NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
597109 |
2n8w   |
25868 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n8w
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 1759
_Distance_constraint_stats_list.Viol_count 731
_Distance_constraint_stats_list.Viol_total 1437.916
_Distance_constraint_stats_list.Viol_max 0.397
_Distance_constraint_stats_list.Viol_rms 0.0180
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0020
_Distance_constraint_stats_list.Viol_average_violations_only 0.0984
_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 2 ASP 0.133 0.117 3 0 "[ . 1 . 2]"
1 3 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 ILE 0.931 0.183 15 0 "[ . 1 . 2]"
1 6 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 7 LYS 0.014 0.007 1 0 "[ . 1 . 2]"
1 8 PHE 0.231 0.108 8 0 "[ . 1 . 2]"
1 9 GLU 0.046 0.046 2 0 "[ . 1 . 2]"
1 11 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 TYR 9.847 0.397 7 0 "[ . 1 . 2]"
1 13 LYS 0.650 0.303 11 0 "[ . 1 . 2]"
1 14 LYS 0.197 0.128 3 0 "[ . 1 . 2]"
1 15 ALA 2.147 0.303 11 0 "[ . 1 . 2]"
1 16 GLU 0.616 0.098 1 0 "[ . 1 . 2]"
1 17 GLU 0.872 0.256 6 0 "[ . 1 . 2]"
1 18 LEU 1.767 0.389 7 0 "[ . 1 . 2]"
1 20 GLN 1.740 0.333 19 0 "[ . 1 . 2]"
1 21 GLY 0.378 0.096 4 0 "[ . 1 . 2]"
1 23 LEU 2.360 0.270 7 0 "[ . 1 . 2]"
1 24 MET 9.067 0.358 5 0 "[ . 1 . 2]"
1 25 GLY 0.215 0.173 2 0 "[ . 1 . 2]"
1 26 ARG 0.373 0.125 13 0 "[ . 1 . 2]"
1 27 ALA 0.024 0.024 18 0 "[ . 1 . 2]"
1 28 LEU 6.460 0.397 7 0 "[ . 1 . 2]"
1 29 TYR 2.771 0.220 11 0 "[ . 1 . 2]"
1 30 ASN 0.326 0.097 5 0 "[ . 1 . 2]"
1 31 ILE 2.502 0.303 9 0 "[ . 1 . 2]"
1 32 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 LEU 0.198 0.074 13 0 "[ . 1 . 2]"
1 34 GLU 0.056 0.056 15 0 "[ . 1 . 2]"
1 35 LYS 1.108 0.233 7 0 "[ . 1 . 2]"
1 36 ASN 0.077 0.038 9 0 "[ . 1 . 2]"
1 37 LYS 0.206 0.206 4 0 "[ . 1 . 2]"
1 38 MET 0.703 0.206 4 0 "[ . 1 . 2]"
1 39 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 LYS 0.567 0.177 8 0 "[ . 1 . 2]"
1 41 ALA 0.151 0.130 3 0 "[ . 1 . 2]"
1 42 ARG 2.715 0.353 10 0 "[ . 1 . 2]"
1 43 GLU 0.141 0.074 15 0 "[ . 1 . 2]"
1 44 ALA 0.212 0.085 1 0 "[ . 1 . 2]"
1 45 ALA 0.373 0.223 10 0 "[ . 1 . 2]"
1 46 GLU 0.134 0.091 6 0 "[ . 1 . 2]"
1 47 TYR 2.240 0.303 9 0 "[ . 1 . 2]"
1 48 PHE 2.888 0.220 11 0 "[ . 1 . 2]"
1 49 PHE 4.077 0.221 5 0 "[ . 1 . 2]"
1 50 ARG 0.088 0.055 20 0 "[ . 1 . 2]"
1 51 ALA 0.108 0.108 16 0 "[ . 1 . 2]"
1 52 ALA 0.479 0.181 9 0 "[ . 1 . 2]"
1 53 ILE 1.740 0.150 11 0 "[ . 1 . 2]"
1 54 VAL 1.615 0.286 4 0 "[ . 1 . 2]"
1 55 PHE 0.437 0.125 13 0 "[ . 1 . 2]"
1 56 TYR 8.368 0.288 14 0 "[ . 1 . 2]"
1 57 LYS 6.522 0.314 10 0 "[ . 1 . 2]"
1 58 GLU 2.417 0.314 10 0 "[ . 1 . 2]"
1 59 HIS 0.374 0.073 15 0 "[ . 1 . 2]"
1 60 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 THR 3.700 0.308 1 0 "[ . 1 . 2]"
1 62 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 LEU 3.236 0.283 15 0 "[ . 1 . 2]"
1 65 ARG 2.103 0.308 1 0 "[ . 1 . 2]"
1 66 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ALA 0.141 0.072 12 0 "[ . 1 . 2]"
1 68 ALA 0.188 0.092 5 0 "[ . 1 . 2]"
1 69 LYS 1.706 0.204 11 0 "[ . 1 . 2]"
1 70 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 LEU 4.343 0.213 9 0 "[ . 1 . 2]"
1 72 LYS 0.761 0.127 3 0 "[ . 1 . 2]"
1 73 GLU 0.004 0.004 9 0 "[ . 1 . 2]"
1 74 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 ILE 1.466 0.175 6 0 "[ . 1 . 2]"
1 76 THR 0.052 0.052 11 0 "[ . 1 . 2]"
1 77 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 ILE 4.442 0.374 18 0 "[ . 1 . 2]"
1 79 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 GLY 1.949 0.325 2 0 "[ . 1 . 2]"
1 84 ARG 0.335 0.145 19 0 "[ . 1 . 2]"
1 86 GLU 1.136 0.325 2 0 "[ . 1 . 2]"
1 87 ALA 0.494 0.189 3 0 "[ . 1 . 2]"
1 88 LYS 6.942 0.374 18 0 "[ . 1 . 2]"
1 89 GLU 0.168 0.055 17 0 "[ . 1 . 2]"
1 90 MET 2.979 0.214 9 0 "[ . 1 . 2]"
1 91 ALA 0.784 0.163 2 0 "[ . 1 . 2]"
1 92 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 LYS 7.248 0.221 5 0 "[ . 1 . 2]"
1 94 ALA 0.025 0.018 19 0 "[ . 1 . 2]"
1 95 GLU 0.059 0.032 20 0 "[ . 1 . 2]"
1 96 GLU 0.601 0.332 18 0 "[ . 1 . 2]"
1 97 TRP 4.850 0.212 10 0 "[ . 1 . 2]"
1 98 LEU 2.077 0.195 19 0 "[ . 1 . 2]"
1 99 GLN 0.358 0.332 18 0 "[ . 1 . 2]"
1 100 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 GLU 0.161 0.161 8 0 "[ . 1 . 2]"
1 102 GLN 0.465 0.156 2 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 2 ASP HA 1 5 ILE H 5.650 . 5.650 3.420 2.925 4.291 . 0 0 "[ . 1 . 2]" 1
2 1 2 ASP HA 1 5 ILE HB 4.430 . 4.430 3.092 2.071 4.547 0.117 3 0 "[ . 1 . 2]" 1
3 1 2 ASP HA 1 5 ILE MD 4.500 . 4.500 2.716 1.526 4.381 . 0 0 "[ . 1 . 2]" 1
4 1 2 ASP HA 1 38 MET ME 5.290 . 5.290 4.037 2.786 5.054 . 0 0 "[ . 1 . 2]" 1
5 1 2 ASP QB 1 5 ILE HB 4.800 . 4.800 2.829 1.652 4.815 0.015 3 0 "[ . 1 . 2]" 1
6 1 2 ASP QB 1 5 ILE MD 5.200 . 5.200 2.877 1.601 4.415 . 0 0 "[ . 1 . 2]" 1
7 1 2 ASP QB 1 5 ILE MG 6.100 . 6.100 3.500 2.426 5.244 . 0 0 "[ . 1 . 2]" 1
8 1 2 ASP HB2 1 5 ILE HB 5.490 . 5.490 3.418 2.128 5.379 . 0 0 "[ . 1 . 2]" 1
9 1 2 ASP HB3 1 5 ILE HB 5.490 . 5.490 3.676 1.656 5.432 . 0 0 "[ . 1 . 2]" 1
10 1 3 GLU HA 1 3 GLU QG 3.630 . 3.630 2.685 2.410 3.162 . 0 0 "[ . 1 . 2]" 1
11 1 3 GLU HA 1 6 ALA MB 4.130 . 4.130 2.965 2.014 3.861 . 0 0 "[ . 1 . 2]" 1
12 1 4 ASN HA 1 7 LYS HB2 5.410 . 5.410 3.466 2.611 4.404 . 0 0 "[ . 1 . 2]" 1
13 1 4 ASN HA 1 7 LYS QB 4.750 . 4.750 3.000 2.357 3.867 . 0 0 "[ . 1 . 2]" 1
