NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
494887 |
2kyc   |
16945 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kyc
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 1636
_Distance_constraint_stats_list.Viol_count 1458
_Distance_constraint_stats_list.Viol_total 1293.239
_Distance_constraint_stats_list.Viol_max 0.655
_Distance_constraint_stats_list.Viol_rms 0.0151
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0020
_Distance_constraint_stats_list.Viol_average_violations_only 0.0443
_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 1 SER 0.148 0.042 15 0 "[ . 1 . 2]"
1 2 LEU 0.226 0.042 15 0 "[ . 1 . 2]"
1 3 THR 0.584 0.135 17 0 "[ . 1 . 2]"
1 4 ASP 0.558 0.094 17 0 "[ . 1 . 2]"
1 5 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 LEU 2.519 0.566 15 2 "[ . 1 + - 2]"
1 7 SER 2.760 0.566 15 2 "[ . 1 + - 2]"
1 8 PRO 0.174 0.034 18 0 "[ . 1 . 2]"
1 9 SER 0.277 0.057 20 0 "[ . 1 . 2]"
1 10 ASP 0.779 0.087 15 0 "[ . 1 . 2]"
1 11 ILE 0.298 0.034 18 0 "[ . 1 . 2]"
1 12 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 ALA 1.074 0.087 15 0 "[ . 1 . 2]"
1 14 ALA 0.094 0.021 17 0 "[ . 1 . 2]"
1 15 LEU 0.420 0.074 2 0 "[ . 1 . 2]"
1 16 ARG 0.229 0.037 11 0 "[ . 1 . 2]"
1 17 ASP 0.311 0.037 11 0 "[ . 1 . 2]"
1 18 CYS 0.475 0.121 20 0 "[ . 1 . 2]"
1 19 GLN 0.283 0.095 15 0 "[ . 1 . 2]"
1 20 ALA 0.020 0.020 12 0 "[ . 1 . 2]"
1 21 PRO 0.576 0.068 14 0 "[ . 1 . 2]"
1 22 ASP 0.175 0.031 4 0 "[ . 1 . 2]"
1 23 SER 0.591 0.121 20 0 "[ . 1 . 2]"
1 24 PHE 0.866 0.223 3 0 "[ . 1 . 2]"
1 25 SER 0.615 0.096 6 0 "[ . 1 . 2]"
1 26 PRO 1.275 0.066 16 0 "[ . 1 . 2]"
1 27 LYS 1.046 0.125 10 0 "[ . 1 . 2]"
1 28 LYS 0.797 0.096 6 0 "[ . 1 . 2]"
1 29 PHE 0.153 0.030 2 0 "[ . 1 . 2]"
1 30 PHE 1.663 0.090 8 0 "[ . 1 . 2]"
1 31 GLN 1.222 0.078 1 0 "[ . 1 . 2]"
1 32 ILE 0.729 0.108 1 0 "[ . 1 . 2]"
1 33 SER 0.160 0.069 17 0 "[ . 1 . 2]"
1 34 GLY 0.319 0.108 1 0 "[ . 1 . 2]"
1 35 MET 1.690 0.179 1 0 "[ . 1 . 2]"
1 36 SER 0.538 0.271 1 0 "[ . 1 . 2]"
1 37 LYS 0.353 0.078 1 0 "[ . 1 . 2]"
1 38 LYS 4.518 0.271 1 0 "[ . 1 . 2]"
1 39 SER 3.275 0.218 9 0 "[ . 1 . 2]"
1 40 SER 0.225 0.059 1 0 "[ . 1 . 2]"
1 41 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 GLN 7.272 0.465 19 0 "[ . 1 . 2]"
1 43 LEU 7.841 0.465 19 0 "[ . 1 . 2]"
1 44 LYS 2.000 0.160 3 0 "[ . 1 . 2]"
1 45 GLU 1.325 0.161 4 0 "[ . 1 . 2]"
1 46 ILE 1.916 0.185 13 0 "[ . 1 . 2]"
1 47 PHE 1.863 0.161 4 0 "[ . 1 . 2]"
1 48 ARG 0.290 0.077 4 0 "[ . 1 . 2]"
1 49 ILE 0.765 0.176 10 0 "[ . 1 . 2]"
1 50 LEU 1.080 0.176 10 0 "[ . 1 . 2]"
1 51 ASP 0.883 0.115 6 0 "[ . 1 . 2]"
1 52 ASN 1.635 0.176 4 0 "[ . 1 . 2]"
1 53 ASP 0.137 0.045 12 0 "[ . 1 . 2]"
1 54 GLN 1.867 0.176 18 0 "[ . 1 . 2]"
1 55 SER 0.558 0.176 18 0 "[ . 1 . 2]"
1 56 GLY 0.031 0.023 13 0 "[ . 1 . 2]"
1 57 PHE 0.652 0.094 18 0 "[ . 1 . 2]"
1 58 ILE 0.528 0.101 13 0 "[ . 1 . 2]"
1 59 GLU 0.402 0.180 5 0 "[ . 1 . 2]"
1 60 GLU 1.171 0.105 18 0 "[ . 1 . 2]"
1 61 ASP 0.754 0.059 17 0 "[ . 1 . 2]"
1 62 GLU 1.206 0.098 5 0 "[ . 1 . 2]"
1 63 LEU 1.356 0.655 9 1 "[ . +1 . 2]"
1 64 LYS 1.976 0.105 2 0 "[ . 1 . 2]"
1 65 TYR 2.136 0.330 12 0 "[ . 1 . 2]"
1 66 PHE 2.720 0.330 12 0 "[ . 1 . 2]"
1 67 LEU 0.123 0.053 13 0 "[ . 1 . 2]"
1 68 GLN 2.288 0.153 20 0 "[ . 1 . 2]"
1 69 ARG 1.890 0.285 9 0 "[ . 1 . 2]"
1 70 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 GLU 0.810 0.088 20 0 "[ . 1 . 2]"
1 72 SER 1.912 0.118 7 0 "[ . 1 . 2]"
1 73 GLY 0.966 0.118 7 0 "[ . 1 . 2]"
1 74 ALA 2.761 0.163 10 0 "[ . 1 . 2]"
1 75 ARG 3.069 0.184 1 0 "[ . 1 . 2]"
1 76 VAL 0.655 0.163 10 0 "[ . 1 . 2]"
1 77 LEU 1.833 0.132 15 0 "[ . 1 . 2]"
1 78 THR 1.412 0.105 2 0 "[ . 1 . 2]"
1 79 ALA 0.745 0.114 7 0 "[ . 1 . 2]"
1 80 SER 0.270 0.066 12 0 "[ . 1 . 2]"
1 81 GLU 1.731 0.223 3 0 "[ . 1 . 2]"
1 82 THR 1.797 0.114 7 0 "[ . 1 . 2]"
1 83 LYS 1.860 0.206 3 0 "[ . 1 . 2]"
1 84 THR 0.264 0.131 5 0 "[ . 1 . 2]"
1 85 PHE 3.872 0.655 9 1 "[ . +1 . 2]"
1 86 LEU 4.795 0.307 12 0 "[ . 1 . 2]"
1 87 ALA 1.151 0.173 16 0 "[ . 1 . 2]"
1 88 ALA 0.239 0.034 20 0 "[ . 1 . 2]"
1 89 ALA 0.252 0.067 8 0 "[ . 1 . 2]"
1 90 ASP 0.106 0.064 8 0 "[ . 1 . 2]"
1 91 HIS 0.121 0.035 8 0 "[ . 1 . 2]"
1 92 ASP 0.069 0.035 8 0 "[ . 1 . 2]"
1 93 GLY 0.106 0.030 2 0 "[ . 1 . 2]"
1 94 ASP 0.192 0.036 13 0 "[ . 1 . 2]"
1 95 GLY 0.025 0.012 14 0 "[ . 1 . 2]"
1 96 LYS 0.229 0.036 13 0 "[ . 1 . 2]"
1 97 ILE 0.242 0.040 18 0 "[ . 1 . 2]"
1 98 GLY 0.982 0.076 8 0 "[ . 1 . 2]"
1 99 ALA 0.430 0.085 9 0 "[ . 1 . 2]"
1 100 GLU 0.289 0.093 2 0 "[ . 1 . 2]"
1 101 GLU 0.452 0.067 13 0 "[ . 1 . 2]"
1 102 PHE 0.667 0.093 8 0 "[ . 1 . 2]"
1 103 GLN 1.407 0.081 16 0 "[ . 1 . 2]"
1 104 GLU 0.582 0.093 8 0 "[ . 1 . 2]"
1 105 MET 2.077 0.235 8 0 "[ . 1 . 2]"
1 106 VAL 0.492 0.081 16 0 "[ . 1 . 2]"
1 107 GLN 2.616 0.235 8 0 "[ . 1 . 2]"
1 108 SER 0.353 0.124 5 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 1 SER QB 1 2 LEU H . . 3.780 2.741 2.069 3.713 . 0 0 "[ . 1 . 2]" 1
2 1 1 SER QB 1 2 LEU HA . . 4.210 4.031 3.724 4.252 0.042 15 0 "[ . 1 . 2]" 1
3 1 2 LEU H 1 2 LEU QB . . 3.660 2.407 2.133 2.875 . 0 0 "[ . 1 . 2]" 1
4 1 2 LEU H 1 2 LEU HG . . 5.060 4.460 3.698 4.741 . 0 0 "[ . 1 . 2]" 1
5 1 2 LEU HA 1 4 ASP H . . 4.210 3.871 3.402 4.245 0.035 19 0 "[ . 1 . 2]" 1
6 1 2 LEU QB 1 3 THR H . . 3.860 2.984 1.927 3.713 . 0 0 "[ . 1 . 2]" 1
7 1 2 LEU QB 1 3 THR MG . . 5.260 3.057 2.491 4.230 . 0 0 "[ . 1 . 2]" 1
8 1 2 LEU HB2 1 3 THR H . . 4.590 3.944 3.497 4.329 . 0 0 "[ . 1 . 2]" 1
9 1 2 LEU HB3 1 3 THR H . . 4.590 3.160 1.936 4.052 . 0 0 "[ . 1 . 2]" 1
10 1 2 LEU MD1 1 2 LEU MD2 . . 2.870 2.003 1.899 2.092 . 0 0 "[ . 1 . 2]" 1
11 1 2 LEU MD1 1 3 THR H . . 5.500 3.439 1.925 4.670 . 0 0 "[ . 1 . 2]" 1
12 1 2 LEU MD1 1 70 PHE H . . 4.850 3.672 2.679 4.455 . 0 0 "[ . 1 . 2]" 1
13 1 2 LEU MD1 1 70 PHE HA . . 4.420 3.122 1.972 4.117 . 0 0 "[ . 1 . 2]" 1
14 1 2 LEU MD1 1 70 PHE QD . . 4.460 3.109 1.901 3.827 . 0 0 "[ . 1 . 2]" 1
15 1 2 LEU MD1 1 70 PHE QE . . 5.400 2.920 2.434 3.688 . 0 0 "[ . 1 . 2]" 1
16 1 2 LEU MD2 1 3 THR H . . 4.410 3.553 2.113 4.064 . 0 0 "[ . 1 . 2]" 1
17 1 2 LEU MD2 1 70 PHE H . . 4.660 3.598 2.424 4.398 . 0 0 "[ . 1 . 2]" 1
18 1 2 LEU MD2 1 70 PHE HA . . 4.360 1.978 1.879 2.301 . 0 0 "[ . 1 . 2]" 1
19 1 2 LEU MD2 1 70 PHE QD . . 4.330 2.458 1.945 3.293 . 0 0 "[ . 1 . 2]" 1
20 1 2 LEU MD2 1 70 PHE QE . . 4.970 3.548 2.887 4.356 . 0 0 "[ . 1 . 2]" 1
21 1 2 LEU MD2 1 71 GLU H . . 5.500 4.865 4.505 5.185 . 0 0 "[ . 1 . 2]" 1
22 1 2 LEU HG 1 3 THR H . . 4.900 2.796 1.983 4.481 . 0 0 "[ . 1 . 2]" 1
23 1 3 THR H 1 3 THR HB . . 4.060 3.805 2.949 4.021 . 0 0 "[ . 1 . 2]" 1
24 1 3 THR H 1 3 THR MG . . 3.440 2.543 2.180 3.143 . 0 0 "[ . 1 . 2]" 1
25 1 3 THR H 1 4 ASP H . . 2.980 2.889 2.308 3.074 0.094 17 0 "[ . 1 . 2]" 1
26 1 3 THR H 1 4 ASP HB2 . . 5.500 4.861 4.305 5.308 . 0 0 "[ . 1 . 2]" 1
27 1 3 THR H 1 4 ASP QB . . 4.850 4.411 3.991 4.704 . 0 0 "[ . 1 . 2]" 1
28 1 3 THR H 1 4 ASP HB3 . . 5.500 5.113 4.578 5.347 . 0 0 "[ . 1 . 2]" 1
29 1 3 THR HA 1 6 LEU H . . 3.470 3.336 3.139 3.605 0.135 17 0 "[ . 1 . 2]" 1
30 1 3 THR HB 1 4 ASP H . . 4.610 4.475 4.352 4.649 0.039 10 0 "[ . 1 . 2]" 1
31 1 3 THR HB 1 6 LEU H . . 5.150 4.562 3.729 5.138 . 0 0 "[ . 1 . 2]" 1
32 1 3 THR MG 1 4 ASP H . . 5.500 4.267 3.778 4.396 . 0 0 "[ . 1 . 2]" 1
33 1 3 THR MG 1 8 PRO HA . . 4.250 2.195 1.852 2.756 . 0 0 "[ . 1 . 2]" 1
34 1 3 THR MG 1 8 PRO QB . . 3.670 2.610 1.868 3.227 . 0 0 "[ . 1 . 2]" 1
35 1 3 THR MG 1 8 PRO QG . . 5.350 4.179 3.242 4.862 . 0 0 "[ . 1 . 2]" 1
36 1 3 THR MG 1 11 ILE MD . . 3.870 1.889 1.718 2.617 . 0 0 "[ . 1 . 2]" 1
37 1 4 ASP H 1 4 ASP HB2 . . 3.590 2.702 2.444 3.214 . 0 0 "[ . 1 . 2]" 1
38 1 4 ASP H 1 4 ASP QB . . 3.070 2.260 2.188 2.383 . 0 0 "[ . 1 . 2]" 1
39 1 4 ASP H 1 4 ASP HB3 . . 3.590 2.451 2.272 2.690 . 0 0 "[ . 1 . 2]" 1
40 1 4 ASP H 1 5 ILE MG . . 5.500 4.401 4.153 4.741 . 0 0 "[ . 1 . 2]" 1
41 1 4 ASP H 1 6 LEU H . . 3.650 3.480 3.046 3.673 0.023 11 0 "[ . 1 . 2]" 1
42 1 4 ASP QB 1 5 ILE H . . 3.430 2.128 1.926 2.407 . 0 0 "[ . 1 . 2]" 1
43 1 4 ASP QB 1 6 LEU H . . 4.680 4.156 3.975 4.323 . 0 0 "[ . 1 . 2]" 1
44 1 5 ILE H 1 5 ILE HB . . 2.680 2.229 2.105 2.359 . 0 0 "[ . 1 . 2]" 1
45 1 5 ILE H 1 5 ILE MD . . 4.110 3.744 3.009 3.904 . 0 0 "[ . 1 . 2]" 1
46 1 5 ILE H 1 5 ILE QG . . 5.070 3.969 3.866 4.073 . 0 0 "[ . 1 . 2]" 1
47 1 5 ILE H 1 5 ILE MG . . 3.310 2.730 2.489 3.120 . 0 0 "[ . 1 . 2]" 1
48 1 5 ILE H 1 6 LEU H . . 3.350 2.581 2.381 2.714 . 0 0 "[ . 1 . 2]" 1
49 1 5 ILE HA 1 5 ILE MD . . 3.940 2.821 2.408 3.193 . 0 0 "[ . 1 . 2]" 1
50 1 5 ILE HA 1 5 ILE QG . . 3.560 2.106 1.957 2.292 . 0 0 "[ . 1 . 2]" 1
51 1 5 ILE HB 1 5 ILE MD . . 3.360 2.215 2.144 2.274 . 0 0 "[ . 1 . 2]" 1
52 1 5 ILE HB 1 46 ILE MD . . 3.880 2.704 2.070 3.539 . 0 0 "[ . 1 . 2]" 1
53 1 5 ILE HB 1 46 ILE HG12 . . 4.500 3.386 2.798 4.262 . 0 0 "[ . 1 . 2]" 1
54 1 5 ILE HB 1 46 ILE HG13 . . 4.750 2.967 2.512 3.518 . 0 0 "[ . 1 . 2]" 1
55 1 5 ILE MD 1 42 GLN HA . . 4.510 3.063 2.322 3.693 . 0 0 "[ . 1 . 2]" 1
56 1 5 ILE MD 1 45 GLU H . . 5.200 4.807 4.459 4.931 . 0 0 "[ . 1 . 2]" 1
57 1 5 ILE MD 1 45 GLU HB2 . . 3.650 3.108 2.800 3.439 . 0 0 "[ . 1 . 2]" 1
58 1 5 ILE MD 1 45 GLU QB . . 3.170 2.554 2.108 2.711 . 0 0 "[ . 1 . 2]" 1
59 1 5 ILE MD 1 45 GLU HB3 . . 3.650 2.749 2.144 3.093 . 0 0 "[ . 1 . 2]" 1
60 1 5 ILE MD 1 46 ILE H . . 5.030 4.696 4.181 4.773 . 0 0 "[ . 1 . 2]" 1
61 1 5 ILE MG 1 6 LEU H . . 2.840 2.389 2.196 2.731 . 0 0 "[ . 1 . 2]" 1
62 1 5 ILE MG 1 6 LEU HB2 . . 3.900 2.643 2.396 2.955 . 0 0 "[ . 1 . 2]" 1
63 1 5 ILE MG 1 35 MET HG2 . . 5.500 4.519 3.822 4.877 . 0 0 "[ . 1 . 2]" 1
64 1 5 ILE MG 1 42 GLN QB . . 3.610 2.443 2.087 2.603 . 0 0 "[ . 1 . 2]" 1
65 1 5 ILE MG 1 42 GLN HG2 . . 5.500 3.886 3.585 4.056 . 0 0 "[ . 1 . 2]" 1
66 1 5 ILE MG 1 42 GLN QG . . 4.460 3.733 3.458 3.887 . 0 0 "[ . 1 . 2]" 1
67 1 5 ILE MG 1 42 GLN HG3 . . 5.500 4.832 4.538 4.981 . 0 0 "[ . 1 . 2]" 1
68 1 5 ILE MG 1 43 LEU H . . 5.500 5.169 5.037 5.302 . 0 0 "[ . 1 . 2]" 1
69 1 5 ILE MG 1 46 ILE H . . 5.260 4.361 3.971 4.727 . 0 0 "[ . 1 . 2]" 1
70 1 5 ILE MG 1 46 ILE HG12 . . 4.930 2.947 2.384 3.540 . 0 0 "[ . 1 . 2]" 1
71 1 5 ILE MG 1 46 ILE HG13 . . 5.500 3.298 2.538 3.733 . 0 0 "[ . 1 . 2]" 1
72 1 6 LEU H 1 6 LEU HB2 . . 2.620 2.390 2.172 2.612 . 0 0 "[ . 1 . 2]" 1
73 1 6 LEU H 1 6 LEU MD1 . . 5.400 3.727 3.320 4.385 . 0 0 "[ . 1 . 2]" 1
74 1 6 LEU H 1 7 SER H . . 4.560 4.397 4.317 4.539 . 0 0 "[ . 1 . 2]" 1
75 1 6 LEU HA 1 7 SER H . . 3.340 2.681 2.440 2.775 . 0 0 "[ . 1 . 2]" 1
76 1 6 LEU HB2 1 7 SER H . . 4.800 3.632 3.528 3.928 . 0 0 "[ . 1 . 2]" 1
77 1 6 LEU HB3 1 7 SER H . . 3.290 2.244 2.066 3.158 . 0 0 "[ . 1 . 2]" 1
78 1 6 LEU HB3 1 11 ILE MD . . 3.620 2.505 1.988 2.950 . 0 0 "[ . 1 . 2]" 1
79 1 6 LEU MD1 1 6 LEU MD2 . . 2.670 1.986 1.879 2.083 . 0 0 "[ . 1 . 2]" 1
80 1 6 LEU MD1 1 7 SER H . . 4.520 3.641 1.695 4.093 . 0 0 "[ . 1 . 2]" 1
81 1 6 LEU MD1 1 35 MET H . . 5.500 4.037 3.556 4.565 . 0 0 "[ . 1 . 2]" 1
82 1 6 LEU MD1 1 35 MET HG2 . . 4.650 2.435 1.904 4.161 . 0 0 "[ . 1 . 2]" 1
83 1 6 LEU MD1 1 35 MET HG3 . . 4.340 3.358 2.019 4.109 . 0 0 "[ . 1 . 2]" 1
84 1 6 LEU MD2 1 7 SER H . . 3.340 2.651 1.826 3.482 0.142 16 0 "[ . 1 . 2]" 1
85 1 6 LEU MD2 1 33 SER H . . 5.500 4.569 4.241 5.296 . 0 0 "[ . 1 . 2]" 1
86 1 6 LEU MD2 1 34 GLY H . . 4.280 3.083 2.675 3.900 . 0 0 "[ . 1 . 2]" 1
87 1 6 LEU MD2 1 34 GLY HA2 . . 5.500 3.730 3.557 4.523 . 0 0 "[ . 1 . 2]" 1
88 1 6 LEU MD2 1 34 GLY QA . . 4.790 2.550 2.320 3.415 . 0 0 "[ . 1 . 2]" 1
89 1 6 LEU MD2 1 34 GLY HA3 . . 5.500 2.598 2.348 3.534 . 0 0 "[ . 1 . 2]" 1
90 1 6 LEU MD2 1 35 MET H . . 3.670 3.163 2.477 3.442 . 0 0 "[ . 1 . 2]" 1
91 1 6 LEU MD2 1 35 MET HA . . 3.890 3.170 2.545 3.705 . 0 0 "[ . 1 . 2]" 1
92 1 6 LEU MD2 1 35 MET HB2 . . 4.550 4.082 3.761 4.310 . 0 0 "[ . 1 . 2]" 1
93 1 6 LEU MD2 1 35 MET HB3 . . 4.900 4.462 4.103 4.708 . 0 0 "[ . 1 . 2]" 1
94 1 6 LEU MD2 1 35 MET HG3 . . 3.380 2.724 2.410 3.099 . 0 0 "[ . 1 . 2]" 1
95 1 6 LEU MD2 1 36 SER H . . 5.500 4.853 4.372 5.072 . 0 0 "[ . 1 . 2]" 1
96 1 6 LEU HG 1 7 SER H . . 3.190 2.865 2.194 3.756 0.566 15 2 "[ . 1 + - 2]" 1
97 1 7 SER H 1 7 SER HB2 . . 3.210 2.599 2.214 3.305 0.095 16 0 "[ . 1 . 2]" 1
98 1 7 SER H 1 7 SER HB3 . . 3.480 2.909 2.510 3.508 0.028 18 0 "[ . 1 . 2]" 1
99 1 7 SER H 1 10 ASP QB . . 4.210 3.660 2.825 4.050 . 0 0 "[ . 1 . 2]" 1
100 1 7 SER H 1 11 ILE MD . . 4.390 3.579 3.155 4.103 . 0 0 "[ . 1 . 2]" 1
101 1 7 SER HB2 1 10 ASP H . . 5.340 5.155 4.126 5.357 0.017 4 0 "[ . 1 . 2]" 1
102 1 7 SER HB2 1 10 ASP QB . . 4.940 3.877 2.117 4.947 0.007 12 0 "[ . 1 . 2]" 1
103 1 7 SER HB3 1 8 PRO QD . . 4.270 3.683 3.192 4.187 . 0 0 "[ . 1 . 2]" 1
104 1 7 SER HB3 1 10 ASP H . . 3.630 3.568 3.141 3.664 0.034 9 0 "[ . 1 . 2]" 1
105 1 7 SER HB3 1 10 ASP HB2 . . 4.590 2.732 1.980 3.795 . 0 0 "[ . 1 . 2]" 1
106 1 7 SER HB3 1 10 ASP QB . . 3.910 2.675 1.969 3.622 . 0 0 "[ . 1 . 2]" 1
107 1 7 SER HB3 1 10 ASP HB3 . . 4.590 4.049 3.333 4.656 0.066 12 0 "[ . 1 . 2]" 1
108 1 8 PRO HA 1 10 ASP H . . 4.200 3.528 3.366 3.697 . 0 0 "[ . 1 . 2]" 1
109 1 8 PRO HA 1 11 ILE H . . 3.790 3.658 3.166 3.824 0.034 18 0 "[ . 1 . 2]" 1
110 1 8 PRO HA 1 11 ILE HB . . 3.960 3.579 2.866 3.962 0.002 6 0 "[ . 1 . 2]" 1
111 1 8 PRO HA 1 11 ILE MD . . 3.320 2.348 1.963 2.791 . 0 0 "[ . 1 . 2]" 1
112 1 8 PRO HA 1 12 ALA H . . 5.500 4.798 4.252 5.216 . 0 0 "[ . 1 . 2]" 1
113 1 8 PRO QB 1 10 ASP H . . 4.970 4.595 4.534 4.800 . 0 0 "[ . 1 . 2]" 1
114 1 8 PRO QD 1 10 ASP H . . 5.350 4.693 4.415 4.820 . 0 0 "[ . 1 . 2]" 1
115 1 9 SER H 1 10 ASP H . . 4.130 2.709 2.401 2.896 . 0 0 "[ . 1 . 2]" 1
116 1 9 SER HA 1 11 ILE H . . 4.830 4.541 4.264 4.845 0.015 5 0 "[ . 1 . 2]" 1
117 1 9 SER HA 1 12 ALA H . . 5.040 4.110 3.929 4.321 . 0 0 "[ . 1 . 2]" 1
118 1 9 SER HA 1 13 ALA H . . 5.240 5.216 4.951 5.297 0.057 20 0 "[ . 1 . 2]" 1
119 1 10 ASP H 1 10 ASP HB2 . . 3.910 2.679 2.501 2.799 . 0 0 "[ . 1 . 2]" 1
120 1 10 ASP H 1 10 ASP QB . . 3.030 2.621 2.461 2.734 . 0 0 "[ . 1 . 2]" 1
121 1 10 ASP H 1 10 ASP HB3 . . 3.910 3.745 3.186 3.839 . 0 0 "[ . 1 . 2]" 1
122 1 10 ASP H 1 11 ILE H . . 3.080 1.895 1.812 2.112 . 0 0 "[ . 1 . 2]" 1
123 1 10 ASP H 1 11 ILE HB . . 4.300 4.006 3.900 4.141 . 0 0 "[ . 1 . 2]" 1
124 1 10 ASP H 1 11 ILE MD . . 4.200 3.570 2.876 3.997 . 0 0 "[ . 1 . 2]" 1
125 1 10 ASP H 1 12 ALA H . . 3.840 3.201 2.943 3.414 . 0 0 "[ . 1 . 2]" 1
126 1 10 ASP H 1 13 ALA H . . 4.540 4.532 4.219 4.627 0.087 15 0 "[ . 1 . 2]" 1
127 1 10 ASP H 1 33 SER HA . . 5.180 4.571 4.209 5.071 . 0 0 "[ . 1 . 2]" 1
128 1 10 ASP HA 1 12 ALA H . . 4.510 3.996 3.827 4.299 . 0 0 "[ . 1 . 2]" 1
129 1 10 ASP HA 1 13 ALA H . . 3.620 3.421 3.183 3.614 . 0 0 "[ . 1 . 2]" 1
130 1 10 ASP HA 1 13 ALA MB . . 3.720 3.015 2.706 3.232 . 0 0 "[ . 1 . 2]" 1
131 1 10 ASP HA 1 33 SER HA . . 5.030 3.834 3.515 4.334 . 0 0 "[ . 1 . 2]" 1
132 1 10 ASP QB 1 11 ILE H . . 3.380 2.656 2.344 2.814 . 0 0 "[ . 1 . 2]" 1
133 1 10 ASP QB 1 32 ILE MG . . 4.840 3.790 3.117 4.429 . 0 0 "[ . 1 . 2]" 1
134 1 10 ASP QB 1 33 SER HA . . 3.440 2.020 1.905 2.871 . 0 0 "[ . 1 . 2]" 1
135 1 10 ASP HB2 1 33 SER HA . . 4.140 2.806 2.401 3.695 . 0 0 "[ . 1 . 2]" 1
136 1 10 ASP HB3 1 33 SER HA . . 4.140 2.087 1.977 2.998 . 0 0 "[ . 1 . 2]" 1
137 1 11 ILE H 1 11 ILE HB . . 2.550 2.514 2.385 2.583 0.033 14 0 "[ . 1 . 2]" 1
138 1 11 ILE H 1 11 ILE MD . . 3.200 2.651 1.887 3.053 . 0 0 "[ . 1 . 2]" 1
139 1 11 ILE H 1 11 ILE QG . . 3.690 2.412 2.037 3.217 . 0 0 "[ . 1 . 2]" 1
140 1 11 ILE H 1 33 SER HA . . 4.240 3.541 3.112 4.255 0.015 16 0 "[ . 1 . 2]" 1
141 1 11 ILE HA 1 11 ILE QG . . 3.570 2.383 2.218 2.465 . 0 0 "[ . 1 . 2]" 1
142 1 11 ILE HA 1 11 ILE MG . . 3.510 2.356 2.284 2.447 . 0 0 "[ . 1 . 2]" 1
143 1 11 ILE HA 1 13 ALA H . . 4.360 4.095 3.928 4.231 . 0 0 "[ . 1 . 2]" 1
144 1 11 ILE HA 1 14 ALA MB . . 4.940 3.294 2.721 3.801 . 0 0 "[ . 1 . 2]" 1
145 1 11 ILE HA 1 15 LEU H . . 4.800 4.542 4.204 4.821 0.021 7 0 "[ . 1 . 2]" 1
146 1 11 ILE HA 1 32 ILE MG . . 5.470 3.770 3.506 4.242 . 0 0 "[ . 1 . 2]" 1
147 1 11 ILE HA 1 33 SER HA . . 4.190 2.969 1.989 3.445 . 0 0 "[ . 1 . 2]" 1
148 1 11 ILE HB 1 12 ALA H . . 3.220 2.956 2.740 3.136 . 0 0 "[ . 1 . 2]" 1
149 1 11 ILE HB 1 12 ALA MB . . 4.570 4.097 3.971 4.208 . 0 0 "[ . 1 . 2]" 1
150 1 11 ILE MD 1 70 PHE QD . . 3.950 2.750 2.093 3.524 . 0 0 "[ . 1 . 2]" 1
151 1 11 ILE MD 1 70 PHE QE . . 4.530 2.528 1.947 3.650 . 0 0 "[ . 1 . 2]" 1
152 1 11 ILE QG 1 33 SER HA . . 5.030 3.234 2.768 4.049 . 0 0 "[ . 1 . 2]" 1
153 1 11 ILE QG 1 70 PHE QD . . 5.030 3.721 2.968 4.410 . 0 0 "[ . 1 . 2]" 1
154 1 11 ILE MG 1 12 ALA H . . 5.000 3.686 3.378 3.875 . 0 0 "[ . 1 . 2]" 1
155 1 11 ILE MG 1 12 ALA HA . . 4.920 3.632 3.304 3.831 . 0 0 "[ . 1 . 2]" 1
