NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
403695 |
1wmj   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wmj
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 3300
_Distance_constraint_stats_list.Viol_count 4175
_Distance_constraint_stats_list.Viol_total 3562.413
_Distance_constraint_stats_list.Viol_max 0.549
_Distance_constraint_stats_list.Viol_rms 0.0167
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0027
_Distance_constraint_stats_list.Viol_average_violations_only 0.0427
_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 9 MET 0.133 0.060 20 0 "[ . 1 . 2]"
1 10 ALA 1.671 0.182 14 0 "[ . 1 . 2]"
1 11 ALA 2.489 0.352 12 0 "[ . 1 . 2]"
1 12 GLU 1.814 0.352 12 0 "[ . 1 . 2]"
1 13 GLU 1.097 0.072 17 0 "[ . 1 . 2]"
1 14 GLY 0.911 0.058 13 0 "[ . 1 . 2]"
1 15 VAL 1.916 0.074 10 0 "[ . 1 . 2]"
1 16 VAL 15.898 0.410 15 0 "[ . 1 . 2]"
1 17 ILE 2.934 0.203 8 0 "[ . 1 . 2]"
1 18 ALA 0.212 0.062 15 0 "[ . 1 . 2]"
1 19 CYS 0.613 0.104 17 0 "[ . 1 . 2]"
1 20 HIS 0.067 0.067 10 0 "[ . 1 . 2]"
1 21 ASN 1.251 0.116 3 0 "[ . 1 . 2]"
1 22 LYS 2.890 0.128 9 0 "[ . 1 . 2]"
1 23 ASP 0.369 0.091 15 0 "[ . 1 . 2]"
1 24 GLU 0.682 0.104 17 0 "[ . 1 . 2]"
1 25 PHE 3.868 0.130 15 0 "[ . 1 . 2]"
1 26 ASP 0.922 0.065 6 0 "[ . 1 . 2]"
1 27 ALA 0.528 0.090 13 0 "[ . 1 . 2]"
1 28 GLN 1.853 0.097 13 0 "[ . 1 . 2]"
1 29 MET 2.637 0.117 3 0 "[ . 1 . 2]"
1 30 THR 2.200 0.097 13 0 "[ . 1 . 2]"
1 31 LYS 1.592 0.232 9 0 "[ . 1 . 2]"
1 32 ALA 1.800 0.135 12 0 "[ . 1 . 2]"
1 33 LYS 1.668 0.097 17 0 "[ . 1 . 2]"
1 34 GLU 0.860 0.097 17 0 "[ . 1 . 2]"
1 35 ALA 0.463 0.052 17 0 "[ . 1 . 2]"
1 36 GLY 0.663 0.064 17 0 "[ . 1 . 2]"
1 37 LYS 4.240 0.115 16 0 "[ . 1 . 2]"
1 38 VAL 2.416 0.135 12 0 "[ . 1 . 2]"
1 39 VAL 1.468 0.119 17 0 "[ . 1 . 2]"
1 40 ILE 5.454 0.148 17 0 "[ . 1 . 2]"
1 41 ILE 6.051 0.166 10 0 "[ . 1 . 2]"
1 42 ASP 4.070 0.152 10 0 "[ . 1 . 2]"
1 43 PHE 2.788 0.162 11 0 "[ . 1 . 2]"
1 44 THR 3.692 0.200 7 0 "[ . 1 . 2]"
1 45 ALA 1.555 0.226 20 0 "[ . 1 . 2]"
1 46 SER 0.707 0.329 18 0 "[ . 1 . 2]"
1 47 TRP 1.878 0.383 6 0 "[ . 1 . 2]"
1 48 CYS 1.805 0.383 6 0 "[ . 1 . 2]"
1 50 PRO 0.180 0.065 18 0 "[ . 1 . 2]"
1 51 CYS 0.391 0.060 6 0 "[ . 1 . 2]"
1 52 ARG 1.082 0.549 4 1 "[ +. 1 . 2]"
1 53 PHE 1.684 0.549 4 1 "[ +. 1 . 2]"
1 54 ILE 2.636 0.085 13 0 "[ . 1 . 2]"
1 55 ALA 1.409 0.062 3 0 "[ . 1 . 2]"
1 56 PRO 2.191 0.064 16 0 "[ . 1 . 2]"
1 57 VAL 5.002 0.198 13 0 "[ . 1 . 2]"
1 58 PHE 6.373 0.261 17 0 "[ . 1 . 2]"
1 59 ALA 8.504 0.410 15 0 "[ . 1 . 2]"
1 60 GLU 3.246 0.132 16 0 "[ . 1 . 2]"
1 61 TYR 2.151 0.070 5 0 "[ . 1 . 2]"
1 62 ALA 5.424 0.141 15 0 "[ . 1 . 2]"
1 63 LYS 3.161 0.074 10 0 "[ . 1 . 2]"
1 64 LYS 2.621 0.070 5 0 "[ . 1 . 2]"
1 65 PHE 1.698 0.078 20 0 "[ . 1 . 2]"
1 66 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 GLY 0.041 0.017 13 0 "[ . 1 . 2]"
1 68 ALA 2.940 0.114 12 0 "[ . 1 . 2]"
1 69 VAL 3.052 0.098 17 0 "[ . 1 . 2]"
1 70 PHE 8.884 0.166 13 0 "[ . 1 . 2]"
1 71 LEU 6.738 0.170 9 0 "[ . 1 . 2]"
1 72 LYS 3.547 0.203 8 0 "[ . 1 . 2]"
1 73 VAL 3.484 0.311 19 0 "[ . 1 . 2]"
1 74 ASP 2.259 0.311 19 0 "[ . 1 . 2]"
1 75 VAL 2.287 0.200 7 0 "[ . 1 . 2]"
1 76 ASP 0.012 0.012 8 0 "[ . 1 . 2]"
1 77 GLU 2.516 0.173 19 0 "[ . 1 . 2]"
1 78 LEU 11.602 0.281 16 0 "[ . 1 . 2]"
1 79 LYS 10.933 0.281 16 0 "[ . 1 . 2]"
1 80 GLU 1.134 0.099 18 0 "[ . 1 . 2]"
1 81 VAL 3.372 0.251 19 0 "[ . 1 . 2]"
1 82 ALA 2.421 0.094 16 0 "[ . 1 . 2]"
1 83 GLU 0.209 0.053 15 0 "[ . 1 . 2]"
1 84 LYS 9.496 0.313 19 0 "[ . 1 . 2]"
1 85 TYR 2.058 0.137 16 0 "[ . 1 . 2]"
1 86 ASN 1.045 0.162 11 0 "[ . 1 . 2]"
1 87 VAL 8.919 0.472 11 0 "[ . 1 . 2]"
1 88 GLU 2.801 0.373 5 0 "[ . 1 . 2]"
1 89 ALA 1.036 0.241 15 0 "[ . 1 . 2]"
1 90 MET 4.549 0.388 10 0 "[ . 1 . 2]"
1 91 PRO 3.640 0.180 8 0 "[ . 1 . 2]"
1 92 THR 7.737 0.187 10 0 "[ . 1 . 2]"
1 93 PHE 2.404 0.209 7 0 "[ . 1 . 2]"
1 94 LEU 9.153 0.182 7 0 "[ . 1 . 2]"
1 95 PHE 2.132 0.068 9 0 "[ . 1 . 2]"
1 96 ILE 5.176 0.156 18 0 "[ . 1 . 2]"
1 97 LYS 0.830 0.071 17 0 "[ . 1 . 2]"
1 98 ASP 0.384 0.036 13 0 "[ . 1 . 2]"
1 99 GLY 1.073 0.062 5 0 "[ . 1 . 2]"
1 100 ALA 1.095 0.070 2 0 "[ . 1 . 2]"
1 101 GLU 2.691 0.081 16 0 "[ . 1 . 2]"
1 102 ALA 0.253 0.040 13 0 "[ . 1 . 2]"
1 103 ASP 4.224 0.125 2 0 "[ . 1 . 2]"
1 104 LYS 6.762 0.248 12 0 "[ . 1 . 2]"
1 105 VAL 3.433 0.209 7 0 "[ . 1 . 2]"
1 106 VAL 1.456 0.093 12 0 "[ . 1 . 2]"
1 107 GLY 0.297 0.076 17 0 "[ . 1 . 2]"
1 108 ALA 1.718 0.123 10 0 "[ . 1 . 2]"
1 109 ARG 2.361 0.221 5 0 "[ . 1 . 2]"
1 110 LYS 2.856 0.229 13 0 "[ . 1 . 2]"
1 111 ASP 0.204 0.165 11 0 "[ . 1 . 2]"
1 112 ASP 1.709 0.070 15 0 "[ . 1 . 2]"
1 113 LEU 3.125 0.108 14 0 "[ . 1 . 2]"
1 114 GLN 2.183 0.229 13 0 "[ . 1 . 2]"
1 115 ASN 3.481 0.291 13 0 "[ . 1 . 2]"
1 116 THR 2.109 0.108 17 0 "[ . 1 . 2]"
1 117 ILE 5.735 0.162 15 0 "[ . 1 . 2]"
1 118 VAL 3.146 0.075 15 0 "[ . 1 . 2]"
1 119 LYS 0.973 0.074 10 0 "[ . 1 . 2]"
1 120 HIS 7.014 0.122 2 0 "[ . 1 . 2]"
1 121 VAL 6.370 0.114 13 0 "[ . 1 . 2]"
1 122 GLY 4.127 0.122 2 0 "[ . 1 . 2]"
1 123 ALA 1.507 0.104 10 0 "[ . 1 . 2]"
1 124 THR 0.004 0.004 17 0 "[ . 1 . 2]"
1 125 ALA 0.321 0.042 3 0 "[ . 1 . 2]"
1 126 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 127 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 128 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 130 ALA 0.000 0.000 . 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 9 MET HA 1 10 ALA H . . 3.380 2.445 2.140 3.411 0.031 6 0 "[ . 1 . 2]" 1
2 1 9 MET HA 1 10 ALA MB . . 4.610 4.160 3.884 4.397 . 0 0 "[ . 1 . 2]" 1
3 1 9 MET HA 1 11 ALA MB . . 4.750 4.587 4.080 4.810 0.060 20 0 "[ . 1 . 2]" 1
4 1 9 MET QB 1 10 ALA HA . . 5.340 4.426 3.952 5.029 . 0 0 "[ . 1 . 2]" 1
5 1 10 ALA H 1 10 ALA MB . . 3.630 2.569 2.126 2.966 . 0 0 "[ . 1 . 2]" 1
6 1 10 ALA HA 1 11 ALA H . . 3.380 3.327 2.141 3.562 0.182 14 0 "[ . 1 . 2]" 1
7 1 10 ALA HA 1 13 GLU HB2 . . 5.500 5.400 4.518 5.545 0.045 5 0 "[ . 1 . 2]" 1
8 1 10 ALA HA 1 13 GLU HB3 . . 5.360 5.113 4.404 5.353 . 0 0 "[ . 1 . 2]" 1
9 1 10 ALA HA 1 13 GLU QG . . 4.070 2.927 1.939 3.195 . 0 0 "[ . 1 . 2]" 1
10 1 10 ALA MB 1 11 ALA H . . 3.150 2.502 1.746 3.308 0.158 17 0 "[ . 1 . 2]" 1
11 1 10 ALA MB 1 12 GLU H . . 4.110 3.049 2.481 4.040 . 0 0 "[ . 1 . 2]" 1
12 1 10 ALA MB 1 12 GLU HA . . 5.500 4.433 3.555 5.556 0.056 17 0 "[ . 1 . 2]" 1
13 1 10 ALA MB 1 13 GLU H . . 4.410 3.688 2.970 4.482 0.072 17 0 "[ . 1 . 2]" 1
14 1 10 ALA MB 1 13 GLU HB3 . . 5.240 4.737 4.176 5.238 . 0 0 "[ . 1 . 2]" 1
15 1 10 ALA MB 1 13 GLU QG . . 3.940 2.280 1.941 2.798 . 0 0 "[ . 1 . 2]" 1
16 1 11 ALA H 1 11 ALA HA . . 2.820 2.376 2.276 2.925 0.105 20 0 "[ . 1 . 2]" 1
17 1 11 ALA H 1 11 ALA MB . . 3.360 2.710 2.072 2.984 . 0 0 "[ . 1 . 2]" 1
18 1 11 ALA H 1 13 GLU QG . . 5.000 4.260 3.189 4.882 . 0 0 "[ . 1 . 2]" 1
19 1 11 ALA HA 1 12 GLU H . . 3.070 2.887 2.352 3.422 0.352 12 0 "[ . 1 . 2]" 1
20 1 11 ALA MB 1 12 GLU H . . 4.350 3.572 3.057 3.721 . 0 0 "[ . 1 . 2]" 1
21 1 11 ALA MB 1 12 GLU HA . . 5.500 4.868 4.463 5.080 . 0 0 "[ . 1 . 2]" 1
22 1 12 GLU H 1 12 GLU HB2 . . 3.370 3.259 3.000 3.420 0.050 19 0 "[ . 1 . 2]" 1
23 1 12 GLU H 1 12 GLU HB3 . . 3.460 3.397 3.257 3.476 0.016 18 0 "[ . 1 . 2]" 1
24 1 12 GLU H 1 12 GLU QG . . 4.300 4.255 4.178 4.297 . 0 0 "[ . 1 . 2]" 1
25 1 12 GLU H 1 13 GLU H . . 3.710 3.163 2.408 3.653 . 0 0 "[ . 1 . 2]" 1
26 1 12 GLU H 1 13 GLU QG . . 3.970 3.314 2.380 3.868 . 0 0 "[ . 1 . 2]" 1
27 1 12 GLU HA 1 12 GLU HB2 . . 2.980 2.453 2.343 2.585 . 0 0 "[ . 1 . 2]" 1
28 1 12 GLU HA 1 12 GLU QG . . 3.090 2.484 2.221 2.614 . 0 0 "[ . 1 . 2]" 1
29 1 12 GLU HA 1 13 GLU H . . 2.550 2.330 2.156 2.613 0.063 19 0 "[ . 1 . 2]" 1
30 1 12 GLU HA 1 15 VAL MG2 . . 4.700 4.043 3.800 4.246 . 0 0 "[ . 1 . 2]" 1
31 1 12 GLU HA 1 17 ILE MD . . 4.140 3.583 2.822 4.083 . 0 0 "[ . 1 . 2]" 1
32 1 12 GLU HA 1 17 ILE MG . . 4.940 4.217 3.501 4.728 . 0 0 "[ . 1 . 2]" 1
33 1 12 GLU HB2 1 17 ILE MD . . 4.290 4.099 3.744 4.304 0.014 19 0 "[ . 1 . 2]" 1
34 1 12 GLU HB2 1 17 ILE MG . . 4.310 3.848 3.577 4.200 . 0 0 "[ . 1 . 2]" 1
35 1 12 GLU HB2 1 18 ALA H . . 4.920 4.726 4.107 4.937 0.017 12 0 "[ . 1 . 2]" 1
36 1 12 GLU HB3 1 13 GLU H . . 4.750 4.461 4.333 4.562 . 0 0 "[ . 1 . 2]" 1
37 1 12 GLU HB3 1 17 ILE MD . . 4.500 4.353 4.098 4.512 0.012 2 0 "[ . 1 . 2]" 1
38 1 12 GLU HB3 1 17 ILE MG . . 4.770 4.710 4.574 4.792 0.022 6 0 "[ . 1 . 2]" 1
39 1 12 GLU QG 1 17 ILE MD . . 4.150 1.957 1.837 2.150 . 0 0 "[ . 1 . 2]" 1
40 1 12 GLU QG 1 17 ILE QG . . 4.650 3.709 3.484 3.905 . 0 0 "[ . 1 . 2]" 1
41 1 13 GLU H 1 13 GLU HB2 . . 3.010 2.783 2.652 2.873 . 0 0 "[ . 1 . 2]" 1
42 1 13 GLU H 1 13 GLU HB3 . . 3.890 3.664 3.628 3.745 . 0 0 "[ . 1 . 2]" 1
43 1 13 GLU H 1 13 GLU QG . . 2.800 1.974 1.878 2.174 . 0 0 "[ . 1 . 2]" 1
44 1 13 GLU H 1 14 GLY H . . 4.350 4.228 4.121 4.339 . 0 0 "[ . 1 . 2]" 1
45 1 13 GLU H 1 14 GLY HA2 . . 5.500 5.412 5.264 5.492 . 0 0 "[ . 1 . 2]" 1
46 1 13 GLU H 1 15 VAL H . . 4.560 3.520 3.277 3.708 . 0 0 "[ . 1 . 2]" 1
47 1 13 GLU H 1 15 VAL MG1 . . 4.290 3.692 3.295 3.914 . 0 0 "[ . 1 . 2]" 1
48 1 13 GLU H 1 15 VAL MG2 . . 3.950 3.178 2.980 3.386 . 0 0 "[ . 1 . 2]" 1
49 1 13 GLU H 1 17 ILE HA . . 5.400 5.212 4.898 5.392 . 0 0 "[ . 1 . 2]" 1
50 1 13 GLU H 1 17 ILE MD . . 4.700 4.155 3.854 4.385 . 0 0 "[ . 1 . 2]" 1
51 1 13 GLU HA 1 13 GLU QG . . 3.190 3.046 2.796 3.183 . 0 0 "[ . 1 . 2]" 1
52 1 13 GLU HA 1 14 GLY H . . 2.990 2.926 2.830 3.003 0.013 16 0 "[ . 1 . 2]" 1
53 1 13 GLU HA 1 14 GLY HA2 . . 4.390 4.366 4.350 4.379 . 0 0 "[ . 1 . 2]" 1
54 1 13 GLU HA 1 14 GLY HA3 . . 4.950 4.782 4.721 4.851 . 0 0 "[ . 1 . 2]" 1
55 1 13 GLU HA 1 15 VAL H . . 4.440 4.211 4.155 4.281 . 0 0 "[ . 1 . 2]" 1
56 1 13 GLU HB2 1 14 GLY H . . 3.070 2.220 1.971 2.496 . 0 0 "[ . 1 . 2]" 1
57 1 13 GLU HB2 1 14 GLY HA2 . . 4.750 4.534 4.424 4.693 . 0 0 "[ . 1 . 2]" 1
58 1 13 GLU HB2 1 15 VAL H . . 3.070 2.839 2.620 2.997 . 0 0 "[ . 1 . 2]" 1
59 1 13 GLU HB3 1 14 GLY H . . 3.350 2.051 1.908 2.163 . 0 0 "[ . 1 . 2]" 1
60 1 13 GLU HB3 1 14 GLY HA3 . . 4.570 4.348 4.213 4.440 . 0 0 "[ . 1 . 2]" 1
61 1 13 GLU QG 1 14 GLY H . . 3.940 3.829 3.723 3.939 . 0 0 "[ . 1 . 2]" 1
62 1 13 GLU QG 1 15 VAL H . . 4.310 4.296 4.127 4.365 0.055 12 0 "[ . 1 . 2]" 1
63 1 13 GLU QG 1 15 VAL MG1 . . 4.190 3.213 3.121 3.325 . 0 0 "[ . 1 . 2]" 1
64 1 13 GLU QG 1 15 VAL MG2 . . 4.110 3.828 3.634 3.984 . 0 0 "[ . 1 . 2]" 1
65 1 13 GLU QG 1 63 LYS QD . . 5.240 5.235 4.996 5.305 0.065 20 0 "[ . 1 . 2]" 1
66 1 14 GLY H 1 14 GLY HA3 . . 2.940 2.325 2.317 2.335 . 0 0 "[ . 1 . 2]" 1
67 1 14 GLY H 1 15 VAL H . . 3.030 2.943 2.806 3.020 . 0 0 "[ . 1 . 2]" 1
68 1 14 GLY H 1 15 VAL HA . . 5.120 5.065 5.020 5.102 . 0 0 "[ . 1 . 2]" 1
69 1 14 GLY H 1 15 VAL MG1 . . 3.980 3.167 3.135 3.206 . 0 0 "[ . 1 . 2]" 1
70 1 14 GLY H 1 15 VAL MG2 . . 4.820 4.665 4.522 4.764 . 0 0 "[ . 1 . 2]" 1
71 1 14 GLY H 1 63 LYS QD . . 4.790 4.418 4.323 4.551 . 0 0 "[ . 1 . 2]" 1
72 1 14 GLY H 1 63 LYS HG2 . . 4.640 4.331 4.064 4.472 . 0 0 "[ . 1 . 2]" 1
73 1 14 GLY H 1 63 LYS HG3 . . 5.500 5.474 5.374 5.522 0.022 9 0 "[ . 1 . 2]" 1
74 1 14 GLY HA2 1 15 VAL H . . 3.140 3.002 2.936 3.107 . 0 0 "[ . 1 . 2]" 1
75 1 14 GLY HA2 1 15 VAL MG1 . . 4.840 4.258 4.217 4.335 . 0 0 "[ . 1 . 2]" 1
76 1 14 GLY HA2 1 15 VAL MG2 . . 5.110 5.029 4.963 5.121 0.011 16 0 "[ . 1 . 2]" 1
77 1 14 GLY HA2 1 17 ILE MD . . 5.290 3.822 3.616 4.053 . 0 0 "[ . 1 . 2]" 1
78 1 14 GLY HA2 1 62 ALA MB . . 5.390 5.082 4.974 5.174 . 0 0 "[ . 1 . 2]" 1
79 1 14 GLY HA2 1 63 LYS QD . . 5.500 5.531 5.479 5.558 0.058 13 0 "[ . 1 . 2]" 1
80 1 14 GLY HA3 1 15 VAL H . . 3.500 3.471 3.412 3.502 0.002 1 0 "[ . 1 . 2]" 1
81 1 14 GLY HA3 1 15 VAL HA . . 4.910 4.509 4.488 4.519 . 0 0 "[ . 1 . 2]" 1
82 1 14 GLY HA3 1 15 VAL MG1 . . 3.920 3.794 3.717 3.838 . 0 0 "[ . 1 . 2]" 1
83 1 14 GLY HA3 1 63 LYS QE . . 4.940 4.909 4.730 4.976 0.036 11 0 "[ . 1 . 2]" 1
84 1 15 VAL H 1 15 VAL HB . . 3.800 3.741 3.686 3.769 . 0 0 "[ . 1 . 2]" 1
85 1 15 VAL H 1 15 VAL MG1 . . 3.450 2.289 2.121 2.365 . 0 0 "[ . 1 . 2]" 1
86 1 15 VAL H 1 15 VAL MG2 . . 2.710 2.438 2.354 2.501 . 0 0 "[ . 1 . 2]" 1
87 1 15 VAL H 1 17 ILE QG . . 5.340 5.339 5.210 5.384 0.044 18 0 "[ . 1 . 2]" 1
88 1 15 VAL H 1 62 ALA MB . . 4.230 4.267 4.224 4.300 0.070 12 0 "[ . 1 . 2]" 1
89 1 15 VAL H 1 63 LYS QD . . 4.330 4.204 3.963 4.320 . 0 0 "[ . 1 . 2]" 1
90 1 15 VAL H 1 63 LYS HG2 . . 5.000 4.275 4.074 4.449 . 0 0 "[ . 1 . 2]" 1
91 1 15 VAL H 1 63 LYS HG3 . . 4.760 4.469 4.337 4.575 . 0 0 "[ . 1 . 2]" 1
92 1 15 VAL HA 1 15 VAL HB . . 2.920 2.302 2.291 2.320 . 0 0 "[ . 1 . 2]" 1
93 1 15 VAL HA 1 15 VAL MG1 . . 2.910 2.577 2.559 2.598 . 0 0 "[ . 1 . 2]" 1
94 1 15 VAL HA 1 15 VAL MG2 . . 3.380 3.151 3.138 3.165 . 0 0 "[ . 1 . 2]" 1
95 1 15 VAL HA 1 16 VAL H . . 2.800 2.560 2.481 2.606 . 0 0 "[ . 1 . 2]" 1
96 1 15 VAL HA 1 16 VAL HA . . 5.200 4.308 4.300 4.313 . 0 0 "[ . 1 . 2]" 1
97 1 15 VAL HA 1 17 ILE H . . 5.350 5.146 5.008 5.213 . 0 0 "[ . 1 . 2]" 1
98 1 15 VAL HA 1 59 ALA HA . . 4.330 3.860 3.776 3.937 . 0 0 "[ . 1 . 2]" 1
99 1 15 VAL HA 1 62 ALA MB . . 3.840 1.934 1.918 1.950 . 0 0 "[ . 1 . 2]" 1
100 1 15 VAL HB 1 16 VAL H . . 2.670 2.314 2.229 2.450 . 0 0 "[ . 1 . 2]" 1
101 1 15 VAL HB 1 16 VAL HA . . 5.070 4.929 4.863 5.019 . 0 0 "[ . 1 . 2]" 1
102 1 15 VAL HB 1 59 ALA MB . . 3.530 2.251 2.169 2.359 . 0 0 "[ . 1 . 2]" 1
103 1 15 VAL HB 1 62 ALA MB . . 4.100 3.123 2.989 3.262 . 0 0 "[ . 1 . 2]" 1
104 1 15 VAL MG1 1 16 VAL H . . 4.070 3.848 3.798 3.927 . 0 0 "[ . 1 . 2]" 1
105 1 15 VAL MG1 1 59 ALA HA . . 4.400 4.103 3.975 4.233 . 0 0 "[ . 1 . 2]" 1
106 1 15 VAL MG1 1 59 ALA MB . . 3.060 2.859 2.772 2.953 . 0 0 "[ . 1 . 2]" 1
107 1 15 VAL MG1 1 60 GLU HA . . 5.140 3.933 3.684 4.389 . 0 0 "[ . 1 . 2]" 1
108 1 15 VAL MG1 1 62 ALA MB . . 4.140 3.833 3.756 3.894 . 0 0 "[ . 1 . 2]" 1
109 1 15 VAL MG1 1 63 LYS H . . 4.650 4.385 4.257 4.549 . 0 0 "[ . 1 . 2]" 1
110 1 15 VAL MG1 1 63 LYS QD . . 4.630 1.770 1.741 1.828 . 0 0 "[ . 1 . 2]" 1
111 1 15 VAL MG1 1 63 LYS QE . . 4.450 3.553 3.352 3.634 . 0 0 "[ . 1 . 2]" 1
112 1 15 VAL MG1 1 63 LYS HG2 . . 4.290 2.930 2.734 3.023 . 0 0 "[ . 1 . 2]" 1
113 1 15 VAL MG1 1 63 LYS HG3 . . 4.510 2.857 2.756 2.964 . 0 0 "[ . 1 . 2]" 1
114 1 15 VAL MG2 1 16 VAL H . . 3.580 2.412 2.316 2.551 . 0 0 "[ . 1 . 2]" 1
115 1 15 VAL MG2 1 16 VAL HA . . 4.080 3.873 3.809 3.932 . 0 0 "[ . 1 . 2]" 1
116 1 15 VAL MG2 1 17 ILE H . . 4.120 4.038 3.982 4.093 . 0 0 "[ . 1 . 2]" 1
117 1 15 VAL MG2 1 17 ILE HA . . 4.300 3.719 3.624 3.854 . 0 0 "[ . 1 . 2]" 1
118 1 15 VAL MG2 1 59 ALA H . . 5.110 4.657 4.549 4.786 . 0 0 "[ . 1 . 2]" 1
119 1 15 VAL MG2 1 63 LYS H . . 5.500 5.532 5.507 5.574 0.074 10 0 "[ . 1 . 2]" 1
120 1 15 VAL MG2 1 63 LYS QD . . 4.480 4.138 4.086 4.191 . 0 0 "[ . 1 . 2]" 1
121 1 16 VAL H 1 16 VAL HB . . 3.730 3.616 3.613 3.626 . 0 0 "[ . 1 . 2]" 1
122 1 16 VAL H 1 16 VAL MG1 . . 2.930 2.196 2.148 2.382 . 0 0 "[ . 1 . 2]" 1
123 1 16 VAL H 1 16 VAL MG2 . . 3.630 2.294 2.156 2.344 . 0 0 "[ . 1 . 2]" 1
124 1 16 VAL H 1 17 ILE H . . 4.330 4.223 4.159 4.254 . 0 0 "[ . 1 . 2]" 1
125 1 16 VAL H 1 59 ALA HA . . 4.160 1.842 1.822 1.857 . 0 0 "[ . 1 . 2]" 1
126 1 16 VAL H 1 59 ALA MB . . 4.120 3.217 3.157 3.243 . 0 0 "[ . 1 . 2]" 1
127 1 16 VAL H 1 62 ALA H . . 3.980 3.671 3.633 3.742 . 0 0 "[ . 1 . 2]" 1
128 1 16 VAL H 1 62 ALA HA . . 4.830 4.602 4.559 4.633 . 0 0 "[ . 1 . 2]" 1
129 1 16 VAL H 1 62 ALA MB . . 3.700 1.826 1.803 1.849 . 0 0 "[ . 1 . 2]" 1
130 1 16 VAL H 1 63 LYS H . . 5.120 4.459 4.357 4.544 . 0 0 "[ . 1 . 2]" 1
131 1 16 VAL H 1 70 PHE HB2 . . 5.500 4.551 4.477 4.683 . 0 0 "[ . 1 . 2]" 1
132 1 16 VAL H 1 70 PHE HB3 . . 4.680 4.169 3.992 4.327 . 0 0 "[ . 1 . 2]" 1
133 1 16 VAL HA 1 16 VAL MG1 . . 3.180 2.262 2.159 2.290 . 0 0 "[ . 1 . 2]" 1
134 1 16 VAL HA 1 16 VAL MG2 . . 3.410 3.189 3.182 3.190 . 0 0 "[ . 1 . 2]" 1
135 1 16 VAL HA 1 17 ILE H . . 2.840 2.220 2.205 2.253 . 0 0 "[ . 1 . 2]" 1
136 1 16 VAL HA 1 17 ILE HB . . 4.770 4.673 4.591 4.746 . 0 0 "[ . 1 . 2]" 1
137 1 16 VAL HA 1 59 ALA HA . . 4.630 4.164 4.131 4.190 . 0 0 "[ . 1 . 2]" 1
138 1 16 VAL HA 1 62 ALA MB . . 3.690 2.407 2.269 2.464 . 0 0 "[ . 1 . 2]" 1
139 1 16 VAL HA 1 70 PHE HA . . 4.660 4.381 4.254 4.561 . 0 0 "[ . 1 . 2]" 1
140 1 16 VAL HA 1 70 PHE HB2 . . 3.870 2.741 2.622 2.912 . 0 0 "[ . 1 . 2]" 1
141 1 16 VAL HA 1 70 PHE QD . . 4.610 4.012 3.894 4.134 . 0 0 "[ . 1 . 2]" 1
142 1 16 VAL HA 1 71 LEU H . . 4.470 3.485 3.221 3.673 . 0 0 "[ . 1 . 2]" 1
143 1 16 VAL HA 1 71 LEU HA . . 4.420 3.295 3.188 3.414 . 0 0 "[ . 1 . 2]" 1
144 1 16 VAL HA 1 71 LEU HB2 . . 5.050 4.907 4.774 5.004 . 0 0 "[ . 1 . 2]" 1
145 1 16 VAL HA 1 71 LEU HB3 . . 5.500 5.466 5.305 5.567 0.067 15 0 "[ . 1 . 2]" 1
146 1 16 VAL HA 1 72 LYS H . . 5.300 5.049 4.903 5.198 . 0 0 "[ . 1 . 2]" 1
147 1 16 VAL HB 1 17 ILE H . . 4.300 3.910 3.867 3.985 . 0 0 "[ . 1 . 2]" 1
148 1 16 VAL HB 1 59 ALA H . . 5.360 5.008 4.953 5.099 . 0 0 "[ . 1 . 2]" 1
149 1 16 VAL HB 1 59 ALA HA . . 4.480 3.968 3.941 4.038 . 0 0 "[ . 1 . 2]" 1
150 1 16 VAL HB 1 72 LYS H . . 4.950 4.299 4.047 4.478 . 0 0 "[ . 1 . 2]" 1
151 1 16 VAL MG1 1 17 ILE H . . 4.360 4.194 4.129 4.213 . 0 0 "[ . 1 . 2]" 1
152 1 16 VAL MG1 1 58 PHE HB2 . . 4.460 3.513 3.377 3.555 . 0 0 "[ . 1 . 2]" 1
153 1 16 VAL MG1 1 58 PHE HB3 . . 4.340 2.414 2.315 2.461 . 0 0 "[ . 1 . 2]" 1
154 1 16 VAL MG1 1 59 ALA H . . 3.530 3.215 3.173 3.267 . 0 0 "[ . 1 . 2]" 1
155 1 16 VAL MG1 1 59 ALA HA . . 3.000 1.988 1.956 2.244 . 0 0 "[ . 1 . 2]" 1
156 1 16 VAL MG1 1 59 ALA MB . . 3.150 3.471 3.450 3.560 0.410 15 0 "[ . 1 . 2]" 1
157 1 16 VAL MG1 1 62 ALA H . . 4.110 2.451 2.383 2.768 . 0 0 "[ . 1 . 2]" 1
158 1 16 VAL MG1 1 62 ALA HA . . 3.920 3.040 2.991 3.287 . 0 0 "[ . 1 . 2]" 1
159 1 16 VAL MG1 1 62 ALA MB . . 3.070 1.662 1.641 1.864 . 0 0 "[ . 1 . 2]" 1
160 1 16 VAL MG1 1 63 LYS H . . 5.500 4.371 4.309 4.727 . 0 0 "[ . 1 . 2]" 1
161 1 16 VAL MG1 1 70 PHE HB2 . . 3.780 3.089 2.982 3.317 . 0 0 "[ . 1 . 2]" 1
162 1 16 VAL MG1 1 70 PHE HB3 . . 4.640 1.978 1.944 2.014 . 0 0 "[ . 1 . 2]" 1
163 1 16 VAL MG1 1 70 PHE QD . . 4.970 2.300 2.219 2.347 . 0 0 "[ . 1 . 2]" 1
164 1 16 VAL MG1 1 72 LYS QE . . 4.870 4.886 4.753 4.971 0.101 17 0 "[ . 1 . 2]" 1
165 1 16 VAL MG2 1 58 PHE HA . . 3.910 4.091 4.056 4.171 0.261 17 0 "[ . 1 . 2]" 1
166 1 16 VAL MG2 1 58 PHE HB2 . . 4.680 2.733 2.663 2.823 . 0 0 "[ . 1 . 2]" 1
167 1 16 VAL MG2 1 58 PHE HB3 . . 4.650 2.611 2.529 2.712 . 0 0 "[ . 1 . 2]" 1
168 1 16 VAL MG2 1 59 ALA H . . 4.290 2.292 2.251 2.367 . 0 0 "[ . 1 . 2]" 1
169 1 16 VAL MG2 1 59 ALA HA . . 4.250 1.854 1.800 1.913 . 0 0 "[ . 1 . 2]" 1
170 1 16 VAL MG2 1 59 ALA MB . . 2.940 2.157 2.059 2.227 . 0 0 "[ . 1 . 2]" 1
171 1 16 VAL MG2 1 61 TYR H . . 5.060 4.868 4.821 4.992 . 0 0 "[ . 1 . 2]" 1
172 1 16 VAL MG2 1 62 ALA H . . 4.130 4.256 4.237 4.271 0.141 15 0 "[ . 1 . 2]" 1
173 1 16 VAL MG2 1 62 ALA MB . . 3.750 3.229 3.167 3.267 . 0 0 "[ . 1 . 2]" 1
174 1 16 VAL MG2 1 70 PHE HB2 . . 5.500 5.258 5.172 5.392 . 0 0 "[ . 1 . 2]" 1
175 1 16 VAL MG2 1 70 PHE QD . . 4.620 4.746 4.713 4.786 0.166 13 0 "[ . 1 . 2]" 1
176 1 16 VAL MG2 1 71 LEU HA . . 4.950 4.473 4.358 4.700 . 0 0 "[ . 1 . 2]" 1
177 1 16 VAL MG2 1 72 LYS QE . . 3.650 2.721 2.584 3.034 . 0 0 "[ . 1 . 2]" 1
178 1 17 ILE H 1 17 ILE HB . . 3.210 2.777 2.718 2.824 . 0 0 "[ . 1 . 2]" 1
179 1 17 ILE H 1 17 ILE HG12 . . 3.530 1.898 1.874 1.937 . 0 0 "[ . 1 . 2]" 1
180 1 17 ILE H 1 17 ILE QG . . 3.090 1.890 1.866 1.929 . 0 0 "[ . 1 . 2]" 1
181 1 17 ILE H 1 17 ILE HG13 . . 3.530 3.477 3.443 3.519 . 0 0 "[ . 1 . 2]" 1
182 1 17 ILE H 1 17 ILE MG . . 3.790 3.750 3.733 3.769 . 0 0 "[ . 1 . 2]" 1
183 1 17 ILE H 1 18 ALA H . . 4.800 4.641 4.632 4.648 . 0 0 "[ . 1 . 2]" 1
184 1 17 ILE H 1 62 ALA MB . . 4.320 3.929 3.821 4.000 . 0 0 "[ . 1 . 2]" 1
185 1 17 ILE H 1 70 PHE HA . . 5.500 5.351 5.194 5.486 . 0 0 "[ . 1 . 2]" 1
186 1 17 ILE H 1 70 PHE HB2 . . 4.290 3.841 3.701 3.952 . 0 0 "[ . 1 . 2]" 1
187 1 17 ILE H 1 70 PHE HB3 . . 4.150 3.881 3.711 3.992 . 0 0 "[ . 1 . 2]" 1
188 1 17 ILE H 1 71 LEU H . . 4.990 4.250 4.046 4.352 . 0 0 "[ . 1 . 2]" 1
189 1 17 ILE H 1 71 LEU HA . . 3.590 2.564 2.429 2.694 . 0 0 "[ . 1 . 2]" 1
190 1 17 ILE H 1 71 LEU HB2 . . 4.390 3.621 3.442 3.851 . 0 0 "[ . 1 . 2]" 1
191 1 17 ILE H 1 72 LYS H . . 4.480 4.333 4.181 4.497 0.017 17 0 "[ . 1 . 2]" 1
192 1 17 ILE H 1 72 LYS QE . . 5.500 5.542 5.510 5.703 0.203 8 0 "[ . 1 . 2]" 1
193 1 17 ILE HA 1 17 ILE MD . . 3.370 2.029 1.951 2.166 . 0 0 "[ . 1 . 2]" 1
194 1 17 ILE HA 1 17 ILE HG12 . . 3.830 3.265 3.153 3.349 . 0 0 "[ . 1 . 2]" 1
195 1 17 ILE HA 1 17 ILE QG . . 3.350 3.068 2.991 3.125 . 0 0 "[ . 1 . 2]" 1
196 1 17 ILE HA 1 17 ILE HG13 . . 3.830 3.726 3.711 3.740 . 0 0 "[ . 1 . 2]" 1
197 1 17 ILE HA 1 17 ILE MG . . 3.100 2.244 2.182 2.312 . 0 0 "[ . 1 . 2]" 1
198 1 17 ILE HA 1 18 ALA H . . 2.610 2.439 2.350 2.482 . 0 0 "[ . 1 . 2]" 1
199 1 17 ILE HA 1 18 ALA HA . . 4.550 4.484 4.417 4.511 . 0 0 "[ . 1 . 2]" 1
200 1 17 ILE HA 1 18 ALA MB . . 3.960 3.782 3.729 3.892 . 0 0 "[ . 1 . 2]" 1
201 1 17 ILE HA 1 72 LYS H . . 4.670 4.496 4.349 4.681 0.011 13 0 "[ . 1 . 2]" 1
202 1 17 ILE HB 1 17 ILE MD . . 3.290 3.218 3.212 3.225 . 0 0 "[ . 1 . 2]" 1
203 1 17 ILE HB 1 18 ALA H . . 3.860 3.389 3.243 3.639 . 0 0 "[ . 1 . 2]" 1
204 1 17 ILE HB 1 71 LEU H . . 5.380 4.870 4.675 5.119 . 0 0 "[ . 1 . 2]" 1
205 1 17 ILE HB 1 71 LEU HA . . 3.860 2.332 2.112 2.688 . 0 0 "[ . 1 . 2]" 1
206 1 17 ILE HB 1 71 LEU MD1 . . 3.040 1.934 1.815 2.009 . 0 0 "[ . 1 . 2]" 1
207 1 17 ILE HB 1 71 LEU MD2 . . 4.000 4.082 3.993 4.170 0.170 9 0 "[ . 1 . 2]" 1
208 1 17 ILE HB 1 72 LYS H . . 3.670 3.234 2.970 3.600 . 0 0 "[ . 1 . 2]" 1
209 1 17 ILE MD 1 27 ALA MB . . 5.500 5.118 4.731 5.497 . 0 0 "[ . 1 . 2]" 1
210 1 17 ILE MD 1 28 GLN QE . . 4.380 3.675 2.978 4.182 . 0 0 "[ . 1 . 2]" 1
211 1 17 ILE MD 1 71 LEU HA . . 4.590 4.374 4.174 4.626 0.036 17 0 "[ . 1 . 2]" 1
212 1 17 ILE QG 1 18 ALA H . . 4.710 4.285 4.258 4.361 . 0 0 "[ . 1 . 2]" 1
213 1 17 ILE QG 1 71 LEU HB2 . . 4.020 2.886 2.626 3.354 . 0 0 "[ . 1 . 2]" 1
214 1 17 ILE HG12 1 17 ILE MG . . 3.350 3.185 3.175 3.194 . 0 0 "[ . 1 . 2]" 1
215 1 17 ILE HG13 1 17 ILE MG . . 3.350 2.211 2.159 2.261 . 0 0 "[ . 1 . 2]" 1
216 1 17 ILE MG 1 18 ALA H . . 3.080 1.745 1.711 1.871 . 0 0 "[ . 1 . 2]" 1
217 1 17 ILE MG 1 18 ALA HA . . 4.640 3.572 3.471 3.687 . 0 0 "[ . 1 . 2]" 1
218 1 17 ILE MG 1 18 ALA MB . . 3.680 3.619 3.562 3.676 . 0 0 "[ . 1 . 2]" 1
219 1 17 ILE MG 1 19 CYS H . . 3.450 2.746 2.200 3.421 . 0 0 "[ . 1 . 2]" 1
220 1 17 ILE MG 1 19 CYS HA . . 4.940 3.475 3.223 3.859 . 0 0 "[ . 1 . 2]" 1
221 1 17 ILE MG 1 19 CYS QB . . 4.490 3.391 2.959 3.952 . 0 0 "[ . 1 . 2]" 1
222 1 17 ILE MG 1 27 ALA MB . . 4.860 4.044 3.745 4.335 . 0 0 "[ . 1 . 2]" 1
223 1 17 ILE MG 1 28 GLN HE21 . . 4.020 3.004 2.274 3.947 . 0 0 "[ . 1 . 2]" 1
224 1 17 ILE MG 1 28 GLN HE22 . . 4.020 3.286 2.573 4.005 . 0 0 "[ . 1 . 2]" 1
225 1 17 ILE MG 1 28 GLN QG . . 3.990 3.220 2.899 3.540 . 0 0 "[ . 1 . 2]" 1
226 1 17 ILE MG 1 71 LEU HA . . 4.280 3.853 3.686 4.115 . 0 0 "[ . 1 . 2]" 1
227 1 17 ILE MG 1 72 LYS H . . 4.660 3.739 3.410 4.147 . 0 0 "[ . 1 . 2]" 1
228 1 18 ALA H 1 18 ALA MB . . 2.810 2.616 2.384 2.689 . 0 0 "[ . 1 . 2]" 1
229 1 18 ALA H 1 19 CYS H . . 3.810 3.315 2.971 3.676 . 0 0 "[ . 1 . 2]" 1
230 1 18 ALA H 1 71 LEU HA . . 4.880 4.671 4.575 4.856 . 0 0 "[ . 1 . 2]" 1
231 1 18 ALA H 1 72 LYS H . . 4.440 4.022 3.840 4.374 . 0 0 "[ . 1 . 2]" 1
232 1 18 ALA H 1 72 LYS QE . . 5.090 4.245 4.115 4.628 . 0 0 "[ . 1 . 2]" 1
233 1 18 ALA HA 1 19 CYS H . . 2.620 2.416 2.233 2.599 . 0 0 "[ . 1 . 2]" 1
234 1 18 ALA HA 1 71 LEU HA . . 4.780 4.440 4.247 4.687 . 0 0 "[ . 1 . 2]" 1
235 1 18 ALA HA 1 72 LYS H . . 3.310 2.531 2.375 2.955 . 0 0 "[ . 1 . 2]" 1
236 1 18 ALA MB 1 19 CYS H . . 3.710 3.675 3.559 3.720 0.010 12 0 "[ . 1 . 2]" 1
237 1 18 ALA MB 1 72 LYS H . . 4.360 3.970 3.770 4.422 0.062 15 0 "[ . 1 . 2]" 1
238 1 18 ALA MB 1 72 LYS HD2 . . 4.010 2.405 1.961 2.864 . 0 0 "[ . 1 . 2]" 1
239 1 18 ALA MB 1 72 LYS HD3 . . 4.010 3.625 2.695 3.878 . 0 0 "[ . 1 . 2]" 1
240 1 18 ALA MB 1 72 LYS QE . . 3.920 1.901 1.817 2.040 . 0 0 "[ . 1 . 2]" 1
241 1 18 ALA MB 1 73 VAL HA . . 5.500 5.152 4.789 5.540 0.040 14 0 "[ . 1 . 2]" 1
242 1 19 CYS H 1 19 CYS QB . . 3.170 2.291 2.100 2.765 . 0 0 "[ . 1 . 2]" 1
243 1 19 CYS H 1 20 HIS H . . 4.950 4.486 3.411 4.649 . 0 0 "[ . 1 . 2]" 1
244 1 19 CYS H 1 71 LEU HA . . 5.090 4.677 4.425 5.031 . 0 0 "[ . 1 . 2]" 1
245 1 19 CYS H 1 71 LEU MD1 . . 4.370 2.070 1.846 2.502 . 0 0 "[ . 1 . 2]" 1
246 1 19 CYS H 1 71 LEU HG . . 3.450 3.314 3.037 3.492 0.042 20 0 "[ . 1 . 2]" 1
247 1 19 CYS H 1 72 LYS H . . 3.480 3.060 2.833 3.369 . 0 0 "[ . 1 . 2]" 1
248 1 19 CYS H 1 73 VAL H . . 5.150 5.115 4.863 5.208 0.058 10 0 "[ . 1 . 2]" 1
249 1 19 CYS H 1 73 VAL HA . . 4.510 3.724 3.472 3.883 . 0 0 "[ . 1 . 2]" 1
250 1 19 CYS HA 1 21 ASN H . . 4.680 4.203 3.687 4.465 . 0 0 "[ . 1 . 2]" 1
251 1 19 CYS HA 1 24 GLU HB3 . . 3.920 3.220 2.781 3.935 0.015 20 0 "[ . 1 . 2]" 1
252 1 19 CYS HA 1 24 GLU HG2 . . 4.770 4.523 4.159 4.874 0.104 17 0 "[ . 1 . 2]" 1
253 1 19 CYS HA 1 24 GLU HG3 . . 4.750 3.292 2.836 3.785 . 0 0 "[ . 1 . 2]" 1
254 1 19 CYS QB 1 21 ASN H . . 4.760 3.535 2.313 4.125 . 0 0 "[ . 1 . 2]" 1
255 1 19 CYS QB 1 24 GLU HB2 . . 3.970 2.102 1.775 2.995 . 0 0 "[ . 1 . 2]" 1
256 1 19 CYS QB 1 24 GLU HB3 . . 4.440 3.468 3.150 4.510 0.070 15 0 "[ . 1 . 2]" 1
257 1 19 CYS QB 1 25 PHE H . . 3.520 2.429 1.996 3.253 . 0 0 "[ . 1 . 2]" 1
258 1 19 CYS QB 1 25 PHE HA . . 3.810 2.318 1.985 2.840 . 0 0 "[ . 1 . 2]" 1
259 1 19 CYS QB 1 25 PHE HB3 . . 4.480 3.105 2.410 3.596 . 0 0 "[ . 1 . 2]" 1
260 1 19 CYS QB 1 25 PHE QD . . 5.190 4.321 3.981 4.803 . 0 0 "[ . 1 . 2]" 1
261 1 19 CYS QB 1 73 VAL QG . . 4.630 2.777 1.874 4.293 . 0 0 "[ . 1 . 2]" 1
262 1 19 CYS QB 1 78 LEU MD1 . . 4.560 3.654 2.827 4.021 . 0 0 "[ . 1 . 2]" 1
263 1 20 HIS H 1 21 ASN H . . 3.610 2.058 1.765 2.793 . 0 0 "[ . 1 . 2]" 1
264 1 20 HIS H 1 24 GLU HB2 . . 4.900 3.207 2.606 4.967 0.067 10 0 "[ . 1 . 2]" 1
265 1 20 HIS H 1 78 LEU MD2 . . 5.180 3.950 2.703 4.440 . 0 0 "[ . 1 . 2]" 1
266 1 20 HIS HA 1 74 ASP HB3 . . 4.350 3.854 3.143 4.325 . 0 0 "[ . 1 . 2]" 1
267 1 20 HIS HA 1 77 GLU QG . . 4.220 3.143 2.629 3.385 . 0 0 "[ . 1 . 2]" 1
268 1 20 HIS HA 1 78 LEU MD1 . . 4.740 3.982 3.216 4.350 . 0 0 "[ . 1 . 2]" 1
269 1 20 HIS HA 1 78 LEU MD2 . . 4.010 2.617 1.954 3.095 . 0 0 "[ . 1 . 2]" 1
270 1 20 HIS HB2 1 21 ASN H . . 4.730 4.310 3.883 4.486 . 0 0 "[ . 1 . 2]" 1
271 1 20 HIS HB3 1 21 ASN H . . 4.730 4.401 4.097 4.656 . 0 0 "[ . 1 . 2]" 1
272 1 21 ASN H 1 21 ASN HA . . 2.860 2.808 2.755 2.898 0.038 10 0 "[ . 1 . 2]" 1
273 1 21 ASN H 1 21 ASN QD . . 4.670 3.356 2.330 4.618 . 0 0 "[ . 1 . 2]" 1
274 1 21 ASN H 1 22 LYS H . . 4.730 1.723 1.642 1.783 . 0 0 "[ . 1 . 2]" 1
275 1 21 ASN H 1 22 LYS HA . . 4.560 3.858 3.809 3.896 . 0 0 "[ . 1 . 2]" 1
276 1 21 ASN H 1 22 LYS HB3 . . 4.970 4.713 4.664 4.806 . 0 0 "[ . 1 . 2]" 1
277 1 21 ASN H 1 23 ASP H . . 4.810 4.688 4.566 4.901 0.091 15 0 "[ . 1 . 2]" 1
278 1 21 ASN H 1 24 GLU H . . 4.220 3.867 3.783 4.130 . 0 0 "[ . 1 . 2]" 1
279 1 21 ASN H 1 24 GLU HG2 . . 5.050 4.686 4.302 5.049 . 0 0 "[ . 1 . 2]" 1
280 1 21 ASN H 1 24 GLU HG3 . . 3.530 3.171 2.808 3.409 . 0 0 "[ . 1 . 2]" 1
281 1 21 ASN H 1 25 PHE H . . 4.280 3.891 3.662 4.030 . 0 0 "[ . 1 . 2]" 1
282 1 21 ASN H 1 25 PHE HB3 . . 4.570 4.225 3.932 4.385 . 0 0 "[ . 1 . 2]" 1
283 1 21 ASN H 1 78 LEU HB2 . . 5.090 4.884 4.612 5.140 0.050 10 0 "[ . 1 . 2]" 1
284 1 21 ASN H 1 78 LEU MD1 . . 3.490 2.942 2.774 3.159 . 0 0 "[ . 1 . 2]" 1
285 1 21 ASN H 1 78 LEU MD2 . . 3.580 3.127 2.924 3.561 . 0 0 "[ . 1 . 2]" 1
286 1 21 ASN H 1 78 LEU HG . . 5.500 5.536 5.408 5.616 0.116 3 0 "[ . 1 . 2]" 1
287 1 21 ASN HA 1 21 ASN QD . . 4.390 3.857 3.422 4.287 . 0 0 "[ . 1 . 2]" 1
288 1 21 ASN HA 1 22 LYS H . . 3.210 2.999 2.933 3.153 . 0 0 "[ . 1 . 2]" 1
289 1 21 ASN HA 1 23 ASP HB2 . . 5.500 5.429 5.240 5.528 0.028 3 0 "[ . 1 . 2]" 1
290 1 21 ASN QB 1 23 ASP H . . 5.340 4.089 3.591 4.326 . 0 0 "[ . 1 . 2]" 1
291 1 21 ASN QB 1 24 GLU H . . 4.640 4.252 3.304 4.614 . 0 0 "[ . 1 . 2]" 1
292 1 21 ASN HB2 1 24 GLU H . . 5.500 5.051 4.342 5.508 0.008 18 0 "[ . 1 . 2]" 1
293 1 21 ASN HB3 1 24 GLU H . . 5.500 4.780 3.352 5.429 . 0 0 "[ . 1 . 2]" 1
294 1 21 ASN QD 1 23 ASP H . . 4.250 3.196 2.721 3.871 . 0 0 "[ . 1 . 2]" 1
295 1 21 ASN QD 1 23 ASP HA . . 5.340 4.224 3.704 4.942 . 0 0 "[ . 1 . 2]" 1
296 1 21 ASN QD 1 23 ASP HB2 . . 4.440 2.353 1.887 2.704 . 0 0 "[ . 1 . 2]" 1
297 1 21 ASN QD 1 24 GLU HB2 . . 5.340 3.825 3.135 4.785 . 0 0 "[ . 1 . 2]" 1
298 1 21 ASN QD 1 24 GLU HG2 . . 3.960 1.896 1.764 2.262 . 0 0 "[ . 1 . 2]" 1
299 1 21 ASN QD 1 24 GLU HG3 . . 3.800 2.092 1.834 2.779 . 0 0 "[ . 1 . 2]" 1
300 1 21 ASN HD21 1 23 ASP H . . 4.940 3.643 2.838 4.322 . 0 0 "[ . 1 . 2]" 1
301 1 21 ASN HD21 1 23 ASP HB2 . . 5.120 3.203 2.056 4.081 . 0 0 "[ . 1 . 2]" 1
302 1 21 ASN HD21 1 24 GLU H . . 4.850 2.744 1.949 3.792 . 0 0 "[ . 1 . 2]" 1
303 1 21 ASN HD21 1 24 GLU HG2 . . 4.620 2.633 1.894 3.427 . 0 0 "[ . 1 . 2]" 1
304 1 21 ASN HD21 1 24 GLU HG3 . . 4.360 2.444 1.877 3.797 . 0 0 "[ . 1 . 2]" 1
305 1 21 ASN HD22 1 23 ASP H . . 4.940 3.727 2.922 4.953 0.013 5 0 "[ . 1 . 2]" 1
306 1 21 ASN HD22 1 23 ASP HB2 . . 5.120 2.742 1.980 3.951 . 0 0 "[ . 1 . 2]" 1
307 1 21 ASN HD22 1 24 GLU H . . 4.850 2.716 1.794 4.203 . 0 0 "[ . 1 . 2]" 1
308 1 21 ASN HD22 1 24 GLU HG2 . . 4.620 2.177 1.884 3.890 . 0 0 "[ . 1 . 2]" 1
309 1 21 ASN HD22 1 24 GLU HG3 . . 4.360 2.767 1.995 4.395 0.035 17 0 "[ . 1 . 2]" 1
310 1 22 LYS H 1 22 LYS HB2 . . 3.940 3.386 3.305 3.471 . 0 0 "[ . 1 . 2]" 1
311 1 22 LYS H 1 22 LYS HB3 . . 4.000 3.347 3.303 3.445 . 0 0 "[ . 1 . 2]" 1
312 1 22 LYS H 1 22 LYS QE . . 4.800 4.756 4.616 4.843 0.043 15 0 "[ . 1 . 2]" 1
313 1 22 LYS H 1 22 LYS HG2 . . 5.200 4.996 4.931 5.076 . 0 0 "[ . 1 . 2]" 1
314 1 22 LYS H 1 23 ASP H . . 3.920 3.830 3.767 3.901 . 0 0 "[ . 1 . 2]" 1
315 1 22 LYS H 1 23 ASP HB2 . . 5.500 5.424 5.268 5.480 . 0 0 "[ . 1 . 2]" 1
316 1 22 LYS H 1 24 GLU H . . 4.790 3.839 3.763 3.991 . 0 0 "[ . 1 . 2]" 1
317 1 22 LYS H 1 25 PHE HA . . 5.500 5.544 5.274 5.628 0.128 9 0 "[ . 1 . 2]" 1
318 1 22 LYS H 1 78 LEU MD1 . . 4.370 1.859 1.788 1.939 . 0 0 "[ . 1 . 2]" 1
319 1 22 LYS H 1 78 LEU MD2 . . 4.720 3.011 2.829 3.441 . 0 0 "[ . 1 . 2]" 1
320 1 22 LYS H 1 81 VAL QG . . 4.720 4.321 4.141 4.514 . 0 0 "[ . 1 . 2]" 1
321 1 22 LYS HA 1 22 LYS QD . . 4.510 4.169 4.046 4.254 . 0 0 "[ . 1 . 2]" 1
322 1 22 LYS HA 1 22 LYS QE . . 4.460 3.057 2.927 3.161 . 0 0 "[ . 1 . 2]" 1
323 1 22 LYS HA 1 22 LYS HG2 . . 3.800 3.760 3.686 3.805 0.005 1 0 "[ . 1 . 2]" 1
324 1 22 LYS HA 1 22 LYS HG3 . . 4.050 2.773 2.634 2.871 . 0 0 "[ . 1 . 2]" 1
325 1 22 LYS HA 1 23 ASP HA . . 5.170 4.931 4.888 4.974 . 0 0 "[ . 1 . 2]" 1
326 1 22 LYS HA 1 24 GLU H . . 4.320 4.038 3.948 4.268 . 0 0 "[ . 1 . 2]" 1
327 1 22 LYS HA 1 25 PHE H . . 3.410 3.049 3.011 3.122 . 0 0 "[ . 1 . 2]" 1
328 1 22 LYS HA 1 25 PHE HA . . 4.920 4.814 4.709 4.889 . 0 0 "[ . 1 . 2]" 1
329 1 22 LYS HA 1 25 PHE HB2 . . 3.950 3.642 3.552 3.806 . 0 0 "[ . 1 . 2]" 1
330 1 22 LYS HA 1 25 PHE HB3 . . 3.680 2.033 1.951 2.178 . 0 0 "[ . 1 . 2]" 1
331 1 22 LYS HA 1 25 PHE QD . . 4.210 2.573 2.055 2.981 . 0 0 "[ . 1 . 2]" 1
332 1 22 LYS HA 1 26 ASP H . . 4.000 3.855 3.625 4.018 0.018 15 0 "[ . 1 . 2]" 1
333 1 22 LYS HA 1 78 LEU MD1 . . 3.260 1.977 1.880 2.116 . 0 0 "[ . 1 . 2]" 1
334 1 22 LYS HA 1 78 LEU HG . . 4.870 4.698 4.571 4.838 . 0 0 "[ . 1 . 2]" 1
335 1 22 LYS HA 1 81 VAL MG1 . . 5.130 5.005 4.836 5.178 0.048 7 0 "[ . 1 . 2]" 1
336 1 22 LYS HA 1 81 VAL QG . . 3.680 3.171 3.030 3.308 . 0 0 "[ . 1 . 2]" 1
337 1 22 LYS HA 1 81 VAL MG2 . . 5.130 3.207 3.060 3.350 . 0 0 "[ . 1 . 2]" 1
338 1 22 LYS HB2 1 22 LYS QD . . 3.460 2.518 2.305 2.650 . 0 0 "[ . 1 . 2]" 1
339 1 22 LYS HB2 1 22 LYS QE . . 3.830 2.109 1.940 2.412 . 0 0 "[ . 1 . 2]" 1
340 1 22 LYS HB2 1 23 ASP H . . 3.840 3.684 3.629 3.741 . 0 0 "[ . 1 . 2]" 1
341 1 22 LYS HB2 1 78 LEU HB2 . . 4.410 2.688 2.218 2.969 . 0 0 "[ . 1 . 2]" 1
342 1 22 LYS HB3 1 23 ASP H . . 4.190 2.321 2.188 2.440 . 0 0 "[ . 1 . 2]" 1
343 1 22 LYS HB3 1 23 ASP HB2 . . 5.100 4.282 4.128 4.444 . 0 0 "[ . 1 . 2]" 1
344 1 22 LYS HB3 1 24 GLU H . . 5.010 4.796 4.606 5.012 0.002 20 0 "[ . 1 . 2]" 1
345 1 22 LYS HB3 1 25 PHE HB3 . . 5.260 4.966 4.864 5.110 . 0 0 "[ . 1 . 2]" 1
346 1 22 LYS HB3 1 78 LEU HB3 . . 4.730 4.279 3.928 4.688 . 0 0 "[ . 1 . 2]" 1
347 1 22 LYS QD 1 23 ASP H . . 5.040 4.079 3.986 4.277 . 0 0 "[ . 1 . 2]" 1
348 1 22 LYS QD 1 80 GLU QG . . 4.020 3.576 3.227 3.971 . 0 0 "[ . 1 . 2]" 1
349 1 22 LYS QD 1 81 VAL QG . . 4.480 3.814 3.565 4.053 . 0 0 "[ . 1 . 2]" 1
350 1 22 LYS QE 1 23 ASP H . . 5.080 4.726 4.624 4.950 . 0 0 "[ . 1 . 2]" 1
351 1 22 LYS QE 1 25 PHE H . . 5.500 5.488 5.330 5.547 0.047 20 0 "[ . 1 . 2]" 1
352 1 22 LYS QE 1 78 LEU MD1 . . 3.920 2.967 2.746 3.170 . 0 0 "[ . 1 . 2]" 1
353 1 22 LYS QE 1 80 GLU QG . . 4.010 2.219 1.932 3.435 . 0 0 "[ . 1 . 2]" 1
354 1 22 LYS QE 1 81 VAL H . . 4.700 4.208 3.869 4.442 . 0 0 "[ . 1 . 2]" 1
355 1 22 LYS QE 1 81 VAL MG1 . . 4.510 4.009 3.741 4.269 . 0 0 "[ . 1 . 2]" 1
356 1 22 LYS QE 1 81 VAL QG . . 3.430 2.134 1.918 2.351 . 0 0 "[ . 1 . 2]" 1
357 1 22 LYS QE 1 81 VAL MG2 . . 4.510 2.142 1.923 2.363 . 0 0 "[ . 1 . 2]" 1
358 1 22 LYS HG2 1 23 ASP H . . 3.920 2.364 2.194 2.714 . 0 0 "[ . 1 . 2]" 1
359 1 22 LYS HG2 1 23 ASP HA . . 4.260 3.154 3.072 3.292 . 0 0 "[ . 1 . 2]" 1
360 1 22 LYS HG2 1 24 GLU H . . 5.350 4.994 4.898 5.208 . 0 0 "[ . 1 . 2]" 1