14 1 4 ASN HA 1 7 LYS HB3 5.410 . 5.410 3.495 2.548 5.198 . 0 0 "[ . 1 . 2]" 1
15 1 4 ASN HA 1 7 LYS QD 5.510 . 5.510 3.888 2.149 5.444 . 0 0 "[ . 1 . 2]" 1
16 1 4 ASN QB 1 8 PHE QD 6.030 . 6.030 4.367 3.227 5.332 . 0 0 "[ . 1 . 2]" 1
17 1 4 ASN QB 1 8 PHE QE 5.220 . 5.220 3.301 2.222 4.611 . 0 0 "[ . 1 . 2]" 1
18 1 4 ASN HB2 1 8 PHE QE 5.920 . 5.920 4.169 2.915 5.487 . 0 0 "[ . 1 . 2]" 1
19 1 4 ASN HB3 1 8 PHE QE 5.920 . 5.920 3.553 2.258 5.048 . 0 0 "[ . 1 . 2]" 1
20 1 5 ILE H 1 5 ILE HB 4.360 . 4.360 2.477 2.305 2.638 . 0 0 "[ . 1 . 2]" 1
21 1 5 ILE H 1 5 ILE MD 5.110 . 5.110 3.521 2.061 3.803 . 0 0 "[ . 1 . 2]" 1
22 1 5 ILE H 1 5 ILE QG 4.050 . 4.050 2.213 1.939 3.357 . 0 0 "[ . 1 . 2]" 1
23 1 5 ILE HA 1 5 ILE MD 4.570 . 4.570 3.725 2.118 3.908 . 0 0 "[ . 1 . 2]" 1
24 1 5 ILE HA 1 8 PHE HB2 6.140 . 6.140 3.148 2.409 3.977 . 0 0 "[ . 1 . 2]" 1
25 1 5 ILE HA 1 8 PHE QB 5.330 . 5.330 3.103 2.393 3.877 . 0 0 "[ . 1 . 2]" 1
26 1 5 ILE HA 1 8 PHE HB3 6.140 . 6.140 4.753 4.075 5.492 . 0 0 "[ . 1 . 2]" 1
27 1 5 ILE HA 1 8 PHE QD 4.240 . 4.240 2.289 1.783 3.029 . 0 0 "[ . 1 . 2]" 1
28 1 5 ILE HA 1 31 ILE MG 5.820 . 5.820 3.573 2.952 4.504 . 0 0 "[ . 1 . 2]" 1
29 1 5 ILE HB 1 6 ALA H 4.870 . 4.870 2.587 2.302 2.850 . 0 0 "[ . 1 . 2]" 1
30 1 5 ILE MD 1 8 PHE QD 5.690 . 5.690 4.972 3.541 5.744 0.054 18 0 "[ . 1 . 2]" 1
31 1 5 ILE MD 1 31 ILE HA 5.250 . 5.250 4.147 3.047 5.232 . 0 0 "[ . 1 . 2]" 1
32 1 5 ILE MD 1 31 ILE MG 4.120 . 4.120 3.152 1.951 4.303 0.183 15 0 "[ . 1 . 2]" 1
33 1 5 ILE MD 1 34 GLU H 6.020 . 6.020 4.667 4.082 5.284 . 0 0 "[ . 1 . 2]" 1
34 1 5 ILE MD 1 34 GLU QB 4.080 . 4.080 2.209 1.820 2.794 . 0 0 "[ . 1 . 2]" 1
35 1 5 ILE MD 1 34 GLU QG 4.760 . 4.760 3.569 2.460 4.319 . 0 0 "[ . 1 . 2]" 1
36 1 5 ILE MD 1 35 LYS H 5.430 . 5.430 3.664 3.010 4.421 . 0 0 "[ . 1 . 2]" 1
37 1 5 ILE MD 1 35 LYS HA 5.000 . 5.000 3.487 2.620 4.534 . 0 0 "[ . 1 . 2]" 1
38 1 5 ILE MD 1 35 LYS QE 4.820 . 4.820 2.755 1.791 4.380 . 0 0 "[ . 1 . 2]" 1
39 1 5 ILE MD 1 35 LYS QG 4.340 . 4.340 3.107 1.931 4.523 0.183 8 0 "[ . 1 . 2]" 1
40 1 5 ILE MD 1 38 MET ME 3.900 . 3.900 2.255 1.854 3.031 . 0 0 "[ . 1 . 2]" 1
41 1 5 ILE MD 1 38 MET QG 6.030 . 6.030 3.845 2.479 4.697 . 0 0 "[ . 1 . 2]" 1
42 1 5 ILE QG 1 31 ILE MG 4.640 . 4.640 3.138 1.801 4.735 0.095 5 0 "[ . 1 . 2]" 1
43 1 5 ILE QG 1 34 GLU QG 5.890 . 5.890 2.762 1.963 5.146 . 0 0 "[ . 1 . 2]" 1
44 1 5 ILE QG 1 38 MET ME 5.090 . 5.090 3.771 2.489 4.791 . 0 0 "[ . 1 . 2]" 1
45 1 5 ILE MG 1 6 ALA H 5.170 . 5.170 3.342 3.014 3.643 . 0 0 "[ . 1 . 2]" 1
46 1 5 ILE MG 1 6 ALA HA 4.400 . 4.400 3.425 3.158 3.702 . 0 0 "[ . 1 . 2]" 1
47 1 5 ILE MG 1 8 PHE QD 4.770 . 4.770 3.868 2.820 4.878 0.108 8 0 "[ . 1 . 2]" 1
48 1 5 ILE MG 1 9 GLU QG 4.000 . 4.000 2.663 2.131 3.817 . 0 0 "[ . 1 . 2]" 1
49 1 5 ILE MG 1 31 ILE MG 3.850 . 3.850 1.841 1.577 2.265 . 0 0 "[ . 1 . 2]" 1
50 1 5 ILE MG 1 34 GLU QG 5.740 . 5.740 4.290 2.714 5.192 . 0 0 "[ . 1 . 2]" 1
51 1 5 ILE MG 1 35 LYS HE2 5.490 . 5.490 2.834 1.734 4.852 . 0 0 "[ . 1 . 2]" 1
52 1 5 ILE MG 1 35 LYS QE 4.650 . 4.650 2.557 1.728 4.019 . 0 0 "[ . 1 . 2]" 1
53 1 5 ILE MG 1 35 LYS HE3 5.490 . 5.490 3.511 1.913 4.356 . 0 0 "[ . 1 . 2]" 1
54 1 5 ILE MG 1 47 TYR QE 6.170 . 6.170 4.388 3.877 5.419 . 0 0 "[ . 1 . 2]" 1
55 1 6 ALA HA 1 9 GLU QG 4.060 . 4.060 2.982 2.121 4.009 . 0 0 "[ . 1 . 2]" 1
56 1 7 LYS QB 1 8 PHE H 4.700 . 4.700 2.549 2.354 2.709 . 0 0 "[ . 1 . 2]" 1
57 1 7 LYS QB 1 8 PHE QD 5.010 . 5.010 3.898 3.129 4.264 . 0 0 "[ . 1 . 2]" 1
58 1 7 LYS QB 1 8 PHE HZ 5.440 . 5.440 5.169 4.717 5.447 0.007 1 0 "[ . 1 . 2]" 1
59 1 7 LYS HB2 1 8 PHE H 5.420 . 5.420 3.628 2.598 3.982 . 0 0 "[ . 1 . 2]" 1
60 1 7 LYS HB3 1 8 PHE H 5.420 . 5.420 2.793 2.379 3.849 . 0 0 "[ . 1 . 2]" 1
61 1 8 PHE HA 1 8 PHE QD 3.690 . 3.690 2.301 2.069 2.903 . 0 0 "[ . 1 . 2]" 1
62 1 8 PHE HA 1 11 ALA MB 4.830 . 4.830 2.381 1.789 3.301 . 0 0 "[ . 1 . 2]" 1
63 1 8 PHE QB 1 27 ALA MB 5.460 . 5.460 3.077 1.978 4.539 . 0 0 "[ . 1 . 2]" 1
64 1 8 PHE QB 1 31 ILE MD 3.950 . 3.950 2.550 2.053 3.336 . 0 0 "[ . 1 . 2]" 1
65 1 8 PHE QB 1 31 ILE QG 3.910 . 3.910 2.006 1.853 2.183 . 0 0 "[ . 1 . 2]" 1
66 1 8 PHE QB 1 31 ILE MG 5.910 . 5.910 3.768 2.648 4.300 . 0 0 "[ . 1 . 2]" 1
67 1 8 PHE HB2 1 31 ILE MD 4.500 . 4.500 2.850 2.092 3.774 . 0 0 "[ . 1 . 2]" 1
68 1 8 PHE HB2 1 31 ILE HG12 5.100 . 5.100 2.257 1.941 2.605 . 0 0 "[ . 1 . 2]" 1
69 1 8 PHE HB2 1 31 ILE HG13 5.100 . 5.100 2.971 2.233 3.888 . 0 0 "[ . 1 . 2]" 1
70 1 8 PHE HB3 1 31 ILE MD 4.500 . 4.500 2.960 2.409 3.745 . 0 0 "[ . 1 . 2]" 1
71 1 8 PHE HB3 1 31 ILE HG12 5.100 . 5.100 3.043 2.189 4.024 . 0 0 "[ . 1 . 2]" 1
72 1 8 PHE HB3 1 31 ILE HG13 5.100 . 5.100 2.811 2.374 3.513 . 0 0 "[ . 1 . 2]" 1
73 1 8 PHE QD 1 11 ALA MB 5.210 . 5.210 3.472 2.205 4.186 . 0 0 "[ . 1 . 2]" 1
74 1 8 PHE QD 1 31 ILE HA 5.630 . 5.630 3.215 2.604 4.372 . 0 0 "[ . 1 . 2]" 1
75 1 8 PHE QD 1 31 ILE QG 4.750 . 4.750 2.872 2.181 3.823 . 0 0 "[ . 1 . 2]" 1
76 1 8 PHE QD 1 34 GLU QB 5.610 . 5.610 4.393 3.408 5.376 . 0 0 "[ . 1 . 2]" 1
77 1 8 PHE QD 1 34 GLU QG 4.760 . 4.760 3.237 2.044 4.048 . 0 0 "[ . 1 . 2]" 1
78 1 8 PHE QE 1 31 ILE HA 6.210 . 6.210 4.524 3.527 5.594 . 0 0 "[ . 1 . 2]" 1
79 1 8 PHE QE 1 34 GLU HG2 5.130 . 5.130 3.512 2.477 5.186 0.056 15 0 "[ . 1 . 2]" 1
80 1 8 PHE QE 1 34 GLU QG 4.270 . 4.270 2.708 2.051 3.839 . 0 0 "[ . 1 . 2]" 1
81 1 8 PHE QE 1 34 GLU HG3 5.130 . 5.130 2.858 2.168 4.190 . 0 0 "[ . 1 . 2]" 1