156 1 11 ILE MG 1 13 ALA H . . 5.500 4.901 4.695 4.989 . 0 0 "[ . 1 . 2]" 1
157 1 11 ILE MG 1 15 LEU H . . 4.880 3.846 3.490 4.203 . 0 0 "[ . 1 . 2]" 1
158 1 11 ILE MG 1 70 PHE H . . 5.500 4.797 4.479 5.046 . 0 0 "[ . 1 . 2]" 1
159 1 11 ILE MG 1 70 PHE HB2 . . 3.890 3.084 2.557 3.469 . 0 0 "[ . 1 . 2]" 1
160 1 11 ILE MG 1 70 PHE HB3 . . 3.980 2.292 1.937 2.704 . 0 0 "[ . 1 . 2]" 1
161 1 11 ILE MG 1 71 GLU H . . 5.500 4.653 4.127 5.124 . 0 0 "[ . 1 . 2]" 1
162 1 12 ALA H 1 12 ALA MB . . 2.960 2.125 2.039 2.256 . 0 0 "[ . 1 . 2]" 1
163 1 12 ALA H 1 13 ALA H . . 2.770 2.505 2.364 2.693 . 0 0 "[ . 1 . 2]" 1
164 1 12 ALA H 1 32 ILE MG . . 5.500 5.119 5.082 5.158 . 0 0 "[ . 1 . 2]" 1
165 1 12 ALA H 1 33 SER HA . . 5.500 5.179 4.709 5.467 . 0 0 "[ . 1 . 2]" 1
166 1 12 ALA HA 1 14 ALA H . . 5.010 3.715 3.530 3.944 . 0 0 "[ . 1 . 2]" 1
167 1 12 ALA HA 1 15 LEU H . . 3.760 3.151 2.816 3.417 . 0 0 "[ . 1 . 2]" 1
168 1 12 ALA HA 1 15 LEU QB . . 3.280 2.493 2.020 3.105 . 0 0 "[ . 1 . 2]" 1
169 1 12 ALA HA 1 15 LEU QD . . 4.460 2.711 2.304 3.454 . 0 0 "[ . 1 . 2]" 1
170 1 12 ALA HA 1 15 LEU HG . . 5.170 3.381 2.874 4.076 . 0 0 "[ . 1 . 2]" 1
171 1 12 ALA MB 1 13 ALA H . . 3.320 2.830 2.670 2.915 . 0 0 "[ . 1 . 2]" 1
172 1 12 ALA MB 1 15 LEU H . . 5.500 4.477 4.191 4.675 . 0 0 "[ . 1 . 2]" 1
173 1 13 ALA H 1 13 ALA MB . . 2.870 2.228 2.152 2.267 . 0 0 "[ . 1 . 2]" 1
174 1 13 ALA H 1 14 ALA H . . 3.070 2.598 2.436 2.673 . 0 0 "[ . 1 . 2]" 1
175 1 13 ALA H 1 14 ALA HA . . 5.380 5.217 5.055 5.294 . 0 0 "[ . 1 . 2]" 1
176 1 13 ALA H 1 15 LEU H . . 4.290 4.209 4.012 4.364 0.074 2 0 "[ . 1 . 2]" 1
177 1 13 ALA H 1 32 ILE MG . . 4.320 3.708 3.562 3.887 . 0 0 "[ . 1 . 2]" 1
178 1 13 ALA H 1 33 SER HA . . 5.500 5.125 4.717 5.378 . 0 0 "[ . 1 . 2]" 1
179 1 13 ALA HA 1 14 ALA HA . . 4.870 4.624 4.561 4.684 . 0 0 "[ . 1 . 2]" 1
180 1 13 ALA HA 1 32 ILE MG . . 5.500 4.149 3.652 4.581 . 0 0 "[ . 1 . 2]" 1
181 1 13 ALA MB 1 14 ALA H . . 3.210 2.972 2.814 3.044 . 0 0 "[ . 1 . 2]" 1
182 1 13 ALA MB 1 15 LEU H . . 5.500 4.763 4.618 4.912 . 0 0 "[ . 1 . 2]" 1
183 1 13 ALA MB 1 32 ILE MG . . 3.310 2.170 1.862 2.504 . 0 0 "[ . 1 . 2]" 1
184 1 14 ALA H 1 14 ALA MB . . 2.640 2.303 2.205 2.406 . 0 0 "[ . 1 . 2]" 1
185 1 14 ALA H 1 15 LEU H . . 2.890 2.236 1.996 2.440 . 0 0 "[ . 1 . 2]" 1
186 1 14 ALA H 1 15 LEU QB . . 4.330 4.145 3.925 4.351 0.021 17 0 "[ . 1 . 2]" 1
187 1 14 ALA H 1 17 ASP HB2 . . 5.500 5.334 5.176 5.488 . 0 0 "[ . 1 . 2]" 1
188 1 14 ALA H 1 32 ILE MD . . 4.990 4.415 4.092 4.713 . 0 0 "[ . 1 . 2]" 1
189 1 14 ALA HA 1 16 ARG H . . 5.060 3.820 3.634 3.960 . 0 0 "[ . 1 . 2]" 1
190 1 14 ALA HA 1 17 ASP H . . 3.870 3.237 2.884 3.499 . 0 0 "[ . 1 . 2]" 1
191 1 14 ALA HA 1 17 ASP HB2 . . 4.390 3.495 3.123 3.886 . 0 0 "[ . 1 . 2]" 1
192 1 14 ALA HA 1 17 ASP HB3 . . 4.250 2.733 2.384 3.019 . 0 0 "[ . 1 . 2]" 1
193 1 14 ALA HA 1 18 CYS H . . 4.990 3.977 2.971 5.007 0.017 8 0 "[ . 1 . 2]" 1
194 1 14 ALA HA 1 32 ILE HB . . 5.290 4.196 3.420 4.834 . 0 0 "[ . 1 . 2]" 1
195 1 14 ALA HA 1 32 ILE MD . . 4.440 2.639 1.974 3.203 . 0 0 "[ . 1 . 2]" 1
196 1 14 ALA HA 1 32 ILE HG12 . . 4.960 4.368 3.831 4.965 0.005 10 0 "[ . 1 . 2]" 1
197 1 14 ALA HA 1 32 ILE MG . . 3.730 2.706 2.056 3.467 . 0 0 "[ . 1 . 2]" 1
198 1 14 ALA MB 1 15 LEU H . . 3.300 2.615 2.442 2.840 . 0 0 "[ . 1 . 2]" 1
199 1 14 ALA MB 1 16 ARG H . . 5.500 4.269 4.151 4.383 . 0 0 "[ . 1 . 2]" 1
200 1 14 ALA MB 1 17 ASP HB3 . . 4.800 4.155 3.874 4.387 . 0 0 "[ . 1 . 2]" 1
201 1 14 ALA MB 1 33 SER QB . . 4.700 3.772 3.131 4.323 . 0 0 "[ . 1 . 2]" 1
202 1 15 LEU H 1 15 LEU QB . . 2.480 2.354 2.283 2.440 . 0 0 "[ . 1 . 2]" 1
203 1 15 LEU H 1 15 LEU QD . . 3.800 3.163 3.060 3.276 . 0 0 "[ . 1 . 2]" 1
204 1 15 LEU H 1 15 LEU HG . . 4.700 2.439 2.292 2.667 . 0 0 "[ . 1 . 2]" 1
205 1 15 LEU H 1 17 ASP H . . 5.500 4.220 3.846 4.620 . 0 0 "[ . 1 . 2]" 1
206 1 15 LEU HA 1 15 LEU QD . . 3.590 1.995 1.931 2.311 . 0 0 "[ . 1 . 2]" 1
207 1 15 LEU HA 1 15 LEU HG . . 4.050 3.007 2.939 3.103 . 0 0 "[ . 1 . 2]" 1
208 1 15 LEU HA 1 17 ASP H . . 5.500 4.734 4.079 5.215 . 0 0 "[ . 1 . 2]" 1
209 1 15 LEU HA 1 18 CYS H . . 4.360 4.118 3.884 4.368 0.008 18 0 "[ . 1 . 2]" 1
210 1 15 LEU QD 1 67 LEU H . . 5.500 4.573 4.490 4.626 . 0 0 "[ . 1 . 2]" 1
211 1 15 LEU QD 1 67 LEU HA . . 4.830 2.813 2.496 3.033 . 0 0 "[ . 1 . 2]" 1
212 1 15 LEU QD 1 67 LEU QB . . 4.070 2.491 2.159 2.871 . 0 0 "[ . 1 . 2]" 1
213 1 15 LEU QD 1 67 LEU QD . . 3.170 1.932 1.778 2.230 . 0 0 "[ . 1 . 2]" 1
214 1 15 LEU QD 1 70 PHE H . . 5.330 3.799 3.225 4.221 . 0 0 "[ . 1 . 2]" 1
215 1 15 LEU QD 1 70 PHE HB2 . . 4.030 2.076 1.863 2.469 . 0 0 "[ . 1 . 2]" 1
216 1 15 LEU QD 1 70 PHE QD . . 4.540 3.163 2.567 3.375 . 0 0 "[ . 1 . 2]" 1
217 1 15 LEU QD 1 71 GLU H . . 4.750 2.257 1.885 2.674 . 0 0 "[ . 1 . 2]" 1
218 1 15 LEU QD 1 71 GLU HA . . 5.380 2.555 2.011 2.959 . 0 0 "[ . 1 . 2]" 1
219 1 15 LEU QD 1 71 GLU QB . . 4.610 2.106 1.799 2.558 . 0 0 "[ . 1 . 2]" 1
220 1 15 LEU QD 1 71 GLU QG . . 4.940 3.235 2.049 3.911 . 0 0 "[ . 1 . 2]" 1
221 1 15 LEU QD 1 72 SER H . . 5.500 4.340 4.031 4.651 . 0 0 "[ . 1 . 2]" 1
222 1 16 ARG H 1 16 ARG HB2 . . 3.060 2.721 2.388 2.978 . 0 0 "[ . 1 . 2]" 1
223 1 16 ARG H 1 16 ARG HB3 . . 3.170 2.601 2.379 2.966 . 0 0 "[ . 1 . 2]" 1
224 1 16 ARG H 1 16 ARG QG . . 4.830 4.064 3.957 4.160 . 0 0 "[ . 1 . 2]" 1
225 1 16 ARG H 1 17 ASP H . . 3.570 2.259 1.933 2.522 . 0 0 "[ . 1 . 2]" 1
226 1 16 ARG H 1 17 ASP HA . . 5.240 4.926 4.678 5.112 . 0 0 "[ . 1 . 2]" 1
227 1 16 ARG H 1 17 ASP HB2 . . 4.470 4.415 4.236 4.493 0.023 20 0 "[ . 1 . 2]" 1
228 1 16 ARG H 1 18 CYS H . . 4.140 3.672 3.308 4.043 . 0 0 "[ . 1 . 2]" 1
229 1 16 ARG H 1 19 GLN QE . . 4.910 4.765 4.340 4.931 0.021 6 0 "[ . 1 . 2]" 1
230 1 16 ARG HA 1 16 ARG HG2 . . 4.090 2.440 2.221 2.900 . 0 0 "[ . 1 . 2]" 1
231 1 16 ARG HA 1 16 ARG QG . . 3.350 2.361 2.197 2.528 . 0 0 "[ . 1 . 2]" 1
232 1 16 ARG HA 1 16 ARG HG3 . . 4.090 3.386 2.759 3.602 . 0 0 "[ . 1 . 2]" 1
233 1 16 ARG HA 1 19 GLN HE21 . . 5.500 2.313 1.954 2.870 . 0 0 "[ . 1 . 2]" 1
234 1 16 ARG HA 1 19 GLN HE22 . . 5.500 3.442 2.766 4.027 . 0 0 "[ . 1 . 2]" 1
235 1 16 ARG HA 1 19 GLN QG . . 4.440 3.574 2.009 4.432 . 0 0 "[ . 1 . 2]" 1
236 1 16 ARG HB2 1 19 GLN HE21 . . 5.500 4.090 3.440 4.864 . 0 0 "[ . 1 . 2]" 1
237 1 16 ARG HB2 1 19 GLN HE22 . . 5.500 4.619 3.692 5.181 . 0 0 "[ . 1 . 2]" 1
238 1 16 ARG HB3 1 16 ARG QD . . 3.710 2.271 1.971 2.613 . 0 0 "[ . 1 . 2]" 1
239 1 16 ARG HB3 1 17 ASP H . . 3.190 2.657 2.232 3.194 0.004 2 0 "[ . 1 . 2]" 1
240 1 16 ARG HB3 1 17 ASP HB2 . . 5.110 4.020 3.848 4.299 . 0 0 "[ . 1 . 2]" 1
241 1 16 ARG HB3 1 18 CYS H . . 5.070 4.823 4.501 5.104 0.034 20 0 "[ . 1 . 2]" 1
242 1 16 ARG HD2 1 17 ASP H . . 5.500 3.942 2.945 5.490 . 0 0 "[ . 1 . 2]" 1
243 1 16 ARG HD3 1 17 ASP H . . 5.500 4.667 2.773 5.537 0.037 11 0 "[ . 1 . 2]" 1
244 1 16 ARG QG 1 17 ASP H . . 4.670 4.136 3.650 4.544 . 0 0 "[ . 1 . 2]" 1
245 1 16 ARG QG 1 19 GLN QE . . 4.260 2.416 1.859 3.316 . 0 0 "[ . 1 . 2]" 1
246 1 16 ARG HG2 1 19 GLN HE21 . . 5.500 2.879 1.958 4.213 . 0 0 "[ . 1 . 2]" 1
247 1 16 ARG HG2 1 19 GLN HE22 . . 5.500 3.037 2.160 4.825 . 0 0 "[ . 1 . 2]" 1
248 1 16 ARG HG3 1 19 GLN HE21 . . 5.500 4.002 2.845 5.083 . 0 0 "[ . 1 . 2]" 1
249 1 16 ARG HG3 1 19 GLN HE22 . . 5.500 3.894 2.888 4.641 . 0 0 "[ . 1 . 2]" 1
250 1 16 ARG HH11 1 17 ASP HB2 . . 5.500 4.413 3.438 5.372 . 0 0 "[ . 1 . 2]" 1
251 1 16 ARG HH12 1 17 ASP HB2 . . 5.500 5.191 4.458 5.526 0.026 11 0 "[ . 1 . 2]" 1
252 1 17 ASP H 1 17 ASP HB2 . . 2.710 2.422 2.188 2.676 . 0 0 "[ . 1 . 2]" 1
253 1 17 ASP H 1 17 ASP HB3 . . 2.940 2.767 2.591 2.947 0.007 3 0 "[ . 1 . 2]" 1
254 1 17 ASP H 1 18 CYS H . . 3.250 2.635 2.214 2.816 . 0 0 "[ . 1 . 2]" 1
255 1 17 ASP H 1 19 GLN H . . 4.900 4.263 3.975 4.730 . 0 0 "[ . 1 . 2]" 1
256 1 17 ASP HA 1 19 GLN H . . 4.180 3.872 3.679 4.209 0.029 20 0 "[ . 1 . 2]" 1
257 1 17 ASP HB2 1 18 CYS H . . 4.480 4.054 3.587 4.476 . 0 0 "[ . 1 . 2]" 1
258 1 17 ASP HB3 1 18 CYS H . . 3.920 3.268 2.507 3.957 0.037 6 0 "[ . 1 . 2]" 1
259 1 17 ASP HB3 1 32 ILE MD . . 5.240 3.494 2.837 4.229 . 0 0 "[ . 1 . 2]" 1
260 1 18 CYS H 1 18 CYS QB . . 3.570 2.752 2.339 3.069 . 0 0 "[ . 1 . 2]" 1
261 1 18 CYS H 1 19 GLN H . . 2.740 2.388 1.895 2.835 0.095 15 0 "[ . 1 . 2]" 1
262 1 18 CYS H 1 19 GLN HA . . 4.570 4.343 4.102 4.578 0.008 10 0 "[ . 1 . 2]" 1
263 1 18 CYS H 1 19 GLN QB . . 4.330 4.033 3.612 4.330 . 0 0 "[ . 1 . 2]" 1
264 1 18 CYS HA 1 19 GLN H . . 3.540 2.991 2.754 3.181 . 0 0 "[ . 1 . 2]" 1
265 1 18 CYS HA 1 20 ALA H . . 4.000 3.177 2.973 3.342 . 0 0 "[ . 1 . 2]" 1
266 1 18 CYS HA 1 20 ALA MB . . 5.190 3.916 3.656 4.113 . 0 0 "[ . 1 . 2]" 1
267 1 18 CYS HA 1 23 SER H . . 5.500 5.341 5.072 5.621 0.121 20 0 "[ . 1 . 2]" 1
268 1 18 CYS QB 1 20 ALA H . . 5.340 4.418 3.925 4.644 . 0 0 "[ . 1 . 2]" 1
269 1 18 CYS QB 1 23 SER H . . 5.340 4.634 4.171 5.019 . 0 0 "[ . 1 . 2]" 1
270 1 18 CYS QB 1 24 PHE H . . 4.560 3.446 3.204 3.779 . 0 0 "[ . 1 . 2]" 1
271 1 18 CYS QB 1 24 PHE HA . . 4.440 2.179 1.960 2.761 . 0 0 "[ . 1 . 2]" 1
272 1 18 CYS QB 1 24 PHE HD1 . . 4.040 2.443 1.979 3.853 . 0 0 "[ . 1 . 2]" 1
273 1 18 CYS QB 1 25 SER H . . 4.530 3.972 3.692 4.524 . 0 0 "[ . 1 . 2]" 1
274 1 18 CYS HB2 1 24 PHE HD1 . . 4.680 2.616 2.173 4.128 . 0 0 "[ . 1 . 2]" 1
275 1 18 CYS HB3 1 24 PHE HD1 . . 4.680 3.023 2.212 4.616 . 0 0 "[ . 1 . 2]" 1
276 1 19 GLN H 1 19 GLN HB2 . . 3.580 2.818 2.123 3.591 0.011 17 0 "[ . 1 . 2]" 1
277 1 19 GLN H 1 19 GLN QB . . 2.710 2.309 2.104 2.559 . 0 0 "[ . 1 . 2]" 1
278 1 19 GLN H 1 19 GLN HB3 . . 3.580 2.835 2.361 3.564 . 0 0 "[ . 1 . 2]" 1
279 1 19 GLN H 1 19 GLN QG . . 4.010 2.942 1.924 4.022 0.012 16 0 "[ . 1 . 2]" 1
280 1 19 GLN H 1 20 ALA H . . 3.380 2.611 2.340 2.709 . 0 0 "[ . 1 . 2]" 1
281 1 19 GLN H 1 20 ALA HA . . 5.500 5.166 4.950 5.277 . 0 0 "[ . 1 . 2]" 1
282 1 19 GLN H 1 20 ALA MB . . 4.740 4.168 3.841 4.291 . 0 0 "[ . 1 . 2]" 1
283 1 19 GLN QB 1 19 GLN QG . . 2.250 2.074 2.018 2.086 . 0 0 "[ . 1 . 2]" 1
284 1 19 GLN QB 1 20 ALA H . . 3.700 3.291 2.800 3.720 0.020 12 0 "[ . 1 . 2]" 1
285 1 19 GLN HB2 1 20 ALA H . . 4.520 3.853 3.165 4.366 . 0 0 "[ . 1 . 2]" 1
286 1 19 GLN HB3 1 20 ALA H . . 4.520 3.695 2.858 4.252 . 0 0 "[ . 1 . 2]" 1
287 1 19 GLN QE 1 19 GLN QG . . 2.980 2.356 2.077 2.551 . 0 0 "[ . 1 . 2]" 1
288 1 20 ALA H 1 20 ALA MB . . 2.640 2.117 2.025 2.356 . 0 0 "[ . 1 . 2]" 1
289 1 20 ALA H 1 23 SER QB . . 3.770 3.096 2.677 3.324 . 0 0 "[ . 1 . 2]" 1
290 1 20 ALA HA 1 21 PRO HA . . 4.540 4.388 4.387 4.389 . 0 0 "[ . 1 . 2]" 1
291 1 20 ALA HA 1 21 PRO HB3 . . 4.970 4.866 4.856 4.872 . 0 0 "[ . 1 . 2]" 1
292 1 20 ALA HA 1 21 PRO HG2 . . 5.500 4.591 4.555 4.611 . 0 0 "[ . 1 . 2]" 1
293 1 20 ALA HA 1 21 PRO HG3 . . 5.500 4.532 4.503 4.548 . 0 0 "[ . 1 . 2]" 1
294 1 20 ALA MB 1 21 PRO QD . . 3.370 1.941 1.921 2.056 . 0 0 "[ . 1 . 2]" 1
295 1 20 ALA MB 1 21 PRO QG . . 5.190 3.502 3.478 3.536 . 0 0 "[ . 1 . 2]" 1
296 1 20 ALA MB 1 23 SER H . . 4.320 3.971 3.744 4.146 . 0 0 "[ . 1 . 2]" 1
297 1 20 ALA MB 1 23 SER HB2 . . 3.940 2.245 1.971 2.489 . 0 0 "[ . 1 . 2]" 1
298 1 20 ALA MB 1 23 SER QB . . 3.430 2.161 1.888 2.403 . 0 0 "[ . 1 . 2]" 1
299 1 20 ALA MB 1 23 SER HB3 . . 3.940 2.869 2.396 3.168 . 0 0 "[ . 1 . 2]" 1
300 1 20 ALA MB 1 24 PHE H . . 5.500 5.110 4.965 5.176 . 0 0 "[ . 1 . 2]" 1
301 1 21 PRO HA 1 22 ASP H . . 3.010 2.184 2.160 2.233 . 0 0 "[ . 1 . 2]" 1
302 1 21 PRO HA 1 23 SER H . . 3.630 3.478 3.393 3.569 . 0 0 "[ . 1 . 2]" 1
303 1 21 PRO HA 1 78 THR HB . . 5.500 5.046 4.091 5.539 0.039 11 0 "[ . 1 . 2]" 1
304 1 21 PRO HA 1 78 THR MG . . 3.920 2.883 1.989 3.483 . 0 0 "[ . 1 . 2]" 1
305 1 21 PRO HB2 1 22 ASP H . . 3.450 3.323 3.105 3.463 0.013 5 0 "[ . 1 . 2]" 1
306 1 21 PRO HB2 1 23 SER H . . 5.500 5.004 4.957 5.047 . 0 0 "[ . 1 . 2]" 1
307 1 21 PRO HB2 1 78 THR MG . . 4.230 3.428 2.241 4.061 . 0 0 "[ . 1 . 2]" 1
308 1 21 PRO HB3 1 22 ASP H . . 4.020 3.864 3.727 3.953 . 0 0 "[ . 1 . 2]" 1
309 1 21 PRO HB3 1 23 SER H . . 5.500 5.513 5.443 5.568 0.068 14 0 "[ . 1 . 2]" 1
310 1 21 PRO HB3 1 78 THR MG . . 3.760 2.773 1.969 3.458 . 0 0 "[ . 1 . 2]" 1
311 1 22 ASP H 1 23 SER H . . 3.340 2.720 2.603 2.881 . 0 0 "[ . 1 . 2]" 1
312 1 22 ASP H 1 23 SER QB . . 5.050 4.579 4.459 4.757 . 0 0 "[ . 1 . 2]" 1
313 1 22 ASP H 1 24 PHE H . . 4.300 3.956 3.727 4.278 . 0 0 "[ . 1 . 2]" 1
314 1 22 ASP H 1 78 THR H . . 5.500 5.100 4.243 5.518 0.018 2 0 "[ . 1 . 2]" 1
315 1 22 ASP H 1 78 THR HB . . 5.340 4.693 3.569 5.346 0.006 4 0 "[ . 1 . 2]" 1
316 1 22 ASP H 1 78 THR MG . . 4.770 3.377 2.143 4.244 . 0 0 "[ . 1 . 2]" 1
317 1 22 ASP H 1 81 GLU H . . 4.770 3.701 2.803 4.393 . 0 0 "[ . 1 . 2]" 1
318 1 22 ASP H 1 81 GLU QG . . 3.820 2.312 1.895 2.913 . 0 0 "[ . 1 . 2]" 1
319 1 22 ASP HA 1 24 PHE H . . 3.850 3.746 3.440 3.881 0.031 4 0 "[ . 1 . 2]" 1
320 1 23 SER H 1 23 SER HB2 . . 3.810 2.658 2.244 3.116 . 0 0 "[ . 1 . 2]" 1
321 1 23 SER H 1 23 SER QB . . 3.180 2.381 2.212 2.497 . 0 0 "[ . 1 . 2]" 1
322 1 23 SER H 1 23 SER HB3 . . 3.810 3.084 2.359 3.665 . 0 0 "[ . 1 . 2]" 1
323 1 23 SER H 1 24 PHE H . . 3.020 1.985 1.877 2.159 . 0 0 "[ . 1 . 2]" 1
324 1 23 SER H 1 81 GLU QG . . 4.390 3.226 2.495 3.951 . 0 0 "[ . 1 . 2]" 1
325 1 23 SER QB 1 24 PHE H . . 3.950 3.057 2.932 3.220 . 0 0 "[ . 1 . 2]" 1
326 1 23 SER HB2 1 24 PHE H . . 4.510 3.692 3.065 4.310 . 0 0 "[ . 1 . 2]" 1
327 1 23 SER HB3 1 24 PHE H . . 4.510 3.461 3.050 3.887 . 0 0 "[ . 1 . 2]" 1
328 1 24 PHE H 1 24 PHE QB . . 2.730 2.325 2.259 2.392 . 0 0 "[ . 1 . 2]" 1
329 1 24 PHE H 1 24 PHE HD1 . . 5.430 4.838 4.502 5.083 . 0 0 "[ . 1 . 2]" 1
330 1 24 PHE H 1 24 PHE HD2 . . 5.500 4.643 4.324 5.022 . 0 0 "[ . 1 . 2]" 1
331 1 24 PHE H 1 25 SER H . . 4.750 4.506 3.993 4.563 . 0 0 "[ . 1 . 2]" 1
332 1 24 PHE H 1 81 GLU HB3 . . 5.230 4.628 4.146 5.246 0.016 18 0 "[ . 1 . 2]" 1
333 1 24 PHE H 1 81 GLU QG . . 3.710 2.724 1.917 3.933 0.223 3 0 "[ . 1 . 2]" 1
334 1 24 PHE HA 1 24 PHE HD1 . . 4.110 2.369 2.082 3.031 . 0 0 "[ . 1 . 2]" 1
335 1 24 PHE HA 1 25 SER H . . 2.550 2.227 2.149 2.299 . 0 0 "[ . 1 . 2]" 1
336 1 24 PHE HA 1 25 SER QB . . 4.880 4.331 3.993 4.701 . 0 0 "[ . 1 . 2]" 1
337 1 24 PHE QB 1 77 LEU MD2 . . 5.200 3.383 2.950 3.782 . 0 0 "[ . 1 . 2]" 1
338 1 24 PHE HD1 1 25 SER H . . 4.040 2.757 2.268 3.869 . 0 0 "[ . 1 . 2]" 1
339 1 24 PHE HD2 1 67 LEU QD . . 3.650 2.803 2.482 3.096 . 0 0 "[ . 1 . 2]" 1
340 1 24 PHE HD2 1 77 LEU MD2 . . 4.510 2.559 2.026 3.035 . 0 0 "[ . 1 . 2]" 1
341 1 24 PHE HE1 1 25 SER H . . 5.260 3.979 3.565 5.311 0.051 10 0 "[ . 1 . 2]" 1
342 1 24 PHE HE2 1 67 LEU QD . . 4.920 2.221 1.902 2.836 . 0 0 "[ . 1 . 2]" 1
343 1 24 PHE HE2 1 67 LEU HG . . 5.130 4.033 3.552 4.490 . 0 0 "[ . 1 . 2]" 1
344 1 24 PHE HE2 1 77 LEU MD1 . . 5.500 3.640 2.593 4.405 . 0 0 "[ . 1 . 2]" 1
345 1 24 PHE HE2 1 77 LEU MD2 . . 5.110 3.549 2.890 3.870 . 0 0 "[ . 1 . 2]" 1
346 1 25 SER H 1 25 SER HB2 . . 4.030 3.145 2.257 4.025 . 0 0 "[ . 1 . 2]" 1
347 1 25 SER H 1 25 SER QB . . 3.280 2.974 2.232 3.343 0.063 2 0 "[ . 1 . 2]" 1
348 1 25 SER H 1 25 SER HB3 . . 4.030 3.850 3.517 4.007 . 0 0 "[ . 1 . 2]" 1
349 1 25 SER H 1 28 LYS H . . 5.390 4.450 4.201 4.825 . 0 0 "[ . 1 . 2]" 1
350 1 25 SER HA 1 26 PRO HD3 . . 4.060 2.334 2.299 2.352 . 0 0 "[ . 1 . 2]" 1
351 1 25 SER HA 1 27 LYS H . . 4.370 4.279 4.020 4.395 0.025 10 0 "[ . 1 . 2]" 1
352 1 25 SER QB 1 26 PRO HB2 . . 5.200 5.104 5.049 5.222 0.022 8 0 "[ . 1 . 2]" 1
353 1 25 SER QB 1 26 PRO HB3 . . 5.340 5.148 5.114 5.226 . 0 0 "[ . 1 . 2]" 1
354 1 25 SER QB 1 26 PRO HD2 . . 3.090 1.990 1.925 2.145 . 0 0 "[ . 1 . 2]" 1
355 1 25 SER QB 1 26 PRO HG2 . . 3.780 3.681 3.606 3.775 . 0 0 "[ . 1 . 2]" 1
356 1 25 SER QB 1 27 LYS H . . 3.740 2.610 2.327 2.793 . 0 0 "[ . 1 . 2]" 1
357 1 25 SER QB 1 28 LYS QB . . 3.840 2.504 2.103 3.380 . 0 0 "[ . 1 . 2]" 1
358 1 25 SER HB2 1 28 LYS H . . 4.940 3.848 2.948 4.399 . 0 0 "[ . 1 . 2]" 1
359 1 25 SER HB3 1 28 LYS H . . 4.940 4.428 3.859 5.036 0.096 6 0 "[ . 1 . 2]" 1
360 1 26 PRO HA 1 28 LYS H . . 4.170 3.685 3.613 3.742 . 0 0 "[ . 1 . 2]" 1
361 1 26 PRO HA 1 29 PHE H . . 4.670 3.901 3.711 4.046 . 0 0 "[ . 1 . 2]" 1
362 1 26 PRO HA 1 29 PHE HD1 . . 4.120 2.310 2.037 2.496 . 0 0 "[ . 1 . 2]" 1
363 1 26 PRO HA 1 29 PHE HE1 . . 4.150 2.005 1.981 2.091 . 0 0 "[ . 1 . 2]" 1
364 1 26 PRO HA 1 30 PHE H . . 4.810 4.542 4.220 4.715 . 0 0 "[ . 1 . 2]" 1
365 1 26 PRO HA 1 30 PHE HD1 . . 5.500 5.525 5.445 5.566 0.066 16 0 "[ . 1 . 2]" 1
366 1 26 PRO HB2 1 27 LYS H . . 3.600 3.280 3.142 3.568 . 0 0 "[ . 1 . 2]" 1
367 1 26 PRO HB2 1 29 PHE HD1 . . 5.000 4.681 4.423 4.911 . 0 0 "[ . 1 . 2]" 1
368 1 26 PRO HB2 1 29 PHE HE1 . . 5.180 3.551 3.185 3.822 . 0 0 "[ . 1 . 2]" 1
369 1 26 PRO HB3 1 27 LYS H . . 4.250 4.109 4.029 4.276 0.026 8 0 "[ . 1 . 2]" 1