361 1 22 LYS HG2 1 25 PHE H . . 5.500 5.536 5.500 5.618 0.118 15 0 "[ . 1 . 2]" 1
362 1 22 LYS HG2 1 26 ASP H . . 5.240 5.039 4.796 5.279 0.039 17 0 "[ . 1 . 2]" 1
363 1 22 LYS HG3 1 23 ASP H . . 4.070 3.169 3.005 3.492 . 0 0 "[ . 1 . 2]" 1
364 1 22 LYS HG3 1 23 ASP HA . . 4.020 3.501 3.328 3.890 . 0 0 "[ . 1 . 2]" 1
365 1 22 LYS HG3 1 25 PHE HB3 . . 4.670 4.127 3.950 4.316 . 0 0 "[ . 1 . 2]" 1
366 1 22 LYS HG3 1 78 LEU MD1 . . 3.990 3.940 3.712 4.056 0.066 7 0 "[ . 1 . 2]" 1
367 1 22 LYS HG3 1 81 VAL QG . . 4.130 3.971 3.776 4.160 0.030 20 0 "[ . 1 . 2]" 1
368 1 23 ASP H 1 23 ASP HA . . 2.900 2.640 2.608 2.664 . 0 0 "[ . 1 . 2]" 1
369 1 23 ASP H 1 23 ASP HB2 . . 2.680 2.152 2.137 2.182 . 0 0 "[ . 1 . 2]" 1
370 1 23 ASP H 1 23 ASP HB3 . . 3.490 3.343 3.222 3.434 . 0 0 "[ . 1 . 2]" 1
371 1 23 ASP H 1 24 GLU HG2 . . 5.100 4.663 4.324 5.040 . 0 0 "[ . 1 . 2]" 1
372 1 23 ASP H 1 25 PHE H . . 5.380 4.384 4.278 4.426 . 0 0 "[ . 1 . 2]" 1
373 1 23 ASP H 1 25 PHE HB3 . . 5.170 5.002 4.901 5.142 . 0 0 "[ . 1 . 2]" 1
374 1 23 ASP H 1 26 ASP H . . 5.070 4.931 4.825 5.038 . 0 0 "[ . 1 . 2]" 1
375 1 23 ASP H 1 78 LEU MD1 . . 5.030 4.543 4.403 4.655 . 0 0 "[ . 1 . 2]" 1
376 1 23 ASP HA 1 24 GLU HA . . 4.880 4.679 4.645 4.718 . 0 0 "[ . 1 . 2]" 1
377 1 23 ASP HA 1 25 PHE H . . 4.830 4.762 4.596 4.863 0.033 20 0 "[ . 1 . 2]" 1
378 1 23 ASP HA 1 26 ASP H . . 4.140 4.042 3.856 4.146 0.006 18 0 "[ . 1 . 2]" 1
379 1 23 ASP HB2 1 24 GLU H . . 3.530 3.337 3.206 3.461 . 0 0 "[ . 1 . 2]" 1
380 1 23 ASP HB3 1 24 GLU HB3 . . 5.310 5.148 4.812 5.334 0.024 13 0 "[ . 1 . 2]" 1
381 1 23 ASP HB3 1 24 GLU HG2 . . 4.230 2.906 2.634 3.252 . 0 0 "[ . 1 . 2]" 1
382 1 24 GLU H 1 24 GLU HB2 . . 3.100 2.919 2.753 3.130 0.030 17 0 "[ . 1 . 2]" 1
383 1 24 GLU H 1 24 GLU HG2 . . 3.470 2.155 1.901 2.570 . 0 0 "[ . 1 . 2]" 1
384 1 24 GLU H 1 24 GLU HG3 . . 3.190 2.330 1.877 2.643 . 0 0 "[ . 1 . 2]" 1
385 1 24 GLU H 1 25 PHE H . . 3.120 2.435 2.306 2.529 . 0 0 "[ . 1 . 2]" 1
386 1 24 GLU H 1 25 PHE HA . . 5.390 5.060 4.950 5.144 . 0 0 "[ . 1 . 2]" 1
387 1 24 GLU H 1 25 PHE HB3 . . 4.560 4.177 4.052 4.297 . 0 0 "[ . 1 . 2]" 1
388 1 24 GLU H 1 25 PHE QD . . 4.940 4.727 4.520 4.975 0.035 15 0 "[ . 1 . 2]" 1
389 1 24 GLU H 1 26 ASP H . . 4.180 4.050 3.891 4.191 0.011 6 0 "[ . 1 . 2]" 1
390 1 24 GLU H 1 27 ALA MB . . 4.970 4.784 4.526 5.015 0.045 17 0 "[ . 1 . 2]" 1
391 1 24 GLU H 1 78 LEU MD1 . . 5.500 4.811 4.695 4.960 . 0 0 "[ . 1 . 2]" 1
392 1 24 GLU HA 1 24 GLU HG2 . . 3.360 2.853 2.668 3.104 . 0 0 "[ . 1 . 2]" 1
393 1 24 GLU HA 1 24 GLU HG3 . . 3.950 3.797 3.661 3.893 . 0 0 "[ . 1 . 2]" 1
394 1 24 GLU HA 1 26 ASP H . . 4.680 4.225 3.939 4.540 . 0 0 "[ . 1 . 2]" 1
395 1 24 GLU HA 1 27 ALA H . . 3.790 3.268 3.162 3.392 . 0 0 "[ . 1 . 2]" 1
396 1 24 GLU HA 1 27 ALA MB . . 3.110 2.454 2.199 2.658 . 0 0 "[ . 1 . 2]" 1
397 1 24 GLU HB2 1 25 PHE H . . 3.440 2.655 2.557 2.916 . 0 0 "[ . 1 . 2]" 1
398 1 24 GLU HB2 1 25 PHE HA . . 4.260 3.870 3.790 3.951 . 0 0 "[ . 1 . 2]" 1
399 1 24 GLU HB3 1 27 ALA MB . . 4.370 3.832 3.667 3.907 . 0 0 "[ . 1 . 2]" 1
400 1 24 GLU HG2 1 25 PHE H . . 4.470 4.101 3.863 4.408 . 0 0 "[ . 1 . 2]" 1
401 1 24 GLU HG2 1 27 ALA MB . . 5.330 4.918 4.628 5.348 0.018 17 0 "[ . 1 . 2]" 1
402 1 24 GLU HG3 1 25 PHE H . . 3.950 3.555 3.032 3.842 . 0 0 "[ . 1 . 2]" 1
403 1 24 GLU HG3 1 25 PHE HB3 . . 5.480 5.215 4.636 5.524 0.044 8 0 "[ . 1 . 2]" 1
404 1 25 PHE H 1 25 PHE HB2 . . 3.440 3.217 3.137 3.287 . 0 0 "[ . 1 . 2]" 1
405 1 25 PHE H 1 25 PHE HB3 . . 3.150 2.075 2.067 2.097 . 0 0 "[ . 1 . 2]" 1
406 1 25 PHE H 1 25 PHE QD . . 3.550 3.357 3.235 3.553 0.003 15 0 "[ . 1 . 2]" 1
407 1 25 PHE H 1 26 ASP H . . 3.200 2.806 2.725 2.866 . 0 0 "[ . 1 . 2]" 1
408 1 25 PHE H 1 27 ALA H . . 4.500 4.202 3.968 4.383 . 0 0 "[ . 1 . 2]" 1
409 1 25 PHE H 1 27 ALA MB . . 4.860 4.680 4.462 4.825 . 0 0 "[ . 1 . 2]" 1
410 1 25 PHE H 1 78 LEU MD1 . . 4.000 3.757 3.608 3.877 . 0 0 "[ . 1 . 2]" 1
411 1 25 PHE HA 1 25 PHE QD . . 3.660 3.471 3.389 3.535 . 0 0 "[ . 1 . 2]" 1
412 1 25 PHE HA 1 28 GLN H . . 4.110 3.985 3.699 4.137 0.027 8 0 "[ . 1 . 2]" 1
413 1 25 PHE HA 1 28 GLN HB2 . . 3.920 3.698 3.302 3.911 . 0 0 "[ . 1 . 2]" 1
414 1 25 PHE HA 1 29 MET H . . 4.780 4.534 4.146 4.803 0.023 8 0 "[ . 1 . 2]" 1
415 1 25 PHE HA 1 71 LEU MD1 . . 4.140 1.973 1.768 2.523 . 0 0 "[ . 1 . 2]" 1
416 1 25 PHE HA 1 71 LEU MD2 . . 4.330 2.374 2.147 2.680 . 0 0 "[ . 1 . 2]" 1
417 1 25 PHE HB2 1 29 MET ME . . 4.740 4.444 4.118 4.749 0.009 12 0 "[ . 1 . 2]" 1
418 1 25 PHE HB2 1 71 LEU MD1 . . 4.430 3.245 2.984 3.428 . 0 0 "[ . 1 . 2]" 1
419 1 25 PHE HB2 1 71 LEU HG . . 4.530 4.554 4.431 4.660 0.130 15 0 "[ . 1 . 2]" 1
420 1 25 PHE HB2 1 78 LEU MD1 . . 3.560 2.957 2.741 3.145 . 0 0 "[ . 1 . 2]" 1
421 1 25 PHE HB2 1 78 LEU MD2 . . 4.680 4.501 4.146 4.693 0.013 11 0 "[ . 1 . 2]" 1
422 1 25 PHE HB2 1 81 VAL QG . . 4.260 3.426 3.139 3.698 . 0 0 "[ . 1 . 2]" 1
423 1 25 PHE HB3 1 26 ASP H . . 3.390 3.163 3.056 3.319 . 0 0 "[ . 1 . 2]" 1
424 1 25 PHE HB3 1 73 VAL QG . . 5.130 3.546 3.138 4.070 . 0 0 "[ . 1 . 2]" 1
425 1 25 PHE HB3 1 78 LEU MD1 . . 3.740 2.541 2.389 2.661 . 0 0 "[ . 1 . 2]" 1
426 1 25 PHE HB3 1 78 LEU MD2 . . 4.510 4.377 4.055 4.548 0.038 15 0 "[ . 1 . 2]" 1
427 1 25 PHE HB3 1 81 VAL QG . . 4.320 3.404 3.144 3.591 . 0 0 "[ . 1 . 2]" 1
428 1 25 PHE QD 1 26 ASP H . . 3.580 2.046 1.894 2.223 . 0 0 "[ . 1 . 2]" 1
429 1 25 PHE QD 1 26 ASP HA . . 3.970 3.432 3.109 3.718 . 0 0 "[ . 1 . 2]" 1
430 1 25 PHE QD 1 27 ALA H . . 4.600 4.544 4.443 4.654 0.054 13 0 "[ . 1 . 2]" 1
431 1 25 PHE QD 1 28 GLN H . . 5.500 5.249 5.099 5.420 . 0 0 "[ . 1 . 2]" 1
432 1 25 PHE QD 1 29 MET H . . 4.800 4.748 4.443 4.834 0.034 19 0 "[ . 1 . 2]" 1
433 1 25 PHE QD 1 29 MET QG . . 4.720 4.538 4.025 4.729 0.009 6 0 "[ . 1 . 2]" 1
434 1 25 PHE QD 1 41 ILE HG12 . . 4.690 3.745 3.439 3.994 . 0 0 "[ . 1 . 2]" 1
435 1 25 PHE QD 1 41 ILE MG . . 3.890 2.770 2.520 2.962 . 0 0 "[ . 1 . 2]" 1
436 1 25 PHE QD 1 71 LEU MD1 . . 4.330 4.254 3.977 4.379 0.049 15 0 "[ . 1 . 2]" 1
437 1 25 PHE QD 1 71 LEU MD2 . . 4.590 2.645 2.305 2.784 . 0 0 "[ . 1 . 2]" 1
438 1 25 PHE QD 1 73 VAL QG . . 4.160 2.640 1.946 3.343 . 0 0 "[ . 1 . 2]" 1
439 1 25 PHE QD 1 78 LEU MD1 . . 4.910 3.345 3.112 3.508 . 0 0 "[ . 1 . 2]" 1
440 1 25 PHE QD 1 81 VAL MG1 . . 4.710 2.607 2.351 3.022 . 0 0 "[ . 1 . 2]" 1
441 1 25 PHE QD 1 81 VAL QG . . 3.830 2.475 2.261 2.717 . 0 0 "[ . 1 . 2]" 1
442 1 25 PHE QD 1 81 VAL MG2 . . 4.710 3.119 2.935 3.334 . 0 0 "[ . 1 . 2]" 1
443 1 25 PHE QE 1 73 VAL QG . . 4.590 4.130 3.449 4.482 . 0 0 "[ . 1 . 2]" 1
444 1 25 PHE QE 1 78 LEU MD1 . . 4.880 4.373 4.109 4.563 . 0 0 "[ . 1 . 2]" 1
445 1 25 PHE QE 1 81 VAL MG1 . . 3.470 2.189 1.951 2.492 . 0 0 "[ . 1 . 2]" 1
446 1 25 PHE QE 1 81 VAL QG . . 2.950 2.144 1.928 2.400 . 0 0 "[ . 1 . 2]" 1
447 1 25 PHE QE 1 81 VAL MG2 . . 3.470 3.137 2.907 3.391 . 0 0 "[ . 1 . 2]" 1
448 1 25 PHE QE 1 84 LYS QD . . 5.340 3.722 3.196 4.409 . 0 0 "[ . 1 . 2]" 1
449 1 25 PHE QE 1 84 LYS QE . . 4.720 4.045 3.115 4.553 . 0 0 "[ . 1 . 2]" 1
450 1 26 ASP H 1 26 ASP HB2 . . 2.940 2.096 2.070 2.120 . 0 0 "[ . 1 . 2]" 1
451 1 26 ASP H 1 26 ASP HB3 . . 3.410 3.373 3.273 3.425 0.015 11 0 "[ . 1 . 2]" 1
452 1 26 ASP H 1 27 ALA H . . 3.110 2.603 2.494 2.692 . 0 0 "[ . 1 . 2]" 1
453 1 26 ASP H 1 27 ALA HA . . 5.500 5.182 5.095 5.257 . 0 0 "[ . 1 . 2]" 1
454 1 26 ASP H 1 27 ALA MB . . 4.260 4.172 4.090 4.271 0.011 13 0 "[ . 1 . 2]" 1
455 1 26 ASP H 1 28 GLN H . . 4.220 4.145 4.060 4.285 0.065 6 0 "[ . 1 . 2]" 1
456 1 26 ASP H 1 29 MET H . . 4.940 4.855 4.676 4.976 0.036 13 0 "[ . 1 . 2]" 1
457 1 26 ASP H 1 29 MET ME . . 5.500 5.409 5.157 5.553 0.053 11 0 "[ . 1 . 2]" 1
458 1 26 ASP H 1 71 LEU MD2 . . 5.500 4.875 4.576 5.160 . 0 0 "[ . 1 . 2]" 1
459 1 26 ASP HA 1 28 GLN H . . 4.450 3.566 3.309 4.016 . 0 0 "[ . 1 . 2]" 1
460 1 26 ASP HA 1 29 MET H . . 3.330 3.101 2.850 3.364 0.034 15 0 "[ . 1 . 2]" 1
461 1 26 ASP HA 1 29 MET HA . . 5.160 4.927 4.638 5.151 . 0 0 "[ . 1 . 2]" 1
462 1 26 ASP HA 1 29 MET HB2 . . 3.470 2.445 2.092 2.949 . 0 0 "[ . 1 . 2]" 1
463 1 26 ASP HA 1 29 MET HB3 . . 3.470 3.083 2.678 3.452 . 0 0 "[ . 1 . 2]" 1
464 1 26 ASP HA 1 29 MET ME . . 4.390 4.160 3.709 4.423 0.033 3 0 "[ . 1 . 2]" 1
465 1 26 ASP HA 1 29 MET QG . . 4.330 4.270 3.949 4.387 0.057 7 0 "[ . 1 . 2]" 1
466 1 26 ASP HA 1 30 THR H . . 4.320 3.769 3.485 4.003 . 0 0 "[ . 1 . 2]" 1
467 1 26 ASP HB2 1 27 ALA H . . 3.140 3.073 2.945 3.191 0.051 9 0 "[ . 1 . 2]" 1
468 1 26 ASP HB2 1 27 ALA HA . . 5.050 4.908 4.821 5.045 . 0 0 "[ . 1 . 2]" 1
469 1 26 ASP HB2 1 27 ALA MB . . 4.780 4.612 4.476 4.725 . 0 0 "[ . 1 . 2]" 1
470 1 26 ASP HB3 1 27 ALA H . . 3.470 3.157 2.809 3.419 . 0 0 "[ . 1 . 2]" 1
471 1 26 ASP HB3 1 27 ALA HA . . 4.280 3.942 3.801 4.046 . 0 0 "[ . 1 . 2]" 1
472 1 26 ASP HB3 1 27 ALA MB . . 4.580 4.487 4.304 4.591 0.011 9 0 "[ . 1 . 2]" 1
473 1 26 ASP HB3 1 30 THR H . . 5.010 4.770 4.357 5.020 0.010 15 0 "[ . 1 . 2]" 1
474 1 27 ALA H 1 27 ALA MB . . 2.600 2.104 2.026 2.257 . 0 0 "[ . 1 . 2]" 1
475 1 27 ALA H 1 28 GLN H . . 3.120 2.813 2.712 2.954 . 0 0 "[ . 1 . 2]" 1
476 1 27 ALA H 1 28 GLN HB2 . . 5.100 4.803 4.529 5.076 . 0 0 "[ . 1 . 2]" 1
477 1 27 ALA H 1 30 THR H . . 5.350 5.036 4.896 5.146 . 0 0 "[ . 1 . 2]" 1
478 1 27 ALA H 1 71 LEU MD1 . . 5.360 5.010 4.311 5.254 . 0 0 "[ . 1 . 2]" 1
479 1 27 ALA HA 1 30 THR H . . 4.530 4.322 4.079 4.417 . 0 0 "[ . 1 . 2]" 1
480 1 27 ALA HA 1 30 THR MG . . 4.300 4.129 3.794 4.317 0.017 9 0 "[ . 1 . 2]" 1
481 1 27 ALA HA 1 31 LYS QB . . 5.190 5.023 4.591 5.280 0.090 13 0 "[ . 1 . 2]" 1
482 1 27 ALA MB 1 28 GLN H . . 3.230 2.951 2.770 3.229 . 0 0 "[ . 1 . 2]" 1
483 1 27 ALA MB 1 28 GLN HA . . 4.080 3.951 3.810 4.065 . 0 0 "[ . 1 . 2]" 1
484 1 27 ALA MB 1 28 GLN HB2 . . 4.480 4.142 4.028 4.269 . 0 0 "[ . 1 . 2]" 1
485 1 27 ALA MB 1 28 GLN HE21 . . 4.480 2.681 2.050 3.464 . 0 0 "[ . 1 . 2]" 1
486 1 27 ALA MB 1 28 GLN QE . . 3.850 1.948 1.749 2.384 . 0 0 "[ . 1 . 2]" 1
487 1 27 ALA MB 1 28 GLN HE22 . . 4.480 2.019 1.862 2.429 . 0 0 "[ . 1 . 2]" 1
488 1 27 ALA MB 1 28 GLN QG . . 4.530 4.249 3.979 4.391 . 0 0 "[ . 1 . 2]" 1
489 1 27 ALA MB 1 30 THR H . . 5.190 5.093 4.901 5.174 . 0 0 "[ . 1 . 2]" 1
490 1 27 ALA MB 1 30 THR MG . . 5.400 5.057 4.717 5.215 . 0 0 "[ . 1 . 2]" 1
491 1 27 ALA MB 1 31 LYS QE . . 4.540 2.903 2.474 3.822 . 0 0 "[ . 1 . 2]" 1
492 1 27 ALA MB 1 71 LEU MD1 . . 5.270 4.249 4.007 4.540 . 0 0 "[ . 1 . 2]" 1
493 1 28 GLN H 1 28 GLN HB2 . . 3.100 2.290 2.178 2.401 . 0 0 "[ . 1 . 2]" 1
494 1 28 GLN H 1 28 GLN HB3 . . 3.840 3.497 3.418 3.595 . 0 0 "[ . 1 . 2]" 1
495 1 28 GLN H 1 28 GLN HE21 . . 4.560 3.120 2.226 4.558 . 0 0 "[ . 1 . 2]" 1
496 1 28 GLN H 1 28 GLN HE22 . . 4.560 3.819 3.435 4.338 . 0 0 "[ . 1 . 2]" 1
497 1 28 GLN H 1 28 GLN QG . . 3.990 3.819 3.701 3.982 . 0 0 "[ . 1 . 2]" 1
498 1 28 GLN H 1 29 MET H . . 2.940 2.297 1.969 2.450 . 0 0 "[ . 1 . 2]" 1
499 1 28 GLN H 1 29 MET ME . . 4.130 3.909 3.660 4.200 0.070 17 0 "[ . 1 . 2]" 1
500 1 28 GLN H 1 30 THR H . . 4.240 3.506 3.327 3.754 . 0 0 "[ . 1 . 2]" 1
501 1 28 GLN H 1 30 THR MG . . 5.500 5.555 5.527 5.597 0.097 13 0 "[ . 1 . 2]" 1
502 1 28 GLN H 1 71 LEU MD1 . . 4.290 3.903 3.448 4.179 . 0 0 "[ . 1 . 2]" 1
503 1 28 GLN H 1 71 LEU MD2 . . 4.640 3.884 3.557 4.297 . 0 0 "[ . 1 . 2]" 1
504 1 28 GLN HA 1 28 GLN HE21 . . 4.540 3.508 2.927 4.010 . 0 0 "[ . 1 . 2]" 1
505 1 28 GLN HA 1 28 GLN HE22 . . 4.540 3.798 3.233 4.320 . 0 0 "[ . 1 . 2]" 1
506 1 28 GLN HA 1 28 GLN QG . . 3.640 2.623 2.349 2.773 . 0 0 "[ . 1 . 2]" 1
507 1 28 GLN HA 1 30 THR H . . 4.050 3.752 3.603 4.049 . 0 0 "[ . 1 . 2]" 1
508 1 28 GLN HA 1 31 LYS H . . 3.220 2.963 2.867 3.147 . 0 0 "[ . 1 . 2]" 1
509 1 28 GLN HA 1 31 LYS QB . . 3.340 2.167 1.988 2.560 . 0 0 "[ . 1 . 2]" 1
510 1 28 GLN HA 1 31 LYS QD . . 3.360 2.794 2.457 3.444 0.084 6 0 "[ . 1 . 2]" 1
511 1 28 GLN HA 1 31 LYS QE . . 4.110 3.707 1.952 4.081 . 0 0 "[ . 1 . 2]" 1
512 1 28 GLN HA 1 69 VAL HB . . 3.490 3.388 3.175 3.537 0.047 15 0 "[ . 1 . 2]" 1
513 1 28 GLN HA 1 69 VAL MG2 . . 4.510 3.836 3.645 4.054 . 0 0 "[ . 1 . 2]" 1
514 1 28 GLN HA 1 71 LEU MD1 . . 5.040 4.938 4.512 5.073 0.033 17 0 "[ . 1 . 2]" 1
515 1 28 GLN HA 1 71 LEU MD2 . . 5.240 5.068 4.858 5.311 0.071 9 0 "[ . 1 . 2]" 1
516 1 28 GLN HB2 1 28 GLN HE21 . . 4.680 2.790 2.130 4.340 . 0 0 "[ . 1 . 2]" 1
517 1 28 GLN HB2 1 28 GLN QE . . 4.030 2.712 2.116 3.969 . 0 0 "[ . 1 . 2]" 1
518 1 28 GLN HB2 1 28 GLN HE22 . . 4.680 4.046 3.637 4.605 . 0 0 "[ . 1 . 2]" 1
519 1 28 GLN HB2 1 29 MET H . . 2.950 2.659 2.410 2.987 0.037 9 0 "[ . 1 . 2]" 1
520 1 28 GLN HB2 1 41 ILE MG . . 5.270 5.217 5.050 5.352 0.082 18 0 "[ . 1 . 2]" 1
521 1 28 GLN HB2 1 71 LEU MD1 . . 3.240 2.583 1.999 2.776 . 0 0 "[ . 1 . 2]" 1
522 1 28 GLN HB2 1 71 LEU MD2 . . 4.180 2.521 2.182 2.893 . 0 0 "[ . 1 . 2]" 1
523 1 28 GLN HB3 1 29 MET H . . 3.600 3.010 2.858 3.366 . 0 0 "[ . 1 . 2]" 1
524 1 28 GLN QE 1 31 LYS QD . . 4.420 3.606 2.789 4.292 . 0 0 "[ . 1 . 2]" 1
525 1 28 GLN QE 1 71 LEU MD1 . . 4.910 2.852 2.216 4.006 . 0 0 "[ . 1 . 2]" 1
526 1 28 GLN HE21 1 31 LYS QD . . 5.070 4.502 2.860 5.085 0.015 17 0 "[ . 1 . 2]" 1
527 1 28 GLN HE22 1 28 GLN QG . . 3.710 3.352 3.225 3.429 . 0 0 "[ . 1 . 2]" 1
528 1 28 GLN HE22 1 31 LYS QD . . 5.070 3.913 2.948 4.625 . 0 0 "[ . 1 . 2]" 1
529 1 28 GLN QG 1 29 MET ME . . 4.630 4.134 3.780 4.444 . 0 0 "[ . 1 . 2]" 1
530 1 28 GLN QG 1 31 LYS QB . . 5.400 3.866 3.622 4.311 . 0 0 "[ . 1 . 2]" 1
531 1 28 GLN QG 1 71 LEU MD1 . . 3.750 2.468 2.107 2.836 . 0 0 "[ . 1 . 2]" 1
532 1 28 GLN QG 1 71 LEU MD2 . . 4.620 3.504 3.324 3.734 . 0 0 "[ . 1 . 2]" 1
533 1 28 GLN QG 1 71 LEU HG . . 4.620 4.525 4.286 4.642 0.022 1 0 "[ . 1 . 2]" 1
534 1 29 MET H 1 29 MET ME . . 3.680 2.183 1.914 2.367 . 0 0 "[ . 1 . 2]" 1
535 1 29 MET H 1 29 MET QG . . 3.940 3.817 3.657 4.016 0.076 17 0 "[ . 1 . 2]" 1
536 1 29 MET H 1 30 THR H . . 3.130 2.785 2.592 2.843 . 0 0 "[ . 1 . 2]" 1
537 1 29 MET H 1 30 THR HB . . 4.770 4.746 4.490 4.800 0.030 5 0 "[ . 1 . 2]" 1
538 1 29 MET H 1 31 LYS H . . 4.290 4.098 3.916 4.250 . 0 0 "[ . 1 . 2]" 1
539 1 29 MET H 1 31 LYS QB . . 5.130 4.933 4.658 5.153 0.023 13 0 "[ . 1 . 2]" 1
540 1 29 MET H 1 71 LEU MD1 . . 4.520 4.530 4.057 4.637 0.117 3 0 "[ . 1 . 2]" 1
541 1 29 MET H 1 71 LEU MD2 . . 4.910 3.430 3.137 3.948 . 0 0 "[ . 1 . 2]" 1
542 1 29 MET HA 1 29 MET ME . . 3.290 2.056 1.941 2.318 . 0 0 "[ . 1 . 2]" 1
543 1 29 MET HA 1 29 MET QG . . 3.110 2.167 2.089 2.697 . 0 0 "[ . 1 . 2]" 1
544 1 29 MET HA 1 32 ALA MB . . 3.740 3.364 3.109 3.628 . 0 0 "[ . 1 . 2]" 1
545 1 29 MET HA 1 39 VAL MG1 . . 4.070 2.881 2.448 3.119 . 0 0 "[ . 1 . 2]" 1
546 1 29 MET HA 1 39 VAL QG . . 3.190 2.263 2.069 2.520 . 0 0 "[ . 1 . 2]" 1
547 1 29 MET HA 1 39 VAL MG2 . . 4.070 2.378 2.143 2.750 . 0 0 "[ . 1 . 2]" 1
548 1 29 MET HA 1 69 VAL MG2 . . 3.550 3.343 3.039 3.564 0.014 15 0 "[ . 1 . 2]" 1
549 1 29 MET QB 1 29 MET ME . . 3.760 2.329 1.901 2.835 . 0 0 "[ . 1 . 2]" 1
550 1 29 MET QB 1 30 THR H . . 3.720 3.000 2.765 3.137 . 0 0 "[ . 1 . 2]" 1
551 1 29 MET ME 1 29 MET QG . . 3.120 2.466 2.250 2.690 . 0 0 "[ . 1 . 2]" 1
552 1 29 MET ME 1 30 THR H . . 4.360 4.289 4.144 4.392 0.032 2 0 "[ . 1 . 2]" 1
553 1 29 MET ME 1 39 VAL MG1 . . 3.000 1.802 1.746 1.921 . 0 0 "[ . 1 . 2]" 1
554 1 29 MET ME 1 39 VAL QG . . 2.420 1.785 1.726 1.888 . 0 0 "[ . 1 . 2]" 1
555 1 29 MET ME 1 39 VAL MG2 . . 3.000 2.907 2.711 3.096 0.096 17 0 "[ . 1 . 2]" 1
556 1 29 MET ME 1 40 ILE H . . 4.100 3.883 3.715 4.165 0.065 17 0 "[ . 1 . 2]" 1
557 1 29 MET ME 1 41 ILE MD . . 3.690 3.050 2.581 3.168 . 0 0 "[ . 1 . 2]" 1
558 1 29 MET ME 1 41 ILE MG . . 4.440 2.586 2.346 2.944 . 0 0 "[ . 1 . 2]" 1
559 1 29 MET ME 1 69 VAL MG1 . . 4.740 4.680 4.407 4.771 0.031 11 0 "[ . 1 . 2]" 1
560 1 29 MET ME 1 71 LEU HB3 . . 3.490 3.159 2.815 3.415 . 0 0 "[ . 1 . 2]" 1
561 1 29 MET ME 1 71 LEU MD2 . . 4.120 1.865 1.757 2.140 . 0 0 "[ . 1 . 2]" 1
562 1 29 MET ME 1 96 ILE H . . 5.180 5.161 4.963 5.267 0.087 17 0 "[ . 1 . 2]" 1
563 1 29 MET ME 1 96 ILE QG . . 3.470 3.437 3.349 3.492 0.022 19 0 "[ . 1 . 2]" 1
564 1 29 MET QG 1 39 VAL QG . . 3.090 2.451 2.112 3.152 0.062 17 0 "[ . 1 . 2]" 1
565 1 29 MET QG 1 96 ILE QG . . 4.440 2.885 2.677 3.338 . 0 0 "[ . 1 . 2]" 1
566 1 29 MET QG 1 96 ILE MG . . 4.320 2.943 2.757 3.216 . 0 0 "[ . 1 . 2]" 1
567 1 30 THR H 1 30 THR HB . . 2.730 2.240 2.148 2.295 . 0 0 "[ . 1 . 2]" 1
568 1 30 THR H 1 30 THR MG . . 3.640 3.457 3.333 3.532 . 0 0 "[ . 1 . 2]" 1
569 1 30 THR H 1 31 LYS H . . 2.920 2.212 2.093 2.434 . 0 0 "[ . 1 . 2]" 1
570 1 30 THR H 1 31 LYS HA . . 5.150 4.889 4.766 5.084 . 0 0 "[ . 1 . 2]" 1
571 1 30 THR H 1 31 LYS QB . . 4.510 3.959 3.805 4.150 . 0 0 "[ . 1 . 2]" 1
572 1 30 THR H 1 32 ALA H . . 4.310 4.183 3.933 4.327 0.017 18 0 "[ . 1 . 2]" 1
573 1 30 THR H 1 32 ALA MB . . 4.950 4.707 4.560 4.884 . 0 0 "[ . 1 . 2]" 1
574 1 30 THR H 1 33 LYS H . . 5.500 5.406 5.281 5.547 0.047 2 0 "[ . 1 . 2]" 1
575 1 30 THR H 1 39 VAL QG . . 5.440 4.659 4.502 4.821 . 0 0 "[ . 1 . 2]" 1
576 1 30 THR HA 1 30 THR MG . . 2.880 2.751 2.688 2.853 . 0 0 "[ . 1 . 2]" 1
577 1 30 THR HA 1 31 LYS HA . . 4.900 4.694 4.684 4.739 . 0 0 "[ . 1 . 2]" 1
578 1 30 THR HA 1 32 ALA MB . . 4.580 4.448 4.359 4.574 . 0 0 "[ . 1 . 2]" 1
579 1 30 THR HA 1 33 LYS H . . 3.710 3.541 3.378 3.626 . 0 0 "[ . 1 . 2]" 1
580 1 30 THR HA 1 33 LYS QB . . 4.410 4.301 4.098 4.454 0.044 6 0 "[ . 1 . 2]" 1
581 1 30 THR HA 1 33 LYS QD . . 4.030 1.968 1.816 2.155 . 0 0 "[ . 1 . 2]" 1
582 1 30 THR HA 1 33 LYS QE . . 4.350 3.719 2.532 4.123 . 0 0 "[ . 1 . 2]" 1
583 1 30 THR HA 1 33 LYS QG . . 4.320 2.781 2.637 2.984 . 0 0 "[ . 1 . 2]" 1
584 1 30 THR HA 1 34 GLU H . . 4.600 4.419 4.352 4.504 . 0 0 "[ . 1 . 2]" 1
585 1 30 THR HB 1 31 LYS H . . 3.430 3.265 3.080 3.438 0.008 14 0 "[ . 1 . 2]" 1
586 1 30 THR HB 1 31 LYS QB . . 4.920 4.771 4.570 4.910 . 0 0 "[ . 1 . 2]" 1
587 1 30 THR HB 1 31 LYS QE . . 5.250 4.942 4.258 5.331 0.081 13 0 "[ . 1 . 2]" 1
588 1 30 THR HB 1 33 LYS QD . . 4.450 4.338 4.113 4.500 0.050 6 0 "[ . 1 . 2]" 1
589 1 30 THR MG 1 31 LYS H . . 3.290 3.073 2.898 3.160 . 0 0 "[ . 1 . 2]" 1
590 1 30 THR MG 1 31 LYS HA . . 3.560 3.070 2.999 3.117 . 0 0 "[ . 1 . 2]" 1
591 1 30 THR MG 1 31 LYS QB . . 4.100 3.910 3.697 4.095 . 0 0 "[ . 1 . 2]" 1
592 1 30 THR MG 1 31 LYS HG2 . . 4.730 4.473 4.158 4.754 0.024 13 0 "[ . 1 . 2]" 1
593 1 30 THR MG 1 33 LYS QD . . 4.030 3.384 3.155 3.765 . 0 0 "[ . 1 . 2]" 1
594 1 30 THR MG 1 33 LYS QE . . 5.190 5.058 4.532 5.239 0.049 13 0 "[ . 1 . 2]" 1
595 1 30 THR MG 1 34 GLU H . . 4.100 4.056 3.833 4.129 0.029 18 0 "[ . 1 . 2]" 1
596 1 30 THR MG 1 34 GLU QB . . 4.100 3.968 3.495 4.070 . 0 0 "[ . 1 . 2]" 1
597 1 30 THR MG 1 34 GLU HG2 . . 3.580 2.477 2.349 2.617 . 0 0 "[ . 1 . 2]" 1
598 1 30 THR MG 1 34 GLU HG3 . . 4.000 3.484 3.183 3.722 . 0 0 "[ . 1 . 2]" 1
599 1 30 THR MG 1 35 ALA H . . 5.220 5.053 4.768 5.272 0.052 17 0 "[ . 1 . 2]" 1
600 1 31 LYS H 1 31 LYS QB . . 2.590 2.130 2.094 2.169 . 0 0 "[ . 1 . 2]" 1
601 1 31 LYS H 1 31 LYS QD . . 4.030 3.731 2.378 4.015 . 0 0 "[ . 1 . 2]" 1
602 1 31 LYS H 1 31 LYS QE . . 4.470 4.260 3.623 4.486 0.016 2 0 "[ . 1 . 2]" 1
603 1 31 LYS H 1 31 LYS HG2 . . 4.540 4.406 4.257 4.556 0.016 6 0 "[ . 1 . 2]" 1
604 1 31 LYS H 1 31 LYS HG3 . . 3.670 3.437 3.141 3.818 0.148 9 0 "[ . 1 . 2]" 1
605 1 31 LYS H 1 33 LYS H . . 4.910 4.681 4.569 4.836 . 0 0 "[ . 1 . 2]" 1
606 1 31 LYS H 1 34 GLU HG2 . . 5.400 5.185 4.544 5.338 . 0 0 "[ . 1 . 2]" 1
607 1 31 LYS H 1 39 VAL QG . . 5.440 4.612 4.459 4.871 . 0 0 "[ . 1 . 2]" 1
608 1 31 LYS H 1 69 VAL MG1 . . 4.550 3.651 3.485 3.903 . 0 0 "[ . 1 . 2]" 1
609 1 31 LYS H 1 69 VAL MG2 . . 5.060 4.444 4.260 4.645 . 0 0 "[ . 1 . 2]" 1
610 1 31 LYS HA 1 31 LYS QE . . 4.370 4.229 3.798 4.602 0.232 9 0 "[ . 1 . 2]" 1
611 1 31 LYS HA 1 31 LYS HG2 . . 3.340 2.791 2.598 3.482 0.142 9 0 "[ . 1 . 2]" 1
612 1 31 LYS HA 1 31 LYS HG3 . . 2.910 2.351 2.052 2.545 . 0 0 "[ . 1 . 2]" 1
613 1 31 LYS HA 1 34 GLU HG2 . . 4.340 3.629 2.564 4.055 . 0 0 "[ . 1 . 2]" 1
614 1 31 LYS HA 1 34 GLU HG3 . . 3.060 2.793 2.495 2.920 . 0 0 "[ . 1 . 2]" 1
615 1 31 LYS HA 1 35 ALA H . . 4.000 3.612 3.327 3.887 . 0 0 "[ . 1 . 2]" 1
616 1 31 LYS QB 1 31 LYS QD . . 3.180 2.053 1.950 2.406 . 0 0 "[ . 1 . 2]" 1
617 1 31 LYS QB 1 34 GLU HG3 . . 5.030 4.841 4.398 4.948 . 0 0 "[ . 1 . 2]" 1
618 1 31 LYS QE 1 31 LYS HG3 . . 3.180 2.209 1.933 3.303 0.123 6 0 "[ . 1 . 2]" 1
619 1 32 ALA H 1 32 ALA MB . . 2.670 2.427 2.299 2.545 . 0 0 "[ . 1 . 2]" 1
620 1 32 ALA H 1 33 LYS H . . 2.990 2.035 1.931 2.150 . 0 0 "[ . 1 . 2]" 1
621 1 32 ALA H 1 33 LYS QE . . 5.500 4.894 3.196 5.352 . 0 0 "[ . 1 . 2]" 1
622 1 32 ALA H 1 34 GLU H . . 3.810 3.323 3.172 3.480 . 0 0 "[ . 1 . 2]" 1
623 1 32 ALA H 1 34 GLU HG2 . . 5.130 4.195 4.076 4.301 . 0 0 "[ . 1 . 2]" 1
624 1 32 ALA H 1 34 GLU HG3 . . 4.970 3.506 3.348 3.623 . 0 0 "[ . 1 . 2]" 1
625 1 32 ALA H 1 35 ALA H . . 4.410 3.823 3.564 4.238 . 0 0 "[ . 1 . 2]" 1
626 1 32 ALA H 1 35 ALA MB . . 4.650 3.970 3.691 4.520 . 0 0 "[ . 1 . 2]" 1
627 1 32 ALA H 1 39 VAL QG . . 3.960 3.843 3.652 3.964 0.004 9 0 "[ . 1 . 2]" 1
628 1 32 ALA H 1 69 VAL MG2 . . 4.480 4.460 4.207 4.518 0.038 12 0 "[ . 1 . 2]" 1
629 1 32 ALA HA 1 33 LYS HA . . 5.000 4.766 4.735 4.797 . 0 0 "[ . 1 . 2]" 1
630 1 32 ALA HA 1 34 GLU H . . 5.010 4.587 4.414 4.775 . 0 0 "[ . 1 . 2]" 1
631 1 32 ALA HA 1 35 ALA H . . 3.850 3.710 3.576 3.789 . 0 0 "[ . 1 . 2]" 1
632 1 32 ALA HA 1 35 ALA MB . . 3.450 2.666 2.463 3.102 . 0 0 "[ . 1 . 2]" 1
633 1 32 ALA HA 1 37 LYS H . . 3.510 2.768 2.670 2.910 . 0 0 "[ . 1 . 2]" 1
634 1 32 ALA HA 1 37 LYS HA . . 5.080 5.016 4.891 5.128 0.048 18 0 "[ . 1 . 2]" 1
635 1 32 ALA HA 1 37 LYS HB2 . . 4.970 4.707 4.651 4.761 . 0 0 "[ . 1 . 2]" 1
636 1 32 ALA HA 1 37 LYS HB3 . . 4.380 4.209 3.937 4.415 0.035 15 0 "[ . 1 . 2]" 1
637 1 32 ALA HA 1 37 LYS QD . . 4.370 2.736 2.102 3.458 . 0 0 "[ . 1 . 2]" 1
638 1 32 ALA HA 1 37 LYS HG2 . . 3.030 1.956 1.921 1.979 . 0 0 "[ . 1 . 2]" 1
639 1 32 ALA HA 1 37 LYS HG3 . . 4.760 3.175 2.751 3.536 . 0 0 "[ . 1 . 2]" 1
640 1 32 ALA HA 1 38 VAL H . . 5.500 5.562 5.516 5.635 0.135 12 0 "[ . 1 . 2]" 1
641 1 32 ALA HA 1 39 VAL QG . . 4.030 3.730 3.618 3.881 . 0 0 "[ . 1 . 2]" 1
642 1 32 ALA HA 1 69 VAL H . . 5.500 5.149 5.033 5.315 . 0 0 "[ . 1 . 2]" 1
643 1 32 ALA HA 1 69 VAL MG1 . . 4.030 2.538 2.345 2.673 . 0 0 "[ . 1 . 2]" 1
644 1 32 ALA HA 1 69 VAL MG2 . . 4.510 4.161 3.805 4.379 . 0 0 "[ . 1 . 2]" 1
645 1 32 ALA MB 1 33 LYS H . . 3.470 2.567 2.317 2.699 . 0 0 "[ . 1 . 2]" 1
646 1 32 ALA MB 1 33 LYS HA . . 4.210 3.735 3.649 3.834 . 0 0 "[ . 1 . 2]" 1
647 1 32 ALA MB 1 33 LYS QE . . 5.130 4.493 3.005 5.054 . 0 0 "[ . 1 . 2]" 1
648 1 32 ALA MB 1 35 ALA H . . 4.940 4.723 4.634 4.830 . 0 0 "[ . 1 . 2]" 1
649 1 32 ALA MB 1 36 GLY HA2 . . 5.500 5.415 5.105 5.523 0.023 13 0 "[ . 1 . 2]" 1
650 1 32 ALA MB 1 37 LYS H . . 4.120 3.522 3.373 3.644 . 0 0 "[ . 1 . 2]" 1
651 1 32 ALA MB 1 37 LYS HA . . 5.370 4.842 4.666 4.967 . 0 0 "[ . 1 . 2]" 1
652 1 32 ALA MB 1 37 LYS QE . . 5.500 4.815 4.587 4.982 . 0 0 "[ . 1 . 2]" 1
653 1 32 ALA MB 1 38 VAL H . . 4.650 4.553 4.302 4.679 0.029 13 0 "[ . 1 . 2]" 1
654 1 32 ALA MB 1 38 VAL HA . . 4.460 3.657 3.545 3.803 . 0 0 "[ . 1 . 2]" 1
655 1 32 ALA MB 1 38 VAL MG1 . . 4.600 4.495 4.418 4.574 . 0 0 "[ . 1 . 2]" 1
656 1 32 ALA MB 1 39 VAL H . . 4.040 3.876 3.802 4.011 . 0 0 "[ . 1 . 2]" 1
657 1 32 ALA MB 1 39 VAL HB . . 4.410 3.725 3.633 3.864 . 0 0 "[ . 1 . 2]" 1
658 1 32 ALA MB 1 39 VAL QG . . 2.710 1.622 1.596 1.703 . 0 0 "[ . 1 . 2]" 1
659 1 32 ALA MB 1 40 ILE H . . 5.270 4.923 4.849 5.132 . 0 0 "[ . 1 . 2]" 1
660 1 32 ALA MB 1 69 VAL H . . 4.700 3.709 3.496 3.957 . 0 0 "[ . 1 . 2]" 1
661 1 32 ALA MB 1 69 VAL HB . . 4.290 4.108 3.887 4.304 0.014 19 0 "[ . 1 . 2]" 1
662 1 32 ALA MB 1 69 VAL MG1 . . 3.500 2.031 1.793 2.363 . 0 0 "[ . 1 . 2]" 1
663 1 32 ALA MB 1 69 VAL MG2 . . 2.940 2.388 1.941 2.592 . 0 0 "[ . 1 . 2]" 1
664 1 32 ALA MB 1 97 LYS HA . . 5.500 4.513 4.269 4.710 . 0 0 "[ . 1 . 2]" 1
665 1 33 LYS H 1 33 LYS QB . . 2.730 2.624 2.555 2.669 . 0 0 "[ . 1 . 2]" 1
666 1 33 LYS H 1 33 LYS QD . . 3.700 2.870 2.518 3.581 . 0 0 "[ . 1 . 2]" 1
667 1 33 LYS H 1 33 LYS QE . . 4.530 3.529 2.008 4.032 . 0 0 "[ . 1 . 2]" 1
668 1 33 LYS H 1 33 LYS QG . . 2.890 1.936 1.850 2.081 . 0 0 "[ . 1 . 2]" 1
669 1 33 LYS H 1 34 GLU H . . 2.960 2.654 2.542 2.796 . 0 0 "[ . 1 . 2]" 1
670 1 33 LYS H 1 34 GLU HG2 . . 4.410 4.331 4.099 4.507 0.097 17 0 "[ . 1 . 2]" 1
671 1 33 LYS H 1 34 GLU HG3 . . 4.480 3.907 3.762 4.168 . 0 0 "[ . 1 . 2]" 1
672 1 33 LYS H 1 35 ALA H . . 4.540 4.032 3.886 4.154 . 0 0 "[ . 1 . 2]" 1
673 1 33 LYS H 1 37 LYS H . . 5.250 4.936 4.837 5.026 . 0 0 "[ . 1 . 2]" 1
674 1 33 LYS H 1 39 VAL QG . . 3.960 3.906 3.783 4.031 0.071 17 0 "[ . 1 . 2]" 1
675 1 33 LYS H 1 69 VAL MG2 . . 5.500 5.465 5.239 5.553 0.053 20 0 "[ . 1 . 2]" 1
676 1 33 LYS HA 1 33 LYS QD . . 4.620 4.335 4.165 4.548 . 0 0 "[ . 1 . 2]" 1
677 1 33 LYS HA 1 33 LYS QE . . 4.400 3.962 3.556 4.128 . 0 0 "[ . 1 . 2]" 1
678 1 33 LYS HA 1 33 LYS QG . . 3.420 3.343 3.332 3.353 . 0 0 "[ . 1 . 2]" 1
679 1 33 LYS HA 1 35 ALA H . . 4.880 4.773 4.667 4.856 . 0 0 "[ . 1 . 2]" 1
680 1 33 LYS HA 1 37 LYS H . . 4.560 4.448 4.278 4.604 0.044 13 0 "[ . 1 . 2]" 1
681 1 33 LYS HA 1 98 ASP HA . . 4.090 3.528 3.352 3.829 . 0 0 "[ . 1 . 2]" 1
682 1 33 LYS QB 1 34 GLU HA . . 4.470 4.211 4.123 4.322 . 0 0 "[ . 1 . 2]" 1
683 1 33 LYS QB 1 96 ILE MG . . 5.260 4.958 4.756 5.275 0.015 17 0 "[ . 1 . 2]" 1
684 1 33 LYS QB 1 98 ASP H . . 5.100 4.949 4.669 5.126 0.026 12 0 "[ . 1 . 2]" 1
685 1 33 LYS QB 1 99 GLY H . . 4.960 4.456 4.278 4.794 . 0 0 "[ . 1 . 2]" 1
686 1 33 LYS QD 1 34 GLU H . . 4.060 3.842 3.770 4.004 . 0 0 "[ . 1 . 2]" 1
687 1 33 LYS QD 1 99 GLY HA2 . . 4.360 4.237 3.964 4.414 0.054 2 0 "[ . 1 . 2]" 1
688 1 33 LYS QD 1 99 GLY HA3 . . 4.190 3.997 3.670 4.199 0.009 13 0 "[ . 1 . 2]" 1
689 1 33 LYS QE 1 33 LYS QG . . 3.090 2.444 2.311 2.710 . 0 0 "[ . 1 . 2]" 1
690 1 33 LYS QE 1 34 GLU H . . 4.910 4.587 4.035 4.917 0.007 16 0 "[ . 1 . 2]" 1
691 1 33 LYS QE 1 96 ILE MG . . 4.500 4.260 3.686 4.518 0.018 3 0 "[ . 1 . 2]" 1
692 1 33 LYS QE 1 99 GLY H . . 4.930 4.599 3.986 4.868 . 0 0 "[ . 1 . 2]" 1
693 1 33 LYS QE 1 99 GLY HA2 . . 4.180 3.009 2.435 3.353 . 0 0 "[ . 1 . 2]" 1
694 1 33 LYS QE 1 100 ALA H . . 5.500 5.376 4.889 5.534 0.034 16 0 "[ . 1 . 2]" 1
695 1 33 LYS QG 1 34 GLU H . . 3.250 1.908 1.857 2.026 . 0 0 "[ . 1 . 2]" 1
696 1 33 LYS QG 1 34 GLU QB . . 4.210 3.366 3.254 3.428 . 0 0 "[ . 1 . 2]" 1
697 1 33 LYS QG 1 34 GLU HG2 . . 4.430 2.765 2.406 3.401 . 0 0 "[ . 1 . 2]" 1
698 1 34 GLU H 1 34 GLU HA . . 2.890 2.878 2.838 2.908 0.018 5 0 "[ . 1 . 2]" 1
699 1 34 GLU H 1 34 GLU QB . . 2.920 2.845 2.743 2.933 0.013 5 0 "[ . 1 . 2]" 1
700 1 34 GLU H 1 34 GLU HG2 . . 3.050 2.366 2.136 2.670 . 0 0 "[ . 1 . 2]" 1
701 1 34 GLU H 1 34 GLU HG3 . . 3.110 1.921 1.872 2.063 . 0 0 "[ . 1 . 2]" 1
702 1 34 GLU H 1 35 ALA H . . 2.930 2.456 2.308 2.624 . 0 0 "[ . 1 . 2]" 1
703 1 34 GLU H 1 35 ALA HA . . 5.390 5.103 4.979 5.246 . 0 0 "[ . 1 . 2]" 1
704 1 34 GLU H 1 35 ALA MB . . 4.480 4.106 4.019 4.267 . 0 0 "[ . 1 . 2]" 1
705 1 34 GLU H 1 36 GLY H . . 3.960 3.789 3.655 3.855 . 0 0 "[ . 1 . 2]" 1
706 1 34 GLU HA 1 34 GLU QB . . 2.620 2.164 2.159 2.173 . 0 0 "[ . 1 . 2]" 1
707 1 34 GLU HA 1 35 ALA HA . . 4.870 4.775 4.696 4.805 . 0 0 "[ . 1 . 2]" 1
708 1 34 GLU HA 1 36 GLY H . . 4.100 4.107 4.053 4.164 0.064 17 0 "[ . 1 . 2]" 1
709 1 34 GLU QB 1 34 GLU HG3 . . 2.650 2.496 2.446 2.527 . 0 0 "[ . 1 . 2]" 1
710 1 34 GLU QB 1 35 ALA H . . 3.350 3.209 3.114 3.295 . 0 0 "[ . 1 . 2]" 1
711 1 34 GLU QB 1 35 ALA HA . . 4.090 4.030 3.961 4.135 0.045 17 0 "[ . 1 . 2]" 1
712 1 34 GLU QB 1 35 ALA MB . . 4.350 4.273 4.188 4.342 . 0 0 "[ . 1 . 2]" 1
713 1 34 GLU QB 1 36 GLY H . . 4.960 4.826 4.756 4.883 . 0 0 "[ . 1 . 2]" 1
714 1 34 GLU HG2 1 35 ALA H . . 4.060 3.602 3.519 3.665 . 0 0 "[ . 1 . 2]" 1
715 1 34 GLU HG2 1 35 ALA MB . . 5.200 4.805 4.567 4.903 . 0 0 "[ . 1 . 2]" 1
716 1 34 GLU HG3 1 35 ALA H . . 3.920 1.943 1.872 2.028 . 0 0 "[ . 1 . 2]" 1
717 1 34 GLU HG3 1 36 GLY H . . 4.860 4.348 4.064 4.555 . 0 0 "[ . 1 . 2]" 1
718 1 35 ALA H 1 35 ALA HA . . 2.920 2.826 2.809 2.874 . 0 0 "[ . 1 . 2]" 1
719 1 35 ALA H 1 35 ALA MB . . 2.630 2.143 2.035 2.234 . 0 0 "[ . 1 . 2]" 1
720 1 35 ALA H 1 36 GLY H . . 2.840 2.589 2.420 2.647 . 0 0 "[ . 1 . 2]" 1
721 1 35 ALA H 1 36 GLY HA2 . . 5.200 4.886 4.729 4.933 . 0 0 "[ . 1 . 2]" 1
722 1 35 ALA H 1 36 GLY HA3 . . 5.400 5.198 5.079 5.234 . 0 0 "[ . 1 . 2]" 1
723 1 35 ALA H 1 37 LYS H . . 4.300 4.241 4.057 4.333 0.033 10 0 "[ . 1 . 2]" 1
724 1 35 ALA H 1 37 LYS QE . . 5.390 5.280 5.105 5.420 0.030 8 0 "[ . 1 . 2]" 1
725 1 35 ALA HA 1 36 GLY H . . 3.570 3.486 3.445 3.505 . 0 0 "[ . 1 . 2]" 1
726 1 35 ALA HA 1 37 LYS H . . 5.100 5.043 4.924 5.120 0.020 13 0 "[ . 1 . 2]" 1
727 1 35 ALA HA 1 37 LYS QE . . 4.820 4.629 4.358 4.852 0.032 12 0 "[ . 1 . 2]" 1
728 1 35 ALA MB 1 36 GLY H . . 3.280 2.845 2.724 3.020 . 0 0 "[ . 1 . 2]" 1
729 1 35 ALA MB 1 36 GLY HA2 . . 4.680 4.537 4.486 4.605 . 0 0 "[ . 1 . 2]" 1
730 1 35 ALA MB 1 36 GLY HA3 . . 4.570 4.278 4.253 4.319 . 0 0 "[ . 1 . 2]" 1
731 1 35 ALA MB 1 37 LYS H . . 3.220 3.093 2.996 3.238 0.018 14 0 "[ . 1 . 2]" 1
732 1 35 ALA MB 1 37 LYS HA . . 5.040 4.923 4.813 5.003 . 0 0 "[ . 1 . 2]" 1
733 1 35 ALA MB 1 37 LYS HB3 . . 4.100 3.318 2.964 3.644 . 0 0 "[ . 1 . 2]" 1
734 1 35 ALA MB 1 37 LYS QE . . 2.680 2.274 2.123 2.446 . 0 0 "[ . 1 . 2]" 1
735 1 36 GLY H 1 37 LYS H . . 2.910 2.349 2.302 2.452 . 0 0 "[ . 1 . 2]" 1
736 1 36 GLY H 1 37 LYS HA . . 5.470 5.042 5.003 5.114 . 0 0 "[ . 1 . 2]" 1
737 1 36 GLY H 1 37 LYS HB3 . . 4.830 4.733 4.579 4.861 0.031 4 0 "[ . 1 . 2]" 1
738 1 36 GLY H 1 37 LYS QE . . 5.010 4.823 4.510 5.048 0.038 2 0 "[ . 1 . 2]" 1
739 1 36 GLY HA2 1 37 LYS HA . . 4.520 4.420 4.390 4.453 . 0 0 "[ . 1 . 2]" 1
740 1 36 GLY HA3 1 37 LYS H . . 3.540 3.517 3.497 3.530 . 0 0 "[ . 1 . 2]" 1
741 1 37 LYS H 1 37 LYS HB3 . . 3.290 3.011 2.819 3.166 . 0 0 "[ . 1 . 2]" 1
742 1 37 LYS H 1 37 LYS QD . . 4.580 3.657 3.041 4.391 . 0 0 "[ . 1 . 2]" 1
743 1 37 LYS H 1 37 LYS QE . . 4.000 3.865 3.681 4.011 0.011 14 0 "[ . 1 . 2]" 1
744 1 37 LYS H 1 37 LYS HG2 . . 3.360 2.457 2.280 2.666 . 0 0 "[ . 1 . 2]" 1
745 1 37 LYS H 1 37 LYS HG3 . . 4.620 3.792 3.409 4.117 . 0 0 "[ . 1 . 2]" 1
746 1 37 LYS H 1 38 VAL H . . 4.470 4.454 4.422 4.485 0.015 9 0 "[ . 1 . 2]" 1
747 1 37 LYS H 1 68 ALA HA . . 5.500 5.512 5.397 5.614 0.114 12 0 "[ . 1 . 2]" 1
748 1 37 LYS HA 1 37 LYS QE . . 4.530 4.027 3.992 4.119 . 0 0 "[ . 1 . 2]" 1
749 1 37 LYS HA 1 38 VAL H . . 2.880 2.369 2.268 2.474 . 0 0 "[ . 1 . 2]" 1
750 1 37 LYS HB2 1 37 LYS QE . . 3.060 2.535 2.243 2.904 . 0 0 "[ . 1 . 2]" 1
751 1 37 LYS HB2 1 38 VAL H . . 3.230 2.604 2.426 2.902 . 0 0 "[ . 1 . 2]" 1
752 1 37 LYS HB2 1 67 GLY H . . 5.240 5.174 5.023 5.257 0.017 13 0 "[ . 1 . 2]" 1
753 1 37 LYS HB2 1 68 ALA HA . . 3.810 2.548 2.287 2.866 . 0 0 "[ . 1 . 2]" 1
754 1 37 LYS HB2 1 68 ALA MB . . 4.270 3.986 3.807 4.227 . 0 0 "[ . 1 . 2]" 1
755 1 37 LYS HB2 1 69 VAL H . . 5.160 4.566 4.260 4.928 . 0 0 "[ . 1 . 2]" 1
756 1 37 LYS HB3 1 37 LYS QD . . 3.580 2.738 2.577 2.940 . 0 0 "[ . 1 . 2]" 1
757 1 37 LYS HB3 1 37 LYS QE . . 3.510 1.903 1.874 1.987 . 0 0 "[ . 1 . 2]" 1
758 1 37 LYS HB3 1 68 ALA HA . . 4.560 4.087 3.925 4.290 . 0 0 "[ . 1 . 2]" 1
759 1 37 LYS QD 1 68 ALA H . . 4.670 3.999 2.991 4.717 0.047 14 0 "[ . 1 . 2]" 1
760 1 37 LYS QD 1 68 ALA HA . . 4.530 3.397 2.696 3.953 . 0 0 "[ . 1 . 2]" 1
761 1 37 LYS QD 1 69 VAL MG2 . . 4.040 3.902 3.686 4.091 0.051 17 0 "[ . 1 . 2]" 1
762 1 37 LYS QD 1 70 PHE H . . 5.500 5.252 4.846 5.615 0.115 16 0 "[ . 1 . 2]" 1
763 1 37 LYS QE 1 38 VAL H . . 5.500 4.844 4.509 5.183 . 0 0 "[ . 1 . 2]" 1
764 1 37 LYS QE 1 67 GLY H . . 5.500 5.151 4.983 5.416 . 0 0 "[ . 1 . 2]" 1
765 1 37 LYS QE 1 67 GLY HA2 . . 3.920 3.261 3.083 3.468 . 0 0 "[ . 1 . 2]" 1
766 1 37 LYS QE 1 67 GLY HA3 . . 5.030 4.731 4.516 4.998 . 0 0 "[ . 1 . 2]" 1
767 1 37 LYS QE 1 68 ALA H . . 4.480 3.509 3.197 3.878 . 0 0 "[ . 1 . 2]" 1
768 1 37 LYS QE 1 69 VAL H . . 5.310 4.980 4.755 5.248 . 0 0 "[ . 1 . 2]" 1
769 1 37 LYS QE 1 69 VAL HA . . 4.680 4.634 4.460 4.767 0.087 11 0 "[ . 1 . 2]" 1
770 1 37 LYS HG2 1 38 VAL H . . 4.570 4.122 3.627 4.618 0.048 13 0 "[ . 1 . 2]" 1
771 1 37 LYS HG2 1 68 ALA HA . . 4.390 3.772 3.365 4.186 . 0 0 "[ . 1 . 2]" 1
772 1 37 LYS HG2 1 69 VAL MG1 . . 3.250 2.494 2.210 2.674 . 0 0 "[ . 1 . 2]" 1
773 1 37 LYS HG2 1 69 VAL MG2 . . 4.900 4.361 3.803 4.631 . 0 0 "[ . 1 . 2]" 1
774 1 37 LYS HG3 1 69 VAL HA . . 4.150 4.073 3.764 4.216 0.066 19 0 "[ . 1 . 2]" 1
775 1 37 LYS HG3 1 69 VAL MG2 . . 5.420 3.773 3.350 4.084 . 0 0 "[ . 1 . 2]" 1
776 1 37 LYS HG3 1 70 PHE H . . 5.150 5.098 4.914 5.187 0.037 13 0 "[ . 1 . 2]" 1
777 1 37 LYS HG3 1 121 VAL MG2 . . 5.420 5.282 5.062 5.455 0.035 4 0 "[ . 1 . 2]" 1
778 1 38 VAL H 1 38 VAL HB . . 2.900 2.126 2.102 2.166 . 0 0 "[ . 1 . 2]" 1
779 1 38 VAL H 1 38 VAL MG1 . . 3.600 3.354 3.253 3.499 . 0 0 "[ . 1 . 2]" 1
780 1 38 VAL H 1 38 VAL MG2 . . 3.470 3.218 3.070 3.352 . 0 0 "[ . 1 . 2]" 1
781 1 38 VAL H 1 39 VAL H . . 4.740 4.618 4.597 4.631 . 0 0 "[ . 1 . 2]" 1
782 1 38 VAL H 1 40 ILE MD . . 5.310 4.660 4.515 4.804 . 0 0 "[ . 1 . 2]" 1
783 1 38 VAL H 1 68 ALA HA . . 3.880 3.012 2.804 3.243 . 0 0 "[ . 1 . 2]" 1
784 1 38 VAL H 1 68 ALA MB . . 4.210 3.658 3.518 3.881 . 0 0 "[ . 1 . 2]" 1
785 1 38 VAL H 1 69 VAL H . . 5.250 4.978 4.836 5.159 . 0 0 "[ . 1 . 2]" 1