82 1 9 GLU HA 1 9 GLU HG2 4.270 . 4.270 2.689 2.524 3.205 . 0 0 "[ . 1 . 2]" 1
83 1 9 GLU HA 1 9 GLU HG3 4.270 . 4.270 3.322 3.047 3.852 . 0 0 "[ . 1 . 2]" 1
84 1 9 GLU HA 1 31 ILE MD 4.550 . 4.550 2.697 1.920 3.452 . 0 0 "[ . 1 . 2]" 1
85 1 9 GLU QG 1 31 ILE MD 3.910 . 3.910 2.414 1.797 3.592 . 0 0 "[ . 1 . 2]" 1
86 1 9 GLU HG2 1 31 ILE MD 4.670 . 4.670 2.531 1.858 3.725 . 0 0 "[ . 1 . 2]" 1
87 1 9 GLU HG3 1 31 ILE MD 4.670 . 4.670 3.192 2.359 4.716 0.046 2 0 "[ . 1 . 2]" 1
88 1 12 TYR HA 1 27 ALA MB 4.510 . 4.510 3.479 2.824 4.393 . 0 0 "[ . 1 . 2]" 1
89 1 12 TYR HB2 1 13 LYS H 5.720 . 5.720 4.397 3.677 4.683 . 0 0 "[ . 1 . 2]" 1
90 1 12 TYR HB2 1 27 ALA MB 4.610 . 4.610 2.538 2.020 3.045 . 0 0 "[ . 1 . 2]" 1
91 1 12 TYR HB2 1 28 LEU H 6.300 . 6.300 4.694 4.306 5.301 . 0 0 "[ . 1 . 2]" 1
92 1 12 TYR HB3 1 13 LYS H 5.410 . 5.410 4.029 2.332 4.419 . 0 0 "[ . 1 . 2]" 1
93 1 12 TYR HB3 1 27 ALA MB 5.480 . 5.480 3.886 2.998 4.426 . 0 0 "[ . 1 . 2]" 1
94 1 12 TYR HB3 1 31 ILE MD 5.520 . 5.520 4.046 2.515 4.904 . 0 0 "[ . 1 . 2]" 1
95 1 12 TYR QD 1 13 LYS H 4.280 . 4.280 3.088 1.502 4.133 . 0 0 "[ . 1 . 2]" 1
96 1 12 TYR QD 1 15 ALA MB 5.740 . 5.740 4.199 2.561 5.763 0.023 7 0 "[ . 1 . 2]" 1
97 1 12 TYR QD 1 24 MET QB 5.780 . 5.780 3.316 2.635 4.083 . 0 0 "[ . 1 . 2]" 1
98 1 12 TYR QD 1 24 MET ME 5.190 . 5.190 4.842 4.014 5.271 0.081 4 0 "[ . 1 . 2]" 1
99 1 12 TYR QD 1 24 MET QG 5.210 . 5.210 3.567 2.398 5.254 0.044 4 0 "[ . 1 . 2]" 1
100 1 12 TYR QD 1 27 ALA MB 3.480 . 3.480 1.841 1.511 2.594 . 0 0 "[ . 1 . 2]" 1
101 1 12 TYR QD 1 28 LEU H 4.750 . 4.750 2.738 2.319 4.211 . 0 0 "[ . 1 . 2]" 1
102 1 12 TYR QD 1 28 LEU HA 3.860 . 3.860 3.908 3.448 4.075 0.215 9 0 "[ . 1 . 2]" 1
103 1 12 TYR QD 1 28 LEU QB 3.850 . 3.850 3.900 3.438 4.114 0.264 10 0 "[ . 1 . 2]" 1
104 1 12 TYR QD 1 28 LEU MD1 4.400 . 4.400 3.856 3.492 4.302 . 0 0 "[ . 1 . 2]" 1
105 1 12 TYR QD 1 28 LEU HG 3.430 . 3.430 2.634 2.218 3.566 0.136 18 0 "[ . 1 . 2]" 1
106 1 12 TYR QD 1 31 ILE MD 5.040 . 5.040 3.769 2.842 4.427 . 0 0 "[ . 1 . 2]" 1
107 1 12 TYR QE 1 24 MET HB2 3.970 . 3.970 3.664 1.993 4.134 0.164 19 0 "[ . 1 . 2]" 1
108 1 12 TYR QE 1 24 MET QB 3.140 . 3.140 2.667 1.498 3.195 0.055 6 0 "[ . 1 . 2]" 1
109 1 12 TYR QE 1 24 MET HB3 3.970 . 3.970 2.874 1.501 4.011 0.041 12 0 "[ . 1 . 2]" 1
110 1 12 TYR QE 1 24 MET ME 4.220 . 4.220 4.321 3.577 4.578 0.358 5 0 "[ . 1 . 2]" 1
111 1 12 TYR QE 1 25 GLY HA2 4.810 . 4.810 2.688 2.202 4.251 . 0 0 "[ . 1 . 2]" 1
112 1 12 TYR QE 1 27 ALA MB 3.960 . 3.960 3.396 2.950 3.984 0.024 18 0 "[ . 1 . 2]" 1
113 1 12 TYR QE 1 28 LEU HA 4.440 . 4.440 4.544 4.080 4.837 0.397 7 0 "[ . 1 . 2]" 1
114 1 12 TYR QE 1 28 LEU QB 4.190 . 4.190 2.970 2.623 3.353 . 0 0 "[ . 1 . 2]" 1
115 1 12 TYR QE 1 28 LEU MD1 3.170 . 3.170 2.687 2.270 3.204 0.034 17 0 "[ . 1 . 2]" 1
116 1 12 TYR QE 1 28 LEU MD2 6.220 . 6.220 3.794 3.004 4.259 . 0 0 "[ . 1 . 2]" 1
117 1 12 TYR QE 1 28 LEU HG 3.390 . 3.390 2.293 1.487 2.880 . 0 0 "[ . 1 . 2]" 1
118 1 12 TYR QE 1 54 VAL MG2 4.120 . 4.120 3.494 3.005 4.167 0.047 16 0 "[ . 1 . 2]" 1
119 1 13 LYS H 1 13 LYS QB 3.920 . 3.920 2.654 2.308 3.442 . 0 0 "[ . 1 . 2]" 1
120 1 13 LYS H 1 13 LYS QE 6.300 . 6.300 4.819 3.968 6.203 . 0 0 "[ . 1 . 2]" 1
121 1 13 LYS H 1 15 ALA MB 5.380 . 5.380 4.790 3.402 5.683 0.303 11 0 "[ . 1 . 2]" 1
122 1 13 LYS H 1 24 MET ME 6.180 . 6.180 4.323 3.365 6.314 0.134 12 0 "[ . 1 . 2]" 1
123 1 13 LYS QB 1 14 LYS H 4.710 . 4.710 2.818 1.794 4.005 . 0 0 "[ . 1 . 2]" 1
124 1 14 LYS H 1 14 LYS QE 6.300 . 6.300 5.031 2.278 6.428 0.128 3 0 "[ . 1 . 2]" 1
125 1 14 LYS H 1 14 LYS QG 5.130 . 5.130 3.513 1.897 4.495 . 0 0 "[ . 1 . 2]" 1
126 1 14 LYS HA 1 14 LYS QE 4.860 . 4.860 4.275 2.126 4.888 0.028 9 0 "[ . 1 . 2]" 1
127 1 15 ALA MB 1 16 GLU H 4.560 . 4.560 3.130 2.185 3.737 . 0 0 "[ . 1 . 2]" 1
128 1 15 ALA MB 1 17 GLU H 5.880 . 5.880 4.773 3.322 6.136 0.256 6 0 "[ . 1 . 2]" 1
129 1 15 ALA MB 1 24 MET H 4.670 . 4.670 4.129 3.603 4.937 0.267 11 0 "[ . 1 . 2]" 1
130 1 15 ALA MB 1 24 MET ME 4.750 . 4.750 2.339 1.633 3.745 . 0 0 "[ . 1 . 2]" 1
131 1 15 ALA MB 1 24 MET QG 3.570 . 3.570 3.224 2.108 3.740 0.170 12 0 "[ . 1 . 2]" 1
132 1 16 GLU H 1 17 GLU H 4.580 . 4.580 2.559 1.648 4.357 . 0 0 "[ . 1 . 2]" 1
133 1 16 GLU H 1 17 GLU HA 5.080 . 5.080 4.818 4.059 5.178 0.098 1 0 "[ . 1 . 2]" 1
134 1 16 GLU H 1 17 GLU QG 6.100 . 6.100 4.900 2.506 6.197 0.097 10 0 "[ . 1 . 2]" 1
135 1 17 GLU H 1 17 GLU HG2 5.130 . 5.130 3.577 2.048 4.939 . 0 0 "[ . 1 . 2]" 1
136 1 17 GLU H 1 17 GLU HG3 5.130 . 5.130 3.591 1.982 4.856 . 0 0 "[ . 1 . 2]" 1
137 1 17 GLU H 1 18 LEU H 5.670 . 5.670 3.102 1.720 4.444 . 0 0 "[ . 1 . 2]" 1
138 1 18 LEU HA 1 18 LEU MD1 4.490 . 4.490 3.671 2.144 3.980 . 0 0 "[ . 1 . 2]" 1
139 1 18 LEU HA 1 18 LEU MD2 3.290 . 3.290 2.604 2.046 3.679 0.389 7 0 "[ . 1 . 2]" 1
140 1 18 LEU HA 1 20 GLN QG 5.330 . 5.330 4.548 3.925 5.261 . 0 0 "[ . 1 . 2]" 1
141 1 18 LEU QB 1 20 GLN H 5.260 . 5.260 3.688 2.098 4.598 . 0 0 "[ . 1 . 2]" 1
142 1 18 LEU QB 1 20 GLN HG2 4.680 . 4.680 3.307 1.894 4.835 0.155 10 0 "[ . 1 . 2]" 1
143 1 18 LEU QB 1 20 GLN QG 4.080 . 4.080 2.544 1.832 3.550 . 0 0 "[ . 1 . 2]" 1
144 1 18 LEU QB 1 20 GLN HG3 4.680 . 4.680 3.074 1.840 4.183 . 0 0 "[ . 1 . 2]" 1
145 1 18 LEU MD1 1 20 GLN H 6.300 . 6.300 5.376 2.904 6.364 0.064 3 0 "[ . 1 . 2]" 1
146 1 18 LEU MD1 1 20 GLN HE21 5.810 . 5.810 3.309 2.169 5.081 . 0 0 "[ . 1 . 2]" 1