370 1 26 PRO HB3 1 28 LYS H . . 5.500 5.514 5.394 5.559 0.059 17 0 "[ . 1 . 2]" 1
371 1 26 PRO HB3 1 29 PHE HD1 . . 4.790 4.595 4.325 4.789 . 0 0 "[ . 1 . 2]" 1
372 1 26 PRO HB3 1 29 PHE HE1 . . 4.690 3.375 3.138 3.519 . 0 0 "[ . 1 . 2]" 1
373 1 26 PRO HB3 1 85 PHE HA . . 4.080 3.713 3.182 4.095 0.015 19 0 "[ . 1 . 2]" 1
374 1 26 PRO HD2 1 27 LYS H . . 4.230 2.661 2.651 2.693 . 0 0 "[ . 1 . 2]" 1
375 1 26 PRO HD3 1 29 PHE HD1 . . 5.500 5.423 5.189 5.518 0.018 17 0 "[ . 1 . 2]" 1
376 1 26 PRO HD3 1 29 PHE HE1 . . 5.500 5.478 5.354 5.530 0.030 2 0 "[ . 1 . 2]" 1
377 1 26 PRO HG2 1 27 LYS H . . 2.860 2.312 2.148 2.684 . 0 0 "[ . 1 . 2]" 1
378 1 26 PRO HG3 1 85 PHE HA . . 3.980 2.057 1.953 2.301 . 0 0 "[ . 1 . 2]" 1
379 1 27 LYS H 1 27 LYS HE2 . . 5.500 4.848 3.705 5.494 . 0 0 "[ . 1 . 2]" 1
380 1 27 LYS H 1 27 LYS HE3 . . 5.500 4.825 3.450 5.483 . 0 0 "[ . 1 . 2]" 1
381 1 27 LYS H 1 27 LYS HG2 . . 5.060 2.809 1.944 4.626 . 0 0 "[ . 1 . 2]" 1
382 1 27 LYS H 1 27 LYS QG . . 4.310 2.408 1.933 4.014 . 0 0 "[ . 1 . 2]" 1
383 1 27 LYS H 1 27 LYS HG3 . . 5.060 3.084 2.100 4.518 . 0 0 "[ . 1 . 2]" 1
384 1 27 LYS H 1 28 LYS H . . 3.220 2.855 2.525 3.024 . 0 0 "[ . 1 . 2]" 1
385 1 27 LYS H 1 30 PHE HB3 . . 5.500 5.402 5.122 5.551 0.051 16 0 "[ . 1 . 2]" 1
386 1 27 LYS H 1 85 PHE HA . . 5.500 5.531 5.288 5.625 0.125 10 0 "[ . 1 . 2]" 1
387 1 27 LYS HA 1 30 PHE H . . 4.200 3.878 3.771 3.933 . 0 0 "[ . 1 . 2]" 1
388 1 27 LYS HA 1 30 PHE HB2 . . 4.890 4.649 4.484 4.763 . 0 0 "[ . 1 . 2]" 1
389 1 27 LYS HA 1 30 PHE HB3 . . 4.450 3.235 3.061 3.394 . 0 0 "[ . 1 . 2]" 1
390 1 27 LYS HA 1 30 PHE HD1 . . 3.750 2.887 2.741 3.037 . 0 0 "[ . 1 . 2]" 1
391 1 27 LYS HA 1 30 PHE HE1 . . 5.060 3.881 3.557 4.199 . 0 0 "[ . 1 . 2]" 1
392 1 27 LYS QB 1 27 LYS QD . . 3.250 2.211 1.943 2.353 . 0 0 "[ . 1 . 2]" 1
393 1 27 LYS QB 1 27 LYS QG . . 2.370 2.062 1.986 2.087 . 0 0 "[ . 1 . 2]" 1
394 1 28 LYS H 1 28 LYS QB . . 3.400 2.568 2.481 2.649 . 0 0 "[ . 1 . 2]" 1
395 1 28 LYS H 1 29 PHE H . . 3.000 1.890 1.870 1.947 . 0 0 "[ . 1 . 2]" 1
396 1 28 LYS H 1 29 PHE QB . . 5.070 4.051 3.981 4.111 . 0 0 "[ . 1 . 2]" 1
397 1 28 LYS H 1 30 PHE H . . 3.930 2.857 2.746 3.084 . 0 0 "[ . 1 . 2]" 1
398 1 28 LYS H 1 31 GLN H . . 5.500 4.882 4.625 5.126 . 0 0 "[ . 1 . 2]" 1
399 1 28 LYS H 1 32 ILE MD . . 5.500 5.143 4.985 5.232 . 0 0 "[ . 1 . 2]" 1
400 1 28 LYS HA 1 28 LYS QD . . 3.960 2.470 1.978 3.361 . 0 0 "[ . 1 . 2]" 1
401 1 28 LYS HA 1 30 PHE H . . 4.580 4.108 3.935 4.313 . 0 0 "[ . 1 . 2]" 1
402 1 28 LYS HA 1 31 GLN H . . 4.550 4.349 4.146 4.516 . 0 0 "[ . 1 . 2]" 1
403 1 28 LYS HA 1 31 GLN HE21 . . 5.500 2.877 2.277 3.259 . 0 0 "[ . 1 . 2]" 1
404 1 28 LYS QB 1 31 GLN HE22 . . 4.880 4.529 3.960 4.901 0.021 15 0 "[ . 1 . 2]" 1
405 1 28 LYS HB2 1 31 GLN HE21 . . 5.500 4.925 4.543 5.294 . 0 0 "[ . 1 . 2]" 1
406 1 28 LYS HB3 1 31 GLN HE21 . . 5.500 4.352 3.398 4.879 . 0 0 "[ . 1 . 2]" 1
407 1 28 LYS QD 1 29 PHE H . . 5.210 4.678 3.606 5.154 . 0 0 "[ . 1 . 2]" 1
408 1 28 LYS QD 1 31 GLN HE21 . . 5.340 3.069 2.286 4.229 . 0 0 "[ . 1 . 2]" 1
409 1 28 LYS QD 1 31 GLN HE22 . . 4.040 2.942 2.153 4.036 . 0 0 "[ . 1 . 2]" 1
410 1 28 LYS QE 1 31 GLN HE21 . . 4.340 3.624 2.600 4.351 0.011 12 0 "[ . 1 . 2]" 1
411 1 28 LYS QE 1 31 GLN HE22 . . 4.480 3.305 2.002 4.213 . 0 0 "[ . 1 . 2]" 1
412 1 28 LYS HE2 1 31 GLN HE21 . . 5.040 4.283 2.680 5.008 . 0 0 "[ . 1 . 2]" 1
413 1 28 LYS HE2 1 31 GLN HE22 . . 5.180 3.994 2.010 5.075 . 0 0 "[ . 1 . 2]" 1
414 1 28 LYS HE3 1 31 GLN HE21 . . 5.040 4.219 2.800 5.025 . 0 0 "[ . 1 . 2]" 1
415 1 28 LYS HE3 1 31 GLN HE22 . . 5.180 3.876 2.342 5.014 . 0 0 "[ . 1 . 2]" 1
416 1 29 PHE H 1 29 PHE HD1 . . 3.630 2.025 1.932 2.162 . 0 0 "[ . 1 . 2]" 1
417 1 29 PHE H 1 30 PHE H . . 3.380 2.342 2.247 2.401 . 0 0 "[ . 1 . 2]" 1
418 1 29 PHE H 1 30 PHE HB3 . . 5.500 4.356 4.206 4.421 . 0 0 "[ . 1 . 2]" 1
419 1 29 PHE H 1 32 ILE MD . . 4.420 3.895 3.768 3.977 . 0 0 "[ . 1 . 2]" 1
420 1 29 PHE HA 1 29 PHE HD1 . . 4.830 4.124 4.053 4.206 . 0 0 "[ . 1 . 2]" 1
421 1 29 PHE HA 1 29 PHE HD2 . . 4.490 4.168 4.100 4.244 . 0 0 "[ . 1 . 2]" 1
422 1 29 PHE HA 1 32 ILE H . . 5.050 2.825 2.723 2.988 . 0 0 "[ . 1 . 2]" 1
423 1 29 PHE HA 1 32 ILE HB . . 4.300 2.419 2.224 2.565 . 0 0 "[ . 1 . 2]" 1
424 1 29 PHE HA 1 32 ILE MD . . 3.450 1.924 1.886 2.006 . 0 0 "[ . 1 . 2]" 1
425 1 29 PHE QB 1 29 PHE HE1 . . 4.710 4.486 4.454 4.510 . 0 0 "[ . 1 . 2]" 1
426 1 29 PHE QB 1 29 PHE HE2 . . 4.750 4.341 4.329 4.360 . 0 0 "[ . 1 . 2]" 1
427 1 29 PHE QB 1 30 PHE H . . 4.310 3.640 3.561 3.713 . 0 0 "[ . 1 . 2]" 1
428 1 29 PHE QB 1 30 PHE HD1 . . 5.500 5.051 4.913 5.125 . 0 0 "[ . 1 . 2]" 1
429 1 29 PHE QB 1 32 ILE MD . . 4.190 2.984 2.854 3.281 . 0 0 "[ . 1 . 2]" 1
430 1 29 PHE HD1 1 30 PHE H . . 3.940 2.787 2.597 3.070 . 0 0 "[ . 1 . 2]" 1
431 1 30 PHE H 1 30 PHE HB3 . . 3.030 2.322 2.262 2.372 . 0 0 "[ . 1 . 2]" 1
432 1 30 PHE H 1 30 PHE HD1 . . 4.400 1.970 1.927 2.096 . 0 0 "[ . 1 . 2]" 1
433 1 30 PHE H 1 31 GLN H . . 3.400 2.748 2.680 2.776 . 0 0 "[ . 1 . 2]" 1
434 1 30 PHE H 1 31 GLN HA . . 5.500 5.355 5.299 5.377 . 0 0 "[ . 1 . 2]" 1
435 1 30 PHE H 1 31 GLN HB3 . . 5.110 4.996 4.897 5.083 . 0 0 "[ . 1 . 2]" 1
436 1 30 PHE H 1 32 ILE MD . . 5.010 4.633 4.528 4.704 . 0 0 "[ . 1 . 2]" 1
437 1 30 PHE H 1 35 MET H . . 5.500 5.491 5.343 5.590 0.090 8 0 "[ . 1 . 2]" 1
438 1 30 PHE H 1 35 MET ME . . 5.500 3.990 3.596 4.240 . 0 0 "[ . 1 . 2]" 1
439 1 30 PHE H 1 35 MET HG3 . . 5.500 5.510 5.297 5.570 0.070 2 0 "[ . 1 . 2]" 1
440 1 30 PHE H 1 106 VAL MG1 . . 5.500 4.823 4.412 5.123 . 0 0 "[ . 1 . 2]" 1
441 1 30 PHE HB2 1 30 PHE HE2 . . 4.990 4.602 4.594 4.614 . 0 0 "[ . 1 . 2]" 1
442 1 30 PHE HB2 1 31 GLN H . . 4.610 4.039 3.952 4.123 . 0 0 "[ . 1 . 2]" 1
443 1 30 PHE HB2 1 35 MET HB2 . . 4.730 2.458 1.993 2.671 . 0 0 "[ . 1 . 2]" 1
444 1 30 PHE HB2 1 36 SER H . . 4.180 3.574 3.140 3.951 . 0 0 "[ . 1 . 2]" 1
445 1 30 PHE HB2 1 36 SER HA . . 5.060 3.765 3.513 3.988 . 0 0 "[ . 1 . 2]" 1
446 1 30 PHE HB2 1 106 VAL MG1 . . 4.480 2.151 1.907 2.426 . 0 0 "[ . 1 . 2]" 1
447 1 30 PHE HB3 1 30 PHE HE1 . . 4.990 4.779 4.736 4.839 . 0 0 "[ . 1 . 2]" 1
448 1 30 PHE HB3 1 31 GLN H . . 3.960 3.889 3.824 3.954 . 0 0 "[ . 1 . 2]" 1
449 1 30 PHE HB3 1 35 MET HB2 . . 4.690 3.527 3.098 3.701 . 0 0 "[ . 1 . 2]" 1
450 1 30 PHE HB3 1 36 SER H . . 5.500 5.174 4.794 5.549 0.049 1 0 "[ . 1 . 2]" 1
451 1 30 PHE HB3 1 36 SER HA . . 5.500 5.427 5.217 5.534 0.034 2 0 "[ . 1 . 2]" 1
452 1 30 PHE HB3 1 106 VAL MG1 . . 4.460 2.864 2.445 3.296 . 0 0 "[ . 1 . 2]" 1
453 1 30 PHE HD2 1 35 MET HB3 . . 5.400 4.865 3.974 5.323 . 0 0 "[ . 1 . 2]" 1
454 1 30 PHE HD2 1 36 SER H . . 3.900 3.493 2.738 3.779 . 0 0 "[ . 1 . 2]" 1
455 1 30 PHE HD2 1 106 VAL MG1 . . 3.570 2.809 2.293 3.182 . 0 0 "[ . 1 . 2]" 1
456 1 30 PHE HE1 1 31 GLN H . . 4.090 3.845 3.613 4.098 0.008 15 0 "[ . 1 . 2]" 1
457 1 30 PHE HE2 1 106 VAL MG1 . . 5.500 4.604 3.842 5.086 . 0 0 "[ . 1 . 2]" 1
458 1 31 GLN H 1 31 GLN HB3 . . 2.700 2.534 2.412 2.652 . 0 0 "[ . 1 . 2]" 1
459 1 31 GLN H 1 31 GLN HG2 . . 3.040 2.376 2.271 2.556 . 0 0 "[ . 1 . 2]" 1
460 1 31 GLN H 1 32 ILE H . . 3.100 2.272 2.163 2.360 . 0 0 "[ . 1 . 2]" 1
461 1 31 GLN H 1 32 ILE HB . . 4.730 4.502 4.362 4.593 . 0 0 "[ . 1 . 2]" 1
462 1 31 GLN H 1 32 ILE MD . . 4.560 4.213 3.951 4.307 . 0 0 "[ . 1 . 2]" 1
463 1 31 GLN H 1 32 ILE HG13 . . 4.430 3.994 3.857 4.122 . 0 0 "[ . 1 . 2]" 1
464 1 31 GLN HA 1 31 GLN HE21 . . 5.500 5.522 5.501 5.543 0.043 10 0 "[ . 1 . 2]" 1
465 1 31 GLN HA 1 31 GLN HG2 . . 4.130 3.650 3.622 3.672 . 0 0 "[ . 1 . 2]" 1
466 1 31 GLN HA 1 36 SER H . . 3.920 3.465 3.345 3.723 . 0 0 "[ . 1 . 2]" 1
467 1 31 GLN HA 1 37 LYS H . . 5.500 5.451 5.173 5.578 0.078 1 0 "[ . 1 . 2]" 1
468 1 31 GLN HB3 1 32 ILE H . . 3.920 3.875 3.821 3.972 0.052 1 0 "[ . 1 . 2]" 1
469 1 31 GLN HE21 1 32 ILE HA . . 5.500 5.515 5.477 5.531 0.031 10 0 "[ . 1 . 2]" 1
470 1 31 GLN HE21 1 32 ILE MD . . 5.500 3.024 2.658 3.249 . 0 0 "[ . 1 . 2]" 1
471 1 31 GLN HE21 1 32 ILE HG12 . . 5.500 4.588 4.460 4.695 . 0 0 "[ . 1 . 2]" 1
472 1 31 GLN HG2 1 32 ILE H . . 4.310 2.150 2.038 2.530 . 0 0 "[ . 1 . 2]" 1
473 1 32 ILE H 1 32 ILE HB . . 3.050 2.484 2.444 2.514 . 0 0 "[ . 1 . 2]" 1
474 1 32 ILE H 1 32 ILE MD . . 3.450 3.158 2.969 3.233 . 0 0 "[ . 1 . 2]" 1
475 1 32 ILE H 1 32 ILE HG12 . . 4.000 3.789 3.712 4.025 0.025 1 0 "[ . 1 . 2]" 1
476 1 32 ILE H 1 32 ILE HG13 . . 3.010 2.334 2.239 2.640 . 0 0 "[ . 1 . 2]" 1
477 1 32 ILE H 1 33 SER H . . 3.410 2.704 2.528 2.864 . 0 0 "[ . 1 . 2]" 1
478 1 32 ILE H 1 34 GLY H . . 4.140 4.051 3.738 4.248 0.108 1 0 "[ . 1 . 2]" 1
479 1 32 ILE HA 1 32 ILE HG12 . . 3.360 2.820 2.769 2.951 . 0 0 "[ . 1 . 2]" 1
480 1 32 ILE HA 1 32 ILE HG13 . . 3.620 2.656 2.568 2.723 . 0 0 "[ . 1 . 2]" 1
481 1 32 ILE HA 1 32 ILE MG . . 3.020 2.339 2.314 2.374 . 0 0 "[ . 1 . 2]" 1
482 1 32 ILE HB 1 32 ILE MD . . 3.370 2.220 2.146 2.298 . 0 0 "[ . 1 . 2]" 1
483 1 32 ILE HB 1 33 SER H . . 3.290 2.251 2.044 2.487 . 0 0 "[ . 1 . 2]" 1
484 1 32 ILE HB 1 33 SER HA . . 5.040 4.267 4.167 4.370 . 0 0 "[ . 1 . 2]" 1
485 1 32 ILE MD 1 33 SER H . . 5.120 4.052 3.814 4.274 . 0 0 "[ . 1 . 2]" 1
486 1 32 ILE HG12 1 32 ILE MG . . 2.850 2.209 2.136 2.253 . 0 0 "[ . 1 . 2]" 1
487 1 32 ILE HG12 1 33 SER H . . 5.500 4.915 4.781 5.052 . 0 0 "[ . 1 . 2]" 1
488 1 32 ILE HG13 1 33 SER H . . 4.330 4.259 4.181 4.325 . 0 0 "[ . 1 . 2]" 1
489 1 32 ILE MG 1 33 SER H . . 3.450 3.051 2.848 3.269 . 0 0 "[ . 1 . 2]" 1
490 1 32 ILE MG 1 33 SER HA . . 3.620 3.289 3.217 3.381 . 0 0 "[ . 1 . 2]" 1
491 1 33 SER H 1 33 SER QB . . 3.470 2.476 2.088 2.750 . 0 0 "[ . 1 . 2]" 1
492 1 33 SER H 1 34 GLY H . . 3.130 2.760 2.498 3.004 . 0 0 "[ . 1 . 2]" 1
493 1 33 SER HA 1 35 MET H . . 5.500 5.313 4.942 5.569 0.069 17 0 "[ . 1 . 2]" 1
494 1 33 SER QB 1 34 GLY H . . 4.270 2.908 2.246 3.387 . 0 0 "[ . 1 . 2]" 1
495 1 33 SER HB2 1 34 GLY H . . 4.970 3.260 2.336 4.056 . 0 0 "[ . 1 . 2]" 1
496 1 33 SER HB3 1 34 GLY H . . 4.970 3.570 2.267 3.944 . 0 0 "[ . 1 . 2]" 1
497 1 34 GLY H 1 35 MET H . . 3.140 1.952 1.804 2.185 . 0 0 "[ . 1 . 2]" 1
498 1 34 GLY H 1 35 MET HA . . 4.960 4.536 4.333 4.742 . 0 0 "[ . 1 . 2]" 1
499 1 34 GLY H 1 35 MET HG3 . . 4.240 3.803 3.232 4.110 . 0 0 "[ . 1 . 2]" 1
500 1 34 GLY QA 1 37 LYS H . . 4.250 3.827 3.643 4.191 . 0 0 "[ . 1 . 2]" 1
501 1 34 GLY QA 1 37 LYS QE . . 4.280 3.320 2.558 4.089 . 0 0 "[ . 1 . 2]" 1
502 1 34 GLY HA2 1 37 LYS HE2 . . 5.500 4.352 3.258 5.521 0.021 19 0 "[ . 1 . 2]" 1
503 1 34 GLY HA2 1 37 LYS HE3 . . 5.500 4.940 3.731 5.508 0.008 18 0 "[ . 1 . 2]" 1
504 1 34 GLY HA3 1 37 LYS HE2 . . 5.500 4.003 2.688 5.449 . 0 0 "[ . 1 . 2]" 1
505 1 34 GLY HA3 1 37 LYS HE3 . . 5.500 4.583 3.219 5.466 . 0 0 "[ . 1 . 2]" 1
506 1 35 MET H 1 35 MET HB2 . . 2.680 2.348 2.213 2.469 . 0 0 "[ . 1 . 2]" 1
507 1 35 MET H 1 35 MET ME . . 5.390 4.183 4.044 4.379 . 0 0 "[ . 1 . 2]" 1
508 1 35 MET H 1 35 MET HG3 . . 3.390 2.959 2.675 3.387 . 0 0 "[ . 1 . 2]" 1
509 1 35 MET H 1 37 LYS H . . 5.500 4.250 3.988 4.502 . 0 0 "[ . 1 . 2]" 1
510 1 35 MET HA 1 35 MET HG3 . . 4.230 3.345 3.155 3.395 . 0 0 "[ . 1 . 2]" 1
511 1 35 MET HA 1 37 LYS H . . 4.280 3.763 3.283 3.918 . 0 0 "[ . 1 . 2]" 1
512 1 35 MET HA 1 38 LYS H . . 3.870 3.269 3.187 3.471 . 0 0 "[ . 1 . 2]" 1
513 1 35 MET HA 1 38 LYS QB . . 4.210 3.792 3.659 4.052 . 0 0 "[ . 1 . 2]" 1
514 1 35 MET HA 1 38 LYS QD . . 4.590 3.752 2.772 3.988 . 0 0 "[ . 1 . 2]" 1
515 1 35 MET HA 1 38 LYS QE . . 4.130 2.879 2.723 3.039 . 0 0 "[ . 1 . 2]" 1
516 1 35 MET HA 1 38 LYS QG . . 3.750 1.996 1.908 2.195 . 0 0 "[ . 1 . 2]" 1
517 1 35 MET HB2 1 36 SER H . . 3.600 3.132 2.977 3.616 0.016 1 0 "[ . 1 . 2]" 1
518 1 35 MET HB2 1 36 SER HA . . 5.090 4.477 4.368 4.676 . 0 0 "[ . 1 . 2]" 1
519 1 35 MET HB2 1 106 VAL MG1 . . 3.530 2.873 2.418 3.129 . 0 0 "[ . 1 . 2]" 1
520 1 35 MET HB3 1 36 SER H . . 5.100 3.881 3.520 4.285 . 0 0 "[ . 1 . 2]" 1
521 1 35 MET HB3 1 38 LYS QE . . 5.310 4.910 4.652 5.247 . 0 0 "[ . 1 . 2]" 1
522 1 35 MET HB3 1 38 LYS HG2 . . 5.080 3.375 3.053 3.832 . 0 0 "[ . 1 . 2]" 1
523 1 35 MET HB3 1 38 LYS QG . . 4.300 3.029 2.303 3.537 . 0 0 "[ . 1 . 2]" 1
524 1 35 MET HB3 1 38 LYS HG3 . . 5.080 3.459 2.378 4.153 . 0 0 "[ . 1 . 2]" 1
525 1 35 MET HB3 1 43 LEU MD2 . . 5.120 3.498 3.012 4.349 . 0 0 "[ . 1 . 2]" 1
526 1 35 MET HB3 1 106 VAL MG1 . . 4.450 2.228 1.879 2.517 . 0 0 "[ . 1 . 2]" 1
527 1 35 MET ME 1 36 SER H . . 5.500 4.891 4.648 5.173 . 0 0 "[ . 1 . 2]" 1
528 1 35 MET ME 1 106 VAL MG1 . . 3.930 2.035 1.857 2.552 . 0 0 "[ . 1 . 2]" 1
529 1 35 MET ME 1 106 VAL MG2 . . 3.600 2.030 1.846 2.502 . 0 0 "[ . 1 . 2]" 1
530 1 35 MET HG2 1 38 LYS H . . 5.500 5.401 5.229 5.679 0.179 1 0 "[ . 1 . 2]" 1
531 1 35 MET HG2 1 38 LYS QE . . 4.510 4.505 4.293 4.614 0.104 13 0 "[ . 1 . 2]" 1
532 1 35 MET HG3 1 106 VAL MG1 . . 5.500 4.366 4.000 4.789 . 0 0 "[ . 1 . 2]" 1
533 1 36 SER H 1 36 SER HB2 . . 3.800 3.011 2.184 3.588 . 0 0 "[ . 1 . 2]" 1
534 1 36 SER H 1 36 SER QB . . 3.280 2.292 2.131 2.853 . 0 0 "[ . 1 . 2]" 1
535 1 36 SER H 1 36 SER HB3 . . 3.800 2.580 2.161 3.017 . 0 0 "[ . 1 . 2]" 1
536 1 36 SER H 1 37 LYS H . . 3.350 2.737 2.474 2.770 . 0 0 "[ . 1 . 2]" 1
537 1 36 SER H 1 37 LYS QB . . 5.320 4.884 4.636 5.099 . 0 0 "[ . 1 . 2]" 1
538 1 36 SER H 1 38 LYS H . . 4.500 4.176 4.093 4.300 . 0 0 "[ . 1 . 2]" 1
539 1 36 SER H 1 38 LYS QB . . 5.340 5.275 5.195 5.611 0.271 1 0 "[ . 1 . 2]" 1
540 1 36 SER H 1 38 LYS QG . . 4.590 4.455 4.014 4.627 0.037 13 0 "[ . 1 . 2]" 1
541 1 36 SER H 1 106 VAL MG1 . . 5.500 3.985 3.462 4.454 . 0 0 "[ . 1 . 2]" 1
542 1 36 SER HA 1 37 LYS QG . . 5.340 5.056 4.566 5.306 . 0 0 "[ . 1 . 2]" 1
543 1 36 SER HA 1 38 LYS H . . 4.220 3.981 3.697 4.111 . 0 0 "[ . 1 . 2]" 1
544 1 36 SER HA 1 106 VAL MG1 . . 3.640 2.928 2.619 3.194 . 0 0 "[ . 1 . 2]" 1
545 1 37 LYS H 1 37 LYS HB2 . . 3.780 2.800 2.349 3.581 . 0 0 "[ . 1 . 2]" 1
546 1 37 LYS H 1 37 LYS QB . . 2.940 2.533 2.318 2.682 . 0 0 "[ . 1 . 2]" 1
547 1 37 LYS H 1 37 LYS HB3 . . 3.780 3.383 2.698 3.747 . 0 0 "[ . 1 . 2]" 1
548 1 37 LYS H 1 37 LYS QG . . 3.260 2.179 1.932 2.568 . 0 0 "[ . 1 . 2]" 1
549 1 37 LYS H 1 38 LYS H . . 2.880 2.573 2.231 2.673 . 0 0 "[ . 1 . 2]" 1
550 1 37 LYS H 1 38 LYS HE2 . . 5.500 4.761 4.503 5.461 . 0 0 "[ . 1 . 2]" 1
551 1 37 LYS H 1 38 LYS HE3 . . 5.500 3.789 3.431 4.137 . 0 0 "[ . 1 . 2]" 1
552 1 37 LYS H 1 38 LYS QG . . 4.470 3.858 3.086 4.003 . 0 0 "[ . 1 . 2]" 1
553 1 37 LYS QB 1 38 LYS QE . . 5.180 2.655 2.232 3.524 . 0 0 "[ . 1 . 2]" 1
554 1 38 LYS H 1 38 LYS QB . . 2.650 2.537 2.493 2.617 . 0 0 "[ . 1 . 2]" 1
555 1 38 LYS H 1 38 LYS HD2 . . 5.040 4.328 4.162 4.551 . 0 0 "[ . 1 . 2]" 1
556 1 38 LYS H 1 38 LYS QD . . 4.400 3.565 3.395 4.025 . 0 0 "[ . 1 . 2]" 1
557 1 38 LYS H 1 38 LYS HD3 . . 5.040 3.800 3.598 4.486 . 0 0 "[ . 1 . 2]" 1
558 1 38 LYS H 1 38 LYS QE . . 3.670 2.446 2.164 2.933 . 0 0 "[ . 1 . 2]" 1
559 1 38 LYS H 1 38 LYS QG . . 4.360 2.071 1.934 2.180 . 0 0 "[ . 1 . 2]" 1
560 1 38 LYS H 1 39 SER H . . 4.740 4.596 4.517 4.641 . 0 0 "[ . 1 . 2]" 1
561 1 38 LYS H 1 42 GLN QB . . 5.340 5.392 5.211 5.508 0.168 1 0 "[ . 1 . 2]" 1
562 1 38 LYS H 1 43 LEU MD2 . . 5.500 4.317 4.104 4.509 . 0 0 "[ . 1 . 2]" 1
563 1 38 LYS H 1 106 VAL MG1 . . 5.500 4.437 3.787 4.776 . 0 0 "[ . 1 . 2]" 1
564 1 38 LYS HA 1 38 LYS QD . . 3.550 2.117 1.968 2.952 . 0 0 "[ . 1 . 2]" 1
565 1 38 LYS HA 1 39 SER H . . 2.740 2.552 2.421 2.688 . 0 0 "[ . 1 . 2]" 1
566 1 38 LYS HA 1 43 LEU MD2 . . 5.500 3.937 3.857 4.081 . 0 0 "[ . 1 . 2]" 1
567 1 38 LYS QB 1 38 LYS QD . . 3.050 2.352 2.152 2.410 . 0 0 "[ . 1 . 2]" 1
568 1 38 LYS QB 1 38 LYS QE . . 3.740 3.296 2.958 3.391 . 0 0 "[ . 1 . 2]" 1
569 1 38 LYS QB 1 39 SER H . . 3.140 2.130 1.921 2.366 . 0 0 "[ . 1 . 2]" 1
570 1 38 LYS QB 1 42 GLN H . . 3.620 3.416 3.204 3.685 0.065 1 0 "[ . 1 . 2]" 1
571 1 38 LYS QB 1 42 GLN QB . . 3.810 3.055 2.729 3.251 . 0 0 "[ . 1 . 2]" 1
572 1 38 LYS QB 1 42 GLN HE21 . . 4.990 2.715 2.403 2.973 . 0 0 "[ . 1 . 2]" 1
573 1 38 LYS QB 1 43 LEU H . . 3.670 3.640 3.498 3.793 0.123 17 0 "[ . 1 . 2]" 1
574 1 38 LYS QB 1 43 LEU MD1 . . 4.560 3.470 3.239 3.757 . 0 0 "[ . 1 . 2]" 1
575 1 38 LYS QB 1 43 LEU MD2 . . 4.080 1.792 1.738 1.903 . 0 0 "[ . 1 . 2]" 1
576 1 38 LYS HB2 1 38 LYS HE2 . . 5.020 4.408 4.181 4.659 . 0 0 "[ . 1 . 2]" 1
577 1 38 LYS HB2 1 38 LYS HE3 . . 5.020 4.057 3.907 4.260 . 0 0 "[ . 1 . 2]" 1
578 1 38 LYS HB2 1 43 LEU MD1 . . 5.370 3.858 3.456 4.198 . 0 0 "[ . 1 . 2]" 1
579 1 38 LYS HB3 1 38 LYS HE2 . . 5.020 4.037 3.475 4.292 . 0 0 "[ . 1 . 2]" 1
580 1 38 LYS HB3 1 38 LYS HE3 . . 5.020 4.223 3.510 4.359 . 0 0 "[ . 1 . 2]" 1
581 1 38 LYS HB3 1 43 LEU MD1 . . 5.370 3.950 3.730 4.344 . 0 0 "[ . 1 . 2]" 1
582 1 38 LYS QD 1 39 SER H . . 3.550 3.428 3.247 3.618 0.068 16 0 "[ . 1 . 2]" 1