786 1 38 VAL H 1 121 VAL HA . . 4.820 3.876 3.786 3.988 . 0 0 "[ . 1 . 2]" 1
787 1 38 VAL H 1 121 VAL MG1 . . 4.540 3.508 3.418 3.662 . 0 0 "[ . 1 . 2]" 1
788 1 38 VAL HA 1 38 VAL MG1 . . 3.060 2.873 2.756 2.949 . 0 0 "[ . 1 . 2]" 1
789 1 38 VAL HA 1 38 VAL MG2 . . 3.170 1.992 1.948 2.058 . 0 0 "[ . 1 . 2]" 1
790 1 38 VAL HA 1 39 VAL H . . 2.760 2.382 2.357 2.399 . 0 0 "[ . 1 . 2]" 1
791 1 38 VAL HA 1 39 VAL HB . . 4.620 4.485 4.402 4.547 . 0 0 "[ . 1 . 2]" 1
792 1 38 VAL HA 1 39 VAL QG . . 4.220 3.615 3.425 3.793 . 0 0 "[ . 1 . 2]" 1
793 1 38 VAL HA 1 40 ILE MD . . 5.380 4.772 4.699 5.006 . 0 0 "[ . 1 . 2]" 1
794 1 38 VAL HA 1 68 ALA HA . . 4.960 4.650 4.569 4.795 . 0 0 "[ . 1 . 2]" 1
795 1 38 VAL HA 1 68 ALA MB . . 5.320 4.686 4.564 4.815 . 0 0 "[ . 1 . 2]" 1
796 1 38 VAL HA 1 69 VAL H . . 5.500 5.484 5.308 5.543 0.043 12 0 "[ . 1 . 2]" 1
797 1 38 VAL HA 1 96 ILE H . . 5.480 5.258 5.000 5.444 . 0 0 "[ . 1 . 2]" 1
798 1 38 VAL HA 1 97 LYS HA . . 3.730 2.645 2.393 2.821 . 0 0 "[ . 1 . 2]" 1
799 1 38 VAL HA 1 97 LYS HB2 . . 4.550 3.741 3.488 3.977 . 0 0 "[ . 1 . 2]" 1
800 1 38 VAL HA 1 97 LYS HB3 . . 5.500 5.158 4.912 5.385 . 0 0 "[ . 1 . 2]" 1
801 1 38 VAL HA 1 98 ASP H . . 4.320 3.523 3.381 3.655 . 0 0 "[ . 1 . 2]" 1
802 1 38 VAL HB 1 39 VAL H . . 4.180 3.998 3.967 4.031 . 0 0 "[ . 1 . 2]" 1
803 1 38 VAL HB 1 40 ILE MD . . 4.480 3.905 3.788 4.023 . 0 0 "[ . 1 . 2]" 1
804 1 38 VAL HB 1 68 ALA HA . . 4.420 3.876 3.707 4.081 . 0 0 "[ . 1 . 2]" 1
805 1 38 VAL HB 1 68 ALA MB . . 3.640 3.289 3.056 3.495 . 0 0 "[ . 1 . 2]" 1
806 1 38 VAL HB 1 97 LYS HA . . 5.500 5.024 4.873 5.147 . 0 0 "[ . 1 . 2]" 1
807 1 38 VAL HB 1 121 VAL H . . 5.130 4.276 4.185 4.375 . 0 0 "[ . 1 . 2]" 1
808 1 38 VAL HB 1 121 VAL HA . . 5.220 2.811 2.723 2.910 . 0 0 "[ . 1 . 2]" 1
809 1 38 VAL HB 1 121 VAL MG2 . . 3.340 2.235 2.055 2.449 . 0 0 "[ . 1 . 2]" 1
810 1 38 VAL MG1 1 39 VAL H . . 3.370 1.963 1.848 2.065 . 0 0 "[ . 1 . 2]" 1
811 1 38 VAL MG1 1 39 VAL QG . . 4.120 3.661 3.606 3.701 . 0 0 "[ . 1 . 2]" 1
812 1 38 VAL MG1 1 40 ILE MD . . 4.310 1.901 1.854 2.078 . 0 0 "[ . 1 . 2]" 1
813 1 38 VAL MG1 1 40 ILE QG . . 4.460 2.486 2.341 2.597 . 0 0 "[ . 1 . 2]" 1
814 1 38 VAL MG1 1 40 ILE MG . . 4.470 4.357 4.265 4.442 . 0 0 "[ . 1 . 2]" 1
815 1 38 VAL MG1 1 68 ALA HA . . 4.320 3.306 3.205 3.546 . 0 0 "[ . 1 . 2]" 1
816 1 38 VAL MG1 1 68 ALA MB . . 3.270 2.021 1.938 2.309 . 0 0 "[ . 1 . 2]" 1
817 1 38 VAL MG1 1 69 VAL H . . 4.280 3.846 3.758 3.948 . 0 0 "[ . 1 . 2]" 1
818 1 38 VAL MG1 1 95 PHE HA . . 4.990 4.365 4.135 4.573 . 0 0 "[ . 1 . 2]" 1
819 1 38 VAL MG1 1 95 PHE QD . . 4.460 2.434 2.232 2.567 . 0 0 "[ . 1 . 2]" 1
820 1 38 VAL MG1 1 96 ILE H . . 4.610 3.703 3.374 3.908 . 0 0 "[ . 1 . 2]" 1
821 1 38 VAL MG1 1 97 LYS HA . . 4.080 3.924 3.648 4.046 . 0 0 "[ . 1 . 2]" 1
822 1 38 VAL MG1 1 97 LYS HB2 . . 4.220 3.715 3.443 3.902 . 0 0 "[ . 1 . 2]" 1
823 1 38 VAL MG1 1 97 LYS QE . . 4.400 4.154 3.866 4.404 0.004 15 0 "[ . 1 . 2]" 1
824 1 38 VAL MG1 1 98 ASP H . . 5.500 5.451 5.249 5.521 0.021 19 0 "[ . 1 . 2]" 1
825 1 38 VAL MG1 1 117 ILE HA . . 4.550 3.868 3.776 4.052 . 0 0 "[ . 1 . 2]" 1
826 1 38 VAL MG1 1 120 HIS H . . 4.680 4.582 4.521 4.665 . 0 0 "[ . 1 . 2]" 1
827 1 38 VAL MG1 1 120 HIS HA . . 4.360 4.357 4.215 4.427 0.067 15 0 "[ . 1 . 2]" 1
828 1 38 VAL MG1 1 120 HIS HB2 . . 3.830 2.388 2.332 2.496 . 0 0 "[ . 1 . 2]" 1
829 1 38 VAL MG1 1 120 HIS HB3 . . 4.790 2.527 2.371 2.628 . 0 0 "[ . 1 . 2]" 1
830 1 38 VAL MG1 1 121 VAL H . . 4.250 3.488 3.401 3.672 . 0 0 "[ . 1 . 2]" 1
831 1 38 VAL MG1 1 121 VAL HA . . 4.120 3.686 3.516 3.879 . 0 0 "[ . 1 . 2]" 1
832 1 38 VAL MG1 1 121 VAL MG1 . . 3.610 3.491 3.342 3.635 0.025 13 0 "[ . 1 . 2]" 1
833 1 38 VAL MG2 1 39 VAL H . . 3.190 2.870 2.684 3.148 . 0 0 "[ . 1 . 2]" 1
834 1 38 VAL MG2 1 68 ALA HA . . 5.500 5.058 4.968 5.187 . 0 0 "[ . 1 . 2]" 1
835 1 38 VAL MG2 1 95 PHE HB2 . . 5.270 5.282 5.173 5.307 0.037 13 0 "[ . 1 . 2]" 1
836 1 38 VAL MG2 1 95 PHE QD . . 4.050 3.664 3.489 3.798 . 0 0 "[ . 1 . 2]" 1
837 1 38 VAL MG2 1 95 PHE QE . . 5.260 5.083 4.865 5.253 . 0 0 "[ . 1 . 2]" 1
838 1 38 VAL MG2 1 96 ILE H . . 4.870 4.560 4.278 4.743 . 0 0 "[ . 1 . 2]" 1
839 1 38 VAL MG2 1 97 LYS HA . . 3.910 2.608 2.389 2.813 . 0 0 "[ . 1 . 2]" 1
840 1 38 VAL MG2 1 97 LYS HB2 . . 4.250 1.964 1.847 2.153 . 0 0 "[ . 1 . 2]" 1
841 1 38 VAL MG2 1 97 LYS HB3 . . 4.670 3.423 3.286 3.631 . 0 0 "[ . 1 . 2]" 1
842 1 38 VAL MG2 1 97 LYS QD . . 4.170 2.595 1.834 3.671 . 0 0 "[ . 1 . 2]" 1
843 1 38 VAL MG2 1 97 LYS QG . . 4.160 2.565 1.930 3.152 . 0 0 "[ . 1 . 2]" 1
844 1 38 VAL MG2 1 120 HIS H . . 4.750 4.636 4.489 4.770 0.020 20 0 "[ . 1 . 2]" 1
845 1 38 VAL MG2 1 120 HIS HA . . 4.060 3.023 2.902 3.122 . 0 0 "[ . 1 . 2]" 1
846 1 38 VAL MG2 1 120 HIS HB2 . . 3.740 3.038 2.920 3.201 . 0 0 "[ . 1 . 2]" 1
847 1 38 VAL MG2 1 120 HIS HB3 . . 3.750 1.886 1.814 1.998 . 0 0 "[ . 1 . 2]" 1
848 1 38 VAL MG2 1 120 HIS HD2 . . 4.690 4.522 4.402 4.692 0.002 20 0 "[ . 1 . 2]" 1
849 1 38 VAL MG2 1 121 VAL HA . . 3.920 3.414 3.278 3.703 . 0 0 "[ . 1 . 2]" 1
850 1 39 VAL H 1 39 VAL HB . . 3.300 2.507 2.460 2.589 . 0 0 "[ . 1 . 2]" 1
851 1 39 VAL H 1 39 VAL MG1 . . 3.920 3.750 3.689 3.819 . 0 0 "[ . 1 . 2]" 1
852 1 39 VAL H 1 39 VAL QG . . 3.350 2.844 2.761 2.947 . 0 0 "[ . 1 . 2]" 1
853 1 39 VAL H 1 39 VAL MG2 . . 3.920 2.948 2.840 3.098 . 0 0 "[ . 1 . 2]" 1
854 1 39 VAL H 1 40 ILE H . . 4.530 4.493 4.472 4.507 . 0 0 "[ . 1 . 2]" 1
855 1 39 VAL H 1 40 ILE HA . . 5.320 5.061 4.993 5.094 . 0 0 "[ . 1 . 2]" 1
856 1 39 VAL H 1 40 ILE MD . . 4.570 3.807 3.665 4.171 . 0 0 "[ . 1 . 2]" 1
857 1 39 VAL H 1 40 ILE QG . . 5.050 4.113 3.941 4.229 . 0 0 "[ . 1 . 2]" 1
858 1 39 VAL H 1 95 PHE HA . . 4.890 4.690 4.516 4.850 . 0 0 "[ . 1 . 2]" 1
859 1 39 VAL H 1 95 PHE QD . . 4.860 4.144 3.961 4.323 . 0 0 "[ . 1 . 2]" 1
860 1 39 VAL H 1 96 ILE H . . 3.440 3.027 2.838 3.179 . 0 0 "[ . 1 . 2]" 1
861 1 39 VAL H 1 96 ILE HB . . 4.340 4.234 4.114 4.306 . 0 0 "[ . 1 . 2]" 1
862 1 39 VAL H 1 96 ILE QG . . 5.500 5.093 4.941 5.194 . 0 0 "[ . 1 . 2]" 1
863 1 39 VAL H 1 96 ILE MG . . 5.150 5.032 4.931 5.106 . 0 0 "[ . 1 . 2]" 1
864 1 39 VAL H 1 97 LYS H . . 4.580 4.196 3.995 4.320 . 0 0 "[ . 1 . 2]" 1
865 1 39 VAL H 1 97 LYS HA . . 3.850 2.964 2.794 3.085 . 0 0 "[ . 1 . 2]" 1
866 1 39 VAL H 1 97 LYS HB2 . . 4.610 3.924 3.727 4.049 . 0 0 "[ . 1 . 2]" 1
867 1 39 VAL H 1 98 ASP H . . 5.180 4.552 4.447 4.697 . 0 0 "[ . 1 . 2]" 1
868 1 39 VAL HA 1 39 VAL MG1 . . 3.240 2.501 2.387 2.577 . 0 0 "[ . 1 . 2]" 1
869 1 39 VAL HA 1 39 VAL MG2 . . 3.240 2.214 2.102 2.373 . 0 0 "[ . 1 . 2]" 1
870 1 39 VAL HA 1 40 ILE H . . 2.920 2.248 2.221 2.296 . 0 0 "[ . 1 . 2]" 1
871 1 39 VAL HA 1 40 ILE MD . . 3.970 2.817 2.675 3.100 . 0 0 "[ . 1 . 2]" 1
872 1 39 VAL HA 1 40 ILE QG . . 5.300 3.946 3.730 4.027 . 0 0 "[ . 1 . 2]" 1
873 1 39 VAL HA 1 40 ILE MG . . 5.500 5.420 5.413 5.426 . 0 0 "[ . 1 . 2]" 1
874 1 39 VAL HA 1 41 ILE H . . 5.500 5.525 5.489 5.562 0.062 17 0 "[ . 1 . 2]" 1
875 1 39 VAL HA 1 68 ALA HA . . 4.410 4.220 4.049 4.410 . 0 0 "[ . 1 . 2]" 1
876 1 39 VAL HA 1 68 ALA MB . . 4.020 3.718 3.556 3.850 . 0 0 "[ . 1 . 2]" 1
877 1 39 VAL HA 1 69 VAL MG1 . . 4.070 3.690 3.380 3.939 . 0 0 "[ . 1 . 2]" 1
878 1 39 VAL HA 1 70 PHE H . . 3.430 3.175 2.859 3.360 . 0 0 "[ . 1 . 2]" 1
879 1 39 VAL HB 1 40 ILE H . . 4.090 4.010 3.915 4.070 . 0 0 "[ . 1 . 2]" 1
880 1 39 VAL HB 1 40 ILE MD . . 5.500 4.879 4.722 5.227 . 0 0 "[ . 1 . 2]" 1
881 1 39 VAL HB 1 96 ILE H . . 3.660 2.202 1.950 2.382 . 0 0 "[ . 1 . 2]" 1
882 1 39 VAL HB 1 96 ILE HB . . 3.710 1.967 1.946 1.984 . 0 0 "[ . 1 . 2]" 1
883 1 39 VAL HB 1 96 ILE QG . . 4.000 3.190 2.983 3.330 . 0 0 "[ . 1 . 2]" 1
884 1 39 VAL HB 1 96 ILE MG . . 3.640 3.569 3.497 3.656 0.016 12 0 "[ . 1 . 2]" 1
885 1 39 VAL QG 1 40 ILE HA . . 3.640 3.139 3.039 3.408 . 0 0 "[ . 1 . 2]" 1
886 1 39 VAL QG 1 40 ILE MD . . 4.610 3.704 3.587 3.930 . 0 0 "[ . 1 . 2]" 1
887 1 39 VAL QG 1 41 ILE HG13 . . 3.190 2.165 2.135 2.207 . 0 0 "[ . 1 . 2]" 1
888 1 39 VAL QG 1 41 ILE MG . . 4.000 3.903 3.821 4.051 0.051 18 0 "[ . 1 . 2]" 1
889 1 39 VAL QG 1 68 ALA HA . . 5.440 4.670 4.484 4.857 . 0 0 "[ . 1 . 2]" 1
890 1 39 VAL QG 1 69 VAL H . . 4.510 3.562 3.275 3.809 . 0 0 "[ . 1 . 2]" 1
891 1 39 VAL QG 1 69 VAL MG2 . . 3.250 1.830 1.772 1.882 . 0 0 "[ . 1 . 2]" 1
892 1 39 VAL QG 1 70 PHE H . . 4.460 3.698 3.423 3.910 . 0 0 "[ . 1 . 2]" 1
893 1 39 VAL QG 1 95 PHE HA . . 4.580 3.228 3.001 3.745 . 0 0 "[ . 1 . 2]" 1
894 1 39 VAL QG 1 96 ILE H . . 3.220 2.698 2.389 3.115 . 0 0 "[ . 1 . 2]" 1
895 1 39 VAL QG 1 96 ILE HB . . 3.270 2.206 2.002 2.504 . 0 0 "[ . 1 . 2]" 1
896 1 39 VAL QG 1 96 ILE QG . . 3.330 2.353 2.183 2.584 . 0 0 "[ . 1 . 2]" 1
897 1 39 VAL MG1 1 40 ILE H . . 3.670 2.137 1.830 2.249 . 0 0 "[ . 1 . 2]" 1
898 1 39 VAL MG1 1 96 ILE H . . 3.970 2.754 2.419 3.256 . 0 0 "[ . 1 . 2]" 1
899 1 39 VAL MG2 1 40 ILE H . . 3.670 3.666 3.562 3.789 0.119 17 0 "[ . 1 . 2]" 1
900 1 39 VAL MG2 1 96 ILE H . . 3.970 3.902 3.705 4.038 0.068 20 0 "[ . 1 . 2]" 1
901 1 40 ILE H 1 40 ILE HB . . 3.930 2.891 2.828 2.913 . 0 0 "[ . 1 . 2]" 1
902 1 40 ILE H 1 40 ILE MD . . 3.610 2.809 2.649 2.912 . 0 0 "[ . 1 . 2]" 1
903 1 40 ILE H 1 40 ILE QG . . 3.820 3.338 3.145 3.443 . 0 0 "[ . 1 . 2]" 1
904 1 40 ILE H 1 40 ILE MG . . 4.020 3.954 3.930 3.963 . 0 0 "[ . 1 . 2]" 1
905 1 40 ILE H 1 41 ILE MG . . 5.500 5.352 5.266 5.463 . 0 0 "[ . 1 . 2]" 1
906 1 40 ILE H 1 68 ALA MB . . 4.470 4.116 3.994 4.195 . 0 0 "[ . 1 . 2]" 1
907 1 40 ILE H 1 69 VAL H . . 4.000 3.802 3.676 3.914 . 0 0 "[ . 1 . 2]" 1
908 1 40 ILE H 1 69 VAL MG2 . . 3.350 2.538 2.421 2.691 . 0 0 "[ . 1 . 2]" 1
909 1 40 ILE H 1 70 PHE H . . 4.890 2.662 2.521 2.792 . 0 0 "[ . 1 . 2]" 1
910 1 40 ILE H 1 70 PHE HA . . 3.730 2.987 2.570 3.197 . 0 0 "[ . 1 . 2]" 1
911 1 40 ILE H 1 95 PHE HA . . 4.830 4.625 4.549 4.696 . 0 0 "[ . 1 . 2]" 1
912 1 40 ILE H 1 96 ILE H . . 4.880 4.605 4.471 4.728 . 0 0 "[ . 1 . 2]" 1
913 1 40 ILE H 1 96 ILE QG . . 5.160 5.168 5.066 5.308 0.148 17 0 "[ . 1 . 2]" 1
914 1 40 ILE HA 1 40 ILE MD . . 3.810 3.569 3.496 3.721 . 0 0 "[ . 1 . 2]" 1
915 1 40 ILE HA 1 40 ILE HG12 . . 4.160 3.460 3.357 3.520 . 0 0 "[ . 1 . 2]" 1
916 1 40 ILE HA 1 40 ILE HG13 . . 4.160 2.429 2.401 2.500 . 0 0 "[ . 1 . 2]" 1
917 1 40 ILE HA 1 40 ILE MG . . 3.430 2.230 2.199 2.257 . 0 0 "[ . 1 . 2]" 1
918 1 40 ILE HA 1 41 ILE H . . 2.950 2.208 2.195 2.222 . 0 0 "[ . 1 . 2]" 1
919 1 40 ILE HA 1 41 ILE MD . . 4.060 3.382 3.145 3.671 . 0 0 "[ . 1 . 2]" 1
920 1 40 ILE HA 1 41 ILE HG13 . . 4.290 3.876 3.746 4.010 . 0 0 "[ . 1 . 2]" 1
921 1 40 ILE HA 1 70 PHE HA . . 4.910 4.500 4.301 4.620 . 0 0 "[ . 1 . 2]" 1
922 1 40 ILE HA 1 93 PHE QD . . 4.960 4.003 3.667 4.667 . 0 0 "[ . 1 . 2]" 1
923 1 40 ILE HA 1 95 PHE H . . 5.200 5.068 5.008 5.136 . 0 0 "[ . 1 . 2]" 1
924 1 40 ILE HA 1 95 PHE HA . . 3.790 2.553 2.494 2.643 . 0 0 "[ . 1 . 2]" 1
925 1 40 ILE HA 1 95 PHE QD . . 4.530 3.503 3.386 3.589 . 0 0 "[ . 1 . 2]" 1
926 1 40 ILE HA 1 95 PHE QE . . 5.270 4.060 3.987 4.132 . 0 0 "[ . 1 . 2]" 1
927 1 40 ILE HA 1 96 ILE H . . 4.250 3.911 3.856 3.980 . 0 0 "[ . 1 . 2]" 1
928 1 40 ILE HB 1 40 ILE MD . . 3.250 2.079 2.055 2.115 . 0 0 "[ . 1 . 2]" 1
929 1 40 ILE HB 1 41 ILE H . . 4.570 4.401 4.384 4.421 . 0 0 "[ . 1 . 2]" 1
930 1 40 ILE HB 1 70 PHE H . . 3.630 3.294 3.216 3.462 . 0 0 "[ . 1 . 2]" 1
931 1 40 ILE HB 1 70 PHE HA . . 3.750 2.104 2.008 2.165 . 0 0 "[ . 1 . 2]" 1
932 1 40 ILE HB 1 70 PHE HB2 . . 5.500 4.682 4.593 4.748 . 0 0 "[ . 1 . 2]" 1
933 1 40 ILE HB 1 71 LEU H . . 3.810 3.726 3.523 3.832 0.022 11 0 "[ . 1 . 2]" 1
934 1 40 ILE MD 1 62 ALA MB . . 4.860 4.840 4.652 4.885 0.025 6 0 "[ . 1 . 2]" 1
935 1 40 ILE MD 1 65 PHE QB . . 4.180 3.971 3.867 4.015 . 0 0 "[ . 1 . 2]" 1
936 1 40 ILE MD 1 65 PHE QD . . 5.090 5.112 4.987 5.168 0.078 20 0 "[ . 1 . 2]" 1
937 1 40 ILE MD 1 68 ALA H . . 4.760 4.578 4.501 4.663 . 0 0 "[ . 1 . 2]" 1
938 1 40 ILE MD 1 68 ALA HA . . 4.160 3.329 3.280 3.470 . 0 0 "[ . 1 . 2]" 1
939 1 40 ILE MD 1 68 ALA MB . . 3.090 1.602 1.586 1.686 . 0 0 "[ . 1 . 2]" 1
940 1 40 ILE MD 1 69 VAL H . . 4.150 2.903 2.784 3.016 . 0 0 "[ . 1 . 2]" 1
941 1 40 ILE MD 1 69 VAL HA . . 4.860 4.922 4.874 4.958 0.098 17 0 "[ . 1 . 2]" 1
942 1 40 ILE MD 1 69 VAL MG1 . . 4.920 4.593 4.396 4.799 . 0 0 "[ . 1 . 2]" 1
943 1 40 ILE MD 1 70 PHE H . . 4.890 2.527 2.410 2.606 . 0 0 "[ . 1 . 2]" 1
944 1 40 ILE MD 1 70 PHE HA . . 4.390 2.893 2.710 2.984 . 0 0 "[ . 1 . 2]" 1
945 1 40 ILE MD 1 70 PHE HB2 . . 4.880 4.263 4.143 4.312 . 0 0 "[ . 1 . 2]" 1
946 1 40 ILE MD 1 70 PHE QD . . 4.560 3.023 2.885 3.132 . 0 0 "[ . 1 . 2]" 1
947 1 40 ILE MD 1 70 PHE QE . . 3.650 2.989 2.815 3.129 . 0 0 "[ . 1 . 2]" 1
948 1 40 ILE MD 1 70 PHE HZ . . 3.690 3.272 3.135 3.404 . 0 0 "[ . 1 . 2]" 1
949 1 40 ILE MD 1 71 LEU H . . 4.980 4.857 4.716 4.932 . 0 0 "[ . 1 . 2]" 1
950 1 40 ILE MD 1 93 PHE QD . . 5.380 5.224 5.007 5.307 . 0 0 "[ . 1 . 2]" 1
951 1 40 ILE MD 1 95 PHE QD . . 4.250 3.641 3.531 3.861 . 0 0 "[ . 1 . 2]" 1
952 1 40 ILE MD 1 95 PHE QE . . 3.610 3.289 3.125 3.381 . 0 0 "[ . 1 . 2]" 1
953 1 40 ILE MD 1 96 ILE H . . 5.500 5.053 4.889 5.379 . 0 0 "[ . 1 . 2]" 1
954 1 40 ILE MD 1 117 ILE HA . . 4.270 3.977 3.927 4.027 . 0 0 "[ . 1 . 2]" 1
955 1 40 ILE MD 1 117 ILE HB . . 5.500 5.243 5.155 5.315 . 0 0 "[ . 1 . 2]" 1
956 1 40 ILE MD 1 117 ILE MD . . 4.100 4.078 3.963 4.124 0.024 9 0 "[ . 1 . 2]" 1
957 1 40 ILE MD 1 117 ILE QG . . 3.690 2.884 2.780 2.928 . 0 0 "[ . 1 . 2]" 1
958 1 40 ILE MD 1 117 ILE MG . . 3.860 3.245 3.161 3.362 . 0 0 "[ . 1 . 2]" 1
959 1 40 ILE MD 1 120 HIS HB2 . . 5.260 4.454 4.381 4.536 . 0 0 "[ . 1 . 2]" 1
960 1 40 ILE MD 1 121 VAL MG1 . . 3.330 3.393 3.281 3.444 0.114 13 0 "[ . 1 . 2]" 1
961 1 40 ILE MD 1 121 VAL MG2 . . 3.530 1.964 1.883 2.035 . 0 0 "[ . 1 . 2]" 1
962 1 40 ILE QG 1 40 ILE MG . . 3.170 1.943 1.917 1.983 . 0 0 "[ . 1 . 2]" 1
963 1 40 ILE QG 1 41 ILE H . . 4.800 4.408 4.387 4.431 . 0 0 "[ . 1 . 2]" 1
964 1 40 ILE QG 1 68 ALA MB . . 3.550 3.253 3.161 3.342 . 0 0 "[ . 1 . 2]" 1
965 1 40 ILE QG 1 95 PHE QD . . 4.060 2.295 2.180 2.480 . 0 0 "[ . 1 . 2]" 1
966 1 40 ILE QG 1 95 PHE QE . . 4.010 1.927 1.892 1.948 . 0 0 "[ . 1 . 2]" 1
967 1 40 ILE QG 1 96 ILE H . . 4.790 4.390 4.315 4.460 . 0 0 "[ . 1 . 2]" 1
968 1 40 ILE HG12 1 40 ILE MG . . 3.730 1.981 1.952 2.026 . 0 0 "[ . 1 . 2]" 1
969 1 40 ILE HG12 1 68 ALA MB . . 4.290 3.658 3.628 3.766 . 0 0 "[ . 1 . 2]" 1
970 1 40 ILE HG12 1 95 PHE QD . . 4.670 3.310 3.195 3.458 . 0 0 "[ . 1 . 2]" 1
971 1 40 ILE HG12 1 95 PHE QE . . 4.590 1.984 1.961 2.001 . 0 0 "[ . 1 . 2]" 1
972 1 40 ILE HG13 1 40 ILE MG . . 3.730 2.806 2.758 2.905 . 0 0 "[ . 1 . 2]" 1
973 1 40 ILE HG13 1 68 ALA MB . . 4.290 3.647 3.447 3.743 . 0 0 "[ . 1 . 2]" 1
974 1 40 ILE HG13 1 95 PHE QD . . 4.670 2.342 2.209 2.584 . 0 0 "[ . 1 . 2]" 1
975 1 40 ILE HG13 1 95 PHE QE . . 4.590 2.630 2.451 2.927 . 0 0 "[ . 1 . 2]" 1
976 1 40 ILE MG 1 41 ILE H . . 3.400 3.239 3.140 3.326 . 0 0 "[ . 1 . 2]" 1
977 1 40 ILE MG 1 42 ASP H . . 4.870 4.479 4.288 4.638 . 0 0 "[ . 1 . 2]" 1
978 1 40 ILE MG 1 42 ASP HA . . 4.670 4.501 4.324 4.598 . 0 0 "[ . 1 . 2]" 1
979 1 40 ILE MG 1 42 ASP QB . . 5.340 4.102 3.810 4.636 . 0 0 "[ . 1 . 2]" 1
980 1 40 ILE MG 1 70 PHE HA . . 4.670 3.475 3.400 3.544 . 0 0 "[ . 1 . 2]" 1
981 1 40 ILE MG 1 70 PHE HB2 . . 5.500 5.507 5.429 5.547 0.047 6 0 "[ . 1 . 2]" 1
982 1 40 ILE MG 1 70 PHE QD . . 4.630 3.092 2.955 3.228 . 0 0 "[ . 1 . 2]" 1
983 1 40 ILE MG 1 71 LEU H . . 4.370 3.900 3.681 4.016 . 0 0 "[ . 1 . 2]" 1
984 1 40 ILE MG 1 93 PHE H . . 5.500 5.416 5.200 5.557 0.057 19 0 "[ . 1 . 2]" 1
985 1 40 ILE MG 1 93 PHE HA . . 4.500 3.725 3.504 3.831 . 0 0 "[ . 1 . 2]" 1
986 1 40 ILE MG 1 93 PHE HB2 . . 4.400 4.188 3.993 4.358 . 0 0 "[ . 1 . 2]" 1
987 1 40 ILE MG 1 93 PHE QB . . 3.840 2.830 2.636 3.131 . 0 0 "[ . 1 . 2]" 1
988 1 40 ILE MG 1 93 PHE HB3 . . 4.400 2.878 2.674 3.209 . 0 0 "[ . 1 . 2]" 1
989 1 40 ILE MG 1 93 PHE QD . . 3.800 1.791 1.756 1.929 . 0 0 "[ . 1 . 2]" 1
990 1 40 ILE MG 1 94 LEU HA . . 5.500 5.499 5.344 5.556 0.056 18 0 "[ . 1 . 2]" 1
991 1 40 ILE MG 1 95 PHE HA . . 4.270 4.027 3.966 4.096 . 0 0 "[ . 1 . 2]" 1
992 1 40 ILE MG 1 95 PHE HB2 . . 5.500 5.427 5.344 5.505 0.005 15 0 "[ . 1 . 2]" 1
993 1 40 ILE MG 1 96 ILE H . . 5.500 5.506 5.442 5.556 0.056 14 0 "[ . 1 . 2]" 1
994 1 40 ILE MG 1 105 VAL QG . . 5.440 4.367 4.189 4.595 . 0 0 "[ . 1 . 2]" 1
995 1 40 ILE MG 1 113 LEU MD1 . . 5.000 2.899 2.762 3.041 . 0 0 "[ . 1 . 2]" 1
996 1 40 ILE MG 1 113 LEU QD . . 4.320 2.871 2.738 3.013 . 0 0 "[ . 1 . 2]" 1
997 1 40 ILE MG 1 113 LEU MD2 . . 5.000 4.641 4.440 4.903 . 0 0 "[ . 1 . 2]" 1
998 1 40 ILE MG 1 117 ILE MD . . 4.130 2.452 2.283 2.800 . 0 0 "[ . 1 . 2]" 1
999 1 41 ILE H 1 41 ILE HB . . 3.370 2.891 2.810 2.954 . 0 0 "[ . 1 . 2]" 1
1000 1 41 ILE H 1 41 ILE MD . . 3.320 2.104 1.939 2.310 . 0 0 "[ . 1 . 2]" 1
1001 1 41 ILE H 1 41 ILE HG12 . . 4.720 3.670 3.597 3.796 . 0 0 "[ . 1 . 2]" 1
1002 1 41 ILE H 1 41 ILE HG13 . . 3.390 2.347 2.170 2.477 . 0 0 "[ . 1 . 2]" 1
1003 1 41 ILE H 1 41 ILE MG . . 4.000 3.803 3.777 3.837 . 0 0 "[ . 1 . 2]" 1
1004 1 41 ILE H 1 42 ASP H . . 4.590 4.458 4.404 4.500 . 0 0 "[ . 1 . 2]" 1
1005 1 41 ILE H 1 93 PHE HA . . 4.780 4.614 4.442 4.813 0.033 20 0 "[ . 1 . 2]" 1
1006 1 41 ILE H 1 93 PHE QD . . 5.500 4.221 3.664 5.359 . 0 0 "[ . 1 . 2]" 1
1007 1 41 ILE H 1 94 LEU HA . . 5.060 5.019 4.881 5.105 0.045 11 0 "[ . 1 . 2]" 1
1008 1 41 ILE H 1 94 LEU HB3 . . 4.000 3.765 3.594 3.875 . 0 0 "[ . 1 . 2]" 1
1009 1 41 ILE H 1 94 LEU QD . . 5.440 4.553 4.374 4.642 . 0 0 "[ . 1 . 2]" 1
1010 1 41 ILE H 1 95 PHE H . . 5.260 4.822 4.755 4.889 . 0 0 "[ . 1 . 2]" 1
1011 1 41 ILE H 1 95 PHE HA . . 3.890 3.019 2.847 3.210 . 0 0 "[ . 1 . 2]" 1
1012 1 41 ILE H 1 95 PHE QD . . 4.790 4.725 4.606 4.822 0.032 19 0 "[ . 1 . 2]" 1
1013 1 41 ILE H 1 95 PHE QE . . 5.500 5.431 5.359 5.491 . 0 0 "[ . 1 . 2]" 1
1014 1 41 ILE H 1 96 ILE H . . 4.650 4.482 4.377 4.560 . 0 0 "[ . 1 . 2]" 1
1015 1 41 ILE H 1 96 ILE MD . . 5.160 5.097 4.870 5.199 0.039 5 0 "[ . 1 . 2]" 1
1016 1 41 ILE H 1 96 ILE QG . . 4.400 3.986 3.933 4.075 . 0 0 "[ . 1 . 2]" 1
1017 1 41 ILE HA 1 41 ILE MD . . 4.510 3.761 3.656 3.866 . 0 0 "[ . 1 . 2]" 1
1018 1 41 ILE HA 1 41 ILE MG . . 3.370 2.111 1.982 2.209 . 0 0 "[ . 1 . 2]" 1
1019 1 41 ILE HA 1 42 ASP H . . 3.010 2.150 2.138 2.167 . 0 0 "[ . 1 . 2]" 1
1020 1 41 ILE HA 1 42 ASP QB . . 5.340 4.304 4.005 4.758 . 0 0 "[ . 1 . 2]" 1
1021 1 41 ILE HA 1 70 PHE HA . . 5.380 4.556 4.404 4.741 . 0 0 "[ . 1 . 2]" 1
1022 1 41 ILE HA 1 71 LEU H . . 4.020 3.543 3.326 3.753 . 0 0 "[ . 1 . 2]" 1
1023 1 41 ILE HA 1 71 LEU HA . . 5.250 4.858 4.746 4.977 . 0 0 "[ . 1 . 2]" 1
1024 1 41 ILE HA 1 71 LEU HB3 . . 3.780 3.463 3.144 3.675 . 0 0 "[ . 1 . 2]" 1
1025 1 41 ILE HA 1 71 LEU MD1 . . 5.020 5.048 4.902 5.085 0.065 13 0 "[ . 1 . 2]" 1
1026 1 41 ILE HA 1 71 LEU MD2 . . 5.070 2.971 2.408 3.300 . 0 0 "[ . 1 . 2]" 1
1027 1 41 ILE HA 1 72 LYS H . . 5.250 5.026 4.808 5.156 . 0 0 "[ . 1 . 2]" 1
1028 1 41 ILE HA 1 73 VAL H . . 5.000 4.783 4.545 4.981 . 0 0 "[ . 1 . 2]" 1
1029 1 41 ILE HB 1 41 ILE MD . . 3.280 2.073 2.022 2.199 . 0 0 "[ . 1 . 2]" 1
1030 1 41 ILE HB 1 42 ASP H . . 4.140 3.895 3.811 3.974 . 0 0 "[ . 1 . 2]" 1
1031 1 41 ILE HB 1 43 PHE QE . . 4.710 3.779 3.398 4.170 . 0 0 "[ . 1 . 2]" 1
1032 1 41 ILE HB 1 73 VAL QG . . 5.160 3.650 3.203 3.798 . 0 0 "[ . 1 . 2]" 1
1033 1 41 ILE HB 1 81 VAL QG . . 4.840 4.655 4.476 4.836 . 0 0 "[ . 1 . 2]" 1
1034 1 41 ILE HB 1 85 TYR QE . . 5.250 4.196 3.397 4.599 . 0 0 "[ . 1 . 2]" 1
1035 1 41 ILE HB 1 93 PHE HA . . 4.970 4.875 4.766 4.999 0.029 5 0 "[ . 1 . 2]" 1
1036 1 41 ILE HB 1 94 LEU H . . 4.520 4.281 3.883 4.486 . 0 0 "[ . 1 . 2]" 1
1037 1 41 ILE HB 1 94 LEU HB3 . . 4.160 2.858 2.674 2.929 . 0 0 "[ . 1 . 2]" 1
1038 1 41 ILE MD 1 41 ILE MG . . 3.190 3.056 2.886 3.147 . 0 0 "[ . 1 . 2]" 1
1039 1 41 ILE MD 1 85 TYR QE . . 3.510 2.561 1.911 2.984 . 0 0 "[ . 1 . 2]" 1
1040 1 41 ILE MD 1 94 LEU H . . 4.560 4.298 4.189 4.664 0.104 18 0 "[ . 1 . 2]" 1
1041 1 41 ILE MD 1 94 LEU HB2 . . 4.190 3.471 3.345 3.713 . 0 0 "[ . 1 . 2]" 1
1042 1 41 ILE MD 1 94 LEU HB3 . . 3.800 1.974 1.930 2.357 . 0 0 "[ . 1 . 2]" 1
1043 1 41 ILE MD 1 94 LEU QD . . 4.100 2.956 2.605 3.166 . 0 0 "[ . 1 . 2]" 1
1044 1 41 ILE MD 1 94 LEU HG . . 3.650 3.442 3.256 3.652 0.002 18 0 "[ . 1 . 2]" 1
1045 1 41 ILE MD 1 95 PHE H . . 4.990 3.735 3.471 3.974 . 0 0 "[ . 1 . 2]" 1
1046 1 41 ILE MD 1 95 PHE HA . . 4.770 2.646 2.381 3.024 . 0 0 "[ . 1 . 2]" 1
1047 1 41 ILE MD 1 96 ILE H . . 3.930 3.163 2.919 3.360 . 0 0 "[ . 1 . 2]" 1
1048 1 41 ILE MD 1 96 ILE HA . . 4.290 4.262 4.149 4.416 0.126 18 0 "[ . 1 . 2]" 1
1049 1 41 ILE MD 1 96 ILE HB . . 4.040 3.430 3.289 3.528 . 0 0 "[ . 1 . 2]" 1
1050 1 41 ILE MD 1 96 ILE QG . . 3.480 1.662 1.637 1.695 . 0 0 "[ . 1 . 2]" 1
1051 1 41 ILE HG12 1 85 TYR QE . . 4.570 3.306 2.893 3.789 . 0 0 "[ . 1 . 2]" 1
1052 1 41 ILE HG13 1 41 ILE MG . . 3.400 2.778 2.669 2.914 . 0 0 "[ . 1 . 2]" 1
1053 1 41 ILE HG13 1 95 PHE HA . . 4.570 4.412 4.268 4.576 0.006 19 0 "[ . 1 . 2]" 1
1054 1 41 ILE HG13 1 96 ILE MD . . 4.990 4.797 4.669 4.948 . 0 0 "[ . 1 . 2]" 1
1055 1 41 ILE MG 1 42 ASP H . . 3.340 2.669 2.342 2.910 . 0 0 "[ . 1 . 2]" 1
1056 1 41 ILE MG 1 42 ASP HA . . 4.590 4.378 4.173 4.537 . 0 0 "[ . 1 . 2]" 1
1057 1 41 ILE MG 1 42 ASP QB . . 5.200 4.464 4.179 4.834 . 0 0 "[ . 1 . 2]" 1
1058 1 41 ILE MG 1 43 PHE H . . 4.180 4.045 3.778 4.211 0.031 5 0 "[ . 1 . 2]" 1
1059 1 41 ILE MG 1 43 PHE HA . . 4.720 3.950 3.751 4.108 . 0 0 "[ . 1 . 2]" 1
1060 1 41 ILE MG 1 43 PHE QD . . 4.110 4.008 3.849 4.132 0.022 19 0 "[ . 1 . 2]" 1
1061 1 41 ILE MG 1 43 PHE QE . . 4.140 3.729 3.502 3.942 . 0 0 "[ . 1 . 2]" 1
1062 1 41 ILE MG 1 71 LEU H . . 5.090 4.711 4.512 4.887 . 0 0 "[ . 1 . 2]" 1
1063 1 41 ILE MG 1 71 LEU HA . . 5.310 4.952 4.712 5.109 . 0 0 "[ . 1 . 2]" 1
1064 1 41 ILE MG 1 71 LEU HB3 . . 4.010 3.480 3.026 3.790 . 0 0 "[ . 1 . 2]" 1
1065 1 41 ILE MG 1 71 LEU MD1 . . 3.680 3.793 3.719 3.846 0.166 10 0 "[ . 1 . 2]" 1
1066 1 41 ILE MG 1 71 LEU MD2 . . 4.240 1.812 1.713 1.984 . 0 0 "[ . 1 . 2]" 1
1067 1 41 ILE MG 1 72 LYS H . . 4.720 4.498 4.327 4.653 . 0 0 "[ . 1 . 2]" 1
1068 1 41 ILE MG 1 72 LYS HA . . 4.420 3.347 3.081 3.563 . 0 0 "[ . 1 . 2]" 1
1069 1 41 ILE MG 1 73 VAL H . . 3.850 3.106 2.871 3.463 . 0 0 "[ . 1 . 2]" 1
1070 1 41 ILE MG 1 73 VAL HA . . 4.780 4.489 4.046 4.768 . 0 0 "[ . 1 . 2]" 1
1071 1 41 ILE MG 1 73 VAL HB . . 4.120 3.546 2.394 4.158 0.038 17 0 "[ . 1 . 2]" 1
1072 1 41 ILE MG 1 73 VAL MG1 . . 3.770 2.129 1.659 3.521 . 0 0 "[ . 1 . 2]" 1
1073 1 41 ILE MG 1 73 VAL QG . . 2.980 1.760 1.656 2.196 . 0 0 "[ . 1 . 2]" 1
1074 1 41 ILE MG 1 73 VAL MG2 . . 3.770 2.753 1.659 3.610 . 0 0 "[ . 1 . 2]" 1
1075 1 41 ILE MG 1 81 VAL QG . . 3.680 3.242 3.105 3.538 . 0 0 "[ . 1 . 2]" 1
1076 1 41 ILE MG 1 85 TYR QE . . 4.390 3.753 3.438 4.145 . 0 0 "[ . 1 . 2]" 1
1077 1 41 ILE MG 1 94 LEU HB3 . . 4.330 4.325 4.179 4.380 0.050 3 0 "[ . 1 . 2]" 1
1078 1 41 ILE MG 1 96 ILE MD . . 5.060 5.104 5.052 5.216 0.156 18 0 "[ . 1 . 2]" 1
1079 1 42 ASP H 1 42 ASP QB . . 3.240 2.522 2.183 3.025 . 0 0 "[ . 1 . 2]" 1
1080 1 42 ASP H 1 70 PHE HA . . 5.500 5.607 5.473 5.652 0.152 10 0 "[ . 1 . 2]" 1
1081 1 42 ASP H 1 71 LEU H . . 4.040 3.907 3.792 3.998 . 0 0 "[ . 1 . 2]" 1
1082 1 42 ASP H 1 71 LEU HA . . 5.090 4.893 4.862 4.946 . 0 0 "[ . 1 . 2]" 1
1083 1 42 ASP H 1 71 LEU HB3 . . 5.360 4.740 4.504 4.861 . 0 0 "[ . 1 . 2]" 1
1084 1 42 ASP H 1 71 LEU HG . . 4.290 3.981 3.855 4.233 . 0 0 "[ . 1 . 2]" 1
1085 1 42 ASP H 1 72 LYS HA . . 3.650 2.129 2.011 2.330 . 0 0 "[ . 1 . 2]" 1
1086 1 42 ASP H 1 72 LYS QB . . 5.340 3.631 3.375 3.887 . 0 0 "[ . 1 . 2]" 1
1087 1 42 ASP H 1 73 VAL QG . . 3.740 3.570 3.279 3.766 0.026 8 0 "[ . 1 . 2]" 1
1088 1 42 ASP H 1 93 PHE HA . . 4.900 4.414 4.292 4.592 . 0 0 "[ . 1 . 2]" 1
1089 1 42 ASP H 1 93 PHE QD . . 5.220 4.342 3.868 5.203 . 0 0 "[ . 1 . 2]" 1
1090 1 42 ASP H 1 93 PHE QE . . 5.330 4.247 3.777 5.295 . 0 0 "[ . 1 . 2]" 1
1091 1 42 ASP HA 1 43 PHE H . . 2.980 2.244 2.201 2.294 . 0 0 "[ . 1 . 2]" 1
1092 1 42 ASP HA 1 43 PHE HA . . 4.760 4.495 4.462 4.533 . 0 0 "[ . 1 . 2]" 1
1093 1 42 ASP HA 1 44 THR MG . . 5.500 5.358 5.201 5.457 . 0 0 "[ . 1 . 2]" 1
1094 1 42 ASP HA 1 73 VAL H . . 4.940 4.732 4.445 4.990 0.050 4 0 "[ . 1 . 2]" 1
1095 1 42 ASP HA 1 92 THR H . . 5.500 5.481 5.030 5.620 0.120 6 0 "[ . 1 . 2]" 1
1096 1 42 ASP HA 1 93 PHE HA . . 3.880 2.092 1.959 2.363 . 0 0 "[ . 1 . 2]" 1
1097 1 42 ASP HA 1 93 PHE QB . . 4.790 4.165 4.063 4.422 . 0 0 "[ . 1 . 2]" 1
1098 1 42 ASP HA 1 93 PHE QD . . 3.770 3.289 2.853 3.502 . 0 0 "[ . 1 . 2]" 1
1099 1 42 ASP HA 1 93 PHE QE . . 4.360 4.094 3.778 4.283 . 0 0 "[ . 1 . 2]" 1
1100 1 42 ASP HA 1 94 LEU H . . 4.260 3.955 3.675 4.105 . 0 0 "[ . 1 . 2]" 1
1101 1 42 ASP HA 1 94 LEU HB2 . . 5.500 5.364 5.208 5.468 . 0 0 "[ . 1 . 2]" 1
1102 1 42 ASP QB 1 72 LYS H . . 5.130 4.655 4.304 5.146 0.016 6 0 "[ . 1 . 2]" 1
1103 1 42 ASP QB 1 72 LYS HA . . 3.560 2.483 2.065 2.873 . 0 0 "[ . 1 . 2]" 1
1104 1 42 ASP QB 1 72 LYS QE . . 4.370 4.233 3.920 4.403 0.033 2 0 "[ . 1 . 2]" 1
1105 1 42 ASP QB 1 72 LYS HG3 . . 4.540 4.016 3.289 4.543 0.003 2 0 "[ . 1 . 2]" 1
1106 1 42 ASP QB 1 73 VAL H . . 4.260 3.825 3.444 4.021 . 0 0 "[ . 1 . 2]" 1
1107 1 42 ASP QB 1 73 VAL QG . . 5.280 4.641 4.405 5.192 . 0 0 "[ . 1 . 2]" 1
1108 1 42 ASP HB2 1 72 LYS HA . . 4.070 3.474 2.464 4.138 0.068 18 0 "[ . 1 . 2]" 1
1109 1 42 ASP HB3 1 72 LYS HA . . 4.070 3.073 2.075 4.175 0.105 20 0 "[ . 1 . 2]" 1
1110 1 43 PHE H 1 43 PHE HB2 . . 3.520 2.294 2.230 2.355 . 0 0 "[ . 1 . 2]" 1
1111 1 43 PHE H 1 43 PHE HB3 . . 3.650 3.550 3.522 3.574 . 0 0 "[ . 1 . 2]" 1
1112 1 43 PHE H 1 43 PHE QD . . 3.400 2.946 2.738 3.205 . 0 0 "[ . 1 . 2]" 1
1113 1 43 PHE H 1 44 THR H . . 4.610 4.462 4.399 4.498 . 0 0 "[ . 1 . 2]" 1
1114 1 43 PHE H 1 44 THR MG . . 5.000 4.666 4.596 4.739 . 0 0 "[ . 1 . 2]" 1
1115 1 43 PHE H 1 72 LYS HA . . 5.210 4.911 4.735 5.056 . 0 0 "[ . 1 . 2]" 1
1116 1 43 PHE H 1 73 VAL QG . . 4.690 4.082 3.291 4.681 . 0 0 "[ . 1 . 2]" 1
1117 1 43 PHE H 1 87 VAL MG1 . . 5.310 4.857 4.210 5.220 . 0 0 "[ . 1 . 2]" 1
1118 1 43 PHE H 1 87 VAL MG2 . . 5.310 5.154 4.398 5.465 0.155 15 0 "[ . 1 . 2]" 1
1119 1 43 PHE H 1 91 PRO HA . . 4.270 4.078 3.647 4.285 0.015 5 0 "[ . 1 . 2]" 1
1120 1 43 PHE H 1 91 PRO QB . . 5.340 5.257 4.846 5.453 0.113 5 0 "[ . 1 . 2]" 1
1121 1 43 PHE H 1 92 THR H . . 4.710 4.282 3.788 4.546 . 0 0 "[ . 1 . 2]" 1
1122 1 43 PHE H 1 92 THR HA . . 5.500 4.969 4.817 5.110 . 0 0 "[ . 1 . 2]" 1
1123 1 43 PHE H 1 92 THR HB . . 4.820 4.413 4.124 4.690 . 0 0 "[ . 1 . 2]" 1
1124 1 43 PHE H 1 92 THR MG . . 3.880 3.548 3.241 3.810 . 0 0 "[ . 1 . 2]" 1
1125 1 43 PHE H 1 93 PHE H . . 5.040 4.930 4.800 5.044 0.004 16 0 "[ . 1 . 2]" 1
1126 1 43 PHE H 1 93 PHE HA . . 3.830 3.377 3.230 3.695 . 0 0 "[ . 1 . 2]" 1
1127 1 43 PHE H 1 94 LEU H . . 4.170 3.570 3.368 3.903 . 0 0 "[ . 1 . 2]" 1
1128 1 43 PHE H 1 94 LEU HB2 . . 4.640 4.320 4.068 4.576 . 0 0 "[ . 1 . 2]" 1
1129 1 43 PHE HA 1 43 PHE QD . . 3.780 2.426 2.234 2.591 . 0 0 "[ . 1 . 2]" 1
1130 1 43 PHE HA 1 44 THR H . . 3.070 2.763 2.711 2.820 . 0 0 "[ . 1 . 2]" 1
1131 1 43 PHE HA 1 44 THR HB . . 5.270 4.742 4.656 4.816 . 0 0 "[ . 1 . 2]" 1
1132 1 43 PHE HA 1 44 THR MG . . 3.910 3.065 2.996 3.113 . 0 0 "[ . 1 . 2]" 1
1133 1 43 PHE HA 1 73 VAL QG . . 4.280 2.432 1.761 3.338 . 0 0 "[ . 1 . 2]" 1
1134 1 43 PHE HA 1 74 ASP HA . . 4.380 4.180 3.962 4.371 . 0 0 "[ . 1 . 2]" 1
1135 1 43 PHE HA 1 75 VAL H . . 4.660 4.298 4.039 4.472 . 0 0 "[ . 1 . 2]" 1
1136 1 43 PHE HA 1 75 VAL MG1 . . 3.610 3.090 3.000 3.238 . 0 0 "[ . 1 . 2]" 1
1137 1 43 PHE HA 1 87 VAL QG . . 5.440 4.431 4.126 4.720 . 0 0 "[ . 1 . 2]" 1
1138 1 43 PHE HB2 1 44 THR H . . 3.870 3.170 2.975 3.290 . 0 0 "[ . 1 . 2]" 1
1139 1 43 PHE HB2 1 73 VAL QG . . 5.440 4.464 3.751 5.073 . 0 0 "[ . 1 . 2]" 1
1140 1 43 PHE HB2 1 75 VAL MG1 . . 3.520 3.418 3.160 3.588 0.068 10 0 "[ . 1 . 2]" 1
1141 1 43 PHE HB2 1 87 VAL MG1 . . 4.140 3.513 2.819 3.921 . 0 0 "[ . 1 . 2]" 1
1142 1 43 PHE HB2 1 87 VAL QG . . 3.600 3.000 2.552 3.240 . 0 0 "[ . 1 . 2]" 1
1143 1 43 PHE HB2 1 87 VAL MG2 . . 4.140 3.345 2.748 4.020 . 0 0 "[ . 1 . 2]" 1
1144 1 43 PHE HB2 1 91 PRO HA . . 4.730 3.821 3.362 4.233 . 0 0 "[ . 1 . 2]" 1
1145 1 43 PHE HB2 1 92 THR H . . 3.870 3.065 2.527 3.357 . 0 0 "[ . 1 . 2]" 1
1146 1 43 PHE HB2 1 92 THR HB . . 4.490 2.947 2.565 3.217 . 0 0 "[ . 1 . 2]" 1
1147 1 43 PHE HB2 1 92 THR MG . . 4.380 3.101 2.668 3.522 . 0 0 "[ . 1 . 2]" 1
1148 1 43 PHE HB2 1 94 LEU H . . 4.840 4.277 4.002 4.749 . 0 0 "[ . 1 . 2]" 1
1149 1 43 PHE HB3 1 44 THR H . . 4.060 1.736 1.677 1.818 . 0 0 "[ . 1 . 2]" 1
1150 1 43 PHE HB3 1 73 VAL QG . . 5.170 3.929 3.380 4.509 . 0 0 "[ . 1 . 2]" 1
1151 1 43 PHE HB3 1 75 VAL MG1 . . 3.730 2.047 1.840 2.198 . 0 0 "[ . 1 . 2]" 1
1152 1 43 PHE HB3 1 75 VAL MG2 . . 4.910 3.474 3.088 3.836 . 0 0 "[ . 1 . 2]" 1
1153 1 43 PHE HB3 1 87 VAL MG1 . . 4.120 3.662 2.283 4.050 . 0 0 "[ . 1 . 2]" 1
1154 1 43 PHE HB3 1 87 VAL QG . . 3.600 2.716 2.230 3.280 . 0 0 "[ . 1 . 2]" 1
1155 1 43 PHE HB3 1 87 VAL MG2 . . 4.120 2.900 2.463 3.813 . 0 0 "[ . 1 . 2]" 1
1156 1 43 PHE HB3 1 90 MET ME . . 4.790 4.182 3.380 4.655 . 0 0 "[ . 1 . 2]" 1
1157 1 43 PHE HB3 1 91 PRO HA . . 4.580 4.225 3.892 4.473 . 0 0 "[ . 1 . 2]" 1
1158 1 43 PHE HB3 1 92 THR H . . 4.190 4.053 3.771 4.267 0.077 7 0 "[ . 1 . 2]" 1
1159 1 43 PHE QD 1 44 THR H . . 3.890 3.202 3.042 3.453 . 0 0 "[ . 1 . 2]" 1
1160 1 43 PHE QD 1 73 VAL H . . 4.750 4.537 4.306 4.819 0.069 10 0 "[ . 1 . 2]" 1
1161 1 43 PHE QD 1 73 VAL HB . . 4.970 4.346 2.451 4.928 . 0 0 "[ . 1 . 2]" 1
1162 1 43 PHE QD 1 73 VAL QG . . 3.740 2.087 1.867 2.580 . 0 0 "[ . 1 . 2]" 1
1163 1 43 PHE QD 1 75 VAL H . . 4.740 3.674 3.311 3.886 . 0 0 "[ . 1 . 2]" 1
1164 1 43 PHE QD 1 75 VAL MG1 . . 3.320 1.816 1.760 1.961 . 0 0 "[ . 1 . 2]" 1
1165 1 43 PHE QD 1 75 VAL MG2 . . 4.600 4.145 3.982 4.498 . 0 0 "[ . 1 . 2]" 1
1166 1 43 PHE QD 1 82 ALA H . . 4.610 4.432 4.271 4.625 0.015 16 0 "[ . 1 . 2]" 1
1167 1 43 PHE QD 1 82 ALA HA . . 4.330 4.062 3.895 4.195 . 0 0 "[ . 1 . 2]" 1
1168 1 43 PHE QD 1 82 ALA MB . . 4.040 2.831 2.571 3.062 . 0 0 "[ . 1 . 2]" 1
1169 1 43 PHE QD 1 87 VAL QG . . 3.730 2.309 1.832 2.580 . 0 0 "[ . 1 . 2]" 1
1170 1 43 PHE QD 1 90 MET ME . . 4.950 4.157 3.643 4.735 . 0 0 "[ . 1 . 2]" 1
1171 1 43 PHE QD 1 92 THR H . . 4.840 4.467 3.831 4.848 0.008 5 0 "[ . 1 . 2]" 1
1172 1 43 PHE QD 1 92 THR HB . . 4.430 3.231 2.671 3.702 . 0 0 "[ . 1 . 2]" 1
1173 1 43 PHE QD 1 92 THR MG . . 3.680 1.956 1.893 2.096 . 0 0 "[ . 1 . 2]" 1
1174 1 43 PHE QD 1 94 LEU H . . 3.650 3.060 2.889 3.297 . 0 0 "[ . 1 . 2]" 1
1175 1 43 PHE QD 1 94 LEU HA . . 5.040 4.809 4.645 5.076 0.036 16 0 "[ . 1 . 2]" 1
1176 1 43 PHE QD 1 94 LEU HB2 . . 4.540 2.357 2.131 2.781 . 0 0 "[ . 1 . 2]" 1
1177 1 43 PHE QD 1 94 LEU HB3 . . 4.540 3.701 3.342 4.342 . 0 0 "[ . 1 . 2]" 1
1178 1 43 PHE QD 1 94 LEU QD . . 4.780 3.178 2.743 3.602 . 0 0 "[ . 1 . 2]" 1
1179 1 43 PHE QD 1 94 LEU HG . . 4.780 4.270 3.913 4.791 0.011 19 0 "[ . 1 . 2]" 1
1180 1 43 PHE QE 1 81 VAL H . . 4.620 4.366 4.207 4.518 . 0 0 "[ . 1 . 2]" 1
1181 1 43 PHE QE 1 81 VAL HA . . 5.180 4.733 4.488 4.940 . 0 0 "[ . 1 . 2]" 1
1182 1 43 PHE QE 1 81 VAL MG1 . . 4.110 2.539 2.106 2.896 . 0 0 "[ . 1 . 2]" 1
1183 1 43 PHE QE 1 81 VAL QG . . 3.110 2.508 2.100 2.830 . 0 0 "[ . 1 . 2]" 1
1184 1 43 PHE QE 1 81 VAL MG2 . . 4.110 3.996 3.813 4.141 0.031 2 0 "[ . 1 . 2]" 1
1185 1 43 PHE QE 1 82 ALA H . . 4.090 2.782 2.459 3.301 . 0 0 "[ . 1 . 2]" 1
1186 1 43 PHE QE 1 82 ALA HA . . 3.630 2.844 2.535 3.007 . 0 0 "[ . 1 . 2]" 1
1187 1 43 PHE QE 1 82 ALA MB . . 4.120 2.684 2.379 2.987 . 0 0 "[ . 1 . 2]" 1
1188 1 43 PHE QE 1 85 TYR QD . . 3.400 2.075 1.952 2.775 . 0 0 "[ . 1 . 2]" 1
1189 1 43 PHE QE 1 86 ASN H . . 5.500 5.515 5.415 5.662 0.162 11 0 "[ . 1 . 2]" 1
1190 1 43 PHE QE 1 87 VAL H . . 5.380 5.257 4.981 5.411 0.031 10 0 "[ . 1 . 2]" 1
1191 1 43 PHE QE 1 87 VAL QG . . 4.200 2.303 2.044 2.498 . 0 0 "[ . 1 . 2]" 1
1192 1 43 PHE QE 1 92 THR MG . . 4.040 3.402 2.973 3.649 . 0 0 "[ . 1 . 2]" 1
1193 1 43 PHE QE 1 94 LEU HB2 . . 4.260 2.320 1.966 2.770 . 0 0 "[ . 1 . 2]" 1
1194 1 43 PHE QE 1 94 LEU HB3 . . 4.140 2.719 2.437 3.054 . 0 0 "[ . 1 . 2]" 1
1195 1 43 PHE QE 1 94 LEU MD1 . . 3.970 3.987 3.864 4.044 0.074 5 0 "[ . 1 . 2]" 1
1196 1 43 PHE QE 1 94 LEU MD2 . . 3.970 2.711 2.057 3.264 . 0 0 "[ . 1 . 2]" 1
1197 1 43 PHE QE 1 94 LEU HG . . 3.950 2.485 2.396 2.694 . 0 0 "[ . 1 . 2]" 1
1198 1 43 PHE HZ 1 81 VAL QG . . 3.310 2.085 1.952 2.698 . 0 0 "[ . 1 . 2]" 1
1199 1 43 PHE HZ 1 82 ALA MB . . 4.090 3.431 3.210 3.879 . 0 0 "[ . 1 . 2]" 1
1200 1 44 THR H 1 44 THR HB . . 3.980 3.815 3.751 3.858 . 0 0 "[ . 1 . 2]" 1
1201 1 44 THR H 1 44 THR MG . . 3.100 2.742 2.617 2.979 . 0 0 "[ . 1 . 2]" 1
1202 1 44 THR H 1 73 VAL QG . . 4.390 4.018 3.565 4.495 0.105 13 0 "[ . 1 . 2]" 1
1203 1 44 THR H 1 74 ASP HA . . 4.410 3.816 3.400 4.052 . 0 0 "[ . 1 . 2]" 1
1204 1 44 THR H 1 75 VAL H . . 3.950 2.924 2.644 3.100 . 0 0 "[ . 1 . 2]" 1
1205 1 44 THR H 1 75 VAL HA . . 5.050 4.992 4.883 5.095 0.045 10 0 "[ . 1 . 2]" 1
1206 1 44 THR H 1 75 VAL HB . . 4.640 4.661 4.547 4.840 0.200 7 0 "[ . 1 . 2]" 1
1207 1 44 THR H 1 75 VAL MG1 . . 3.540 1.969 1.831 2.110 . 0 0 "[ . 1 . 2]" 1
1208 1 44 THR H 1 75 VAL MG2 . . 4.530 2.798 2.519 3.153 . 0 0 "[ . 1 . 2]" 1
1209 1 44 THR H 1 90 MET ME . . 5.270 5.055 4.236 5.468 0.198 10 0 "[ . 1 . 2]" 1
1210 1 44 THR H 1 92 THR HB . . 5.500 5.494 5.049 5.665 0.165 7 0 "[ . 1 . 2]" 1