147 1 18 LEU MD1 1 20 GLN HE22 5.400 . 5.400 3.454 2.129 5.286 . 0 0 "[ . 1 . 2]" 1
148 1 18 LEU MD1 1 20 GLN QG 5.170 . 5.170 3.692 1.639 4.871 . 0 0 "[ . 1 . 2]" 1
149 1 18 LEU MD2 1 20 GLN QB 5.230 . 5.230 4.463 2.452 5.563 0.333 19 0 "[ . 1 . 2]" 1
150 1 18 LEU MD2 1 20 GLN HE21 6.300 . 6.300 3.710 2.080 5.529 . 0 0 "[ . 1 . 2]" 1
151 1 18 LEU MD2 1 20 GLN QG 6.100 . 6.100 3.391 1.897 5.341 . 0 0 "[ . 1 . 2]" 1
152 1 20 GLN H 1 20 GLN QG 5.060 . 5.060 2.750 1.893 3.229 . 0 0 "[ . 1 . 2]" 1
153 1 20 GLN H 1 23 LEU MD1 6.300 . 6.300 5.375 2.687 6.436 0.136 4 0 "[ . 1 . 2]" 1
154 1 20 GLN HA 1 23 LEU MD1 5.430 . 5.430 4.229 2.657 5.115 . 0 0 "[ . 1 . 2]" 1
155 1 20 GLN HA 1 24 MET ME 4.920 . 4.920 4.447 4.056 5.086 0.166 17 0 "[ . 1 . 2]" 1
156 1 20 GLN QB 1 21 GLY H 5.590 . 5.590 3.334 1.782 4.071 . 0 0 "[ . 1 . 2]" 1
157 1 20 GLN QB 1 21 GLY QA 5.930 . 5.930 4.112 3.288 4.688 . 0 0 "[ . 1 . 2]" 1
158 1 20 GLN QB 1 23 LEU MD1 4.060 . 4.060 2.630 1.827 3.956 . 0 0 "[ . 1 . 2]" 1
159 1 20 GLN HE21 1 23 LEU MD1 5.910 . 5.910 4.407 2.263 5.954 0.044 9 0 "[ . 1 . 2]" 1
160 1 20 GLN HE22 1 23 LEU MD1 6.300 . 6.300 4.256 2.753 6.143 . 0 0 "[ . 1 . 2]" 1
161 1 20 GLN QG 1 21 GLY H 6.100 . 6.100 4.191 2.805 4.917 . 0 0 "[ . 1 . 2]" 1
162 1 20 GLN HG2 1 23 LEU MD1 5.280 . 5.280 4.215 2.361 5.333 0.053 13 0 "[ . 1 . 2]" 1
163 1 20 GLN HG3 1 23 LEU MD1 5.280 . 5.280 4.159 3.228 5.152 . 0 0 "[ . 1 . 2]" 1
164 1 21 GLY QA 1 24 MET H 5.600 . 5.600 3.483 2.789 4.093 . 0 0 "[ . 1 . 2]" 1
165 1 21 GLY QA 1 24 MET QB 5.250 . 5.250 3.516 2.550 4.531 . 0 0 "[ . 1 . 2]" 1
166 1 21 GLY QA 1 24 MET ME 4.110 . 4.110 2.953 2.077 3.569 . 0 0 "[ . 1 . 2]" 1
167 1 21 GLY QA 1 54 VAL MG1 4.480 . 4.480 2.496 2.064 3.526 . 0 0 "[ . 1 . 2]" 1
168 1 21 GLY QA 1 58 GLU QG 4.710 . 4.710 3.220 1.890 4.760 0.050 3 0 "[ . 1 . 2]" 1
169 1 21 GLY HA2 1 24 MET ME 4.800 . 4.800 3.005 2.090 3.668 . 0 0 "[ . 1 . 2]" 1
170 1 21 GLY HA3 1 24 MET ME 4.800 . 4.800 4.414 3.606 4.896 0.096 4 0 "[ . 1 . 2]" 1
171 1 23 LEU HA 1 23 LEU MD1 4.450 . 4.450 3.945 3.896 4.035 . 0 0 "[ . 1 . 2]" 1
172 1 23 LEU HA 1 23 LEU MD2 3.310 . 3.310 2.154 2.048 2.372 . 0 0 "[ . 1 . 2]" 1
173 1 23 LEU HA 1 24 MET ME 4.690 . 4.690 4.737 4.341 4.960 0.270 7 0 "[ . 1 . 2]" 1
174 1 23 LEU QB 1 24 MET H 4.350 . 4.350 2.900 2.272 3.464 . 0 0 "[ . 1 . 2]" 1
175 1 23 LEU HB2 1 24 MET H 5.080 . 5.080 2.989 2.303 3.629 . 0 0 "[ . 1 . 2]" 1
176 1 23 LEU HB3 1 24 MET H 5.080 . 5.080 3.965 3.473 4.382 . 0 0 "[ . 1 . 2]" 1
177 1 23 LEU MD1 1 24 MET H 5.650 . 5.650 4.834 4.234 5.379 . 0 0 "[ . 1 . 2]" 1
178 1 23 LEU MD1 1 24 MET ME 4.010 . 4.010 3.135 2.222 3.758 . 0 0 "[ . 1 . 2]" 1
179 1 23 LEU MD2 1 24 MET H 5.800 . 5.800 4.660 4.523 4.802 . 0 0 "[ . 1 . 2]" 1
180 1 23 LEU HG 1 24 MET H 5.180 . 5.180 4.409 3.923 4.829 . 0 0 "[ . 1 . 2]" 1
181 1 23 LEU HG 1 24 MET ME 4.230 . 4.230 4.073 3.433 4.375 0.145 19 0 "[ . 1 . 2]" 1
182 1 24 MET H 1 24 MET HB2 4.180 . 4.180 2.755 2.303 3.904 . 0 0 "[ . 1 . 2]" 1
183 1 24 MET H 1 24 MET HB3 4.180 . 4.180 3.634 3.050 3.787 . 0 0 "[ . 1 . 2]" 1
184 1 24 MET H 1 24 MET ME 5.670 . 5.670 2.991 2.038 3.638 . 0 0 "[ . 1 . 2]" 1
185 1 24 MET H 1 24 MET QG 4.400 . 4.400 3.257 2.298 3.863 . 0 0 "[ . 1 . 2]" 1
186 1 24 MET H 1 25 GLY H 4.640 . 4.640 4.156 2.102 4.534 . 0 0 "[ . 1 . 2]" 1
187 1 24 MET H 1 54 VAL MG1 5.780 . 5.780 3.846 3.257 4.263 . 0 0 "[ . 1 . 2]" 1
188 1 24 MET HA 1 24 MET ME 4.990 . 4.990 4.109 3.743 4.298 . 0 0 "[ . 1 . 2]" 1
189 1 24 MET QB 1 24 MET ME 3.730 . 3.730 1.993 1.851 2.124 . 0 0 "[ . 1 . 2]" 1
190 1 24 MET QB 1 54 VAL MG1 4.920 . 4.920 3.356 2.871 3.796 . 0 0 "[ . 1 . 2]" 1
191 1 24 MET HB2 1 25 GLY H 6.240 . 6.240 2.949 1.986 3.541 . 0 0 "[ . 1 . 2]" 1
192 1 24 MET HB3 1 25 GLY H 6.240 . 6.240 2.285 1.732 3.914 . 0 0 "[ . 1 . 2]" 1
193 1 24 MET ME 1 25 GLY H 5.600 . 5.600 4.697 3.820 5.037 . 0 0 "[ . 1 . 2]" 1
194 1 24 MET ME 1 54 VAL MG1 4.190 . 4.190 4.191 3.709 4.387 0.197 11 0 "[ . 1 . 2]" 1
195 1 25 GLY H 1 26 ARG H 4.850 . 4.850 3.448 2.964 3.972 . 0 0 "[ . 1 . 2]" 1
196 1 25 GLY H 1 27 ALA H 6.090 . 6.090 3.503 3.046 4.330 . 0 0 "[ . 1 . 2]" 1
197 1 25 GLY H 1 28 LEU MD1 6.080 . 6.080 4.394 3.369 6.122 0.042 14 0 "[ . 1 . 2]" 1
198 1 25 GLY H 1 54 VAL MG1 4.340 . 4.340 3.363 2.806 3.894 . 0 0 "[ . 1 . 2]" 1
199 1 25 GLY HA2 1 27 ALA H 5.680 . 5.680 4.345 4.101 4.689 . 0 0 "[ . 1 . 2]" 1
200 1 25 GLY HA2 1 28 LEU H 6.240 . 6.240 3.701 3.090 4.381 . 0 0 "[ . 1 . 2]" 1
201 1 25 GLY HA2 1 28 LEU QB 5.200 . 5.200 3.257 2.380 4.269 . 0 0 "[ . 1 . 2]" 1
202 1 25 GLY HA2 1 28 LEU MD1 4.450 . 4.450 3.470 2.310 4.623 0.173 2 0 "[ . 1 . 2]" 1
203 1 25 GLY HA2 1 51 ALA HA 4.410 . 4.410 2.750 2.176 3.569 . 0 0 "[ . 1 . 2]" 1
204 1 25 GLY HA2 1 51 ALA MB 5.590 . 5.590 3.608 3.057 4.117 . 0 0 "[ . 1 . 2]" 1
205 1 25 GLY HA2 1 54 VAL HB 5.040 . 5.040 2.985 2.667 3.654 . 0 0 "[ . 1 . 2]" 1
206 1 25 GLY HA2 1 54 VAL MG1 4.380 . 4.380 3.049 2.294 3.739 . 0 0 "[ . 1 . 2]" 1
207 1 25 GLY HA2 1 54 VAL MG2 5.010 . 5.010 2.634 2.102 3.109 . 0 0 "[ . 1 . 2]" 1
208 1 25 GLY HA2 1 55 PHE QD 6.240 . 6.240 5.437 5.052 6.050 . 0 0 "[ . 1 . 2]" 1
209 1 25 GLY HA2 1 55 PHE QE 5.330 . 5.330 4.809 4.108 5.291 . 0 0 "[ . 1 . 2]" 1
210 1 25 GLY HA2 1 55 PHE HZ 5.950 . 5.950 5.216 4.680 5.831 . 0 0 "[ . 1 . 2]" 1
211 1 25 GLY HA3 1 29 TYR H 5.970 . 5.970 5.323 4.964 5.960 . 0 0 "[ . 1 . 2]" 1