583 1 38 LYS QD 1 42 GLN HE22 . . 4.260 2.776 2.618 3.661 . 0 0 "[ . 1 . 2]" 1
584 1 38 LYS QE 1 38 LYS QG . . 3.230 1.977 1.930 2.108 . 0 0 "[ . 1 . 2]" 1
585 1 38 LYS QE 1 39 SER H . . 4.730 4.470 3.855 4.737 0.007 10 0 "[ . 1 . 2]" 1
586 1 38 LYS HE2 1 39 SER H . . 5.500 4.732 4.179 5.127 . 0 0 "[ . 1 . 2]" 1
587 1 38 LYS HE3 1 39 SER H . . 5.500 5.523 4.524 5.652 0.152 7 0 "[ . 1 . 2]" 1
588 1 38 LYS QG 1 39 SER H . . 4.790 4.129 4.007 4.277 . 0 0 "[ . 1 . 2]" 1
589 1 38 LYS QG 1 42 GLN H . . 5.340 4.723 4.530 5.300 . 0 0 "[ . 1 . 2]" 1
590 1 38 LYS QG 1 43 LEU H . . 4.760 4.435 4.111 4.833 0.073 1 0 "[ . 1 . 2]" 1
591 1 38 LYS QG 1 43 LEU MD2 . . 4.070 2.120 1.894 2.611 . 0 0 "[ . 1 . 2]" 1
592 1 38 LYS HG2 1 39 SER H . . 5.500 4.795 4.590 4.937 . 0 0 "[ . 1 . 2]" 1
593 1 38 LYS HG3 1 39 SER H . . 5.500 4.506 4.345 4.687 . 0 0 "[ . 1 . 2]" 1
594 1 39 SER H 1 39 SER HB2 . . 3.770 3.370 2.801 3.888 0.118 9 0 "[ . 1 . 2]" 1
595 1 39 SER H 1 39 SER QB . . 3.180 3.009 2.714 3.398 0.218 9 0 "[ . 1 . 2]" 1
596 1 39 SER H 1 39 SER HB3 . . 3.770 3.478 2.968 3.864 0.094 1 0 "[ . 1 . 2]" 1
597 1 39 SER H 1 40 SER H . . 2.900 2.429 1.992 2.758 . 0 0 "[ . 1 . 2]" 1
598 1 39 SER H 1 41 SER H . . 4.190 2.486 2.417 2.620 . 0 0 "[ . 1 . 2]" 1
599 1 39 SER H 1 42 GLN H . . 4.000 3.266 3.128 3.467 . 0 0 "[ . 1 . 2]" 1
600 1 39 SER H 1 42 GLN QB . . 3.980 3.880 3.765 4.020 0.040 13 0 "[ . 1 . 2]" 1
601 1 39 SER H 1 42 GLN HE22 . . 5.500 1.868 1.833 1.934 . 0 0 "[ . 1 . 2]" 1
602 1 39 SER H 1 42 GLN QG . . 5.340 4.645 4.535 4.781 . 0 0 "[ . 1 . 2]" 1
603 1 39 SER H 1 43 LEU MD2 . . 5.420 3.313 2.818 3.563 . 0 0 "[ . 1 . 2]" 1
604 1 39 SER HA 1 40 SER H . . 2.920 2.719 2.500 2.871 . 0 0 "[ . 1 . 2]" 1
605 1 39 SER HA 1 41 SER H . . 4.410 4.216 4.138 4.342 . 0 0 "[ . 1 . 2]" 1
606 1 39 SER HA 1 107 GLN QE . . 4.440 2.662 1.921 4.442 0.002 2 0 "[ . 1 . 2]" 1
607 1 39 SER QB 1 42 GLN HE21 . . 4.790 4.382 3.595 4.860 0.070 9 0 "[ . 1 . 2]" 1
608 1 39 SER HB2 1 40 SER H . . 5.280 4.474 4.252 4.659 . 0 0 "[ . 1 . 2]" 1
609 1 39 SER HB2 1 42 GLN HE21 . . 5.500 4.963 3.701 5.512 0.012 19 0 "[ . 1 . 2]" 1
610 1 39 SER HB2 1 42 GLN HE22 . . 5.500 3.776 2.445 4.713 . 0 0 "[ . 1 . 2]" 1
611 1 39 SER HB3 1 40 SER H . . 5.280 4.427 4.212 4.668 . 0 0 "[ . 1 . 2]" 1
612 1 39 SER HB3 1 42 GLN HE21 . . 5.500 5.005 4.254 5.542 0.042 17 0 "[ . 1 . 2]" 1
613 1 39 SER HB3 1 42 GLN HE22 . . 5.500 3.955 3.398 4.665 . 0 0 "[ . 1 . 2]" 1
614 1 40 SER H 1 40 SER HA . . 2.770 2.276 2.274 2.281 . 0 0 "[ . 1 . 2]" 1
615 1 40 SER H 1 41 SER H . . 4.070 2.677 2.605 2.762 . 0 0 "[ . 1 . 2]" 1
616 1 40 SER H 1 42 GLN H . . 5.120 3.730 3.561 3.865 . 0 0 "[ . 1 . 2]" 1
617 1 40 SER H 1 43 LEU H . . 4.140 3.996 3.827 4.170 0.030 11 0 "[ . 1 . 2]" 1
618 1 40 SER H 1 43 LEU HB2 . . 4.800 4.698 4.358 4.859 0.059 1 0 "[ . 1 . 2]" 1
619 1 40 SER H 1 43 LEU MD1 . . 5.500 2.984 2.219 4.418 . 0 0 "[ . 1 . 2]" 1
620 1 40 SER H 1 107 GLN HE21 . . 4.680 2.966 2.066 4.250 . 0 0 "[ . 1 . 2]" 1
621 1 40 SER H 1 107 GLN QE . . 4.050 2.635 1.971 3.564 . 0 0 "[ . 1 . 2]" 1
622 1 40 SER H 1 107 GLN HE22 . . 4.680 3.064 2.129 4.252 . 0 0 "[ . 1 . 2]" 1
623 1 40 SER HA 1 43 LEU H . . 3.850 3.426 3.293 3.559 . 0 0 "[ . 1 . 2]" 1
624 1 40 SER HA 1 43 LEU HB2 . . 4.060 3.183 2.734 3.403 . 0 0 "[ . 1 . 2]" 1
625 1 40 SER HA 1 43 LEU HB3 . . 4.760 4.402 4.124 4.668 . 0 0 "[ . 1 . 2]" 1
626 1 40 SER HA 1 43 LEU MD1 . . 4.710 2.577 1.934 4.097 . 0 0 "[ . 1 . 2]" 1
627 1 41 SER H 1 41 SER HB2 . . 3.450 2.926 2.435 3.269 . 0 0 "[ . 1 . 2]" 1
628 1 41 SER H 1 41 SER HB3 . . 3.450 2.792 2.390 3.321 . 0 0 "[ . 1 . 2]" 1
629 1 41 SER H 1 42 GLN H . . 4.000 1.897 1.809 2.003 . 0 0 "[ . 1 . 2]" 1
630 1 41 SER H 1 42 GLN QB . . 4.400 4.068 3.924 4.249 . 0 0 "[ . 1 . 2]" 1
631 1 41 SER H 1 42 GLN HE21 . . 5.500 2.406 2.186 2.957 . 0 0 "[ . 1 . 2]" 1
632 1 41 SER QB 1 42 GLN H . . 4.000 3.261 3.166 3.412 . 0 0 "[ . 1 . 2]" 1
633 1 42 GLN H 1 42 GLN QB . . 2.680 2.682 2.556 2.779 0.099 16 0 "[ . 1 . 2]" 1
634 1 42 GLN H 1 42 GLN QG . . 3.540 3.225 3.064 3.586 0.046 19 0 "[ . 1 . 2]" 1
635 1 42 GLN H 1 43 LEU H . . 3.230 1.782 1.694 1.892 . 0 0 "[ . 1 . 2]" 1
636 1 42 GLN H 1 43 LEU MD2 . . 4.470 3.107 2.522 3.627 . 0 0 "[ . 1 . 2]" 1
637 1 42 GLN HA 1 42 GLN HE21 . . 4.940 3.687 3.536 3.950 . 0 0 "[ . 1 . 2]" 1
638 1 42 GLN HA 1 42 GLN HE22 . . 5.500 5.219 4.737 5.354 . 0 0 "[ . 1 . 2]" 1
639 1 42 GLN HA 1 42 GLN HG2 . . 3.980 3.394 3.322 3.724 . 0 0 "[ . 1 . 2]" 1
640 1 42 GLN HA 1 42 GLN QG . . 3.180 2.433 2.375 2.488 . 0 0 "[ . 1 . 2]" 1
641 1 42 GLN HA 1 42 GLN HG3 . . 3.980 2.494 2.425 2.559 . 0 0 "[ . 1 . 2]" 1
642 1 42 GLN HA 1 45 GLU H . . 3.990 3.108 2.687 3.442 . 0 0 "[ . 1 . 2]" 1
643 1 42 GLN QB 1 42 GLN HE21 . . 3.570 2.087 1.782 2.396 . 0 0 "[ . 1 . 2]" 1
644 1 42 GLN QB 1 42 GLN HE22 . . 3.730 3.224 3.188 3.346 . 0 0 "[ . 1 . 2]" 1
645 1 42 GLN QB 1 43 LEU H . . 3.330 3.176 2.871 3.420 0.090 2 0 "[ . 1 . 2]" 1
646 1 42 GLN HE21 1 43 LEU H . . 4.650 3.279 3.081 3.590 . 0 0 "[ . 1 . 2]" 1
647 1 42 GLN HE21 1 43 LEU HB2 . . 5.500 5.748 5.549 5.965 0.465 19 0 "[ . 1 . 2]" 1
648 1 42 GLN HE22 1 42 GLN QG . . 3.520 3.449 3.404 3.465 . 0 0 "[ . 1 . 2]" 1
649 1 42 GLN QG 1 43 LEU H . . 5.340 4.418 4.354 4.567 . 0 0 "[ . 1 . 2]" 1
650 1 43 LEU H 1 43 LEU HB2 . . 3.240 2.646 2.228 2.835 . 0 0 "[ . 1 . 2]" 1
651 1 43 LEU H 1 43 LEU HB3 . . 3.780 3.568 3.521 3.595 . 0 0 "[ . 1 . 2]" 1
652 1 43 LEU H 1 43 LEU MD1 . . 5.500 3.776 3.605 4.140 . 0 0 "[ . 1 . 2]" 1
653 1 43 LEU H 1 43 LEU MD2 . . 3.910 2.394 1.995 2.706 . 0 0 "[ . 1 . 2]" 1
654 1 43 LEU H 1 43 LEU HG . . 3.510 2.306 1.923 3.613 0.103 13 0 "[ . 1 . 2]" 1
655 1 43 LEU H 1 44 LYS H . . 3.910 2.831 2.642 3.100 . 0 0 "[ . 1 . 2]" 1
656 1 43 LEU H 1 45 GLU H . . 4.020 3.700 3.399 3.969 . 0 0 "[ . 1 . 2]" 1
657 1 43 LEU H 1 46 ILE H . . 5.500 5.535 5.410 5.625 0.125 4 0 "[ . 1 . 2]" 1
658 1 43 LEU HA 1 43 LEU MD2 . . 3.640 2.004 1.875 2.388 . 0 0 "[ . 1 . 2]" 1
659 1 43 LEU HA 1 43 LEU HG . . 4.110 3.523 3.400 3.714 . 0 0 "[ . 1 . 2]" 1
660 1 43 LEU HA 1 46 ILE H . . 4.450 4.428 4.108 4.635 0.185 13 0 "[ . 1 . 2]" 1
661 1 43 LEU HA 1 46 ILE MD . . 4.580 3.129 2.645 3.411 . 0 0 "[ . 1 . 2]" 1
662 1 43 LEU HB2 1 43 LEU MD1 . . 3.620 2.562 2.342 3.131 . 0 0 "[ . 1 . 2]" 1
663 1 43 LEU HB2 1 44 LYS H . . 4.620 2.382 1.900 2.955 . 0 0 "[ . 1 . 2]" 1
664 1 43 LEU HB3 1 44 LYS H . . 4.640 3.555 2.941 4.089 . 0 0 "[ . 1 . 2]" 1
665 1 43 LEU MD1 1 44 LYS H . . 5.500 4.463 3.885 4.963 . 0 0 "[ . 1 . 2]" 1
666 1 43 LEU MD1 1 103 GLN H . . 5.500 4.083 3.677 4.663 . 0 0 "[ . 1 . 2]" 1
667 1 43 LEU MD1 1 103 GLN HA . . 4.060 2.053 1.813 2.939 . 0 0 "[ . 1 . 2]" 1
668 1 43 LEU MD1 1 103 GLN QB . . 5.140 3.043 2.117 4.348 . 0 0 "[ . 1 . 2]" 1
669 1 43 LEU MD1 1 103 GLN QE . . 5.340 4.001 3.590 4.519 . 0 0 "[ . 1 . 2]" 1
670 1 43 LEU MD1 1 103 GLN QG . . 3.700 2.173 1.858 3.333 . 0 0 "[ . 1 . 2]" 1
671 1 43 LEU MD1 1 106 VAL HB . . 4.110 2.589 1.934 3.257 . 0 0 "[ . 1 . 2]" 1
672 1 43 LEU MD1 1 106 VAL MG1 . . 5.120 3.083 2.214 3.841 . 0 0 "[ . 1 . 2]" 1
673 1 43 LEU MD1 1 106 VAL MG2 . . 5.230 2.749 2.117 3.889 . 0 0 "[ . 1 . 2]" 1
674 1 43 LEU MD1 1 107 GLN H . . 4.980 3.754 3.388 4.184 . 0 0 "[ . 1 . 2]" 1
675 1 43 LEU MD1 1 107 GLN HE21 . . 4.910 3.072 1.897 4.739 . 0 0 "[ . 1 . 2]" 1
676 1 43 LEU MD1 1 107 GLN QE . . 4.210 2.847 1.871 4.062 . 0 0 "[ . 1 . 2]" 1
677 1 43 LEU MD1 1 107 GLN HE22 . . 4.910 3.653 2.544 4.678 . 0 0 "[ . 1 . 2]" 1
678 1 43 LEU MD1 1 107 GLN QG . . 3.810 3.116 1.974 3.597 . 0 0 "[ . 1 . 2]" 1
679 1 43 LEU MD2 1 44 LYS H . . 5.500 4.292 4.099 4.427 . 0 0 "[ . 1 . 2]" 1
680 1 43 LEU MD2 1 103 GLN HA . . 5.500 4.357 4.088 4.809 . 0 0 "[ . 1 . 2]" 1
681 1 43 LEU MD2 1 107 GLN H . . 5.500 4.974 4.505 5.263 . 0 0 "[ . 1 . 2]" 1
682 1 44 LYS H 1 44 LYS HB3 . . 2.820 2.519 2.218 2.933 0.113 3 0 "[ . 1 . 2]" 1
683 1 44 LYS H 1 44 LYS HD2 . . 3.770 2.512 1.938 3.501 . 0 0 "[ . 1 . 2]" 1
684 1 44 LYS H 1 44 LYS QD . . 3.180 2.241 1.859 3.260 0.080 3 0 "[ . 1 . 2]" 1
685 1 44 LYS H 1 44 LYS HD3 . . 3.770 2.985 2.059 3.909 0.139 13 0 "[ . 1 . 2]" 1
686 1 44 LYS H 1 44 LYS QG . . 4.350 2.930 1.783 3.532 . 0 0 "[ . 1 . 2]" 1
687 1 44 LYS H 1 45 GLU H . . 3.660 2.439 2.117 2.656 . 0 0 "[ . 1 . 2]" 1
688 1 44 LYS H 1 46 ILE H . . 4.810 4.650 4.284 4.843 0.033 17 0 "[ . 1 . 2]" 1
689 1 44 LYS H 1 46 ILE MD . . 5.500 4.751 4.349 5.026 . 0 0 "[ . 1 . 2]" 1
690 1 44 LYS H 1 49 ILE MD . . 5.250 4.611 4.125 4.983 . 0 0 "[ . 1 . 2]" 1
691 1 44 LYS HA 1 44 LYS HD2 . . 5.390 4.124 3.645 4.661 . 0 0 "[ . 1 . 2]" 1
692 1 44 LYS HA 1 44 LYS QD . . 4.540 3.682 3.495 4.236 . 0 0 "[ . 1 . 2]" 1
693 1 44 LYS HA 1 44 LYS HD3 . . 5.390 4.401 3.682 5.311 . 0 0 "[ . 1 . 2]" 1
694 1 44 LYS HA 1 47 PHE H . . 3.400 2.988 2.836 3.269 . 0 0 "[ . 1 . 2]" 1
695 1 44 LYS HA 1 47 PHE HA . . 3.610 3.219 2.944 3.641 0.031 18 0 "[ . 1 . 2]" 1
696 1 44 LYS HA 1 54 GLN QE . . 5.150 4.466 3.844 5.036 . 0 0 "[ . 1 . 2]" 1
697 1 44 LYS HB2 1 45 GLU H . . 4.990 4.323 3.998 4.514 . 0 0 "[ . 1 . 2]" 1
698 1 44 LYS HB2 1 47 PHE HA . . 5.300 4.600 4.086 5.144 . 0 0 "[ . 1 . 2]" 1
699 1 44 LYS HB2 1 54 GLN HE21 . . 5.500 5.340 4.600 5.555 0.055 12 0 "[ . 1 . 2]" 1
700 1 44 LYS HB2 1 54 GLN HE22 . . 5.500 5.065 4.171 5.580 0.080 14 0 "[ . 1 . 2]" 1
701 1 44 LYS HB3 1 44 LYS QD . . 3.150 2.533 1.975 3.310 0.160 3 0 "[ . 1 . 2]" 1
702 1 44 LYS HB3 1 45 GLU H . . 5.280 4.156 3.924 4.425 . 0 0 "[ . 1 . 2]" 1
703 1 44 LYS QD 1 44 LYS QG . . 2.350 2.050 2.012 2.092 . 0 0 "[ . 1 . 2]" 1
704 1 44 LYS HD2 1 45 GLU H . . 5.500 3.363 2.073 5.352 . 0 0 "[ . 1 . 2]" 1
705 1 44 LYS HD3 1 45 GLU H . . 5.500 3.238 1.949 5.197 . 0 0 "[ . 1 . 2]" 1
706 1 44 LYS QG 1 45 GLU HA . . 5.010 3.464 3.011 4.323 . 0 0 "[ . 1 . 2]" 1
707 1 45 GLU H 1 45 GLU QB . . 2.800 2.204 2.065 2.307 . 0 0 "[ . 1 . 2]" 1
708 1 45 GLU H 1 45 GLU HG2 . . 5.370 3.930 2.570 4.640 . 0 0 "[ . 1 . 2]" 1
709 1 45 GLU H 1 45 GLU QG . . 4.580 3.588 2.506 4.078 . 0 0 "[ . 1 . 2]" 1
710 1 45 GLU H 1 45 GLU HG3 . . 5.370 4.283 3.479 4.638 . 0 0 "[ . 1 . 2]" 1
711 1 45 GLU H 1 46 ILE H . . 3.510 2.723 2.283 2.903 . 0 0 "[ . 1 . 2]" 1
712 1 45 GLU H 1 46 ILE HA . . 5.490 5.325 4.985 5.459 . 0 0 "[ . 1 . 2]" 1
713 1 45 GLU H 1 46 ILE MD . . 4.940 3.536 3.243 3.793 . 0 0 "[ . 1 . 2]" 1
714 1 45 GLU H 1 47 PHE H . . 4.160 3.805 3.605 3.941 . 0 0 "[ . 1 . 2]" 1
715 1 45 GLU H 1 47 PHE HA . . 5.500 5.561 5.397 5.661 0.161 4 0 "[ . 1 . 2]" 1
716 1 45 GLU H 1 49 ILE MD . . 5.500 4.572 4.019 5.001 . 0 0 "[ . 1 . 2]" 1
717 1 45 GLU QB 1 45 GLU QG . . 2.300 2.000 1.958 2.066 . 0 0 "[ . 1 . 2]" 1
718 1 46 ILE H 1 46 ILE HB . . 3.780 2.662 2.573 2.828 . 0 0 "[ . 1 . 2]" 1
719 1 46 ILE H 1 46 ILE MD . . 3.030 2.078 1.940 2.443 . 0 0 "[ . 1 . 2]" 1
720 1 46 ILE H 1 46 ILE HG13 . . 4.020 2.622 2.339 2.815 . 0 0 "[ . 1 . 2]" 1
721 1 46 ILE H 1 47 PHE H . . 4.240 2.361 2.231 2.559 . 0 0 "[ . 1 . 2]" 1
722 1 46 ILE H 1 47 PHE QB . . 5.110 4.835 4.414 4.983 . 0 0 "[ . 1 . 2]" 1
723 1 46 ILE HA 1 46 ILE HG13 . . 3.820 2.510 2.394 2.684 . 0 0 "[ . 1 . 2]" 1
724 1 46 ILE HA 1 46 ILE MG . . 3.640 2.274 2.214 2.388 . 0 0 "[ . 1 . 2]" 1
725 1 46 ILE HA 1 48 ARG H . . 5.110 4.459 4.164 4.623 . 0 0 "[ . 1 . 2]" 1
726 1 46 ILE HA 1 48 ARG QG . . 4.890 4.593 3.927 4.967 0.077 4 0 "[ . 1 . 2]" 1
727 1 46 ILE HB 1 46 ILE MD . . 3.370 2.088 1.998 2.178 . 0 0 "[ . 1 . 2]" 1
728 1 46 ILE HB 1 47 PHE H . . 3.320 3.002 2.635 3.215 . 0 0 "[ . 1 . 2]" 1
729 1 46 ILE HB 1 48 ARG H . . 3.760 2.724 2.321 2.841 . 0 0 "[ . 1 . 2]" 1
730 1 46 ILE HB 1 49 ILE H . . 4.380 3.868 3.049 4.080 . 0 0 "[ . 1 . 2]" 1
731 1 46 ILE HB 1 49 ILE MG . . 4.510 2.900 2.177 3.203 . 0 0 "[ . 1 . 2]" 1
732 1 46 ILE MD 1 47 PHE H . . 4.060 3.531 3.176 3.710 . 0 0 "[ . 1 . 2]" 1
733 1 46 ILE MD 1 49 ILE H . . 5.500 4.746 3.851 5.059 . 0 0 "[ . 1 . 2]" 1
734 1 46 ILE HG12 1 46 ILE MG . . 3.490 2.043 1.942 2.176 . 0 0 "[ . 1 . 2]" 1
735 1 46 ILE HG12 1 49 ILE MG . . 4.770 4.024 3.124 4.327 . 0 0 "[ . 1 . 2]" 1
736 1 46 ILE HG13 1 47 PHE H . . 4.610 4.501 4.292 4.626 0.016 9 0 "[ . 1 . 2]" 1
737 1 46 ILE MG 1 47 PHE H . . 4.590 3.924 3.558 4.094 . 0 0 "[ . 1 . 2]" 1
738 1 46 ILE MG 1 48 ARG H . . 4.610 3.027 2.472 3.498 . 0 0 "[ . 1 . 2]" 1
739 1 46 ILE MG 1 48 ARG QG . . 3.440 2.687 1.851 3.308 . 0 0 "[ . 1 . 2]" 1
740 1 46 ILE MG 1 49 ILE H . . 5.130 4.169 3.711 4.564 . 0 0 "[ . 1 . 2]" 1
741 1 46 ILE MG 1 49 ILE MG . . 3.350 2.820 2.272 3.089 . 0 0 "[ . 1 . 2]" 1
742 1 47 PHE H 1 47 PHE QB . . 3.220 2.989 2.844 3.222 0.002 16 0 "[ . 1 . 2]" 1
743 1 47 PHE H 1 47 PHE QD . . 5.470 3.301 3.046 4.053 . 0 0 "[ . 1 . 2]" 1
744 1 47 PHE H 1 48 ARG H . . 3.410 2.900 2.652 3.033 . 0 0 "[ . 1 . 2]" 1
745 1 47 PHE H 1 48 ARG HA . . 5.500 5.460 5.272 5.543 0.043 19 0 "[ . 1 . 2]" 1
746 1 47 PHE H 1 49 ILE H . . 4.360 4.187 3.612 4.365 0.005 10 0 "[ . 1 . 2]" 1
747 1 47 PHE H 1 50 LEU H . . 5.440 5.223 4.677 5.477 0.037 10 0 "[ . 1 . 2]" 1
748 1 47 PHE H 1 54 GLN QE . . 5.340 4.801 4.303 5.114 . 0 0 "[ . 1 . 2]" 1
749 1 47 PHE HA 1 48 ARG H . . 3.090 2.823 2.724 3.061 . 0 0 "[ . 1 . 2]" 1
750 1 47 PHE HA 1 48 ARG QB . . 5.340 4.892 4.700 5.171 . 0 0 "[ . 1 . 2]" 1
751 1 47 PHE HA 1 49 ILE H . . 4.420 3.597 3.525 3.798 . 0 0 "[ . 1 . 2]" 1
752 1 47 PHE HA 1 50 LEU H . . 4.130 4.012 3.803 4.189 0.059 18 0 "[ . 1 . 2]" 1
753 1 47 PHE HA 1 50 LEU MD1 . . 3.780 3.214 2.726 3.577 . 0 0 "[ . 1 . 2]" 1
754 1 47 PHE HA 1 50 LEU HG . . 4.530 4.045 3.555 4.539 0.009 10 0 "[ . 1 . 2]" 1
755 1 47 PHE HA 1 51 ASP H . . 4.970 4.324 3.883 4.780 . 0 0 "[ . 1 . 2]" 1
756 1 47 PHE HB2 1 48 ARG H . . 5.280 4.360 3.983 4.565 . 0 0 "[ . 1 . 2]" 1
757 1 47 PHE HB3 1 48 ARG H . . 5.280 4.550 4.143 4.657 . 0 0 "[ . 1 . 2]" 1
758 1 47 PHE QD 1 48 ARG H . . 5.210 4.582 4.446 4.876 . 0 0 "[ . 1 . 2]" 1
759 1 48 ARG H 1 48 ARG QB . . 3.690 2.713 2.588 2.972 . 0 0 "[ . 1 . 2]" 1
760 1 48 ARG H 1 48 ARG HG2 . . 4.830 3.846 2.775 4.642 . 0 0 "[ . 1 . 2]" 1
761 1 48 ARG H 1 48 ARG QG . . 4.210 3.281 2.705 3.710 . 0 0 "[ . 1 . 2]" 1
762 1 48 ARG H 1 48 ARG HG3 . . 4.830 3.774 3.349 4.093 . 0 0 "[ . 1 . 2]" 1
763 1 48 ARG H 1 49 ILE H . . 3.870 1.868 1.779 1.946 . 0 0 "[ . 1 . 2]" 1
764 1 48 ARG H 1 49 ILE HA . . 5.500 4.450 4.404 4.505 . 0 0 "[ . 1 . 2]" 1
765 1 48 ARG H 1 49 ILE MG . . 4.680 3.115 2.839 3.473 . 0 0 "[ . 1 . 2]" 1
766 1 48 ARG H 1 50 LEU H . . 3.740 3.505 3.383 3.619 . 0 0 "[ . 1 . 2]" 1
767 1 48 ARG H 1 54 GLN QE . . 5.340 4.952 4.469 5.336 . 0 0 "[ . 1 . 2]" 1
768 1 48 ARG HA 1 48 ARG QG . . 3.570 2.515 2.074 3.293 . 0 0 "[ . 1 . 2]" 1
769 1 48 ARG QB 1 48 ARG QD . . 3.280 2.138 1.956 2.580 . 0 0 "[ . 1 . 2]" 1
770 1 48 ARG QB 1 48 ARG QH1 . . 4.430 3.662 1.932 4.240 . 0 0 "[ . 1 . 2]" 1
771 1 48 ARG QB 1 49 ILE H . . 4.270 3.662 3.533 3.925 . 0 0 "[ . 1 . 2]" 1
772 1 48 ARG HB2 1 49 ILE H . . 5.000 4.043 3.819 4.562 . 0 0 "[ . 1 . 2]" 1
773 1 48 ARG HB3 1 49 ILE H . . 5.000 4.244 4.103 4.452 . 0 0 "[ . 1 . 2]" 1
774 1 48 ARG QG 1 48 ARG QH2 . . 4.660 4.029 3.744 4.480 . 0 0 "[ . 1 . 2]" 1
775 1 48 ARG HG2 1 49 ILE H . . 5.500 4.688 3.342 5.468 . 0 0 "[ . 1 . 2]" 1
776 1 48 ARG HG3 1 49 ILE H . . 5.500 4.857 3.888 5.511 0.011 20 0 "[ . 1 . 2]" 1
777 1 49 ILE H 1 49 ILE HB . . 3.920 3.803 3.712 3.921 0.001 10 0 "[ . 1 . 2]" 1
778 1 49 ILE H 1 49 ILE MD . . 4.920 2.775 1.831 3.894 . 0 0 "[ . 1 . 2]" 1
779 1 49 ILE H 1 49 ILE QG . . 3.940 2.477 1.922 3.199 . 0 0 "[ . 1 . 2]" 1
780 1 49 ILE H 1 49 ILE MG . . 3.310 2.762 2.555 2.906 . 0 0 "[ . 1 . 2]" 1
781 1 49 ILE H 1 50 LEU HA . . 5.500 4.610 4.495 4.788 . 0 0 "[ . 1 . 2]" 1
782 1 49 ILE H 1 50 LEU MD1 . . 4.620 4.201 4.067 4.276 . 0 0 "[ . 1 . 2]" 1
783 1 49 ILE H 1 50 LEU HG . . 3.330 3.116 2.841 3.429 0.099 14 0 "[ . 1 . 2]" 1
784 1 49 ILE H 1 54 GLN QE . . 5.340 5.099 4.624 5.402 0.062 4 0 "[ . 1 . 2]" 1
785 1 49 ILE HA 1 49 ILE QG . . 3.560 3.366 3.304 3.433 . 0 0 "[ . 1 . 2]" 1
786 1 49 ILE HA 1 49 ILE MG . . 2.990 2.389 2.219 2.494 . 0 0 "[ . 1 . 2]" 1
787 1 49 ILE HA 1 50 LEU H . . 3.470 3.365 3.178 3.532 0.062 14 0 "[ . 1 . 2]" 1
788 1 49 ILE HB 1 50 LEU H . . 4.270 4.149 3.623 4.446 0.176 10 0 "[ . 1 . 2]" 1
789 1 49 ILE HB 1 50 LEU MD2 . . 4.530 3.950 3.593 4.237 . 0 0 "[ . 1 . 2]" 1
790 1 49 ILE HB 1 50 LEU HG . . 4.560 4.424 4.251 4.576 0.016 13 0 "[ . 1 . 2]" 1
791 1 49 ILE MD 1 50 LEU H . . 5.370 3.544 2.722 4.282 . 0 0 "[ . 1 . 2]" 1
792 1 49 ILE QG 1 50 LEU H . . 3.470 2.673 2.022 3.491 0.021 10 0 "[ . 1 . 2]" 1
793 1 49 ILE QG 1 50 LEU HG . . 2.870 1.979 1.900 2.089 . 0 0 "[ . 1 . 2]" 1
794 1 49 ILE MG 1 50 LEU H . . 4.520 4.040 3.893 4.161 . 0 0 "[ . 1 . 2]" 1
795 1 50 LEU H 1 50 LEU QB . . 3.540 2.703 2.611 2.803 . 0 0 "[ . 1 . 2]" 1