1211 1 44 THR HA 1 44 THR MG . . 3.640 3.166 3.144 3.197 . 0 0 "[ . 1 . 2]" 1
1212 1 44 THR HA 1 45 ALA H . . 3.260 2.180 2.142 2.242 . 0 0 "[ . 1 . 2]" 1
1213 1 44 THR HA 1 90 MET H . . 4.600 3.885 2.963 4.630 0.030 19 0 "[ . 1 . 2]" 1
1214 1 44 THR HA 1 90 MET HA . . 4.350 3.283 2.956 3.472 . 0 0 "[ . 1 . 2]" 1
1215 1 44 THR HA 1 91 PRO HA . . 4.120 2.647 2.424 2.827 . 0 0 "[ . 1 . 2]" 1
1216 1 44 THR HA 1 91 PRO HD2 . . 4.550 4.524 4.198 4.654 0.104 7 0 "[ . 1 . 2]" 1
1217 1 44 THR HA 1 91 PRO QD . . 3.980 3.325 3.056 3.501 . 0 0 "[ . 1 . 2]" 1
1218 1 44 THR HA 1 91 PRO HD3 . . 4.550 3.423 3.139 3.634 . 0 0 "[ . 1 . 2]" 1
1219 1 44 THR HA 1 92 THR H . . 4.630 4.313 3.917 4.621 . 0 0 "[ . 1 . 2]" 1
1220 1 44 THR HB 1 45 ALA H . . 4.220 3.938 3.762 4.113 . 0 0 "[ . 1 . 2]" 1
1221 1 44 THR HB 1 90 MET HA . . 5.500 5.331 4.970 5.531 0.031 11 0 "[ . 1 . 2]" 1
1222 1 44 THR MG 1 45 ALA H . . 4.350 4.148 4.023 4.273 . 0 0 "[ . 1 . 2]" 1
1223 1 44 THR MG 1 45 ALA HA . . 5.060 4.643 4.273 4.893 . 0 0 "[ . 1 . 2]" 1
1224 1 44 THR MG 1 72 LYS QD . . 4.830 3.686 3.327 4.284 . 0 0 "[ . 1 . 2]" 1
1225 1 44 THR MG 1 72 LYS HG3 . . 3.910 3.097 2.766 3.804 . 0 0 "[ . 1 . 2]" 1
1226 1 44 THR MG 1 73 VAL H . . 3.880 3.639 3.490 3.880 0.000 17 0 "[ . 1 . 2]" 1
1227 1 44 THR MG 1 74 ASP HA . . 3.410 1.995 1.929 2.498 . 0 0 "[ . 1 . 2]" 1
1228 1 44 THR MG 1 74 ASP HB2 . . 4.600 3.571 3.344 3.961 . 0 0 "[ . 1 . 2]" 1
1229 1 44 THR MG 1 75 VAL H . . 3.690 2.909 2.617 3.616 . 0 0 "[ . 1 . 2]" 1
1230 1 44 THR MG 1 75 VAL MG2 . . 4.430 3.921 3.694 4.571 0.141 7 0 "[ . 1 . 2]" 1
1231 1 45 ALA H 1 46 SER H . . 5.190 3.111 1.805 4.511 . 0 0 "[ . 1 . 2]" 1
1232 1 45 ALA H 1 48 CYS H . . 5.120 4.283 3.476 5.074 . 0 0 "[ . 1 . 2]" 1
1233 1 45 ALA H 1 75 VAL H . . 5.390 4.949 4.543 5.153 . 0 0 "[ . 1 . 2]" 1
1234 1 45 ALA H 1 75 VAL MG1 . . 5.480 4.662 4.264 4.995 . 0 0 "[ . 1 . 2]" 1
1235 1 45 ALA H 1 75 VAL MG2 . . 4.420 3.377 3.105 3.655 . 0 0 "[ . 1 . 2]" 1
1236 1 45 ALA H 1 89 ALA MB . . 5.500 4.311 3.796 5.209 . 0 0 "[ . 1 . 2]" 1
1237 1 45 ALA H 1 90 MET H . . 4.980 4.023 3.206 4.605 . 0 0 "[ . 1 . 2]" 1
1238 1 45 ALA H 1 90 MET HA . . 5.000 2.995 2.577 3.398 . 0 0 "[ . 1 . 2]" 1
1239 1 45 ALA H 1 90 MET QG . . 5.340 5.319 5.104 5.523 0.183 20 0 "[ . 1 . 2]" 1
1240 1 45 ALA HA 1 46 SER H . . 3.550 3.317 2.522 3.571 0.021 2 0 "[ . 1 . 2]" 1
1241 1 45 ALA HA 1 46 SER HA . . 5.230 4.682 4.306 5.026 . 0 0 "[ . 1 . 2]" 1
1242 1 45 ALA HA 1 46 SER QB . . 4.890 4.400 4.065 4.968 0.078 20 0 "[ . 1 . 2]" 1
1243 1 45 ALA HA 1 47 TRP H . . 5.430 4.935 3.562 5.433 0.003 16 0 "[ . 1 . 2]" 1
1244 1 45 ALA HA 1 75 VAL H . . 4.570 3.906 3.377 4.624 0.054 7 0 "[ . 1 . 2]" 1
1245 1 45 ALA HA 1 75 VAL MG2 . . 4.110 2.096 1.822 3.961 . 0 0 "[ . 1 . 2]" 1
1246 1 45 ALA HA 1 76 ASP QB . . 4.380 3.744 3.085 4.348 . 0 0 "[ . 1 . 2]" 1
1247 1 45 ALA MB 1 46 SER H . . 4.110 2.211 1.788 3.702 . 0 0 "[ . 1 . 2]" 1
1248 1 45 ALA MB 1 46 SER HA . . 4.530 4.140 3.789 4.307 . 0 0 "[ . 1 . 2]" 1
1249 1 45 ALA MB 1 47 TRP H . . 4.960 3.277 2.343 4.908 . 0 0 "[ . 1 . 2]" 1
1250 1 45 ALA MB 1 48 CYS H . . 4.940 3.703 2.404 5.166 0.226 20 0 "[ . 1 . 2]" 1
1251 1 45 ALA MB 1 75 VAL H . . 5.500 4.735 2.052 5.397 . 0 0 "[ . 1 . 2]" 1
1252 1 45 ALA MB 1 75 VAL MG2 . . 3.740 2.616 1.630 3.099 . 0 0 "[ . 1 . 2]" 1
1253 1 46 SER H 1 46 SER QB . . 3.680 2.776 2.096 3.243 . 0 0 "[ . 1 . 2]" 1
1254 1 46 SER H 1 47 TRP H . . 4.520 2.269 1.792 3.404 . 0 0 "[ . 1 . 2]" 1
1255 1 46 SER H 1 47 TRP HE3 . . 5.500 3.701 2.607 5.111 . 0 0 "[ . 1 . 2]" 1
1256 1 46 SER H 1 47 TRP HZ3 . . 5.500 4.657 3.352 5.829 0.329 18 0 "[ . 1 . 2]" 1
1257 1 46 SER HA 1 47 TRP HA . . 5.500 4.610 4.518 4.857 . 0 0 "[ . 1 . 2]" 1
1258 1 46 SER QB 1 47 TRP H . . 4.600 2.842 1.919 3.930 . 0 0 "[ . 1 . 2]" 1
1259 1 46 SER QB 1 47 TRP HA . . 5.500 4.379 3.604 5.296 . 0 0 "[ . 1 . 2]" 1
1260 1 46 SER QB 1 47 TRP HZ3 . . 3.930 3.257 2.260 3.903 . 0 0 "[ . 1 . 2]" 1
1261 1 46 SER QB 1 48 CYS H . . 5.160 4.420 3.136 5.026 . 0 0 "[ . 1 . 2]" 1
1262 1 47 TRP H 1 47 TRP HZ3 . . 5.320 4.327 3.909 5.396 0.076 6 0 "[ . 1 . 2]" 1
1263 1 47 TRP QB 1 47 TRP HZ3 . . 5.190 4.870 4.748 5.379 0.189 18 0 "[ . 1 . 2]" 1
1264 1 47 TRP QB 1 48 CYS QB . . 4.970 4.424 3.214 5.086 0.116 18 0 "[ . 1 . 2]" 1
1265 1 47 TRP HE3 1 48 CYS H . . 5.280 3.527 2.690 4.263 . 0 0 "[ . 1 . 2]" 1
1266 1 47 TRP HZ3 1 48 CYS H . . 5.500 5.369 4.698 5.883 0.383 6 0 "[ . 1 . 2]" 1
1267 1 50 PRO HA 1 53 PHE H . . 4.920 4.475 3.750 4.928 0.008 10 0 "[ . 1 . 2]" 1
1268 1 50 PRO QB 1 51 CYS H . . 3.440 2.740 1.844 2.930 . 0 0 "[ . 1 . 2]" 1
1269 1 50 PRO QB 1 52 ARG H . . 3.690 2.549 2.235 3.027 . 0 0 "[ . 1 . 2]" 1
1270 1 50 PRO QB 1 53 PHE QB . . 4.220 2.757 1.795 3.381 . 0 0 "[ . 1 . 2]" 1
1271 1 50 PRO QB 1 54 ILE H . . 3.890 3.129 2.295 3.682 . 0 0 "[ . 1 . 2]" 1
1272 1 50 PRO QB 1 108 ALA MB . . 4.300 4.084 3.858 4.365 0.065 18 0 "[ . 1 . 2]" 1
1273 1 50 PRO HB2 1 51 CYS H . . 4.190 2.808 1.853 3.019 . 0 0 "[ . 1 . 2]" 1
1274 1 50 PRO HB3 1 51 CYS H . . 4.190 3.840 3.326 3.959 . 0 0 "[ . 1 . 2]" 1
1275 1 50 PRO HD2 1 51 CYS H . . 3.700 2.821 2.705 3.604 . 0 0 "[ . 1 . 2]" 1
1276 1 50 PRO HD2 1 51 CYS HA . . 5.450 4.880 4.775 5.240 . 0 0 "[ . 1 . 2]" 1
1277 1 50 PRO HD2 1 108 ALA HA . . 5.040 3.903 2.691 5.090 0.050 20 0 "[ . 1 . 2]" 1
1278 1 50 PRO HD3 1 51 CYS H . . 4.340 3.905 3.854 4.291 . 0 0 "[ . 1 . 2]" 1
1279 1 50 PRO HD3 1 108 ALA HA . . 5.230 4.092 3.127 5.257 0.027 20 0 "[ . 1 . 2]" 1
1280 1 50 PRO HG2 1 51 CYS H . . 4.220 1.891 1.730 2.025 . 0 0 "[ . 1 . 2]" 1
1281 1 50 PRO HG2 1 51 CYS HA . . 4.410 3.781 3.739 3.850 . 0 0 "[ . 1 . 2]" 1
1282 1 50 PRO HG2 1 54 ILE MG . . 4.190 2.659 2.224 3.338 . 0 0 "[ . 1 . 2]" 1
1283 1 50 PRO HG2 1 108 ALA MB . . 3.920 3.742 3.412 3.923 0.003 14 0 "[ . 1 . 2]" 1
1284 1 50 PRO HG3 1 51 CYS H . . 4.240 3.510 3.276 3.625 . 0 0 "[ . 1 . 2]" 1
1285 1 50 PRO HG3 1 108 ALA HA . . 3.890 2.879 2.125 3.610 . 0 0 "[ . 1 . 2]" 1
1286 1 51 CYS H 1 51 CYS HB2 . . 3.990 2.994 2.742 3.546 . 0 0 "[ . 1 . 2]" 1
1287 1 51 CYS H 1 51 CYS QB . . 3.350 2.889 2.668 3.314 . 0 0 "[ . 1 . 2]" 1
1288 1 51 CYS H 1 51 CYS HB3 . . 3.990 3.830 3.568 4.010 0.020 12 0 "[ . 1 . 2]" 1
1289 1 51 CYS H 1 52 ARG H . . 3.440 2.917 2.594 3.281 . 0 0 "[ . 1 . 2]" 1
1290 1 51 CYS H 1 52 ARG HA . . 5.500 5.427 5.051 5.560 0.060 6 0 "[ . 1 . 2]" 1
1291 1 51 CYS H 1 53 PHE H . . 4.720 4.446 3.642 4.716 . 0 0 "[ . 1 . 2]" 1
1292 1 51 CYS H 1 54 ILE H . . 4.870 4.286 3.367 4.732 . 0 0 "[ . 1 . 2]" 1
1293 1 51 CYS H 1 54 ILE MG . . 4.370 3.300 2.576 3.883 . 0 0 "[ . 1 . 2]" 1
1294 1 51 CYS H 1 55 ALA MB . . 5.100 4.899 4.641 5.137 0.037 8 0 "[ . 1 . 2]" 1
1295 1 51 CYS H 1 108 ALA MB . . 5.330 5.039 4.158 5.343 0.013 20 0 "[ . 1 . 2]" 1
1296 1 51 CYS HA 1 53 PHE H . . 5.260 4.910 4.645 5.294 0.034 4 0 "[ . 1 . 2]" 1
1297 1 51 CYS HA 1 54 ILE H . . 4.830 4.573 4.264 4.823 . 0 0 "[ . 1 . 2]" 1
1298 1 51 CYS HA 1 54 ILE MG . . 3.670 3.491 3.247 3.696 0.026 1 0 "[ . 1 . 2]" 1
1299 1 51 CYS QB 1 52 ARG H . . 4.140 3.709 2.566 3.916 . 0 0 "[ . 1 . 2]" 1
1300 1 51 CYS QB 1 55 ALA MB . . 5.140 4.196 3.189 4.753 . 0 0 "[ . 1 . 2]" 1
1301 1 52 ARG H 1 52 ARG HB2 . . 4.030 2.786 2.432 3.863 . 0 0 "[ . 1 . 2]" 1
1302 1 52 ARG H 1 52 ARG HB3 . . 4.030 3.720 2.853 3.898 . 0 0 "[ . 1 . 2]" 1
1303 1 52 ARG H 1 52 ARG QD . . 5.340 4.966 4.129 5.233 . 0 0 "[ . 1 . 2]" 1
1304 1 52 ARG H 1 52 ARG HG2 . . 4.260 3.929 2.820 4.260 0.000 15 0 "[ . 1 . 2]" 1
1305 1 52 ARG H 1 52 ARG QG . . 3.720 3.515 2.754 3.721 0.001 15 0 "[ . 1 . 2]" 1
1306 1 52 ARG H 1 52 ARG HG3 . . 4.260 4.031 3.705 4.260 . 0 0 "[ . 1 . 2]" 1
1307 1 52 ARG H 1 53 PHE H . . 3.660 2.131 1.814 2.386 . 0 0 "[ . 1 . 2]" 1
1308 1 52 ARG H 1 53 PHE HA . . 4.800 4.626 4.448 4.812 0.012 3 0 "[ . 1 . 2]" 1
1309 1 52 ARG H 1 53 PHE QB . . 4.110 3.848 3.667 3.973 . 0 0 "[ . 1 . 2]" 1
1310 1 52 ARG H 1 54 ILE H . . 4.390 2.984 2.741 3.813 . 0 0 "[ . 1 . 2]" 1
1311 1 52 ARG H 1 55 ALA MB . . 4.770 3.335 2.999 4.008 . 0 0 "[ . 1 . 2]" 1
1312 1 52 ARG HA 1 52 ARG HD2 . . 4.590 3.907 2.154 4.592 0.002 2 0 "[ . 1 . 2]" 1
1313 1 52 ARG HA 1 52 ARG QD . . 4.020 3.394 2.138 3.987 . 0 0 "[ . 1 . 2]" 1
1314 1 52 ARG HA 1 52 ARG HD3 . . 4.590 3.836 2.829 4.566 . 0 0 "[ . 1 . 2]" 1
1315 1 52 ARG HA 1 52 ARG HG2 . . 4.150 2.329 2.140 3.824 . 0 0 "[ . 1 . 2]" 1
1316 1 52 ARG HA 1 52 ARG QG . . 3.580 2.257 2.116 2.988 . 0 0 "[ . 1 . 2]" 1
1317 1 52 ARG HA 1 52 ARG HG3 . . 4.150 3.379 3.119 3.751 . 0 0 "[ . 1 . 2]" 1
1318 1 52 ARG HA 1 53 PHE HA . . 4.770 4.721 4.668 4.788 0.018 18 0 "[ . 1 . 2]" 1
1319 1 52 ARG HA 1 54 ILE H . . 5.240 4.702 4.474 4.891 . 0 0 "[ . 1 . 2]" 1
1320 1 52 ARG HA 1 55 ALA H . . 3.880 3.581 3.312 3.764 . 0 0 "[ . 1 . 2]" 1
1321 1 52 ARG HA 1 55 ALA HA . . 5.060 4.739 4.330 5.021 . 0 0 "[ . 1 . 2]" 1
1322 1 52 ARG HA 1 55 ALA MB . . 3.100 2.200 1.930 2.483 . 0 0 "[ . 1 . 2]" 1
1323 1 52 ARG HA 1 56 PRO QD . . 4.050 3.881 3.699 4.030 . 0 0 "[ . 1 . 2]" 1
1324 1 52 ARG QB 1 52 ARG QD . . 3.150 2.049 1.910 2.536 . 0 0 "[ . 1 . 2]" 1
1325 1 52 ARG HB2 1 53 PHE H . . 3.830 2.649 2.397 3.796 . 0 0 "[ . 1 . 2]" 1
1326 1 52 ARG HB2 1 53 PHE HA . . 4.720 4.664 4.407 5.269 0.549 4 1 "[ +. 1 . 2]" 1
1327 1 52 ARG HB3 1 53 PHE H . . 3.830 3.171 2.797 3.748 . 0 0 "[ . 1 . 2]" 1
1328 1 52 ARG HB3 1 53 PHE HA . . 4.720 4.144 3.990 5.044 0.324 4 0 "[ . 1 . 2]" 1
1329 1 52 ARG QG 1 53 PHE H . . 4.760 4.082 1.860 4.344 . 0 0 "[ . 1 . 2]" 1
1330 1 53 PHE H 1 53 PHE QB . . 3.040 2.242 2.200 2.272 . 0 0 "[ . 1 . 2]" 1
1331 1 53 PHE H 1 53 PHE QD . . 4.370 4.146 4.080 4.193 . 0 0 "[ . 1 . 2]" 1
1332 1 53 PHE H 1 54 ILE MG . . 4.400 4.266 4.100 4.430 0.030 4 0 "[ . 1 . 2]" 1
1333 1 53 PHE H 1 55 ALA MB . . 5.150 4.113 3.968 4.262 . 0 0 "[ . 1 . 2]" 1
1334 1 53 PHE H 1 56 PRO QD . . 4.970 4.736 4.474 4.834 . 0 0 "[ . 1 . 2]" 1
1335 1 53 PHE HA 1 53 PHE QD . . 3.530 2.901 2.520 3.142 . 0 0 "[ . 1 . 2]" 1
1336 1 53 PHE HA 1 56 PRO QD . . 3.970 3.959 3.658 4.017 0.047 20 0 "[ . 1 . 2]" 1
1337 1 53 PHE HA 1 56 PRO QG . . 5.440 4.605 4.123 4.665 . 0 0 "[ . 1 . 2]" 1
1338 1 53 PHE QB 1 54 ILE H . . 3.090 2.574 2.473 2.623 . 0 0 "[ . 1 . 2]" 1
1339 1 53 PHE QB 1 54 ILE HB . . 4.640 3.768 3.570 3.876 . 0 0 "[ . 1 . 2]" 1
1340 1 53 PHE QB 1 54 ILE MD . . 5.330 5.096 4.860 5.218 . 0 0 "[ . 1 . 2]" 1
1341 1 53 PHE QB 1 54 ILE MG . . 4.190 4.115 4.002 4.206 0.016 13 0 "[ . 1 . 2]" 1
1342 1 53 PHE QB 1 55 ALA H . . 4.390 4.396 4.304 4.431 0.041 19 0 "[ . 1 . 2]" 1
1343 1 53 PHE QD 1 54 ILE H . . 4.130 3.188 2.714 3.466 . 0 0 "[ . 1 . 2]" 1
1344 1 53 PHE QD 1 54 ILE HB . . 4.620 2.625 2.144 3.183 . 0 0 "[ . 1 . 2]" 1
1345 1 53 PHE QD 1 54 ILE MD . . 4.040 3.682 3.471 4.016 . 0 0 "[ . 1 . 2]" 1
1346 1 53 PHE QD 1 54 ILE MG . . 4.680 4.024 3.536 4.519 . 0 0 "[ . 1 . 2]" 1
1347 1 53 PHE QE 1 54 ILE MD . . 4.350 3.742 2.947 4.381 0.031 3 0 "[ . 1 . 2]" 1
1348 1 54 ILE H 1 54 ILE HB . . 3.040 2.632 2.494 2.675 . 0 0 "[ . 1 . 2]" 1
1349 1 54 ILE H 1 54 ILE MD . . 4.510 4.454 4.251 4.499 . 0 0 "[ . 1 . 2]" 1
1350 1 54 ILE H 1 54 ILE HG13 . . 4.560 4.429 4.362 4.453 . 0 0 "[ . 1 . 2]" 1
1351 1 54 ILE H 1 54 ILE MG . . 2.990 2.328 2.284 2.391 . 0 0 "[ . 1 . 2]" 1
1352 1 54 ILE H 1 55 ALA HA . . 4.870 4.535 4.499 4.679 . 0 0 "[ . 1 . 2]" 1
1353 1 54 ILE H 1 56 PRO QD . . 3.780 3.808 3.613 3.835 0.055 14 0 "[ . 1 . 2]" 1
1354 1 54 ILE H 1 57 VAL H . . 5.500 5.418 5.330 5.468 . 0 0 "[ . 1 . 2]" 1
1355 1 54 ILE H 1 57 VAL HB . . 5.400 5.145 5.065 5.186 . 0 0 "[ . 1 . 2]" 1
1356 1 54 ILE H 1 58 PHE QE . . 5.500 5.456 5.063 5.512 0.012 2 0 "[ . 1 . 2]" 1
1357 1 54 ILE HA 1 54 ILE MD . . 3.640 3.503 3.373 3.543 . 0 0 "[ . 1 . 2]" 1
1358 1 54 ILE HA 1 54 ILE HG12 . . 3.990 3.127 3.073 3.241 . 0 0 "[ . 1 . 2]" 1
1359 1 54 ILE HA 1 54 ILE HG13 . . 3.530 2.115 2.063 2.138 . 0 0 "[ . 1 . 2]" 1
1360 1 54 ILE HA 1 54 ILE MG . . 3.640 3.168 3.161 3.173 . 0 0 "[ . 1 . 2]" 1
1361 1 54 ILE HA 1 56 PRO QD . . 4.080 3.140 3.067 3.191 . 0 0 "[ . 1 . 2]" 1
1362 1 54 ILE HA 1 57 VAL HA . . 5.440 5.098 5.008 5.145 . 0 0 "[ . 1 . 2]" 1
1363 1 54 ILE HA 1 57 VAL HB . . 3.820 2.663 2.359 2.749 . 0 0 "[ . 1 . 2]" 1
1364 1 54 ILE HA 1 57 VAL MG1 . . 4.190 3.965 3.468 4.040 . 0 0 "[ . 1 . 2]" 1
1365 1 54 ILE HA 1 57 VAL MG2 . . 3.980 2.518 2.343 3.403 . 0 0 "[ . 1 . 2]" 1
1366 1 54 ILE HA 1 58 PHE H . . 4.890 4.644 4.585 4.696 . 0 0 "[ . 1 . 2]" 1
1367 1 54 ILE HB 1 54 ILE MD . . 3.120 2.281 2.061 2.322 . 0 0 "[ . 1 . 2]" 1
1368 1 54 ILE HB 1 55 ALA H . . 4.520 4.301 4.115 4.330 . 0 0 "[ . 1 . 2]" 1
1369 1 54 ILE HB 1 57 VAL HB . . 4.550 4.173 4.117 4.305 . 0 0 "[ . 1 . 2]" 1
1370 1 54 ILE HB 1 108 ALA HA . . 4.250 3.787 3.563 3.911 . 0 0 "[ . 1 . 2]" 1
1371 1 54 ILE MD 1 54 ILE MG . . 3.320 2.301 2.227 2.590 . 0 0 "[ . 1 . 2]" 1
1372 1 54 ILE MD 1 57 VAL HB . . 3.670 3.443 3.402 3.670 0.000 13 0 "[ . 1 . 2]" 1
1373 1 54 ILE MD 1 58 PHE H . . 5.320 4.821 4.706 5.104 . 0 0 "[ . 1 . 2]" 1
1374 1 54 ILE MD 1 58 PHE QD . . 4.180 3.724 3.515 4.057 . 0 0 "[ . 1 . 2]" 1
1375 1 54 ILE MD 1 58 PHE QE . . 3.950 2.099 1.894 2.827 . 0 0 "[ . 1 . 2]" 1
1376 1 54 ILE MD 1 58 PHE HZ . . 3.900 2.637 2.396 3.213 . 0 0 "[ . 1 . 2]" 1
1377 1 54 ILE MD 1 108 ALA HA . . 3.700 3.192 2.970 3.469 . 0 0 "[ . 1 . 2]" 1
1378 1 54 ILE MD 1 109 ARG H . . 3.510 2.885 2.748 3.321 . 0 0 "[ . 1 . 2]" 1
1379 1 54 ILE MD 1 109 ARG HA . . 4.560 3.626 3.524 3.820 . 0 0 "[ . 1 . 2]" 1
1380 1 54 ILE MD 1 110 LYS H . . 4.120 2.888 2.651 2.996 . 0 0 "[ . 1 . 2]" 1
1381 1 54 ILE MD 1 110 LYS HA . . 3.200 2.078 1.862 2.235 . 0 0 "[ . 1 . 2]" 1
1382 1 54 ILE MD 1 110 LYS HB3 . . 3.890 3.599 3.327 3.782 . 0 0 "[ . 1 . 2]" 1
1383 1 54 ILE MD 1 110 LYS QD . . 4.180 3.776 2.004 4.013 . 0 0 "[ . 1 . 2]" 1
1384 1 54 ILE MD 1 110 LYS QE . . 4.490 4.387 3.890 4.501 0.011 12 0 "[ . 1 . 2]" 1
1385 1 54 ILE MD 1 110 LYS HG2 . . 4.090 2.500 2.125 3.793 . 0 0 "[ . 1 . 2]" 1
1386 1 54 ILE MD 1 110 LYS QG . . 3.260 2.374 2.073 2.890 . 0 0 "[ . 1 . 2]" 1
1387 1 54 ILE MD 1 110 LYS HG3 . . 4.090 3.098 2.883 3.289 . 0 0 "[ . 1 . 2]" 1
1388 1 54 ILE MD 1 113 LEU H . . 4.600 4.441 4.156 4.561 . 0 0 "[ . 1 . 2]" 1
1389 1 54 ILE MD 1 113 LEU QD . . 3.600 2.849 2.451 2.987 . 0 0 "[ . 1 . 2]" 1
1390 1 54 ILE MD 1 114 GLN H . . 4.910 4.868 4.538 4.952 0.042 3 0 "[ . 1 . 2]" 1
1391 1 54 ILE HG12 1 54 ILE MG . . 3.270 2.167 2.137 2.244 . 0 0 "[ . 1 . 2]" 1
1392 1 54 ILE HG12 1 57 VAL H . . 4.210 4.035 3.954 4.250 0.040 13 0 "[ . 1 . 2]" 1
1393 1 54 ILE HG12 1 57 VAL HB . . 4.060 2.162 2.062 2.940 . 0 0 "[ . 1 . 2]" 1
1394 1 54 ILE HG12 1 58 PHE H . . 3.870 3.391 3.262 3.729 . 0 0 "[ . 1 . 2]" 1
1395 1 54 ILE HG12 1 58 PHE QE . . 4.560 2.267 2.145 3.222 . 0 0 "[ . 1 . 2]" 1
1396 1 54 ILE HG12 1 58 PHE HZ . . 4.400 3.423 3.270 3.572 . 0 0 "[ . 1 . 2]" 1
1397 1 54 ILE HG12 1 110 LYS HA . . 4.500 4.382 4.146 4.505 0.005 14 0 "[ . 1 . 2]" 1
1398 1 54 ILE HG13 1 54 ILE MG . . 3.310 3.143 3.083 3.156 . 0 0 "[ . 1 . 2]" 1
1399 1 54 ILE HG13 1 57 VAL H . . 4.080 4.109 3.942 4.145 0.065 12 0 "[ . 1 . 2]" 1
1400 1 54 ILE HG13 1 57 VAL HB . . 3.960 2.034 1.990 2.055 . 0 0 "[ . 1 . 2]" 1
1401 1 54 ILE HG13 1 57 VAL MG1 . . 3.470 2.527 1.991 2.611 . 0 0 "[ . 1 . 2]" 1
1402 1 54 ILE HG13 1 57 VAL MG2 . . 4.200 2.334 2.082 2.778 . 0 0 "[ . 1 . 2]" 1
1403 1 54 ILE HG13 1 58 PHE H . . 4.460 4.353 4.274 4.455 . 0 0 "[ . 1 . 2]" 1
1404 1 54 ILE HG13 1 58 PHE QD . . 5.400 4.369 4.203 4.961 . 0 0 "[ . 1 . 2]" 1
1405 1 54 ILE HG13 1 113 LEU QD . . 4.570 4.176 3.702 4.288 . 0 0 "[ . 1 . 2]" 1
1406 1 54 ILE MG 1 55 ALA H . . 3.300 3.147 2.831 3.202 . 0 0 "[ . 1 . 2]" 1
1407 1 54 ILE MG 1 55 ALA HA . . 4.030 3.310 3.151 3.336 . 0 0 "[ . 1 . 2]" 1
1408 1 54 ILE MG 1 55 ALA MB . . 3.980 3.976 3.791 4.005 0.025 9 0 "[ . 1 . 2]" 1
1409 1 54 ILE MG 1 56 PRO QD . . 4.680 4.301 4.070 4.340 . 0 0 "[ . 1 . 2]" 1
1410 1 54 ILE MG 1 57 VAL H . . 4.680 4.112 3.996 4.152 . 0 0 "[ . 1 . 2]" 1
1411 1 54 ILE MG 1 57 VAL HB . . 4.670 3.429 3.364 3.790 . 0 0 "[ . 1 . 2]" 1
1412 1 54 ILE MG 1 58 PHE H . . 4.300 3.560 3.517 3.640 . 0 0 "[ . 1 . 2]" 1
1413 1 54 ILE MG 1 58 PHE HA . . 5.440 5.038 4.953 5.171 . 0 0 "[ . 1 . 2]" 1
1414 1 54 ILE MG 1 58 PHE HB2 . . 4.870 4.172 4.110 4.210 . 0 0 "[ . 1 . 2]" 1
1415 1 54 ILE MG 1 58 PHE QE . . 3.460 2.425 2.007 2.480 . 0 0 "[ . 1 . 2]" 1
1416 1 54 ILE MG 1 58 PHE HZ . . 3.680 1.969 1.940 2.130 . 0 0 "[ . 1 . 2]" 1
1417 1 54 ILE MG 1 59 ALA H . . 5.500 5.532 5.500 5.585 0.085 13 0 "[ . 1 . 2]" 1
1418 1 54 ILE MG 1 107 GLY HA2 . . 4.230 3.800 3.630 3.951 . 0 0 "[ . 1 . 2]" 1
1419 1 54 ILE MG 1 107 GLY HA3 . . 4.380 4.165 4.006 4.355 . 0 0 "[ . 1 . 2]" 1
1420 1 54 ILE MG 1 108 ALA H . . 4.400 4.226 4.063 4.376 . 0 0 "[ . 1 . 2]" 1
1421 1 54 ILE MG 1 108 ALA HA . . 3.920 2.818 2.589 3.017 . 0 0 "[ . 1 . 2]" 1
1422 1 54 ILE MG 1 109 ARG H . . 4.430 4.150 3.892 4.457 0.027 11 0 "[ . 1 . 2]" 1
1423 1 54 ILE MG 1 113 LEU MD1 . . 5.500 5.393 5.185 5.507 0.007 3 0 "[ . 1 . 2]" 1
1424 1 54 ILE MG 1 113 LEU QD . . 4.640 3.965 3.749 4.067 . 0 0 "[ . 1 . 2]" 1
1425 1 54 ILE MG 1 113 LEU MD2 . . 5.500 4.082 3.827 4.214 . 0 0 "[ . 1 . 2]" 1
1426 1 55 ALA H 1 55 ALA MB . . 2.720 2.046 2.024 2.112 . 0 0 "[ . 1 . 2]" 1
1427 1 55 ALA H 1 56 PRO QD . . 2.890 2.039 2.015 2.127 . 0 0 "[ . 1 . 2]" 1
1428 1 55 ALA H 1 56 PRO QG . . 4.190 3.979 3.957 4.062 . 0 0 "[ . 1 . 2]" 1
1429 1 55 ALA H 1 57 VAL H . . 4.210 3.919 3.874 3.959 . 0 0 "[ . 1 . 2]" 1
1430 1 55 ALA H 1 57 VAL HB . . 5.030 4.694 4.652 4.734 . 0 0 "[ . 1 . 2]" 1
1431 1 55 ALA H 1 58 PHE H . . 5.190 5.103 5.025 5.127 . 0 0 "[ . 1 . 2]" 1
1432 1 55 ALA HA 1 56 PRO QD . . 3.800 3.462 3.456 3.464 . 0 0 "[ . 1 . 2]" 1
1433 1 55 ALA HA 1 57 VAL H . . 4.190 3.627 3.597 3.720 . 0 0 "[ . 1 . 2]" 1
1434 1 55 ALA HA 1 58 PHE H . . 3.890 3.787 3.663 3.824 . 0 0 "[ . 1 . 2]" 1
1435 1 55 ALA HA 1 58 PHE HB2 . . 4.600 3.814 3.615 3.870 . 0 0 "[ . 1 . 2]" 1
1436 1 55 ALA HA 1 58 PHE HB3 . . 5.500 5.478 5.238 5.538 0.038 3 0 "[ . 1 . 2]" 1
1437 1 55 ALA HA 1 58 PHE QD . . 5.120 3.972 3.247 4.130 . 0 0 "[ . 1 . 2]" 1
1438 1 55 ALA HA 1 59 ALA H . . 4.420 4.451 4.424 4.482 0.062 3 0 "[ . 1 . 2]" 1
1439 1 55 ALA MB 1 56 PRO HA . . 3.820 3.743 3.723 3.799 . 0 0 "[ . 1 . 2]" 1
1440 1 55 ALA MB 1 56 PRO HB2 . . 5.270 5.001 4.962 5.052 . 0 0 "[ . 1 . 2]" 1
1441 1 55 ALA MB 1 56 PRO HB3 . . 4.560 4.062 4.003 4.158 . 0 0 "[ . 1 . 2]" 1
1442 1 55 ALA MB 1 56 PRO QD . . 2.840 1.951 1.896 2.016 . 0 0 "[ . 1 . 2]" 1
1443 1 55 ALA MB 1 56 PRO QG . . 3.810 3.678 3.654 3.727 . 0 0 "[ . 1 . 2]" 1
1444 1 55 ALA MB 1 57 VAL H . . 4.370 4.018 4.005 4.048 . 0 0 "[ . 1 . 2]" 1
1445 1 56 PRO HA 1 57 VAL H . . 3.550 3.279 3.260 3.331 . 0 0 "[ . 1 . 2]" 1
1446 1 56 PRO HA 1 58 PHE H . . 4.760 4.750 4.601 4.794 0.034 17 0 "[ . 1 . 2]" 1
1447 1 56 PRO HA 1 59 ALA H . . 4.670 4.697 4.519 4.734 0.064 16 0 "[ . 1 . 2]" 1
1448 1 56 PRO HA 1 59 ALA MB . . 3.670 3.615 3.443 3.689 0.019 13 0 "[ . 1 . 2]" 1
1449 1 56 PRO HA 1 60 GLU H . . 3.940 3.702 3.659 3.769 . 0 0 "[ . 1 . 2]" 1
1450 1 56 PRO HA 1 60 GLU HB3 . . 5.270 3.418 3.323 3.664 . 0 0 "[ . 1 . 2]" 1
1451 1 56 PRO HB2 1 57 VAL H . . 4.080 3.995 3.910 4.025 . 0 0 "[ . 1 . 2]" 1
1452 1 56 PRO HB2 1 57 VAL HA . . 4.410 4.375 4.331 4.393 . 0 0 "[ . 1 . 2]" 1
1453 1 56 PRO HB3 1 57 VAL H . . 4.510 4.521 4.473 4.538 0.028 17 0 "[ . 1 . 2]" 1
1454 1 56 PRO QD 1 57 VAL H . . 3.060 2.986 2.884 3.025 . 0 0 "[ . 1 . 2]" 1
1455 1 56 PRO QD 1 57 VAL MG1 . . 5.500 5.383 4.868 5.432 . 0 0 "[ . 1 . 2]" 1
1456 1 56 PRO QG 1 57 VAL H . . 4.110 3.328 3.175 3.383 . 0 0 "[ . 1 . 2]" 1
1457 1 57 VAL H 1 57 VAL HB . . 3.040 2.343 2.279 2.369 . 0 0 "[ . 1 . 2]" 1
1458 1 57 VAL H 1 57 VAL MG2 . . 3.390 3.007 2.922 3.552 0.162 13 0 "[ . 1 . 2]" 1
1459 1 57 VAL H 1 58 PHE H . . 3.060 2.273 2.226 2.296 . 0 0 "[ . 1 . 2]" 1
1460 1 57 VAL H 1 58 PHE HA . . 5.050 4.929 4.900 4.963 . 0 0 "[ . 1 . 2]" 1
1461 1 57 VAL H 1 58 PHE HB2 . . 4.550 4.386 4.331 4.439 . 0 0 "[ . 1 . 2]" 1
1462 1 57 VAL H 1 59 ALA H . . 4.430 4.302 4.195 4.453 0.023 13 0 "[ . 1 . 2]" 1
1463 1 57 VAL H 1 60 GLU H . . 4.780 4.394 4.319 4.572 . 0 0 "[ . 1 . 2]" 1
1464 1 57 VAL HA 1 57 VAL MG1 . . 2.910 2.565 2.512 2.946 0.036 13 0 "[ . 1 . 2]" 1
1465 1 57 VAL HA 1 57 VAL MG2 . . 3.070 2.093 1.923 2.265 . 0 0 "[ . 1 . 2]" 1
1466 1 57 VAL HA 1 59 ALA H . . 5.500 5.426 5.336 5.468 . 0 0 "[ . 1 . 2]" 1
1467 1 57 VAL HA 1 60 GLU H . . 4.320 4.174 4.101 4.221 . 0 0 "[ . 1 . 2]" 1
1468 1 57 VAL HA 1 60 GLU HB3 . . 4.000 3.741 3.662 3.895 . 0 0 "[ . 1 . 2]" 1
1469 1 57 VAL HA 1 60 GLU HG2 . . 3.190 2.154 1.990 2.223 . 0 0 "[ . 1 . 2]" 1
1470 1 57 VAL HA 1 60 GLU HG3 . . 3.910 3.659 3.323 3.743 . 0 0 "[ . 1 . 2]" 1
1471 1 57 VAL HA 1 61 TYR H . . 4.380 4.037 3.960 4.096 . 0 0 "[ . 1 . 2]" 1
1472 1 57 VAL HB 1 58 PHE H . . 3.280 2.629 2.551 3.176 . 0 0 "[ . 1 . 2]" 1
1473 1 57 VAL HB 1 58 PHE HA . . 5.240 4.577 4.504 5.121 . 0 0 "[ . 1 . 2]" 1
1474 1 57 VAL HB 1 110 LYS QG . . 4.330 3.725 3.505 4.528 0.198 13 0 "[ . 1 . 2]" 1
1475 1 57 VAL MG1 1 58 PHE H . . 3.470 2.896 2.207 3.006 . 0 0 "[ . 1 . 2]" 1
1476 1 57 VAL MG1 1 58 PHE QD . . 3.070 2.072 1.900 2.799 . 0 0 "[ . 1 . 2]" 1
1477 1 57 VAL MG1 1 60 GLU HG2 . . 4.630 3.612 3.540 3.884 . 0 0 "[ . 1 . 2]" 1
1478 1 57 VAL MG1 1 60 GLU HG3 . . 4.840 4.634 4.181 4.817 . 0 0 "[ . 1 . 2]" 1
1479 1 57 VAL MG1 1 61 TYR H . . 5.280 4.151 4.071 4.284 . 0 0 "[ . 1 . 2]" 1
1480 1 57 VAL MG1 1 61 TYR HB2 . . 4.320 3.628 3.492 3.848 . 0 0 "[ . 1 . 2]" 1
1481 1 57 VAL MG1 1 61 TYR QE . . 4.360 2.525 2.371 2.633 . 0 0 "[ . 1 . 2]" 1
1482 1 57 VAL MG1 1 110 LYS QD . . 3.290 3.095 2.483 3.324 0.034 11 0 "[ . 1 . 2]" 1
1483 1 57 VAL MG1 1 110 LYS QE . . 4.140 3.496 3.049 4.140 . 0 0 "[ . 1 . 2]" 1
1484 1 57 VAL MG1 1 110 LYS QG . . 4.110 2.256 2.012 3.528 . 0 0 "[ . 1 . 2]" 1
1485 1 57 VAL MG1 1 113 LEU QD . . 4.390 2.051 1.888 2.224 . 0 0 "[ . 1 . 2]" 1
1486 1 57 VAL MG1 1 113 LEU HG . . 5.050 4.117 3.813 4.289 . 0 0 "[ . 1 . 2]" 1
1487 1 57 VAL MG1 1 114 GLN QE . . 4.950 3.253 3.033 3.911 . 0 0 "[ . 1 . 2]" 1
1488 1 57 VAL MG1 1 114 GLN QG . . 5.060 4.953 4.768 5.096 0.036 16 0 "[ . 1 . 2]" 1
1489 1 57 VAL MG2 1 58 PHE H . . 4.240 4.006 3.967 4.167 . 0 0 "[ . 1 . 2]" 1
1490 1 57 VAL MG2 1 60 GLU H . . 5.500 5.602 5.554 5.632 0.132 16 0 "[ . 1 . 2]" 1
1491 1 57 VAL MG2 1 60 GLU HG2 . . 4.240 3.889 3.440 4.027 . 0 0 "[ . 1 . 2]" 1
1492 1 57 VAL MG2 1 60 GLU HG3 . . 5.040 4.926 4.181 5.070 0.030 11 0 "[ . 1 . 2]" 1
1493 1 57 VAL MG2 1 61 TYR H . . 5.500 5.478 4.931 5.537 0.037 8 0 "[ . 1 . 2]" 1
1494 1 57 VAL MG2 1 61 TYR QE . . 3.660 3.521 2.610 3.677 0.017 14 0 "[ . 1 . 2]" 1
1495 1 57 VAL MG2 1 110 LYS HA . . 4.100 4.113 3.872 4.150 0.050 14 0 "[ . 1 . 2]" 1
1496 1 57 VAL MG2 1 110 LYS HB2 . . 4.160 4.114 3.958 4.335 0.175 13 0 "[ . 1 . 2]" 1
1497 1 57 VAL MG2 1 110 LYS QD . . 3.800 2.997 1.759 3.322 . 0 0 "[ . 1 . 2]" 1
1498 1 57 VAL MG2 1 110 LYS QE . . 3.730 2.236 1.918 2.818 . 0 0 "[ . 1 . 2]" 1
1499 1 57 VAL MG2 1 110 LYS HG2 . . 3.410 2.299 2.193 3.495 0.085 13 0 "[ . 1 . 2]" 1
1500 1 57 VAL MG2 1 110 LYS HG3 . . 3.410 2.437 2.163 2.716 . 0 0 "[ . 1 . 2]" 1
1501 1 57 VAL MG2 1 114 GLN HE21 . . 5.500 5.062 4.729 5.544 0.044 7 0 "[ . 1 . 2]" 1
1502 1 57 VAL MG2 1 114 GLN HE22 . . 5.500 5.050 4.128 5.538 0.038 11 0 "[ . 1 . 2]" 1
1503 1 58 PHE H 1 58 PHE HB2 . . 3.120 2.519 2.483 2.537 . 0 0 "[ . 1 . 2]" 1
1504 1 58 PHE H 1 58 PHE HB3 . . 3.760 3.592 3.590 3.594 . 0 0 "[ . 1 . 2]" 1
1505 1 58 PHE H 1 58 PHE QE . . 4.760 4.282 4.232 4.520 . 0 0 "[ . 1 . 2]" 1
1506 1 58 PHE H 1 59 ALA H . . 3.150 3.016 2.954 3.042 . 0 0 "[ . 1 . 2]" 1
1507 1 58 PHE H 1 59 ALA MB . . 4.550 4.431 4.377 4.463 . 0 0 "[ . 1 . 2]" 1
1508 1 58 PHE H 1 60 GLU H . . 4.320 4.129 4.081 4.188 . 0 0 "[ . 1 . 2]" 1
1509 1 58 PHE HA 1 58 PHE QD . . 3.900 1.982 1.927 2.005 . 0 0 "[ . 1 . 2]" 1
1510 1 58 PHE HA 1 59 ALA MB . . 5.130 5.034 5.028 5.041 . 0 0 "[ . 1 . 2]" 1
1511 1 58 PHE HA 1 60 GLU H . . 4.710 4.655 4.579 4.744 0.034 13 0 "[ . 1 . 2]" 1
1512 1 58 PHE HA 1 61 TYR QE . . 5.500 5.126 4.821 5.291 . 0 0 "[ . 1 . 2]" 1
1513 1 58 PHE HA 1 62 ALA H . . 4.040 4.078 4.040 4.149 0.109 13 0 "[ . 1 . 2]" 1
1514 1 58 PHE HB2 1 59 ALA H . . 3.380 1.978 1.953 2.024 . 0 0 "[ . 1 . 2]" 1
1515 1 58 PHE HB2 1 59 ALA MB . . 4.270 3.722 3.707 3.757 . 0 0 "[ . 1 . 2]" 1
1516 1 58 PHE HB2 1 62 ALA MB . . 5.500 5.552 5.496 5.583 0.083 6 0 "[ . 1 . 2]" 1
1517 1 58 PHE HB2 1 113 LEU QD . . 5.440 4.499 4.411 4.661 . 0 0 "[ . 1 . 2]" 1
1518 1 58 PHE HB3 1 59 ALA H . . 3.300 3.021 2.941 3.066 . 0 0 "[ . 1 . 2]" 1
1519 1 58 PHE HB3 1 59 ALA MB . . 4.710 4.498 4.432 4.537 . 0 0 "[ . 1 . 2]" 1
1520 1 58 PHE HB3 1 60 GLU H . . 5.500 5.456 5.427 5.500 0.000 17 0 "[ . 1 . 2]" 1
1521 1 58 PHE HB3 1 62 ALA H . . 5.080 5.010 4.969 5.072 . 0 0 "[ . 1 . 2]" 1
1522 1 58 PHE HB3 1 113 LEU QD . . 5.020 3.823 3.709 4.081 . 0 0 "[ . 1 . 2]" 1
1523 1 58 PHE QD 1 59 ALA MB . . 5.470 5.148 5.076 5.187 . 0 0 "[ . 1 . 2]" 1
1524 1 58 PHE QD 1 113 LEU QD . . 3.170 1.919 1.854 2.033 . 0 0 "[ . 1 . 2]" 1
1525 1 58 PHE QE 1 108 ALA HA . . 4.410 4.376 4.235 4.474 0.064 14 0 "[ . 1 . 2]" 1
1526 1 58 PHE QE 1 108 ALA MB . . 4.960 4.933 4.751 4.989 0.029 14 0 "[ . 1 . 2]" 1
1527 1 58 PHE QE 1 109 ARG H . . 4.230 4.027 3.881 4.235 0.005 11 0 "[ . 1 . 2]" 1
1528 1 58 PHE QE 1 113 LEU QD . . 3.870 1.938 1.747 2.028 . 0 0 "[ . 1 . 2]" 1
1529 1 58 PHE HZ 1 108 ALA HA . . 4.110 3.325 3.140 3.477 . 0 0 "[ . 1 . 2]" 1
1530 1 58 PHE HZ 1 108 ALA MB . . 4.420 4.396 4.251 4.455 0.035 20 0 "[ . 1 . 2]" 1
1531 1 58 PHE HZ 1 109 ARG H . . 4.030 3.480 3.242 3.811 . 0 0 "[ . 1 . 2]" 1
1532 1 59 ALA H 1 59 ALA MB . . 2.670 2.203 2.178 2.225 . 0 0 "[ . 1 . 2]" 1
1533 1 59 ALA H 1 60 GLU H . . 3.070 2.962 2.908 2.992 . 0 0 "[ . 1 . 2]" 1
1534 1 59 ALA H 1 60 GLU HG2 . . 5.210 5.077 4.741 5.137 . 0 0 "[ . 1 . 2]" 1
1535 1 59 ALA H 1 61 TYR H . . 4.260 4.110 4.033 4.232 . 0 0 "[ . 1 . 2]" 1
1536 1 59 ALA H 1 62 ALA H . . 4.940 4.780 4.740 4.827 . 0 0 "[ . 1 . 2]" 1
1537 1 59 ALA H 1 62 ALA MB . . 4.850 4.695 4.631 4.744 . 0 0 "[ . 1 . 2]" 1
1538 1 59 ALA HA 1 62 ALA H . . 3.680 3.543 3.475 3.616 . 0 0 "[ . 1 . 2]" 1
1539 1 59 ALA HA 1 62 ALA HA . . 5.500 5.416 5.341 5.498 . 0 0 "[ . 1 . 2]" 1
1540 1 59 ALA HA 1 62 ALA MB . . 3.400 2.670 2.562 2.744 . 0 0 "[ . 1 . 2]" 1
1541 1 59 ALA MB 1 60 GLU H . . 2.980 2.479 2.423 2.523 . 0 0 "[ . 1 . 2]" 1
1542 1 59 ALA MB 1 60 GLU HB3 . . 4.630 3.908 3.880 3.947 . 0 0 "[ . 1 . 2]" 1
1543 1 59 ALA MB 1 60 GLU HG2 . . 4.980 4.956 4.673 4.997 0.017 17 0 "[ . 1 . 2]" 1
1544 1 59 ALA MB 1 62 ALA MB . . 4.020 3.938 3.841 3.997 . 0 0 "[ . 1 . 2]" 1
1545 1 60 GLU H 1 60 GLU HA . . 2.920 2.807 2.775 2.819 . 0 0 "[ . 1 . 2]" 1
1546 1 60 GLU H 1 60 GLU HB2 . . 3.580 3.484 3.465 3.549 . 0 0 "[ . 1 . 2]" 1
1547 1 60 GLU H 1 60 GLU HB3 . . 2.590 2.176 2.150 2.294 . 0 0 "[ . 1 . 2]" 1
1548 1 60 GLU H 1 60 GLU HG2 . . 3.580 2.928 2.640 3.001 . 0 0 "[ . 1 . 2]" 1
1549 1 60 GLU H 1 60 GLU HG3 . . 3.920 3.922 3.595 3.984 0.064 17 0 "[ . 1 . 2]" 1
1550 1 60 GLU H 1 61 TYR H . . 3.020 2.644 2.606 2.763 . 0 0 "[ . 1 . 2]" 1
1551 1 60 GLU H 1 61 TYR HA . . 5.320 5.253 5.219 5.353 0.033 13 0 "[ . 1 . 2]" 1
1552 1 60 GLU H 1 61 TYR HB2 . . 4.970 4.627 4.574 4.809 . 0 0 "[ . 1 . 2]" 1
1553 1 60 GLU H 1 61 TYR QD . . 5.500 4.818 4.747 5.072 . 0 0 "[ . 1 . 2]" 1
1554 1 60 GLU H 1 62 ALA H . . 4.410 4.342 4.290 4.413 0.003 13 0 "[ . 1 . 2]" 1
1555 1 60 GLU H 1 62 ALA MB . . 5.020 4.815 4.759 4.852 . 0 0 "[ . 1 . 2]" 1
1556 1 60 GLU H 1 63 LYS H . . 5.390 5.371 5.297 5.411 0.021 17 0 "[ . 1 . 2]" 1
1557 1 60 GLU H 1 63 LYS QD . . 5.120 4.984 4.743 5.064 . 0 0 "[ . 1 . 2]" 1
1558 1 60 GLU HA 1 60 GLU HB2 . . 2.760 2.275 2.267 2.330 . 0 0 "[ . 1 . 2]" 1
1559 1 60 GLU HA 1 60 GLU HG2 . . 4.070 3.843 3.829 3.886 . 0 0 "[ . 1 . 2]" 1
1560 1 60 GLU HA 1 60 GLU HG3 . . 3.690 3.491 3.466 3.573 . 0 0 "[ . 1 . 2]" 1
1561 1 60 GLU HA 1 62 ALA H . . 4.860 4.598 4.535 4.694 . 0 0 "[ . 1 . 2]" 1
1562 1 60 GLU HA 1 62 ALA MB . . 5.500 4.806 4.778 4.878 . 0 0 "[ . 1 . 2]" 1
1563 1 60 GLU HA 1 63 LYS H . . 4.030 3.894 3.840 3.969 . 0 0 "[ . 1 . 2]" 1
1564 1 60 GLU HA 1 63 LYS QE . . 4.420 4.364 4.219 4.437 0.017 16 0 "[ . 1 . 2]" 1
1565 1 60 GLU HA 1 64 LYS H . . 5.160 4.531 4.254 4.642 . 0 0 "[ . 1 . 2]" 1
1566 1 60 GLU HB2 1 61 TYR QD . . 4.490 4.393 4.262 4.423 . 0 0 "[ . 1 . 2]" 1
1567 1 60 GLU HB2 1 64 LYS QD . . 4.660 4.663 4.442 4.695 0.035 14 0 "[ . 1 . 2]" 1
1568 1 60 GLU HB2 1 64 LYS HG2 . . 4.960 4.872 4.704 4.964 0.004 5 0 "[ . 1 . 2]" 1
1569 1 60 GLU HB2 1 64 LYS HG3 . . 4.770 4.151 3.508 4.454 . 0 0 "[ . 1 . 2]" 1
1570 1 60 GLU HG2 1 61 TYR H . . 3.880 2.456 2.373 2.552 . 0 0 "[ . 1 . 2]" 1
1571 1 60 GLU HG2 1 61 TYR HA . . 4.500 3.873 3.805 4.339 . 0 0 "[ . 1 . 2]" 1
1572 1 60 GLU HG2 1 61 TYR QD . . 4.510 2.571 2.464 3.270 . 0 0 "[ . 1 . 2]" 1
1573 1 60 GLU HG2 1 61 TYR QE . . 4.270 3.600 3.487 4.059 . 0 0 "[ . 1 . 2]" 1
1574 1 60 GLU HG2 1 62 ALA H . . 5.100 5.050 5.007 5.145 0.045 18 0 "[ . 1 . 2]" 1
1575 1 60 GLU HG2 1 64 LYS QE . . 5.040 4.555 4.364 4.989 . 0 0 "[ . 1 . 2]" 1
1576 1 60 GLU HG2 1 64 LYS HG3 . . 5.090 4.306 4.209 4.928 . 0 0 "[ . 1 . 2]" 1
1577 1 60 GLU HG3 1 61 TYR QD . . 4.570 1.962 1.924 1.982 . 0 0 "[ . 1 . 2]" 1
1578 1 60 GLU HG3 1 62 ALA H . . 5.500 5.136 4.823 5.262 . 0 0 "[ . 1 . 2]" 1
1579 1 60 GLU HG3 1 63 LYS H . . 5.500 5.456 5.411 5.526 0.026 18 0 "[ . 1 . 2]" 1
1580 1 60 GLU HG3 1 64 LYS H . . 5.070 4.694 4.579 4.946 . 0 0 "[ . 1 . 2]" 1
1581 1 60 GLU HG3 1 64 LYS HB2 . . 4.700 4.401 3.960 4.704 0.004 17 0 "[ . 1 . 2]" 1
1582 1 60 GLU HG3 1 64 LYS QD . . 4.930 3.700 3.458 4.373 . 0 0 "[ . 1 . 2]" 1
1583 1 60 GLU HG3 1 64 LYS QE . . 3.980 3.304 3.104 3.651 . 0 0 "[ . 1 . 2]" 1
1584 1 60 GLU HG3 1 64 LYS HG3 . . 4.640 2.680 2.544 3.195 . 0 0 "[ . 1 . 2]" 1
1585 1 61 TYR H 1 61 TYR HB3 . . 3.670 3.529 3.518 3.563 . 0 0 "[ . 1 . 2]" 1
1586 1 61 TYR H 1 61 TYR QD . . 3.510 2.868 2.831 2.959 . 0 0 "[ . 1 . 2]" 1
1587 1 61 TYR H 1 61 TYR QE . . 5.000 4.821 4.683 4.872 . 0 0 "[ . 1 . 2]" 1
1588 1 61 TYR H 1 62 ALA H . . 3.000 2.609 2.542 2.695 . 0 0 "[ . 1 . 2]" 1
1589 1 61 TYR H 1 62 ALA MB . . 4.380 4.100 4.032 4.161 . 0 0 "[ . 1 . 2]" 1
1590 1 61 TYR H 1 63 LYS H . . 4.280 4.266 4.176 4.312 0.032 18 0 "[ . 1 . 2]" 1
1591 1 61 TYR H 1 64 LYS H . . 4.690 4.705 4.638 4.728 0.038 17 0 "[ . 1 . 2]" 1
1592 1 61 TYR HA 1 61 TYR QD . . 3.610 1.935 1.835 1.961 . 0 0 "[ . 1 . 2]" 1
1593 1 61 TYR HA 1 61 TYR QE . . 4.260 4.155 4.138 4.165 . 0 0 "[ . 1 . 2]" 1
1594 1 61 TYR HA 1 62 ALA HA . . 5.100 4.934 4.917 4.948 . 0 0 "[ . 1 . 2]" 1
1595 1 61 TYR HA 1 63 LYS H . . 4.340 4.142 4.018 4.189 . 0 0 "[ . 1 . 2]" 1
1596 1 61 TYR HA 1 63 LYS HB2 . . 5.500 5.211 5.110 5.349 . 0 0 "[ . 1 . 2]" 1
1597 1 61 TYR HA 1 64 LYS H . . 3.350 3.086 3.034 3.166 . 0 0 "[ . 1 . 2]" 1
1598 1 61 TYR HA 1 64 LYS HA . . 4.930 4.844 4.800 4.888 . 0 0 "[ . 1 . 2]" 1
1599 1 61 TYR HA 1 64 LYS HB2 . . 3.320 2.151 1.975 2.281 . 0 0 "[ . 1 . 2]" 1
1600 1 61 TYR HA 1 64 LYS HB3 . . 3.760 3.728 3.594 3.783 0.023 17 0 "[ . 1 . 2]" 1
1601 1 61 TYR HA 1 64 LYS QD . . 4.520 4.228 4.021 4.540 0.020 13 0 "[ . 1 . 2]" 1
1602 1 61 TYR HA 1 64 LYS QE . . 4.400 3.148 2.951 3.253 . 0 0 "[ . 1 . 2]" 1
1603 1 61 TYR HA 1 64 LYS HG2 . . 4.550 3.857 3.508 4.356 . 0 0 "[ . 1 . 2]" 1
1604 1 61 TYR HA 1 64 LYS HG3 . . 4.260 2.356 1.991 2.982 . 0 0 "[ . 1 . 2]" 1
1605 1 61 TYR HA 1 65 PHE H . . 4.120 4.096 3.742 4.149 0.029 8 0 "[ . 1 . 2]" 1
1606 1 61 TYR HA 1 65 PHE QD . . 4.480 3.707 3.142 3.991 . 0 0 "[ . 1 . 2]" 1
1607 1 61 TYR HB2 1 62 ALA H . . 4.480 2.659 2.528 2.727 . 0 0 "[ . 1 . 2]" 1
1608 1 61 TYR HB2 1 62 ALA HA . . 4.680 4.509 4.382 4.557 . 0 0 "[ . 1 . 2]" 1
1609 1 61 TYR HB2 1 63 LYS H . . 5.190 5.168 5.092 5.206 0.016 16 0 "[ . 1 . 2]" 1
1610 1 61 TYR HB2 1 70 PHE QE . . 4.640 3.911 3.392 4.086 . 0 0 "[ . 1 . 2]" 1
1611 1 61 TYR HB2 1 117 ILE MD . . 5.010 4.945 4.694 5.038 0.028 4 0 "[ . 1 . 2]" 1
1612 1 61 TYR HB3 1 62 ALA HA . . 4.400 4.119 4.094 4.194 . 0 0 "[ . 1 . 2]" 1
1613 1 61 TYR HB3 1 63 LYS H . . 5.500 5.269 5.174 5.337 . 0 0 "[ . 1 . 2]" 1
1614 1 61 TYR HB3 1 64 LYS HB2 . . 4.690 3.994 3.913 4.142 . 0 0 "[ . 1 . 2]" 1
1615 1 61 TYR HB3 1 65 PHE QD . . 4.840 3.395 2.983 3.641 . 0 0 "[ . 1 . 2]" 1
1616 1 61 TYR HB3 1 70 PHE QE . . 4.510 3.138 2.764 3.334 . 0 0 "[ . 1 . 2]" 1
1617 1 61 TYR HB3 1 117 ILE MD . . 4.290 4.205 3.957 4.302 0.012 20 0 "[ . 1 . 2]" 1
1618 1 61 TYR QD 1 62 ALA H . . 4.560 4.445 4.413 4.467 . 0 0 "[ . 1 . 2]" 1
1619 1 61 TYR QD 1 64 LYS H . . 4.590 4.634 4.576 4.660 0.070 5 0 "[ . 1 . 2]" 1
1620 1 61 TYR QD 1 64 LYS QD . . 4.380 4.035 3.817 4.287 . 0 0 "[ . 1 . 2]" 1
1621 1 61 TYR QD 1 64 LYS QE . . 4.360 2.616 2.242 2.774 . 0 0 "[ . 1 . 2]" 1
1622 1 61 TYR QD 1 113 LEU QD . . 4.170 1.878 1.819 1.926 . 0 0 "[ . 1 . 2]" 1
1623 1 61 TYR QD 1 114 GLN H . . 4.970 3.878 3.767 4.252 . 0 0 "[ . 1 . 2]" 1
1624 1 61 TYR QD 1 114 GLN HA . . 4.500 3.637 3.511 3.713 . 0 0 "[ . 1 . 2]" 1
1625 1 61 TYR QD 1 114 GLN QG . . 5.280 5.215 5.083 5.300 0.020 12 0 "[ . 1 . 2]" 1
1626 1 61 TYR QE 1 64 LYS QE . . 4.280 2.690 2.488 3.057 . 0 0 "[ . 1 . 2]" 1
1627 1 61 TYR QE 1 64 LYS HG3 . . 4.740 4.406 4.180 4.742 0.002 13 0 "[ . 1 . 2]" 1
1628 1 61 TYR QE 1 110 LYS HA . . 4.460 4.303 4.103 4.453 . 0 0 "[ . 1 . 2]" 1
1629 1 61 TYR QE 1 113 LEU H . . 5.500 5.130 4.942 5.501 0.001 13 0 "[ . 1 . 2]" 1
1630 1 61 TYR QE 1 113 LEU QD . . 5.060 2.319 1.949 2.718 . 0 0 "[ . 1 . 2]" 1