212 1 25 GLY HA3 1 51 ALA HA 5.280 . 5.280 3.604 3.008 4.765 . 0 0 "[ . 1 . 2]" 1
213 1 25 GLY HA3 1 51 ALA MB 5.620 . 5.620 4.029 3.660 4.548 . 0 0 "[ . 1 . 2]" 1
214 1 25 GLY HA3 1 54 VAL H 6.300 . 6.300 5.006 4.447 5.946 . 0 0 "[ . 1 . 2]" 1
215 1 25 GLY HA3 1 54 VAL HB 4.970 . 4.970 2.598 2.198 3.399 . 0 0 "[ . 1 . 2]" 1
216 1 25 GLY HA3 1 54 VAL MG1 4.180 . 4.180 2.463 1.999 2.665 . 0 0 "[ . 1 . 2]" 1
217 1 25 GLY HA3 1 54 VAL MG2 5.700 . 5.700 3.252 2.654 4.171 . 0 0 "[ . 1 . 2]" 1
218 1 25 GLY HA3 1 55 PHE QD 6.120 . 6.120 4.390 3.767 5.006 . 0 0 "[ . 1 . 2]" 1
219 1 25 GLY HA3 1 55 PHE QE 4.730 . 4.730 3.837 2.811 4.512 . 0 0 "[ . 1 . 2]" 1
220 1 25 GLY HA3 1 55 PHE HZ 4.900 . 4.900 4.309 3.631 4.837 . 0 0 "[ . 1 . 2]" 1
221 1 26 ARG H 1 26 ARG QD 5.840 . 5.840 4.280 3.602 4.818 . 0 0 "[ . 1 . 2]" 1
222 1 26 ARG H 1 26 ARG QG 5.040 . 5.040 3.342 1.927 4.090 . 0 0 "[ . 1 . 2]" 1
223 1 26 ARG H 1 27 ALA H 4.490 . 4.490 2.728 2.559 2.832 . 0 0 "[ . 1 . 2]" 1
224 1 26 ARG H 1 55 PHE QE 5.240 . 5.240 3.363 2.452 4.035 . 0 0 "[ . 1 . 2]" 1
225 1 26 ARG H 1 55 PHE HZ 4.860 . 4.860 3.387 2.289 3.936 . 0 0 "[ . 1 . 2]" 1
226 1 26 ARG HA 1 26 ARG HD2 5.190 . 5.190 4.570 3.404 4.991 . 0 0 "[ . 1 . 2]" 1
227 1 26 ARG HA 1 26 ARG QD 4.550 . 4.550 3.950 2.180 4.338 . 0 0 "[ . 1 . 2]" 1
228 1 26 ARG HA 1 26 ARG HD3 5.190 . 5.190 4.423 2.206 4.913 . 0 0 "[ . 1 . 2]" 1
229 1 26 ARG HA 1 26 ARG HG2 4.270 . 4.270 3.016 2.531 3.808 . 0 0 "[ . 1 . 2]" 1
230 1 26 ARG HA 1 26 ARG QG 3.680 . 3.680 2.575 2.403 3.402 . 0 0 "[ . 1 . 2]" 1
231 1 26 ARG HA 1 26 ARG HG3 4.270 . 4.270 2.949 2.518 3.828 . 0 0 "[ . 1 . 2]" 1
232 1 26 ARG HA 1 28 LEU H 5.850 . 5.850 4.494 4.306 4.756 . 0 0 "[ . 1 . 2]" 1
233 1 26 ARG HA 1 29 TYR H 4.570 . 4.570 3.389 3.113 3.723 . 0 0 "[ . 1 . 2]" 1
234 1 26 ARG HA 1 29 TYR HB2 4.410 . 4.410 3.135 2.766 3.622 . 0 0 "[ . 1 . 2]" 1
235 1 26 ARG HA 1 29 TYR HB3 4.230 . 4.230 2.506 1.996 3.085 . 0 0 "[ . 1 . 2]" 1
236 1 26 ARG HA 1 55 PHE QE 4.580 . 4.580 3.191 2.930 3.468 . 0 0 "[ . 1 . 2]" 1
237 1 26 ARG HA 1 55 PHE HZ 3.680 . 3.680 2.018 1.716 2.605 . 0 0 "[ . 1 . 2]" 1
238 1 26 ARG QB 1 27 ALA H 4.590 . 4.590 2.781 2.504 3.603 . 0 0 "[ . 1 . 2]" 1
239 1 26 ARG QB 1 30 ASN QD 5.800 . 5.800 4.246 2.765 5.874 0.074 1 0 "[ . 1 . 2]" 1
240 1 26 ARG QB 1 55 PHE HZ 4.870 . 4.870 2.966 1.929 3.882 . 0 0 "[ . 1 . 2]" 1
241 1 26 ARG QD 1 30 ASN QD 6.100 . 6.100 4.518 3.447 5.622 . 0 0 "[ . 1 . 2]" 1
242 1 26 ARG HD2 1 55 PHE HZ 6.300 . 6.300 4.918 3.662 6.138 . 0 0 "[ . 1 . 2]" 1
243 1 26 ARG HD3 1 55 PHE HZ 6.300 . 6.300 4.941 2.165 5.975 . 0 0 "[ . 1 . 2]" 1
244 1 26 ARG QG 1 30 ASN QD 5.470 . 5.470 3.732 2.168 5.133 . 0 0 "[ . 1 . 2]" 1
245 1 26 ARG QG 1 55 PHE QE 4.430 . 4.430 3.402 1.982 4.555 0.125 13 0 "[ . 1 . 2]" 1
246 1 26 ARG QG 1 55 PHE HZ 4.360 . 4.360 2.971 1.973 3.885 . 0 0 "[ . 1 . 2]" 1
247 1 26 ARG HG2 1 30 ASN QD 6.220 . 6.220 4.106 2.187 5.595 . 0 0 "[ . 1 . 2]" 1
248 1 26 ARG HG2 1 55 PHE HZ 5.020 . 5.020 3.734 1.984 5.031 0.011 18 0 "[ . 1 . 2]" 1
249 1 26 ARG HG3 1 30 ASN QD 6.220 . 6.220 4.569 2.438 6.130 . 0 0 "[ . 1 . 2]" 1
250 1 26 ARG HG3 1 55 PHE HZ 5.020 . 5.020 3.468 2.364 4.639 . 0 0 "[ . 1 . 2]" 1
251 1 27 ALA H 1 28 LEU H 3.890 . 3.890 2.801 2.563 2.906 . 0 0 "[ . 1 . 2]" 1
252 1 27 ALA H 1 29 TYR H 5.740 . 5.740 4.100 3.881 4.357 . 0 0 "[ . 1 . 2]" 1
253 1 27 ALA HA 1 30 ASN QB 6.300 . 6.300 2.935 2.453 3.408 . 0 0 "[ . 1 . 2]" 1
254 1 27 ALA MB 1 28 LEU H 4.000 . 4.000 2.542 2.381 2.774 . 0 0 "[ . 1 . 2]" 1
255 1 27 ALA MB 1 28 LEU HA 4.960 . 4.960 3.946 3.793 4.061 . 0 0 "[ . 1 . 2]" 1
256 1 27 ALA MB 1 31 ILE MD 4.960 . 4.960 3.411 2.368 3.695 . 0 0 "[ . 1 . 2]" 1
257 1 28 LEU H 1 28 LEU HB2 4.160 . 4.160 2.362 2.106 2.464 . 0 0 "[ . 1 . 2]" 1
258 1 28 LEU H 1 28 LEU QB 3.560 . 3.560 2.329 2.071 2.428 . 0 0 "[ . 1 . 2]" 1
259 1 28 LEU H 1 28 LEU HB3 4.160 . 4.160 3.562 2.880 3.677 . 0 0 "[ . 1 . 2]" 1
260 1 28 LEU H 1 28 LEU MD1 4.340 . 4.340 3.904 3.756 4.218 . 0 0 "[ . 1 . 2]" 1
261 1 28 LEU H 1 28 LEU MD2 5.410 . 5.410 3.713 3.457 4.311 . 0 0 "[ . 1 . 2]" 1
262 1 28 LEU H 1 28 LEU HG 4.220 . 4.220 2.900 2.589 4.144 . 0 0 "[ . 1 . 2]" 1
263 1 28 LEU H 1 29 TYR H 4.140 . 4.140 2.661 2.551 2.755 . 0 0 "[ . 1 . 2]" 1
264 1 28 LEU H 1 29 TYR HA 6.300 . 6.300 5.293 5.204 5.380 . 0 0 "[ . 1 . 2]" 1
265 1 28 LEU HA 1 28 LEU MD1 4.660 . 4.660 3.873 3.836 3.913 . 0 0 "[ . 1 . 2]" 1
266 1 28 LEU HA 1 28 LEU MD2 3.920 . 3.920 1.987 1.874 2.373 . 0 0 "[ . 1 . 2]" 1
267 1 28 LEU HA 1 31 ILE H 4.790 . 4.790 3.404 3.176 3.815 . 0 0 "[ . 1 . 2]" 1
268 1 28 LEU HA 1 31 ILE HB 4.910 . 4.910 2.776 2.381 3.219 . 0 0 "[ . 1 . 2]" 1
269 1 28 LEU HA 1 31 ILE MD 3.860 . 3.860 2.102 1.774 2.690 . 0 0 "[ . 1 . 2]" 1
270 1 28 LEU HA 1 31 ILE MG 5.450 . 5.450 4.065 3.715 4.399 . 0 0 "[ . 1 . 2]" 1
271 1 28 LEU HA 1 47 TYR QD 5.250 . 5.250 3.510 2.649 4.599 . 0 0 "[ . 1 . 2]" 1
272 1 28 LEU QB 1 29 TYR H 3.910 . 3.910 2.694 2.468 2.875 . 0 0 "[ . 1 . 2]" 1
273 1 28 LEU QB 1 47 TYR QD 6.100 . 6.100 3.205 2.340 5.380 . 0 0 "[ . 1 . 2]" 1
274 1 28 LEU QB 1 51 ALA H 4.480 . 4.480 3.376 3.081 4.096 . 0 0 "[ . 1 . 2]" 1
275 1 28 LEU QB 1 51 ALA HA 4.390 . 4.390 3.070 2.651 3.531 . 0 0 "[ . 1 . 2]" 1
276 1 28 LEU HB2 1 29 TYR H 4.730 . 4.730 2.874 2.540 3.504 . 0 0 "[ . 1 . 2]" 1
277 1 28 LEU HB3 1 29 TYR H 4.730 . 4.730 3.442 2.589 3.690 . 0 0 "[ . 1 . 2]" 1