796 1 50 LEU H 1 50 LEU MD1 . . 4.130 3.513 3.209 3.803 . 0 0 "[ . 1 . 2]" 1
797 1 50 LEU H 1 50 LEU MD2 . . 4.330 3.486 3.152 3.937 . 0 0 "[ . 1 . 2]" 1
798 1 50 LEU H 1 50 LEU HG . . 3.900 2.251 1.883 2.818 . 0 0 "[ . 1 . 2]" 1
799 1 50 LEU H 1 51 ASP H . . 2.700 2.548 2.397 2.790 0.090 14 0 "[ . 1 . 2]" 1
800 1 50 LEU HA 1 50 LEU MD2 . . 3.640 2.474 2.334 2.625 . 0 0 "[ . 1 . 2]" 1
801 1 50 LEU HA 1 50 LEU HG . . 4.150 3.205 3.081 3.344 . 0 0 "[ . 1 . 2]" 1
802 1 50 LEU HA 1 51 ASP HA . . 4.700 4.612 4.547 4.749 0.049 18 0 "[ . 1 . 2]" 1
803 1 50 LEU QB 1 51 ASP H . . 3.330 1.966 1.912 2.068 . 0 0 "[ . 1 . 2]" 1
804 1 50 LEU QB 1 58 ILE MD . . 3.270 2.828 2.402 3.043 . 0 0 "[ . 1 . 2]" 1
805 1 50 LEU QB 1 58 ILE QG . . 5.180 4.248 3.766 4.622 . 0 0 "[ . 1 . 2]" 1
806 1 50 LEU MD1 1 51 ASP H . . 3.790 3.598 3.556 3.630 . 0 0 "[ . 1 . 2]" 1
807 1 50 LEU MD2 1 51 ASP H . . 5.500 4.497 4.416 4.586 . 0 0 "[ . 1 . 2]" 1
808 1 50 LEU HG 1 51 ASP H . . 4.920 3.747 3.504 3.967 . 0 0 "[ . 1 . 2]" 1
809 1 50 LEU HG 1 54 GLN QE . . 5.340 4.813 3.580 5.368 0.028 14 0 "[ . 1 . 2]" 1
810 1 51 ASP H 1 51 ASP HB2 . . 4.120 3.515 2.837 3.977 . 0 0 "[ . 1 . 2]" 1
811 1 51 ASP H 1 51 ASP QB . . 3.330 3.054 2.600 3.337 0.007 7 0 "[ . 1 . 2]" 1
812 1 51 ASP H 1 51 ASP HB3 . . 4.120 3.421 2.913 3.852 . 0 0 "[ . 1 . 2]" 1
813 1 51 ASP H 1 52 ASN QB . . 5.340 5.332 5.118 5.455 0.115 6 0 "[ . 1 . 2]" 1
814 1 51 ASP H 1 58 ILE MD . . 4.720 3.854 3.566 4.101 . 0 0 "[ . 1 . 2]" 1
815 1 51 ASP H 1 58 ILE QG . . 5.340 4.833 4.423 5.134 . 0 0 "[ . 1 . 2]" 1
816 1 51 ASP HA 1 52 ASN H . . 2.700 2.379 2.139 2.705 0.005 15 0 "[ . 1 . 2]" 1
817 1 51 ASP HA 1 52 ASN QB . . 4.270 4.048 3.853 4.300 0.030 7 0 "[ . 1 . 2]" 1
818 1 51 ASP HA 1 53 ASP H . . 4.570 4.010 3.310 4.615 0.045 12 0 "[ . 1 . 2]" 1
819 1 51 ASP HA 1 54 GLN H . . 5.500 5.040 3.972 5.581 0.081 18 0 "[ . 1 . 2]" 1
820 1 51 ASP HA 1 58 ILE MD . . 4.460 3.442 3.152 4.015 . 0 0 "[ . 1 . 2]" 1
821 1 51 ASP HA 1 58 ILE QG . . 4.570 3.847 2.466 4.592 0.022 18 0 "[ . 1 . 2]" 1
822 1 51 ASP HA 1 58 ILE MG . . 5.110 3.458 2.729 3.786 . 0 0 "[ . 1 . 2]" 1
823 1 51 ASP QB 1 53 ASP H . . 4.540 2.779 2.150 4.361 . 0 0 "[ . 1 . 2]" 1
824 1 51 ASP QB 1 54 GLN H . . 4.260 2.912 2.167 3.711 . 0 0 "[ . 1 . 2]" 1
825 1 51 ASP QB 1 58 ILE MD . . 4.560 2.289 1.832 3.886 . 0 0 "[ . 1 . 2]" 1
826 1 51 ASP QB 1 58 ILE QG . . 4.720 2.058 1.889 2.949 . 0 0 "[ . 1 . 2]" 1
827 1 52 ASN H 1 52 ASN HB2 . . 3.570 2.968 2.339 3.746 0.176 4 0 "[ . 1 . 2]" 1
828 1 52 ASN H 1 52 ASN QB . . 2.980 2.475 2.244 3.002 0.022 4 0 "[ . 1 . 2]" 1
829 1 52 ASN H 1 52 ASN HB3 . . 3.570 2.739 2.414 3.301 . 0 0 "[ . 1 . 2]" 1
830 1 52 ASN H 1 52 ASN QD . . 5.340 4.187 2.091 4.710 . 0 0 "[ . 1 . 2]" 1
831 1 52 ASN H 1 53 ASP H . . 4.020 2.373 1.885 3.285 . 0 0 "[ . 1 . 2]" 1
832 1 52 ASN H 1 58 ILE MD . . 5.500 5.131 4.976 5.188 . 0 0 "[ . 1 . 2]" 1
833 1 52 ASN H 1 58 ILE QG . . 5.340 4.958 4.192 5.398 0.058 3 0 "[ . 1 . 2]" 1
834 1 52 ASN H 1 62 GLU HB2 . . 5.500 5.014 4.371 5.508 0.008 20 0 "[ . 1 . 2]" 1
835 1 52 ASN H 1 62 GLU HB3 . . 5.250 3.660 3.108 4.124 . 0 0 "[ . 1 . 2]" 1
836 1 52 ASN H 1 62 GLU QG . . 4.010 3.500 2.863 4.019 0.009 2 0 "[ . 1 . 2]" 1
837 1 52 ASN HA 1 54 GLN HE21 . . 5.500 5.048 4.008 5.587 0.087 14 0 "[ . 1 . 2]" 1
838 1 52 ASN HA 1 54 GLN QE . . 4.850 4.411 3.913 4.879 0.029 1 0 "[ . 1 . 2]" 1
839 1 52 ASN HA 1 54 GLN HE22 . . 5.500 5.166 4.128 5.529 0.029 7 0 "[ . 1 . 2]" 1
840 1 52 ASN HB2 1 53 ASP H . . 5.200 4.280 3.749 4.595 . 0 0 "[ . 1 . 2]" 1
841 1 52 ASN HB3 1 53 ASP H . . 5.200 3.685 2.298 4.656 . 0 0 "[ . 1 . 2]" 1
842 1 53 ASP H 1 53 ASP QB . . 3.450 2.539 2.211 3.072 . 0 0 "[ . 1 . 2]" 1
843 1 53 ASP H 1 54 GLN H . . 3.000 2.239 1.890 2.650 . 0 0 "[ . 1 . 2]" 1
844 1 53 ASP H 1 54 GLN HA . . 4.850 4.433 4.133 4.881 0.031 9 0 "[ . 1 . 2]" 1
845 1 53 ASP H 1 55 SER H . . 4.780 4.422 4.154 4.812 0.032 18 0 "[ . 1 . 2]" 1
846 1 53 ASP QB 1 54 GLN H . . 3.870 2.827 2.249 3.747 . 0 0 "[ . 1 . 2]" 1
847 1 54 GLN H 1 54 GLN HA . . 2.660 2.302 2.274 2.765 0.105 18 0 "[ . 1 . 2]" 1
848 1 54 GLN H 1 54 GLN QB . . 3.450 3.032 2.089 3.389 . 0 0 "[ . 1 . 2]" 1
849 1 54 GLN H 1 54 GLN HE21 . . 5.420 4.637 3.690 5.417 . 0 0 "[ . 1 . 2]" 1
850 1 54 GLN H 1 54 GLN QE . . 4.620 4.136 3.495 4.660 0.040 12 0 "[ . 1 . 2]" 1
851 1 54 GLN H 1 54 GLN HE22 . . 5.420 4.713 3.937 5.187 . 0 0 "[ . 1 . 2]" 1
852 1 54 GLN H 1 54 GLN HG2 . . 5.200 4.143 2.683 5.046 . 0 0 "[ . 1 . 2]" 1
853 1 54 GLN H 1 54 GLN QG . . 4.420 3.645 2.655 4.327 . 0 0 "[ . 1 . 2]" 1
854 1 54 GLN H 1 54 GLN HG3 . . 5.200 4.386 4.021 4.765 . 0 0 "[ . 1 . 2]" 1
855 1 54 GLN H 1 55 SER H . . 3.130 2.751 2.654 2.825 . 0 0 "[ . 1 . 2]" 1
856 1 54 GLN HA 1 54 GLN HE21 . . 4.650 4.064 2.128 4.678 0.028 5 0 "[ . 1 . 2]" 1
857 1 54 GLN HA 1 54 GLN QE . . 4.080 3.651 2.111 4.088 0.008 5 0 "[ . 1 . 2]" 1
858 1 54 GLN HA 1 54 GLN HE22 . . 4.650 4.202 3.521 4.741 0.091 18 0 "[ . 1 . 2]" 1
859 1 54 GLN HA 1 55 SER H . . 3.270 2.937 2.772 3.446 0.176 18 0 "[ . 1 . 2]" 1
860 1 54 GLN HA 1 56 GLY H . . 4.510 3.640 3.040 4.511 0.001 5 0 "[ . 1 . 2]" 1
861 1 54 GLN QB 1 55 SER H . . 4.430 3.745 2.980 3.872 . 0 0 "[ . 1 . 2]" 1
862 1 54 GLN HB2 1 55 SER H . . 5.190 4.224 3.747 4.498 . 0 0 "[ . 1 . 2]" 1
863 1 54 GLN HB3 1 55 SER H . . 5.190 4.222 3.128 4.561 . 0 0 "[ . 1 . 2]" 1
864 1 55 SER H 1 55 SER HB2 . . 3.850 2.711 2.250 3.667 . 0 0 "[ . 1 . 2]" 1
865 1 55 SER H 1 55 SER QB . . 3.160 2.325 2.172 2.683 . 0 0 "[ . 1 . 2]" 1
866 1 55 SER H 1 55 SER HB3 . . 3.850 2.834 2.221 3.607 . 0 0 "[ . 1 . 2]" 1
867 1 55 SER H 1 56 GLY H . . 3.000 2.334 1.892 2.657 . 0 0 "[ . 1 . 2]" 1
868 1 55 SER H 1 56 GLY QA . . 5.340 4.361 4.012 4.604 . 0 0 "[ . 1 . 2]" 1
869 1 55 SER H 1 57 PHE H . . 4.500 4.235 3.552 4.594 0.094 18 0 "[ . 1 . 2]" 1
870 1 56 GLY H 1 57 PHE H . . 3.090 2.484 1.890 3.113 0.023 13 0 "[ . 1 . 2]" 1
871 1 56 GLY QA 1 57 PHE H . . 3.090 2.604 2.341 2.910 . 0 0 "[ . 1 . 2]" 1
872 1 57 PHE H 1 57 PHE QB . . 3.370 2.940 2.555 3.380 0.010 10 0 "[ . 1 . 2]" 1
873 1 57 PHE H 1 57 PHE QD . . 3.960 2.487 1.903 3.708 . 0 0 "[ . 1 . 2]" 1
874 1 57 PHE H 1 58 ILE H . . 4.560 4.378 4.324 4.477 . 0 0 "[ . 1 . 2]" 1
875 1 57 PHE H 1 58 ILE HA . . 5.070 4.783 4.582 4.988 . 0 0 "[ . 1 . 2]" 1
876 1 57 PHE HA 1 57 PHE QD . . 4.140 3.479 2.687 3.713 . 0 0 "[ . 1 . 2]" 1
877 1 57 PHE HA 1 58 ILE H . . 3.100 2.615 2.407 2.734 . 0 0 "[ . 1 . 2]" 1
878 1 57 PHE HA 1 58 ILE HB . . 5.290 4.939 4.767 5.135 . 0 0 "[ . 1 . 2]" 1
879 1 57 PHE HA 1 58 ILE HG12 . . 4.820 4.334 4.145 4.646 . 0 0 "[ . 1 . 2]" 1
880 1 57 PHE HA 1 58 ILE QG . . 4.220 3.147 3.038 3.435 . 0 0 "[ . 1 . 2]" 1
881 1 57 PHE HA 1 58 ILE HG13 . . 4.820 3.234 3.095 3.539 . 0 0 "[ . 1 . 2]" 1
882 1 57 PHE HA 1 96 LYS QB . . 5.070 4.321 3.739 5.009 . 0 0 "[ . 1 . 2]" 1
883 1 57 PHE HA 1 97 ILE H . . 5.140 4.205 3.314 5.178 0.038 7 0 "[ . 1 . 2]" 1
884 1 57 PHE HA 1 98 GLY QA . . 4.780 3.388 2.097 4.485 . 0 0 "[ . 1 . 2]" 1
885 1 57 PHE HA 1 99 ALA H . . 5.500 5.140 3.466 5.585 0.085 13 0 "[ . 1 . 2]" 1
886 1 57 PHE QB 1 96 LYS QB . . 3.620 2.261 1.878 3.428 . 0 0 "[ . 1 . 2]" 1
887 1 57 PHE QB 1 96 LYS QD . . 4.760 3.596 2.290 4.724 . 0 0 "[ . 1 . 2]" 1
888 1 57 PHE QB 1 96 LYS QG . . 3.950 3.104 2.132 3.829 . 0 0 "[ . 1 . 2]" 1
889 1 57 PHE QB 1 97 ILE H . . 4.200 3.233 2.166 4.129 . 0 0 "[ . 1 . 2]" 1
890 1 57 PHE HB2 1 58 ILE H . . 3.690 2.471 1.897 3.707 0.017 7 0 "[ . 1 . 2]" 1
891 1 57 PHE HB2 1 96 LYS HG2 . . 5.500 4.375 2.891 5.439 . 0 0 "[ . 1 . 2]" 1
892 1 57 PHE HB2 1 96 LYS HG3 . . 5.500 3.944 2.200 5.518 0.018 13 0 "[ . 1 . 2]" 1
893 1 57 PHE HB3 1 58 ILE H . . 3.690 3.168 1.941 3.704 0.014 14 0 "[ . 1 . 2]" 1
894 1 57 PHE HB3 1 96 LYS HG2 . . 5.500 4.530 2.942 5.512 0.012 16 0 "[ . 1 . 2]" 1
895 1 57 PHE HB3 1 96 LYS HG3 . . 5.500 4.063 2.874 5.474 . 0 0 "[ . 1 . 2]" 1
896 1 57 PHE QD 1 58 ILE H . . 4.030 3.032 2.404 3.951 . 0 0 "[ . 1 . 2]" 1
897 1 57 PHE QD 1 96 LYS QB . . 5.300 2.872 2.204 4.930 . 0 0 "[ . 1 . 2]" 1
898 1 57 PHE QD 1 96 LYS HD2 . . 5.500 4.260 2.764 5.353 . 0 0 "[ . 1 . 2]" 1
899 1 57 PHE QD 1 96 LYS HD3 . . 5.500 4.560 2.833 5.380 . 0 0 "[ . 1 . 2]" 1
900 1 57 PHE QD 1 96 LYS HG2 . . 5.150 4.306 2.592 5.095 . 0 0 "[ . 1 . 2]" 1
901 1 57 PHE QD 1 96 LYS QG . . 4.380 3.541 2.039 4.363 . 0 0 "[ . 1 . 2]" 1
902 1 57 PHE QD 1 96 LYS HG3 . . 5.150 4.007 2.048 5.069 . 0 0 "[ . 1 . 2]" 1
903 1 57 PHE QD 1 97 ILE H . . 5.500 4.046 2.974 5.088 . 0 0 "[ . 1 . 2]" 1
904 1 58 ILE H 1 58 ILE HB . . 3.350 2.811 2.647 2.924 . 0 0 "[ . 1 . 2]" 1
905 1 58 ILE H 1 58 ILE MD . . 5.500 3.943 3.505 4.188 . 0 0 "[ . 1 . 2]" 1
906 1 58 ILE H 1 58 ILE HG12 . . 4.070 3.654 3.100 3.948 . 0 0 "[ . 1 . 2]" 1
907 1 58 ILE H 1 58 ILE QG . . 3.350 2.473 1.954 2.782 . 0 0 "[ . 1 . 2]" 1
908 1 58 ILE H 1 58 ILE HG13 . . 4.070 2.517 1.969 2.847 . 0 0 "[ . 1 . 2]" 1
909 1 58 ILE H 1 59 GLU H . . 4.650 4.486 4.406 4.618 . 0 0 "[ . 1 . 2]" 1
910 1 58 ILE H 1 59 GLU HB2 . . 5.440 5.266 5.018 5.541 0.101 13 0 "[ . 1 . 2]" 1
911 1 58 ILE H 1 97 ILE H . . 4.180 2.805 1.908 3.445 . 0 0 "[ . 1 . 2]" 1
912 1 58 ILE H 1 97 ILE HB . . 4.030 3.550 2.879 4.068 0.038 6 0 "[ . 1 . 2]" 1
913 1 58 ILE H 1 97 ILE QG . . 5.310 3.962 2.602 5.100 . 0 0 "[ . 1 . 2]" 1
914 1 58 ILE HA 1 58 ILE QG . . 3.680 2.539 2.506 2.601 . 0 0 "[ . 1 . 2]" 1
915 1 58 ILE HA 1 59 GLU H . . 2.850 2.320 2.293 2.387 . 0 0 "[ . 1 . 2]" 1
916 1 58 ILE HA 1 59 GLU HB2 . . 4.180 4.091 3.991 4.192 0.012 15 0 "[ . 1 . 2]" 1
917 1 58 ILE HA 1 59 GLU HB3 . . 5.190 4.841 4.727 5.030 . 0 0 "[ . 1 . 2]" 1
918 1 58 ILE HB 1 58 ILE MD . . 3.650 2.363 2.319 2.437 . 0 0 "[ . 1 . 2]" 1
919 1 58 ILE HB 1 59 GLU H . . 4.190 3.574 3.332 3.676 . 0 0 "[ . 1 . 2]" 1
920 1 58 ILE HB 1 86 LEU QB . . 4.990 3.071 2.460 3.869 . 0 0 "[ . 1 . 2]" 1
921 1 58 ILE HB 1 97 ILE H . . 4.960 3.468 2.832 4.101 . 0 0 "[ . 1 . 2]" 1
922 1 58 ILE HB 1 97 ILE HB . . 3.560 3.295 2.379 3.600 0.040 18 0 "[ . 1 . 2]" 1
923 1 58 ILE MD 1 97 ILE H . . 5.500 4.210 3.721 4.774 . 0 0 "[ . 1 . 2]" 1
924 1 58 ILE MD 1 97 ILE HB . . 5.330 2.392 1.960 3.270 . 0 0 "[ . 1 . 2]" 1
925 1 58 ILE QG 1 59 GLU H . . 4.350 4.130 4.101 4.181 . 0 0 "[ . 1 . 2]" 1
926 1 58 ILE QG 1 97 ILE H . . 5.340 3.741 3.136 4.434 . 0 0 "[ . 1 . 2]" 1
927 1 58 ILE QG 1 97 ILE HB . . 4.170 2.506 1.983 3.596 . 0 0 "[ . 1 . 2]" 1
928 1 58 ILE HG12 1 59 GLU H . . 5.180 4.408 4.363 4.492 . 0 0 "[ . 1 . 2]" 1
929 1 58 ILE HG13 1 59 GLU H . . 5.180 4.986 4.961 5.019 . 0 0 "[ . 1 . 2]" 1
930 1 58 ILE MG 1 59 GLU H . . 3.730 1.964 1.865 2.066 . 0 0 "[ . 1 . 2]" 1
931 1 58 ILE MG 1 62 GLU H . . 5.400 3.841 3.715 4.092 . 0 0 "[ . 1 . 2]" 1
932 1 58 ILE MG 1 62 GLU HB2 . . 4.390 2.444 2.096 2.708 . 0 0 "[ . 1 . 2]" 1
933 1 58 ILE MG 1 62 GLU HB3 . . 4.390 2.754 2.554 3.178 . 0 0 "[ . 1 . 2]" 1
934 1 58 ILE MG 1 62 GLU QG . . 5.310 3.628 3.050 4.054 . 0 0 "[ . 1 . 2]" 1
935 1 58 ILE MG 1 63 LEU HG . . 3.990 3.500 3.348 3.749 . 0 0 "[ . 1 . 2]" 1
936 1 59 GLU H 1 59 GLU HB2 . . 3.230 2.986 2.823 3.111 . 0 0 "[ . 1 . 2]" 1
937 1 59 GLU H 1 59 GLU HB3 . . 3.390 3.023 2.871 3.154 . 0 0 "[ . 1 . 2]" 1
938 1 59 GLU H 1 61 ASP HB3 . . 5.500 5.137 4.926 5.459 . 0 0 "[ . 1 . 2]" 1
939 1 59 GLU H 1 62 GLU H . . 3.860 3.567 3.468 3.646 . 0 0 "[ . 1 . 2]" 1
940 1 59 GLU H 1 62 GLU HB2 . . 5.190 2.371 2.227 2.489 . 0 0 "[ . 1 . 2]" 1
941 1 59 GLU H 1 63 LEU QD . . 5.500 3.616 3.481 3.749 . 0 0 "[ . 1 . 2]" 1
942 1 59 GLU H 1 63 LEU HG . . 5.500 4.438 4.268 4.643 . 0 0 "[ . 1 . 2]" 1
943 1 59 GLU H 1 86 LEU QB . . 5.340 4.957 4.607 5.520 0.180 5 0 "[ . 1 . 2]" 1
944 1 59 GLU HB2 1 60 GLU H . . 5.230 3.917 3.834 4.001 . 0 0 "[ . 1 . 2]" 1
945 1 59 GLU HB2 1 61 ASP H . . 4.270 4.060 3.949 4.124 . 0 0 "[ . 1 . 2]" 1
946 1 59 GLU HB3 1 59 GLU QG . . 2.550 2.218 2.161 2.293 . 0 0 "[ . 1 . 2]" 1
947 1 59 GLU HB3 1 60 GLU H . . 4.560 3.195 2.797 3.381 . 0 0 "[ . 1 . 2]" 1
948 1 59 GLU HB3 1 61 ASP H . . 3.880 2.410 2.224 2.567 . 0 0 "[ . 1 . 2]" 1
949 1 59 GLU QG 1 60 GLU H . . 4.730 1.973 1.903 2.086 . 0 0 "[ . 1 . 2]" 1
950 1 59 GLU QG 1 61 ASP H . . 4.090 2.609 2.247 3.057 . 0 0 "[ . 1 . 2]" 1
951 1 59 GLU HG2 1 60 GLU H . . 5.470 2.671 1.953 3.661 . 0 0 "[ . 1 . 2]" 1
952 1 59 GLU HG2 1 61 ASP H . . 4.780 3.128 2.337 3.949 . 0 0 "[ . 1 . 2]" 1
953 1 59 GLU HG3 1 60 GLU H . . 5.470 2.381 1.911 3.018 . 0 0 "[ . 1 . 2]" 1
954 1 59 GLU HG3 1 61 ASP H . . 4.780 3.516 2.269 4.377 . 0 0 "[ . 1 . 2]" 1
955 1 60 GLU H 1 61 ASP HB2 . . 5.500 4.849 4.605 4.963 . 0 0 "[ . 1 . 2]" 1
956 1 60 GLU H 1 61 ASP HB3 . . 5.500 5.106 4.847 5.431 . 0 0 "[ . 1 . 2]" 1
957 1 60 GLU H 1 62 GLU H . . 4.260 4.165 4.113 4.191 . 0 0 "[ . 1 . 2]" 1
958 1 60 GLU H 1 62 GLU HB2 . . 5.500 5.527 5.422 5.598 0.098 5 0 "[ . 1 . 2]" 1
959 1 60 GLU H 1 86 LEU MD1 . . 4.020 3.807 3.166 3.945 . 0 0 "[ . 1 . 2]" 1
960 1 60 GLU HA 1 62 GLU H . . 4.460 3.460 3.426 3.502 . 0 0 "[ . 1 . 2]" 1
961 1 60 GLU HA 1 63 LEU H . . 3.840 3.717 3.597 3.843 0.003 2 0 "[ . 1 . 2]" 1
962 1 60 GLU HA 1 63 LEU HA . . 5.230 5.202 5.082 5.283 0.053 9 0 "[ . 1 . 2]" 1
963 1 60 GLU HA 1 63 LEU HB2 . . 3.930 3.141 3.023 3.339 . 0 0 "[ . 1 . 2]" 1
964 1 60 GLU HA 1 63 LEU HB3 . . 4.440 4.302 4.204 4.408 . 0 0 "[ . 1 . 2]" 1
965 1 60 GLU HA 1 63 LEU QD . . 4.480 1.934 1.904 1.992 . 0 0 "[ . 1 . 2]" 1
966 1 60 GLU HA 1 63 LEU HG . . 4.030 2.071 1.977 2.161 . 0 0 "[ . 1 . 2]" 1
967 1 60 GLU HA 1 64 LYS H . . 4.860 4.664 4.219 4.965 0.105 18 0 "[ . 1 . 2]" 1
968 1 60 GLU HA 1 82 THR MG . . 4.990 4.594 4.351 4.666 . 0 0 "[ . 1 . 2]" 1
969 1 60 GLU HA 1 86 LEU MD1 . . 5.500 4.273 3.411 4.474 . 0 0 "[ . 1 . 2]" 1
970 1 60 GLU QB 1 61 ASP H . . 4.100 3.343 2.952 3.656 . 0 0 "[ . 1 . 2]" 1
971 1 60 GLU QB 1 64 LYS H . . 5.340 5.033 4.477 5.345 0.005 14 0 "[ . 1 . 2]" 1
972 1 60 GLU HB2 1 61 ASP H . . 4.790 3.596 3.050 4.083 . 0 0 "[ . 1 . 2]" 1
973 1 60 GLU HB3 1 61 ASP H . . 4.790 4.070 3.883 4.240 . 0 0 "[ . 1 . 2]" 1
974 1 60 GLU QG 1 61 ASP H . . 4.650 3.289 2.332 4.657 0.007 6 0 "[ . 1 . 2]" 1
975 1 60 GLU HG2 1 61 ASP H . . 5.400 3.986 2.383 5.418 0.018 6 0 "[ . 1 . 2]" 1
976 1 60 GLU HG3 1 61 ASP H . . 5.400 3.649 2.372 5.076 . 0 0 "[ . 1 . 2]" 1
977 1 61 ASP H 1 61 ASP HB2 . . 3.090 2.503 2.244 2.630 . 0 0 "[ . 1 . 2]" 1
978 1 61 ASP H 1 61 ASP HB3 . . 3.270 2.621 2.485 2.905 . 0 0 "[ . 1 . 2]" 1
979 1 61 ASP H 1 62 GLU H . . 3.200 2.535 2.483 2.571 . 0 0 "[ . 1 . 2]" 1
980 1 61 ASP H 1 63 LEU H . . 4.370 4.329 4.226 4.424 0.054 5 0 "[ . 1 . 2]" 1
981 1 61 ASP H 1 63 LEU QD . . 5.500 4.449 4.366 4.518 . 0 0 "[ . 1 . 2]" 1
982 1 61 ASP H 1 63 LEU HG . . 4.870 4.273 4.210 4.341 . 0 0 "[ . 1 . 2]" 1
983 1 61 ASP HA 1 61 ASP HB2 . . 2.780 2.526 2.455 2.672 . 0 0 "[ . 1 . 2]" 1
984 1 61 ASP HA 1 64 LYS H . . 4.490 4.315 4.012 4.536 0.046 13 0 "[ . 1 . 2]" 1
985 1 61 ASP HA 1 64 LYS QD . . 4.620 3.696 2.284 4.631 0.011 13 0 "[ . 1 . 2]" 1
986 1 61 ASP HA 1 64 LYS HE2 . . 5.500 3.553 2.021 5.365 . 0 0 "[ . 1 . 2]" 1
987 1 61 ASP HA 1 64 LYS QE . . 4.820 2.969 1.978 4.838 0.018 19 0 "[ . 1 . 2]" 1
988 1 61 ASP HA 1 64 LYS HE3 . . 5.500 3.691 2.420 5.501 0.001 19 0 "[ . 1 . 2]" 1
989 1 61 ASP HB3 1 62 GLU H . . 3.430 3.446 3.353 3.489 0.059 17 0 "[ . 1 . 2]" 1
990 1 61 ASP HB3 1 62 GLU QG . . 3.870 3.614 3.311 3.887 0.017 12 0 "[ . 1 . 2]" 1
991 1 62 GLU H 1 62 GLU HB2 . . 2.930 2.455 2.395 2.521 . 0 0 "[ . 1 . 2]" 1
992 1 62 GLU H 1 62 GLU HB3 . . 3.760 3.607 3.527 3.682 . 0 0 "[ . 1 . 2]" 1
993 1 62 GLU H 1 62 GLU QG . . 3.760 3.458 3.298 3.676 . 0 0 "[ . 1 . 2]" 1
994 1 62 GLU H 1 63 LEU H . . 2.680 2.378 2.280 2.535 . 0 0 "[ . 1 . 2]" 1
995 1 62 GLU H 1 63 LEU QD . . 5.500 3.473 3.367 3.598 . 0 0 "[ . 1 . 2]" 1
996 1 62 GLU H 1 63 LEU HG . . 4.570 2.887 2.752 3.002 . 0 0 "[ . 1 . 2]" 1
997 1 62 GLU HA 1 62 GLU QG . . 3.420 2.450 2.143 2.839 . 0 0 "[ . 1 . 2]" 1
998 1 62 GLU HA 1 64 LYS H . . 4.990 4.464 3.939 4.945 . 0 0 "[ . 1 . 2]" 1
999 1 62 GLU HB3 1 63 LEU H . . 4.820 4.276 4.194 4.342 . 0 0 "[ . 1 . 2]" 1
1000 1 63 LEU H 1 63 LEU HB2 . . 2.790 2.697 2.569 2.814 0.024 1 0 "[ . 1 . 2]" 1
1001 1 63 LEU H 1 63 LEU HB3 . . 3.910 3.759 3.715 3.825 . 0 0 "[ . 1 . 2]" 1
1002 1 63 LEU H 1 63 LEU QD . . 5.110 3.254 3.152 3.333 . 0 0 "[ . 1 . 2]" 1
1003 1 63 LEU H 1 63 LEU HG . . 3.360 2.653 2.503 2.787 . 0 0 "[ . 1 . 2]" 1
1004 1 63 LEU H 1 64 LYS H . . 3.550 2.071 1.852 2.235 . 0 0 "[ . 1 . 2]" 1
1005 1 63 LEU H 1 82 THR MG . . 5.270 3.939 3.609 4.198 . 0 0 "[ . 1 . 2]" 1
1006 1 63 LEU HA 1 63 LEU HG . . 3.840 3.336 3.262 3.394 . 0 0 "[ . 1 . 2]" 1
1007 1 63 LEU HA 1 64 LYS QG . . 5.340 4.972 4.775 5.237 . 0 0 "[ . 1 . 2]" 1
1008 1 63 LEU HB2 1 64 LYS H . . 4.440 2.569 2.211 3.133 . 0 0 "[ . 1 . 2]" 1