1631 1 61 TYR QE 1 114 GLN H . . 4.130 2.665 2.474 2.834 . 0 0 "[ . 1 . 2]" 1
1632 1 61 TYR QE 1 114 GLN HA . . 4.290 3.555 3.349 3.715 . 0 0 "[ . 1 . 2]" 1
1633 1 61 TYR QE 1 114 GLN QE . . 3.840 2.295 1.875 3.629 . 0 0 "[ . 1 . 2]" 1
1634 1 61 TYR QE 1 114 GLN QG . . 4.170 3.563 3.484 3.620 . 0 0 "[ . 1 . 2]" 1
1635 1 62 ALA H 1 62 ALA MB . . 2.720 2.048 2.039 2.059 . 0 0 "[ . 1 . 2]" 1
1636 1 62 ALA H 1 63 LYS H . . 3.010 2.958 2.918 3.008 . 0 0 "[ . 1 . 2]" 1
1637 1 62 ALA H 1 63 LYS QD . . 5.500 5.310 5.232 5.356 . 0 0 "[ . 1 . 2]" 1
1638 1 62 ALA H 1 63 LYS HG3 . . 4.460 4.465 4.419 4.498 0.038 13 0 "[ . 1 . 2]" 1
1639 1 62 ALA H 1 65 PHE H . . 5.220 4.934 4.793 5.031 . 0 0 "[ . 1 . 2]" 1
1640 1 62 ALA H 1 70 PHE HB2 . . 5.500 5.210 5.014 5.327 . 0 0 "[ . 1 . 2]" 1
1641 1 62 ALA H 1 70 PHE QE . . 4.480 4.230 4.111 4.375 . 0 0 "[ . 1 . 2]" 1
1642 1 62 ALA H 1 70 PHE HZ . . 5.480 5.187 5.030 5.298 . 0 0 "[ . 1 . 2]" 1
1643 1 62 ALA HA 1 64 LYS H . . 5.020 4.725 4.638 4.881 . 0 0 "[ . 1 . 2]" 1
1644 1 62 ALA HA 1 65 PHE H . . 4.210 3.936 3.858 4.028 . 0 0 "[ . 1 . 2]" 1
1645 1 62 ALA HA 1 68 ALA MB . . 4.480 4.352 4.285 4.432 . 0 0 "[ . 1 . 2]" 1
1646 1 62 ALA HA 1 70 PHE QD . . 4.070 2.818 2.746 2.854 . 0 0 "[ . 1 . 2]" 1
1647 1 62 ALA HA 1 70 PHE QE . . 3.820 3.016 2.891 3.182 . 0 0 "[ . 1 . 2]" 1
1648 1 62 ALA HA 1 70 PHE HZ . . 4.380 3.516 3.297 3.832 . 0 0 "[ . 1 . 2]" 1
1649 1 62 ALA MB 1 63 LYS H . . 3.080 2.626 2.580 2.687 . 0 0 "[ . 1 . 2]" 1
1650 1 62 ALA MB 1 63 LYS HB2 . . 4.780 4.643 4.615 4.687 . 0 0 "[ . 1 . 2]" 1
1651 1 62 ALA MB 1 63 LYS QD . . 4.900 4.205 4.119 4.253 . 0 0 "[ . 1 . 2]" 1
1652 1 62 ALA MB 1 64 LYS H . . 4.680 4.535 4.492 4.602 . 0 0 "[ . 1 . 2]" 1
1653 1 62 ALA MB 1 65 PHE H . . 5.150 4.784 4.719 4.891 . 0 0 "[ . 1 . 2]" 1
1654 1 62 ALA MB 1 68 ALA MB . . 5.050 4.824 4.732 4.983 . 0 0 "[ . 1 . 2]" 1
1655 1 62 ALA MB 1 70 PHE H . . 5.490 5.039 4.988 5.140 . 0 0 "[ . 1 . 2]" 1
1656 1 62 ALA MB 1 70 PHE HA . . 4.920 4.310 4.219 4.421 . 0 0 "[ . 1 . 2]" 1
1657 1 62 ALA MB 1 70 PHE HB2 . . 3.880 2.071 1.987 2.218 . 0 0 "[ . 1 . 2]" 1
1658 1 62 ALA MB 1 70 PHE HB3 . . 3.750 2.260 2.068 2.375 . 0 0 "[ . 1 . 2]" 1
1659 1 62 ALA MB 1 70 PHE QD . . 3.980 2.897 2.805 3.066 . 0 0 "[ . 1 . 2]" 1
1660 1 62 ALA MB 1 70 PHE QE . . 4.380 3.951 3.809 4.153 . 0 0 "[ . 1 . 2]" 1
1661 1 63 LYS H 1 63 LYS HA . . 2.930 2.874 2.865 2.886 . 0 0 "[ . 1 . 2]" 1
1662 1 63 LYS H 1 63 LYS HB2 . . 2.730 2.617 2.593 2.650 . 0 0 "[ . 1 . 2]" 1
1663 1 63 LYS H 1 63 LYS QD . . 3.760 3.362 3.284 3.402 . 0 0 "[ . 1 . 2]" 1
1664 1 63 LYS H 1 63 LYS QE . . 4.640 4.508 4.460 4.554 . 0 0 "[ . 1 . 2]" 1
1665 1 63 LYS H 1 63 LYS HG2 . . 3.500 3.502 3.459 3.533 0.033 16 0 "[ . 1 . 2]" 1
1666 1 63 LYS H 1 63 LYS HG3 . . 3.310 2.045 1.967 2.095 . 0 0 "[ . 1 . 2]" 1
1667 1 63 LYS H 1 64 LYS H . . 2.680 2.474 2.450 2.497 . 0 0 "[ . 1 . 2]" 1
1668 1 63 LYS H 1 64 LYS HA . . 5.190 5.099 5.073 5.124 . 0 0 "[ . 1 . 2]" 1
1669 1 63 LYS H 1 64 LYS HG3 . . 4.720 4.635 4.536 4.735 0.015 13 0 "[ . 1 . 2]" 1
1670 1 63 LYS H 1 65 PHE H . . 4.150 3.922 3.835 3.987 . 0 0 "[ . 1 . 2]" 1
1671 1 63 LYS H 1 65 PHE QB . . 5.500 5.345 5.219 5.436 . 0 0 "[ . 1 . 2]" 1
1672 1 63 LYS HA 1 63 LYS HG3 . . 3.830 2.997 2.975 3.018 . 0 0 "[ . 1 . 2]" 1
1673 1 63 LYS HA 1 65 PHE H . . 4.150 3.878 3.781 3.956 . 0 0 "[ . 1 . 2]" 1
1674 1 63 LYS HA 1 66 PRO HA . . 4.710 4.483 4.426 4.527 . 0 0 "[ . 1 . 2]" 1
1675 1 63 LYS HB2 1 63 LYS QD . . 3.210 2.351 2.310 2.572 . 0 0 "[ . 1 . 2]" 1
1676 1 63 LYS HB2 1 64 LYS H . . 3.040 2.574 2.501 2.629 . 0 0 "[ . 1 . 2]" 1
1677 1 63 LYS HB2 1 64 LYS HA . . 4.040 4.074 4.039 4.096 0.056 5 0 "[ . 1 . 2]" 1
1678 1 63 LYS HB2 1 64 LYS HG3 . . 4.700 4.384 4.259 4.508 . 0 0 "[ . 1 . 2]" 1
1679 1 63 LYS HB2 1 65 PHE H . . 4.970 4.817 4.750 4.892 . 0 0 "[ . 1 . 2]" 1
1680 1 63 LYS HB3 1 63 LYS QE . . 4.370 1.991 1.959 2.097 . 0 0 "[ . 1 . 2]" 1
1681 1 63 LYS HB3 1 64 LYS H . . 4.760 3.784 3.742 3.831 . 0 0 "[ . 1 . 2]" 1
1682 1 63 LYS QE 1 63 LYS HG2 . . 3.420 2.649 2.554 2.797 . 0 0 "[ . 1 . 2]" 1
1683 1 63 LYS QE 1 63 LYS HG3 . . 3.880 3.387 3.365 3.413 . 0 0 "[ . 1 . 2]" 1
1684 1 63 LYS HG2 1 64 LYS H . . 5.200 4.991 4.953 5.022 . 0 0 "[ . 1 . 2]" 1
1685 1 64 LYS H 1 64 LYS HB2 . . 2.990 2.477 2.385 2.571 . 0 0 "[ . 1 . 2]" 1
1686 1 64 LYS H 1 64 LYS HB3 . . 3.600 3.586 3.574 3.594 . 0 0 "[ . 1 . 2]" 1
1687 1 64 LYS H 1 64 LYS QD . . 4.480 4.262 4.126 4.398 . 0 0 "[ . 1 . 2]" 1
1688 1 64 LYS H 1 64 LYS QE . . 4.460 4.454 4.371 4.491 0.031 7 0 "[ . 1 . 2]" 1
1689 1 64 LYS H 1 64 LYS HG2 . . 4.110 2.660 2.426 2.924 . 0 0 "[ . 1 . 2]" 1
1690 1 64 LYS H 1 64 LYS HG3 . . 3.360 2.782 2.723 2.830 . 0 0 "[ . 1 . 2]" 1
1691 1 64 LYS H 1 65 PHE H . . 2.890 2.719 2.667 2.806 . 0 0 "[ . 1 . 2]" 1
1692 1 64 LYS H 1 65 PHE HA . . 5.490 5.339 5.301 5.398 . 0 0 "[ . 1 . 2]" 1
1693 1 64 LYS H 1 65 PHE QB . . 4.870 4.665 4.603 4.762 . 0 0 "[ . 1 . 2]" 1
1694 1 64 LYS H 1 66 PRO HD3 . . 5.500 5.342 5.208 5.410 . 0 0 "[ . 1 . 2]" 1
1695 1 64 LYS HA 1 64 LYS QD . . 4.140 3.228 3.145 3.312 . 0 0 "[ . 1 . 2]" 1
1696 1 64 LYS HA 1 64 LYS QE . . 4.380 4.151 4.023 4.305 . 0 0 "[ . 1 . 2]" 1
1697 1 64 LYS HA 1 64 LYS HG2 . . 3.440 2.370 2.268 2.443 . 0 0 "[ . 1 . 2]" 1
1698 1 64 LYS HA 1 64 LYS HG3 . . 3.720 3.593 3.490 3.658 . 0 0 "[ . 1 . 2]" 1
1699 1 64 LYS HA 1 65 PHE HA . . 4.610 4.548 4.534 4.565 . 0 0 "[ . 1 . 2]" 1
1700 1 64 LYS HA 1 65 PHE QB . . 5.500 5.284 5.256 5.306 . 0 0 "[ . 1 . 2]" 1
1701 1 64 LYS HA 1 66 PRO HD3 . . 4.270 3.868 3.718 3.940 . 0 0 "[ . 1 . 2]" 1
1702 1 64 LYS HB2 1 65 PHE H . . 3.350 2.928 2.785 3.034 . 0 0 "[ . 1 . 2]" 1
1703 1 64 LYS HB2 1 65 PHE HA . . 5.230 4.679 4.572 4.759 . 0 0 "[ . 1 . 2]" 1
1704 1 64 LYS HB2 1 65 PHE QD . . 4.180 2.925 2.798 3.092 . 0 0 "[ . 1 . 2]" 1
1705 1 64 LYS HB2 1 65 PHE QE . . 5.130 4.368 4.273 4.497 . 0 0 "[ . 1 . 2]" 1
1706 1 64 LYS HB3 1 64 LYS QD . . 3.490 2.361 2.277 2.432 . 0 0 "[ . 1 . 2]" 1
1707 1 64 LYS HB3 1 65 PHE H . . 3.900 3.841 3.742 3.906 0.006 11 0 "[ . 1 . 2]" 1
1708 1 64 LYS HB3 1 65 PHE QB . . 4.970 4.873 4.792 4.922 . 0 0 "[ . 1 . 2]" 1
1709 1 64 LYS HB3 1 65 PHE QD . . 4.690 3.637 3.502 3.808 . 0 0 "[ . 1 . 2]" 1
1710 1 64 LYS HB3 1 65 PHE QE . . 4.860 4.380 4.243 4.554 . 0 0 "[ . 1 . 2]" 1
1711 1 64 LYS QE 1 64 LYS HG2 . . 3.340 3.305 3.302 3.316 . 0 0 "[ . 1 . 2]" 1
1712 1 64 LYS QE 1 64 LYS HG3 . . 3.220 2.413 2.311 2.474 . 0 0 "[ . 1 . 2]" 1
1713 1 64 LYS QE 1 65 PHE H . . 5.160 5.139 5.070 5.185 0.025 7 0 "[ . 1 . 2]" 1
1714 1 64 LYS QE 1 65 PHE QD . . 4.350 4.015 3.860 4.194 . 0 0 "[ . 1 . 2]" 1
1715 1 64 LYS QE 1 65 PHE QE . . 4.240 3.885 3.764 4.105 . 0 0 "[ . 1 . 2]" 1
1716 1 64 LYS HG2 1 65 PHE H . . 4.950 4.700 4.589 4.816 . 0 0 "[ . 1 . 2]" 1
1717 1 64 LYS HG3 1 65 PHE H . . 4.950 4.707 4.579 4.799 . 0 0 "[ . 1 . 2]" 1
1718 1 65 PHE H 1 65 PHE QB . . 2.980 2.355 2.312 2.387 . 0 0 "[ . 1 . 2]" 1
1719 1 65 PHE H 1 66 PRO HA . . 4.980 4.814 4.761 4.890 . 0 0 "[ . 1 . 2]" 1
1720 1 65 PHE H 1 66 PRO HD2 . . 4.590 4.382 4.336 4.430 . 0 0 "[ . 1 . 2]" 1
1721 1 65 PHE H 1 66 PRO HD3 . . 4.040 3.809 3.740 3.894 . 0 0 "[ . 1 . 2]" 1
1722 1 65 PHE H 1 67 GLY H . . 5.500 5.113 5.003 5.213 . 0 0 "[ . 1 . 2]" 1
1723 1 65 PHE H 1 70 PHE QD . . 5.500 5.270 5.204 5.359 . 0 0 "[ . 1 . 2]" 1
1724 1 65 PHE H 1 70 PHE QE . . 3.970 3.902 3.767 4.024 0.054 13 0 "[ . 1 . 2]" 1
1725 1 65 PHE H 1 70 PHE HZ . . 4.440 4.170 3.919 4.334 . 0 0 "[ . 1 . 2]" 1
1726 1 65 PHE HA 1 65 PHE QD . . 3.880 2.923 2.876 2.976 . 0 0 "[ . 1 . 2]" 1
1727 1 65 PHE HA 1 65 PHE QE . . 5.050 4.478 4.458 4.492 . 0 0 "[ . 1 . 2]" 1
1728 1 65 PHE HA 1 66 PRO HA . . 4.820 4.577 4.569 4.591 . 0 0 "[ . 1 . 2]" 1
1729 1 65 PHE HA 1 66 PRO QB . . 4.780 4.693 4.682 4.715 . 0 0 "[ . 1 . 2]" 1
1730 1 65 PHE HA 1 66 PRO HD2 . . 3.310 1.945 1.937 1.965 . 0 0 "[ . 1 . 2]" 1
1731 1 65 PHE HA 1 66 PRO HD3 . . 3.410 2.665 2.642 2.713 . 0 0 "[ . 1 . 2]" 1
1732 1 65 PHE HA 1 66 PRO HG2 . . 4.720 4.128 4.123 4.139 . 0 0 "[ . 1 . 2]" 1
1733 1 65 PHE HA 1 66 PRO QG . . 3.930 3.812 3.805 3.829 . 0 0 "[ . 1 . 2]" 1
1734 1 65 PHE HA 1 66 PRO HG3 . . 4.720 4.479 4.465 4.512 . 0 0 "[ . 1 . 2]" 1
1735 1 65 PHE HA 1 67 GLY H . . 3.900 3.200 3.167 3.229 . 0 0 "[ . 1 . 2]" 1
1736 1 65 PHE HA 1 68 ALA H . . 5.500 5.174 5.067 5.234 . 0 0 "[ . 1 . 2]" 1
1737 1 65 PHE HA 1 68 ALA MB . . 5.500 5.005 4.943 5.071 . 0 0 "[ . 1 . 2]" 1
1738 1 65 PHE HA 1 70 PHE QE . . 5.430 4.550 4.439 4.642 . 0 0 "[ . 1 . 2]" 1
1739 1 65 PHE HA 1 121 VAL MG2 . . 5.500 5.498 5.445 5.546 0.046 5 0 "[ . 1 . 2]" 1
1740 1 65 PHE QB 1 66 PRO HD2 . . 4.410 3.907 3.881 3.956 . 0 0 "[ . 1 . 2]" 1
1741 1 65 PHE QB 1 66 PRO HD3 . . 4.540 4.461 4.458 4.466 . 0 0 "[ . 1 . 2]" 1
1742 1 65 PHE QB 1 67 GLY H . . 4.160 3.091 2.945 3.226 . 0 0 "[ . 1 . 2]" 1
1743 1 65 PHE QB 1 68 ALA H . . 3.820 3.791 3.704 3.858 0.038 18 0 "[ . 1 . 2]" 1
1744 1 65 PHE QB 1 68 ALA MB . . 3.550 2.731 2.648 2.791 . 0 0 "[ . 1 . 2]" 1
1745 1 65 PHE QB 1 70 PHE QE . . 4.070 2.275 2.149 2.354 . 0 0 "[ . 1 . 2]" 1
1746 1 65 PHE QB 1 117 ILE MG . . 3.830 2.479 2.402 2.628 . 0 0 "[ . 1 . 2]" 1
1747 1 65 PHE QB 1 121 VAL MG1 . . 3.770 2.341 2.074 2.439 . 0 0 "[ . 1 . 2]" 1
1748 1 65 PHE QB 1 121 VAL MG2 . . 3.550 3.202 3.143 3.275 . 0 0 "[ . 1 . 2]" 1
1749 1 65 PHE QD 1 66 PRO HD2 . . 4.190 4.005 3.911 4.082 . 0 0 "[ . 1 . 2]" 1
1750 1 65 PHE QD 1 67 GLY H . . 4.520 3.663 3.598 3.722 . 0 0 "[ . 1 . 2]" 1
1751 1 65 PHE QD 1 68 ALA MB . . 4.160 4.172 4.135 4.201 0.041 16 0 "[ . 1 . 2]" 1
1752 1 65 PHE QD 1 70 PHE QE . . 4.510 4.033 3.896 4.105 . 0 0 "[ . 1 . 2]" 1
1753 1 65 PHE QD 1 117 ILE MD . . 4.960 4.925 4.768 4.982 0.022 13 0 "[ . 1 . 2]" 1
1754 1 65 PHE QD 1 117 ILE MG . . 3.900 2.460 2.422 2.498 . 0 0 "[ . 1 . 2]" 1
1755 1 65 PHE QD 1 121 VAL MG1 . . 3.970 1.970 1.943 2.020 . 0 0 "[ . 1 . 2]" 1
1756 1 65 PHE QD 1 121 VAL MG2 . . 3.660 3.651 3.576 3.679 0.019 13 0 "[ . 1 . 2]" 1
1757 1 65 PHE QD 1 122 GLY H . . 4.980 4.246 4.047 4.333 . 0 0 "[ . 1 . 2]" 1
1758 1 65 PHE QE 1 114 GLN HA . . 4.400 3.815 3.599 4.110 . 0 0 "[ . 1 . 2]" 1
1759 1 65 PHE QE 1 114 GLN HB2 . . 5.190 3.705 3.518 4.321 . 0 0 "[ . 1 . 2]" 1
1760 1 65 PHE QE 1 114 GLN QB . . 4.330 3.510 3.369 3.946 . 0 0 "[ . 1 . 2]" 1
1761 1 65 PHE QE 1 114 GLN HB3 . . 5.190 4.378 4.153 4.614 . 0 0 "[ . 1 . 2]" 1
1762 1 65 PHE QE 1 117 ILE MG . . 3.840 2.632 2.572 2.665 . 0 0 "[ . 1 . 2]" 1
1763 1 65 PHE QE 1 118 VAL HA . . 4.090 2.488 2.340 2.593 . 0 0 "[ . 1 . 2]" 1
1764 1 65 PHE QE 1 121 VAL HB . . 4.300 3.306 3.224 3.372 . 0 0 "[ . 1 . 2]" 1
1765 1 65 PHE QE 1 122 GLY H . . 4.020 3.407 3.185 3.564 . 0 0 "[ . 1 . 2]" 1
1766 1 65 PHE QE 1 122 GLY QA . . 4.170 2.521 2.315 2.709 . 0 0 "[ . 1 . 2]" 1
1767 1 65 PHE HZ 1 118 VAL HA . . 4.670 3.361 3.135 3.651 . 0 0 "[ . 1 . 2]" 1
1768 1 65 PHE HZ 1 118 VAL MG1 . . 3.130 1.851 1.766 2.014 . 0 0 "[ . 1 . 2]" 1
1769 1 65 PHE HZ 1 118 VAL MG2 . . 4.570 4.390 4.274 4.550 . 0 0 "[ . 1 . 2]" 1
1770 1 66 PRO QB 1 67 GLY H . . 3.930 3.635 3.553 3.730 . 0 0 "[ . 1 . 2]" 1
1771 1 66 PRO QB 1 67 GLY HA2 . . 4.590 4.171 4.127 4.224 . 0 0 "[ . 1 . 2]" 1
1772 1 66 PRO QB 1 67 GLY HA3 . . 5.220 4.865 4.829 4.892 . 0 0 "[ . 1 . 2]" 1
1773 1 66 PRO QB 1 68 ALA H . . 4.780 4.563 4.467 4.672 . 0 0 "[ . 1 . 2]" 1
1774 1 66 PRO HD2 1 67 GLY H . . 3.700 2.900 2.804 3.041 . 0 0 "[ . 1 . 2]" 1
1775 1 66 PRO HD3 1 67 GLY H . . 4.130 3.978 3.928 4.053 . 0 0 "[ . 1 . 2]" 1
1776 1 66 PRO QG 1 67 GLY H . . 3.670 3.086 2.921 3.289 . 0 0 "[ . 1 . 2]" 1
1777 1 67 GLY H 1 68 ALA H . . 3.120 2.736 2.651 2.834 . 0 0 "[ . 1 . 2]" 1
1778 1 67 GLY H 1 68 ALA MB . . 4.020 3.860 3.751 3.947 . 0 0 "[ . 1 . 2]" 1
1779 1 67 GLY H 1 70 PHE QE . . 5.030 4.315 4.113 4.418 . 0 0 "[ . 1 . 2]" 1
1780 1 67 GLY H 1 121 VAL MG1 . . 5.040 2.487 2.418 2.580 . 0 0 "[ . 1 . 2]" 1
1781 1 67 GLY H 1 121 VAL MG2 . . 5.010 4.756 4.676 4.925 . 0 0 "[ . 1 . 2]" 1
1782 1 67 GLY HA2 1 68 ALA H . . 3.400 3.070 3.030 3.123 . 0 0 "[ . 1 . 2]" 1
1783 1 67 GLY HA2 1 68 ALA HA . . 4.580 4.400 4.389 4.413 . 0 0 "[ . 1 . 2]" 1
1784 1 67 GLY HA2 1 68 ALA MB . . 5.500 4.575 4.550 4.600 . 0 0 "[ . 1 . 2]" 1
1785 1 67 GLY HA3 1 121 VAL HB . . 5.500 4.628 4.544 4.798 . 0 0 "[ . 1 . 2]" 1
1786 1 67 GLY HA3 1 121 VAL MG1 . . 4.980 1.968 1.891 2.095 . 0 0 "[ . 1 . 2]" 1
1787 1 68 ALA H 1 68 ALA MB . . 2.870 2.631 2.597 2.653 . 0 0 "[ . 1 . 2]" 1
1788 1 68 ALA H 1 69 VAL H . . 4.430 4.403 4.392 4.411 . 0 0 "[ . 1 . 2]" 1
1789 1 68 ALA H 1 70 PHE QD . . 4.790 4.127 4.017 4.213 . 0 0 "[ . 1 . 2]" 1
1790 1 68 ALA H 1 70 PHE QE . . 3.950 3.314 3.255 3.348 . 0 0 "[ . 1 . 2]" 1
1791 1 68 ALA H 1 70 PHE HZ . . 5.500 5.533 5.515 5.564 0.064 13 0 "[ . 1 . 2]" 1
1792 1 68 ALA H 1 117 ILE MG . . 5.500 5.542 5.493 5.597 0.097 13 0 "[ . 1 . 2]" 1
1793 1 68 ALA H 1 121 VAL MG1 . . 4.750 2.887 2.829 2.946 . 0 0 "[ . 1 . 2]" 1
1794 1 68 ALA H 1 121 VAL MG2 . . 4.630 4.356 4.200 4.458 . 0 0 "[ . 1 . 2]" 1
1795 1 68 ALA HA 1 69 VAL H . . 2.900 2.426 2.383 2.488 . 0 0 "[ . 1 . 2]" 1
1796 1 68 ALA HA 1 69 VAL HA . . 4.410 4.361 4.348 4.380 . 0 0 "[ . 1 . 2]" 1
1797 1 68 ALA HA 1 69 VAL MG1 . . 4.490 3.429 3.205 3.785 . 0 0 "[ . 1 . 2]" 1
1798 1 68 ALA HA 1 69 VAL MG2 . . 4.210 3.993 3.804 4.239 0.029 17 0 "[ . 1 . 2]" 1
1799 1 68 ALA HA 1 121 VAL MG1 . . 4.250 3.256 3.071 3.475 . 0 0 "[ . 1 . 2]" 1
1800 1 68 ALA HA 1 121 VAL MG2 . . 3.580 3.512 3.354 3.626 0.046 14 0 "[ . 1 . 2]" 1
1801 1 68 ALA MB 1 69 VAL H . . 2.980 2.461 2.330 2.549 . 0 0 "[ . 1 . 2]" 1
1802 1 68 ALA MB 1 69 VAL HA . . 4.580 4.106 4.050 4.147 . 0 0 "[ . 1 . 2]" 1
1803 1 68 ALA MB 1 70 PHE H . . 4.580 2.764 2.600 2.834 . 0 0 "[ . 1 . 2]" 1
1804 1 68 ALA MB 1 70 PHE QD . . 4.100 2.484 2.326 2.561 . 0 0 "[ . 1 . 2]" 1
1805 1 68 ALA MB 1 70 PHE QE . . 3.320 1.917 1.897 1.956 . 0 0 "[ . 1 . 2]" 1
1806 1 68 ALA MB 1 70 PHE HZ . . 3.890 3.151 3.064 3.271 . 0 0 "[ . 1 . 2]" 1
1807 1 68 ALA MB 1 117 ILE MG . . 4.270 3.318 3.260 3.396 . 0 0 "[ . 1 . 2]" 1
1808 1 68 ALA MB 1 121 VAL H . . 5.150 4.848 4.784 4.903 . 0 0 "[ . 1 . 2]" 1
1809 1 68 ALA MB 1 121 VAL HA . . 4.950 4.175 4.044 4.255 . 0 0 "[ . 1 . 2]" 1
1810 1 68 ALA MB 1 121 VAL HB . . 3.870 3.667 3.616 3.728 . 0 0 "[ . 1 . 2]" 1
1811 1 68 ALA MB 1 121 VAL MG1 . . 3.110 1.881 1.814 1.902 . 0 0 "[ . 1 . 2]" 1
1812 1 68 ALA MB 1 121 VAL MG2 . . 2.980 1.887 1.807 1.950 . 0 0 "[ . 1 . 2]" 1
1813 1 69 VAL H 1 69 VAL HB . . 3.740 3.688 3.648 3.731 . 0 0 "[ . 1 . 2]" 1
1814 1 69 VAL H 1 69 VAL MG1 . . 3.610 2.495 2.255 2.863 . 0 0 "[ . 1 . 2]" 1
1815 1 69 VAL H 1 69 VAL MG2 . . 2.990 1.923 1.816 2.163 . 0 0 "[ . 1 . 2]" 1
1816 1 69 VAL H 1 70 PHE H . . 4.210 2.178 2.092 2.257 . 0 0 "[ . 1 . 2]" 1
1817 1 69 VAL H 1 70 PHE HA . . 4.940 4.425 4.339 4.502 . 0 0 "[ . 1 . 2]" 1
1818 1 69 VAL H 1 70 PHE QE . . 5.090 4.741 4.621 4.857 . 0 0 "[ . 1 . 2]" 1
1819 1 69 VAL HA 1 69 VAL MG1 . . 3.190 2.401 2.166 2.527 . 0 0 "[ . 1 . 2]" 1
1820 1 69 VAL HA 1 70 PHE H . . 3.570 3.513 3.482 3.526 . 0 0 "[ . 1 . 2]" 1
1821 1 69 VAL HA 1 70 PHE HA . . 5.430 5.324 5.305 5.332 . 0 0 "[ . 1 . 2]" 1
1822 1 69 VAL HA 1 70 PHE QD . . 4.210 3.602 3.528 3.673 . 0 0 "[ . 1 . 2]" 1
1823 1 69 VAL HB 1 70 PHE H . . 4.110 3.807 3.625 4.037 . 0 0 "[ . 1 . 2]" 1
1824 1 69 VAL MG2 1 70 PHE H . . 3.870 1.987 1.847 2.126 . 0 0 "[ . 1 . 2]" 1
1825 1 70 PHE H 1 70 PHE HB2 . . 3.580 3.468 3.442 3.484 . 0 0 "[ . 1 . 2]" 1
1826 1 70 PHE H 1 70 PHE HB3 . . 4.120 4.065 4.050 4.076 . 0 0 "[ . 1 . 2]" 1
1827 1 70 PHE H 1 70 PHE QD . . 3.460 3.091 3.008 3.161 . 0 0 "[ . 1 . 2]" 1
1828 1 70 PHE H 1 70 PHE QE . . 4.770 4.614 4.556 4.664 . 0 0 "[ . 1 . 2]" 1
1829 1 70 PHE H 1 71 LEU H . . 4.500 4.392 4.255 4.507 0.007 17 0 "[ . 1 . 2]" 1
1830 1 70 PHE HA 1 71 LEU H . . 2.900 2.341 2.241 2.451 . 0 0 "[ . 1 . 2]" 1
1831 1 70 PHE HA 1 71 LEU HA . . 4.930 4.579 4.504 4.650 . 0 0 "[ . 1 . 2]" 1
1832 1 70 PHE HA 1 71 LEU HB3 . . 4.170 4.043 4.008 4.122 . 0 0 "[ . 1 . 2]" 1
1833 1 70 PHE HB2 1 71 LEU H . . 4.040 3.812 3.611 4.031 . 0 0 "[ . 1 . 2]" 1
1834 1 70 PHE HB3 1 71 LEU H . . 4.080 2.591 2.324 2.879 . 0 0 "[ . 1 . 2]" 1
1835 1 70 PHE QD 1 71 LEU H . . 4.330 3.672 3.542 3.802 . 0 0 "[ . 1 . 2]" 1
1836 1 70 PHE QE 1 117 ILE HA . . 5.190 5.306 5.278 5.352 0.162 15 0 "[ . 1 . 2]" 1
1837 1 70 PHE QE 1 121 VAL MG1 . . 3.730 3.311 3.048 3.428 . 0 0 "[ . 1 . 2]" 1
1838 1 70 PHE QE 1 121 VAL MG2 . . 4.130 3.488 3.365 3.580 . 0 0 "[ . 1 . 2]" 1
1839 1 70 PHE HZ 1 117 ILE MG . . 3.930 2.108 1.985 2.225 . 0 0 "[ . 1 . 2]" 1
1840 1 70 PHE HZ 1 121 VAL MG2 . . 4.350 3.309 3.236 3.357 . 0 0 "[ . 1 . 2]" 1
1841 1 71 LEU H 1 71 LEU HB2 . . 4.040 3.842 3.779 3.889 . 0 0 "[ . 1 . 2]" 1
1842 1 71 LEU H 1 71 LEU HB3 . . 3.560 3.190 3.095 3.256 . 0 0 "[ . 1 . 2]" 1
1843 1 71 LEU H 1 71 LEU MD2 . . 5.500 4.374 4.037 4.698 . 0 0 "[ . 1 . 2]" 1
1844 1 71 LEU H 1 72 LYS H . . 4.310 4.170 4.137 4.223 . 0 0 "[ . 1 . 2]" 1
1845 1 71 LEU HA 1 71 LEU MD1 . . 4.070 3.015 2.613 3.340 . 0 0 "[ . 1 . 2]" 1
1846 1 71 LEU HA 1 71 LEU MD2 . . 4.330 4.011 3.881 4.052 . 0 0 "[ . 1 . 2]" 1
1847 1 71 LEU HA 1 71 LEU HG . . 3.800 3.076 2.983 3.167 . 0 0 "[ . 1 . 2]" 1
1848 1 71 LEU HA 1 72 LYS H . . 2.980 2.265 2.249 2.293 . 0 0 "[ . 1 . 2]" 1
1849 1 71 LEU HB2 1 71 LEU MD1 . . 3.340 2.070 1.900 2.210 . 0 0 "[ . 1 . 2]" 1
1850 1 71 LEU HB2 1 71 LEU MD2 . . 3.610 2.854 2.714 3.027 . 0 0 "[ . 1 . 2]" 1
1851 1 71 LEU HB2 1 72 LYS H . . 3.770 3.640 3.594 3.713 . 0 0 "[ . 1 . 2]" 1
1852 1 71 LEU HB3 1 71 LEU MD2 . . 3.590 2.005 1.952 2.107 . 0 0 "[ . 1 . 2]" 1
1853 1 71 LEU HB3 1 72 LYS H . . 4.690 4.129 4.036 4.175 . 0 0 "[ . 1 . 2]" 1
1854 1 71 LEU MD1 1 72 LYS H . . 4.190 2.662 2.264 3.360 . 0 0 "[ . 1 . 2]" 1
1855 1 71 LEU MD2 1 72 LYS H . . 4.570 4.010 3.845 4.108 . 0 0 "[ . 1 . 2]" 1
1856 1 71 LEU HG 1 72 LYS H . . 3.170 2.355 2.248 2.471 . 0 0 "[ . 1 . 2]" 1
1857 1 71 LEU HG 1 72 LYS HA . . 3.620 3.344 3.244 3.438 . 0 0 "[ . 1 . 2]" 1
1858 1 72 LYS H 1 72 LYS QB . . 3.420 2.435 2.360 2.511 . 0 0 "[ . 1 . 2]" 1
1859 1 72 LYS H 1 72 LYS QE . . 4.630 3.523 3.278 3.824 . 0 0 "[ . 1 . 2]" 1
1860 1 72 LYS H 1 72 LYS HG2 . . 4.020 3.467 3.087 4.169 0.149 17 0 "[ . 1 . 2]" 1
1861 1 72 LYS HA 1 72 LYS HG3 . . 3.690 3.311 3.072 3.704 0.014 15 0 "[ . 1 . 2]" 1
1862 1 72 LYS HA 1 73 VAL H . . 2.920 2.168 2.143 2.190 . 0 0 "[ . 1 . 2]" 1
1863 1 72 LYS HA 1 73 VAL HA . . 4.840 4.402 4.391 4.415 . 0 0 "[ . 1 . 2]" 1
1864 1 72 LYS HA 1 73 VAL HB . . 5.500 5.170 4.426 5.594 0.094 17 0 "[ . 1 . 2]" 1
1865 1 72 LYS HA 1 73 VAL QG . . 3.780 3.252 3.017 3.748 . 0 0 "[ . 1 . 2]" 1
1866 1 72 LYS QE 1 72 LYS HG2 . . 3.650 2.607 2.444 3.300 . 0 0 "[ . 1 . 2]" 1
1867 1 72 LYS QE 1 73 VAL H . . 5.500 5.350 5.243 5.400 . 0 0 "[ . 1 . 2]" 1
1868 1 72 LYS HG2 1 73 VAL H . . 3.950 3.765 2.825 4.006 0.056 13 0 "[ . 1 . 2]" 1
1869 1 72 LYS HG2 1 74 ASP H . . 5.500 5.441 5.099 5.562 0.062 3 0 "[ . 1 . 2]" 1
1870 1 73 VAL H 1 73 VAL HB . . 3.990 3.467 2.526 3.887 . 0 0 "[ . 1 . 2]" 1
1871 1 73 VAL H 1 73 VAL MG1 . . 3.780 2.487 1.971 3.830 0.050 6 0 "[ . 1 . 2]" 1
1872 1 73 VAL H 1 73 VAL QG . . 3.200 2.208 1.965 2.761 . 0 0 "[ . 1 . 2]" 1
1873 1 73 VAL H 1 73 VAL MG2 . . 3.780 2.926 2.583 3.898 0.118 10 0 "[ . 1 . 2]" 1
1874 1 73 VAL H 1 74 ASP H . . 4.500 4.472 4.402 4.533 0.033 8 0 "[ . 1 . 2]" 1
1875 1 73 VAL HA 1 73 VAL MG1 . . 3.240 2.747 2.387 3.202 . 0 0 "[ . 1 . 2]" 1
1876 1 73 VAL HA 1 73 VAL MG2 . . 3.240 2.821 2.171 3.130 . 0 0 "[ . 1 . 2]" 1
1877 1 73 VAL HA 1 74 ASP H . . 2.870 2.407 2.270 2.633 . 0 0 "[ . 1 . 2]" 1
1878 1 73 VAL HA 1 74 ASP HA . . 5.200 4.403 4.370 4.470 . 0 0 "[ . 1 . 2]" 1
1879 1 73 VAL HA 1 74 ASP HB2 . . 4.390 4.148 4.023 4.268 . 0 0 "[ . 1 . 2]" 1
1880 1 73 VAL HA 1 78 LEU MD2 . . 3.630 3.426 3.304 3.591 . 0 0 "[ . 1 . 2]" 1
1881 1 73 VAL HB 1 74 ASP HA . . 5.500 5.120 4.742 5.811 0.311 19 0 "[ . 1 . 2]" 1
1882 1 73 VAL HB 1 78 LEU MD2 . . 4.080 2.983 2.319 4.150 0.070 13 0 "[ . 1 . 2]" 1
1883 1 73 VAL QG 1 74 ASP H . . 3.430 2.192 1.777 2.500 . 0 0 "[ . 1 . 2]" 1
1884 1 73 VAL QG 1 74 ASP HA . . 3.890 3.315 3.208 3.463 . 0 0 "[ . 1 . 2]" 1
1885 1 73 VAL QG 1 74 ASP HB3 . . 4.270 4.183 3.867 4.327 0.057 18 0 "[ . 1 . 2]" 1
1886 1 73 VAL QG 1 75 VAL MG1 . . 3.950 2.883 2.694 3.096 . 0 0 "[ . 1 . 2]" 1
1887 1 73 VAL QG 1 78 LEU MD2 . . 3.100 1.911 1.667 2.219 . 0 0 "[ . 1 . 2]" 1
1888 1 73 VAL QG 1 78 LEU HG . . 4.060 2.889 2.490 3.270 . 0 0 "[ . 1 . 2]" 1
1889 1 73 VAL QG 1 79 LYS H . . 5.300 5.146 4.773 5.333 0.033 15 0 "[ . 1 . 2]" 1
1890 1 73 VAL QG 1 82 ALA MB . . 4.400 3.687 3.412 3.827 . 0 0 "[ . 1 . 2]" 1
1891 1 73 VAL MG1 1 74 ASP H . . 4.240 3.513 1.814 4.123 . 0 0 "[ . 1 . 2]" 1
1892 1 73 VAL MG2 1 74 ASP H . . 4.240 2.567 1.785 3.710 . 0 0 "[ . 1 . 2]" 1
1893 1 74 ASP H 1 74 ASP HB2 . . 3.150 2.714 2.501 2.903 . 0 0 "[ . 1 . 2]" 1
1894 1 74 ASP H 1 74 ASP HB3 . . 4.030 2.856 2.680 3.119 . 0 0 "[ . 1 . 2]" 1
1895 1 74 ASP H 1 75 VAL H . . 4.390 4.290 4.040 4.423 0.033 7 0 "[ . 1 . 2]" 1
1896 1 74 ASP H 1 75 VAL HA . . 5.160 4.900 4.707 5.037 . 0 0 "[ . 1 . 2]" 1
1897 1 74 ASP H 1 76 ASP H . . 5.090 4.660 4.553 4.857 . 0 0 "[ . 1 . 2]" 1
1898 1 74 ASP H 1 77 GLU H . . 5.020 4.944 4.752 5.145 0.125 19 0 "[ . 1 . 2]" 1
1899 1 74 ASP H 1 77 GLU QG . . 4.360 3.734 3.476 4.132 . 0 0 "[ . 1 . 2]" 1
1900 1 74 ASP H 1 78 LEU H . . 4.660 4.618 4.494 4.718 0.058 9 0 "[ . 1 . 2]" 1
1901 1 74 ASP H 1 78 LEU HB3 . . 5.270 5.121 4.924 5.297 0.027 20 0 "[ . 1 . 2]" 1
1902 1 74 ASP H 1 78 LEU MD2 . . 3.260 1.962 1.783 2.306 . 0 0 "[ . 1 . 2]" 1
1903 1 74 ASP H 1 78 LEU HG . . 4.950 4.297 4.007 4.658 . 0 0 "[ . 1 . 2]" 1
1904 1 74 ASP HA 1 75 VAL H . . 2.940 2.145 2.139 2.174 . 0 0 "[ . 1 . 2]" 1
1905 1 74 ASP HA 1 75 VAL HA . . 4.810 4.393 4.370 4.440 . 0 0 "[ . 1 . 2]" 1
1906 1 74 ASP HA 1 75 VAL MG1 . . 3.810 3.521 3.302 3.708 . 0 0 "[ . 1 . 2]" 1
1907 1 74 ASP HA 1 75 VAL MG2 . . 4.230 4.044 3.847 4.232 0.002 6 0 "[ . 1 . 2]" 1
1908 1 74 ASP HA 1 76 ASP H . . 4.130 3.799 3.680 3.877 . 0 0 "[ . 1 . 2]" 1
1909 1 74 ASP HA 1 78 LEU MD2 . . 4.140 3.847 3.658 4.179 0.039 20 0 "[ . 1 . 2]" 1
1910 1 74 ASP HB2 1 75 VAL H . . 4.670 4.464 4.360 4.595 . 0 0 "[ . 1 . 2]" 1
1911 1 74 ASP HB2 1 76 ASP H . . 4.720 4.412 4.314 4.588 . 0 0 "[ . 1 . 2]" 1
1912 1 74 ASP HB2 1 77 GLU H . . 5.000 4.809 4.562 4.917 . 0 0 "[ . 1 . 2]" 1
1913 1 74 ASP HB2 1 77 GLU QG . . 4.370 3.663 3.364 3.966 . 0 0 "[ . 1 . 2]" 1
1914 1 74 ASP HB2 1 78 LEU MD2 . . 3.990 3.678 3.260 3.999 0.009 7 0 "[ . 1 . 2]" 1
1915 1 74 ASP HB3 1 76 ASP H . . 4.660 2.977 2.699 3.254 . 0 0 "[ . 1 . 2]" 1
1916 1 74 ASP HB3 1 77 GLU H . . 4.150 3.091 2.869 3.280 . 0 0 "[ . 1 . 2]" 1
1917 1 74 ASP HB3 1 77 GLU HB2 . . 5.110 4.978 4.827 5.134 0.024 3 0 "[ . 1 . 2]" 1
1918 1 74 ASP HB3 1 77 GLU HB3 . . 4.240 4.050 3.823 4.302 0.062 10 0 "[ . 1 . 2]" 1
1919 1 74 ASP HB3 1 77 GLU QG . . 3.760 2.253 1.995 2.603 . 0 0 "[ . 1 . 2]" 1
1920 1 74 ASP HB3 1 78 LEU MD2 . . 3.650 2.917 2.479 3.509 . 0 0 "[ . 1 . 2]" 1
1921 1 75 VAL H 1 75 VAL HB . . 3.770 3.644 3.623 3.668 . 0 0 "[ . 1 . 2]" 1
1922 1 75 VAL H 1 75 VAL MG1 . . 3.100 2.082 1.862 2.276 . 0 0 "[ . 1 . 2]" 1
1923 1 75 VAL H 1 75 VAL MG2 . . 3.070 2.324 2.033 2.530 . 0 0 "[ . 1 . 2]" 1
1924 1 75 VAL H 1 76 ASP H . . 3.440 3.102 2.974 3.313 . 0 0 "[ . 1 . 2]" 1
1925 1 75 VAL H 1 77 GLU H . . 4.970 4.730 4.647 4.882 . 0 0 "[ . 1 . 2]" 1
1926 1 75 VAL H 1 77 GLU QG . . 5.500 5.274 5.047 5.549 0.049 14 0 "[ . 1 . 2]" 1
1927 1 75 VAL H 1 78 LEU H . . 5.500 5.366 5.265 5.478 . 0 0 "[ . 1 . 2]" 1
1928 1 75 VAL H 1 82 ALA MB . . 4.640 4.568 4.389 4.665 0.025 1 0 "[ . 1 . 2]" 1
1929 1 75 VAL HA 1 75 VAL HB . . 2.980 2.381 2.327 2.424 . 0 0 "[ . 1 . 2]" 1
1930 1 75 VAL HA 1 75 VAL MG1 . . 3.030 2.465 2.366 2.581 . 0 0 "[ . 1 . 2]" 1
1931 1 75 VAL HA 1 75 VAL MG2 . . 3.540 3.178 3.158 3.199 . 0 0 "[ . 1 . 2]" 1
1932 1 75 VAL HA 1 76 ASP HA . . 5.170 4.433 4.399 4.464 . 0 0 "[ . 1 . 2]" 1
1933 1 75 VAL HA 1 77 GLU H . . 3.910 3.853 3.657 3.993 0.083 19 0 "[ . 1 . 2]" 1
1934 1 75 VAL HA 1 78 LEU H . . 4.160 3.732 3.655 3.859 . 0 0 "[ . 1 . 2]" 1
1935 1 75 VAL HA 1 78 LEU MD2 . . 4.070 3.567 3.374 3.718 . 0 0 "[ . 1 . 2]" 1
1936 1 75 VAL HA 1 78 LEU HG . . 4.550 4.082 3.929 4.268 . 0 0 "[ . 1 . 2]" 1
1937 1 75 VAL HA 1 79 LYS H . . 4.470 3.224 3.108 3.377 . 0 0 "[ . 1 . 2]" 1
1938 1 75 VAL HA 1 79 LYS HA . . 3.870 2.069 1.990 2.274 . 0 0 "[ . 1 . 2]" 1
1939 1 75 VAL HA 1 79 LYS HG3 . . 4.990 4.553 4.351 4.753 . 0 0 "[ . 1 . 2]" 1
1940 1 75 VAL HA 1 80 GLU H . . 5.500 5.259 5.181 5.375 . 0 0 "[ . 1 . 2]" 1
1941 1 75 VAL HA 1 82 ALA H . . 4.570 4.239 4.081 4.371 . 0 0 "[ . 1 . 2]" 1
1942 1 75 VAL HA 1 82 ALA MB . . 3.400 3.164 2.883 3.332 . 0 0 "[ . 1 . 2]" 1
1943 1 75 VAL HB 1 76 ASP H . . 4.980 4.500 4.472 4.542 . 0 0 "[ . 1 . 2]" 1
1944 1 75 VAL HB 1 76 ASP HA . . 5.190 4.916 4.828 5.040 . 0 0 "[ . 1 . 2]" 1
1945 1 75 VAL HB 1 79 LYS HA . . 4.280 2.957 2.814 3.150 . 0 0 "[ . 1 . 2]" 1
1946 1 75 VAL HB 1 79 LYS HB2 . . 5.240 4.126 3.905 4.403 . 0 0 "[ . 1 . 2]" 1
1947 1 75 VAL HB 1 82 ALA H . . 5.050 4.567 4.312 4.698 . 0 0 "[ . 1 . 2]" 1
1948 1 75 VAL HB 1 82 ALA HA . . 5.500 5.398 5.062 5.560 0.060 20 0 "[ . 1 . 2]" 1
1949 1 75 VAL HB 1 82 ALA MB . . 3.600 2.522 2.270 2.640 . 0 0 "[ . 1 . 2]" 1
1950 1 75 VAL HB 1 87 VAL QG . . 4.780 3.466 2.968 4.043 . 0 0 "[ . 1 . 2]" 1
1951 1 75 VAL HB 1 90 MET H . . 5.480 5.243 4.541 5.522 0.042 2 0 "[ . 1 . 2]" 1
1952 1 75 VAL MG1 1 76 ASP H . . 4.460 4.280 4.192 4.329 . 0 0 "[ . 1 . 2]" 1
1953 1 75 VAL MG1 1 77 GLU H . . 5.500 5.461 5.322 5.550 0.050 19 0 "[ . 1 . 2]" 1
1954 1 75 VAL MG1 1 79 LYS HA . . 4.110 3.238 3.045 3.523 . 0 0 "[ . 1 . 2]" 1
1955 1 75 VAL MG1 1 81 VAL QG . . 4.870 4.481 4.178 4.791 . 0 0 "[ . 1 . 2]" 1
1956 1 75 VAL MG1 1 82 ALA H . . 4.190 3.541 3.217 3.996 . 0 0 "[ . 1 . 2]" 1
1957 1 75 VAL MG1 1 82 ALA HA . . 4.120 3.744 3.419 4.022 . 0 0 "[ . 1 . 2]" 1
1958 1 75 VAL MG1 1 82 ALA MB . . 3.070 1.766 1.622 1.917 . 0 0 "[ . 1 . 2]" 1
1959 1 75 VAL MG1 1 87 VAL HB . . 4.940 4.058 3.278 4.558 . 0 0 "[ . 1 . 2]" 1
1960 1 75 VAL MG1 1 87 VAL MG1 . . 3.500 3.156 1.952 3.685 0.185 15 0 "[ . 1 . 2]" 1
1961 1 75 VAL MG1 1 87 VAL QG . . 3.070 2.042 1.840 2.636 . 0 0 "[ . 1 . 2]" 1
1962 1 75 VAL MG1 1 87 VAL MG2 . . 3.500 2.165 1.855 3.427 . 0 0 "[ . 1 . 2]" 1
1963 1 75 VAL MG1 1 89 ALA HA . . 4.520 3.250 2.380 3.832 . 0 0 "[ . 1 . 2]" 1
1964 1 75 VAL MG1 1 90 MET H . . 3.780 3.411 2.455 3.850 0.070 19 0 "[ . 1 . 2]" 1
1965 1 75 VAL MG2 1 76 ASP H . . 4.190 3.534 3.424 3.693 . 0 0 "[ . 1 . 2]" 1
1966 1 75 VAL MG2 1 76 ASP HA . . 3.950 3.778 3.542 3.918 . 0 0 "[ . 1 . 2]" 1
1967 1 75 VAL MG2 1 76 ASP QB . . 4.720 3.393 3.226 3.593 . 0 0 "[ . 1 . 2]" 1
1968 1 75 VAL MG2 1 77 GLU H . . 5.160 5.004 4.891 5.136 . 0 0 "[ . 1 . 2]" 1
1969 1 75 VAL MG2 1 78 LEU MD2 . . 5.410 5.251 5.076 5.472 0.062 20 0 "[ . 1 . 2]" 1
1970 1 75 VAL MG2 1 79 LYS H . . 5.500 5.291 5.134 5.495 . 0 0 "[ . 1 . 2]" 1
1971 1 75 VAL MG2 1 82 ALA MB . . 3.810 3.521 3.360 3.696 . 0 0 "[ . 1 . 2]" 1
1972 1 75 VAL MG2 1 87 VAL MG1 . . 5.010 4.753 2.905 5.082 0.072 2 0 "[ . 1 . 2]" 1
1973 1 75 VAL MG2 1 87 VAL QG . . 4.360 3.216 2.885 3.986 . 0 0 "[ . 1 . 2]" 1
1974 1 75 VAL MG2 1 87 VAL MG2 . . 5.010 3.432 2.941 4.913 . 0 0 "[ . 1 . 2]" 1
1975 1 75 VAL MG2 1 89 ALA HA . . 5.010 2.073 1.754 2.845 . 0 0 "[ . 1 . 2]" 1
1976 1 75 VAL MG2 1 90 MET H . . 4.400 3.103 2.243 3.465 . 0 0 "[ . 1 . 2]" 1
1977 1 76 ASP H 1 76 ASP HB2 . . 3.190 2.849 2.592 3.077 . 0 0 "[ . 1 . 2]" 1
1978 1 76 ASP H 1 76 ASP HB3 . . 3.190 2.949 2.734 3.151 . 0 0 "[ . 1 . 2]" 1
1979 1 76 ASP H 1 77 GLU H . . 2.820 1.778 1.701 1.850 . 0 0 "[ . 1 . 2]" 1
1980 1 76 ASP H 1 77 GLU HA . . 4.650 4.562 4.491 4.629 . 0 0 "[ . 1 . 2]" 1
1981 1 76 ASP H 1 77 GLU QG . . 3.810 3.191 2.957 3.514 . 0 0 "[ . 1 . 2]" 1
1982 1 76 ASP H 1 78 LEU H . . 3.600 3.101 2.881 3.218 . 0 0 "[ . 1 . 2]" 1
1983 1 76 ASP H 1 78 LEU MD2 . . 4.370 3.559 3.289 3.761 . 0 0 "[ . 1 . 2]" 1
1984 1 76 ASP H 1 78 LEU HG . . 5.500 5.309 5.159 5.421 . 0 0 "[ . 1 . 2]" 1
1985 1 76 ASP H 1 79 LYS H . . 5.060 3.725 3.541 3.851 . 0 0 "[ . 1 . 2]" 1
1986 1 76 ASP H 1 79 LYS HA . . 4.940 4.471 4.328 4.572 . 0 0 "[ . 1 . 2]" 1
1987 1 76 ASP H 1 79 LYS HG2 . . 5.070 4.244 3.889 4.421 . 0 0 "[ . 1 . 2]" 1
1988 1 76 ASP HA 1 77 GLU HA . . 4.630 4.529 4.480 4.558 . 0 0 "[ . 1 . 2]" 1
1989 1 76 ASP HA 1 79 LYS HG3 . . 4.750 4.572 4.244 4.762 0.012 8 0 "[ . 1 . 2]" 1
1990 1 76 ASP QB 1 77 GLU H . . 3.390 3.064 2.936 3.292 . 0 0 "[ . 1 . 2]" 1
1991 1 76 ASP QB 1 77 GLU HA . . 4.560 4.279 4.110 4.450 . 0 0 "[ . 1 . 2]" 1
1992 1 76 ASP QB 1 77 GLU HB3 . . 4.520 3.805 3.612 4.067 . 0 0 "[ . 1 . 2]" 1
1993 1 76 ASP HB2 1 77 GLU H . . 4.160 3.919 3.688 4.140 . 0 0 "[ . 1 . 2]" 1
1994 1 76 ASP HB3 1 77 GLU H . . 4.160 3.206 3.017 3.457 . 0 0 "[ . 1 . 2]" 1
1995 1 77 GLU H 1 77 GLU HB2 . . 3.910 3.760 3.693 3.844 . 0 0 "[ . 1 . 2]" 1
1996 1 77 GLU H 1 77 GLU HB3 . . 3.300 3.055 2.894 3.348 0.048 10 0 "[ . 1 . 2]" 1
1997 1 77 GLU H 1 77 GLU QG . . 3.170 2.048 1.867 2.348 . 0 0 "[ . 1 . 2]" 1
1998 1 77 GLU H 1 78 LEU HB3 . . 4.670 4.618 4.457 4.729 0.059 20 0 "[ . 1 . 2]" 1
1999 1 77 GLU H 1 78 LEU MD2 . . 4.140 3.037 2.913 3.402 . 0 0 "[ . 1 . 2]" 1
2000 1 77 GLU H 1 78 LEU HG . . 5.180 4.955 4.873 5.068 . 0 0 "[ . 1 . 2]" 1
2001 1 77 GLU H 1 79 LYS H . . 4.390 3.157 2.934 3.292 . 0 0 "[ . 1 . 2]" 1
2002 1 77 GLU H 1 79 LYS HA . . 4.890 4.875 4.686 4.944 0.054 7 0 "[ . 1 . 2]" 1
2003 1 77 GLU HA 1 77 GLU QG . . 3.380 3.346 3.330 3.400 0.020 19 0 "[ . 1 . 2]" 1
2004 1 77 GLU HA 1 78 LEU HA . . 4.680 4.529 4.523 4.540 . 0 0 "[ . 1 . 2]" 1
2005 1 77 GLU HA 1 78 LEU HB3 . . 5.500 5.153 5.114 5.222 . 0 0 "[ . 1 . 2]" 1
2006 1 77 GLU HA 1 79 LYS H . . 4.420 4.222 4.142 4.284 . 0 0 "[ . 1 . 2]" 1
2007 1 77 GLU HA 1 79 LYS QD . . 5.500 5.450 5.319 5.527 0.027 7 0 "[ . 1 . 2]" 1
2008 1 77 GLU HA 1 79 LYS HG3 . . 4.730 4.708 4.594 4.765 0.035 6 0 "[ . 1 . 2]" 1
2009 1 77 GLU HB2 1 78 LEU H . . 3.920 3.834 3.565 3.971 0.051 14 0 "[ . 1 . 2]" 1
2010 1 77 GLU HB2 1 78 LEU MD2 . . 4.720 4.138 3.800 4.421 . 0 0 "[ . 1 . 2]" 1
2011 1 77 GLU HB3 1 78 LEU H . . 3.970 3.985 3.841 4.065 0.095 10 0 "[ . 1 . 2]" 1
2012 1 77 GLU QG 1 78 LEU H . . 3.560 2.093 1.869 2.249 . 0 0 "[ . 1 . 2]" 1
2013 1 77 GLU QG 1 78 LEU MD1 . . 4.100 4.027 3.859 4.273 0.173 19 0 "[ . 1 . 2]" 1
2014 1 77 GLU QG 1 78 LEU MD2 . . 3.890 1.918 1.821 2.056 . 0 0 "[ . 1 . 2]" 1
2015 1 77 GLU QG 1 78 LEU HG . . 4.640 4.183 4.113 4.369 . 0 0 "[ . 1 . 2]" 1
2016 1 77 GLU QG 1 79 LYS H . . 4.680 4.123 3.903 4.197 . 0 0 "[ . 1 . 2]" 1
2017 1 78 LEU H 1 78 LEU HB2 . . 3.900 3.835 3.796 3.860 . 0 0 "[ . 1 . 2]" 1
2018 1 78 LEU H 1 78 LEU HB3 . . 3.370 2.904 2.809 2.958 . 0 0 "[ . 1 . 2]" 1
2019 1 78 LEU H 1 78 LEU MD1 . . 4.460 4.245 4.208 4.295 . 0 0 "[ . 1 . 2]" 1
2020 1 78 LEU H 1 78 LEU MD2 . . 3.280 1.912 1.858 2.297 . 0 0 "[ . 1 . 2]" 1
2021 1 78 LEU H 1 78 LEU HG . . 3.530 3.266 3.234 3.395 . 0 0 "[ . 1 . 2]" 1
2022 1 78 LEU H 1 79 LYS H . . 3.400 2.303 2.230 2.394 . 0 0 "[ . 1 . 2]" 1
2023 1 78 LEU H 1 79 LYS HA . . 4.570 4.133 4.089 4.210 . 0 0 "[ . 1 . 2]" 1
2024 1 78 LEU H 1 79 LYS QE . . 5.500 5.577 5.556 5.620 0.120 19 0 "[ . 1 . 2]" 1
2025 1 78 LEU H 1 80 GLU H . . 4.820 4.735 4.679 4.808 . 0 0 "[ . 1 . 2]" 1
2026 1 78 LEU H 1 81 VAL H . . 5.430 5.451 5.418 5.491 0.061 10 0 "[ . 1 . 2]" 1
2027 1 78 LEU HA 1 78 LEU MD1 . . 4.090 3.990 3.940 4.027 . 0 0 "[ . 1 . 2]" 1
2028 1 78 LEU HA 1 78 LEU MD2 . . 4.390 3.648 3.605 3.771 . 0 0 "[ . 1 . 2]" 1
2029 1 78 LEU HA 1 78 LEU HG . . 3.760 3.608 3.579 3.631 . 0 0 "[ . 1 . 2]" 1
2030 1 78 LEU HA 1 79 LYS H . . 3.090 3.002 2.965 3.035 . 0 0 "[ . 1 . 2]" 1
2031 1 78 LEU HA 1 79 LYS HA . . 5.210 4.916 4.900 4.934 . 0 0 "[ . 1 . 2]" 1
2032 1 78 LEU HA 1 79 LYS HB2 . . 5.500 5.760 5.734 5.781 0.281 16 0 "[ . 1 . 2]" 1
2033 1 78 LEU HA 1 79 LYS HG2 . . 5.220 5.036 5.009 5.055 . 0 0 "[ . 1 . 2]" 1
2034 1 78 LEU HA 1 79 LYS HG3 . . 4.180 3.681 3.629 3.712 . 0 0 "[ . 1 . 2]" 1
2035 1 78 LEU HA 1 80 GLU H . . 3.910 3.206 3.103 3.241 . 0 0 "[ . 1 . 2]" 1
2036 1 78 LEU HA 1 81 VAL H . . 4.770 4.494 4.465 4.588 . 0 0 "[ . 1 . 2]" 1
2037 1 78 LEU HA 1 81 VAL QG . . 4.540 4.359 4.184 4.520 . 0 0 "[ . 1 . 2]" 1
2038 1 78 LEU HB2 1 78 LEU MD1 . . 3.290 2.062 1.981 2.226 . 0 0 "[ . 1 . 2]" 1
2039 1 78 LEU HB2 1 78 LEU MD2 . . 3.300 3.150 3.114 3.159 . 0 0 "[ . 1 . 2]" 1
2040 1 78 LEU HB2 1 79 LYS H . . 4.570 4.542 4.533 4.555 . 0 0 "[ . 1 . 2]" 1
2041 1 78 LEU HB2 1 81 VAL QG . . 3.730 3.000 2.801 3.172 . 0 0 "[ . 1 . 2]" 1
2042 1 78 LEU HB3 1 78 LEU MD1 . . 3.190 2.626 2.551 2.681 . 0 0 "[ . 1 . 2]" 1
2043 1 78 LEU HB3 1 78 LEU MD2 . . 3.300 2.215 2.026 2.248 . 0 0 "[ . 1 . 2]" 1
2044 1 78 LEU MD1 1 80 GLU H . . 5.330 5.218 5.034 5.314 . 0 0 "[ . 1 . 2]" 1
2045 1 78 LEU MD1 1 80 GLU QG . . 3.940 3.481 3.230 3.625 . 0 0 "[ . 1 . 2]" 1
2046 1 78 LEU MD1 1 81 VAL H . . 4.040 3.833 3.653 3.957 . 0 0 "[ . 1 . 2]" 1
2047 1 78 LEU MD1 1 81 VAL HA . . 4.970 4.781 4.622 4.935 . 0 0 "[ . 1 . 2]" 1
2048 1 78 LEU MD1 1 81 VAL HB . . 3.440 2.947 2.777 3.209 . 0 0 "[ . 1 . 2]" 1
2049 1 78 LEU MD1 1 82 ALA H . . 5.500 4.859 4.736 4.985 . 0 0 "[ . 1 . 2]" 1
2050 1 78 LEU MD2 1 79 LYS H . . 3.670 3.693 3.561 3.766 0.096 19 0 "[ . 1 . 2]" 1
2051 1 78 LEU MD2 1 79 LYS HA . . 4.270 4.239 4.020 4.330 0.060 19 0 "[ . 1 . 2]" 1
2052 1 78 LEU MD2 1 80 GLU H . . 5.290 5.253 5.158 5.308 0.018 15 0 "[ . 1 . 2]" 1
