . 0 0 "[ . 1 . 2]" 1
1659 1 107 PHE H 1 107 PHE HB3 . . 3.170 2.690 2.451 3.012 . 0 0 "[ . 1 . 2]" 1
1660 1 107 PHE H 1 107 PHE QD . . 4.620 3.884 3.653 4.062 . 0 0 "[ . 1 . 2]" 1
1661 1 107 PHE H 1 108 PHE H . . 3.850 2.876 2.706 3.011 . 0 0 "[ . 1 . 2]" 1
1662 1 107 PHE HA 1 107 PHE QD . . 3.510 2.944 2.619 3.203 . 0 0 "[ . 1 . 2]" 1
1663 1 107 PHE HB2 1 108 PHE H . . 4.150 3.501 3.303 3.744 . 0 0 "[ . 1 . 2]" 1
1664 1 107 PHE HB3 1 108 PHE H . . 3.820 2.312 2.059 3.139 . 0 0 "[ . 1 . 2]" 1
1665 1 107 PHE QD 1 108 PHE H . . 4.710 3.670 3.028 4.574 . 0 0 "[ . 1 . 2]" 1
1666 1 108 PHE H 1 108 PHE HB2 . . 3.410 2.021 1.942 2.086 . 0 0 "[ . 1 . 2]" 1
1667 1 108 PHE H 1 108 PHE HB3 . . 3.510 3.355 3.292 3.405 . 0 0 "[ . 1 . 2]" 1
1668 1 108 PHE H 1 108 PHE QD . . 4.150 2.403 2.227 2.779 . 0 0 "[ . 1 . 2]" 1
1669 1 108 PHE HA 1 108 PHE QD . . 3.330 2.704 2.522 3.032 . 0 0 "[ . 1 . 2]" 1
1670 1 108 PHE HB2 1 109 ASP H . . 4.190 2.854 2.204 4.241 0.051 18 0 "[ . 1 . 2]" 1
1671 1 108 PHE QD 1 109 ASP H . . 4.920 4.480 3.927 4.818 . 0 0 "[ . 1 . 2]" 1
1672 1 109 ASP H 1 109 ASP HB2 . . 3.510 2.340 2.018 3.432 . 0 0 "[ . 1 . 2]" 1
1673 1 109 ASP H 1 109 ASP HB3 . . 3.560 2.927 2.357 3.344 . 0 0 "[ . 1 . 2]" 1
1674 1 109 ASP H 1 110 SER H . . 3.810 2.919 1.997 3.900 0.090 18 0 "[ . 1 . 2]" 1
1675 1 109 ASP HB2 1 110 SER H . . 4.240 3.690 3.166 4.433 0.193 18 0 "[ . 1 . 2]" 1
1676 1 109 ASP HB3 1 110 SER H . . 4.350 2.897 2.047 4.502 0.152 19 0 "[ . 1 . 2]" 1
1677 1 110 SER H 1 110 SER HB2 . . 3.530 2.778 2.049 3.564 0.034 14 0 "[ . 1 . 2]" 1
1678 1 110 SER H 1 110 SER HB3 . . 3.560 3.082 2.340 3.517 . 0 0 "[ . 1 . 2]" 1
1679 1 110 SER HA 1 110 SER HB2 . . 2.930 2.579 2.328 2.947 0.017 2 0 "[ . 1 . 2]" 1
1680 1 111 GLY H 1 112 PRO QD . . 3.780 3.137 2.144 3.802 0.022 10 0 "[ . 1 . 2]" 1
1681 1 111 GLY QA 1 112 PRO QD . . 2.660 1.923 1.839 2.099 . 0 0 "[ . 1 . 2]" 1
1682 1 111 GLY QA 1 112 PRO QG . . 4.350 3.783 3.696 3.963 . 0 0 "[ . 1 . 2]" 1
1683 1 112 PRO QG 1 113 SER H . . 4.660 4.249 2.420 4.727 0.067 3 0 "[ . 1 . 2]" 1
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