1009 1 63 LEU HB2 1 82 THR HA . . 4.960 3.381 2.977 3.715 . 0 0 "[ . 1 . 2]" 1
1010 1 63 LEU HB2 1 82 THR HB . . 4.470 2.050 1.954 2.426 . 0 0 "[ . 1 . 2]" 1
1011 1 63 LEU HB2 1 82 THR MG . . 3.450 2.269 2.036 2.405 . 0 0 "[ . 1 . 2]" 1
1012 1 63 LEU HB3 1 64 LYS H . . 4.380 3.770 3.526 4.211 . 0 0 "[ . 1 . 2]" 1
1013 1 63 LEU HB3 1 82 THR H . . 5.500 5.122 4.799 5.497 . 0 0 "[ . 1 . 2]" 1
1014 1 63 LEU HB3 1 82 THR HA . . 5.180 2.610 2.260 2.982 . 0 0 "[ . 1 . 2]" 1
1015 1 63 LEU HB3 1 82 THR HB . . 4.700 2.809 2.482 3.052 . 0 0 "[ . 1 . 2]" 1
1016 1 63 LEU HB3 1 82 THR MG . . 4.070 2.735 2.471 3.046 . 0 0 "[ . 1 . 2]" 1
1017 1 63 LEU HB3 1 86 LEU H . . 5.500 5.182 4.625 5.500 . 0 0 "[ . 1 . 2]" 1
1018 1 63 LEU MD1 1 63 LEU MD2 . . 2.730 1.905 1.874 1.948 . 0 0 "[ . 1 . 2]" 1
1019 1 63 LEU QD 1 64 LYS H . . 5.500 3.979 3.762 4.145 . 0 0 "[ . 1 . 2]" 1
1020 1 63 LEU QD 1 82 THR HB . . 5.500 1.993 1.909 2.312 . 0 0 "[ . 1 . 2]" 1
1021 1 63 LEU QD 1 85 PHE H . . 4.790 3.171 3.017 3.344 . 0 0 "[ . 1 . 2]" 1
1022 1 63 LEU QD 1 85 PHE HA . . 4.840 3.985 3.851 4.111 . 0 0 "[ . 1 . 2]" 1
1023 1 63 LEU QD 1 85 PHE HD1 . . 4.670 3.710 1.909 4.472 . 0 0 "[ . 1 . 2]" 1
1024 1 63 LEU QD 1 85 PHE HE2 . . 4.820 4.013 3.275 5.475 0.655 9 1 "[ . +1 . 2]" 1
1025 1 63 LEU QD 1 86 LEU H . . 3.980 2.422 2.052 2.699 . 0 0 "[ . 1 . 2]" 1
1026 1 63 LEU QD 1 86 LEU HA . . 4.710 3.770 3.077 4.065 . 0 0 "[ . 1 . 2]" 1
1027 1 63 LEU HG 1 82 THR HA . . 5.250 5.074 4.824 5.312 0.062 19 0 "[ . 1 . 2]" 1
1028 1 63 LEU HG 1 82 THR HB . . 4.600 3.858 3.755 4.025 . 0 0 "[ . 1 . 2]" 1
1029 1 63 LEU HG 1 82 THR MG . . 5.500 4.369 4.100 4.491 . 0 0 "[ . 1 . 2]" 1
1030 1 64 LYS H 1 64 LYS HB2 . . 3.680 3.157 2.580 3.632 . 0 0 "[ . 1 . 2]" 1
1031 1 64 LYS H 1 64 LYS QB . . 2.810 2.573 2.386 2.660 . 0 0 "[ . 1 . 2]" 1
1032 1 64 LYS H 1 64 LYS HB3 . . 3.680 3.074 2.423 3.632 . 0 0 "[ . 1 . 2]" 1
1033 1 64 LYS H 1 64 LYS QD . . 4.530 3.689 2.460 4.240 . 0 0 "[ . 1 . 2]" 1
1034 1 64 LYS H 1 64 LYS HE2 . . 5.500 4.434 2.941 5.528 0.028 8 0 "[ . 1 . 2]" 1
1035 1 64 LYS H 1 64 LYS HE3 . . 5.500 4.596 2.921 5.507 0.007 5 0 "[ . 1 . 2]" 1
1036 1 64 LYS H 1 64 LYS HG2 . . 3.430 2.634 1.907 3.520 0.090 19 0 "[ . 1 . 2]" 1
1037 1 64 LYS H 1 64 LYS HG3 . . 3.430 2.663 1.945 3.526 0.096 7 0 "[ . 1 . 2]" 1
1038 1 64 LYS H 1 65 TYR QB . . 5.340 4.875 4.308 5.347 0.007 13 0 "[ . 1 . 2]" 1
1039 1 64 LYS H 1 77 LEU H . . 5.500 5.343 4.953 5.601 0.101 13 0 "[ . 1 . 2]" 1
1040 1 64 LYS H 1 82 THR MG . . 3.630 2.592 2.323 2.922 . 0 0 "[ . 1 . 2]" 1
1041 1 64 LYS HA 1 77 LEU HB2 . . 3.190 2.035 1.799 2.306 . 0 0 "[ . 1 . 2]" 1
1042 1 64 LYS HA 1 77 LEU MD1 . . 4.440 2.061 1.878 2.683 . 0 0 "[ . 1 . 2]" 1
1043 1 64 LYS HA 1 77 LEU MD2 . . 5.500 4.324 4.167 4.466 . 0 0 "[ . 1 . 2]" 1
1044 1 64 LYS HA 1 78 THR H . . 5.500 5.438 5.082 5.605 0.105 2 0 "[ . 1 . 2]" 1
1045 1 64 LYS HA 1 82 THR MG . . 4.120 2.252 1.992 2.591 . 0 0 "[ . 1 . 2]" 1
1046 1 64 LYS QB 1 65 TYR H . . 3.810 3.051 2.131 3.896 0.086 20 0 "[ . 1 . 2]" 1
1047 1 64 LYS QB 1 76 VAL MG1 . . 3.720 2.121 1.845 2.839 . 0 0 "[ . 1 . 2]" 1
1048 1 64 LYS QB 1 77 LEU H . . 3.140 2.512 2.158 3.171 0.031 8 0 "[ . 1 . 2]" 1
1049 1 64 LYS QD 1 65 TYR QD . . 4.950 3.679 2.396 4.823 . 0 0 "[ . 1 . 2]" 1
1050 1 64 LYS QD 1 65 TYR QE . . 4.690 2.972 2.006 3.704 . 0 0 "[ . 1 . 2]" 1
1051 1 64 LYS QG 1 65 TYR H . . 4.810 3.258 1.903 4.198 . 0 0 "[ . 1 . 2]" 1
1052 1 64 LYS QG 1 65 TYR QD . . 5.340 3.233 1.894 4.946 . 0 0 "[ . 1 . 2]" 1
1053 1 64 LYS QG 1 65 TYR QE . . 5.340 3.718 2.427 4.886 . 0 0 "[ . 1 . 2]" 1
1054 1 64 LYS QG 1 82 THR MG . . 4.160 2.950 1.883 3.935 . 0 0 "[ . 1 . 2]" 1
1055 1 64 LYS HG2 1 65 TYR H . . 5.500 3.916 1.923 5.167 . 0 0 "[ . 1 . 2]" 1
1056 1 64 LYS HG3 1 65 TYR H . . 5.500 3.644 1.970 4.808 . 0 0 "[ . 1 . 2]" 1
1057 1 65 TYR H 1 65 TYR HB2 . . 4.150 2.816 2.366 3.705 . 0 0 "[ . 1 . 2]" 1
1058 1 65 TYR H 1 65 TYR QB . . 3.440 2.721 2.335 3.423 . 0 0 "[ . 1 . 2]" 1
1059 1 65 TYR H 1 65 TYR HB3 . . 4.150 3.775 3.591 4.079 . 0 0 "[ . 1 . 2]" 1
1060 1 65 TYR H 1 66 PHE H . . 3.030 2.951 2.603 3.360 0.330 12 0 "[ . 1 . 2]" 1
1061 1 65 TYR H 1 76 VAL MG1 . . 5.500 4.583 2.951 5.221 . 0 0 "[ . 1 . 2]" 1
1062 1 65 TYR H 1 77 LEU H . . 5.330 4.618 2.602 5.373 0.043 12 0 "[ . 1 . 2]" 1
1063 1 65 TYR HA 1 66 PHE H . . 3.430 2.801 2.631 3.103 . 0 0 "[ . 1 . 2]" 1
1064 1 65 TYR HA 1 67 LEU H . . 4.920 4.429 4.084 4.756 . 0 0 "[ . 1 . 2]" 1
1065 1 65 TYR QB 1 68 GLN H . . 5.040 4.537 4.341 4.744 . 0 0 "[ . 1 . 2]" 1
1066 1 65 TYR QB 1 68 GLN QB . . 4.180 3.091 2.946 3.314 . 0 0 "[ . 1 . 2]" 1
1067 1 65 TYR QB 1 68 GLN HG2 . . 5.340 4.858 4.330 5.393 0.053 13 0 "[ . 1 . 2]" 1
1068 1 65 TYR QB 1 68 GLN HG3 . . 5.340 5.325 4.953 5.449 0.109 20 0 "[ . 1 . 2]" 1
1069 1 65 TYR QE 1 76 VAL MG1 . . 4.840 3.268 2.057 4.280 . 0 0 "[ . 1 . 2]" 1
1070 1 66 PHE H 1 66 PHE HB2 . . 3.410 2.725 2.503 2.856 . 0 0 "[ . 1 . 2]" 1
1071 1 66 PHE H 1 66 PHE QB . . 2.920 2.313 2.243 2.362 . 0 0 "[ . 1 . 2]" 1
1072 1 66 PHE H 1 66 PHE HB3 . . 3.410 2.514 2.345 2.646 . 0 0 "[ . 1 . 2]" 1
1073 1 66 PHE H 1 66 PHE QD . . 5.470 4.197 4.088 4.255 . 0 0 "[ . 1 . 2]" 1
1074 1 66 PHE H 1 67 LEU H . . 3.880 2.555 2.363 2.778 . 0 0 "[ . 1 . 2]" 1
1075 1 66 PHE H 1 67 LEU HA . . 5.500 5.124 4.993 5.288 . 0 0 "[ . 1 . 2]" 1
1076 1 66 PHE H 1 67 LEU HG . . 4.200 3.965 3.731 4.219 0.019 5 0 "[ . 1 . 2]" 1
1077 1 66 PHE H 1 68 GLN H . . 5.500 3.525 3.327 3.795 . 0 0 "[ . 1 . 2]" 1
1078 1 66 PHE H 1 77 LEU MD1 . . 3.710 2.133 1.868 2.736 . 0 0 "[ . 1 . 2]" 1
1079 1 66 PHE H 1 77 LEU HG . . 4.240 4.197 3.444 4.372 0.132 15 0 "[ . 1 . 2]" 1
1080 1 66 PHE HA 1 66 PHE QD . . 4.100 2.965 2.743 3.097 . 0 0 "[ . 1 . 2]" 1
1081 1 66 PHE HA 1 67 LEU QD . . 5.500 4.866 4.746 4.956 . 0 0 "[ . 1 . 2]" 1
1082 1 66 PHE HA 1 68 GLN H . . 4.410 3.962 3.779 4.071 . 0 0 "[ . 1 . 2]" 1
1083 1 66 PHE HA 1 69 ARG HB2 . . 4.410 4.051 3.700 4.406 . 0 0 "[ . 1 . 2]" 1
1084 1 66 PHE HA 1 69 ARG HG2 . . 4.710 4.141 2.907 4.729 0.019 16 0 "[ . 1 . 2]" 1
1085 1 66 PHE HA 1 69 ARG QG . . 4.100 3.659 2.429 4.133 0.033 5 0 "[ . 1 . 2]" 1
1086 1 66 PHE HA 1 69 ARG HG3 . . 4.710 4.157 2.604 4.995 0.285 9 0 "[ . 1 . 2]" 1
1087 1 66 PHE QB 1 67 LEU H . . 3.150 2.183 1.913 2.461 . 0 0 "[ . 1 . 2]" 1
1088 1 66 PHE QB 1 68 GLN H . . 5.340 4.302 4.095 4.539 . 0 0 "[ . 1 . 2]" 1
1089 1 66 PHE QB 1 77 LEU MD1 . . 3.960 2.245 1.907 2.775 . 0 0 "[ . 1 . 2]" 1
1090 1 66 PHE HB2 1 67 LEU H . . 3.830 3.649 3.439 3.883 0.053 13 0 "[ . 1 . 2]" 1
1091 1 66 PHE HB3 1 67 LEU H . . 3.830 2.201 1.923 2.489 . 0 0 "[ . 1 . 2]" 1
1092 1 66 PHE QD 1 67 LEU H . . 4.990 2.895 2.606 3.168 . 0 0 "[ . 1 . 2]" 1
1093 1 66 PHE QD 1 67 LEU QD . . 3.710 1.990 1.893 2.292 . 0 0 "[ . 1 . 2]" 1
1094 1 66 PHE QD 1 69 ARG H . . 5.500 5.016 4.695 5.274 . 0 0 "[ . 1 . 2]" 1
1095 1 66 PHE QD 1 77 LEU MD1 . . 5.500 3.695 3.239 4.243 . 0 0 "[ . 1 . 2]" 1
1096 1 66 PHE QE 1 67 LEU H . . 5.500 5.152 4.931 5.333 . 0 0 "[ . 1 . 2]" 1
1097 1 67 LEU H 1 67 LEU HB2 . . 3.730 2.723 2.657 2.782 . 0 0 "[ . 1 . 2]" 1
1098 1 67 LEU H 1 67 LEU QB . . 3.240 2.642 2.590 2.688 . 0 0 "[ . 1 . 2]" 1
1099 1 67 LEU H 1 67 LEU HB3 . . 3.730 3.569 3.558 3.581 . 0 0 "[ . 1 . 2]" 1
1100 1 67 LEU H 1 67 LEU QD . . 3.830 2.648 2.509 2.729 . 0 0 "[ . 1 . 2]" 1
1101 1 67 LEU H 1 67 LEU HG . . 3.290 1.968 1.878 2.074 . 0 0 "[ . 1 . 2]" 1
1102 1 67 LEU H 1 68 GLN H . . 3.290 2.735 2.699 2.773 . 0 0 "[ . 1 . 2]" 1
1103 1 67 LEU H 1 68 GLN QB . . 5.320 4.408 4.359 4.476 . 0 0 "[ . 1 . 2]" 1
1104 1 67 LEU H 1 69 ARG H . . 4.690 4.390 4.197 4.697 0.007 17 0 "[ . 1 . 2]" 1
1105 1 67 LEU H 1 77 LEU MD1 . . 4.450 2.459 2.043 2.909 . 0 0 "[ . 1 . 2]" 1
1106 1 67 LEU H 1 77 LEU MD2 . . 5.500 3.832 3.505 4.154 . 0 0 "[ . 1 . 2]" 1
1107 1 67 LEU QB 1 74 ALA HA . . 5.340 4.287 3.797 4.842 . 0 0 "[ . 1 . 2]" 1
1108 1 67 LEU QB 1 74 ALA MB . . 3.190 2.026 1.820 2.344 . 0 0 "[ . 1 . 2]" 1
1109 1 67 LEU QD 1 68 GLN H . . 5.500 4.138 4.073 4.187 . 0 0 "[ . 1 . 2]" 1
1110 1 67 LEU QD 1 75 ARG H . . 5.500 4.762 3.966 5.233 . 0 0 "[ . 1 . 2]" 1
1111 1 67 LEU QD 1 77 LEU MD1 . . 5.500 2.817 2.496 3.081 . 0 0 "[ . 1 . 2]" 1
1112 1 67 LEU QD 1 77 LEU MD2 . . 4.180 1.921 1.717 2.459 . 0 0 "[ . 1 . 2]" 1
1113 1 67 LEU HG 1 74 ALA MB . . 4.880 3.931 3.684 4.340 . 0 0 "[ . 1 . 2]" 1
1114 1 67 LEU HG 1 77 LEU MD1 . . 3.920 2.377 2.007 2.750 . 0 0 "[ . 1 . 2]" 1
1115 1 67 LEU HG 1 77 LEU MD2 . . 4.540 2.429 2.038 2.903 . 0 0 "[ . 1 . 2]" 1
1116 1 67 LEU HG 1 77 LEU HG . . 3.910 2.856 2.136 3.501 . 0 0 "[ . 1 . 2]" 1
1117 1 68 GLN H 1 68 GLN HB2 . . 3.930 2.138 2.066 2.271 . 0 0 "[ . 1 . 2]" 1
1118 1 68 GLN H 1 68 GLN QB . . 3.100 2.094 2.043 2.183 . 0 0 "[ . 1 . 2]" 1
1119 1 68 GLN H 1 68 GLN HB3 . . 3.930 3.045 2.818 3.242 . 0 0 "[ . 1 . 2]" 1
1120 1 68 GLN H 1 68 GLN HE21 . . 4.310 3.512 3.032 4.008 . 0 0 "[ . 1 . 2]" 1
1121 1 68 GLN H 1 69 ARG HB2 . . 4.830 4.734 4.523 4.872 0.042 19 0 "[ . 1 . 2]" 1
1122 1 68 GLN H 1 74 ALA H . . 5.500 5.054 4.420 5.514 0.014 11 0 "[ . 1 . 2]" 1
1123 1 68 GLN H 1 74 ALA MB . . 3.470 2.850 2.407 3.344 . 0 0 "[ . 1 . 2]" 1
1124 1 68 GLN H 1 77 LEU MD1 . . 5.500 4.226 3.817 4.783 . 0 0 "[ . 1 . 2]" 1
1125 1 68 GLN HA 1 68 GLN HE22 . . 5.500 5.123 4.644 5.609 0.109 11 0 "[ . 1 . 2]" 1
1126 1 68 GLN HA 1 73 GLY H . . 5.380 4.060 3.070 4.680 . 0 0 "[ . 1 . 2]" 1
1127 1 68 GLN HA 1 74 ALA H . . 3.940 2.870 2.058 3.500 . 0 0 "[ . 1 . 2]" 1
1128 1 68 GLN QB 1 68 GLN HE21 . . 3.980 2.001 1.894 2.353 . 0 0 "[ . 1 . 2]" 1
1129 1 68 GLN QB 1 68 GLN HE22 . . 3.510 3.212 3.160 3.320 . 0 0 "[ . 1 . 2]" 1
1130 1 68 GLN QB 1 69 ARG H . . 3.630 2.881 2.415 3.140 . 0 0 "[ . 1 . 2]" 1
1131 1 68 GLN HE21 1 68 GLN HG3 . . 3.430 2.657 2.493 2.757 . 0 0 "[ . 1 . 2]" 1
1132 1 68 GLN HE21 1 69 ARG H . . 5.500 5.514 5.216 5.653 0.153 20 0 "[ . 1 . 2]" 1
1133 1 68 GLN HE21 1 74 ALA H . . 5.500 5.081 4.217 5.528 0.028 4 0 "[ . 1 . 2]" 1
1134 1 68 GLN HE21 1 74 ALA MB . . 5.370 2.997 1.919 3.601 . 0 0 "[ . 1 . 2]" 1
1135 1 68 GLN HE21 1 75 ARG H . . 4.670 4.022 3.258 4.787 0.117 20 0 "[ . 1 . 2]" 1
1136 1 68 GLN HE21 1 75 ARG HA . . 4.980 3.081 2.133 3.898 . 0 0 "[ . 1 . 2]" 1
1137 1 68 GLN HE21 1 76 VAL H . . 5.270 4.807 4.119 5.287 0.017 8 0 "[ . 1 . 2]" 1
1138 1 68 GLN HE22 1 68 GLN HG3 . . 3.890 3.660 3.589 3.705 . 0 0 "[ . 1 . 2]" 1
1139 1 68 GLN HE22 1 74 ALA MB . . 5.460 4.417 3.445 5.042 . 0 0 "[ . 1 . 2]" 1
1140 1 68 GLN HE22 1 75 ARG HA . . 4.640 2.897 2.157 3.945 . 0 0 "[ . 1 . 2]" 1
1141 1 68 GLN HE22 1 76 VAL H . . 5.500 5.001 3.916 5.515 0.015 3 0 "[ . 1 . 2]" 1
1142 1 68 GLN HE22 1 76 VAL MG2 . . 4.680 4.028 3.552 4.429 . 0 0 "[ . 1 . 2]" 1
1143 1 68 GLN HG2 1 69 ARG HA . . 5.470 5.038 4.221 5.485 0.015 14 0 "[ . 1 . 2]" 1
1144 1 68 GLN HG3 1 73 GLY H . . 5.500 4.900 3.698 5.536 0.036 17 0 "[ . 1 . 2]" 1
1145 1 68 GLN HG3 1 74 ALA H . . 4.080 3.554 2.402 4.119 0.039 8 0 "[ . 1 . 2]" 1
1146 1 68 GLN HG3 1 74 ALA MB . . 4.190 3.148 2.093 3.786 . 0 0 "[ . 1 . 2]" 1
1147 1 69 ARG H 1 69 ARG HB2 . . 3.760 2.292 2.151 2.448 . 0 0 "[ . 1 . 2]" 1
1148 1 69 ARG H 1 69 ARG HG2 . . 4.190 2.850 2.300 3.855 . 0 0 "[ . 1 . 2]" 1
1149 1 69 ARG H 1 69 ARG QG . . 3.450 2.754 2.279 3.489 0.039 9 0 "[ . 1 . 2]" 1
1150 1 69 ARG H 1 69 ARG HG3 . . 4.190 3.749 3.343 4.079 . 0 0 "[ . 1 . 2]" 1
1151 1 69 ARG HA 1 69 ARG QD . . 3.540 2.823 1.994 3.303 . 0 0 "[ . 1 . 2]" 1
1152 1 69 ARG HA 1 69 ARG HG2 . . 4.130 2.682 2.314 3.643 . 0 0 "[ . 1 . 2]" 1
1153 1 69 ARG HA 1 69 ARG QG . . 3.630 2.568 2.287 2.875 . 0 0 "[ . 1 . 2]" 1
1154 1 69 ARG HA 1 69 ARG HG3 . . 4.130 3.615 2.530 3.745 . 0 0 "[ . 1 . 2]" 1
1155 1 69 ARG HA 1 69 ARG QH2 . . 4.510 3.691 3.171 4.516 0.006 8 0 "[ . 1 . 2]" 1
1156 1 69 ARG HB2 1 69 ARG QH1 . . 5.340 4.864 4.015 5.349 0.009 19 0 "[ . 1 . 2]" 1
1157 1 69 ARG HB2 1 70 PHE H . . 4.210 2.300 2.026 2.717 . 0 0 "[ . 1 . 2]" 1
1158 1 69 ARG HB3 1 70 PHE H . . 4.810 2.821 2.525 3.475 . 0 0 "[ . 1 . 2]" 1
1159 1 69 ARG HB3 1 70 PHE QD . . 4.970 4.033 3.222 4.611 . 0 0 "[ . 1 . 2]" 1
1160 1 69 ARG HB3 1 71 GLU H . . 5.500 5.514 5.389 5.588 0.088 20 0 "[ . 1 . 2]" 1
1161 1 69 ARG QG 1 69 ARG QH1 . . 4.670 2.945 2.041 3.844 . 0 0 "[ . 1 . 2]" 1
1162 1 69 ARG QG 1 69 ARG QH2 . . 4.880 4.036 3.760 4.458 . 0 0 "[ . 1 . 2]" 1
1163 1 69 ARG QG 1 70 PHE QD . . 5.340 4.892 4.176 5.231 . 0 0 "[ . 1 . 2]" 1
1164 1 70 PHE H 1 70 PHE HB2 . . 2.910 2.491 2.326 2.640 . 0 0 "[ . 1 . 2]" 1
1165 1 70 PHE H 1 70 PHE HB3 . . 3.740 3.598 3.561 3.679 . 0 0 "[ . 1 . 2]" 1
1166 1 70 PHE H 1 70 PHE QE . . 5.030 4.280 3.968 4.703 . 0 0 "[ . 1 . 2]" 1
1167 1 70 PHE HA 1 70 PHE QD . . 4.140 2.736 2.367 3.115 . 0 0 "[ . 1 . 2]" 1
1168 1 70 PHE HB2 1 71 GLU H . . 3.530 2.206 1.944 2.731 . 0 0 "[ . 1 . 2]" 1
1169 1 70 PHE HB3 1 71 GLU H . . 3.880 3.208 2.773 3.711 . 0 0 "[ . 1 . 2]" 1
1170 1 71 GLU H 1 71 GLU QB . . 3.580 2.208 2.094 2.293 . 0 0 "[ . 1 . 2]" 1
1171 1 71 GLU H 1 72 SER H . . 4.700 3.872 2.688 4.647 . 0 0 "[ . 1 . 2]" 1
1172 1 71 GLU HA 1 71 GLU QG . . 3.290 2.622 2.131 3.096 . 0 0 "[ . 1 . 2]" 1
1173 1 71 GLU QB 1 72 SER H . . 3.770 3.021 2.459 3.746 . 0 0 "[ . 1 . 2]" 1
1174 1 71 GLU QB 1 73 GLY H . . 3.890 2.807 2.603 3.300 . 0 0 "[ . 1 . 2]" 1
1175 1 71 GLU QB 1 74 ALA H . . 3.520 2.704 2.268 3.128 . 0 0 "[ . 1 . 2]" 1
1176 1 71 GLU QB 1 74 ALA HA . . 5.340 4.267 3.648 4.830 . 0 0 "[ . 1 . 2]" 1
1177 1 71 GLU QB 1 74 ALA MB . . 3.310 2.334 1.939 2.760 . 0 0 "[ . 1 . 2]" 1
1178 1 71 GLU HB2 1 72 SER H . . 4.410 4.033 3.828 4.412 0.002 7 0 "[ . 1 . 2]" 1
1179 1 71 GLU HB2 1 73 GLY H . . 4.730 4.272 4.057 4.742 0.012 10 0 "[ . 1 . 2]" 1
1180 1 71 GLU HB2 1 74 ALA MB . . 3.820 3.389 2.836 3.697 . 0 0 "[ . 1 . 2]" 1
1181 1 71 GLU HB3 1 72 SER H . . 4.410 3.147 2.489 4.051 . 0 0 "[ . 1 . 2]" 1
1182 1 71 GLU HB3 1 73 GLY H . . 4.730 2.848 2.630 3.367 . 0 0 "[ . 1 . 2]" 1
1183 1 71 GLU HB3 1 74 ALA MB . . 3.820 2.388 1.961 2.852 . 0 0 "[ . 1 . 2]" 1
1184 1 71 GLU QG 1 72 SER H . . 3.540 2.776 1.944 3.571 0.031 20 0 "[ . 1 . 2]" 1
1185 1 71 GLU QG 1 72 SER HA . . 4.590 4.498 4.231 4.655 0.065 13 0 "[ . 1 . 2]" 1
1186 1 71 GLU QG 1 73 GLY H . . 3.520 2.131 1.927 2.769 . 0 0 "[ . 1 . 2]" 1
1187 1 71 GLU QG 1 74 ALA H . . 4.060 2.928 1.937 3.509 . 0 0 "[ . 1 . 2]" 1
1188 1 71 GLU HG2 1 74 ALA H . . 4.930 3.259 1.945 4.001 . 0 0 "[ . 1 . 2]" 1
1189 1 71 GLU HG3 1 74 ALA H . . 4.930 3.697 2.394 4.940 0.010 10 0 "[ . 1 . 2]" 1
1190 1 72 SER H 1 72 SER QB . . 2.870 2.551 2.173 2.980 0.110 20 0 "[ . 1 . 2]" 1
1191 1 72 SER H 1 73 GLY QA . . 4.600 4.440 3.933 4.683 0.083 10 0 "[ . 1 . 2]" 1
1192 1 72 SER H 1 74 ALA MB . . 5.500 4.687 4.014 5.139 . 0 0 "[ . 1 . 2]" 1
1193 1 72 SER HA 1 74 ALA H . . 5.500 4.486 3.784 5.540 0.040 10 0 "[ . 1 . 2]" 1
1194 1 72 SER QB 1 73 GLY H . . 3.600 3.366 2.342 3.718 0.118 7 0 "[ . 1 . 2]" 1
1195 1 73 GLY H 1 73 GLY QA . . 2.500 2.442 2.376 2.502 0.002 6 0 "[ . 1 . 2]" 1
1196 1 73 GLY H 1 74 ALA H . . 2.870 2.071 1.853 2.768 . 0 0 "[ . 1 . 2]" 1
1197 1 73 GLY H 1 74 ALA MB . . 4.690 3.559 3.288 4.114 . 0 0 "[ . 1 . 2]" 1
1198 1 74 ALA H 1 74 ALA MB . . 2.710 2.115 2.036 2.261 . 0 0 "[ . 1 . 2]" 1
1199 1 74 ALA H 1 75 ARG H . . 5.500 4.570 4.485 4.616 . 0 0 "[ . 1 . 2]" 1
1200 1 74 ALA HA 1 75 ARG H . . 2.710 2.454 2.144 2.620 . 0 0 "[ . 1 . 2]" 1
1201 1 74 ALA HA 1 75 ARG HB2 . . 5.500 5.600 5.550 5.657 0.157 14 0 "[ . 1 . 2]" 1
1202 1 74 ALA HA 1 75 ARG HB3 . . 5.500 4.853 4.610 5.084 . 0 0 "[ . 1 . 2]" 1
1203 1 74 ALA HA 1 76 VAL H . . 4.920 4.770 4.084 5.083 0.163 10 0 "[ . 1 . 2]" 1
1204 1 74 ALA MB 1 75 ARG H . . 4.090 2.498 2.165 3.218 . 0 0 "[ . 1 . 2]" 1
1205 1 74 ALA MB 1 76 VAL H . . 5.500 4.113 3.235 4.805 . 0 0 "[ . 1 . 2]" 1
1206 1 75 ARG H 1 75 ARG HB2 . . 3.800 3.596 3.461 3.710 . 0 0 "[ . 1 . 2]" 1
1207 1 75 ARG H 1 75 ARG HB3 . . 3.800 3.495 3.074 3.652 . 0 0 "[ . 1 . 2]" 1
1208 1 75 ARG H 1 75 ARG HD2 . . 4.710 4.261 3.702 4.605 . 0 0 "[ . 1 . 2]" 1
1209 1 75 ARG H 1 75 ARG QD . . 4.100 3.880 2.331 4.104 0.004 5 0 "[ . 1 . 2]" 1
1210 1 75 ARG H 1 75 ARG HD3 . . 4.710 4.559 2.356 4.837 0.127 7 0 "[ . 1 . 2]" 1
1211 1 75 ARG H 1 75 ARG HG2 . . 3.340 2.676 1.894 3.068 . 0 0 "[ . 1 . 2]" 1
1212 1 75 ARG H 1 75 ARG QG . . 2.480 1.963 1.788 2.084 . 0 0 "[ . 1 . 2]" 1
1213 1 75 ARG H 1 75 ARG HG3 . . 3.340 2.148 1.910 3.524 0.184 1 0 "[ . 1 . 2]" 1
1214 1 75 ARG H 1 76 VAL H . . 3.420 2.432 1.871 3.071 . 0 0 "[ . 1 . 2]" 1
1215 1 75 ARG H 1 76 VAL HA . . 5.500 4.465 4.286 5.033 . 0 0 "[ . 1 . 2]" 1
1216 1 75 ARG HA 1 75 ARG HD2 . . 5.500 4.949 3.927 5.237 . 0 0 "[ . 1 . 2]" 1
1217 1 75 ARG HA 1 75 ARG QD . . 4.650 4.223 3.376 4.281 . 0 0 "[ . 1 . 2]" 1
1218 1 75 ARG HA 1 75 ARG HD3 . . 5.500 4.590 3.680 4.858 . 0 0 "[ . 1 . 2]" 1