2053 1 78 LEU MD2 1 81 VAL H . . 4.720 4.741 4.618 4.779 0.059 10 0 "[ . 1 . 2]" 1
2054 1 78 LEU HG 1 79 LYS H . . 4.510 3.850 3.759 3.889 . 0 0 "[ . 1 . 2]" 1
2055 1 78 LEU HG 1 80 GLU QG . . 4.110 3.702 3.550 3.770 . 0 0 "[ . 1 . 2]" 1
2056 1 78 LEU HG 1 81 VAL H . . 3.660 3.265 3.179 3.331 . 0 0 "[ . 1 . 2]" 1
2057 1 78 LEU HG 1 81 VAL HB . . 3.830 3.023 2.905 3.162 . 0 0 "[ . 1 . 2]" 1
2058 1 78 LEU HG 1 81 VAL MG1 . . 4.670 4.346 4.285 4.425 . 0 0 "[ . 1 . 2]" 1
2059 1 78 LEU HG 1 81 VAL QG . . 3.310 2.664 2.249 2.914 . 0 0 "[ . 1 . 2]" 1
2060 1 78 LEU HG 1 81 VAL MG2 . . 4.670 2.691 2.256 2.965 . 0 0 "[ . 1 . 2]" 1
2061 1 78 LEU HG 1 82 ALA H . . 4.270 4.237 4.117 4.301 0.031 19 0 "[ . 1 . 2]" 1
2062 1 79 LYS H 1 79 LYS HB2 . . 3.630 3.528 3.515 3.536 . 0 0 "[ . 1 . 2]" 1
2063 1 79 LYS H 1 79 LYS HB3 . . 3.440 3.046 3.031 3.070 . 0 0 "[ . 1 . 2]" 1
2064 1 79 LYS H 1 79 LYS QD . . 4.050 3.857 3.834 3.874 . 0 0 "[ . 1 . 2]" 1
2065 1 79 LYS H 1 79 LYS QE . . 4.390 3.668 3.601 3.734 . 0 0 "[ . 1 . 2]" 1
2066 1 79 LYS H 1 79 LYS HG2 . . 2.840 2.422 2.389 2.456 . 0 0 "[ . 1 . 2]" 1
2067 1 79 LYS H 1 79 LYS HG3 . . 3.080 1.827 1.806 1.844 . 0 0 "[ . 1 . 2]" 1
2068 1 79 LYS H 1 80 GLU H . . 3.300 3.004 2.954 3.028 . 0 0 "[ . 1 . 2]" 1
2069 1 79 LYS H 1 80 GLU QG . . 4.690 4.681 3.953 4.789 0.099 18 0 "[ . 1 . 2]" 1
2070 1 79 LYS H 1 81 VAL H . . 4.490 4.471 4.413 4.524 0.034 2 0 "[ . 1 . 2]" 1
2071 1 79 LYS H 1 82 ALA H . . 5.350 5.145 4.968 5.218 . 0 0 "[ . 1 . 2]" 1
2072 1 79 LYS HA 1 79 LYS QD . . 4.520 4.416 4.401 4.434 . 0 0 "[ . 1 . 2]" 1
2073 1 79 LYS HA 1 79 LYS QE . . 4.530 4.403 4.339 4.450 . 0 0 "[ . 1 . 2]" 1
2074 1 79 LYS HA 1 79 LYS HG3 . . 3.460 3.468 3.458 3.474 0.014 12 0 "[ . 1 . 2]" 1
2075 1 79 LYS HA 1 81 VAL H . . 4.260 3.473 3.366 3.570 . 0 0 "[ . 1 . 2]" 1
2076 1 79 LYS HA 1 81 VAL QG . . 5.260 4.525 4.395 4.641 . 0 0 "[ . 1 . 2]" 1
2077 1 79 LYS HA 1 82 ALA H . . 3.390 2.874 2.730 2.937 . 0 0 "[ . 1 . 2]" 1
2078 1 79 LYS HA 1 82 ALA MB . . 2.520 2.521 2.286 2.591 0.071 14 0 "[ . 1 . 2]" 1
2079 1 79 LYS HA 1 83 GLU H . . 4.670 4.192 3.975 4.490 . 0 0 "[ . 1 . 2]" 1
2080 1 79 LYS HA 1 83 GLU HG2 . . 4.820 4.413 4.198 4.761 . 0 0 "[ . 1 . 2]" 1
2081 1 79 LYS HA 1 83 GLU QG . . 4.230 3.963 3.802 4.130 . 0 0 "[ . 1 . 2]" 1
2082 1 79 LYS HA 1 83 GLU HG3 . . 4.820 4.506 4.217 4.817 . 0 0 "[ . 1 . 2]" 1
2083 1 79 LYS HB2 1 79 LYS QE . . 4.440 2.556 2.428 2.683 . 0 0 "[ . 1 . 2]" 1
2084 1 79 LYS HB2 1 80 GLU H . . 3.330 3.269 3.213 3.398 0.068 16 0 "[ . 1 . 2]" 1
2085 1 79 LYS HB2 1 82 ALA H . . 5.440 4.488 4.270 4.570 . 0 0 "[ . 1 . 2]" 1
2086 1 79 LYS HB3 1 79 LYS QE . . 4.420 3.768 3.708 3.818 . 0 0 "[ . 1 . 2]" 1
2087 1 79 LYS HB3 1 80 GLU H . . 4.380 4.219 4.198 4.282 . 0 0 "[ . 1 . 2]" 1
2088 1 79 LYS QD 1 79 LYS HG3 . . 2.720 2.470 2.454 2.484 . 0 0 "[ . 1 . 2]" 1
2089 1 79 LYS QE 1 79 LYS HG3 . . 3.030 2.137 2.030 2.247 . 0 0 "[ . 1 . 2]" 1
2090 1 79 LYS QE 1 80 GLU HA . . 4.580 3.219 3.146 3.296 . 0 0 "[ . 1 . 2]" 1
2091 1 79 LYS QE 1 81 VAL H . . 4.900 4.959 4.926 4.972 0.072 19 0 "[ . 1 . 2]" 1
2092 1 79 LYS QE 1 83 GLU H . . 5.500 5.216 5.083 5.462 . 0 0 "[ . 1 . 2]" 1
2093 1 79 LYS QE 1 83 GLU HG2 . . 4.660 4.150 3.918 4.464 . 0 0 "[ . 1 . 2]" 1
2094 1 79 LYS QE 1 83 GLU QG . . 4.060 3.056 2.899 3.235 . 0 0 "[ . 1 . 2]" 1
2095 1 79 LYS QE 1 83 GLU HG3 . . 4.660 3.150 2.982 3.397 . 0 0 "[ . 1 . 2]" 1
2096 1 79 LYS HG3 1 80 GLU H . . 3.680 2.594 2.565 2.664 . 0 0 "[ . 1 . 2]" 1
2097 1 80 GLU H 1 80 GLU HB2 . . 3.730 3.567 3.543 3.626 . 0 0 "[ . 1 . 2]" 1
2098 1 80 GLU H 1 80 GLU QB . . 2.980 2.300 2.236 2.615 . 0 0 "[ . 1 . 2]" 1
2099 1 80 GLU H 1 80 GLU HB3 . . 3.730 2.329 2.261 2.682 . 0 0 "[ . 1 . 2]" 1
2100 1 80 GLU H 1 80 GLU QG . . 3.450 2.746 2.112 2.824 . 0 0 "[ . 1 . 2]" 1
2101 1 80 GLU H 1 81 VAL H . . 3.280 2.938 2.847 2.980 . 0 0 "[ . 1 . 2]" 1
2102 1 80 GLU H 1 81 VAL HA . . 5.500 5.497 5.429 5.529 0.029 2 0 "[ . 1 . 2]" 1
2103 1 80 GLU H 1 81 VAL QG . . 4.410 4.254 4.077 4.419 0.009 2 0 "[ . 1 . 2]" 1
2104 1 80 GLU H 1 82 ALA H . . 4.610 4.509 4.200 4.612 0.002 14 0 "[ . 1 . 2]" 1
2105 1 80 GLU H 1 82 ALA MB . . 5.380 5.108 4.989 5.168 . 0 0 "[ . 1 . 2]" 1
2106 1 80 GLU H 1 83 GLU H . . 5.010 4.818 4.716 5.025 0.015 16 0 "[ . 1 . 2]" 1
2107 1 80 GLU HA 1 80 GLU QB . . 2.480 2.174 2.171 2.180 . 0 0 "[ . 1 . 2]" 1
2108 1 80 GLU HA 1 80 GLU QG . . 3.450 3.324 3.309 3.380 . 0 0 "[ . 1 . 2]" 1
2109 1 80 GLU HA 1 81 VAL QG . . 5.440 4.681 4.569 4.783 . 0 0 "[ . 1 . 2]" 1
2110 1 80 GLU HA 1 82 ALA H . . 4.990 4.694 4.371 4.803 . 0 0 "[ . 1 . 2]" 1
2111 1 80 GLU HA 1 83 GLU H . . 4.050 3.696 3.619 3.810 . 0 0 "[ . 1 . 2]" 1
2112 1 80 GLU HA 1 83 GLU QG . . 4.980 2.319 1.989 3.095 . 0 0 "[ . 1 . 2]" 1
2113 1 80 GLU HA 1 84 LYS H . . 4.910 4.816 4.573 4.947 0.037 19 0 "[ . 1 . 2]" 1
2114 1 80 GLU QB 1 81 VAL QG . . 4.060 3.920 3.798 3.995 . 0 0 "[ . 1 . 2]" 1
2115 1 80 GLU HB2 1 81 VAL H . . 4.220 4.038 3.649 4.117 . 0 0 "[ . 1 . 2]" 1
2116 1 80 GLU HB3 1 81 VAL H . . 4.220 3.933 3.837 4.132 . 0 0 "[ . 1 . 2]" 1
2117 1 80 GLU QG 1 81 VAL H . . 3.640 2.182 1.988 2.462 . 0 0 "[ . 1 . 2]" 1
2118 1 80 GLU QG 1 81 VAL HA . . 4.530 3.323 3.090 3.797 . 0 0 "[ . 1 . 2]" 1
2119 1 80 GLU QG 1 81 VAL QG . . 3.640 2.161 2.042 2.368 . 0 0 "[ . 1 . 2]" 1
2120 1 80 GLU QG 1 82 ALA H . . 5.370 4.443 4.288 4.518 . 0 0 "[ . 1 . 2]" 1
2121 1 81 VAL H 1 81 VAL HB . . 2.930 2.510 2.434 2.625 . 0 0 "[ . 1 . 2]" 1
2122 1 81 VAL H 1 81 VAL MG1 . . 3.960 3.774 3.752 3.808 . 0 0 "[ . 1 . 2]" 1
2123 1 81 VAL H 1 81 VAL QG . . 2.750 2.255 2.100 2.373 . 0 0 "[ . 1 . 2]" 1
2124 1 81 VAL H 1 81 VAL MG2 . . 3.960 2.273 2.110 2.399 . 0 0 "[ . 1 . 2]" 1
2125 1 81 VAL H 1 82 ALA H . . 2.880 2.483 2.207 2.577 . 0 0 "[ . 1 . 2]" 1
2126 1 81 VAL H 1 82 ALA MB . . 4.220 4.070 3.849 4.153 . 0 0 "[ . 1 . 2]" 1
2127 1 81 VAL H 1 83 GLU H . . 3.840 3.752 3.652 3.830 . 0 0 "[ . 1 . 2]" 1
2128 1 81 VAL H 1 83 GLU HB2 . . 5.500 5.172 5.044 5.326 . 0 0 "[ . 1 . 2]" 1
2129 1 81 VAL H 1 83 GLU QG . . 4.960 4.220 4.032 4.549 . 0 0 "[ . 1 . 2]" 1
2130 1 81 VAL HA 1 81 VAL MG1 . . 3.040 2.376 2.280 2.446 . 0 0 "[ . 1 . 2]" 1
2131 1 81 VAL HA 1 81 VAL MG2 . . 3.040 2.352 2.261 2.416 . 0 0 "[ . 1 . 2]" 1
2132 1 81 VAL HA 1 83 GLU H . . 4.470 4.119 3.732 4.389 . 0 0 "[ . 1 . 2]" 1
2133 1 81 VAL HA 1 84 LYS H . . 3.750 3.574 3.369 3.688 . 0 0 "[ . 1 . 2]" 1
2134 1 81 VAL HA 1 84 LYS HB2 . . 5.020 4.786 4.581 4.961 . 0 0 "[ . 1 . 2]" 1
2135 1 81 VAL HA 1 84 LYS HB3 . . 3.480 3.279 3.074 3.731 0.251 19 0 "[ . 1 . 2]" 1
2136 1 81 VAL HA 1 84 LYS HD2 . . 4.450 2.682 2.310 3.694 . 0 0 "[ . 1 . 2]" 1
2137 1 81 VAL HA 1 84 LYS QD . . 3.800 2.496 2.163 3.546 . 0 0 "[ . 1 . 2]" 1
2138 1 81 VAL HA 1 84 LYS HD3 . . 4.450 3.007 2.477 4.569 0.119 19 0 "[ . 1 . 2]" 1
2139 1 81 VAL HA 1 84 LYS QG . . 4.690 3.539 1.878 3.911 . 0 0 "[ . 1 . 2]" 1
2140 1 81 VAL HA 1 85 TYR QE . . 5.500 5.187 4.882 5.514 0.014 15 0 "[ . 1 . 2]" 1
2141 1 81 VAL HB 1 82 ALA H . . 3.150 2.527 2.417 2.897 . 0 0 "[ . 1 . 2]" 1
2142 1 81 VAL HB 1 82 ALA HA . . 4.470 4.248 4.154 4.326 . 0 0 "[ . 1 . 2]" 1
2143 1 81 VAL HB 1 82 ALA MB . . 3.990 3.876 3.820 3.942 . 0 0 "[ . 1 . 2]" 1
2144 1 81 VAL HB 1 83 GLU H . . 5.070 4.787 4.716 4.865 . 0 0 "[ . 1 . 2]" 1
2145 1 81 VAL HB 1 84 LYS H . . 5.500 5.466 5.392 5.535 0.035 11 0 "[ . 1 . 2]" 1
2146 1 81 VAL QG 1 82 ALA H . . 3.460 3.163 3.059 3.382 . 0 0 "[ . 1 . 2]" 1
2147 1 81 VAL QG 1 82 ALA HA . . 4.070 3.427 3.201 3.671 . 0 0 "[ . 1 . 2]" 1
2148 1 81 VAL QG 1 82 ALA MB . . 4.900 3.851 3.731 4.006 . 0 0 "[ . 1 . 2]" 1
2149 1 81 VAL QG 1 83 GLU H . . 4.690 4.407 4.272 4.539 . 0 0 "[ . 1 . 2]" 1
2150 1 81 VAL QG 1 84 LYS H . . 4.500 4.206 4.054 4.320 . 0 0 "[ . 1 . 2]" 1
2151 1 81 VAL QG 1 84 LYS HB2 . . 5.440 5.017 4.841 5.175 . 0 0 "[ . 1 . 2]" 1
2152 1 81 VAL QG 1 84 LYS QD . . 3.510 2.171 1.950 2.886 . 0 0 "[ . 1 . 2]" 1
2153 1 81 VAL QG 1 84 LYS QE . . 4.620 3.413 2.407 3.798 . 0 0 "[ . 1 . 2]" 1
2154 1 81 VAL QG 1 85 TYR H . . 4.730 4.351 4.010 4.478 . 0 0 "[ . 1 . 2]" 1
2155 1 81 VAL QG 1 85 TYR QD . . 3.960 3.103 2.766 3.570 . 0 0 "[ . 1 . 2]" 1
2156 1 81 VAL QG 1 85 TYR QE . . 3.420 2.686 2.408 3.137 . 0 0 "[ . 1 . 2]" 1
2157 1 81 VAL MG1 1 82 ALA H . . 4.050 3.402 3.211 3.744 . 0 0 "[ . 1 . 2]" 1
2158 1 81 VAL MG1 1 83 GLU H . . 5.500 4.786 4.663 4.995 . 0 0 "[ . 1 . 2]" 1
2159 1 81 VAL MG1 1 84 LYS H . . 5.500 4.407 4.226 4.547 . 0 0 "[ . 1 . 2]" 1
2160 1 81 VAL MG2 1 82 ALA H . . 4.050 3.778 3.690 3.857 . 0 0 "[ . 1 . 2]" 1
2161 1 81 VAL MG2 1 83 GLU H . . 5.500 5.158 4.957 5.274 . 0 0 "[ . 1 . 2]" 1
2162 1 81 VAL MG2 1 84 LYS H . . 5.500 5.325 5.188 5.401 . 0 0 "[ . 1 . 2]" 1
2163 1 82 ALA H 1 82 ALA MB . . 2.830 2.056 2.027 2.134 . 0 0 "[ . 1 . 2]" 1
2164 1 82 ALA H 1 83 GLU H . . 3.120 2.583 2.426 2.674 . 0 0 "[ . 1 . 2]" 1
2165 1 82 ALA H 1 83 GLU HA . . 5.400 5.182 5.018 5.264 . 0 0 "[ . 1 . 2]" 1
2166 1 82 ALA H 1 83 GLU HG2 . . 4.650 4.294 4.000 4.643 . 0 0 "[ . 1 . 2]" 1
2167 1 82 ALA H 1 83 GLU QG . . 3.960 3.866 3.704 3.981 0.021 2 0 "[ . 1 . 2]" 1
2168 1 82 ALA H 1 83 GLU HG3 . . 4.650 4.421 4.199 4.561 . 0 0 "[ . 1 . 2]" 1
2169 1 82 ALA H 1 84 LYS H . . 4.370 4.099 3.975 4.300 . 0 0 "[ . 1 . 2]" 1
2170 1 82 ALA H 1 84 LYS QG . . 5.340 5.111 4.191 5.332 . 0 0 "[ . 1 . 2]" 1
2171 1 82 ALA H 1 87 VAL QG . . 5.210 4.022 3.873 4.450 . 0 0 "[ . 1 . 2]" 1
2172 1 82 ALA HA 1 83 GLU HA . . 4.810 4.758 4.576 4.814 0.004 8 0 "[ . 1 . 2]" 1
2173 1 82 ALA HA 1 84 LYS H . . 4.650 3.906 3.722 4.368 . 0 0 "[ . 1 . 2]" 1
2174 1 82 ALA HA 1 85 TYR H . . 4.090 3.323 3.217 3.772 . 0 0 "[ . 1 . 2]" 1
2175 1 82 ALA HA 1 85 TYR HB2 . . 4.300 3.094 2.948 3.488 . 0 0 "[ . 1 . 2]" 1
2176 1 82 ALA HA 1 85 TYR HB3 . . 5.070 4.831 4.683 5.164 0.094 16 0 "[ . 1 . 2]" 1
2177 1 82 ALA HA 1 85 TYR QD . . 4.070 3.471 3.126 4.084 0.014 19 0 "[ . 1 . 2]" 1
2178 1 82 ALA HA 1 86 ASN H . . 4.460 4.088 3.917 4.469 0.009 5 0 "[ . 1 . 2]" 1
2179 1 82 ALA HA 1 87 VAL H . . 3.980 3.972 3.790 4.028 0.048 15 0 "[ . 1 . 2]" 1
2180 1 82 ALA HA 1 87 VAL MG1 . . 4.210 2.504 1.890 4.226 0.016 11 0 "[ . 1 . 2]" 1
2181 1 82 ALA HA 1 87 VAL MG2 . . 4.210 3.335 1.944 3.834 . 0 0 "[ . 1 . 2]" 1
2182 1 82 ALA HA 1 94 LEU QD . . 4.460 4.468 4.308 4.543 0.083 14 0 "[ . 1 . 2]" 1
2183 1 82 ALA MB 1 83 GLU H . . 3.380 2.920 2.775 3.232 . 0 0 "[ . 1 . 2]" 1
2184 1 82 ALA MB 1 83 GLU QG . . 4.410 3.296 3.076 3.413 . 0 0 "[ . 1 . 2]" 1
2185 1 82 ALA MB 1 84 LYS H . . 4.960 4.431 4.301 4.699 . 0 0 "[ . 1 . 2]" 1
2186 1 82 ALA MB 1 86 ASN H . . 5.130 4.466 4.284 4.875 . 0 0 "[ . 1 . 2]" 1
2187 1 82 ALA MB 1 86 ASN HA . . 5.420 4.878 4.671 5.451 0.031 16 0 "[ . 1 . 2]" 1
2188 1 82 ALA MB 1 87 VAL H . . 4.130 3.189 2.924 3.775 . 0 0 "[ . 1 . 2]" 1
2189 1 82 ALA MB 1 87 VAL MG1 . . 3.680 2.174 1.839 3.581 . 0 0 "[ . 1 . 2]" 1
2190 1 82 ALA MB 1 87 VAL QG . . 3.110 1.743 1.611 1.991 . 0 0 "[ . 1 . 2]" 1
2191 1 82 ALA MB 1 87 VAL MG2 . . 3.680 1.932 1.712 2.858 . 0 0 "[ . 1 . 2]" 1
2192 1 82 ALA MB 1 90 MET H . . 5.060 4.854 4.418 5.103 0.043 9 0 "[ . 1 . 2]" 1
2193 1 82 ALA MB 1 90 MET ME . . 4.840 4.531 4.184 4.933 0.093 1 0 "[ . 1 . 2]" 1
2194 1 83 GLU H 1 83 GLU HB2 . . 3.640 2.661 2.571 2.741 . 0 0 "[ . 1 . 2]" 1
2195 1 83 GLU H 1 83 GLU HB3 . . 3.710 3.601 3.576 3.711 0.001 16 0 "[ . 1 . 2]" 1
2196 1 83 GLU H 1 83 GLU HG2 . . 3.320 2.367 2.085 2.750 . 0 0 "[ . 1 . 2]" 1
2197 1 83 GLU H 1 83 GLU QG . . 2.870 2.194 2.008 2.594 . 0 0 "[ . 1 . 2]" 1
2198 1 83 GLU H 1 83 GLU HG3 . . 3.320 2.648 2.366 3.179 . 0 0 "[ . 1 . 2]" 1
2199 1 83 GLU H 1 84 LYS H . . 3.120 2.505 2.052 2.630 . 0 0 "[ . 1 . 2]" 1
2200 1 83 GLU H 1 84 LYS HA . . 5.480 5.128 4.745 5.242 . 0 0 "[ . 1 . 2]" 1
2201 1 83 GLU H 1 85 TYR H . . 4.200 4.090 3.675 4.253 0.053 15 0 "[ . 1 . 2]" 1
2202 1 83 GLU H 1 86 ASN H . . 4.750 4.571 4.399 4.708 . 0 0 "[ . 1 . 2]" 1
2203 1 83 GLU H 1 87 VAL H . . 5.380 5.063 4.594 5.336 . 0 0 "[ . 1 . 2]" 1
2204 1 83 GLU HA 1 83 GLU HG2 . . 3.830 2.605 2.511 2.687 . 0 0 "[ . 1 . 2]" 1
2205 1 83 GLU HA 1 83 GLU QG . . 3.180 2.558 2.471 2.635 . 0 0 "[ . 1 . 2]" 1
2206 1 83 GLU HA 1 83 GLU HG3 . . 3.830 3.736 3.628 3.812 . 0 0 "[ . 1 . 2]" 1
2207 1 83 GLU HA 1 85 TYR H . . 4.470 4.232 4.018 4.369 . 0 0 "[ . 1 . 2]" 1
2208 1 83 GLU HA 1 86 ASN H . . 3.610 3.316 3.159 3.408 . 0 0 "[ . 1 . 2]" 1
2209 1 83 GLU HA 1 86 ASN HA . . 4.060 3.390 3.125 3.527 . 0 0 "[ . 1 . 2]" 1
2210 1 83 GLU HA 1 86 ASN HB2 . . 5.500 5.226 4.827 5.527 0.027 5 0 "[ . 1 . 2]" 1
2211 1 83 GLU HA 1 87 VAL H . . 4.170 3.809 3.128 4.185 0.015 15 0 "[ . 1 . 2]" 1
2212 1 83 GLU HB2 1 84 LYS H . . 3.140 3.007 2.663 3.144 0.004 9 0 "[ . 1 . 2]" 1
2213 1 83 GLU HB3 1 84 LYS H . . 4.140 4.087 3.892 4.166 0.026 14 0 "[ . 1 . 2]" 1
2214 1 83 GLU QG 1 84 LYS H . . 4.410 3.952 3.760 4.089 . 0 0 "[ . 1 . 2]" 1
2215 1 84 LYS H 1 84 LYS HB2 . . 3.660 3.558 3.470 3.621 . 0 0 "[ . 1 . 2]" 1
2216 1 84 LYS H 1 84 LYS HB3 . . 2.970 2.325 2.156 2.751 . 0 0 "[ . 1 . 2]" 1
2217 1 84 LYS H 1 84 LYS HD2 . . 4.450 3.870 3.738 4.548 0.098 19 0 "[ . 1 . 2]" 1
2218 1 84 LYS H 1 84 LYS QD . . 3.770 3.564 3.412 4.083 0.313 19 0 "[ . 1 . 2]" 1
2219 1 84 LYS H 1 84 LYS HD3 . . 4.450 4.178 3.936 4.619 0.169 19 0 "[ . 1 . 2]" 1
2220 1 84 LYS H 1 84 LYS QE . . 5.340 5.127 4.315 5.364 0.024 8 0 "[ . 1 . 2]" 1
2221 1 84 LYS H 1 84 LYS HG2 . . 4.170 2.836 2.382 3.064 . 0 0 "[ . 1 . 2]" 1
2222 1 84 LYS H 1 84 LYS QG . . 3.460 2.727 1.985 2.973 . 0 0 "[ . 1 . 2]" 1
2223 1 84 LYS H 1 84 LYS HG3 . . 4.170 3.926 2.010 4.206 0.036 11 0 "[ . 1 . 2]" 1
2224 1 84 LYS H 1 85 TYR H . . 3.110 2.403 2.297 2.635 . 0 0 "[ . 1 . 2]" 1
2225 1 84 LYS H 1 85 TYR HA . . 5.300 5.088 5.001 5.272 . 0 0 "[ . 1 . 2]" 1
2226 1 84 LYS H 1 86 ASN H . . 3.980 3.612 3.524 3.731 . 0 0 "[ . 1 . 2]" 1
2227 1 84 LYS H 1 87 VAL H . . 5.500 5.501 5.224 5.606 0.106 15 0 "[ . 1 . 2]" 1
2228 1 84 LYS HA 1 84 LYS HB3 . . 2.940 2.651 2.415 2.697 . 0 0 "[ . 1 . 2]" 1
2229 1 84 LYS HA 1 84 LYS QD . . 4.040 4.289 3.807 4.342 0.302 15 0 "[ . 1 . 2]" 1
2230 1 84 LYS HA 1 84 LYS HG2 . . 4.070 3.676 3.612 4.171 0.101 16 0 "[ . 1 . 2]" 1
2231 1 84 LYS HA 1 84 LYS QG . . 3.500 3.263 3.235 3.389 . 0 0 "[ . 1 . 2]" 1
2232 1 84 LYS HA 1 84 LYS HG3 . . 4.070 3.661 3.587 3.734 . 0 0 "[ . 1 . 2]" 1
2233 1 84 LYS HA 1 85 TYR H . . 3.550 3.496 3.451 3.521 . 0 0 "[ . 1 . 2]" 1
2234 1 84 LYS HA 1 85 TYR QD . . 5.310 5.067 4.674 5.208 . 0 0 "[ . 1 . 2]" 1
2235 1 84 LYS HA 1 86 ASN H . . 4.650 4.166 3.859 4.361 . 0 0 "[ . 1 . 2]" 1
2236 1 84 LYS HB2 1 84 LYS QD . . 2.690 2.703 2.086 2.818 0.128 2 0 "[ . 1 . 2]" 1
2237 1 84 LYS HB2 1 84 LYS HE2 . . 4.210 4.053 3.667 4.256 0.046 3 0 "[ . 1 . 2]" 1
2238 1 84 LYS HB2 1 84 LYS QE . . 3.690 3.280 2.805 3.748 0.058 17 0 "[ . 1 . 2]" 1
2239 1 84 LYS HB2 1 84 LYS HE3 . . 4.210 3.540 2.848 4.201 . 0 0 "[ . 1 . 2]" 1
2240 1 84 LYS HB2 1 85 TYR H . . 4.190 4.123 3.892 4.193 0.003 2 0 "[ . 1 . 2]" 1
2241 1 84 LYS HB2 1 85 TYR QD . . 4.680 4.589 3.633 4.721 0.041 12 0 "[ . 1 . 2]" 1
2242 1 84 LYS HB3 1 85 TYR H . . 4.470 3.695 3.559 4.123 . 0 0 "[ . 1 . 2]" 1
2243 1 84 LYS HB3 1 85 TYR QD . . 5.340 5.077 4.909 5.477 0.137 16 0 "[ . 1 . 2]" 1
2244 1 84 LYS QD 1 85 TYR H . . 3.950 3.813 3.161 3.917 . 0 0 "[ . 1 . 2]" 1
2245 1 84 LYS QD 1 85 TYR QD . . 5.340 3.586 2.421 3.768 . 0 0 "[ . 1 . 2]" 1
2246 1 84 LYS QD 1 85 TYR QE . . 4.350 3.071 2.155 3.369 . 0 0 "[ . 1 . 2]" 1
2247 1 84 LYS HD2 1 85 TYR H . . 4.620 4.529 3.466 4.662 0.042 5 0 "[ . 1 . 2]" 1
2248 1 84 LYS HD3 1 85 TYR H . . 4.620 4.113 3.645 4.431 . 0 0 "[ . 1 . 2]" 1
2249 1 84 LYS QE 1 84 LYS QG . . 3.100 2.210 2.066 2.446 . 0 0 "[ . 1 . 2]" 1
2250 1 84 LYS QE 1 85 TYR QD . . 5.180 3.733 3.536 4.747 . 0 0 "[ . 1 . 2]" 1
2251 1 84 LYS QE 1 85 TYR QE . . 4.370 2.262 2.023 3.711 . 0 0 "[ . 1 . 2]" 1
2252 1 84 LYS HE2 1 84 LYS HG2 . . 4.210 3.485 2.146 4.164 . 0 0 "[ . 1 . 2]" 1
2253 1 84 LYS HE2 1 84 LYS HG3 . . 4.210 2.875 2.176 3.539 . 0 0 "[ . 1 . 2]" 1
2254 1 84 LYS HE3 1 84 LYS HG2 . . 4.210 3.583 3.383 3.840 . 0 0 "[ . 1 . 2]" 1
2255 1 84 LYS HE3 1 84 LYS HG3 . . 4.210 2.688 2.202 4.126 . 0 0 "[ . 1 . 2]" 1
2256 1 84 LYS QG 1 85 TYR H . . 3.600 2.091 1.973 2.278 . 0 0 "[ . 1 . 2]" 1
2257 1 84 LYS QG 1 85 TYR QD . . 5.340 2.604 2.346 3.616 . 0 0 "[ . 1 . 2]" 1
2258 1 84 LYS HG2 1 85 TYR H . . 4.200 2.262 1.989 4.016 . 0 0 "[ . 1 . 2]" 1
2259 1 84 LYS HG3 1 85 TYR H . . 4.200 3.338 2.113 3.610 . 0 0 "[ . 1 . 2]" 1
2260 1 85 TYR H 1 85 TYR HB2 . . 3.160 2.482 2.423 2.515 . 0 0 "[ . 1 . 2]" 1
2261 1 85 TYR H 1 85 TYR HB3 . . 3.690 3.655 3.641 3.669 . 0 0 "[ . 1 . 2]" 1
2262 1 85 TYR H 1 85 TYR QD . . 3.490 3.403 3.294 3.566 0.076 16 0 "[ . 1 . 2]" 1
2263 1 85 TYR H 1 86 ASN H . . 2.990 2.198 2.089 2.313 . 0 0 "[ . 1 . 2]" 1
2264 1 85 TYR H 1 86 ASN HA . . 4.660 4.453 4.364 4.507 . 0 0 "[ . 1 . 2]" 1
2265 1 85 TYR H 1 86 ASN HB2 . . 5.380 5.065 4.876 5.385 0.005 5 0 "[ . 1 . 2]" 1
2266 1 85 TYR H 1 86 ASN HB3 . . 5.500 5.460 5.261 5.568 0.068 20 0 "[ . 1 . 2]" 1
2267 1 85 TYR H 1 87 VAL H . . 4.540 4.466 4.307 4.555 0.015 10 0 "[ . 1 . 2]" 1
2268 1 85 TYR HA 1 85 TYR QD . . 3.340 1.971 1.874 2.028 . 0 0 "[ . 1 . 2]" 1
2269 1 85 TYR HA 1 85 TYR QE . . 4.480 4.313 4.219 4.357 . 0 0 "[ . 1 . 2]" 1
2270 1 85 TYR HA 1 86 ASN H . . 3.560 3.388 3.245 3.453 . 0 0 "[ . 1 . 2]" 1
2271 1 85 TYR HA 1 87 VAL QG . . 5.120 4.622 4.384 4.961 . 0 0 "[ . 1 . 2]" 1
2272 1 85 TYR HA 1 94 LEU MD1 . . 4.360 4.284 3.941 4.390 0.030 17 0 "[ . 1 . 2]" 1
2273 1 85 TYR HA 1 94 LEU QD . . 3.810 3.755 3.588 3.875 0.065 16 0 "[ . 1 . 2]" 1
2274 1 85 TYR HA 1 94 LEU MD2 . . 4.360 4.165 3.838 4.394 0.034 20 0 "[ . 1 . 2]" 1
2275 1 85 TYR HA 1 96 ILE MD . . 4.650 4.644 4.353 4.741 0.091 18 0 "[ . 1 . 2]" 1
2276 1 85 TYR HB2 1 86 ASN H . . 3.720 3.226 3.013 3.593 . 0 0 "[ . 1 . 2]" 1
2277 1 85 TYR HB2 1 86 ASN HA . . 5.270 5.047 4.948 5.309 0.039 5 0 "[ . 1 . 2]" 1
2278 1 85 TYR HB2 1 87 VAL QG . . 5.140 2.522 2.346 2.900 . 0 0 "[ . 1 . 2]" 1
2279 1 85 TYR HB2 1 94 LEU MD1 . . 4.740 4.005 3.540 4.167 . 0 0 "[ . 1 . 2]" 1
2280 1 85 TYR HB2 1 94 LEU QD . . 3.520 2.697 2.235 2.966 . 0 0 "[ . 1 . 2]" 1
2281 1 85 TYR HB2 1 94 LEU MD2 . . 4.740 2.748 2.246 3.057 . 0 0 "[ . 1 . 2]" 1
2282 1 85 TYR HB3 1 86 ASN H . . 4.380 4.100 3.906 4.288 . 0 0 "[ . 1 . 2]" 1
2283 1 85 TYR HB3 1 87 VAL H . . 5.470 5.275 4.943 5.565 0.095 5 0 "[ . 1 . 2]" 1
2284 1 85 TYR HB3 1 87 VAL QG . . 4.720 3.352 3.111 3.611 . 0 0 "[ . 1 . 2]" 1
2285 1 85 TYR HB3 1 92 THR MG . . 5.010 4.802 4.460 5.039 0.029 11 0 "[ . 1 . 2]" 1
2286 1 85 TYR HB3 1 94 LEU MD1 . . 3.670 2.677 2.194 2.790 . 0 0 "[ . 1 . 2]" 1
2287 1 85 TYR HB3 1 94 LEU MD2 . . 3.670 2.283 1.907 2.558 . 0 0 "[ . 1 . 2]" 1
2288 1 85 TYR QD 1 86 ASN H . . 4.840 4.611 4.529 4.672 . 0 0 "[ . 1 . 2]" 1
2289 1 85 TYR QD 1 87 VAL QG . . 5.400 3.435 3.246 3.809 . 0 0 "[ . 1 . 2]" 1
2290 1 85 TYR QD 1 94 LEU MD1 . . 3.870 3.601 3.272 3.765 . 0 0 "[ . 1 . 2]" 1
2291 1 85 TYR QD 1 94 LEU MD2 . . 3.870 3.562 3.042 3.861 . 0 0 "[ . 1 . 2]" 1
2292 1 85 TYR QD 1 96 ILE MD . . 4.360 3.026 2.826 3.113 . 0 0 "[ . 1 . 2]" 1
2293 1 85 TYR QD 1 101 GLU HG2 . . 5.500 5.173 5.014 5.506 0.006 19 0 "[ . 1 . 2]" 1
2294 1 85 TYR QE 1 96 ILE MD . . 3.630 2.290 2.134 2.409 . 0 0 "[ . 1 . 2]" 1
2295 1 86 ASN H 1 86 ASN HA . . 2.550 2.281 2.274 2.300 . 0 0 "[ . 1 . 2]" 1
2296 1 86 ASN H 1 86 ASN HB2 . . 3.530 3.210 3.158 3.269 . 0 0 "[ . 1 . 2]" 1
2297 1 86 ASN H 1 86 ASN HB3 . . 3.850 3.678 3.464 3.818 . 0 0 "[ . 1 . 2]" 1
2298 1 86 ASN H 1 86 ASN HD21 . . 4.750 4.048 3.907 4.397 . 0 0 "[ . 1 . 2]" 1
2299 1 86 ASN H 1 87 VAL H . . 3.100 2.940 2.707 3.019 . 0 0 "[ . 1 . 2]" 1
2300 1 86 ASN HA 1 86 ASN HD21 . . 4.850 1.975 1.876 2.218 . 0 0 "[ . 1 . 2]" 1
2301 1 86 ASN HA 1 86 ASN HD22 . . 4.470 3.454 3.342 3.713 . 0 0 "[ . 1 . 2]" 1
2302 1 86 ASN HA 1 87 VAL H . . 2.940 2.430 2.389 2.506 . 0 0 "[ . 1 . 2]" 1
2303 1 86 ASN HA 1 87 VAL HA . . 4.710 4.477 4.416 4.540 . 0 0 "[ . 1 . 2]" 1
2304 1 86 ASN HA 1 87 VAL QG . . 4.550 3.674 3.559 4.460 . 0 0 "[ . 1 . 2]" 1
2305 1 86 ASN HB2 1 86 ASN HD22 . . 3.890 3.684 3.631 3.883 . 0 0 "[ . 1 . 2]" 1
2306 1 86 ASN HB2 1 87 VAL H . . 4.710 4.649 4.620 4.663 . 0 0 "[ . 1 . 2]" 1
2307 1 86 ASN HB3 1 87 VAL H . . 4.530 4.435 4.377 4.501 . 0 0 "[ . 1 . 2]" 1
2308 1 86 ASN HD21 1 87 VAL H . . 5.020 4.016 3.081 4.428 . 0 0 "[ . 1 . 2]" 1
2309 1 86 ASN HD21 1 88 GLU HA . . 5.500 5.144 4.739 5.429 . 0 0 "[ . 1 . 2]" 1
2310 1 86 ASN HD22 1 87 VAL H . . 5.500 5.167 4.697 5.505 0.005 20 0 "[ . 1 . 2]" 1
2311 1 86 ASN HD22 1 88 GLU HA . . 5.500 5.242 4.956 5.545 0.045 8 0 "[ . 1 . 2]" 1
2312 1 87 VAL H 1 87 VAL HB . . 3.570 3.547 2.462 3.743 0.173 10 0 "[ . 1 . 2]" 1
2313 1 87 VAL H 1 87 VAL MG1 . . 3.300 2.246 1.843 3.772 0.472 11 0 "[ . 1 . 2]" 1
2314 1 87 VAL H 1 87 VAL QG . . 2.800 1.953 1.743 3.067 0.267 5 0 "[ . 1 . 2]" 1
2315 1 87 VAL H 1 87 VAL MG2 . . 3.300 2.560 1.747 3.315 0.015 5 0 "[ . 1 . 2]" 1
2316 1 87 VAL H 1 88 GLU H . . 4.010 2.370 1.919 4.246 0.236 5 0 "[ . 1 . 2]" 1
2317 1 87 VAL H 1 88 GLU HA . . 5.190 4.426 4.161 4.815 . 0 0 "[ . 1 . 2]" 1
2318 1 87 VAL H 1 88 GLU QB . . 5.340 5.135 4.939 5.713 0.373 5 0 "[ . 1 . 2]" 1
2319 1 87 VAL H 1 88 GLU QG . . 5.290 4.094 3.706 5.015 . 0 0 "[ . 1 . 2]" 1
2320 1 87 VAL HA 1 87 VAL MG1 . . 3.220 2.610 1.971 2.806 . 0 0 "[ . 1 . 2]" 1
2321 1 87 VAL HA 1 87 VAL MG2 . . 3.220 3.015 2.032 3.157 . 0 0 "[ . 1 . 2]" 1
2322 1 87 VAL HA 1 88 GLU QB . . 4.700 4.379 3.901 4.868 0.168 10 0 "[ . 1 . 2]" 1
2323 1 87 VAL HA 1 88 GLU HG2 . . 4.890 3.852 3.321 4.972 0.082 5 0 "[ . 1 . 2]" 1
2324 1 87 VAL HA 1 88 GLU HG3 . . 4.890 3.997 3.544 4.936 0.046 5 0 "[ . 1 . 2]" 1
2325 1 87 VAL HA 1 92 THR MG . . 4.040 3.513 3.149 4.170 0.130 5 0 "[ . 1 . 2]" 1
2326 1 87 VAL HA 1 94 LEU QD . . 4.060 3.396 3.043 4.020 . 0 0 "[ . 1 . 2]" 1
2327 1 87 VAL HB 1 88 GLU H . . 4.230 3.861 1.784 4.513 0.283 10 0 "[ . 1 . 2]" 1
2328 1 87 VAL HB 1 89 ALA H . . 4.980 4.219 2.963 4.519 . 0 0 "[ . 1 . 2]" 1
2329 1 87 VAL HB 1 92 THR MG . . 5.210 3.047 2.504 4.957 . 0 0 "[ . 1 . 2]" 1
2330 1 87 VAL QG 1 88 GLU H . . 3.320 2.241 1.820 2.919 . 0 0 "[ . 1 . 2]" 1
2331 1 87 VAL QG 1 88 GLU HA . . 4.220 3.681 3.464 4.247 0.027 19 0 "[ . 1 . 2]" 1
2332 1 87 VAL QG 1 88 GLU QB . . 4.410 3.576 2.822 4.357 . 0 0 "[ . 1 . 2]" 1
2333 1 87 VAL QG 1 89 ALA H . . 4.510 2.402 1.676 3.693 . 0 0 "[ . 1 . 2]" 1
2334 1 87 VAL QG 1 90 MET H . . 4.460 2.602 2.066 3.618 . 0 0 "[ . 1 . 2]" 1
2335 1 87 VAL QG 1 90 MET HA . . 5.440 4.861 4.441 5.544 0.104 19 0 "[ . 1 . 2]" 1
2336 1 87 VAL QG 1 90 MET QB . . 5.280 4.120 3.507 4.525 . 0 0 "[ . 1 . 2]" 1
2337 1 87 VAL QG 1 90 MET ME . . 3.770 2.056 1.647 2.578 . 0 0 "[ . 1 . 2]" 1
2338 1 87 VAL QG 1 92 THR MG . . 3.240 2.614 1.722 3.023 . 0 0 "[ . 1 . 2]" 1
2339 1 87 VAL QG 1 94 LEU HB2 . . 4.380 3.158 2.802 3.540 . 0 0 "[ . 1 . 2]" 1
2340 1 87 VAL QG 1 94 LEU HB3 . . 4.920 4.183 3.871 4.509 . 0 0 "[ . 1 . 2]" 1
2341 1 87 VAL QG 1 94 LEU QD . . 3.050 1.965 1.826 2.296 . 0 0 "[ . 1 . 2]" 1
2342 1 87 VAL QG 1 94 LEU HG . . 3.810 3.381 2.817 3.792 . 0 0 "[ . 1 . 2]" 1
2343 1 87 VAL QG 1 104 LYS QB . . 5.280 4.452 3.782 5.010 . 0 0 "[ . 1 . 2]" 1
2344 1 87 VAL MG1 1 88 GLU H . . 3.850 3.318 1.866 3.761 . 0 0 "[ . 1 . 2]" 1
2345 1 87 VAL MG1 1 88 GLU HA . . 5.500 5.196 3.643 5.548 0.048 2 0 "[ . 1 . 2]" 1
2346 1 87 VAL MG1 1 90 MET H . . 5.500 4.625 2.430 5.245 . 0 0 "[ . 1 . 2]" 1
2347 1 87 VAL MG1 1 90 MET ME . . 4.320 3.165 1.650 3.978 . 0 0 "[ . 1 . 2]" 1
2348 1 87 VAL MG1 1 92 THR HB . . 4.010 3.493 1.842 4.110 0.100 12 0 "[ . 1 . 2]" 1
2349 1 87 VAL MG1 1 92 THR MG . . 3.800 2.771 1.724 3.765 . 0 0 "[ . 1 . 2]" 1
2350 1 87 VAL MG2 1 88 GLU H . . 3.850 2.406 1.827 3.743 . 0 0 "[ . 1 . 2]" 1
2351 1 87 VAL MG2 1 88 GLU HA . . 5.500 3.927 3.504 5.497 . 0 0 "[ . 1 . 2]" 1
2352 1 87 VAL MG2 1 90 MET H . . 5.500 2.874 2.068 4.890 . 0 0 "[ . 1 . 2]" 1
2353 1 87 VAL MG2 1 90 MET ME . . 4.320 2.335 1.778 3.572 . 0 0 "[ . 1 . 2]" 1
2354 1 87 VAL MG2 1 92 THR HB . . 4.010 3.499 2.734 4.095 0.085 19 0 "[ . 1 . 2]" 1
2355 1 87 VAL MG2 1 92 THR MG . . 3.800 3.717 2.297 3.987 0.187 10 0 "[ . 1 . 2]" 1
2356 1 88 GLU H 1 88 GLU QB . . 3.610 3.367 2.254 3.514 . 0 0 "[ . 1 . 2]" 1
2357 1 88 GLU H 1 88 GLU HG2 . . 4.800 3.046 2.766 4.081 . 0 0 "[ . 1 . 2]" 1
2358 1 88 GLU H 1 88 GLU QG . . 3.940 2.950 2.723 3.876 . 0 0 "[ . 1 . 2]" 1
2359 1 88 GLU H 1 88 GLU HG3 . . 4.800 4.125 3.405 4.831 0.031 11 0 "[ . 1 . 2]" 1
2360 1 88 GLU H 1 89 ALA H . . 3.770 3.433 1.809 3.794 0.024 16 0 "[ . 1 . 2]" 1
2361 1 88 GLU H 1 89 ALA HA . . 5.040 4.795 3.883 5.265 0.225 5 0 "[ . 1 . 2]" 1
2362 1 88 GLU HA 1 88 GLU HG2 . . 3.880 2.679 2.151 3.575 . 0 0 "[ . 1 . 2]" 1
2363 1 88 GLU HA 1 88 GLU QG . . 3.200 2.616 2.132 3.261 0.061 10 0 "[ . 1 . 2]" 1
2364 1 88 GLU HA 1 88 GLU HG3 . . 3.880 3.766 3.422 3.906 0.026 18 0 "[ . 1 . 2]" 1
2365 1 88 GLU QB 1 89 ALA H . . 3.930 2.313 1.808 3.973 0.043 10 0 "[ . 1 . 2]" 1
2366 1 88 GLU QB 1 90 MET ME . . 3.990 2.983 1.969 3.955 . 0 0 "[ . 1 . 2]" 1
2367 1 88 GLU HB2 1 89 ALA H . . 4.590 2.425 1.818 4.460 . 0 0 "[ . 1 . 2]" 1
2368 1 88 GLU HB3 1 89 ALA H . . 4.590 3.457 2.549 4.658 0.068 10 0 "[ . 1 . 2]" 1
2369 1 88 GLU QG 1 89 ALA H . . 4.380 3.673 3.373 4.621 0.241 15 0 "[ . 1 . 2]" 1
2370 1 88 GLU QG 1 90 MET ME . . 4.300 3.342 2.055 3.836 . 0 0 "[ . 1 . 2]" 1
2371 1 89 ALA H 1 90 MET H . . 4.570 2.871 1.936 3.602 . 0 0 "[ . 1 . 2]" 1
2372 1 89 ALA H 1 90 MET QG . . 5.340 3.549 2.076 5.478 0.138 14 0 "[ . 1 . 2]" 1
2373 1 89 ALA HA 1 90 MET ME . . 4.970 3.924 3.004 4.603 . 0 0 "[ . 1 . 2]" 1
2374 1 89 ALA MB 1 90 MET H . . 4.610 3.620 3.440 3.721 . 0 0 "[ . 1 . 2]" 1
2375 1 89 ALA MB 1 90 MET HA . . 4.230 4.168 4.075 4.212 . 0 0 "[ . 1 . 2]" 1
2376 1 90 MET H 1 90 MET ME . . 4.180 2.525 1.845 3.764 . 0 0 "[ . 1 . 2]" 1
2377 1 90 MET H 1 90 MET QG . . 4.200 2.903 2.185 3.651 . 0 0 "[ . 1 . 2]" 1
2378 1 90 MET H 1 92 THR H . . 4.200 3.753 3.628 4.036 . 0 0 "[ . 1 . 2]" 1
2379 1 90 MET H 1 92 THR HB . . 5.290 4.195 3.947 4.588 . 0 0 "[ . 1 . 2]" 1
2380 1 90 MET HA 1 90 MET ME . . 4.290 3.966 3.485 4.678 0.388 10 0 "[ . 1 . 2]" 1
2381 1 90 MET HA 1 90 MET HG2 . . 4.250 3.508 3.344 3.713 . 0 0 "[ . 1 . 2]" 1
2382 1 90 MET HA 1 90 MET QG . . 3.680 3.057 2.834 3.252 . 0 0 "[ . 1 . 2]" 1
2383 1 90 MET HA 1 90 MET HG3 . . 4.250 3.455 3.032 4.019 . 0 0 "[ . 1 . 2]" 1
2384 1 90 MET HA 1 92 THR H . . 4.030 4.049 3.920 4.203 0.173 9 0 "[ . 1 . 2]" 1
2385 1 90 MET QB 1 90 MET ME . . 3.680 2.302 1.878 2.822 . 0 0 "[ . 1 . 2]" 1
2386 1 90 MET QB 1 91 PRO QD . . 4.380 1.824 1.756 1.926 . 0 0 "[ . 1 . 2]" 1
2387 1 90 MET QB 1 92 THR H . . 4.390 3.071 2.358 3.892 . 0 0 "[ . 1 . 2]" 1
2388 1 90 MET ME 1 90 MET HG2 . . 3.820 2.835 2.071 3.400 . 0 0 "[ . 1 . 2]" 1
2389 1 90 MET ME 1 90 MET QG . . 3.240 2.351 2.049 2.523 . 0 0 "[ . 1 . 2]" 1
2390 1 90 MET ME 1 90 MET HG3 . . 3.820 2.935 2.290 3.397 . 0 0 "[ . 1 . 2]" 1
2391 1 90 MET ME 1 91 PRO QD . . 4.630 4.166 3.789 4.810 0.180 8 0 "[ . 1 . 2]" 1
2392 1 90 MET ME 1 92 THR H . . 3.720 2.570 1.943 3.802 0.082 5 0 "[ . 1 . 2]" 1
2393 1 90 MET ME 1 92 THR HB . . 4.370 1.985 1.739 2.922 . 0 0 "[ . 1 . 2]" 1
2394 1 91 PRO HA 1 92 THR H . . 3.280 3.034 2.870 3.134 . 0 0 "[ . 1 . 2]" 1
2395 1 91 PRO HA 1 92 THR HB . . 5.070 4.952 4.840 5.048 . 0 0 "[ . 1 . 2]" 1
2396 1 91 PRO HA 1 92 THR MG . . 5.370 5.434 5.267 5.543 0.173 2 0 "[ . 1 . 2]" 1
2397 1 91 PRO HA 1 107 GLY H . . 4.880 3.919 3.803 4.071 . 0 0 "[ . 1 . 2]" 1
2398 1 91 PRO QB 1 92 THR H . . 4.020 3.927 3.877 3.991 . 0 0 "[ . 1 . 2]" 1
2399 1 91 PRO QB 1 107 GLY H . . 4.570 1.927 1.844 2.098 . 0 0 "[ . 1 . 2]" 1
2400 1 91 PRO QD 1 107 GLY H . . 5.190 4.229 4.056 4.374 . 0 0 "[ . 1 . 2]" 1
2401 1 91 PRO QD 1 108 ALA MB . . 4.300 4.316 4.154 4.423 0.123 10 0 "[ . 1 . 2]" 1
2402 1 91 PRO HD2 1 92 THR H . . 4.810 3.619 3.397 3.978 . 0 0 "[ . 1 . 2]" 1
2403 1 91 PRO HD2 1 108 ALA MB . . 5.110 4.718 4.490 4.883 . 0 0 "[ . 1 . 2]" 1
2404 1 91 PRO HD3 1 92 THR H . . 4.810 4.367 4.242 4.573 . 0 0 "[ . 1 . 2]" 1
2405 1 91 PRO HD3 1 108 ALA MB . . 5.110 5.004 4.866 5.133 0.023 14 0 "[ . 1 . 2]" 1
2406 1 91 PRO QG 1 106 VAL HA . . 4.580 3.564 3.342 3.751 . 0 0 "[ . 1 . 2]" 1
2407 1 91 PRO QG 1 106 VAL MG2 . . 3.240 3.047 2.869 3.254 0.014 20 0 "[ . 1 . 2]" 1
2408 1 91 PRO QG 1 107 GLY H . . 4.200 2.504 2.274 2.668 . 0 0 "[ . 1 . 2]" 1
2409 1 91 PRO QG 1 107 GLY HA2 . . 5.350 4.609 4.355 4.741 . 0 0 "[ . 1 . 2]" 1
2410 1 91 PRO QG 1 107 GLY HA3 . . 4.580 3.617 3.344 3.793 . 0 0 "[ . 1 . 2]" 1
2411 1 91 PRO QG 1 108 ALA HA . . 5.300 4.802 4.634 4.899 . 0 0 "[ . 1 . 2]" 1
2412 1 91 PRO QG 1 108 ALA MB . . 3.420 2.792 2.652 2.950 . 0 0 "[ . 1 . 2]" 1
2413 1 92 THR H 1 92 THR HB . . 3.480 2.205 2.110 2.336 . 0 0 "[ . 1 . 2]" 1
2414 1 92 THR H 1 92 THR MG . . 3.920 3.579 3.382 3.711 . 0 0 "[ . 1 . 2]" 1
2415 1 92 THR H 1 93 PHE H . . 4.560 4.518 4.463 4.560 . 20 0 "[ . 1 . 2]" 1
2416 1 92 THR H 1 106 VAL HA . . 4.260 3.957 3.700 4.144 . 0 0 "[ . 1 . 2]" 1
2417 1 92 THR H 1 106 VAL MG1 . . 5.280 5.201 4.799 5.373 0.093 12 0 "[ . 1 . 2]" 1
2418 1 92 THR H 1 106 VAL MG2 . . 4.760 3.888 3.448 4.100 . 0 0 "[ . 1 . 2]" 1
2419 1 92 THR H 1 107 GLY H . . 4.610 4.137 3.980 4.390 . 0 0 "[ . 1 . 2]" 1
2420 1 92 THR HA 1 93 PHE H . . 2.960 2.148 2.141 2.158 . 0 0 "[ . 1 . 2]" 1
2421 1 92 THR HA 1 93 PHE HA . . 4.660 4.378 4.368 4.395 . 0 0 "[ . 1 . 2]" 1
2422 1 92 THR HA 1 94 LEU H . . 4.600 4.056 3.912 4.507 . 0 0 "[ . 1 . 2]" 1
2423 1 92 THR HA 1 105 VAL H . . 4.190 3.617 3.480 3.810 . 0 0 "[ . 1 . 2]" 1
2424 1 92 THR HA 1 107 GLY H . . 3.850 3.453 3.275 3.649 . 0 0 "[ . 1 . 2]" 1
2425 1 92 THR HB 1 93 PHE H . . 4.760 4.455 4.395 4.541 . 0 0 "[ . 1 . 2]" 1
2426 1 92 THR HB 1 94 LEU H . . 5.170 4.039 3.837 4.448 . 0 0 "[ . 1 . 2]" 1
2427 1 92 THR MG 1 93 PHE H . . 3.180 2.773 2.567 3.036 . 0 0 "[ . 1 . 2]" 1
2428 1 92 THR MG 1 93 PHE HA . . 4.380 3.662 3.594 3.745 . 0 0 "[ . 1 . 2]" 1
2429 1 92 THR MG 1 94 LEU H . . 3.850 1.785 1.670 2.270 . 0 0 "[ . 1 . 2]" 1
2430 1 92 THR MG 1 94 LEU QD . . 3.560 1.840 1.774 1.919 . 0 0 "[ . 1 . 2]" 1
2431 1 92 THR MG 1 94 LEU HG . . 4.240 3.884 3.683 4.126 . 0 0 "[ . 1 . 2]" 1
2432 1 92 THR MG 1 104 LYS H . . 5.290 5.150 5.044 5.240 . 0 0 "[ . 1 . 2]" 1
2433 1 92 THR MG 1 104 LYS HA . . 4.460 3.440 3.306 3.538 . 0 0 "[ . 1 . 2]" 1
2434 1 92 THR MG 1 104 LYS QB . . 3.930 1.885 1.822 2.001 . 0 0 "[ . 1 . 2]" 1
2435 1 92 THR MG 1 104 LYS QD . . 4.090 4.077 3.933 4.143 0.053 15 0 "[ . 1 . 2]" 1
2436 1 92 THR MG 1 104 LYS QE . . 3.680 2.963 2.678 3.350 . 0 0 "[ . 1 . 2]" 1
2437 1 92 THR MG 1 104 LYS HG2 . . 4.100 3.644 2.447 4.185 0.085 5 0 "[ . 1 . 2]" 1
2438 1 92 THR MG 1 104 LYS QG . . 3.350 2.852 2.414 3.067 . 0 0 "[ . 1 . 2]" 1
2439 1 92 THR MG 1 104 LYS HG3 . . 4.100 3.275 2.847 3.805 . 0 0 "[ . 1 . 2]" 1
2440 1 92 THR MG 1 105 VAL H . . 3.610 2.766 2.577 2.964 . 0 0 "[ . 1 . 2]" 1
2441 1 92 THR MG 1 105 VAL HB . . 5.500 4.940 4.708 5.137 . 0 0 "[ . 1 . 2]" 1
2442 1 93 PHE H 1 93 PHE HB2 . . 3.690 2.145 2.108 2.183 . 0 0 "[ . 1 . 2]" 1
2443 1 93 PHE H 1 93 PHE HB3 . . 3.690 3.302 3.166 3.401 . 0 0 "[ . 1 . 2]" 1
2444 1 93 PHE H 1 93 PHE QD . . 3.810 3.576 3.017 3.783 . 0 0 "[ . 1 . 2]" 1
2445 1 93 PHE H 1 94 LEU H . . 4.090 3.266 3.125 3.626 . 0 0 "[ . 1 . 2]" 1
2446 1 93 PHE H 1 104 LYS HA . . 4.960 4.471 4.350 4.638 . 0 0 "[ . 1 . 2]" 1
2447 1 93 PHE H 1 105 VAL H . . 3.750 2.441 2.266 2.692 . 0 0 "[ . 1 . 2]" 1
2448 1 93 PHE H 1 105 VAL HA . . 4.640 4.486 4.343 4.638 . 0 0 "[ . 1 . 2]" 1
2449 1 93 PHE H 1 105 VAL HB . . 3.830 3.193 3.075 3.401 . 0 0 "[ . 1 . 2]" 1
2450 1 93 PHE H 1 105 VAL QG . . 4.780 3.663 3.574 3.759 . 0 0 "[ . 1 . 2]" 1
2451 1 93 PHE H 1 106 VAL HA . . 3.640 2.558 2.403 2.685 . 0 0 "[ . 1 . 2]" 1
2452 1 93 PHE H 1 106 VAL HB . . 4.700 4.692 4.609 4.766 0.066 10 0 "[ . 1 . 2]" 1
2453 1 93 PHE H 1 106 VAL MG1 . . 4.790 4.774 4.667 4.855 0.065 15 0 "[ . 1 . 2]" 1
2454 1 93 PHE H 1 106 VAL MG2 . . 4.140 3.715 3.592 3.872 . 0 0 "[ . 1 . 2]" 1
2455 1 93 PHE H 1 107 GLY H . . 3.950 3.877 3.616 4.026 0.076 17 0 "[ . 1 . 2]" 1
2456 1 93 PHE HA 1 93 PHE QD . . 3.650 2.585 2.387 2.741 . 0 0 "[ . 1 . 2]" 1
2457 1 93 PHE HA 1 93 PHE QE . . 4.340 4.291 4.212 4.364 0.024 7 0 "[ . 1 . 2]" 1
2458 1 93 PHE HA 1 94 LEU H . . 2.900 2.738 2.504 2.816 . 0 0 "[ . 1 . 2]" 1
2459 1 93 PHE HA 1 94 LEU HA . . 4.930 4.798 4.648 4.844 . 0 0 "[ . 1 . 2]" 1
2460 1 93 PHE HA 1 94 LEU HB2 . . 4.960 4.640 4.523 4.698 . 0 0 "[ . 1 . 2]" 1
2461 1 93 PHE HA 1 94 LEU HB3 . . 5.120 5.138 5.060 5.170 0.050 19 0 "[ . 1 . 2]" 1
2462 1 93 PHE HA 1 105 VAL H . . 4.700 4.533 4.313 4.741 0.041 12 0 "[ . 1 . 2]" 1
2463 1 93 PHE QB 1 94 LEU H . . 3.990 3.877 3.844 3.939 . 0 0 "[ . 1 . 2]" 1
2464 1 93 PHE QB 1 105 VAL H . . 3.680 3.117 2.920 3.394 . 0 0 "[ . 1 . 2]" 1
2465 1 93 PHE QB 1 105 VAL HB . . 4.100 1.975 1.858 2.131 . 0 0 "[ . 1 . 2]" 1
2466 1 93 PHE QB 1 105 VAL QG . . 3.490 2.669 2.482 2.813 . 0 0 "[ . 1 . 2]" 1
2467 1 93 PHE QB 1 106 VAL H . . 5.040 1.920 1.822 2.080 . 0 0 "[ . 1 . 2]" 1
2468 1 93 PHE HB2 1 94 LEU H . . 4.690 4.436 4.360 4.592 . 0 0 "[ . 1 . 2]" 1
2469 1 93 PHE HB2 1 105 VAL H . . 4.210 3.331 3.129 3.613 . 0 0 "[ . 1 . 2]" 1
2470 1 93 PHE HB2 1 105 VAL MG1 . . 4.760 2.952 2.716 3.151 . 0 0 "[ . 1 . 2]" 1
2471 1 93 PHE HB2 1 105 VAL MG2 . . 4.760 3.681 3.626 3.863 . 0 0 "[ . 1 . 2]" 1
2472 1 93 PHE HB3 1 94 LEU H . . 4.690 4.278 4.236 4.302 . 0 0 "[ . 1 . 2]" 1