278 1 28 LEU MD1 1 29 TYR H 5.590 . 5.590 4.746 4.504 4.944 . 0 0 "[ . 1 . 2]" 1
279 1 28 LEU MD1 1 50 ARG H 5.290 . 5.290 4.235 3.813 4.490 . 0 0 "[ . 1 . 2]" 1
280 1 28 LEU MD1 1 50 ARG HA 4.540 . 4.540 4.113 3.929 4.408 . 0 0 "[ . 1 . 2]" 1
281 1 28 LEU MD1 1 50 ARG HB2 3.950 . 3.950 2.140 1.779 2.474 . 0 0 "[ . 1 . 2]" 1
282 1 28 LEU MD1 1 50 ARG HB3 3.300 . 3.300 2.309 1.905 2.709 . 0 0 "[ . 1 . 2]" 1
283 1 28 LEU MD1 1 50 ARG HD2 5.470 . 5.470 3.576 2.526 5.053 . 0 0 "[ . 1 . 2]" 1
284 1 28 LEU MD1 1 50 ARG QD 4.710 . 4.710 2.832 2.190 3.668 . 0 0 "[ . 1 . 2]" 1
285 1 28 LEU MD1 1 50 ARG HD3 5.470 . 5.470 3.086 2.402 3.869 . 0 0 "[ . 1 . 2]" 1
286 1 28 LEU MD1 1 51 ALA H 4.690 . 4.690 3.377 2.611 3.786 . 0 0 "[ . 1 . 2]" 1
287 1 28 LEU MD1 1 51 ALA HA 4.050 . 4.050 3.221 2.654 3.816 . 0 0 "[ . 1 . 2]" 1
288 1 28 LEU MD1 1 51 ALA MB 4.210 . 4.210 3.520 2.684 3.895 . 0 0 "[ . 1 . 2]" 1
289 1 28 LEU MD1 1 52 ALA H 5.630 . 5.630 5.388 4.762 5.811 0.181 9 0 "[ . 1 . 2]" 1
290 1 28 LEU MD2 1 29 TYR H 5.910 . 5.910 4.670 3.973 4.819 . 0 0 "[ . 1 . 2]" 1
291 1 28 LEU MD2 1 32 GLY H 5.930 . 5.930 4.883 3.547 5.323 . 0 0 "[ . 1 . 2]" 1
292 1 28 LEU MD2 1 47 TYR HA 5.210 . 5.210 3.280 2.398 3.674 . 0 0 "[ . 1 . 2]" 1
293 1 28 LEU MD2 1 47 TYR QD 3.750 . 3.750 1.935 1.641 2.654 . 0 0 "[ . 1 . 2]" 1
294 1 28 LEU MD2 1 47 TYR QE 3.800 . 3.800 2.804 2.308 3.776 . 0 0 "[ . 1 . 2]" 1
295 1 28 LEU MD2 1 50 ARG HB2 5.580 . 5.580 3.773 2.783 4.354 . 0 0 "[ . 1 . 2]" 1
296 1 28 LEU MD2 1 50 ARG HD2 6.040 . 6.040 4.151 2.053 5.635 . 0 0 "[ . 1 . 2]" 1
297 1 28 LEU MD2 1 50 ARG HD3 6.040 . 6.040 3.915 2.887 4.860 . 0 0 "[ . 1 . 2]" 1
298 1 29 TYR H 1 29 TYR HB2 3.800 . 3.800 2.579 2.410 2.713 . 0 0 "[ . 1 . 2]" 1
299 1 29 TYR H 1 29 TYR HB3 3.900 . 3.900 2.486 2.392 2.563 . 0 0 "[ . 1 . 2]" 1
300 1 29 TYR H 1 29 TYR QD 4.640 . 4.640 4.233 4.199 4.270 . 0 0 "[ . 1 . 2]" 1
301 1 29 TYR H 1 30 ASN H 4.270 . 4.270 2.750 2.592 2.903 . 0 0 "[ . 1 . 2]" 1
302 1 29 TYR H 1 31 ILE MD 6.200 . 6.200 5.120 4.818 5.531 . 0 0 "[ . 1 . 2]" 1
303 1 29 TYR H 1 48 PHE QD 5.760 . 5.760 5.164 4.829 5.487 . 0 0 "[ . 1 . 2]" 1
304 1 29 TYR H 1 51 ALA HA 5.760 . 5.760 4.521 4.144 4.935 . 0 0 "[ . 1 . 2]" 1
305 1 29 TYR H 1 51 ALA MB 4.060 . 4.060 2.684 2.421 3.190 . 0 0 "[ . 1 . 2]" 1
306 1 29 TYR HA 1 29 TYR QD 3.510 . 3.510 2.654 2.384 3.168 . 0 0 "[ . 1 . 2]" 1
307 1 29 TYR HA 1 29 TYR QE 5.210 . 5.210 4.643 4.496 4.857 . 0 0 "[ . 1 . 2]" 1
308 1 29 TYR HA 1 32 GLY H 5.400 . 5.400 3.562 3.458 3.827 . 0 0 "[ . 1 . 2]" 1
309 1 29 TYR HA 1 33 LEU H 6.300 . 6.300 4.411 4.276 4.519 . 0 0 "[ . 1 . 2]" 1
310 1 29 TYR HA 1 48 PHE HA 5.230 . 5.230 3.189 2.869 3.857 . 0 0 "[ . 1 . 2]" 1
311 1 29 TYR HA 1 48 PHE QD 4.320 . 4.320 2.497 2.170 2.793 . 0 0 "[ . 1 . 2]" 1
312 1 29 TYR HA 1 48 PHE QE 4.900 . 4.900 3.340 3.021 3.733 . 0 0 "[ . 1 . 2]" 1
313 1 29 TYR HA 1 51 ALA H 5.970 . 5.970 5.149 4.885 5.579 . 0 0 "[ . 1 . 2]" 1
314 1 29 TYR HA 1 51 ALA MB 4.420 . 4.420 2.936 2.672 3.373 . 0 0 "[ . 1 . 2]" 1
315 1 29 TYR HB2 1 30 ASN H 4.780 . 4.780 3.950 3.892 4.021 . 0 0 "[ . 1 . 2]" 1
316 1 29 TYR HB2 1 48 PHE QE 5.960 . 5.960 4.985 4.587 5.392 . 0 0 "[ . 1 . 2]" 1
317 1 29 TYR HB2 1 51 ALA H 5.740 . 5.740 5.370 5.096 5.848 0.108 16 0 "[ . 1 . 2]" 1
318 1 29 TYR HB2 1 51 ALA MB 3.890 . 3.890 2.304 2.032 2.571 . 0 0 "[ . 1 . 2]" 1
319 1 29 TYR HB2 1 55 PHE QE 4.810 . 4.810 2.704 2.101 3.495 . 0 0 "[ . 1 . 2]" 1
320 1 29 TYR HB2 1 55 PHE HZ 6.030 . 6.030 3.519 2.547 4.526 . 0 0 "[ . 1 . 2]" 1
321 1 29 TYR HB2 1 67 ALA MB 5.380 . 5.380 3.701 3.215 4.180 . 0 0 "[ . 1 . 2]" 1
322 1 29 TYR HB3 1 30 ASN H 4.340 . 4.340 2.647 2.556 2.741 . 0 0 "[ . 1 . 2]" 1
323 1 29 TYR HB3 1 30 ASN QD 5.640 . 5.640 3.790 2.536 5.234 . 0 0 "[ . 1 . 2]" 1
324 1 29 TYR HB3 1 51 ALA MB 4.660 . 4.660 3.559 3.322 3.978 . 0 0 "[ . 1 . 2]" 1
325 1 29 TYR QD 1 30 ASN H 4.620 . 4.620 3.652 3.164 3.931 . 0 0 "[ . 1 . 2]" 1
326 1 29 TYR QD 1 30 ASN HA 4.770 . 4.770 3.808 3.342 4.227 . 0 0 "[ . 1 . 2]" 1
327 1 29 TYR QD 1 30 ASN QD 3.810 . 3.810 3.181 1.803 3.907 0.097 5 0 "[ . 1 . 2]" 1
328 1 29 TYR QD 1 33 LEU MD1 4.350 . 4.350 3.140 2.675 3.647 . 0 0 "[ . 1 . 2]" 1
329 1 29 TYR QD 1 33 LEU MD2 5.200 . 5.200 4.056 3.731 4.224 . 0 0 "[ . 1 . 2]" 1
330 1 29 TYR QD 1 33 LEU HG 4.690 . 4.690 3.930 3.349 4.175 . 0 0 "[ . 1 . 2]" 1
331 1 29 TYR QD 1 48 PHE QE 3.180 . 3.180 3.289 3.215 3.400 0.220 11 0 "[ . 1 . 2]" 1
332 1 29 TYR QD 1 51 ALA MB 4.020 . 4.020 3.235 2.891 3.808 . 0 0 "[ . 1 . 2]" 1
333 1 29 TYR QD 1 67 ALA H 6.300 . 6.300 4.811 4.453 5.251 . 0 0 "[ . 1 . 2]" 1
334 1 29 TYR QD 1 67 ALA HA 3.550 . 3.550 2.809 2.529 3.330 . 0 0 "[ . 1 . 2]" 1
335 1 29 TYR QD 1 67 ALA MB 4.060 . 4.060 2.915 2.687 3.210 . 0 0 "[ . 1 . 2]" 1
336 1 29 TYR QE 1 33 LEU MD1 3.240 . 3.240 2.450 2.128 2.719 . 0 0 "[ . 1 . 2]" 1
337 1 29 TYR QE 1 33 LEU MD2 3.700 . 3.700 3.128 2.881 3.349 . 0 0 "[ . 1 . 2]" 1
338 1 29 TYR QE 1 33 LEU HG 4.130 . 4.130 3.983 3.713 4.204 0.074 13 0 "[ . 1 . 2]" 1
339 1 29 TYR QE 1 66 ARG QB 5.600 . 5.600 3.717 2.966 4.364 . 0 0 "[ . 1 . 2]" 1
340 1 29 TYR QE 1 66 ARG HD2 5.740 . 5.740 3.922 2.488 5.202 . 0 0 "[ . 1 . 2]" 1
341 1 29 TYR QE 1 66 ARG QD 5.060 . 5.060 3.225 2.467 4.172 . 0 0 "[ . 1 . 2]" 1
342 1 29 TYR QE 1 66 ARG HD3 5.740 . 5.740 3.783 2.669 5.445 . 0 0 "[ . 1 . 2]" 1