1219 1 75 ARG HA 1 76 VAL MG2 . . 4.770 3.671 3.423 3.951 . 0 0 "[ . 1 . 2]" 1
1220 1 75 ARG QB 1 75 ARG QD . . 3.330 2.085 2.009 2.128 . 0 0 "[ . 1 . 2]" 1
1221 1 75 ARG QB 1 76 VAL H . . 3.610 2.617 2.232 3.340 . 0 0 "[ . 1 . 2]" 1
1222 1 75 ARG QD 1 75 ARG QH2 . . 3.890 3.670 3.659 3.678 . 0 0 "[ . 1 . 2]" 1
1223 1 75 ARG HD2 1 76 VAL H . . 4.660 3.109 2.554 4.674 0.014 1 0 "[ . 1 . 2]" 1
1224 1 75 ARG HD3 1 76 VAL H . . 4.660 3.996 3.559 4.663 0.003 5 0 "[ . 1 . 2]" 1
1225 1 75 ARG QG 1 75 ARG QH1 . . 4.970 2.097 1.976 2.296 . 0 0 "[ . 1 . 2]" 1
1226 1 75 ARG QG 1 76 VAL MG2 . . 4.230 3.475 2.449 3.931 . 0 0 "[ . 1 . 2]" 1
1227 1 75 ARG HG2 1 75 ARG HH21 . . 5.500 4.449 4.293 4.896 . 0 0 "[ . 1 . 2]" 1
1228 1 75 ARG HG2 1 75 ARG HH22 . . 5.500 4.857 4.350 5.421 . 0 0 "[ . 1 . 2]" 1
1229 1 75 ARG HG2 1 76 VAL H . . 3.850 3.387 1.917 3.599 . 0 0 "[ . 1 . 2]" 1
1230 1 75 ARG HG3 1 75 ARG HH21 . . 5.500 4.993 4.488 5.231 . 0 0 "[ . 1 . 2]" 1
1231 1 75 ARG HG3 1 75 ARG HH22 . . 5.500 5.006 4.441 5.598 0.098 19 0 "[ . 1 . 2]" 1
1232 1 75 ARG HG3 1 76 VAL H . . 3.850 1.981 1.897 3.073 . 0 0 "[ . 1 . 2]" 1
1233 1 75 ARG QH1 1 76 VAL MG2 . . 5.080 4.218 2.405 4.811 . 0 0 "[ . 1 . 2]" 1
1234 1 76 VAL H 1 76 VAL MG2 . . 3.650 2.708 2.465 2.879 . 0 0 "[ . 1 . 2]" 1
1235 1 76 VAL H 1 77 LEU H . . 4.650 4.310 3.985 4.437 . 0 0 "[ . 1 . 2]" 1
1236 1 76 VAL HA 1 77 LEU H . . 2.920 2.301 2.141 2.404 . 0 0 "[ . 1 . 2]" 1
1237 1 76 VAL HB 1 77 LEU H . . 4.180 3.460 2.542 4.251 0.071 7 0 "[ . 1 . 2]" 1
1238 1 76 VAL MG1 1 77 LEU H . . 3.960 2.432 1.910 3.225 . 0 0 "[ . 1 . 2]" 1
1239 1 76 VAL MG2 1 77 LEU H . . 5.500 4.040 3.931 4.313 . 0 0 "[ . 1 . 2]" 1
1240 1 77 LEU H 1 77 LEU HB2 . . 2.970 2.338 2.152 2.416 . 0 0 "[ . 1 . 2]" 1
1241 1 77 LEU H 1 77 LEU MD1 . . 5.020 3.352 2.999 3.571 . 0 0 "[ . 1 . 2]" 1
1242 1 77 LEU H 1 78 THR H . . 4.670 4.491 4.413 4.620 . 0 0 "[ . 1 . 2]" 1
1243 1 77 LEU H 1 82 THR MG . . 5.500 3.870 3.536 4.309 . 0 0 "[ . 1 . 2]" 1
1244 1 77 LEU HA 1 77 LEU MD2 . . 3.940 2.712 2.412 3.016 . 0 0 "[ . 1 . 2]" 1
1245 1 77 LEU HA 1 78 THR H . . 3.050 2.574 2.467 2.675 . 0 0 "[ . 1 . 2]" 1
1246 1 77 LEU HA 1 78 THR MG . . 4.160 3.513 3.318 3.773 . 0 0 "[ . 1 . 2]" 1
1247 1 77 LEU HB2 1 78 THR H . . 3.930 3.491 3.211 3.774 . 0 0 "[ . 1 . 2]" 1
1248 1 77 LEU HB2 1 81 GLU HB2 . . 4.820 4.231 3.852 4.648 . 0 0 "[ . 1 . 2]" 1
1249 1 77 LEU HB2 1 82 THR H . . 4.780 4.458 4.066 4.817 0.037 11 0 "[ . 1 . 2]" 1
1250 1 77 LEU HB3 1 77 LEU MD2 . . 3.480 2.065 1.935 2.217 . 0 0 "[ . 1 . 2]" 1
1251 1 77 LEU HB3 1 78 THR H . . 3.630 2.066 1.867 2.323 . 0 0 "[ . 1 . 2]" 1
1252 1 77 LEU HB3 1 81 GLU HB2 . . 4.300 2.634 2.283 2.949 . 0 0 "[ . 1 . 2]" 1
1253 1 77 LEU HB3 1 81 GLU HB3 . . 4.220 3.644 3.300 4.109 . 0 0 "[ . 1 . 2]" 1
1254 1 77 LEU HB3 1 82 THR H . . 3.650 3.562 3.290 3.706 0.056 20 0 "[ . 1 . 2]" 1
1255 1 77 LEU HB3 1 82 THR HA . . 5.500 4.887 4.649 5.122 . 0 0 "[ . 1 . 2]" 1
1256 1 77 LEU HB3 1 82 THR MG . . 3.390 2.548 2.153 2.970 . 0 0 "[ . 1 . 2]" 1
1257 1 77 LEU MD1 1 78 THR H . . 5.500 4.416 4.182 4.626 . 0 0 "[ . 1 . 2]" 1
1258 1 77 LEU MD1 1 81 GLU HB2 . . 5.500 4.072 3.418 4.398 . 0 0 "[ . 1 . 2]" 1
1259 1 77 LEU MD1 1 81 GLU HB3 . . 5.500 3.884 3.508 4.242 . 0 0 "[ . 1 . 2]" 1
1260 1 77 LEU MD1 1 82 THR H . . 5.500 4.449 3.837 4.851 . 0 0 "[ . 1 . 2]" 1
1261 1 77 LEU MD1 1 82 THR HA . . 5.200 4.011 3.529 4.550 . 0 0 "[ . 1 . 2]" 1
1262 1 77 LEU MD1 1 82 THR MG . . 5.150 2.273 1.924 2.907 . 0 0 "[ . 1 . 2]" 1
1263 1 77 LEU MD2 1 78 THR H . . 3.820 2.852 2.514 3.067 . 0 0 "[ . 1 . 2]" 1
1264 1 77 LEU MD2 1 81 GLU H . . 5.410 4.500 4.053 4.908 . 0 0 "[ . 1 . 2]" 1
1265 1 77 LEU MD2 1 81 GLU HB2 . . 5.060 2.435 1.927 2.808 . 0 0 "[ . 1 . 2]" 1
1266 1 77 LEU MD2 1 81 GLU HB3 . . 4.870 2.364 1.953 3.083 . 0 0 "[ . 1 . 2]" 1
1267 1 77 LEU MD2 1 81 GLU QG . . 5.340 3.066 2.271 3.529 . 0 0 "[ . 1 . 2]" 1
1268 1 77 LEU MD2 1 82 THR H . . 5.500 4.057 3.437 4.456 . 0 0 "[ . 1 . 2]" 1
1269 1 78 THR H 1 78 THR HB . . 4.160 3.677 3.625 3.754 . 0 0 "[ . 1 . 2]" 1
1270 1 78 THR H 1 78 THR MG . . 3.370 2.318 2.001 2.675 . 0 0 "[ . 1 . 2]" 1
1271 1 78 THR H 1 79 ALA H . . 4.800 4.513 4.416 4.603 . 0 0 "[ . 1 . 2]" 1
1272 1 78 THR H 1 80 SER H . . 4.780 4.391 3.974 4.774 . 0 0 "[ . 1 . 2]" 1
1273 1 78 THR H 1 81 GLU H . . 4.080 3.855 3.573 4.101 0.021 17 0 "[ . 1 . 2]" 1
1274 1 78 THR H 1 81 GLU HB2 . . 3.220 2.793 2.672 2.912 . 0 0 "[ . 1 . 2]" 1
1275 1 78 THR H 1 81 GLU HB3 . . 4.290 4.305 4.244 4.335 0.045 3 0 "[ . 1 . 2]" 1
1276 1 78 THR H 1 82 THR H . . 4.390 4.119 3.657 4.467 0.077 20 0 "[ . 1 . 2]" 1
1277 1 78 THR H 1 82 THR MG . . 5.480 3.761 3.374 4.241 . 0 0 "[ . 1 . 2]" 1
1278 1 78 THR HA 1 78 THR MG . . 3.670 2.394 2.278 2.479 . 0 0 "[ . 1 . 2]" 1
1279 1 78 THR HA 1 79 ALA H . . 2.800 2.557 2.365 2.693 . 0 0 "[ . 1 . 2]" 1
1280 1 78 THR HA 1 80 SER H . . 4.560 4.064 3.913 4.270 . 0 0 "[ . 1 . 2]" 1
1281 1 78 THR HB 1 79 ALA H . . 3.050 2.145 1.952 2.479 . 0 0 "[ . 1 . 2]" 1
1282 1 78 THR HB 1 80 SER H . . 3.400 2.783 2.531 3.096 . 0 0 "[ . 1 . 2]" 1
1283 1 78 THR HB 1 81 GLU H . . 4.430 3.957 3.521 4.321 . 0 0 "[ . 1 . 2]" 1
1284 1 78 THR MG 1 79 ALA H . . 5.140 3.668 3.519 3.833 . 0 0 "[ . 1 . 2]" 1
1285 1 78 THR MG 1 80 SER H . . 5.350 4.041 4.009 4.095 . 0 0 "[ . 1 . 2]" 1
1286 1 79 ALA H 1 79 ALA MB . . 3.200 2.227 2.100 2.316 . 0 0 "[ . 1 . 2]" 1
1287 1 79 ALA H 1 80 SER H . . 3.440 2.501 2.285 2.632 . 0 0 "[ . 1 . 2]" 1
1288 1 79 ALA H 1 81 GLU H . . 4.630 4.486 4.176 4.678 0.048 15 0 "[ . 1 . 2]" 1
1289 1 79 ALA HA 1 81 GLU H . . 5.250 4.898 4.734 5.074 . 0 0 "[ . 1 . 2]" 1
1290 1 79 ALA HA 1 82 THR H . . 4.190 4.186 3.994 4.304 0.114 7 0 "[ . 1 . 2]" 1
1291 1 79 ALA HA 1 82 THR MG . . 4.800 4.049 3.616 4.478 . 0 0 "[ . 1 . 2]" 1
1292 1 79 ALA HA 1 83 LYS H . . 5.500 4.003 3.638 4.609 . 0 0 "[ . 1 . 2]" 1
1293 1 79 ALA MB 1 80 SER H . . 3.710 3.240 3.051 3.427 . 0 0 "[ . 1 . 2]" 1
1294 1 80 SER H 1 80 SER QB . . 2.940 2.294 2.111 2.812 . 0 0 "[ . 1 . 2]" 1
1295 1 80 SER H 1 81 GLU H . . 3.230 2.334 2.148 2.550 . 0 0 "[ . 1 . 2]" 1
1296 1 80 SER H 1 81 GLU HB2 . . 4.560 4.256 3.916 4.626 0.066 12 0 "[ . 1 . 2]" 1
1297 1 80 SER H 1 81 GLU QG . . 4.500 4.252 3.643 4.515 0.015 9 0 "[ . 1 . 2]" 1
1298 1 80 SER H 1 82 THR H . . 4.460 3.791 3.259 4.252 . 0 0 "[ . 1 . 2]" 1
1299 1 80 SER H 1 82 THR MG . . 5.500 4.937 4.613 5.156 . 0 0 "[ . 1 . 2]" 1
1300 1 80 SER HA 1 83 LYS H . . 4.660 3.571 3.199 3.969 . 0 0 "[ . 1 . 2]" 1
1301 1 80 SER QB 1 81 GLU H . . 3.950 2.509 2.232 3.243 . 0 0 "[ . 1 . 2]" 1
1302 1 80 SER HB2 1 81 GLU H . . 4.670 2.734 2.275 3.589 . 0 0 "[ . 1 . 2]" 1
1303 1 80 SER HB2 1 82 THR H . . 5.500 5.240 4.774 5.511 0.011 20 0 "[ . 1 . 2]" 1
1304 1 80 SER HB3 1 81 GLU H . . 4.670 3.045 2.335 3.698 . 0 0 "[ . 1 . 2]" 1
1305 1 80 SER HB3 1 82 THR H . . 5.500 5.385 4.695 5.559 0.059 11 0 "[ . 1 . 2]" 1
1306 1 81 GLU H 1 81 GLU HB2 . . 3.150 2.434 2.275 2.640 . 0 0 "[ . 1 . 2]" 1
1307 1 81 GLU H 1 81 GLU HB3 . . 3.670 3.576 3.542 3.596 . 0 0 "[ . 1 . 2]" 1
1308 1 81 GLU H 1 81 GLU QG . . 2.950 2.311 1.914 2.604 . 0 0 "[ . 1 . 2]" 1
1309 1 81 GLU H 1 82 THR H . . 3.050 2.852 2.630 2.950 . 0 0 "[ . 1 . 2]" 1
1310 1 81 GLU H 1 82 THR HA . . 5.500 5.420 5.263 5.485 . 0 0 "[ . 1 . 2]" 1
1311 1 81 GLU H 1 82 THR MG . . 5.500 4.544 4.344 4.731 . 0 0 "[ . 1 . 2]" 1
1312 1 81 GLU HA 1 81 GLU QG . . 3.370 2.499 2.265 2.957 . 0 0 "[ . 1 . 2]" 1
1313 1 81 GLU HA 1 84 THR H . . 4.140 3.811 3.585 3.991 . 0 0 "[ . 1 . 2]" 1
1314 1 81 GLU HA 1 84 THR MG . . 4.520 2.255 2.080 2.545 . 0 0 "[ . 1 . 2]" 1
1315 1 81 GLU HB2 1 82 THR H . . 3.370 2.510 2.148 2.948 . 0 0 "[ . 1 . 2]" 1
1316 1 81 GLU HB3 1 82 THR H . . 3.540 3.382 3.101 3.620 0.080 19 0 "[ . 1 . 2]" 1
1317 1 81 GLU QG 1 82 THR H . . 4.500 4.121 3.762 4.383 . 0 0 "[ . 1 . 2]" 1
1318 1 82 THR H 1 82 THR HB . . 4.090 3.621 3.604 3.649 . 0 0 "[ . 1 . 2]" 1
1319 1 82 THR H 1 82 THR MG . . 3.670 2.444 2.210 2.654 . 0 0 "[ . 1 . 2]" 1
1320 1 82 THR H 1 83 LYS H . . 3.300 2.657 2.291 2.905 . 0 0 "[ . 1 . 2]" 1
1321 1 82 THR H 1 83 LYS HA . . 5.500 5.249 4.963 5.450 . 0 0 "[ . 1 . 2]" 1
1322 1 82 THR H 1 84 THR H . . 4.630 4.103 3.650 4.411 . 0 0 "[ . 1 . 2]" 1
1323 1 82 THR H 1 84 THR MG . . 5.500 4.240 3.866 4.466 . 0 0 "[ . 1 . 2]" 1
1324 1 82 THR HA 1 82 THR MG . . 3.610 2.224 2.169 2.284 . 0 0 "[ . 1 . 2]" 1
1325 1 82 THR HA 1 84 THR H . . 4.460 4.076 3.653 4.369 . 0 0 "[ . 1 . 2]" 1
1326 1 82 THR HA 1 85 PHE H . . 4.280 4.065 3.647 4.342 0.062 8 0 "[ . 1 . 2]" 1
1327 1 82 THR HA 1 85 PHE HB2 . . 4.700 2.471 2.088 2.904 . 0 0 "[ . 1 . 2]" 1
1328 1 82 THR HA 1 85 PHE QB . . 3.930 2.419 2.070 2.870 . 0 0 "[ . 1 . 2]" 1
1329 1 82 THR HA 1 85 PHE HB3 . . 4.700 3.619 2.832 4.490 . 0 0 "[ . 1 . 2]" 1
1330 1 82 THR HB 1 83 LYS H . . 4.150 3.571 3.419 3.906 . 0 0 "[ . 1 . 2]" 1
1331 1 82 THR MG 1 83 LYS H . . 5.500 3.891 3.774 4.025 . 0 0 "[ . 1 . 2]" 1
1332 1 83 LYS H 1 83 LYS HB2 . . 3.890 2.583 2.372 2.673 . 0 0 "[ . 1 . 2]" 1
1333 1 83 LYS H 1 83 LYS HB3 . . 4.130 2.472 2.377 2.680 . 0 0 "[ . 1 . 2]" 1
1334 1 83 LYS H 1 83 LYS HG2 . . 5.380 4.492 4.369 4.609 . 0 0 "[ . 1 . 2]" 1
1335 1 83 LYS H 1 83 LYS QG . . 4.600 3.978 3.939 4.056 . 0 0 "[ . 1 . 2]" 1
1336 1 83 LYS H 1 83 LYS HG3 . . 5.380 4.447 4.343 4.618 . 0 0 "[ . 1 . 2]" 1
1337 1 83 LYS HA 1 86 LEU H . . 4.340 4.388 4.146 4.546 0.206 3 0 "[ . 1 . 2]" 1
1338 1 83 LYS HA 1 87 ALA H . . 4.430 4.172 3.832 4.507 0.077 5 0 "[ . 1 . 2]" 1
1339 1 83 LYS HB3 1 84 THR H . . 3.340 2.807 2.522 3.281 . 0 0 "[ . 1 . 2]" 1
1340 1 83 LYS HB3 1 85 PHE H . . 5.240 5.050 4.745 5.199 . 0 0 "[ . 1 . 2]" 1
1341 1 83 LYS QG 1 84 THR H . . 4.210 3.631 3.252 4.022 . 0 0 "[ . 1 . 2]" 1
1342 1 83 LYS QG 1 84 THR HA . . 4.370 3.672 3.433 4.003 . 0 0 "[ . 1 . 2]" 1
1343 1 83 LYS QG 1 84 THR HB . . 4.370 4.021 3.619 4.423 0.053 12 0 "[ . 1 . 2]" 1
1344 1 84 THR H 1 84 THR HB . . 2.900 2.806 2.663 2.925 0.025 10 0 "[ . 1 . 2]" 1
1345 1 84 THR H 1 84 THR MG . . 3.720 2.127 1.987 2.263 . 0 0 "[ . 1 . 2]" 1
1346 1 84 THR H 1 85 PHE QB . . 4.540 3.945 3.774 4.119 . 0 0 "[ . 1 . 2]" 1
1347 1 84 THR HA 1 85 PHE H . . 3.530 2.880 2.753 3.072 . 0 0 "[ . 1 . 2]" 1
1348 1 84 THR HA 1 87 ALA H . . 4.710 4.010 3.525 4.841 0.131 5 0 "[ . 1 . 2]" 1
1349 1 84 THR HA 1 87 ALA MB . . 4.760 3.680 2.985 4.411 . 0 0 "[ . 1 . 2]" 1
1350 1 84 THR HA 1 88 ALA H . . 4.100 3.585 2.792 4.109 0.009 18 0 "[ . 1 . 2]" 1
1351 1 84 THR MG 1 85 PHE H . . 4.150 3.590 3.177 3.773 . 0 0 "[ . 1 . 2]" 1
1352 1 85 PHE H 1 85 PHE HB2 . . 3.360 2.591 2.294 2.988 . 0 0 "[ . 1 . 2]" 1
1353 1 85 PHE H 1 85 PHE QB . . 2.720 2.425 2.255 2.654 . 0 0 "[ . 1 . 2]" 1
1354 1 85 PHE H 1 85 PHE HB3 . . 3.360 3.051 2.733 3.473 0.113 3 0 "[ . 1 . 2]" 1
1355 1 85 PHE H 1 85 PHE HD1 . . 5.460 4.317 3.184 5.100 . 0 0 "[ . 1 . 2]" 1
1356 1 85 PHE H 1 85 PHE HD2 . . 5.500 5.179 4.784 5.388 . 0 0 "[ . 1 . 2]" 1
1357 1 85 PHE H 1 86 LEU H . . 3.100 2.128 1.878 2.387 . 0 0 "[ . 1 . 2]" 1
1358 1 85 PHE HA 1 85 PHE HD1 . . 4.120 2.908 2.352 3.668 . 0 0 "[ . 1 . 2]" 1
1359 1 85 PHE HA 1 85 PHE HD2 . . 4.360 3.810 3.289 4.187 . 0 0 "[ . 1 . 2]" 1
1360 1 85 PHE HA 1 88 ALA H . . 5.020 4.682 4.198 4.933 . 0 0 "[ . 1 . 2]" 1
1361 1 85 PHE HA 1 88 ALA MB . . 4.690 3.834 2.740 4.246 . 0 0 "[ . 1 . 2]" 1
1362 1 85 PHE QB 1 86 LEU H . . 3.170 2.510 2.243 2.683 . 0 0 "[ . 1 . 2]" 1
1363 1 85 PHE QB 1 87 ALA H . . 4.750 4.203 3.895 4.751 0.001 5 0 "[ . 1 . 2]" 1
1364 1 85 PHE HB2 1 86 LEU H . . 3.880 3.357 2.607 3.755 . 0 0 "[ . 1 . 2]" 1
1365 1 85 PHE HB2 1 87 ALA H . . 5.500 5.029 4.178 5.478 . 0 0 "[ . 1 . 2]" 1
1366 1 85 PHE HB3 1 86 LEU H . . 3.880 2.617 2.285 2.875 . 0 0 "[ . 1 . 2]" 1
1367 1 85 PHE HB3 1 87 ALA H . . 5.500 4.538 4.191 5.252 . 0 0 "[ . 1 . 2]" 1
1368 1 85 PHE HD1 1 86 LEU H . . 5.280 4.898 3.393 5.587 0.307 12 0 "[ . 1 . 2]" 1
1369 1 86 LEU H 1 86 LEU HB2 . . 3.830 3.559 2.668 3.766 . 0 0 "[ . 1 . 2]" 1
1370 1 86 LEU H 1 86 LEU QB . . 3.050 2.845 2.393 3.096 0.046 16 0 "[ . 1 . 2]" 1
1371 1 86 LEU H 1 86 LEU HB3 . . 3.830 3.035 2.515 3.601 . 0 0 "[ . 1 . 2]" 1
1372 1 86 LEU H 1 86 LEU MD1 . . 4.180 3.230 1.990 3.943 . 0 0 "[ . 1 . 2]" 1
1373 1 86 LEU H 1 87 ALA H . . 3.020 1.943 1.839 2.780 . 0 0 "[ . 1 . 2]" 1
1374 1 86 LEU H 1 87 ALA MB . . 5.300 3.678 3.535 4.356 . 0 0 "[ . 1 . 2]" 1
1375 1 86 LEU H 1 88 ALA H . . 3.530 3.525 3.441 3.564 0.034 20 0 "[ . 1 . 2]" 1
1376 1 86 LEU HA 1 86 LEU MD1 . . 3.970 3.507 3.328 3.750 . 0 0 "[ . 1 . 2]" 1
1377 1 86 LEU HA 1 97 ILE MD . . 4.690 2.640 1.891 3.638 . 0 0 "[ . 1 . 2]" 1
1378 1 86 LEU HA 1 97 ILE QG . . 4.460 3.082 1.926 4.081 . 0 0 "[ . 1 . 2]" 1
1379 1 86 LEU QB 1 87 ALA H . . 3.610 3.393 1.979 3.656 0.046 20 0 "[ . 1 . 2]" 1
1380 1 86 LEU HB2 1 87 ALA H . . 4.110 3.871 1.994 4.063 . 0 0 "[ . 1 . 2]" 1
1381 1 86 LEU HB3 1 87 ALA H . . 4.110 3.909 2.763 4.283 0.173 16 0 "[ . 1 . 2]" 1
1382 1 86 LEU MD1 1 87 ALA H . . 4.580 2.630 2.001 4.159 . 0 0 "[ . 1 . 2]" 1
1383 1 86 LEU MD1 1 97 ILE H . . 5.500 4.371 3.147 4.983 . 0 0 "[ . 1 . 2]" 1
1384 1 86 LEU MD2 1 97 ILE H . . 5.500 4.083 1.957 5.100 . 0 0 "[ . 1 . 2]" 1
1385 1 87 ALA H 1 87 ALA MB . . 3.130 2.194 2.078 2.385 . 0 0 "[ . 1 . 2]" 1
1386 1 87 ALA H 1 88 ALA H . . 3.180 2.496 2.261 2.707 . 0 0 "[ . 1 . 2]" 1
1387 1 87 ALA MB 1 88 ALA H . . 4.540 3.230 2.841 3.578 . 0 0 "[ . 1 . 2]" 1
1388 1 88 ALA H 1 88 ALA MB . . 3.130 2.297 2.039 2.451 . 0 0 "[ . 1 . 2]" 1
1389 1 88 ALA H 1 105 MET ME . . 4.840 3.989 3.479 4.564 . 0 0 "[ . 1 . 2]" 1
1390 1 88 ALA MB 1 105 MET ME . . 3.320 2.947 2.068 3.125 . 0 0 "[ . 1 . 2]" 1
1391 1 89 ALA H 1 89 ALA MB . . 2.400 2.099 2.025 2.275 . 0 0 "[ . 1 . 2]" 1
1392 1 89 ALA H 1 90 ASP H . . 3.280 3.055 2.188 3.253 . 0 0 "[ . 1 . 2]" 1
1393 1 89 ALA H 1 97 ILE MD . . 5.500 3.510 2.433 4.216 . 0 0 "[ . 1 . 2]" 1
1394 1 89 ALA H 1 105 MET ME . . 3.150 2.893 2.480 3.067 . 0 0 "[ . 1 . 2]" 1
1395 1 89 ALA HA 1 105 MET H . . 5.500 5.417 4.857 5.567 0.067 8 0 "[ . 1 . 2]" 1
1396 1 89 ALA HA 1 105 MET HB2 . . 4.300 3.202 2.605 3.552 . 0 0 "[ . 1 . 2]" 1
1397 1 89 ALA HA 1 105 MET ME . . 5.090 3.047 2.153 4.351 . 0 0 "[ . 1 . 2]" 1
1398 1 89 ALA MB 1 90 ASP H . . 4.390 2.217 1.919 3.552 . 0 0 "[ . 1 . 2]" 1
1399 1 89 ALA MB 1 97 ILE MD . . 4.180 2.038 1.778 2.647 . 0 0 "[ . 1 . 2]" 1
1400 1 89 ALA MB 1 101 GLU HB2 . . 5.270 2.868 2.112 3.399 . 0 0 "[ . 1 . 2]" 1
1401 1 89 ALA MB 1 101 GLU HB3 . . 4.270 2.025 1.892 2.445 . 0 0 "[ . 1 . 2]" 1
1402 1 89 ALA MB 1 101 GLU QG . . 5.280 3.286 2.413 3.884 . 0 0 "[ . 1 . 2]" 1
1403 1 89 ALA MB 1 102 PHE H . . 5.500 3.716 2.735 4.590 . 0 0 "[ . 1 . 2]" 1
1404 1 89 ALA MB 1 105 MET HB2 . . 4.460 3.035 1.912 3.962 . 0 0 "[ . 1 . 2]" 1
1405 1 89 ALA MB 1 105 MET ME . . 4.070 2.204 1.862 2.525 . 0 0 "[ . 1 . 2]" 1
1406 1 89 ALA MB 1 105 MET QG . . 5.340 4.322 3.522 4.936 . 0 0 "[ . 1 . 2]" 1
1407 1 90 ASP H 1 90 ASP QB . . 3.080 2.878 2.400 3.144 0.064 8 0 "[ . 1 . 2]" 1
1408 1 90 ASP H 1 91 HIS H . . 5.500 4.271 2.826 4.520 . 0 0 "[ . 1 . 2]" 1
1409 1 90 ASP H 1 97 ILE MD . . 5.000 3.483 2.529 4.354 . 0 0 "[ . 1 . 2]" 1
1410 1 90 ASP H 1 101 GLU HB3 . . 5.490 4.057 3.346 5.198 . 0 0 "[ . 1 . 2]" 1
1411 1 90 ASP HA 1 91 HIS H . . 3.340 2.574 2.307 2.799 . 0 0 "[ . 1 . 2]" 1
1412 1 90 ASP QB 1 91 HIS H . . 4.150 2.633 1.995 3.932 . 0 0 "[ . 1 . 2]" 1
1413 1 90 ASP HB2 1 91 HIS H . . 4.950 3.501 2.006 4.291 . 0 0 "[ . 1 . 2]" 1
1414 1 90 ASP HB3 1 91 HIS H . . 4.950 3.031 2.116 4.622 . 0 0 "[ . 1 . 2]" 1
1415 1 91 HIS H 1 92 ASP HB2 . . 5.500 4.584 3.603 4.966 . 0 0 "[ . 1 . 2]" 1
1416 1 91 HIS H 1 92 ASP HB3 . . 5.500 5.205 4.450 5.509 0.009 2 0 "[ . 1 . 2]" 1
1417 1 91 HIS HA 1 92 ASP H . . 3.360 2.776 2.297 3.395 0.035 8 0 "[ . 1 . 2]" 1
1418 1 91 HIS HB2 1 92 ASP H . . 5.190 4.284 3.412 4.655 . 0 0 "[ . 1 . 2]" 1
1419 1 91 HIS HB2 1 93 GLY H . . 5.500 5.094 4.044 5.525 0.025 14 0 "[ . 1 . 2]" 1
1420 1 91 HIS HB3 1 92 ASP H . . 5.190 4.429 3.706 4.660 . 0 0 "[ . 1 . 2]" 1
1421 1 91 HIS HB3 1 93 GLY H . . 5.500 5.200 4.329 5.530 0.030 2 0 "[ . 1 . 2]" 1
1422 1 92 ASP H 1 92 ASP HB2 . . 3.660 2.567 2.108 2.977 . 0 0 "[ . 1 . 2]" 1
1423 1 92 ASP H 1 92 ASP QB . . 3.070 2.244 2.087 2.515 . 0 0 "[ . 1 . 2]" 1
1424 1 92 ASP H 1 92 ASP HB3 . . 3.660 2.572 2.292 3.350 . 0 0 "[ . 1 . 2]" 1
1425 1 92 ASP H 1 93 GLY H . . 3.700 2.645 1.966 2.828 . 0 0 "[ . 1 . 2]" 1
1426 1 92 ASP H 1 95 GLY H . . 5.500 4.118 3.536 4.910 . 0 0 "[ . 1 . 2]" 1
1427 1 92 ASP H 1 95 GLY QA . . 5.210 4.384 3.801 5.187 . 0 0 "[ . 1 . 2]" 1
1428 1 92 ASP H 1 101 GLU QG . . 5.240 4.559 2.584 5.245 0.005 13 0 "[ . 1 . 2]" 1
1429 1 92 ASP QB 1 93 GLY H . . 3.380 2.796 2.594 3.397 0.017 2 0 "[ . 1 . 2]" 1