2473 1 93 PHE HB3 1 105 VAL H . . 4.210 3.774 3.283 4.150 . 0 0 "[ . 1 . 2]" 1
2474 1 93 PHE HB3 1 105 VAL MG1 . . 4.760 3.924 3.596 4.197 . 0 0 "[ . 1 . 2]" 1
2475 1 93 PHE HB3 1 105 VAL MG2 . . 4.760 3.498 3.151 3.738 . 0 0 "[ . 1 . 2]" 1
2476 1 93 PHE QD 1 105 VAL HB . . 4.070 3.665 3.486 3.980 . 0 0 "[ . 1 . 2]" 1
2477 1 93 PHE QD 1 105 VAL QG . . 3.450 3.207 2.951 3.659 0.209 7 0 "[ . 1 . 2]" 1
2478 1 93 PHE QD 1 106 VAL H . . 4.800 3.009 2.680 3.873 . 0 0 "[ . 1 . 2]" 1
2479 1 93 PHE QD 1 106 VAL HA . . 4.650 4.029 3.471 4.253 . 0 0 "[ . 1 . 2]" 1
2480 1 93 PHE QD 1 107 GLY H . . 4.810 3.645 2.837 4.151 . 0 0 "[ . 1 . 2]" 1
2481 1 93 PHE QD 1 117 ILE MD . . 4.160 3.849 2.464 4.187 0.027 10 0 "[ . 1 . 2]" 1
2482 1 93 PHE QE 1 107 GLY H . . 5.230 4.839 3.871 5.251 0.021 16 0 "[ . 1 . 2]" 1
2483 1 94 LEU H 1 94 LEU HB2 . . 3.360 2.122 2.078 2.155 . 0 0 "[ . 1 . 2]" 1
2484 1 94 LEU H 1 94 LEU HB3 . . 3.460 3.164 3.075 3.224 . 0 0 "[ . 1 . 2]" 1
2485 1 94 LEU H 1 94 LEU MD1 . . 4.140 4.047 3.970 4.195 0.055 20 0 "[ . 1 . 2]" 1
2486 1 94 LEU H 1 94 LEU QD . . 3.580 3.089 2.989 3.164 . 0 0 "[ . 1 . 2]" 1
2487 1 94 LEU H 1 94 LEU MD2 . . 4.140 3.206 3.067 3.311 . 0 0 "[ . 1 . 2]" 1
2488 1 94 LEU H 1 94 LEU HG . . 4.840 4.586 4.513 4.656 . 0 0 "[ . 1 . 2]" 1
2489 1 94 LEU H 1 95 PHE H . . 4.630 4.605 4.573 4.630 . 0 0 "[ . 1 . 2]" 1
2490 1 94 LEU H 1 95 PHE QD . . 4.710 4.597 4.504 4.744 0.034 9 0 "[ . 1 . 2]" 1
2491 1 94 LEU H 1 104 LYS HA . . 4.690 3.950 3.855 4.138 . 0 0 "[ . 1 . 2]" 1
2492 1 94 LEU H 1 104 LYS QB . . 4.590 3.335 3.174 3.770 . 0 0 "[ . 1 . 2]" 1
2493 1 94 LEU H 1 105 VAL H . . 4.870 3.822 3.602 4.341 . 0 0 "[ . 1 . 2]" 1
2494 1 94 LEU H 1 105 VAL HB . . 5.500 5.492 5.352 5.589 0.089 19 0 "[ . 1 . 2]" 1
2495 1 94 LEU HA 1 94 LEU MD1 . . 3.590 1.974 1.855 2.311 . 0 0 "[ . 1 . 2]" 1
2496 1 94 LEU HA 1 94 LEU QD . . 2.920 1.886 1.820 2.017 . 0 0 "[ . 1 . 2]" 1
2497 1 94 LEU HA 1 94 LEU MD2 . . 3.590 2.471 2.222 2.686 . 0 0 "[ . 1 . 2]" 1
2498 1 94 LEU HA 1 94 LEU HG . . 4.130 3.653 3.637 3.671 . 0 0 "[ . 1 . 2]" 1
2499 1 94 LEU HA 1 95 PHE H . . 2.960 2.223 2.191 2.250 . 0 0 "[ . 1 . 2]" 1
2500 1 94 LEU HA 1 95 PHE QD . . 3.770 2.977 2.893 3.115 . 0 0 "[ . 1 . 2]" 1
2501 1 94 LEU HA 1 96 ILE MD . . 5.390 5.073 4.756 5.302 . 0 0 "[ . 1 . 2]" 1
2502 1 94 LEU HA 1 103 ASP H . . 5.310 4.887 4.833 4.958 . 0 0 "[ . 1 . 2]" 1
2503 1 94 LEU HA 1 104 LYS H . . 4.630 4.549 4.462 4.651 0.021 9 0 "[ . 1 . 2]" 1
2504 1 94 LEU HA 1 104 LYS HA . . 3.600 2.185 2.107 2.255 . 0 0 "[ . 1 . 2]" 1
2505 1 94 LEU HA 1 104 LYS QB . . 3.820 2.361 2.156 2.760 . 0 0 "[ . 1 . 2]" 1
2506 1 94 LEU HA 1 104 LYS QG . . 4.230 3.760 2.544 4.278 0.048 18 0 "[ . 1 . 2]" 1
2507 1 94 LEU HA 1 105 VAL H . . 3.950 3.780 3.643 3.977 0.027 19 0 "[ . 1 . 2]" 1
2508 1 94 LEU HB2 1 94 LEU MD1 . . 3.440 3.158 3.126 3.186 . 0 0 "[ . 1 . 2]" 1
2509 1 94 LEU HB2 1 94 LEU QD . . 2.960 2.152 1.992 2.239 . 0 0 "[ . 1 . 2]" 1
2510 1 94 LEU HB2 1 94 LEU MD2 . . 3.440 2.190 2.014 2.287 . 0 0 "[ . 1 . 2]" 1
2511 1 94 LEU HB2 1 95 PHE H . . 4.280 4.273 4.238 4.315 0.035 7 0 "[ . 1 . 2]" 1
2512 1 94 LEU HB3 1 95 PHE H . . 3.870 3.550 3.437 3.716 . 0 0 "[ . 1 . 2]" 1
2513 1 94 LEU HB3 1 96 ILE MD . . 4.070 3.646 3.290 3.902 . 0 0 "[ . 1 . 2]" 1
2514 1 94 LEU HB3 1 104 LYS QB . . 5.110 4.651 4.399 5.151 0.041 7 0 "[ . 1 . 2]" 1
2515 1 94 LEU QD 1 96 ILE MD . . 3.250 2.541 2.305 2.734 . 0 0 "[ . 1 . 2]" 1
2516 1 94 LEU QD 1 101 GLU HA . . 3.750 3.385 3.273 3.426 . 0 0 "[ . 1 . 2]" 1
2517 1 94 LEU QD 1 101 GLU QB . . 4.980 3.655 3.472 3.720 . 0 0 "[ . 1 . 2]" 1
2518 1 94 LEU QD 1 101 GLU HG2 . . 3.520 2.793 2.637 3.045 . 0 0 "[ . 1 . 2]" 1
2519 1 94 LEU QD 1 101 GLU HG3 . . 3.030 1.910 1.885 1.932 . 0 0 "[ . 1 . 2]" 1
2520 1 94 LEU QD 1 102 ALA H . . 4.590 3.915 3.824 3.989 . 0 0 "[ . 1 . 2]" 1
2521 1 94 LEU QD 1 103 ASP H . . 4.510 3.231 3.179 3.266 . 0 0 "[ . 1 . 2]" 1
2522 1 94 LEU QD 1 104 LYS H . . 3.800 3.903 3.849 3.982 0.182 7 0 "[ . 1 . 2]" 1
2523 1 94 LEU QD 1 104 LYS HA . . 3.810 2.995 2.896 3.095 . 0 0 "[ . 1 . 2]" 1
2524 1 94 LEU QD 1 104 LYS QB . . 2.890 2.085 1.765 2.809 . 0 0 "[ . 1 . 2]" 1
2525 1 94 LEU QD 1 104 LYS QD . . 3.000 2.914 2.710 3.079 0.079 19 0 "[ . 1 . 2]" 1
2526 1 94 LEU QD 1 104 LYS QE . . 3.060 2.140 1.859 2.580 . 0 0 "[ . 1 . 2]" 1
2527 1 94 LEU QD 1 104 LYS QG . . 3.260 2.749 1.599 3.291 0.031 18 0 "[ . 1 . 2]" 1
2528 1 94 LEU QD 1 105 VAL H . . 5.010 4.189 4.024 4.375 . 0 0 "[ . 1 . 2]" 1
2529 1 94 LEU MD1 1 95 PHE H . . 3.970 1.682 1.668 1.715 . 0 0 "[ . 1 . 2]" 1
2530 1 94 LEU MD1 1 101 GLU HG2 . . 4.320 2.828 2.659 3.125 . 0 0 "[ . 1 . 2]" 1
2531 1 94 LEU MD1 1 101 GLU HG3 . . 4.020 1.914 1.889 1.937 . 0 0 "[ . 1 . 2]" 1
2532 1 94 LEU MD1 1 103 ASP H . . 5.260 3.260 3.202 3.303 . 0 0 "[ . 1 . 2]" 1
2533 1 94 LEU MD1 1 104 LYS H . . 4.960 4.159 4.089 4.419 . 0 0 "[ . 1 . 2]" 1
2534 1 94 LEU MD1 1 104 LYS HA . . 4.430 3.164 3.006 3.507 . 0 0 "[ . 1 . 2]" 1
2535 1 94 LEU MD1 1 104 LYS HB2 . . 4.500 3.920 3.563 4.380 . 0 0 "[ . 1 . 2]" 1
2536 1 94 LEU MD1 1 104 LYS HB3 . . 4.500 2.780 2.312 3.644 . 0 0 "[ . 1 . 2]" 1
2537 1 94 LEU MD1 1 104 LYS QD . . 3.820 3.449 3.193 3.706 . 0 0 "[ . 1 . 2]" 1
2538 1 94 LEU MD1 1 104 LYS QE . . 3.750 3.544 3.209 3.857 0.107 19 0 "[ . 1 . 2]" 1
2539 1 94 LEU MD2 1 95 PHE H . . 3.970 3.753 3.451 3.880 . 0 0 "[ . 1 . 2]" 1
2540 1 94 LEU MD2 1 101 GLU HG2 . . 4.320 4.346 4.207 4.385 0.065 18 0 "[ . 1 . 2]" 1
2541 1 94 LEU MD2 1 101 GLU HG3 . . 4.020 3.964 3.690 4.056 0.036 17 0 "[ . 1 . 2]" 1
2542 1 94 LEU MD2 1 103 ASP H . . 5.260 5.293 4.954 5.385 0.125 2 0 "[ . 1 . 2]" 1
2543 1 94 LEU MD2 1 104 LYS H . . 4.960 4.752 4.372 4.991 0.031 2 0 "[ . 1 . 2]" 1
2544 1 94 LEU MD2 1 104 LYS HA . . 4.430 3.753 3.438 3.997 . 0 0 "[ . 1 . 2]" 1
2545 1 94 LEU MD2 1 104 LYS HB2 . . 4.500 3.003 2.306 4.002 . 0 0 "[ . 1 . 2]" 1
2546 1 94 LEU MD2 1 104 LYS HB3 . . 4.500 2.232 1.841 3.058 . 0 0 "[ . 1 . 2]" 1
2547 1 94 LEU MD2 1 104 LYS QD . . 3.820 3.153 2.848 3.398 . 0 0 "[ . 1 . 2]" 1
2548 1 94 LEU MD2 1 104 LYS QE . . 3.750 2.160 1.868 2.621 . 0 0 "[ . 1 . 2]" 1
2549 1 94 LEU HG 1 95 PHE H . . 4.170 4.097 4.026 4.173 0.003 14 0 "[ . 1 . 2]" 1
2550 1 94 LEU HG 1 96 ILE MD . . 3.700 3.270 2.983 3.659 . 0 0 "[ . 1 . 2]" 1
2551 1 95 PHE H 1 95 PHE HB2 . . 3.350 2.547 2.508 2.589 . 0 0 "[ . 1 . 2]" 1
2552 1 95 PHE H 1 95 PHE HB3 . . 3.910 3.722 3.700 3.747 . 0 0 "[ . 1 . 2]" 1
2553 1 95 PHE H 1 95 PHE QD . . 3.260 2.612 2.474 2.771 . 0 0 "[ . 1 . 2]" 1
2554 1 95 PHE H 1 96 ILE H . . 4.650 4.467 4.395 4.501 . 0 0 "[ . 1 . 2]" 1
2555 1 95 PHE H 1 96 ILE MD . . 4.410 3.985 3.706 4.228 . 0 0 "[ . 1 . 2]" 1
2556 1 95 PHE H 1 96 ILE QG . . 5.500 4.254 4.089 4.416 . 0 0 "[ . 1 . 2]" 1
2557 1 95 PHE H 1 101 GLU HG2 . . 4.800 4.673 4.499 4.827 0.027 14 0 "[ . 1 . 2]" 1
2558 1 95 PHE H 1 101 GLU HG3 . . 4.050 3.840 3.679 3.991 . 0 0 "[ . 1 . 2]" 1
2559 1 95 PHE H 1 102 ALA H . . 4.630 4.171 4.040 4.287 . 0 0 "[ . 1 . 2]" 1
2560 1 95 PHE H 1 103 ASP H . . 3.530 3.039 2.982 3.102 . 0 0 "[ . 1 . 2]" 1
2561 1 95 PHE H 1 103 ASP HA . . 4.690 4.433 4.384 4.476 . 0 0 "[ . 1 . 2]" 1
2562 1 95 PHE H 1 103 ASP QB . . 4.810 4.714 4.694 4.729 . 0 0 "[ . 1 . 2]" 1
2563 1 95 PHE H 1 104 LYS H . . 4.860 4.682 4.646 4.748 . 0 0 "[ . 1 . 2]" 1
2564 1 95 PHE H 1 104 LYS HA . . 3.630 3.067 2.978 3.140 . 0 0 "[ . 1 . 2]" 1
2565 1 95 PHE HA 1 95 PHE QD . . 4.010 3.124 3.104 3.136 . 0 0 "[ . 1 . 2]" 1
2566 1 95 PHE HA 1 96 ILE H . . 2.930 2.273 2.180 2.357 . 0 0 "[ . 1 . 2]" 1
2567 1 95 PHE HA 1 96 ILE HB . . 4.950 4.733 4.684 4.799 . 0 0 "[ . 1 . 2]" 1
2568 1 95 PHE HA 1 96 ILE MD . . 4.510 4.210 3.961 4.403 . 0 0 "[ . 1 . 2]" 1
2569 1 95 PHE HA 1 96 ILE QG . . 3.960 3.186 3.115 3.286 . 0 0 "[ . 1 . 2]" 1
2570 1 95 PHE HA 1 96 ILE MG . . 5.500 5.388 5.379 5.404 . 0 0 "[ . 1 . 2]" 1
2571 1 95 PHE HA 1 97 LYS H . . 5.500 5.076 4.910 5.243 . 0 0 "[ . 1 . 2]" 1
2572 1 95 PHE HA 1 102 ALA MB . . 5.240 4.581 4.405 4.679 . 0 0 "[ . 1 . 2]" 1
2573 1 95 PHE HA 1 103 ASP H . . 4.970 4.704 4.628 4.781 . 0 0 "[ . 1 . 2]" 1
2574 1 95 PHE HB2 1 102 ALA H . . 4.150 3.320 3.220 3.402 . 0 0 "[ . 1 . 2]" 1
2575 1 95 PHE HB2 1 102 ALA MB . . 3.730 2.808 2.722 2.872 . 0 0 "[ . 1 . 2]" 1
2576 1 95 PHE HB2 1 103 ASP H . . 3.390 2.293 2.169 2.382 . 0 0 "[ . 1 . 2]" 1
2577 1 95 PHE HB2 1 103 ASP HA . . 4.730 4.328 4.266 4.395 . 0 0 "[ . 1 . 2]" 1
2578 1 95 PHE HB2 1 103 ASP QB . . 4.020 3.537 3.399 3.610 . 0 0 "[ . 1 . 2]" 1
2579 1 95 PHE HB2 1 116 THR MG . . 4.330 4.154 4.047 4.257 . 0 0 "[ . 1 . 2]" 1
2580 1 95 PHE HB3 1 96 ILE H . . 4.120 2.789 2.543 3.129 . 0 0 "[ . 1 . 2]" 1
2581 1 95 PHE HB3 1 96 ILE HA . . 4.680 4.352 4.256 4.462 . 0 0 "[ . 1 . 2]" 1
2582 1 95 PHE HB3 1 102 ALA H . . 4.320 3.555 3.468 3.707 . 0 0 "[ . 1 . 2]" 1
2583 1 95 PHE HB3 1 103 ASP H . . 4.050 3.610 3.487 3.731 . 0 0 "[ . 1 . 2]" 1
2584 1 95 PHE HB3 1 103 ASP QB . . 4.800 4.734 4.539 4.833 0.033 1 0 "[ . 1 . 2]" 1
2585 1 95 PHE HB3 1 104 LYS HA . . 5.500 5.534 5.472 5.568 0.068 9 0 "[ . 1 . 2]" 1
2586 1 95 PHE QD 1 96 ILE H . . 4.340 3.949 3.790 4.099 . 0 0 "[ . 1 . 2]" 1
2587 1 95 PHE QD 1 102 ALA H . . 5.470 5.143 5.076 5.233 . 0 0 "[ . 1 . 2]" 1
2588 1 95 PHE QD 1 103 ASP H . . 4.600 4.094 4.000 4.151 . 0 0 "[ . 1 . 2]" 1
2589 1 95 PHE QD 1 103 ASP QB . . 4.300 3.985 3.903 4.081 . 0 0 "[ . 1 . 2]" 1
2590 1 95 PHE QD 1 104 LYS H . . 4.440 4.199 4.097 4.271 . 0 0 "[ . 1 . 2]" 1
2591 1 95 PHE QD 1 104 LYS HA . . 3.720 2.092 1.996 2.249 . 0 0 "[ . 1 . 2]" 1
2592 1 95 PHE QD 1 105 VAL H . . 4.560 4.010 3.814 4.322 . 0 0 "[ . 1 . 2]" 1
2593 1 95 PHE QD 1 105 VAL HB . . 4.970 4.571 4.332 4.729 . 0 0 "[ . 1 . 2]" 1
2594 1 95 PHE QD 1 116 THR MG . . 3.680 3.098 3.005 3.227 . 0 0 "[ . 1 . 2]" 1
2595 1 95 PHE QD 1 120 HIS H . . 5.500 5.534 5.517 5.562 0.062 8 0 "[ . 1 . 2]" 1
2596 1 95 PHE QE 1 104 LYS H . . 5.500 5.344 5.265 5.501 0.001 9 0 "[ . 1 . 2]" 1
2597 1 95 PHE QE 1 104 LYS HA . . 4.040 3.309 3.175 3.604 . 0 0 "[ . 1 . 2]" 1
2598 1 95 PHE QE 1 105 VAL H . . 4.460 3.546 3.237 4.101 . 0 0 "[ . 1 . 2]" 1
2599 1 95 PHE QE 1 105 VAL QG . . 3.270 2.185 1.964 2.437 . 0 0 "[ . 1 . 2]" 1
2600 1 95 PHE QE 1 113 LEU HA . . 4.800 4.682 4.565 4.802 0.002 16 0 "[ . 1 . 2]" 1
2601 1 95 PHE QE 1 116 THR HB . . 4.850 3.628 3.528 3.720 . 0 0 "[ . 1 . 2]" 1
2602 1 95 PHE QE 1 116 THR MG . . 3.530 2.307 2.247 2.506 . 0 0 "[ . 1 . 2]" 1
2603 1 95 PHE QE 1 117 ILE HA . . 3.410 2.613 2.549 2.689 . 0 0 "[ . 1 . 2]" 1
2604 1 95 PHE QE 1 117 ILE QG . . 4.690 2.175 2.056 2.337 . 0 0 "[ . 1 . 2]" 1
2605 1 95 PHE QE 1 117 ILE MG . . 4.140 4.071 3.928 4.143 0.003 18 0 "[ . 1 . 2]" 1
2606 1 95 PHE HZ 1 113 LEU QD . . 3.880 2.889 2.650 3.210 . 0 0 "[ . 1 . 2]" 1
2607 1 95 PHE HZ 1 117 ILE H . . 3.910 3.807 3.656 3.958 0.048 11 0 "[ . 1 . 2]" 1
2608 1 95 PHE HZ 1 117 ILE MD . . 3.540 2.151 1.977 2.288 . 0 0 "[ . 1 . 2]" 1
2609 1 95 PHE HZ 1 117 ILE QG . . 4.090 3.137 2.881 3.330 . 0 0 "[ . 1 . 2]" 1
2610 1 96 ILE H 1 96 ILE HB . . 3.210 2.897 2.823 2.960 . 0 0 "[ . 1 . 2]" 1
2611 1 96 ILE H 1 96 ILE MD . . 4.020 3.764 3.507 3.960 . 0 0 "[ . 1 . 2]" 1
2612 1 96 ILE H 1 96 ILE QG . . 3.290 2.640 2.437 2.770 . 0 0 "[ . 1 . 2]" 1
2613 1 96 ILE H 1 96 ILE MG . . 4.100 3.955 3.916 3.981 . 0 0 "[ . 1 . 2]" 1
2614 1 96 ILE H 1 97 LYS H . . 4.020 3.433 3.298 3.613 . 0 0 "[ . 1 . 2]" 1
2615 1 96 ILE H 1 97 LYS HA . . 4.800 4.411 4.303 4.550 . 0 0 "[ . 1 . 2]" 1
2616 1 96 ILE H 1 97 LYS HB2 . . 5.430 4.930 4.770 5.161 . 0 0 "[ . 1 . 2]" 1
2617 1 96 ILE H 1 100 ALA H . . 5.500 5.546 5.521 5.570 0.070 2 0 "[ . 1 . 2]" 1
2618 1 96 ILE H 1 101 GLU HA . . 5.500 4.689 4.612 4.811 . 0 0 "[ . 1 . 2]" 1
2619 1 96 ILE H 1 102 ALA H . . 4.860 4.073 3.915 4.187 . 0 0 "[ . 1 . 2]" 1
2620 1 96 ILE H 1 103 ASP H . . 5.500 5.140 4.978 5.249 . 0 0 "[ . 1 . 2]" 1
2621 1 96 ILE HA 1 96 ILE MD . . 3.210 2.245 2.057 2.356 . 0 0 "[ . 1 . 2]" 1
2622 1 96 ILE HA 1 96 ILE MG . . 3.200 2.278 2.249 2.303 . 0 0 "[ . 1 . 2]" 1
2623 1 96 ILE HA 1 97 LYS H . . 2.700 2.374 2.320 2.414 . 0 0 "[ . 1 . 2]" 1
2624 1 96 ILE HA 1 101 GLU HA . . 3.510 2.246 2.181 2.359 . 0 0 "[ . 1 . 2]" 1
2625 1 96 ILE HA 1 102 ALA H . . 3.410 2.631 2.506 2.777 . 0 0 "[ . 1 . 2]" 1
2626 1 96 ILE HA 1 102 ALA MB . . 3.840 3.657 3.551 3.757 . 0 0 "[ . 1 . 2]" 1
2627 1 96 ILE HB 1 99 GLY H . . 4.740 4.219 4.150 4.295 . 0 0 "[ . 1 . 2]" 1
2628 1 96 ILE HB 1 100 ALA H . . 4.140 4.113 4.063 4.146 0.006 13 0 "[ . 1 . 2]" 1
2629 1 96 ILE MD 1 97 LYS H . . 4.370 4.325 4.141 4.414 0.044 5 0 "[ . 1 . 2]" 1
2630 1 96 ILE MD 1 100 ALA H . . 4.450 3.859 3.710 3.972 . 0 0 "[ . 1 . 2]" 1
2631 1 96 ILE MD 1 100 ALA MB . . 5.500 4.433 4.340 4.557 . 0 0 "[ . 1 . 2]" 1
2632 1 96 ILE MD 1 101 GLU HA . . 3.300 2.208 2.076 2.346 . 0 0 "[ . 1 . 2]" 1
2633 1 96 ILE MD 1 101 GLU HB2 . . 4.700 3.267 3.076 3.448 . 0 0 "[ . 1 . 2]" 1
2634 1 96 ILE MD 1 101 GLU QB . . 3.880 3.180 3.011 3.344 . 0 0 "[ . 1 . 2]" 1
2635 1 96 ILE MD 1 101 GLU HB3 . . 4.700 4.366 4.229 4.500 . 0 0 "[ . 1 . 2]" 1
2636 1 96 ILE MD 1 101 GLU HG2 . . 4.650 4.203 4.021 4.407 . 0 0 "[ . 1 . 2]" 1
2637 1 96 ILE MD 1 101 GLU HG3 . . 4.280 2.755 2.535 3.019 . 0 0 "[ . 1 . 2]" 1
2638 1 96 ILE MD 1 102 ALA H . . 4.010 3.661 3.427 3.774 . 0 0 "[ . 1 . 2]" 1
2639 1 96 ILE MD 1 103 ASP H . . 5.000 4.646 4.412 4.810 . 0 0 "[ . 1 . 2]" 1
2640 1 96 ILE QG 1 96 ILE MG . . 3.110 2.402 2.311 2.460 . 0 0 "[ . 1 . 2]" 1
2641 1 96 ILE QG 1 97 LYS H . . 5.090 4.750 4.705 4.828 . 0 0 "[ . 1 . 2]" 1
2642 1 96 ILE QG 1 99 GLY H . . 5.500 5.533 5.508 5.562 0.062 5 0 "[ . 1 . 2]" 1
2643 1 96 ILE QG 1 101 GLU HA . . 4.600 4.054 3.870 4.245 . 0 0 "[ . 1 . 2]" 1
2644 1 96 ILE MG 1 97 LYS H . . 3.800 3.720 3.634 3.784 . 0 0 "[ . 1 . 2]" 1
2645 1 96 ILE MG 1 97 LYS HA . . 4.450 4.403 4.328 4.458 0.008 19 0 "[ . 1 . 2]" 1
2646 1 96 ILE MG 1 98 ASP H . . 4.740 4.549 4.432 4.634 . 0 0 "[ . 1 . 2]" 1
2647 1 96 ILE MG 1 98 ASP HA . . 5.500 5.433 5.338 5.481 . 0 0 "[ . 1 . 2]" 1
2648 1 96 ILE MG 1 99 GLY H . . 3.080 2.444 2.356 2.493 . 0 0 "[ . 1 . 2]" 1
2649 1 96 ILE MG 1 99 GLY HA2 . . 3.700 1.928 1.905 1.938 . 0 0 "[ . 1 . 2]" 1
2650 1 96 ILE MG 1 99 GLY HA3 . . 3.570 3.327 3.291 3.358 . 0 0 "[ . 1 . 2]" 1
2651 1 96 ILE MG 1 100 ALA H . . 3.050 1.789 1.735 1.825 . 0 0 "[ . 1 . 2]" 1
2652 1 96 ILE MG 1 100 ALA MB . . 3.720 3.490 3.471 3.523 . 0 0 "[ . 1 . 2]" 1
2653 1 96 ILE MG 1 101 GLU HA . . 3.900 3.238 3.188 3.292 . 0 0 "[ . 1 . 2]" 1
2654 1 96 ILE MG 1 101 GLU QB . . 5.340 3.961 3.881 4.088 . 0 0 "[ . 1 . 2]" 1
2655 1 96 ILE MG 1 102 ALA H . . 4.770 4.366 4.286 4.501 . 0 0 "[ . 1 . 2]" 1
2656 1 97 LYS H 1 97 LYS HB2 . . 3.240 2.857 2.679 2.995 . 0 0 "[ . 1 . 2]" 1
2657 1 97 LYS H 1 97 LYS HB3 . . 3.310 2.299 2.220 2.421 . 0 0 "[ . 1 . 2]" 1
2658 1 97 LYS H 1 98 ASP HB2 . . 5.450 5.432 5.359 5.473 0.023 13 0 "[ . 1 . 2]" 1
2659 1 97 LYS H 1 98 ASP HB3 . . 5.500 5.494 5.460 5.536 0.036 13 0 "[ . 1 . 2]" 1
2660 1 97 LYS H 1 100 ALA H . . 3.880 3.828 3.719 3.890 0.010 14 0 "[ . 1 . 2]" 1
2661 1 97 LYS H 1 101 GLU HA . . 3.700 3.625 3.517 3.714 0.014 5 0 "[ . 1 . 2]" 1
2662 1 97 LYS H 1 102 ALA H . . 3.620 2.452 2.342 2.517 . 0 0 "[ . 1 . 2]" 1
2663 1 97 LYS H 1 102 ALA MB . . 3.240 1.984 1.923 2.073 . 0 0 "[ . 1 . 2]" 1
2664 1 97 LYS H 1 103 ASP H . . 4.510 4.516 4.437 4.581 0.071 17 0 "[ . 1 . 2]" 1
2665 1 97 LYS HA 1 97 LYS QE . . 4.540 4.111 3.978 4.275 . 0 0 "[ . 1 . 2]" 1
2666 1 97 LYS HA 1 97 LYS HG2 . . 3.980 3.455 2.954 3.819 . 0 0 "[ . 1 . 2]" 1
2667 1 97 LYS HA 1 97 LYS HG3 . . 3.980 2.773 2.614 2.934 . 0 0 "[ . 1 . 2]" 1
2668 1 97 LYS HA 1 98 ASP H . . 3.160 2.142 2.140 2.143 . 0 0 "[ . 1 . 2]" 1
2669 1 97 LYS HA 1 98 ASP HA . . 4.510 4.371 4.367 4.374 . 0 0 "[ . 1 . 2]" 1
2670 1 97 LYS HA 1 98 ASP HB2 . . 4.740 4.368 4.345 4.382 . 0 0 "[ . 1 . 2]" 1
2671 1 97 LYS HA 1 98 ASP HB3 . . 5.200 5.015 4.991 5.047 . 0 0 "[ . 1 . 2]" 1
2672 1 97 LYS HA 1 99 GLY H . . 4.050 3.417 3.367 3.477 . 0 0 "[ . 1 . 2]" 1
2673 1 97 LYS HA 1 100 ALA H . . 5.150 4.763 4.720 4.807 . 0 0 "[ . 1 . 2]" 1
2674 1 97 LYS HB2 1 97 LYS QD . . 3.650 2.699 2.364 3.170 . 0 0 "[ . 1 . 2]" 1
2675 1 97 LYS HB2 1 97 LYS QE . . 3.420 2.176 1.988 2.516 . 0 0 "[ . 1 . 2]" 1
2676 1 97 LYS HB2 1 102 ALA H . . 5.320 4.662 4.453 4.834 . 0 0 "[ . 1 . 2]" 1
2677 1 97 LYS HB2 1 102 ALA MB . . 3.240 2.450 2.199 2.599 . 0 0 "[ . 1 . 2]" 1
2678 1 97 LYS HB3 1 97 LYS QE . . 4.450 2.515 2.151 2.975 . 0 0 "[ . 1 . 2]" 1
2679 1 97 LYS HB3 1 98 ASP H . . 4.690 4.371 4.289 4.423 . 0 0 "[ . 1 . 2]" 1
2680 1 97 LYS HB3 1 99 GLY H . . 4.910 4.880 4.783 4.941 0.031 14 0 "[ . 1 . 2]" 1
2681 1 97 LYS HB3 1 102 ALA HA . . 4.640 3.524 3.346 3.719 . 0 0 "[ . 1 . 2]" 1
2682 1 97 LYS HB3 1 102 ALA MB . . 3.300 1.983 1.823 2.142 . 0 0 "[ . 1 . 2]" 1
2683 1 97 LYS QD 1 102 ALA MB . . 4.760 3.502 2.738 3.959 . 0 0 "[ . 1 . 2]" 1
2684 1 97 LYS HD2 1 98 ASP H . . 5.500 5.254 5.026 5.407 . 0 0 "[ . 1 . 2]" 1
2685 1 97 LYS HD3 1 98 ASP H . . 5.500 4.826 4.325 5.345 . 0 0 "[ . 1 . 2]" 1
2686 1 97 LYS QE 1 102 ALA HA . . 4.990 4.119 3.825 4.655 . 0 0 "[ . 1 . 2]" 1
2687 1 97 LYS QE 1 102 ALA MB . . 4.090 2.250 1.986 2.666 . 0 0 "[ . 1 . 2]" 1
2688 1 97 LYS QG 1 98 ASP H . . 4.100 2.779 2.684 2.865 . 0 0 "[ . 1 . 2]" 1
2689 1 97 LYS QG 1 98 ASP HA . . 4.910 3.764 3.707 3.832 . 0 0 "[ . 1 . 2]" 1
2690 1 97 LYS QG 1 98 ASP HB2 . . 4.080 2.483 2.384 2.619 . 0 0 "[ . 1 . 2]" 1
2691 1 97 LYS QG 1 102 ALA MB . . 4.570 3.481 3.216 3.743 . 0 0 "[ . 1 . 2]" 1
2692 1 97 LYS HG2 1 98 ASP H . . 4.730 3.728 2.968 4.285 . 0 0 "[ . 1 . 2]" 1
2693 1 97 LYS HG3 1 98 ASP H . . 4.730 3.086 2.720 3.647 . 0 0 "[ . 1 . 2]" 1
2694 1 98 ASP H 1 98 ASP HB2 . . 3.860 3.256 3.245 3.273 . 0 0 "[ . 1 . 2]" 1
2695 1 98 ASP H 1 98 ASP HB3 . . 4.090 3.865 3.854 3.882 . 0 0 "[ . 1 . 2]" 1
2696 1 98 ASP H 1 99 GLY H . . 3.610 2.677 2.597 2.769 . 0 0 "[ . 1 . 2]" 1
2697 1 98 ASP H 1 99 GLY HA2 . . 4.760 4.696 4.677 4.728 . 0 0 "[ . 1 . 2]" 1
2698 1 98 ASP H 1 99 GLY HA3 . . 5.280 4.999 4.966 5.030 . 0 0 "[ . 1 . 2]" 1
2699 1 98 ASP H 1 100 ALA H . . 4.930 4.721 4.669 4.785 . 0 0 "[ . 1 . 2]" 1
2700 1 98 ASP HA 1 99 GLY H . . 3.550 3.368 3.326 3.413 . 0 0 "[ . 1 . 2]" 1
2701 1 98 ASP HA 1 99 GLY HA2 . . 5.160 5.013 5.001 5.019 . 0 0 "[ . 1 . 2]" 1
2702 1 98 ASP HA 1 99 GLY HA3 . . 4.660 4.476 4.461 4.495 . 0 0 "[ . 1 . 2]" 1
2703 1 98 ASP HB2 1 99 GLY H . . 4.180 4.005 3.930 4.074 . 0 0 "[ . 1 . 2]" 1
2704 1 98 ASP HB2 1 100 ALA MB . . 5.020 4.690 4.623 4.798 . 0 0 "[ . 1 . 2]" 1
2705 1 98 ASP HB3 1 99 GLY H . . 3.970 3.350 3.212 3.465 . 0 0 "[ . 1 . 2]" 1
2706 1 98 ASP HB3 1 100 ALA H . . 4.420 4.103 4.025 4.266 . 0 0 "[ . 1 . 2]" 1
2707 1 98 ASP HB3 1 100 ALA MB . . 4.320 3.404 3.286 3.540 . 0 0 "[ . 1 . 2]" 1
2708 1 99 GLY H 1 100 ALA H . . 2.820 2.237 2.138 2.315 . 0 0 "[ . 1 . 2]" 1
2709 1 99 GLY H 1 100 ALA MB . . 4.140 3.925 3.812 4.037 . 0 0 "[ . 1 . 2]" 1
2710 1 99 GLY H 1 102 ALA MB . . 5.500 5.485 5.384 5.532 0.032 18 0 "[ . 1 . 2]" 1
2711 1 99 GLY HA2 1 100 ALA H . . 3.330 2.780 2.725 2.813 . 0 0 "[ . 1 . 2]" 1
2712 1 99 GLY HA2 1 100 ALA MB . . 4.680 4.508 4.473 4.536 . 0 0 "[ . 1 . 2]" 1
2713 1 99 GLY HA3 1 100 ALA MB . . 4.690 4.366 4.320 4.398 . 0 0 "[ . 1 . 2]" 1
2714 1 100 ALA H 1 100 ALA MB . . 2.790 2.618 2.573 2.695 . 0 0 "[ . 1 . 2]" 1
2715 1 100 ALA H 1 101 GLU H . . 3.840 2.958 2.906 3.035 . 0 0 "[ . 1 . 2]" 1
2716 1 100 ALA H 1 101 GLU HA . . 4.250 4.155 4.114 4.195 . 0 0 "[ . 1 . 2]" 1
2717 1 100 ALA H 1 101 GLU QB . . 5.340 4.825 4.794 4.857 . 0 0 "[ . 1 . 2]" 1
2718 1 100 ALA H 1 102 ALA MB . . 5.370 5.273 5.230 5.316 . 0 0 "[ . 1 . 2]" 1
2719 1 100 ALA HA 1 101 GLU H . . 3.530 3.513 3.497 3.524 . 0 0 "[ . 1 . 2]" 1
2720 1 100 ALA MB 1 101 GLU H . . 2.880 1.920 1.859 1.967 . 0 0 "[ . 1 . 2]" 1
2721 1 100 ALA MB 1 101 GLU HA . . 4.150 4.086 4.055 4.118 . 0 0 "[ . 1 . 2]" 1
2722 1 100 ALA MB 1 101 GLU HB2 . . 4.050 3.587 3.529 3.746 . 0 0 "[ . 1 . 2]" 1
2723 1 100 ALA MB 1 101 GLU HB3 . . 4.050 3.767 3.655 3.877 . 0 0 "[ . 1 . 2]" 1
2724 1 100 ALA MB 1 102 ALA H . . 5.500 4.956 4.777 5.074 . 0 0 "[ . 1 . 2]" 1
2725 1 101 GLU H 1 101 GLU HB2 . . 3.970 3.338 3.296 3.409 . 0 0 "[ . 1 . 2]" 1
2726 1 101 GLU H 1 101 GLU QB . . 3.340 2.964 2.938 2.984 . 0 0 "[ . 1 . 2]" 1
2727 1 101 GLU H 1 101 GLU HB3 . . 3.970 3.318 3.232 3.369 . 0 0 "[ . 1 . 2]" 1
2728 1 101 GLU H 1 101 GLU HG2 . . 4.880 4.920 4.848 4.946 0.066 13 0 "[ . 1 . 2]" 1
2729 1 101 GLU H 1 101 GLU HG3 . . 5.100 4.697 4.686 4.720 . 0 0 "[ . 1 . 2]" 1
2730 1 101 GLU H 1 102 ALA H . . 3.950 3.614 3.496 3.726 . 0 0 "[ . 1 . 2]" 1
2731 1 101 GLU H 1 103 ASP H . . 5.500 5.540 5.497 5.581 0.081 16 0 "[ . 1 . 2]" 1
2732 1 101 GLU HA 1 101 GLU HG2 . . 3.610 3.156 3.102 3.261 . 0 0 "[ . 1 . 2]" 1
2733 1 101 GLU HA 1 101 GLU HG3 . . 3.730 2.251 2.234 2.314 . 0 0 "[ . 1 . 2]" 1
2734 1 101 GLU HA 1 102 ALA H . . 2.960 2.164 2.146 2.193 . 0 0 "[ . 1 . 2]" 1
2735 1 101 GLU HA 1 102 ALA HA . . 4.650 4.423 4.405 4.449 . 0 0 "[ . 1 . 2]" 1
2736 1 101 GLU HA 1 102 ALA MB . . 4.110 3.985 3.959 4.018 . 0 0 "[ . 1 . 2]" 1
2737 1 101 GLU HA 1 103 ASP H . . 3.610 3.595 3.564 3.615 0.005 7 0 "[ . 1 . 2]" 1
2738 1 101 GLU HG2 1 102 ALA H . . 4.320 3.962 3.777 4.149 . 0 0 "[ . 1 . 2]" 1
2739 1 101 GLU HG2 1 102 ALA HA . . 5.010 4.990 4.923 5.050 0.040 13 0 "[ . 1 . 2]" 1
2740 1 101 GLU HG2 1 102 ALA MB . . 5.500 5.210 5.154 5.257 . 0 0 "[ . 1 . 2]" 1
2741 1 101 GLU HG2 1 103 ASP H . . 3.650 3.481 3.359 3.624 . 0 0 "[ . 1 . 2]" 1
2742 1 101 GLU HG2 1 103 ASP HA . . 4.670 3.642 3.572 3.709 . 0 0 "[ . 1 . 2]" 1
2743 1 101 GLU HG2 1 104 LYS QD . . 4.780 4.508 4.246 4.705 . 0 0 "[ . 1 . 2]" 1
2744 1 101 GLU HG3 1 102 ALA H . . 4.220 3.604 3.494 3.657 . 0 0 "[ . 1 . 2]" 1
2745 1 101 GLU HG3 1 103 ASP H . . 3.640 3.610 3.416 3.689 0.049 17 0 "[ . 1 . 2]" 1
2746 1 101 GLU HG3 1 103 ASP HA . . 4.890 4.653 4.334 4.830 . 0 0 "[ . 1 . 2]" 1
2747 1 102 ALA H 1 102 ALA MB . . 3.050 2.150 2.103 2.204 . 0 0 "[ . 1 . 2]" 1
2748 1 102 ALA H 1 103 ASP H . . 2.900 2.290 2.173 2.415 . 0 0 "[ . 1 . 2]" 1
2749 1 102 ALA HA 1 103 ASP H . . 3.550 3.502 3.487 3.516 . 0 0 "[ . 1 . 2]" 1
2750 1 102 ALA HA 1 103 ASP QB . . 4.530 4.272 4.246 4.301 . 0 0 "[ . 1 . 2]" 1
2751 1 102 ALA MB 1 103 ASP H . . 3.100 2.820 2.744 2.873 . 0 0 "[ . 1 . 2]" 1
2752 1 102 ALA MB 1 103 ASP QB . . 3.910 3.084 3.059 3.112 . 0 0 "[ . 1 . 2]" 1
2753 1 103 ASP H 1 104 LYS H . . 4.370 4.371 4.367 4.378 0.008 15 0 "[ . 1 . 2]" 1
2754 1 103 ASP H 1 104 LYS HA . . 4.770 4.674 4.654 4.692 . 0 0 "[ . 1 . 2]" 1
2755 1 103 ASP H 1 116 THR MG . . 5.500 5.470 5.399 5.542 0.042 14 0 "[ . 1 . 2]" 1
2756 1 103 ASP HA 1 104 LYS H . . 2.660 2.597 2.576 2.621 . 0 0 "[ . 1 . 2]" 1
2757 1 103 ASP HA 1 104 LYS HA . . 4.730 4.484 4.454 4.501 . 0 0 "[ . 1 . 2]" 1
2758 1 103 ASP QB 1 104 LYS H . . 3.030 2.118 2.066 2.163 . 0 0 "[ . 1 . 2]" 1
2759 1 103 ASP QB 1 104 LYS HA . . 4.140 3.943 3.915 3.992 . 0 0 "[ . 1 . 2]" 1
2760 1 103 ASP QB 1 104 LYS QD . . 5.240 4.171 3.952 4.352 . 0 0 "[ . 1 . 2]" 1
2761 1 103 ASP QB 1 105 VAL H . . 5.500 5.536 5.498 5.575 0.075 12 0 "[ . 1 . 2]" 1
2762 1 103 ASP QB 1 105 VAL QG . . 3.900 3.907 3.824 3.954 0.054 6 0 "[ . 1 . 2]" 1
2763 1 103 ASP QB 1 116 THR MG . . 3.500 3.519 3.488 3.558 0.058 10 0 "[ . 1 . 2]" 1
2764 1 104 LYS H 1 104 LYS QB . . 3.650 2.976 2.794 3.060 . 0 0 "[ . 1 . 2]" 1
2765 1 104 LYS H 1 104 LYS QD . . 4.350 2.591 2.368 2.765 . 0 0 "[ . 1 . 2]" 1
2766 1 104 LYS H 1 104 LYS QE . . 4.670 4.435 4.244 4.649 . 0 0 "[ . 1 . 2]" 1
2767 1 104 LYS H 1 104 LYS HG2 . . 4.670 3.022 2.426 4.175 . 0 0 "[ . 1 . 2]" 1
2768 1 104 LYS H 1 104 LYS QG . . 4.020 2.593 2.405 2.877 . 0 0 "[ . 1 . 2]" 1
2769 1 104 LYS H 1 104 LYS HG3 . . 4.670 3.653 2.769 4.065 . 0 0 "[ . 1 . 2]" 1
2770 1 104 LYS H 1 105 VAL H . . 4.470 4.412 4.344 4.441 . 0 0 "[ . 1 . 2]" 1
2771 1 104 LYS H 1 105 VAL HA . . 4.990 4.835 4.815 4.890 . 0 0 "[ . 1 . 2]" 1
2772 1 104 LYS H 1 116 THR MG . . 4.850 4.866 4.811 4.909 0.059 11 0 "[ . 1 . 2]" 1
2773 1 104 LYS HA 1 104 LYS QD . . 4.400 3.885 3.772 3.985 . 0 0 "[ . 1 . 2]" 1
2774 1 104 LYS HA 1 104 LYS QE . . 4.700 4.707 4.513 4.948 0.248 12 0 "[ . 1 . 2]" 1
2775 1 104 LYS HA 1 104 LYS HG2 . . 4.240 3.561 3.453 3.597 . 0 0 "[ . 1 . 2]" 1
2776 1 104 LYS HA 1 104 LYS QG . . 3.700 3.161 2.622 3.400 . 0 0 "[ . 1 . 2]" 1
2777 1 104 LYS HA 1 104 LYS HG3 . . 4.240 3.731 2.703 4.188 . 0 0 "[ . 1 . 2]" 1
2778 1 104 LYS HA 1 105 VAL H . . 3.010 2.562 2.475 2.721 . 0 0 "[ . 1 . 2]" 1
2779 1 104 LYS HA 1 105 VAL HA . . 4.790 4.547 4.499 4.635 . 0 0 "[ . 1 . 2]" 1
2780 1 104 LYS HA 1 105 VAL HB . . 4.520 4.343 4.257 4.414 . 0 0 "[ . 1 . 2]" 1
2781 1 104 LYS HA 1 105 VAL QG . . 4.020 3.533 3.413 3.656 . 0 0 "[ . 1 . 2]" 1
2782 1 104 LYS HA 1 116 THR MG . . 4.750 4.343 4.226 4.501 . 0 0 "[ . 1 . 2]" 1
2783 1 104 LYS QB 1 104 LYS QD . . 3.210 2.132 1.971 2.253 . 0 0 "[ . 1 . 2]" 1
2784 1 104 LYS QB 1 104 LYS QE . . 3.230 2.475 2.205 2.847 . 0 0 "[ . 1 . 2]" 1
2785 1 104 LYS QB 1 105 VAL H . . 3.820 2.186 2.050 2.301 . 0 0 "[ . 1 . 2]" 1
2786 1 104 LYS HB2 1 104 LYS QD . . 3.720 2.953 1.989 3.388 . 0 0 "[ . 1 . 2]" 1
2787 1 104 LYS HB2 1 104 LYS QE . . 3.930 3.070 2.777 3.322 . 0 0 "[ . 1 . 2]" 1
2788 1 104 LYS HB2 1 105 VAL H . . 4.500 2.386 2.077 2.932 . 0 0 "[ . 1 . 2]" 1
2789 1 104 LYS HB3 1 104 LYS QD . . 3.720 2.525 2.160 3.254 . 0 0 "[ . 1 . 2]" 1
2790 1 104 LYS HB3 1 104 LYS QE . . 3.930 2.725 2.251 3.532 . 0 0 "[ . 1 . 2]" 1
2791 1 104 LYS HB3 1 105 VAL H . . 4.500 3.238 2.138 3.752 . 0 0 "[ . 1 . 2]" 1
2792 1 104 LYS QD 1 105 VAL H . . 5.130 4.770 4.458 4.930 . 0 0 "[ . 1 . 2]" 1
2793 1 104 LYS QE 1 104 LYS HG2 . . 3.780 2.962 2.104 3.469 . 0 0 "[ . 1 . 2]" 1
2794 1 104 LYS QE 1 104 LYS QG . . 3.240 2.175 2.034 2.521 . 0 0 "[ . 1 . 2]" 1
2795 1 104 LYS QE 1 104 LYS HG3 . . 3.780 2.507 2.057 3.159 . 0 0 "[ . 1 . 2]" 1
2796 1 104 LYS QG 1 105 VAL H . . 3.950 3.496 3.136 4.003 0.053 7 0 "[ . 1 . 2]" 1
2797 1 104 LYS HG2 1 105 VAL H . . 4.520 3.860 3.460 4.432 . 0 0 "[ . 1 . 2]" 1
2798 1 104 LYS HG3 1 105 VAL H . . 4.520 3.998 3.588 4.561 0.041 7 0 "[ . 1 . 2]" 1
2799 1 105 VAL H 1 105 VAL HB . . 3.560 2.830 2.742 2.974 . 0 0 "[ . 1 . 2]" 1
2800 1 105 VAL H 1 105 VAL QG . . 4.000 3.091 2.989 3.188 . 0 0 "[ . 1 . 2]" 1
2801 1 105 VAL H 1 106 VAL H . . 4.180 3.203 3.098 3.295 . 0 0 "[ . 1 . 2]" 1
2802 1 105 VAL H 1 106 VAL HA . . 4.770 4.203 4.147 4.254 . 0 0 "[ . 1 . 2]" 1
2803 1 105 VAL H 1 106 VAL HB . . 5.500 5.138 4.985 5.286 . 0 0 "[ . 1 . 2]" 1
2804 1 105 VAL H 1 106 VAL MG2 . . 4.320 4.309 4.140 4.384 0.064 20 0 "[ . 1 . 2]" 1
2805 1 105 VAL H 1 116 THR MG . . 5.310 5.015 4.814 5.290 . 0 0 "[ . 1 . 2]" 1
2806 1 105 VAL HA 1 105 VAL MG1 . . 3.090 2.468 2.436 2.518 . 0 0 "[ . 1 . 2]" 1
2807 1 105 VAL HA 1 105 VAL MG2 . . 3.090 2.260 2.158 2.375 . 0 0 "[ . 1 . 2]" 1
2808 1 105 VAL HA 1 106 VAL HB . . 4.130 4.057 3.999 4.118 . 0 0 "[ . 1 . 2]" 1
2809 1 105 VAL HA 1 116 THR MG . . 5.120 4.865 4.692 5.139 0.019 11 0 "[ . 1 . 2]" 1
2810 1 105 VAL HB 1 106 VAL H . . 4.410 1.914 1.853 2.007 . 0 0 "[ . 1 . 2]" 1
2811 1 105 VAL HB 1 106 VAL MG2 . . 5.310 5.037 4.968 5.131 . 0 0 "[ . 1 . 2]" 1
2812 1 105 VAL QG 1 106 VAL H . . 3.290 1.846 1.807 1.881 . 0 0 "[ . 1 . 2]" 1
2813 1 105 VAL QG 1 106 VAL HA . . 3.830 3.727 3.675 3.757 . 0 0 "[ . 1 . 2]" 1
2814 1 105 VAL QG 1 106 VAL HB . . 4.010 2.630 2.594 2.704 . 0 0 "[ . 1 . 2]" 1
2815 1 105 VAL QG 1 108 ALA H . . 4.680 4.178 4.009 4.300 . 0 0 "[ . 1 . 2]" 1
2816 1 105 VAL QG 1 109 ARG HB2 . . 3.580 3.112 2.846 3.356 . 0 0 "[ . 1 . 2]" 1
2817 1 105 VAL QG 1 109 ARG HB3 . . 4.220 3.733 3.413 4.047 . 0 0 "[ . 1 . 2]" 1
2818 1 105 VAL QG 1 109 ARG QG . . 5.280 3.910 1.852 4.406 . 0 0 "[ . 1 . 2]" 1
2819 1 105 VAL QG 1 112 ASP H . . 5.440 4.036 3.927 4.214 . 0 0 "[ . 1 . 2]" 1
2820 1 105 VAL QG 1 112 ASP HA . . 4.050 3.662 3.528 3.918 . 0 0 "[ . 1 . 2]" 1
2821 1 105 VAL QG 1 112 ASP HB2 . . 3.530 3.414 3.293 3.543 0.013 7 0 "[ . 1 . 2]" 1
2822 1 105 VAL QG 1 112 ASP HB3 . . 3.220 2.032 1.891 2.165 . 0 0 "[ . 1 . 2]" 1
2823 1 105 VAL QG 1 113 LEU H . . 4.240 3.293 2.955 3.556 . 0 0 "[ . 1 . 2]" 1
2824 1 105 VAL QG 1 113 LEU HA . . 3.120 2.398 2.018 2.737 . 0 0 "[ . 1 . 2]" 1
2825 1 105 VAL QG 1 116 THR H . . 4.420 3.527 3.403 3.801 . 0 0 "[ . 1 . 2]" 1
2826 1 105 VAL QG 1 116 THR HB . . 3.650 2.132 1.934 2.541 . 0 0 "[ . 1 . 2]" 1
2827 1 105 VAL QG 1 116 THR MG . . 3.160 2.051 1.946 2.185 . 0 0 "[ . 1 . 2]" 1
2828 1 105 VAL MG1 1 106 VAL H . . 3.800 1.852 1.812 1.889 . 0 0 "[ . 1 . 2]" 1
2829 1 105 VAL MG1 1 112 ASP HA . . 4.750 3.874 3.728 4.192 . 0 0 "[ . 1 . 2]" 1
2830 1 105 VAL MG1 1 112 ASP HB2 . . 5.010 3.475 3.354 3.621 . 0 0 "[ . 1 . 2]" 1
2831 1 105 VAL MG1 1 112 ASP HB3 . . 3.730 2.042 1.901 2.179 . 0 0 "[ . 1 . 2]" 1
2832 1 105 VAL MG1 1 113 LEU H . . 4.890 3.360 2.997 3.662 . 0 0 "[ . 1 . 2]" 1
2833 1 105 VAL MG1 1 113 LEU HA . . 3.760 2.524 2.077 2.958 . 0 0 "[ . 1 . 2]" 1
2834 1 105 VAL MG1 1 116 THR H . . 5.260 4.423 4.226 4.829 . 0 0 "[ . 1 . 2]" 1
2835 1 105 VAL MG1 1 116 THR HB . . 4.230 3.689 3.493 4.002 . 0 0 "[ . 1 . 2]" 1
2836 1 105 VAL MG1 1 116 THR MG . . 4.560 4.187 4.028 4.318 . 0 0 "[ . 1 . 2]" 1
2837 1 105 VAL MG2 1 106 VAL H . . 3.800 3.515 3.471 3.568 . 0 0 "[ . 1 . 2]" 1
2838 1 105 VAL MG2 1 112 ASP HA . . 4.750 4.517 4.349 4.723 . 0 0 "[ . 1 . 2]" 1
2839 1 105 VAL MG2 1 112 ASP HB2 . . 5.010 5.005 4.811 5.080 0.070 15 0 "[ . 1 . 2]" 1
2840 1 105 VAL MG2 1 112 ASP HB3 . . 3.730 3.671 3.408 3.748 0.018 10 0 "[ . 1 . 2]" 1
2841 1 105 VAL MG2 1 113 LEU H . . 4.890 4.746 4.490 4.920 0.030 5 0 "[ . 1 . 2]" 1
2842 1 105 VAL MG2 1 113 LEU HA . . 3.760 3.006 2.742 3.225 . 0 0 "[ . 1 . 2]" 1
2843 1 105 VAL MG2 1 116 THR H . . 5.260 3.707 3.571 3.977 . 0 0 "[ . 1 . 2]" 1
2844 1 105 VAL MG2 1 116 THR HB . . 4.230 2.146 1.943 2.570 . 0 0 "[ . 1 . 2]" 1
2845 1 105 VAL MG2 1 116 THR MG . . 4.560 2.056 1.950 2.192 . 0 0 "[ . 1 . 2]" 1
2846 1 106 VAL H 1 106 VAL HB . . 3.330 3.255 3.200 3.299 . 0 0 "[ . 1 . 2]" 1
2847 1 106 VAL H 1 106 VAL MG2 . . 4.000 3.741 3.722 3.762 . 0 0 "[ . 1 . 2]" 1
2848 1 106 VAL H 1 107 GLY H . . 4.350 3.984 3.796 4.144 . 0 0 "[ . 1 . 2]" 1
2849 1 106 VAL HA 1 106 VAL MG1 . . 3.150 2.744 2.716 2.761 . 0 0 "[ . 1 . 2]" 1
2850 1 106 VAL HA 1 106 VAL MG2 . . 3.140 2.015 1.965 2.050 . 0 0 "[ . 1 . 2]" 1
2851 1 106 VAL HA 1 107 GLY H . . 2.900 2.186 2.148 2.242 . 0 0 "[ . 1 . 2]" 1
2852 1 106 VAL HA 1 107 GLY HA3 . . 4.550 4.377 4.372 4.384 . 0 0 "[ . 1 . 2]" 1
2853 1 106 VAL HB 1 107 GLY H . . 4.450 4.341 4.208 4.461 0.011 15 0 "[ . 1 . 2]" 1
2854 1 106 VAL HB 1 108 ALA H . . 4.170 3.943 3.844 4.021 . 0 0 "[ . 1 . 2]" 1
2855 1 106 VAL HB 1 109 ARG H . . 5.020 4.591 4.294 4.790 . 0 0 "[ . 1 . 2]" 1
2856 1 106 VAL MG1 1 107 GLY H . . 3.370 2.477 2.170 2.792 . 0 0 "[ . 1 . 2]" 1
2857 1 106 VAL MG1 1 107 GLY HA2 . . 4.510 3.623 3.495 3.763 . 0 0 "[ . 1 . 2]" 1
2858 1 106 VAL MG1 1 107 GLY HA3 . . 4.570 3.802 3.663 3.971 . 0 0 "[ . 1 . 2]" 1
2859 1 106 VAL MG2 1 107 GLY H . . 3.660 3.403 3.269 3.529 . 0 0 "[ . 1 . 2]" 1
2860 1 106 VAL MG2 1 108 ALA H . . 5.080 4.282 4.143 4.402 . 0 0 "[ . 1 . 2]" 1
2861 1 106 VAL MG2 1 109 ARG H . . 5.480 5.309 5.101 5.488 0.008 14 0 "[ . 1 . 2]" 1
2862 1 107 GLY H 1 108 ALA H . . 3.830 3.311 3.217 3.443 . 0 0 "[ . 1 . 2]" 1
2863 1 107 GLY H 1 108 ALA MB . . 4.370 3.974 3.847 4.195 . 0 0 "[ . 1 . 2]" 1
2864 1 107 GLY H 1 109 ARG H . . 5.160 4.964 4.874 5.066 . 0 0 "[ . 1 . 2]" 1
2865 1 107 GLY HA2 1 108 ALA H . . 3.040 2.755 2.704 2.802 . 0 0 "[ . 1 . 2]" 1
2866 1 107 GLY HA3 1 108 ALA MB . . 4.440 4.241 4.178 4.319 . 0 0 "[ . 1 . 2]" 1
2867 1 108 ALA H 1 108 ALA MB . . 3.030 2.715 2.641 2.787 . 0 0 "[ . 1 . 2]" 1
2868 1 108 ALA H 1 109 ARG H . . 3.610 1.773 1.649 1.808 . 0 0 "[ . 1 . 2]" 1
2869 1 108 ALA HA 1 109 ARG H . . 3.140 3.118 3.069 3.258 0.118 11 0 "[ . 1 . 2]" 1
2870 1 108 ALA HA 1 110 LYS H . . 5.500 5.429 5.097 5.539 0.039 20 0 "[ . 1 . 2]" 1
2871 1 109 ARG H 1 109 ARG HB2 . . 2.970 2.527 2.461 2.986 0.016 11 0 "[ . 1 . 2]" 1
2872 1 109 ARG H 1 109 ARG HB3 . . 3.570 3.565 3.448 3.791 0.221 5 0 "[ . 1 . 2]" 1
2873 1 109 ARG H 1 109 ARG HD2 . . 4.080 3.737 3.172 4.174 0.094 5 0 "[ . 1 . 2]" 1
2874 1 109 ARG H 1 109 ARG QD . . 3.560 3.238 3.019 3.735 0.175 11 0 "[ . 1 . 2]" 1
2875 1 109 ARG H 1 109 ARG HD3 . . 4.080 3.649 3.206 4.246 0.166 11 0 "[ . 1 . 2]" 1
2876 1 109 ARG H 1 109 ARG HG2 . . 4.650 4.450 1.801 4.752 0.102 13 0 "[ . 1 . 2]" 1
2877 1 109 ARG H 1 109 ARG HG3 . . 4.650 4.394 3.395 4.679 0.029 2 0 "[ . 1 . 2]" 1
2878 1 109 ARG H 1 110 LYS H . . 4.600 4.150 3.945 4.227 . 0 0 "[ . 1 . 2]" 1
2879 1 109 ARG H 1 110 LYS HA . . 4.910 4.733 4.613 4.954 0.044 11 0 "[ . 1 . 2]" 1
2880 1 109 ARG H 1 112 ASP H . . 5.290 4.953 4.837 5.127 . 0 0 "[ . 1 . 2]" 1
2881 1 109 ARG H 1 112 ASP HB3 . . 5.360 4.916 4.640 5.164 . 0 0 "[ . 1 . 2]" 1
2882 1 109 ARG H 1 113 LEU H . . 5.050 4.816 4.498 5.013 . 0 0 "[ . 1 . 2]" 1
2883 1 109 ARG H 1 113 LEU QD . . 5.250 4.536 4.167 4.737 . 0 0 "[ . 1 . 2]" 1
2884 1 109 ARG HA 1 109 ARG HD2 . . 4.280 2.653 1.952 4.368 0.088 11 0 "[ . 1 . 2]" 1
2885 1 109 ARG HA 1 109 ARG HD3 . . 4.280 3.475 2.711 4.287 0.007 10 0 "[ . 1 . 2]" 1
2886 1 109 ARG HA 1 109 ARG HG2 . . 4.090 3.519 3.134 3.610 . 0 0 "[ . 1 . 2]" 1
2887 1 109 ARG HA 1 109 ARG QG . . 3.320 2.426 2.144 3.185 . 0 0 "[ . 1 . 2]" 1
2888 1 109 ARG HA 1 109 ARG HG3 . . 4.090 2.531 2.181 4.039 . 0 0 "[ . 1 . 2]" 1