343 1 29 TYR QE 1 66 ARG QG 6.100 . 6.100 3.531 2.732 4.750 . 0 0 "[ . 1 . 2]" 1
344 1 29 TYR QE 1 67 ALA H 4.770 . 4.770 4.276 3.942 4.606 . 0 0 "[ . 1 . 2]" 1
345 1 29 TYR QE 1 67 ALA HA 2.970 . 2.970 2.249 1.935 2.754 . 0 0 "[ . 1 . 2]" 1
346 1 29 TYR QE 1 67 ALA MB 3.800 . 3.800 3.608 3.057 3.872 0.072 12 0 "[ . 1 . 2]" 1
347 1 29 TYR QE 1 70 SER H 4.470 . 4.470 3.944 3.602 4.207 . 0 0 "[ . 1 . 2]" 1
348 1 29 TYR QE 1 70 SER HB2 3.960 . 3.960 2.477 2.082 3.472 . 0 0 "[ . 1 . 2]" 1
349 1 29 TYR QE 1 70 SER QB 3.230 . 3.230 2.238 1.932 2.981 . 0 0 "[ . 1 . 2]" 1
350 1 29 TYR QE 1 70 SER HB3 3.960 . 3.960 2.853 1.981 3.563 . 0 0 "[ . 1 . 2]" 1
351 1 29 TYR QE 1 71 LEU H 5.290 . 5.290 4.867 4.356 5.303 0.013 12 0 "[ . 1 . 2]" 1
352 1 30 ASN H 1 31 ILE H 4.270 . 4.270 2.640 2.523 2.722 . 0 0 "[ . 1 . 2]" 1
353 1 30 ASN H 1 32 GLY H 5.750 . 5.750 4.036 3.843 4.276 . 0 0 "[ . 1 . 2]" 1
354 1 30 ASN H 1 33 LEU MD1 5.830 . 5.830 4.382 4.059 4.670 . 0 0 "[ . 1 . 2]" 1
355 1 30 ASN HA 1 33 LEU H 4.620 . 4.620 3.328 3.024 3.696 . 0 0 "[ . 1 . 2]" 1
356 1 30 ASN HA 1 33 LEU HB2 4.980 . 4.980 2.846 2.514 3.410 . 0 0 "[ . 1 . 2]" 1
357 1 30 ASN HA 1 33 LEU HB3 4.980 . 4.980 4.342 4.071 4.883 . 0 0 "[ . 1 . 2]" 1
358 1 30 ASN HA 1 33 LEU MD1 3.970 . 3.970 2.158 1.942 2.371 . 0 0 "[ . 1 . 2]" 1
359 1 30 ASN HA 1 33 LEU HG 5.260 . 5.260 2.887 2.164 3.349 . 0 0 "[ . 1 . 2]" 1
360 1 30 ASN HA 1 34 GLU H 6.250 . 6.250 4.437 4.182 4.992 . 0 0 "[ . 1 . 2]" 1
361 1 30 ASN QB 1 31 ILE H 5.440 . 5.440 2.705 2.513 2.913 . 0 0 "[ . 1 . 2]" 1
362 1 30 ASN QB 1 32 GLY H 5.600 . 5.600 4.732 4.569 4.816 . 0 0 "[ . 1 . 2]" 1
363 1 30 ASN QD 1 33 LEU HB2 6.300 . 6.300 5.059 3.675 6.309 0.009 12 0 "[ . 1 . 2]" 1
364 1 31 ILE H 1 31 ILE HB 3.920 . 3.920 2.577 2.440 2.757 . 0 0 "[ . 1 . 2]" 1
365 1 31 ILE H 1 31 ILE MD 4.380 . 4.380 3.546 3.373 3.669 . 0 0 "[ . 1 . 2]" 1
366 1 31 ILE H 1 31 ILE HG12 4.840 . 4.840 3.437 3.162 3.577 . 0 0 "[ . 1 . 2]" 1
367 1 31 ILE H 1 31 ILE QG 4.080 . 4.080 2.110 1.925 2.267 . 0 0 "[ . 1 . 2]" 1
368 1 31 ILE H 1 31 ILE HG13 4.840 . 4.840 2.130 1.942 2.295 . 0 0 "[ . 1 . 2]" 1
369 1 31 ILE H 1 31 ILE MG 4.790 . 4.790 3.814 3.782 3.844 . 0 0 "[ . 1 . 2]" 1
370 1 31 ILE H 1 47 TYR QE 6.300 . 6.300 6.272 5.403 6.603 0.303 9 0 "[ . 1 . 2]" 1
371 1 31 ILE H 1 48 PHE QE 6.300 . 6.300 5.849 5.633 6.042 . 0 0 "[ . 1 . 2]" 1
372 1 31 ILE HA 1 33 LEU H 6.230 . 6.230 4.463 4.333 4.666 . 0 0 "[ . 1 . 2]" 1
373 1 31 ILE HA 1 34 GLU H 5.000 . 5.000 3.544 3.339 3.855 . 0 0 "[ . 1 . 2]" 1
374 1 31 ILE HA 1 34 GLU QB 4.880 . 4.880 2.870 2.538 3.286 . 0 0 "[ . 1 . 2]" 1
375 1 31 ILE HB 1 32 GLY H 4.290 . 4.290 2.626 2.428 2.761 . 0 0 "[ . 1 . 2]" 1
376 1 31 ILE HB 1 32 GLY HA2 5.920 . 5.920 4.292 4.109 4.453 . 0 0 "[ . 1 . 2]" 1
377 1 31 ILE HB 1 47 TYR HB3 6.120 . 6.120 3.341 2.846 4.353 . 0 0 "[ . 1 . 2]" 1
378 1 31 ILE HB 1 47 TYR QD 4.430 . 4.430 3.192 2.157 3.830 . 0 0 "[ . 1 . 2]" 1
379 1 31 ILE HB 1 47 TYR QE 4.960 . 4.960 4.027 2.784 4.632 . 0 0 "[ . 1 . 2]" 1
380 1 31 ILE MD 1 31 ILE MG 3.350 . 3.350 2.039 1.951 2.131 . 0 0 "[ . 1 . 2]" 1
381 1 31 ILE MD 1 32 GLY H 6.300 . 6.300 4.547 4.347 4.700 . 0 0 "[ . 1 . 2]" 1
382 1 31 ILE MD 1 47 TYR QD 4.560 . 4.560 3.527 2.570 4.397 . 0 0 "[ . 1 . 2]" 1
383 1 31 ILE MD 1 47 TYR QE 3.950 . 3.950 3.372 2.417 4.138 0.188 1 0 "[ . 1 . 2]" 1
384 1 31 ILE MG 1 32 GLY H 4.880 . 4.880 3.521 3.365 3.816 . 0 0 "[ . 1 . 2]" 1
385 1 31 ILE MG 1 32 GLY HA2 5.130 . 5.130 3.634 3.375 4.048 . 0 0 "[ . 1 . 2]" 1
386 1 31 ILE MG 1 34 GLU H 5.520 . 5.520 4.694 4.398 5.009 . 0 0 "[ . 1 . 2]" 1
387 1 31 ILE MG 1 34 GLU QB 4.750 . 4.750 3.616 3.239 4.152 . 0 0 "[ . 1 . 2]" 1
388 1 31 ILE MG 1 35 LYS H 5.290 . 5.290 4.101 3.805 4.404 . 0 0 "[ . 1 . 2]" 1
389 1 31 ILE MG 1 35 LYS HA 6.300 . 6.300 5.301 4.760 6.015 . 0 0 "[ . 1 . 2]" 1
390 1 31 ILE MG 1 35 LYS QB 5.620 . 5.620 4.137 3.767 4.572 . 0 0 "[ . 1 . 2]" 1
391 1 31 ILE MG 1 35 LYS HD2 6.150 . 6.150 3.947 2.467 4.903 . 0 0 "[ . 1 . 2]" 1
392 1 31 ILE MG 1 35 LYS HD3 6.150 . 6.150 3.786 2.295 5.202 . 0 0 "[ . 1 . 2]" 1
393 1 31 ILE MG 1 35 LYS HE2 4.580 . 4.580 2.908 1.806 4.641 0.061 14 0 "[ . 1 . 2]" 1
394 1 31 ILE MG 1 35 LYS QE 3.850 . 3.850 2.542 1.782 3.808 . 0 0 "[ . 1 . 2]" 1
395 1 31 ILE MG 1 35 LYS HE3 4.580 . 4.580 3.087 2.283 4.284 . 0 0 "[ . 1 . 2]" 1
396 1 31 ILE MG 1 35 LYS QG 4.370 . 4.370 2.901 2.197 4.101 . 0 0 "[ . 1 . 2]" 1
397 1 31 ILE MG 1 47 TYR HB2 5.830 . 5.830 4.314 3.800 5.590 . 0 0 "[ . 1 . 2]" 1
398 1 31 ILE MG 1 47 TYR QD 4.220 . 4.220 2.963 2.296 3.392 . 0 0 "[ . 1 . 2]" 1
399 1 31 ILE MG 1 47 TYR QE 3.690 . 3.690 2.627 2.007 2.883 . 0 0 "[ . 1 . 2]" 1
400 1 32 GLY H 1 33 LEU H 4.620 . 4.620 2.716 2.660 2.800 . 0 0 "[ . 1 . 2]" 1
401 1 32 GLY H 1 47 TYR HB2 5.900 . 5.900 3.495 3.088 4.392 . 0 0 "[ . 1 . 2]" 1
402 1 32 GLY H 1 47 TYR HB3 5.310 . 5.310 3.011 2.751 3.479 . 0 0 "[ . 1 . 2]" 1
403 1 32 GLY H 1 47 TYR QD 5.220 . 5.220 3.904 2.870 4.328 . 0 0 "[ . 1 . 2]" 1
404 1 32 GLY H 1 47 TYR QE 6.260 . 6.260 5.479 4.716 5.831 . 0 0 "[ . 1 . 2]" 1
405 1 32 GLY H 1 48 PHE QE 5.220 . 5.220 4.169 3.900 4.429 . 0 0 "[ . 1 . 2]" 1
406 1 32 GLY HA2 1 35 LYS H 5.590 . 5.590 3.457 3.161 3.711 . 0 0 "[ . 1 . 2]" 1
407 1 32 GLY HA2 1 35 LYS QB 5.290 . 5.290 2.702 2.391 3.313 . 0 0 "[ . 1 . 2]" 1
408 1 32 GLY HA2 1 44 ALA HA 4.200 . 4.200 2.170 1.861 2.745 . 0 0 "[ . 1 . 2]" 1