1430 1 93 GLY H 1 94 ASP H . . 3.950 2.658 2.264 3.082 . 0 0 "[ . 1 . 2]" 1
1431 1 93 GLY H 1 94 ASP QB . . 5.340 4.866 4.608 5.163 . 0 0 "[ . 1 . 2]" 1
1432 1 93 GLY H 1 95 GLY H . . 3.760 2.810 2.536 3.102 . 0 0 "[ . 1 . 2]" 1
1433 1 93 GLY H 1 96 LYS H . . 4.300 4.089 3.750 4.307 0.007 4 0 "[ . 1 . 2]" 1
1434 1 94 ASP H 1 94 ASP HB2 . . 3.470 2.883 2.426 3.253 . 0 0 "[ . 1 . 2]" 1
1435 1 94 ASP H 1 94 ASP QB . . 2.970 2.630 2.377 2.787 . 0 0 "[ . 1 . 2]" 1
1436 1 94 ASP H 1 94 ASP HB3 . . 3.470 3.165 2.794 3.445 . 0 0 "[ . 1 . 2]" 1
1437 1 94 ASP H 1 95 GLY H . . 3.270 2.083 1.889 2.228 . 0 0 "[ . 1 . 2]" 1
1438 1 94 ASP H 1 95 GLY HA2 . . 4.660 4.324 4.173 4.596 . 0 0 "[ . 1 . 2]" 1
1439 1 94 ASP H 1 95 GLY QA . . 4.060 3.963 3.837 4.063 0.003 17 0 "[ . 1 . 2]" 1
1440 1 94 ASP H 1 95 GLY HA3 . . 4.660 4.610 4.480 4.672 0.012 14 0 "[ . 1 . 2]" 1
1441 1 94 ASP H 1 96 LYS H . . 4.010 2.690 2.569 3.024 . 0 0 "[ . 1 . 2]" 1
1442 1 94 ASP H 1 96 LYS HA . . 5.500 5.428 5.160 5.536 0.036 13 0 "[ . 1 . 2]" 1
1443 1 94 ASP H 1 96 LYS HD2 . . 5.500 4.508 2.953 5.487 . 0 0 "[ . 1 . 2]" 1
1444 1 94 ASP H 1 96 LYS HD3 . . 5.500 3.987 1.983 5.509 0.009 12 0 "[ . 1 . 2]" 1
1445 1 94 ASP H 1 96 LYS HG2 . . 5.500 3.739 2.505 5.519 0.019 18 0 "[ . 1 . 2]" 1
1446 1 94 ASP H 1 96 LYS HG3 . . 5.500 4.205 2.647 5.497 . 0 0 "[ . 1 . 2]" 1
1447 1 94 ASP HA 1 96 LYS H . . 5.100 4.612 4.307 5.055 . 0 0 "[ . 1 . 2]" 1
1448 1 94 ASP QB 1 95 GLY H . . 4.000 3.664 3.227 3.800 . 0 0 "[ . 1 . 2]" 1
1449 1 94 ASP QB 1 96 LYS H . . 3.850 3.659 3.235 3.873 0.023 12 0 "[ . 1 . 2]" 1
1450 1 94 ASP QB 1 96 LYS QD . . 5.180 3.176 1.936 5.166 . 0 0 "[ . 1 . 2]" 1
1451 1 94 ASP QB 1 96 LYS QG . . 5.180 3.414 2.184 4.595 . 0 0 "[ . 1 . 2]" 1
1452 1 94 ASP HB2 1 95 GLY H . . 4.680 4.291 3.566 4.522 . 0 0 "[ . 1 . 2]" 1
1453 1 94 ASP HB3 1 95 GLY H . . 4.680 3.993 3.543 4.141 . 0 0 "[ . 1 . 2]" 1
1454 1 95 GLY H 1 96 LYS H . . 3.400 2.360 1.921 2.627 . 0 0 "[ . 1 . 2]" 1
1455 1 96 LYS H 1 96 LYS QB . . 3.550 2.646 2.155 3.260 . 0 0 "[ . 1 . 2]" 1
1456 1 96 LYS H 1 96 LYS HD2 . . 5.500 3.983 1.919 4.815 . 0 0 "[ . 1 . 2]" 1
1457 1 96 LYS H 1 96 LYS QD . . 4.770 3.251 1.909 4.284 . 0 0 "[ . 1 . 2]" 1
1458 1 96 LYS H 1 96 LYS HD3 . . 5.500 3.681 2.038 5.089 . 0 0 "[ . 1 . 2]" 1
1459 1 96 LYS H 1 96 LYS QE . . 4.360 3.862 3.014 4.370 0.010 20 0 "[ . 1 . 2]" 1
1460 1 96 LYS H 1 96 LYS HG2 . . 4.350 2.781 1.943 4.159 . 0 0 "[ . 1 . 2]" 1
1461 1 96 LYS H 1 96 LYS QG . . 3.740 2.340 1.924 3.583 . 0 0 "[ . 1 . 2]" 1
1462 1 96 LYS H 1 96 LYS HG3 . . 4.350 3.102 1.946 4.224 . 0 0 "[ . 1 . 2]" 1
1463 1 96 LYS H 1 97 ILE H . . 5.470 4.390 4.064 4.599 . 0 0 "[ . 1 . 2]" 1
1464 1 96 LYS HA 1 97 ILE H . . 3.120 2.196 2.141 2.455 . 0 0 "[ . 1 . 2]" 1
1465 1 96 LYS QB 1 97 ILE H . . 4.090 3.252 2.291 3.835 . 0 0 "[ . 1 . 2]" 1
1466 1 96 LYS QE 1 96 LYS QG . . 3.210 2.261 2.080 2.820 . 0 0 "[ . 1 . 2]" 1
1467 1 97 ILE H 1 97 ILE HB . . 3.380 2.647 2.479 2.859 . 0 0 "[ . 1 . 2]" 1
1468 1 97 ILE H 1 97 ILE MD . . 4.750 3.150 2.809 3.799 . 0 0 "[ . 1 . 2]" 1
1469 1 97 ILE H 1 97 ILE QG . . 2.770 2.103 1.916 2.731 . 0 0 "[ . 1 . 2]" 1
1470 1 97 ILE HA 1 98 GLY H . . 3.010 2.275 2.242 2.368 . 0 0 "[ . 1 . 2]" 1
1471 1 97 ILE HB 1 98 GLY H . . 4.930 3.731 3.400 3.936 . 0 0 "[ . 1 . 2]" 1
1472 1 97 ILE MD 1 97 ILE MG . . 3.730 2.048 1.923 2.213 . 0 0 "[ . 1 . 2]" 1
1473 1 97 ILE MD 1 98 GLY H . . 5.400 3.841 3.454 4.860 . 0 0 "[ . 1 . 2]" 1
1474 1 97 ILE MD 1 101 GLU H . . 5.500 4.223 3.805 5.137 . 0 0 "[ . 1 . 2]" 1
1475 1 97 ILE MD 1 102 PHE H . . 4.500 3.280 2.617 4.158 . 0 0 "[ . 1 . 2]" 1
1476 1 97 ILE QG 1 102 PHE HB2 . . 4.800 3.629 2.582 4.739 . 0 0 "[ . 1 . 2]" 1
1477 1 97 ILE HG12 1 98 GLY H . . 5.200 4.921 4.153 5.116 . 0 0 "[ . 1 . 2]" 1
1478 1 97 ILE HG13 1 98 GLY H . . 5.200 5.075 4.896 5.200 0.000 18 0 "[ . 1 . 2]" 1
1479 1 97 ILE MG 1 98 GLY H . . 4.040 2.010 1.880 2.207 . 0 0 "[ . 1 . 2]" 1
1480 1 97 ILE MG 1 98 GLY QA . . 5.340 3.392 3.221 3.525 . 0 0 "[ . 1 . 2]" 1
1481 1 97 ILE MG 1 101 GLU H . . 5.500 2.722 2.336 3.278 . 0 0 "[ . 1 . 2]" 1
1482 1 97 ILE MG 1 101 GLU HB2 . . 4.000 2.154 1.904 2.551 . 0 0 "[ . 1 . 2]" 1
1483 1 97 ILE MG 1 101 GLU HB3 . . 5.310 3.548 3.128 4.111 . 0 0 "[ . 1 . 2]" 1
1484 1 97 ILE MG 1 101 GLU QG . . 5.340 3.336 2.246 4.133 . 0 0 "[ . 1 . 2]" 1
1485 1 97 ILE MG 1 102 PHE H . . 3.580 2.044 1.863 2.469 . 0 0 "[ . 1 . 2]" 1
1486 1 97 ILE MG 1 102 PHE HA . . 5.170 3.526 2.688 4.102 . 0 0 "[ . 1 . 2]" 1
1487 1 97 ILE MG 1 102 PHE HB2 . . 4.100 2.005 1.889 2.234 . 0 0 "[ . 1 . 2]" 1
1488 1 97 ILE MG 1 103 GLN H . . 5.500 4.052 3.606 4.517 . 0 0 "[ . 1 . 2]" 1
1489 1 97 ILE MG 1 103 GLN QE . . 5.340 3.383 2.658 4.189 . 0 0 "[ . 1 . 2]" 1
1490 1 98 GLY H 1 99 ALA H . . 4.310 2.867 2.506 3.067 . 0 0 "[ . 1 . 2]" 1
1491 1 98 GLY H 1 100 GLU H . . 4.410 2.940 2.633 3.370 . 0 0 "[ . 1 . 2]" 1
1492 1 98 GLY H 1 100 GLU QG . . 5.340 4.004 2.363 5.022 . 0 0 "[ . 1 . 2]" 1
1493 1 98 GLY H 1 101 GLU H . . 4.220 2.936 2.684 3.502 . 0 0 "[ . 1 . 2]" 1
1494 1 98 GLY H 1 101 GLU HB2 . . 3.660 3.424 2.914 3.685 0.025 17 0 "[ . 1 . 2]" 1
1495 1 98 GLY H 1 101 GLU HB3 . . 5.380 5.049 4.658 5.390 0.010 6 0 "[ . 1 . 2]" 1
1496 1 98 GLY H 1 101 GLU QG . . 4.020 3.367 2.333 4.083 0.063 17 0 "[ . 1 . 2]" 1
1497 1 98 GLY QA 1 99 ALA H . . 2.880 2.535 2.218 2.807 . 0 0 "[ . 1 . 2]" 1
1498 1 98 GLY QA 1 99 ALA HA . . 5.340 4.368 4.030 4.531 . 0 0 "[ . 1 . 2]" 1
1499 1 98 GLY QA 1 99 ALA MB . . 5.340 3.535 3.488 3.601 . 0 0 "[ . 1 . 2]" 1
1500 1 98 GLY QA 1 100 GLU H . . 4.300 3.864 3.581 4.210 . 0 0 "[ . 1 . 2]" 1
1501 1 98 GLY QA 1 101 GLU QG . . 5.180 4.751 4.018 5.205 0.025 7 0 "[ . 1 . 2]" 1
1502 1 98 GLY QA 1 103 GLN QE . . 5.180 5.218 5.185 5.256 0.076 8 0 "[ . 1 . 2]" 1
1503 1 98 GLY HA2 1 100 GLU H . . 5.100 4.572 4.280 4.962 . 0 0 "[ . 1 . 2]" 1
1504 1 98 GLY HA3 1 100 GLU H . . 5.100 4.197 3.748 4.720 . 0 0 "[ . 1 . 2]" 1
1505 1 99 ALA H 1 100 GLU H . . 5.490 2.698 1.878 2.913 . 0 0 "[ . 1 . 2]" 1
1506 1 99 ALA H 1 102 PHE HB2 . . 5.500 4.927 4.283 5.519 0.019 6 0 "[ . 1 . 2]" 1
1507 1 99 ALA H 1 102 PHE HB3 . . 5.500 5.192 4.521 5.585 0.085 9 0 "[ . 1 . 2]" 1
1508 1 99 ALA H 1 103 GLN QE . . 4.580 3.548 3.323 4.209 . 0 0 "[ . 1 . 2]" 1
1509 1 99 ALA HA 1 102 PHE H . . 5.060 4.586 3.791 4.859 . 0 0 "[ . 1 . 2]" 1
1510 1 99 ALA HA 1 102 PHE HB3 . . 4.500 4.239 3.371 4.522 0.022 14 0 "[ . 1 . 2]" 1
1511 1 99 ALA HA 1 103 GLN H . . 4.860 4.402 4.035 4.860 . 0 0 "[ . 1 . 2]" 1
1512 1 99 ALA HA 1 103 GLN HE21 . . 4.500 2.894 2.696 3.525 . 0 0 "[ . 1 . 2]" 1
1513 1 99 ALA HA 1 103 GLN QE . . 3.850 1.949 1.903 2.066 . 0 0 "[ . 1 . 2]" 1
1514 1 99 ALA HA 1 103 GLN HE22 . . 4.500 1.984 1.932 2.091 . 0 0 "[ . 1 . 2]" 1
1515 1 99 ALA MB 1 100 GLU H . . 4.630 3.649 3.480 3.716 . 0 0 "[ . 1 . 2]" 1
1516 1 99 ALA MB 1 100 GLU HA . . 5.500 4.275 4.132 4.379 . 0 0 "[ . 1 . 2]" 1
1517 1 99 ALA MB 1 103 GLN QE . . 5.010 3.265 2.986 3.416 . 0 0 "[ . 1 . 2]" 1
1518 1 100 GLU H 1 100 GLU QB . . 3.190 2.920 2.625 3.283 0.093 2 0 "[ . 1 . 2]" 1
1519 1 100 GLU H 1 100 GLU QG . . 3.380 2.870 2.151 3.391 0.011 7 0 "[ . 1 . 2]" 1
1520 1 100 GLU H 1 101 GLU H . . 3.570 1.908 1.811 2.377 . 0 0 "[ . 1 . 2]" 1
1521 1 100 GLU H 1 102 PHE HB2 . . 5.500 4.696 4.027 5.422 . 0 0 "[ . 1 . 2]" 1
1522 1 100 GLU H 1 102 PHE HB3 . . 5.500 4.728 3.907 5.294 . 0 0 "[ . 1 . 2]" 1
1523 1 100 GLU HA 1 103 GLN H . . 4.600 3.960 3.525 4.325 . 0 0 "[ . 1 . 2]" 1
1524 1 100 GLU HA 1 103 GLN QB . . 3.560 2.910 2.510 3.540 . 0 0 "[ . 1 . 2]" 1
1525 1 100 GLU HA 1 103 GLN QE . . 3.250 2.703 2.327 3.201 . 0 0 "[ . 1 . 2]" 1
1526 1 100 GLU HA 1 103 GLN QG . . 4.260 3.885 3.356 4.290 0.030 13 0 "[ . 1 . 2]" 1
1527 1 100 GLU HA 1 104 GLU H . . 5.050 4.330 3.640 5.052 0.002 9 0 "[ . 1 . 2]" 1
1528 1 100 GLU QB 1 101 GLU H . . 3.900 2.951 2.176 3.744 . 0 0 "[ . 1 . 2]" 1
1529 1 100 GLU QB 1 101 GLU QG . . 4.520 3.596 2.932 4.415 . 0 0 "[ . 1 . 2]" 1
1530 1 100 GLU HB2 1 101 GLU H . . 4.750 3.134 2.233 4.120 . 0 0 "[ . 1 . 2]" 1
1531 1 100 GLU HB3 1 101 GLU H . . 4.750 3.724 3.003 4.299 . 0 0 "[ . 1 . 2]" 1
1532 1 101 GLU H 1 101 GLU HB2 . . 4.060 2.487 2.232 2.720 . 0 0 "[ . 1 . 2]" 1
1533 1 101 GLU H 1 101 GLU HB3 . . 3.920 3.599 3.524 3.694 . 0 0 "[ . 1 . 2]" 1
1534 1 101 GLU H 1 101 GLU QG . . 2.750 2.446 2.038 2.786 0.036 13 0 "[ . 1 . 2]" 1
1535 1 101 GLU H 1 102 PHE H . . 3.510 2.613 1.988 2.904 . 0 0 "[ . 1 . 2]" 1
1536 1 101 GLU HA 1 101 GLU HG2 . . 4.080 2.935 2.431 3.565 . 0 0 "[ . 1 . 2]" 1
1537 1 101 GLU HA 1 101 GLU QG . . 3.400 2.670 2.295 3.222 . 0 0 "[ . 1 . 2]" 1
1538 1 101 GLU HA 1 101 GLU HG3 . . 4.080 3.291 2.344 3.846 . 0 0 "[ . 1 . 2]" 1
1539 1 101 GLU HB2 1 102 PHE H . . 2.960 2.398 2.123 2.944 . 0 0 "[ . 1 . 2]" 1
1540 1 101 GLU HB2 1 102 PHE HB2 . . 4.920 4.102 3.877 4.375 . 0 0 "[ . 1 . 2]" 1
1541 1 101 GLU HB2 1 103 GLN H . . 5.320 4.846 4.486 5.220 . 0 0 "[ . 1 . 2]" 1
1542 1 101 GLU HB2 1 103 GLN QE . . 5.340 5.004 4.736 5.407 0.067 13 0 "[ . 1 . 2]" 1
1543 1 101 GLU HB3 1 102 PHE H . . 4.540 3.411 2.878 3.873 . 0 0 "[ . 1 . 2]" 1
1544 1 101 GLU HB3 1 102 PHE HB2 . . 5.500 5.098 4.543 5.527 0.027 9 0 "[ . 1 . 2]" 1
1545 1 101 GLU QG 1 102 PHE H . . 4.520 3.957 3.584 4.360 . 0 0 "[ . 1 . 2]" 1
1546 1 102 PHE H 1 102 PHE HB2 . . 2.500 2.257 2.090 2.510 0.010 7 0 "[ . 1 . 2]" 1
1547 1 102 PHE H 1 103 GLN H . . 3.570 2.760 2.321 2.963 . 0 0 "[ . 1 . 2]" 1
1548 1 102 PHE H 1 103 GLN QE . . 4.180 3.234 2.837 3.452 . 0 0 "[ . 1 . 2]" 1
1549 1 102 PHE H 1 104 GLU H . . 4.840 4.495 3.947 4.853 0.013 9 0 "[ . 1 . 2]" 1
1550 1 102 PHE H 1 105 MET H . . 5.160 4.802 4.556 4.941 . 0 0 "[ . 1 . 2]" 1
1551 1 102 PHE H 1 105 MET ME . . 5.500 4.368 3.988 4.730 . 0 0 "[ . 1 . 2]" 1
1552 1 102 PHE HA 1 105 MET H . . 4.040 3.505 3.149 3.848 . 0 0 "[ . 1 . 2]" 1
1553 1 102 PHE HA 1 105 MET HB3 . . 4.130 2.532 2.253 2.872 . 0 0 "[ . 1 . 2]" 1
1554 1 102 PHE HA 1 105 MET QG . . 4.930 4.164 3.698 4.617 . 0 0 "[ . 1 . 2]" 1
1555 1 102 PHE HA 1 106 VAL H . . 4.870 4.592 4.066 4.879 0.009 9 0 "[ . 1 . 2]" 1
1556 1 102 PHE HA 1 106 VAL MG2 . . 4.860 4.149 3.914 4.382 . 0 0 "[ . 1 . 2]" 1
1557 1 102 PHE HB2 1 105 MET HB3 . . 5.500 5.076 4.665 5.543 0.043 19 0 "[ . 1 . 2]" 1
1558 1 102 PHE HB3 1 103 GLN H . . 3.160 2.721 2.256 3.147 . 0 0 "[ . 1 . 2]" 1
1559 1 102 PHE HB3 1 103 GLN QE . . 4.760 2.559 2.233 2.794 . 0 0 "[ . 1 . 2]" 1
1560 1 102 PHE HB3 1 104 GLU H . . 5.500 5.274 4.684 5.593 0.093 8 0 "[ . 1 . 2]" 1
1561 1 102 PHE HB3 1 105 MET HB3 . . 5.500 5.006 4.688 5.407 . 0 0 "[ . 1 . 2]" 1
1562 1 103 GLN H 1 103 GLN QB . . 2.730 2.246 2.127 2.337 . 0 0 "[ . 1 . 2]" 1
1563 1 103 GLN H 1 103 GLN QE . . 4.220 2.025 1.869 2.195 . 0 0 "[ . 1 . 2]" 1
1564 1 103 GLN H 1 103 GLN HG2 . . 4.660 3.857 3.649 4.184 . 0 0 "[ . 1 . 2]" 1
1565 1 103 GLN H 1 103 GLN QG . . 4.000 3.430 3.275 3.637 . 0 0 "[ . 1 . 2]" 1
1566 1 103 GLN H 1 103 GLN HG3 . . 4.660 3.862 3.421 4.124 . 0 0 "[ . 1 . 2]" 1
1567 1 103 GLN HA 1 103 GLN QE . . 4.850 3.604 2.968 3.801 . 0 0 "[ . 1 . 2]" 1
1568 1 103 GLN HA 1 105 MET H . . 5.500 4.165 3.777 4.736 . 0 0 "[ . 1 . 2]" 1
1569 1 103 GLN HA 1 106 VAL H . . 4.070 3.700 3.470 3.902 . 0 0 "[ . 1 . 2]" 1
1570 1 103 GLN HA 1 106 VAL HB . . 4.180 3.620 3.279 4.006 . 0 0 "[ . 1 . 2]" 1
1571 1 103 GLN HA 1 106 VAL MG2 . . 5.500 3.331 2.355 4.054 . 0 0 "[ . 1 . 2]" 1
1572 1 103 GLN HA 1 107 GLN H . . 4.860 4.126 3.207 4.753 . 0 0 "[ . 1 . 2]" 1
1573 1 103 GLN HA 1 107 GLN QG . . 4.440 3.700 2.371 4.459 0.019 16 0 "[ . 1 . 2]" 1
1574 1 103 GLN QB 1 103 GLN QE . . 2.760 2.109 1.924 2.786 0.026 2 0 "[ . 1 . 2]" 1
1575 1 103 GLN QG 1 106 VAL HB . . 5.340 5.268 4.844 5.421 0.081 16 0 "[ . 1 . 2]" 1
1576 1 104 GLU H 1 104 GLU HA . . 2.940 2.812 2.761 2.879 . 0 0 "[ . 1 . 2]" 1
1577 1 104 GLU H 1 104 GLU QB . . 2.540 2.321 2.191 2.567 0.027 2 0 "[ . 1 . 2]" 1
1578 1 104 GLU H 1 104 GLU HG2 . . 4.100 2.928 2.046 3.914 . 0 0 "[ . 1 . 2]" 1
1579 1 104 GLU H 1 104 GLU QG . . 3.420 2.518 2.017 2.890 . 0 0 "[ . 1 . 2]" 1
1580 1 104 GLU H 1 104 GLU HG3 . . 4.100 3.322 2.394 4.130 0.030 8 0 "[ . 1 . 2]" 1
1581 1 104 GLU H 1 105 MET HA . . 5.500 5.208 4.993 5.412 . 0 0 "[ . 1 . 2]" 1
1582 1 104 GLU HA 1 104 GLU HG2 . . 3.730 2.962 2.230 3.769 0.039 2 0 "[ . 1 . 2]" 1
1583 1 104 GLU HA 1 104 GLU HG3 . . 3.730 3.450 2.727 3.779 0.049 18 0 "[ . 1 . 2]" 1
1584 1 104 GLU HA 1 107 GLN H . . 4.650 3.587 3.196 4.290 . 0 0 "[ . 1 . 2]" 1
1585 1 104 GLU HA 1 107 GLN QG . . 5.340 3.276 2.056 4.445 . 0 0 "[ . 1 . 2]" 1
1586 1 104 GLU HB2 1 105 MET H . . 5.500 3.335 2.458 4.317 . 0 0 "[ . 1 . 2]" 1
1587 1 104 GLU HB3 1 105 MET H . . 5.500 3.753 3.118 4.131 . 0 0 "[ . 1 . 2]" 1
1588 1 104 GLU QG 1 105 MET H . . 5.340 3.638 2.242 4.495 . 0 0 "[ . 1 . 2]" 1
1589 1 105 MET H 1 105 MET HB3 . . 2.510 2.336 2.222 2.462 . 0 0 "[ . 1 . 2]" 1
1590 1 105 MET H 1 105 MET ME . . 4.810 4.046 3.702 4.339 . 0 0 "[ . 1 . 2]" 1
1591 1 105 MET H 1 105 MET HG2 . . 4.620 4.315 4.125 4.394 . 0 0 "[ . 1 . 2]" 1
1592 1 105 MET H 1 105 MET QG . . 4.040 3.909 3.795 3.971 . 0 0 "[ . 1 . 2]" 1
1593 1 105 MET H 1 105 MET HG3 . . 4.620 4.474 4.403 4.601 . 0 0 "[ . 1 . 2]" 1
1594 1 105 MET H 1 106 VAL H . . 2.980 2.658 2.284 2.964 . 0 0 "[ . 1 . 2]" 1
1595 1 105 MET H 1 106 VAL HA . . 5.500 5.273 4.998 5.449 . 0 0 "[ . 1 . 2]" 1
1596 1 105 MET H 1 106 VAL MG2 . . 5.100 4.058 3.852 4.291 . 0 0 "[ . 1 . 2]" 1
1597 1 105 MET H 1 107 GLN QG . . 5.340 5.056 4.440 5.405 0.065 14 0 "[ . 1 . 2]" 1
1598 1 105 MET HA 1 105 MET QG . . 3.350 2.592 2.507 2.740 . 0 0 "[ . 1 . 2]" 1
1599 1 105 MET HA 1 106 VAL MG2 . . 5.500 4.756 4.400 4.892 . 0 0 "[ . 1 . 2]" 1
1600 1 105 MET HB3 1 106 VAL H . . 3.120 2.796 2.044 3.123 0.003 10 0 "[ . 1 . 2]" 1
1601 1 105 MET HB3 1 106 VAL MG2 . . 4.230 3.214 2.965 3.549 . 0 0 "[ . 1 . 2]" 1
1602 1 105 MET ME 1 106 VAL H . . 5.500 4.701 4.236 5.027 . 0 0 "[ . 1 . 2]" 1
1603 1 105 MET ME 1 106 VAL MG2 . . 5.500 3.977 3.469 4.294 . 0 0 "[ . 1 . 2]" 1
1604 1 105 MET QG 1 106 VAL H . . 4.180 3.426 3.002 3.724 . 0 0 "[ . 1 . 2]" 1
1605 1 105 MET QG 1 106 VAL MG2 . . 4.820 3.000 2.404 3.353 . 0 0 "[ . 1 . 2]" 1
1606 1 105 MET QG 1 107 GLN H . . 5.340 5.365 4.911 5.575 0.235 8 0 "[ . 1 . 2]" 1
1607 1 105 MET HG2 1 106 VAL MG2 . . 5.500 3.067 2.447 3.428 . 0 0 "[ . 1 . 2]" 1
1608 1 105 MET HG3 1 106 VAL MG2 . . 5.500 4.273 3.531 4.752 . 0 0 "[ . 1 . 2]" 1
1609 1 106 VAL H 1 106 VAL HB . . 3.080 2.601 2.509 2.729 . 0 0 "[ . 1 . 2]" 1
1610 1 106 VAL H 1 106 VAL MG2 . . 3.040 2.295 1.988 2.719 . 0 0 "[ . 1 . 2]" 1
1611 1 106 VAL H 1 107 GLN QG . . 5.140 4.069 3.522 4.659 . 0 0 "[ . 1 . 2]" 1
1612 1 106 VAL HA 1 106 VAL MG1 . . 3.550 2.372 2.269 2.427 . 0 0 "[ . 1 . 2]" 1
1613 1 106 VAL HA 1 106 VAL MG2 . . 3.410 2.367 2.280 2.468 . 0 0 "[ . 1 . 2]" 1
1614 1 106 VAL HA 1 108 SER H . . 4.500 4.137 3.740 4.507 0.007 13 0 "[ . 1 . 2]" 1
1615 1 106 VAL HB 1 107 GLN H . . 3.200 2.363 1.957 2.723 . 0 0 "[ . 1 . 2]" 1
1616 1 106 VAL HB 1 107 GLN QB . . 4.940 4.496 3.823 4.736 . 0 0 "[ . 1 . 2]" 1
1617 1 106 VAL HB 1 107 GLN QG . . 4.110 3.445 2.825 3.823 . 0 0 "[ . 1 . 2]" 1
1618 1 106 VAL HB 1 108 SER H . . 5.080 4.720 4.295 4.968 . 0 0 "[ . 1 . 2]" 1
1619 1 106 VAL MG1 1 107 GLN H . . 4.340 3.394 3.048 3.745 . 0 0 "[ . 1 . 2]" 1
1620 1 106 VAL MG1 1 107 GLN HA . . 4.910 3.571 3.218 3.910 . 0 0 "[ . 1 . 2]" 1
1621 1 106 VAL MG1 1 108 SER H . . 5.450 4.777 4.568 4.996 . 0 0 "[ . 1 . 2]" 1
1622 1 106 VAL MG2 1 107 GLN H . . 4.320 3.653 3.506 3.810 . 0 0 "[ . 1 . 2]" 1
1623 1 107 GLN H 1 107 GLN HB2 . . 3.700 2.669 2.305 3.588 . 0 0 "[ . 1 . 2]" 1
1624 1 107 GLN H 1 107 GLN QB . . 3.070 2.522 2.278 2.647 . 0 0 "[ . 1 . 2]" 1
1625 1 107 GLN H 1 107 GLN HB3 . . 3.700 3.497 2.643 3.652 . 0 0 "[ . 1 . 2]" 1
1626 1 107 GLN H 1 107 GLN QE . . 4.350 3.339 2.148 4.450 0.100 14 0 "[ . 1 . 2]" 1
1627 1 107 GLN H 1 107 GLN QG . . 2.910 2.211 1.913 2.551 . 0 0 "[ . 1 . 2]" 1
1628 1 107 GLN HA 1 107 GLN QE . . 4.170 3.258 2.310 4.278 0.108 9 0 "[ . 1 . 2]" 1
1629 1 107 GLN HA 1 107 GLN HG2 . . 4.130 3.334 2.716 3.898 . 0 0 "[ . 1 . 2]" 1
1630 1 107 GLN HA 1 107 GLN QG . . 3.350 3.055 2.461 3.335 . 0 0 "[ . 1 . 2]" 1
1631 1 107 GLN HA 1 107 GLN HG3 . . 4.130 3.577 2.815 3.751 . 0 0 "[ . 1 . 2]" 1
1632 1 107 GLN QB 1 108 SER H . . 3.530 2.857 2.485 3.530 . 0 0 "[ . 1 . 2]" 1
1633 1 107 GLN HB2 1 108 SER H . . 4.260 2.953 2.539 3.852 . 0 0 "[ . 1 . 2]" 1
1634 1 107 GLN HB3 1 108 SER H . . 4.260 3.893 3.534 4.384 0.124 5 0 "[ . 1 . 2]" 1
1635 1 107 GLN QE 1 108 SER H . . 5.340 5.157 4.437 5.399 0.059 13 0 "[ . 1 . 2]" 1
1636 1 107 GLN QG 1 108 SER H . . 4.430 3.933 2.081 4.459 0.029 5 0 "[ . 1 . 2]" 1
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