2889 1 109 ARG HA 1 110 LYS H . . 3.170 2.147 2.139 2.186 . 0 0 "[ . 1 . 2]" 1
2890 1 109 ARG HA 1 110 LYS HA . . 4.590 4.407 4.394 4.447 . 0 0 "[ . 1 . 2]" 1
2891 1 109 ARG HA 1 110 LYS HB2 . . 4.520 4.282 4.198 4.391 . 0 0 "[ . 1 . 2]" 1
2892 1 109 ARG HA 1 110 LYS HB3 . . 5.320 5.043 4.909 5.202 . 0 0 "[ . 1 . 2]" 1
2893 1 109 ARG HA 1 112 ASP H . . 4.720 4.170 3.799 4.366 . 0 0 "[ . 1 . 2]" 1
2894 1 109 ARG HA 1 112 ASP HB2 . . 4.780 4.627 4.211 4.792 0.012 17 0 "[ . 1 . 2]" 1
2895 1 109 ARG HB2 1 110 LYS H . . 5.010 4.509 4.134 4.612 . 0 0 "[ . 1 . 2]" 1
2896 1 109 ARG HB2 1 112 ASP H . . 4.000 3.577 2.425 3.792 . 0 0 "[ . 1 . 2]" 1
2897 1 109 ARG HB2 1 112 ASP HA . . 5.500 5.256 4.213 5.487 . 0 0 "[ . 1 . 2]" 1
2898 1 109 ARG HB2 1 112 ASP HB2 . . 4.420 3.060 2.613 3.326 . 0 0 "[ . 1 . 2]" 1
2899 1 109 ARG HB2 1 112 ASP HB3 . . 4.450 2.777 2.064 3.120 . 0 0 "[ . 1 . 2]" 1
2900 1 109 ARG HB2 1 113 LEU H . . 4.240 3.957 2.543 4.263 0.023 16 0 "[ . 1 . 2]" 1
2901 1 109 ARG HB3 1 109 ARG HD2 . . 3.940 3.706 2.549 3.928 . 0 0 "[ . 1 . 2]" 1
2902 1 109 ARG HB3 1 109 ARG HD3 . . 3.940 3.516 2.221 3.715 . 0 0 "[ . 1 . 2]" 1
2903 1 109 ARG HB3 1 110 LYS H . . 4.240 3.715 3.586 3.926 . 0 0 "[ . 1 . 2]" 1
2904 1 109 ARG HB3 1 111 ASP H . . 5.250 2.698 2.571 3.295 . 0 0 "[ . 1 . 2]" 1
2905 1 109 ARG HB3 1 112 ASP H . . 3.730 2.213 2.056 2.782 . 0 0 "[ . 1 . 2]" 1
2906 1 109 ARG HB3 1 112 ASP HA . . 4.630 4.218 4.002 4.512 . 0 0 "[ . 1 . 2]" 1
2907 1 109 ARG HB3 1 112 ASP HB2 . . 4.270 2.081 1.979 2.259 . 0 0 "[ . 1 . 2]" 1
2908 1 109 ARG HB3 1 112 ASP HB3 . . 4.400 2.627 2.208 3.016 . 0 0 "[ . 1 . 2]" 1
2909 1 109 ARG HB3 1 113 LEU H . . 3.860 3.340 2.903 3.915 0.055 11 0 "[ . 1 . 2]" 1
2910 1 109 ARG QG 1 111 ASP H . . 4.740 3.771 3.379 4.905 0.165 11 0 "[ . 1 . 2]" 1
2911 1 109 ARG QG 1 112 ASP H . . 4.500 3.815 3.430 4.202 . 0 0 "[ . 1 . 2]" 1
2912 1 109 ARG QG 1 112 ASP HA . . 5.340 4.984 4.639 5.356 0.016 20 0 "[ . 1 . 2]" 1
2913 1 110 LYS H 1 110 LYS HB2 . . 3.420 2.314 2.221 2.455 . 0 0 "[ . 1 . 2]" 1
2914 1 110 LYS H 1 110 LYS QD . . 4.800 4.477 4.097 4.640 . 0 0 "[ . 1 . 2]" 1
2915 1 110 LYS H 1 111 ASP HA . . 5.500 5.073 5.017 5.167 . 0 0 "[ . 1 . 2]" 1
2916 1 110 LYS H 1 112 ASP H . . 5.120 4.066 3.915 4.157 . 0 0 "[ . 1 . 2]" 1
2917 1 110 LYS H 1 113 LEU H . . 5.020 5.043 4.885 5.128 0.108 14 0 "[ . 1 . 2]" 1
2918 1 110 LYS HA 1 110 LYS QD . . 4.010 3.057 2.928 3.238 . 0 0 "[ . 1 . 2]" 1
2919 1 110 LYS HA 1 110 LYS QE . . 4.810 4.518 4.405 4.636 . 0 0 "[ . 1 . 2]" 1
2920 1 110 LYS HA 1 111 ASP HA . . 4.550 4.470 4.448 4.491 . 0 0 "[ . 1 . 2]" 1
2921 1 110 LYS HA 1 112 ASP H . . 4.490 3.979 3.889 4.155 . 0 0 "[ . 1 . 2]" 1
2922 1 110 LYS HA 1 113 LEU H . . 4.010 3.880 3.740 4.039 0.029 11 0 "[ . 1 . 2]" 1
2923 1 110 LYS HA 1 113 LEU HB2 . . 4.760 4.500 4.252 4.811 0.051 13 0 "[ . 1 . 2]" 1
2924 1 110 LYS HA 1 113 LEU QB . . 4.140 3.271 3.040 3.426 . 0 0 "[ . 1 . 2]" 1
2925 1 110 LYS HA 1 113 LEU HB3 . . 4.760 3.361 3.114 3.543 . 0 0 "[ . 1 . 2]" 1
2926 1 110 LYS HA 1 113 LEU QD . . 3.720 3.715 3.497 3.778 0.058 11 0 "[ . 1 . 2]" 1
2927 1 110 LYS HA 1 114 GLN H . . 4.510 4.287 3.864 4.488 . 0 0 "[ . 1 . 2]" 1
2928 1 110 LYS HB2 1 110 LYS QD . . 3.370 3.183 1.930 3.310 . 0 0 "[ . 1 . 2]" 1
2929 1 110 LYS HB2 1 110 LYS QE . . 4.250 3.981 3.436 4.263 0.013 11 0 "[ . 1 . 2]" 1
2930 1 110 LYS HB2 1 111 ASP QB . . 5.380 5.141 4.980 5.388 0.008 11 0 "[ . 1 . 2]" 1
2931 1 110 LYS HB3 1 110 LYS QE . . 4.020 3.625 2.809 3.879 . 0 0 "[ . 1 . 2]" 1
2932 1 110 LYS HB3 1 111 ASP H . . 4.520 3.767 3.632 3.866 . 0 0 "[ . 1 . 2]" 1
2933 1 110 LYS HB3 1 111 ASP QB . . 4.380 4.013 3.907 4.170 . 0 0 "[ . 1 . 2]" 1
2934 1 110 LYS QD 1 114 GLN H . . 5.500 4.922 4.622 5.545 0.045 13 0 "[ . 1 . 2]" 1
2935 1 110 LYS QD 1 114 GLN QG . . 4.680 3.890 3.422 4.909 0.229 13 0 "[ . 1 . 2]" 1
2936 1 110 LYS QE 1 110 LYS QG . . 3.450 2.024 1.949 2.142 . 0 0 "[ . 1 . 2]" 1
2937 1 110 LYS QE 1 114 GLN QG . . 5.360 5.191 4.598 5.366 0.006 14 0 "[ . 1 . 2]" 1
2938 1 110 LYS QG 1 114 GLN QE . . 5.180 3.142 2.535 3.578 . 0 0 "[ . 1 . 2]" 1
2939 1 110 LYS QG 1 114 GLN QG . . 5.340 5.137 3.409 5.389 0.049 11 0 "[ . 1 . 2]" 1
2940 1 111 ASP H 1 111 ASP QB . . 3.850 2.660 2.450 3.066 . 0 0 "[ . 1 . 2]" 1
2941 1 111 ASP H 1 112 ASP H . . 4.420 1.822 1.764 1.883 . 0 0 "[ . 1 . 2]" 1
2942 1 111 ASP HA 1 111 ASP QB . . 2.760 2.316 2.160 2.539 . 0 0 "[ . 1 . 2]" 1
2943 1 111 ASP HA 1 114 GLN HE21 . . 4.610 3.854 3.239 4.214 . 0 0 "[ . 1 . 2]" 1
2944 1 111 ASP HA 1 114 GLN QE . . 4.050 3.095 2.798 3.236 . 0 0 "[ . 1 . 2]" 1
2945 1 111 ASP HA 1 114 GLN HE22 . . 4.610 3.379 2.899 4.062 . 0 0 "[ . 1 . 2]" 1
2946 1 111 ASP HA 1 114 GLN QG . . 4.000 3.523 3.221 3.898 . 0 0 "[ . 1 . 2]" 1
2947 1 111 ASP QB 1 112 ASP H . . 3.810 3.484 3.224 3.831 0.021 10 0 "[ . 1 . 2]" 1
2948 1 111 ASP QB 1 114 GLN QE . . 5.290 4.425 4.225 4.533 . 0 0 "[ . 1 . 2]" 1
2949 1 111 ASP QB 1 114 GLN QG . . 5.340 5.073 4.697 5.351 0.011 6 0 "[ . 1 . 2]" 1
2950 1 112 ASP H 1 112 ASP HB2 . . 3.240 2.529 2.410 2.649 . 0 0 "[ . 1 . 2]" 1
2951 1 112 ASP H 1 112 ASP HB3 . . 3.140 3.005 2.905 3.124 . 0 0 "[ . 1 . 2]" 1
2952 1 112 ASP H 1 113 LEU H . . 3.330 1.993 1.940 2.049 . 0 0 "[ . 1 . 2]" 1
2953 1 112 ASP H 1 113 LEU HA . . 4.690 4.679 4.601 4.737 0.047 13 0 "[ . 1 . 2]" 1
2954 1 112 ASP H 1 113 LEU QB . . 4.060 3.740 3.665 3.813 . 0 0 "[ . 1 . 2]" 1
2955 1 112 ASP H 1 113 LEU QD . . 5.440 5.049 4.994 5.098 . 0 0 "[ . 1 . 2]" 1
2956 1 112 ASP H 1 114 GLN H . . 4.550 4.484 4.270 4.581 0.031 16 0 "[ . 1 . 2]" 1
2957 1 112 ASP H 1 114 GLN QE . . 4.690 3.101 2.561 3.284 . 0 0 "[ . 1 . 2]" 1
2958 1 112 ASP H 1 115 ASN H . . 4.630 4.544 4.367 4.649 0.019 11 0 "[ . 1 . 2]" 1
2959 1 112 ASP H 1 115 ASN QB . . 4.390 4.283 4.051 4.357 . 0 0 "[ . 1 . 2]" 1
2960 1 112 ASP HA 1 113 LEU HA . . 4.980 4.753 4.701 4.823 . 0 0 "[ . 1 . 2]" 1
2961 1 112 ASP HA 1 115 ASN H . . 3.920 3.830 3.632 3.920 . 0 0 "[ . 1 . 2]" 1
2962 1 112 ASP HA 1 115 ASN HB2 . . 4.150 3.450 2.202 3.946 . 0 0 "[ . 1 . 2]" 1
2963 1 112 ASP HA 1 115 ASN QB . . 3.330 2.401 2.170 2.517 . 0 0 "[ . 1 . 2]" 1
2964 1 112 ASP HA 1 115 ASN HB3 . . 4.150 2.696 2.315 3.562 . 0 0 "[ . 1 . 2]" 1
2965 1 112 ASP HA 1 115 ASN QD . . 4.050 3.049 2.343 4.072 0.022 17 0 "[ . 1 . 2]" 1
2966 1 112 ASP HA 1 116 THR H . . 4.640 4.372 4.270 4.462 . 0 0 "[ . 1 . 2]" 1
2967 1 112 ASP HA 1 116 THR HB . . 5.500 5.530 5.489 5.560 0.060 4 0 "[ . 1 . 2]" 1
2968 1 112 ASP HB2 1 113 LEU H . . 3.930 3.707 3.499 3.842 . 0 0 "[ . 1 . 2]" 1
2969 1 112 ASP HB3 1 113 LEU H . . 3.650 3.122 2.814 3.340 . 0 0 "[ . 1 . 2]" 1
2970 1 112 ASP HB3 1 113 LEU HA . . 4.410 4.011 3.908 4.093 . 0 0 "[ . 1 . 2]" 1
2971 1 112 ASP HB3 1 114 GLN QE . . 5.340 5.288 4.445 5.378 0.038 14 0 "[ . 1 . 2]" 1
2972 1 113 LEU H 1 113 LEU HB2 . . 3.280 2.782 2.707 2.883 . 0 0 "[ . 1 . 2]" 1
2973 1 113 LEU H 1 113 LEU HB3 . . 3.280 2.296 2.227 2.361 . 0 0 "[ . 1 . 2]" 1
2974 1 113 LEU H 1 113 LEU MD1 . . 4.370 4.270 4.232 4.317 . 0 0 "[ . 1 . 2]" 1
2975 1 113 LEU H 1 113 LEU QD . . 3.800 3.750 3.703 3.770 . 0 0 "[ . 1 . 2]" 1
2976 1 113 LEU H 1 113 LEU MD2 . . 4.370 4.156 4.050 4.202 . 0 0 "[ . 1 . 2]" 1
2977 1 113 LEU H 1 113 LEU HG . . 4.720 4.312 4.228 4.375 . 0 0 "[ . 1 . 2]" 1
2978 1 113 LEU H 1 114 GLN H . . 3.430 2.980 2.846 3.089 . 0 0 "[ . 1 . 2]" 1
2979 1 113 LEU H 1 114 GLN HA . . 5.480 5.428 5.321 5.528 0.048 17 0 "[ . 1 . 2]" 1
2980 1 113 LEU H 1 114 GLN QG . . 4.790 4.549 3.949 4.876 0.086 11 0 "[ . 1 . 2]" 1
2981 1 113 LEU H 1 115 ASN H . . 4.460 3.582 3.440 3.844 . 0 0 "[ . 1 . 2]" 1
2982 1 113 LEU H 1 116 THR H . . 4.880 4.612 4.519 4.734 . 0 0 "[ . 1 . 2]" 1
2983 1 113 LEU H 1 117 ILE MD . . 5.320 4.934 4.890 4.995 . 0 0 "[ . 1 . 2]" 1
2984 1 113 LEU HA 1 113 LEU QD . . 3.840 2.287 2.201 2.538 . 0 0 "[ . 1 . 2]" 1
2985 1 113 LEU HA 1 115 ASN H . . 4.660 3.943 3.775 4.265 . 0 0 "[ . 1 . 2]" 1
2986 1 113 LEU HA 1 116 THR H . . 3.980 3.412 3.322 3.551 . 0 0 "[ . 1 . 2]" 1
2987 1 113 LEU HA 1 116 THR HB . . 3.950 3.044 2.940 3.161 . 0 0 "[ . 1 . 2]" 1
2988 1 113 LEU HA 1 116 THR MG . . 4.610 4.397 4.300 4.485 . 0 0 "[ . 1 . 2]" 1
2989 1 113 LEU HA 1 117 ILE MD . . 4.540 3.034 2.941 3.164 . 0 0 "[ . 1 . 2]" 1
2990 1 113 LEU QB 1 113 LEU QD . . 2.640 1.913 1.870 1.937 . 0 0 "[ . 1 . 2]" 1
2991 1 113 LEU QB 1 114 GLN H . . 3.140 2.072 1.958 2.182 . 0 0 "[ . 1 . 2]" 1
2992 1 113 LEU QB 1 114 GLN QE . . 4.620 2.290 1.895 2.443 . 0 0 "[ . 1 . 2]" 1
2993 1 113 LEU QB 1 114 GLN QG . . 4.720 4.405 3.919 4.682 . 0 0 "[ . 1 . 2]" 1
2994 1 113 LEU QB 1 116 THR H . . 5.340 4.831 4.788 4.905 . 0 0 "[ . 1 . 2]" 1
2995 1 113 LEU HB2 1 113 LEU MD1 . . 3.500 2.294 2.174 2.341 . 0 0 "[ . 1 . 2]" 1
2996 1 113 LEU HB2 1 113 LEU MD2 . . 3.500 2.493 2.451 2.540 . 0 0 "[ . 1 . 2]" 1
2997 1 113 LEU HB2 1 114 GLN H . . 3.810 3.572 3.509 3.645 . 0 0 "[ . 1 . 2]" 1
2998 1 113 LEU HB3 1 113 LEU MD1 . . 3.500 3.182 3.154 3.190 . 0 0 "[ . 1 . 2]" 1
2999 1 113 LEU HB3 1 113 LEU MD2 . . 3.500 2.220 2.089 2.280 . 0 0 "[ . 1 . 2]" 1
3000 1 113 LEU HB3 1 114 GLN H . . 3.810 2.086 1.968 2.200 . 0 0 "[ . 1 . 2]" 1
3001 1 113 LEU QD 1 114 GLN H . . 3.540 2.981 2.808 3.126 . 0 0 "[ . 1 . 2]" 1
3002 1 113 LEU QD 1 114 GLN QE . . 3.890 3.090 2.907 3.328 . 0 0 "[ . 1 . 2]" 1
3003 1 113 LEU QD 1 116 THR HB . . 3.870 3.700 3.530 3.891 0.021 10 0 "[ . 1 . 2]" 1
3004 1 113 LEU QD 1 117 ILE H . . 4.720 3.922 3.860 3.978 . 0 0 "[ . 1 . 2]" 1
3005 1 113 LEU QD 1 117 ILE HB . . 4.120 4.077 3.917 4.184 0.064 7 0 "[ . 1 . 2]" 1
3006 1 113 LEU QD 1 117 ILE QG . . 3.650 3.093 2.922 3.224 . 0 0 "[ . 1 . 2]" 1
3007 1 113 LEU QD 1 117 ILE MG . . 5.440 4.358 4.213 4.459 . 0 0 "[ . 1 . 2]" 1
3008 1 113 LEU MD1 1 114 GLN H . . 4.060 3.896 3.745 3.996 . 0 0 "[ . 1 . 2]" 1
3009 1 113 LEU MD1 1 114 GLN HA . . 4.650 4.200 3.945 4.371 . 0 0 "[ . 1 . 2]" 1
3010 1 113 LEU MD1 1 115 ASN H . . 5.350 5.065 4.876 5.398 0.048 10 0 "[ . 1 . 2]" 1
3011 1 113 LEU MD1 1 117 ILE MD . . 3.300 1.672 1.621 1.698 . 0 0 "[ . 1 . 2]" 1
3012 1 113 LEU MD2 1 114 GLN H . . 4.060 3.096 2.877 3.265 . 0 0 "[ . 1 . 2]" 1
3013 1 113 LEU MD2 1 114 GLN HA . . 4.650 4.153 3.932 4.288 . 0 0 "[ . 1 . 2]" 1
3014 1 113 LEU MD2 1 115 ASN H . . 5.350 5.377 5.263 5.439 0.089 5 0 "[ . 1 . 2]" 1
3015 1 113 LEU MD2 1 117 ILE MD . . 3.300 3.189 2.966 3.301 0.001 17 0 "[ . 1 . 2]" 1
3016 1 113 LEU HG 1 114 GLN H . . 4.160 2.518 2.251 2.710 . 0 0 "[ . 1 . 2]" 1
3017 1 113 LEU HG 1 114 GLN QG . . 5.290 4.940 4.376 5.293 0.003 18 0 "[ . 1 . 2]" 1
3018 1 113 LEU HG 1 117 ILE H . . 5.280 4.400 4.271 4.574 . 0 0 "[ . 1 . 2]" 1
3019 1 113 LEU HG 1 117 ILE MD . . 4.140 2.023 1.945 2.193 . 0 0 "[ . 1 . 2]" 1
3020 1 114 GLN H 1 114 GLN HB2 . . 3.870 3.589 3.574 3.597 . 0 0 "[ . 1 . 2]" 1
3021 1 114 GLN H 1 114 GLN QB . . 3.070 2.478 2.407 2.669 . 0 0 "[ . 1 . 2]" 1
3022 1 114 GLN H 1 114 GLN HB3 . . 3.870 2.528 2.446 2.755 . 0 0 "[ . 1 . 2]" 1
3023 1 114 GLN H 1 114 GLN HE21 . . 4.720 1.958 1.776 2.330 . 0 0 "[ . 1 . 2]" 1
3024 1 114 GLN H 1 114 GLN HE22 . . 4.720 2.531 2.196 3.231 . 0 0 "[ . 1 . 2]" 1
3025 1 114 GLN H 1 114 GLN QG . . 3.190 2.903 2.233 3.211 0.021 3 0 "[ . 1 . 2]" 1
3026 1 114 GLN H 1 115 ASN H . . 3.270 2.793 2.747 2.853 . 0 0 "[ . 1 . 2]" 1
3027 1 114 GLN H 1 115 ASN HA . . 5.500 5.356 5.302 5.417 . 0 0 "[ . 1 . 2]" 1
3028 1 114 GLN H 1 116 THR H . . 4.550 4.331 4.183 4.394 . 0 0 "[ . 1 . 2]" 1
3029 1 114 GLN H 1 117 ILE HB . . 5.500 4.973 4.883 5.107 . 0 0 "[ . 1 . 2]" 1
3030 1 114 GLN H 1 117 ILE MD . . 4.080 3.656 3.450 3.771 . 0 0 "[ . 1 . 2]" 1
3031 1 114 GLN HA 1 114 GLN QE . . 5.020 3.962 3.789 4.183 . 0 0 "[ . 1 . 2]" 1
3032 1 114 GLN HA 1 114 GLN QG . . 3.740 3.494 3.365 3.568 . 0 0 "[ . 1 . 2]" 1
3033 1 114 GLN HA 1 115 ASN HA . . 4.930 4.729 4.677 4.802 . 0 0 "[ . 1 . 2]" 1
3034 1 114 GLN HA 1 116 THR H . . 4.290 4.181 3.938 4.282 . 0 0 "[ . 1 . 2]" 1
3035 1 114 GLN HA 1 117 ILE H . . 3.750 3.456 3.338 3.565 . 0 0 "[ . 1 . 2]" 1
3036 1 114 GLN HA 1 117 ILE HB . . 3.780 2.583 2.457 2.739 . 0 0 "[ . 1 . 2]" 1
3037 1 114 GLN HA 1 117 ILE MD . . 3.510 2.735 2.369 2.892 . 0 0 "[ . 1 . 2]" 1
3038 1 114 GLN HA 1 117 ILE MG . . 4.510 3.867 3.795 3.988 . 0 0 "[ . 1 . 2]" 1
3039 1 114 GLN HA 1 118 VAL H . . 4.710 4.266 4.096 4.458 . 0 0 "[ . 1 . 2]" 1
3040 1 114 GLN HA 1 118 VAL MG1 . . 4.440 3.688 3.546 3.912 . 0 0 "[ . 1 . 2]" 1
3041 1 114 GLN QB 1 114 GLN QE . . 4.000 2.514 2.067 3.435 . 0 0 "[ . 1 . 2]" 1
3042 1 114 GLN QB 1 115 ASN H . . 3.780 3.609 3.426 3.706 . 0 0 "[ . 1 . 2]" 1
3043 1 114 GLN HB2 1 115 ASN H . . 4.400 3.978 3.688 4.149 . 0 0 "[ . 1 . 2]" 1
3044 1 114 GLN HB3 1 115 ASN H . . 4.400 4.147 4.036 4.319 . 0 0 "[ . 1 . 2]" 1
3045 1 114 GLN QE 1 115 ASN H . . 4.600 3.458 2.520 3.665 . 0 0 "[ . 1 . 2]" 1
3046 1 114 GLN QE 1 115 ASN QB . . 5.180 4.451 3.484 4.672 . 0 0 "[ . 1 . 2]" 1
3047 1 114 GLN QE 1 117 ILE MD . . 5.340 4.777 4.632 4.950 . 0 0 "[ . 1 . 2]" 1
3048 1 114 GLN HE22 1 114 GLN QG . . 3.690 3.357 3.259 3.416 . 0 0 "[ . 1 . 2]" 1
3049 1 114 GLN QG 1 115 ASN H . . 3.800 2.689 1.923 3.062 . 0 0 "[ . 1 . 2]" 1
3050 1 114 GLN QG 1 115 ASN HA . . 5.270 3.602 3.433 3.934 . 0 0 "[ . 1 . 2]" 1
3051 1 114 GLN QG 1 115 ASN QB . . 5.340 3.513 3.236 3.890 . 0 0 "[ . 1 . 2]" 1
3052 1 114 GLN QG 1 118 VAL MG2 . . 5.500 4.627 4.362 5.193 . 0 0 "[ . 1 . 2]" 1
3053 1 115 ASN H 1 115 ASN HB2 . . 3.140 2.764 2.120 3.104 . 0 0 "[ . 1 . 2]" 1
3054 1 115 ASN H 1 115 ASN HB3 . . 3.140 2.523 2.164 3.431 0.291 13 0 "[ . 1 . 2]" 1
3055 1 115 ASN H 1 115 ASN QD . . 4.280 3.619 2.627 4.233 . 0 0 "[ . 1 . 2]" 1
3056 1 115 ASN H 1 116 THR H . . 3.290 2.451 2.317 2.629 . 0 0 "[ . 1 . 2]" 1
3057 1 115 ASN H 1 116 THR HA . . 5.290 5.115 5.001 5.260 . 0 0 "[ . 1 . 2]" 1
3058 1 115 ASN H 1 117 ILE HB . . 5.500 5.021 4.926 5.232 . 0 0 "[ . 1 . 2]" 1
3059 1 115 ASN H 1 117 ILE MD . . 4.560 4.277 4.182 4.490 . 0 0 "[ . 1 . 2]" 1
3060 1 115 ASN H 1 118 VAL H . . 5.240 4.848 4.775 4.960 . 0 0 "[ . 1 . 2]" 1
3061 1 115 ASN H 1 118 VAL MG1 . . 4.650 4.543 4.405 4.648 . 0 0 "[ . 1 . 2]" 1
3062 1 115 ASN H 1 118 VAL MG2 . . 4.550 4.195 4.099 4.366 . 0 0 "[ . 1 . 2]" 1
3063 1 115 ASN HA 1 115 ASN QD . . 4.390 3.699 2.492 4.222 . 0 0 "[ . 1 . 2]" 1
3064 1 115 ASN HA 1 116 THR HA . . 4.810 4.691 4.670 4.704 . 0 0 "[ . 1 . 2]" 1
3065 1 115 ASN HA 1 117 ILE H . . 4.870 4.650 4.491 4.848 . 0 0 "[ . 1 . 2]" 1
3066 1 115 ASN HA 1 118 VAL H . . 3.880 3.825 3.734 3.934 0.054 10 0 "[ . 1 . 2]" 1
3067 1 115 ASN HA 1 118 VAL MG1 . . 3.290 3.046 2.960 3.118 . 0 0 "[ . 1 . 2]" 1
3068 1 115 ASN HA 1 118 VAL MG2 . . 3.830 2.041 1.967 2.196 . 0 0 "[ . 1 . 2]" 1
3069 1 115 ASN HA 1 119 LYS H . . 5.130 4.884 4.795 5.014 . 0 0 "[ . 1 . 2]" 1
3070 1 115 ASN QB 1 116 THR H . . 3.410 2.887 2.791 2.985 . 0 0 "[ . 1 . 2]" 1
3071 1 115 ASN QB 1 118 VAL MG1 . . 4.720 4.672 4.595 4.795 0.075 15 0 "[ . 1 . 2]" 1
3072 1 115 ASN HB2 1 118 VAL MG1 . . 5.500 5.092 4.933 5.461 . 0 0 "[ . 1 . 2]" 1
3073 1 115 ASN HB3 1 118 VAL MG1 . . 5.500 5.469 5.272 5.549 0.049 8 0 "[ . 1 . 2]" 1
3074 1 115 ASN QD 1 116 THR H . . 4.510 3.628 2.659 4.618 0.108 17 0 "[ . 1 . 2]" 1
3075 1 116 THR H 1 116 THR HB . . 3.130 2.334 2.275 2.392 . 0 0 "[ . 1 . 2]" 1
3076 1 116 THR H 1 116 THR MG . . 3.930 3.701 3.641 3.741 . 0 0 "[ . 1 . 2]" 1
3077 1 116 THR H 1 117 ILE H . . 3.230 2.427 2.377 2.489 . 0 0 "[ . 1 . 2]" 1
3078 1 116 THR H 1 117 ILE HA . . 5.220 5.070 5.029 5.111 . 0 0 "[ . 1 . 2]" 1
3079 1 116 THR H 1 117 ILE HB . . 4.650 4.413 4.345 4.451 . 0 0 "[ . 1 . 2]" 1
3080 1 116 THR H 1 117 ILE MD . . 4.440 3.370 3.281 3.517 . 0 0 "[ . 1 . 2]" 1
3081 1 116 THR H 1 118 VAL H . . 4.100 3.829 3.742 3.894 . 0 0 "[ . 1 . 2]" 1
3082 1 116 THR H 1 118 VAL MG1 . . 5.500 4.795 4.577 4.907 . 0 0 "[ . 1 . 2]" 1
3083 1 116 THR H 1 118 VAL MG2 . . 4.470 3.904 3.792 4.024 . 0 0 "[ . 1 . 2]" 1
3084 1 116 THR H 1 119 LYS H . . 5.130 4.835 4.735 4.883 . 0 0 "[ . 1 . 2]" 1
3085 1 116 THR H 1 119 LYS HD2 . . 5.020 4.941 4.829 5.027 0.007 15 0 "[ . 1 . 2]" 1
3086 1 116 THR H 1 119 LYS HD3 . . 5.500 5.465 5.409 5.516 0.016 11 0 "[ . 1 . 2]" 1
3087 1 116 THR HA 1 116 THR MG . . 3.130 2.526 2.436 2.612 . 0 0 "[ . 1 . 2]" 1
3088 1 116 THR HA 1 118 VAL H . . 4.530 3.929 3.855 3.971 . 0 0 "[ . 1 . 2]" 1
3089 1 116 THR HA 1 119 LYS H . . 3.380 3.264 3.189 3.328 . 0 0 "[ . 1 . 2]" 1
3090 1 116 THR HA 1 119 LYS HB2 . . 4.660 4.567 4.446 4.658 . 0 0 "[ . 1 . 2]" 1
3091 1 116 THR HA 1 119 LYS HB3 . . 4.130 3.020 2.864 3.174 . 0 0 "[ . 1 . 2]" 1
3092 1 116 THR HA 1 119 LYS HD2 . . 4.430 2.148 2.040 2.276 . 0 0 "[ . 1 . 2]" 1
3093 1 116 THR HA 1 119 LYS HD3 . . 4.610 2.706 2.637 2.797 . 0 0 "[ . 1 . 2]" 1
3094 1 116 THR HA 1 119 LYS HE2 . . 5.000 4.903 4.614 5.004 0.004 15 0 "[ . 1 . 2]" 1
3095 1 116 THR HA 1 119 LYS QE . . 4.280 4.088 3.939 4.247 . 0 0 "[ . 1 . 2]" 1
3096 1 116 THR HA 1 119 LYS HE3 . . 5.000 4.388 4.167 4.774 . 0 0 "[ . 1 . 2]" 1
3097 1 116 THR HA 1 119 LYS HG2 . . 4.470 3.374 3.191 3.550 . 0 0 "[ . 1 . 2]" 1
3098 1 116 THR HA 1 120 HIS H . . 4.550 4.368 4.312 4.430 . 0 0 "[ . 1 . 2]" 1
3099 1 116 THR HB 1 117 ILE MD . . 4.790 2.751 2.568 3.039 . 0 0 "[ . 1 . 2]" 1
3100 1 116 THR MG 1 117 ILE H . . 4.170 3.141 2.971 3.266 . 0 0 "[ . 1 . 2]" 1
3101 1 116 THR MG 1 117 ILE HA . . 4.320 3.111 2.963 3.286 . 0 0 "[ . 1 . 2]" 1
3102 1 116 THR MG 1 117 ILE MD . . 4.180 3.038 2.869 3.268 . 0 0 "[ . 1 . 2]" 1
3103 1 116 THR MG 1 119 LYS H . . 4.450 4.222 4.056 4.334 . 0 0 "[ . 1 . 2]" 1
3104 1 116 THR MG 1 119 LYS HB3 . . 4.670 4.371 4.146 4.562 . 0 0 "[ . 1 . 2]" 1
3105 1 116 THR MG 1 119 LYS HD2 . . 4.090 3.246 3.017 3.363 . 0 0 "[ . 1 . 2]" 1
3106 1 116 THR MG 1 119 LYS HD3 . . 4.140 2.139 2.011 2.294 . 0 0 "[ . 1 . 2]" 1
3107 1 116 THR MG 1 119 LYS HE2 . . 4.930 4.513 4.167 4.710 . 0 0 "[ . 1 . 2]" 1
3108 1 116 THR MG 1 119 LYS QE . . 4.280 4.101 3.944 4.251 . 0 0 "[ . 1 . 2]" 1
3109 1 116 THR MG 1 119 LYS HE3 . . 4.930 4.734 4.538 4.939 0.009 4 0 "[ . 1 . 2]" 1
3110 1 116 THR MG 1 119 LYS HG2 . . 3.670 3.120 2.755 3.282 . 0 0 "[ . 1 . 2]" 1
3111 1 116 THR MG 1 120 HIS H . . 4.300 3.894 3.760 4.011 . 0 0 "[ . 1 . 2]" 1
3112 1 116 THR MG 1 120 HIS HB2 . . 3.940 3.630 3.522 3.754 . 0 0 "[ . 1 . 2]" 1
3113 1 117 ILE H 1 117 ILE HB . . 3.200 2.330 2.303 2.367 . 0 0 "[ . 1 . 2]" 1
3114 1 117 ILE H 1 117 ILE MD . . 3.670 1.931 1.855 2.128 . 0 0 "[ . 1 . 2]" 1
3115 1 117 ILE H 1 117 ILE QG . . 4.060 3.241 3.119 3.291 . 0 0 "[ . 1 . 2]" 1
3116 1 117 ILE H 1 117 ILE MG . . 3.880 3.703 3.686 3.722 . 0 0 "[ . 1 . 2]" 1
3117 1 117 ILE H 1 118 VAL H . . 3.370 2.644 2.579 2.739 . 0 0 "[ . 1 . 2]" 1
3118 1 117 ILE H 1 118 VAL MG1 . . 4.360 4.104 4.008 4.198 . 0 0 "[ . 1 . 2]" 1
3119 1 117 ILE H 1 118 VAL MG2 . . 4.210 3.990 3.859 4.122 . 0 0 "[ . 1 . 2]" 1
3120 1 117 ILE H 1 119 LYS H . . 4.270 4.137 4.098 4.166 . 0 0 "[ . 1 . 2]" 1
3121 1 117 ILE H 1 120 HIS HB2 . . 5.500 5.437 5.356 5.502 0.002 11 0 "[ . 1 . 2]" 1
3122 1 117 ILE HA 1 117 ILE MD . . 3.670 3.015 2.856 3.190 . 0 0 "[ . 1 . 2]" 1
3123 1 117 ILE HA 1 117 ILE QG . . 3.590 2.159 2.124 2.207 . 0 0 "[ . 1 . 2]" 1
3124 1 117 ILE HA 1 117 ILE MG . . 3.490 2.545 2.519 2.585 . 0 0 "[ . 1 . 2]" 1
3125 1 117 ILE HA 1 118 VAL HA . . 4.900 4.718 4.700 4.725 . 0 0 "[ . 1 . 2]" 1
3126 1 117 ILE HA 1 118 VAL MG1 . . 5.200 4.832 4.767 4.882 . 0 0 "[ . 1 . 2]" 1
3127 1 117 ILE HA 1 119 LYS H . . 4.530 4.166 4.090 4.222 . 0 0 "[ . 1 . 2]" 1
3128 1 117 ILE HA 1 119 LYS HG2 . . 5.500 4.805 4.628 4.927 . 0 0 "[ . 1 . 2]" 1
3129 1 117 ILE HA 1 120 HIS H . . 4.080 3.427 3.390 3.454 . 0 0 "[ . 1 . 2]" 1
3130 1 117 ILE HA 1 120 HIS HB2 . . 4.450 3.080 3.049 3.131 . 0 0 "[ . 1 . 2]" 1
3131 1 117 ILE HA 1 120 HIS HB3 . . 5.250 4.827 4.798 4.876 . 0 0 "[ . 1 . 2]" 1
3132 1 117 ILE HA 1 121 VAL H . . 4.480 3.002 2.975 3.044 . 0 0 "[ . 1 . 2]" 1
3133 1 117 ILE HA 1 121 VAL HB . . 4.060 3.826 3.734 3.876 . 0 0 "[ . 1 . 2]" 1
3134 1 117 ILE HA 1 121 VAL MG1 . . 4.890 4.907 4.853 4.980 0.090 11 0 "[ . 1 . 2]" 1
3135 1 117 ILE HA 1 122 GLY H . . 4.650 4.420 4.375 4.460 . 0 0 "[ . 1 . 2]" 1
3136 1 117 ILE HB 1 117 ILE MD . . 3.360 2.278 2.077 2.329 . 0 0 "[ . 1 . 2]" 1
3137 1 117 ILE HB 1 118 VAL H . . 3.220 3.050 3.007 3.114 . 0 0 "[ . 1 . 2]" 1
3138 1 117 ILE HB 1 118 VAL HA . . 4.890 4.622 4.596 4.650 . 0 0 "[ . 1 . 2]" 1
3139 1 117 ILE HB 1 118 VAL MG1 . . 3.640 3.381 3.306 3.442 . 0 0 "[ . 1 . 2]" 1
3140 1 117 ILE HB 1 121 VAL H . . 5.330 5.214 5.194 5.253 . 0 0 "[ . 1 . 2]" 1
3141 1 117 ILE HB 1 122 GLY H . . 5.500 5.558 5.541 5.575 0.075 2 0 "[ . 1 . 2]" 1
3142 1 117 ILE MD 1 117 ILE MG . . 3.330 3.171 3.130 3.213 . 0 0 "[ . 1 . 2]" 1
3143 1 117 ILE MD 1 118 VAL H . . 4.310 4.103 4.058 4.182 . 0 0 "[ . 1 . 2]" 1
3144 1 117 ILE MD 1 119 LYS H . . 5.500 5.454 5.341 5.574 0.074 10 0 "[ . 1 . 2]" 1
3145 1 117 ILE MD 1 120 HIS HB2 . . 5.500 5.311 5.131 5.458 . 0 0 "[ . 1 . 2]" 1
3146 1 117 ILE QG 1 121 VAL HB . . 5.140 4.300 4.210 4.362 . 0 0 "[ . 1 . 2]" 1
3147 1 117 ILE MG 1 118 VAL H . . 3.540 3.370 3.300 3.440 . 0 0 "[ . 1 . 2]" 1
3148 1 117 ILE MG 1 118 VAL HA . . 3.830 3.229 3.161 3.307 . 0 0 "[ . 1 . 2]" 1
3149 1 117 ILE MG 1 118 VAL MG1 . . 3.750 3.030 2.944 3.118 . 0 0 "[ . 1 . 2]" 1
3150 1 117 ILE MG 1 118 VAL MG2 . . 4.710 4.546 4.488 4.602 . 0 0 "[ . 1 . 2]" 1
3151 1 117 ILE MG 1 120 HIS H . . 4.640 4.560 4.536 4.597 . 0 0 "[ . 1 . 2]" 1
3152 1 117 ILE MG 1 121 VAL H . . 4.140 3.305 3.263 3.350 . 0 0 "[ . 1 . 2]" 1
3153 1 117 ILE MG 1 121 VAL HA . . 4.440 4.417 4.382 4.461 0.021 13 0 "[ . 1 . 2]" 1
3154 1 117 ILE MG 1 121 VAL HB . . 4.150 1.992 1.944 2.067 . 0 0 "[ . 1 . 2]" 1
3155 1 117 ILE MG 1 121 VAL MG1 . . 2.980 2.992 2.940 3.024 0.044 10 0 "[ . 1 . 2]" 1
3156 1 117 ILE MG 1 121 VAL MG2 . . 3.570 1.890 1.869 1.930 . 0 0 "[ . 1 . 2]" 1
3157 1 117 ILE MG 1 122 GLY H . . 4.520 3.599 3.560 3.637 . 0 0 "[ . 1 . 2]" 1
3158 1 117 ILE MG 1 122 GLY QA . . 4.970 4.102 4.047 4.150 . 0 0 "[ . 1 . 2]" 1
3159 1 118 VAL H 1 118 VAL HB . . 3.720 3.636 3.629 3.646 . 0 0 "[ . 1 . 2]" 1
3160 1 118 VAL H 1 118 VAL MG1 . . 2.860 2.350 2.274 2.419 . 0 0 "[ . 1 . 2]" 1
3161 1 118 VAL H 1 118 VAL MG2 . . 3.220 2.217 2.143 2.277 . 0 0 "[ . 1 . 2]" 1
3162 1 118 VAL H 1 119 LYS H . . 3.250 2.410 2.360 2.430 . 0 0 "[ . 1 . 2]" 1
3163 1 118 VAL H 1 119 LYS HA . . 5.070 5.071 5.027 5.088 0.018 11 0 "[ . 1 . 2]" 1
3164 1 118 VAL H 1 120 HIS H . . 3.930 3.878 3.862 3.912 . 0 0 "[ . 1 . 2]" 1
3165 1 118 VAL H 1 120 HIS HB2 . . 5.500 5.523 5.508 5.547 0.047 13 0 "[ . 1 . 2]" 1
3166 1 118 VAL H 1 122 GLY H . . 4.900 4.169 4.156 4.200 . 0 0 "[ . 1 . 2]" 1
3167 1 118 VAL HA 1 118 VAL MG1 . . 2.830 2.394 2.352 2.419 . 0 0 "[ . 1 . 2]" 1
3168 1 118 VAL HA 1 118 VAL MG2 . . 3.350 3.191 3.187 3.197 . 0 0 "[ . 1 . 2]" 1
3169 1 118 VAL HA 1 119 LYS HA . . 4.780 4.699 4.683 4.713 . 0 0 "[ . 1 . 2]" 1
3170 1 118 VAL HA 1 120 HIS H . . 4.230 4.209 4.154 4.249 0.019 17 0 "[ . 1 . 2]" 1
3171 1 118 VAL HA 1 121 VAL H . . 4.160 3.858 3.803 3.910 . 0 0 "[ . 1 . 2]" 1
3172 1 118 VAL HA 1 122 GLY H . . 3.310 2.243 2.194 2.290 . 0 0 "[ . 1 . 2]" 1
3173 1 118 VAL HA 1 122 GLY QA . . 3.910 1.962 1.946 1.977 . 0 0 "[ . 1 . 2]" 1
3174 1 118 VAL HA 1 125 ALA HA . . 4.590 4.381 4.198 4.566 . 0 0 "[ . 1 . 2]" 1
3175 1 118 VAL HA 1 125 ALA MB . . 5.270 5.271 5.194 5.299 0.029 17 0 "[ . 1 . 2]" 1
3176 1 118 VAL HB 1 119 LYS H . . 4.060 3.915 3.848 3.998 . 0 0 "[ . 1 . 2]" 1
3177 1 118 VAL HB 1 119 LYS HA . . 4.760 4.543 4.479 4.640 . 0 0 "[ . 1 . 2]" 1
3178 1 118 VAL HB 1 125 ALA HA . . 3.680 2.671 2.385 2.998 . 0 0 "[ . 1 . 2]" 1
3179 1 118 VAL MG1 1 119 LYS H . . 3.940 3.955 3.897 3.977 0.037 11 0 "[ . 1 . 2]" 1
3180 1 118 VAL MG1 1 121 VAL H . . 5.200 5.241 5.211 5.264 0.064 13 0 "[ . 1 . 2]" 1
3181 1 118 VAL MG1 1 122 GLY H . . 4.370 4.238 4.189 4.272 . 0 0 "[ . 1 . 2]" 1
3182 1 118 VAL MG1 1 122 GLY QA . . 4.150 3.431 3.324 3.541 . 0 0 "[ . 1 . 2]" 1
3183 1 118 VAL MG1 1 125 ALA MB . . 5.030 4.867 4.507 5.014 . 0 0 "[ . 1 . 2]" 1
3184 1 118 VAL MG2 1 119 LYS H . . 3.360 1.988 1.932 2.166 . 0 0 "[ . 1 . 2]" 1
3185 1 118 VAL MG2 1 119 LYS HA . . 3.820 3.299 3.140 3.357 . 0 0 "[ . 1 . 2]" 1
3186 1 118 VAL MG2 1 119 LYS HG3 . . 5.410 5.228 5.197 5.248 . 0 0 "[ . 1 . 2]" 1
3187 1 118 VAL MG2 1 120 HIS H . . 4.700 4.101 4.069 4.158 . 0 0 "[ . 1 . 2]" 1
3188 1 118 VAL MG2 1 122 GLY H . . 5.190 4.437 4.415 4.469 . 0 0 "[ . 1 . 2]" 1
3189 1 118 VAL MG2 1 122 GLY QA . . 4.050 4.075 4.063 4.104 0.054 2 0 "[ . 1 . 2]" 1
3190 1 118 VAL MG2 1 124 THR H . . 5.500 4.724 4.529 5.496 . 0 0 "[ . 1 . 2]" 1
3191 1 118 VAL MG2 1 125 ALA MB . . 4.090 2.734 2.120 2.901 . 0 0 "[ . 1 . 2]" 1
3192 1 119 LYS H 1 119 LYS HA . . 2.940 2.884 2.875 2.895 . 0 0 "[ . 1 . 2]" 1
3193 1 119 LYS H 1 119 LYS HB2 . . 3.860 3.538 3.519 3.560 . 0 0 "[ . 1 . 2]" 1
3194 1 119 LYS H 1 119 LYS HB3 . . 2.870 2.254 2.225 2.288 . 0 0 "[ . 1 . 2]" 1
3195 1 119 LYS H 1 119 LYS HD2 . . 4.000 3.668 3.578 3.790 . 0 0 "[ . 1 . 2]" 1
3196 1 119 LYS H 1 119 LYS HD3 . . 4.580 4.371 4.312 4.463 . 0 0 "[ . 1 . 2]" 1
3197 1 119 LYS H 1 119 LYS HG2 . . 4.390 2.948 2.812 3.043 . 0 0 "[ . 1 . 2]" 1
3198 1 119 LYS H 1 119 LYS HG3 . . 4.410 4.180 4.089 4.241 . 0 0 "[ . 1 . 2]" 1
3199 1 119 LYS H 1 120 HIS H . . 3.190 2.374 2.330 2.410 . 0 0 "[ . 1 . 2]" 1
3200 1 119 LYS H 1 120 HIS HA . . 5.240 5.067 5.031 5.096 . 0 0 "[ . 1 . 2]" 1
3201 1 119 LYS H 1 120 HIS HB2 . . 4.950 4.746 4.685 4.802 . 0 0 "[ . 1 . 2]" 1
3202 1 119 LYS H 1 120 HIS HD2 . . 5.500 5.409 5.316 5.486 . 0 0 "[ . 1 . 2]" 1
3203 1 119 LYS H 1 121 VAL H . . 4.030 3.981 3.924 4.031 0.001 11 0 "[ . 1 . 2]" 1
3204 1 119 LYS H 1 122 GLY H . . 4.200 3.856 3.822 3.887 . 0 0 "[ . 1 . 2]" 1
3205 1 119 LYS H 1 125 ALA HA . . 4.000 3.607 3.464 3.747 . 0 0 "[ . 1 . 2]" 1
3206 1 119 LYS H 1 125 ALA MB . . 4.530 3.514 3.160 3.789 . 0 0 "[ . 1 . 2]" 1
3207 1 119 LYS HA 1 119 LYS QE . . 5.340 4.710 4.574 4.804 . 0 0 "[ . 1 . 2]" 1
3208 1 119 LYS HA 1 119 LYS HG2 . . 3.690 3.609 3.581 3.650 . 0 0 "[ . 1 . 2]" 1
3209 1 119 LYS HA 1 119 LYS HG3 . . 3.730 3.643 3.610 3.679 . 0 0 "[ . 1 . 2]" 1
3210 1 119 LYS HA 1 120 HIS H . . 3.560 3.476 3.464 3.483 . 0 0 "[ . 1 . 2]" 1
3211 1 119 LYS HA 1 120 HIS HA . . 4.730 4.593 4.583 4.599 . 0 0 "[ . 1 . 2]" 1
3212 1 119 LYS HA 1 121 VAL H . . 5.330 5.074 5.007 5.097 . 0 0 "[ . 1 . 2]" 1
3213 1 119 LYS HA 1 122 GLY H . . 4.440 4.419 4.388 4.445 0.005 1 0 "[ . 1 . 2]" 1
3214 1 119 LYS HA 1 122 GLY QA . . 4.690 4.592 4.558 4.681 . 0 0 "[ . 1 . 2]" 1
3215 1 119 LYS HA 1 123 ALA H . . 4.350 4.021 3.746 4.204 . 0 0 "[ . 1 . 2]" 1
3216 1 119 LYS HA 1 125 ALA MB . . 3.180 2.202 2.003 2.804 . 0 0 "[ . 1 . 2]" 1
3217 1 119 LYS HB2 1 119 LYS HD3 . . 4.100 3.930 3.895 3.952 . 0 0 "[ . 1 . 2]" 1
3218 1 119 LYS HB2 1 119 LYS HE2 . . 4.040 3.300 2.893 4.045 0.005 11 0 "[ . 1 . 2]" 1
3219 1 119 LYS HB2 1 119 LYS QE . . 3.540 2.794 2.474 2.956 . 0 0 "[ . 1 . 2]" 1
3220 1 119 LYS HB2 1 119 LYS HE3 . . 4.040 3.126 2.497 3.442 . 0 0 "[ . 1 . 2]" 1
3221 1 119 LYS HB3 1 119 LYS HD3 . . 3.890 3.362 3.297 3.464 . 0 0 "[ . 1 . 2]" 1
3222 1 119 LYS HB3 1 119 LYS QE . . 4.560 3.223 3.125 3.329 . 0 0 "[ . 1 . 2]" 1
3223 1 119 LYS HB3 1 120 HIS H . . 3.940 3.665 3.624 3.729 . 0 0 "[ . 1 . 2]" 1
3224 1 119 LYS HD2 1 120 HIS H . . 4.860 4.530 4.455 4.613 . 0 0 "[ . 1 . 2]" 1
3225 1 119 LYS HD2 1 120 HIS HE1 . . 4.170 4.186 4.170 4.208 0.038 13 0 "[ . 1 . 2]" 1
3226 1 119 LYS HD3 1 120 HIS H . . 4.750 4.319 4.240 4.433 . 0 0 "[ . 1 . 2]" 1
3227 1 119 LYS HD3 1 120 HIS HE1 . . 4.070 2.784 2.705 2.854 . 0 0 "[ . 1 . 2]" 1
3228 1 119 LYS QE 1 119 LYS HG2 . . 3.440 3.205 3.161 3.254 . 0 0 "[ . 1 . 2]" 1
3229 1 119 LYS QE 1 120 HIS HE1 . . 3.610 2.483 2.098 2.804 . 0 0 "[ . 1 . 2]" 1
3230 1 119 LYS HE2 1 119 LYS HG3 . . 3.780 2.130 1.996 2.967 . 0 0 "[ . 1 . 2]" 1
3231 1 119 LYS HE3 1 119 LYS HG3 . . 3.780 3.038 2.233 3.346 . 0 0 "[ . 1 . 2]" 1
3232 1 119 LYS HG2 1 120 HIS H . . 3.850 2.272 2.227 2.360 . 0 0 "[ . 1 . 2]" 1
3233 1 119 LYS HG2 1 120 HIS HA . . 4.160 3.511 3.415 3.665 . 0 0 "[ . 1 . 2]" 1
3234 1 119 LYS HG2 1 120 HIS HE1 . . 3.460 3.332 3.282 3.420 . 0 0 "[ . 1 . 2]" 1
3235 1 119 LYS HG3 1 120 HIS H . . 4.060 3.691 3.551 3.807 . 0 0 "[ . 1 . 2]" 1
3236 1 119 LYS HG3 1 120 HIS HA . . 4.130 3.843 3.714 3.916 . 0 0 "[ . 1 . 2]" 1
3237 1 120 HIS H 1 120 HIS HB2 . . 3.120 2.587 2.571 2.600 . 0 0 "[ . 1 . 2]" 1
3238 1 120 HIS H 1 120 HIS HB3 . . 3.850 3.696 3.689 3.707 . 0 0 "[ . 1 . 2]" 1
3239 1 120 HIS H 1 120 HIS HD2 . . 4.080 4.052 3.984 4.105 0.025 2 0 "[ . 1 . 2]" 1
3240 1 120 HIS H 1 121 VAL H . . 2.960 2.245 2.218 2.267 . 0 0 "[ . 1 . 2]" 1
3241 1 120 HIS H 1 121 VAL HA . . 4.940 4.906 4.880 4.924 . 0 0 "[ . 1 . 2]" 1
3242 1 120 HIS H 1 121 VAL HB . . 4.890 4.795 4.726 4.851 . 0 0 "[ . 1 . 2]" 1
3243 1 120 HIS H 1 121 VAL MG2 . . 4.120 3.687 3.595 3.825 . 0 0 "[ . 1 . 2]" 1
3244 1 120 HIS H 1 122 GLY H . . 3.800 3.213 3.170 3.239 . 0 0 "[ . 1 . 2]" 1
3245 1 120 HIS H 1 122 GLY QA . . 4.820 4.802 4.757 4.876 0.056 2 0 "[ . 1 . 2]" 1
3246 1 120 HIS H 1 123 ALA H . . 4.280 4.129 3.953 4.233 . 0 0 "[ . 1 . 2]" 1
3247 1 120 HIS H 1 123 ALA HA . . 5.500 5.476 5.225 5.543 0.043 8 0 "[ . 1 . 2]" 1
3248 1 120 HIS H 1 125 ALA HA . . 5.500 5.494 5.424 5.542 0.042 3 0 "[ . 1 . 2]" 1
3249 1 120 HIS H 1 125 ALA MB . . 5.160 4.866 4.754 5.176 0.016 8 0 "[ . 1 . 2]" 1
3250 1 120 HIS HA 1 120 HIS HD2 . . 5.070 4.856 4.849 4.863 . 0 0 "[ . 1 . 2]" 1
3251 1 120 HIS HA 1 120 HIS HE1 . . 5.060 4.766 4.744 4.784 . 0 0 "[ . 1 . 2]" 1
3252 1 120 HIS HA 1 121 VAL HA . . 4.620 4.611 4.604 4.615 . 0 0 "[ . 1 . 2]" 1
3253 1 120 HIS HA 1 121 VAL MG2 . . 4.410 4.478 4.448 4.497 0.087 9 0 "[ . 1 . 2]" 1
3254 1 120 HIS HA 1 122 GLY H . . 4.960 4.706 4.673 4.727 . 0 0 "[ . 1 . 2]" 1
3255 1 120 HIS HB2 1 121 VAL H . . 3.560 2.451 2.424 2.511 . 0 0 "[ . 1 . 2]" 1
3256 1 120 HIS HB2 1 121 VAL HA . . 4.570 4.360 4.343 4.389 . 0 0 "[ . 1 . 2]" 1
3257 1 120 HIS HB2 1 121 VAL MG1 . . 5.030 5.068 5.027 5.137 0.107 13 0 "[ . 1 . 2]" 1
3258 1 120 HIS HB2 1 121 VAL MG2 . . 5.070 2.509 2.480 2.552 . 0 0 "[ . 1 . 2]" 1
3259 1 120 HIS HB2 1 122 GLY H . . 4.840 4.569 4.549 4.606 . 0 0 "[ . 1 . 2]" 1
3260 1 120 HIS HB2 1 123 ALA H . . 5.500 5.529 5.466 5.547 0.047 13 0 "[ . 1 . 2]" 1
3261 1 120 HIS HB3 1 121 VAL H . . 3.920 3.635 3.616 3.673 . 0 0 "[ . 1 . 2]" 1
3262 1 120 HIS HB3 1 122 GLY H . . 5.500 5.597 5.584 5.622 0.122 2 0 "[ . 1 . 2]" 1
3263 1 120 HIS HD2 1 121 VAL H . . 5.050 4.870 4.811 4.964 . 0 0 "[ . 1 . 2]" 1
3264 1 121 VAL H 1 121 VAL HB . . 3.200 2.737 2.664 2.789 . 0 0 "[ . 1 . 2]" 1
3265 1 121 VAL H 1 121 VAL MG1 . . 3.950 3.821 3.815 3.827 . 0 0 "[ . 1 . 2]" 1
3266 1 121 VAL H 1 121 VAL MG2 . . 4.010 2.003 1.915 2.111 . 0 0 "[ . 1 . 2]" 1
3267 1 121 VAL H 1 122 GLY H . . 2.850 2.199 2.167 2.216 . 0 0 "[ . 1 . 2]" 1
3268 1 121 VAL H 1 122 GLY QA . . 4.190 4.162 4.143 4.175 . 0 0 "[ . 1 . 2]" 1
3269 1 121 VAL H 1 123 ALA MB . . 5.500 5.524 5.493 5.604 0.104 10 0 "[ . 1 . 2]" 1
3270 1 121 VAL HA 1 121 VAL MG1 . . 3.130 2.122 2.093 2.220 . 0 0 "[ . 1 . 2]" 1
3271 1 121 VAL HA 1 121 VAL MG2 . . 2.890 2.577 2.552 2.619 . 0 0 "[ . 1 . 2]" 1
3272 1 121 VAL HA 1 122 GLY QA . . 4.450 4.411 4.378 4.426 . 0 0 "[ . 1 . 2]" 1
3273 1 121 VAL HB 1 122 GLY H . . 3.400 2.879 2.853 2.906 . 0 0 "[ . 1 . 2]" 1
3274 1 121 VAL HB 1 122 GLY QA . . 3.840 3.794 3.762 3.835 . 0 0 "[ . 1 . 2]" 1
3275 1 121 VAL MG1 1 122 GLY H . . 4.180 3.955 3.857 4.003 . 0 0 "[ . 1 . 2]" 1
3276 1 121 VAL MG1 1 122 GLY QA . . 4.930 3.905 3.717 4.014 . 0 0 "[ . 1 . 2]" 1
3277 1 121 VAL MG2 1 122 GLY H . . 4.400 3.602 3.521 3.711 . 0 0 "[ . 1 . 2]" 1
3278 1 121 VAL MG2 1 122 GLY QA . . 4.770 4.773 4.725 4.835 0.065 13 0 "[ . 1 . 2]" 1
3279 1 122 GLY H 1 122 GLY QA . . 2.610 2.227 2.219 2.247 . 0 0 "[ . 1 . 2]" 1
3280 1 122 GLY H 1 123 ALA H . . 3.920 2.482 2.378 2.522 . 0 0 "[ . 1 . 2]" 1
3281 1 122 GLY H 1 123 ALA HA . . 5.030 4.713 4.610 4.754 . 0 0 "[ . 1 . 2]" 1
3282 1 122 GLY H 1 123 ALA MB . . 4.590 4.595 4.565 4.624 0.034 8 0 "[ . 1 . 2]" 1
3283 1 122 GLY QA 1 123 ALA H . . 3.060 2.893 2.846 2.908 . 0 0 "[ . 1 . 2]" 1
3284 1 122 GLY QA 1 123 ALA HA . . 4.760 4.535 4.529 4.559 . 0 0 "[ . 1 . 2]" 1
3285 1 122 GLY QA 1 123 ALA MB . . 4.170 3.791 3.711 3.831 . 0 0 "[ . 1 . 2]" 1
3286 1 122 GLY QA 1 125 ALA HA . . 5.320 4.532 4.330 4.729 . 0 0 "[ . 1 . 2]" 1
3287 1 123 ALA H 1 123 ALA MB . . 3.010 2.712 2.647 2.806 . 0 0 "[ . 1 . 2]" 1
3288 1 123 ALA HA 1 124 THR H . . 3.460 2.828 2.166 3.113 . 0 0 "[ . 1 . 2]" 1
3289 1 123 ALA MB 1 124 THR H . . 3.880 3.605 3.430 3.691 . 0 0 "[ . 1 . 2]" 1
3290 1 123 ALA MB 1 124 THR HA . . 4.770 4.387 4.219 4.745 . 0 0 "[ . 1 . 2]" 1
3291 1 123 ALA MB 1 124 THR HB . . 5.500 4.968 4.130 5.504 0.004 17 0 "[ . 1 . 2]" 1
3292 1 124 THR H 1 124 THR MG . . 4.190 3.775 3.369 4.040 . 0 0 "[ . 1 . 2]" 1
3293 1 124 THR HA 1 124 THR MG . . 2.930 2.248 1.975 2.451 . 0 0 "[ . 1 . 2]" 1
3294 1 124 THR HA 1 125 ALA MB . . 5.030 3.984 3.890 4.119 . 0 0 "[ . 1 . 2]" 1
3295 1 124 THR HB 1 125 ALA MB . . 5.500 4.816 4.576 5.452 . 0 0 "[ . 1 . 2]" 1
3296 1 124 THR MG 1 125 ALA H . . 4.960 3.880 3.427 4.351 . 0 0 "[ . 1 . 2]" 1
3297 1 125 ALA H 1 125 ALA MB . . 3.580 2.733 2.160 2.951 . 0 0 "[ . 1 . 2]" 1
3298 1 125 ALA MB 1 127 SER H . . 5.450 3.647 2.987 5.177 . 0 0 "[ . 1 . 2]" 1
3299 1 126 ALA MB 1 127 SER H . . 5.500 2.661 1.909 3.719 . 0 0 "[ . 1 . 2]" 1
3300 1 128 ALA MB 1 130 ALA H . . 4.710 3.956 2.474 4.472 . 0 0 "[ . 1 . 2]" 1
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