409 1 32 GLY HA2 1 44 ALA MB 4.660 . 4.660 3.238 2.827 3.968 . 0 0 "[ . 1 . 2]" 1
410 1 32 GLY HA2 1 47 TYR HB2 5.110 . 5.110 2.622 2.392 3.101 . 0 0 "[ . 1 . 2]" 1
411 1 32 GLY HA2 1 48 PHE QD 6.300 . 6.300 5.024 4.831 5.349 . 0 0 "[ . 1 . 2]" 1
412 1 32 GLY HA2 1 48 PHE QE 6.300 . 6.300 4.439 4.306 4.638 . 0 0 "[ . 1 . 2]" 1
413 1 32 GLY HA2 1 48 PHE HZ 6.300 . 6.300 4.730 4.443 5.028 . 0 0 "[ . 1 . 2]" 1
414 1 32 GLY HA3 1 35 LYS QB 5.830 . 5.830 4.199 3.822 4.836 . 0 0 "[ . 1 . 2]" 1
415 1 32 GLY HA3 1 44 ALA HA 4.820 . 4.820 3.118 2.893 3.443 . 0 0 "[ . 1 . 2]" 1
416 1 32 GLY HA3 1 47 TYR HB2 5.100 . 5.100 2.574 2.336 3.002 . 0 0 "[ . 1 . 2]" 1
417 1 32 GLY HA3 1 48 PHE QD 5.810 . 5.810 3.614 3.372 3.969 . 0 0 "[ . 1 . 2]" 1
418 1 32 GLY HA3 1 48 PHE QE 5.340 . 5.340 3.105 2.848 3.323 . 0 0 "[ . 1 . 2]" 1
419 1 33 LEU H 1 33 LEU HB2 3.930 . 3.930 2.514 2.448 2.591 . 0 0 "[ . 1 . 2]" 1
420 1 33 LEU H 1 33 LEU HB3 4.250 . 4.250 3.620 3.592 3.648 . 0 0 "[ . 1 . 2]" 1
421 1 33 LEU H 1 33 LEU MD1 4.250 . 4.250 3.654 3.555 3.747 . 0 0 "[ . 1 . 2]" 1
422 1 33 LEU H 1 33 LEU MD2 4.570 . 4.570 3.357 3.107 3.532 . 0 0 "[ . 1 . 2]" 1
423 1 33 LEU H 1 33 LEU HG 3.820 . 3.820 2.333 2.187 2.477 . 0 0 "[ . 1 . 2]" 1
424 1 33 LEU H 1 34 GLU H 4.370 . 4.370 2.706 2.587 2.816 . 0 0 "[ . 1 . 2]" 1
425 1 33 LEU H 1 35 LYS H 5.570 . 5.570 4.224 3.985 4.551 . 0 0 "[ . 1 . 2]" 1
426 1 33 LEU H 1 48 PHE QE 4.550 . 4.550 2.906 2.610 3.403 . 0 0 "[ . 1 . 2]" 1
427 1 33 LEU H 1 48 PHE HZ 4.870 . 4.870 3.608 3.090 3.911 . 0 0 "[ . 1 . 2]" 1
428 1 33 LEU HA 1 33 LEU MD1 4.420 . 4.420 3.940 3.921 3.980 . 0 0 "[ . 1 . 2]" 1
429 1 33 LEU HA 1 33 LEU MD2 3.330 . 3.330 2.103 2.039 2.193 . 0 0 "[ . 1 . 2]" 1
430 1 33 LEU HA 1 36 ASN H 4.860 . 4.860 3.669 3.383 3.883 . 0 0 "[ . 1 . 2]" 1
431 1 33 LEU HA 1 36 ASN QB 4.180 . 4.180 2.774 2.453 3.070 . 0 0 "[ . 1 . 2]" 1
432 1 33 LEU HA 1 36 ASN HD21 5.290 . 5.290 4.042 3.367 5.328 0.038 9 0 "[ . 1 . 2]" 1
433 1 33 LEU HA 1 36 ASN HD22 6.300 . 6.300 5.583 5.074 6.154 . 0 0 "[ . 1 . 2]" 1
434 1 33 LEU HA 1 48 PHE QE 4.190 . 4.190 3.492 3.225 4.094 . 0 0 "[ . 1 . 2]" 1
435 1 33 LEU HA 1 48 PHE HZ 3.730 . 3.730 2.408 2.123 2.969 . 0 0 "[ . 1 . 2]" 1
436 1 33 LEU HB2 1 33 LEU MD1 3.640 . 3.640 2.359 2.327 2.402 . 0 0 "[ . 1 . 2]" 1
437 1 33 LEU HB2 1 34 GLU H 4.040 . 4.040 2.627 2.417 2.782 . 0 0 "[ . 1 . 2]" 1
438 1 33 LEU HB2 1 48 PHE QE 6.300 . 6.300 4.497 4.167 4.973 . 0 0 "[ . 1 . 2]" 1
439 1 33 LEU HB2 1 48 PHE HZ 6.300 . 6.300 4.880 4.457 5.363 . 0 0 "[ . 1 . 2]" 1
440 1 33 LEU HB3 1 33 LEU MD1 3.440 . 3.440 2.453 2.407 2.499 . 0 0 "[ . 1 . 2]" 1
441 1 33 LEU HB3 1 33 LEU MD2 3.630 . 3.630 2.445 2.406 2.509 . 0 0 "[ . 1 . 2]" 1
442 1 33 LEU HB3 1 34 GLU H 4.710 . 4.710 3.632 3.404 3.782 . 0 0 "[ . 1 . 2]" 1
443 1 33 LEU HB3 1 48 PHE QE 6.300 . 6.300 4.832 4.546 5.309 . 0 0 "[ . 1 . 2]" 1
444 1 33 LEU HB3 1 48 PHE HZ 6.300 . 6.300 4.586 4.297 4.993 . 0 0 "[ . 1 . 2]" 1
445 1 33 LEU MD1 1 34 GLU H 5.450 . 5.450 4.555 4.363 4.665 . 0 0 "[ . 1 . 2]" 1
446 1 33 LEU MD1 1 48 PHE QE 4.650 . 4.650 3.896 3.662 4.140 . 0 0 "[ . 1 . 2]" 1
447 1 33 LEU MD1 1 48 PHE HZ 5.190 . 5.190 4.756 4.478 5.172 . 0 0 "[ . 1 . 2]" 1
448 1 33 LEU MD1 1 66 ARG QD 6.100 . 6.100 4.984 4.034 6.006 . 0 0 "[ . 1 . 2]" 1
449 1 33 LEU MD1 1 70 SER QB 6.100 . 6.100 5.104 4.444 5.691 . 0 0 "[ . 1 . 2]" 1
450 1 33 LEU MD2 1 34 GLU H 5.750 . 5.750 4.724 4.639 4.809 . 0 0 "[ . 1 . 2]" 1
451 1 33 LEU MD2 1 36 ASN H 6.150 . 6.150 5.209 4.936 5.412 . 0 0 "[ . 1 . 2]" 1
452 1 33 LEU MD2 1 36 ASN HB2 5.330 . 5.330 4.451 4.105 5.071 . 0 0 "[ . 1 . 2]" 1
453 1 33 LEU MD2 1 36 ASN QB 4.600 . 4.600 3.748 3.428 4.117 . 0 0 "[ . 1 . 2]" 1
454 1 33 LEU MD2 1 36 ASN HB3 5.330 . 5.330 4.045 3.665 4.523 . 0 0 "[ . 1 . 2]" 1
455 1 33 LEU MD2 1 36 ASN HD21 5.550 . 5.550 4.017 3.092 5.459 . 0 0 "[ . 1 . 2]" 1
456 1 33 LEU MD2 1 36 ASN HD22 6.280 . 6.280 5.172 4.397 5.818 . 0 0 "[ . 1 . 2]" 1
457 1 33 LEU MD2 1 48 PHE QE 4.060 . 4.060 2.535 2.208 2.803 . 0 0 "[ . 1 . 2]" 1
458 1 33 LEU MD2 1 48 PHE HZ 3.440 . 3.440 2.077 1.876 2.358 . 0 0 "[ . 1 . 2]" 1
459 1 33 LEU MD2 1 70 SER QB 5.580 . 5.580 3.280 2.530 4.014 . 0 0 "[ . 1 . 2]" 1
460 1 33 LEU HG 1 34 GLU H 5.570 . 5.570 4.401 4.207 4.541 . 0 0 "[ . 1 . 2]" 1
461 1 33 LEU HG 1 48 PHE QE 4.230 . 4.230 2.431 2.111 2.819 . 0 0 "[ . 1 . 2]" 1
462 1 33 LEU HG 1 48 PHE HZ 5.060 . 5.060 3.620 3.219 4.300 . 0 0 "[ . 1 . 2]" 1
463 1 34 GLU H 1 34 GLU QB 3.900 . 3.900 2.438 2.334 2.534 . 0 0 "[ . 1 . 2]" 1
464 1 34 GLU H 1 34 GLU HG2 4.410 . 4.410 2.322 2.150 2.620 . 0 0 "[ . 1 . 2]" 1
465 1 34 GLU H 1 34 GLU HG3 4.410 . 4.410 3.716 3.602 3.966 . 0 0 "[ . 1 . 2]" 1
466 1 34 GLU H 1 35 LYS H 4.190 . 4.190 2.671 2.492 2.834 . 0 0 "[ . 1 . 2]" 1
467 1 34 GLU H 1 36 ASN H 5.820 . 5.820 4.142 3.916 4.326 . 0 0 "[ . 1 . 2]" 1
468 1 34 GLU H 1 48 PHE QE 6.300 . 6.300 5.360 5.054 5.839 . 0 0 "[ . 1 . 2]" 1
469 1 34 GLU HA 1 37 LYS H 4.320 . 4.320 3.530 2.888 3.951 . 0 0 "[ . 1 . 2]" 1
470 1 34 GLU QB 1 35 LYS H 4.050 . 4.050 2.621 2.428 2.945 . 0 0 "[ . 1 . 2]" 1
471 1 34 GLU QB 1 35 LYS QE 5.850 . 5.850 4.560 3.872 5.439 . 0 0 "[ . 1 . 2]" 1
472 1 34 GLU QG 1 35 LYS H 6.100 . 6.100 4.128 3.971 4.415 . 0 0 "[ . 1 . 2]" 1
473 1 35 LYS H 1 35 LYS QB 3.630 . 3.630 2.362 2.150 2.477 . 0 0 "[ . 1 . 2]" 1
474 1 35 LYS H 1 35 LYS QD 5.840 . 5.840 3.445 2.206 4.271 . 0 0 "[ . 1 . 2]" 1
475 1 35 LYS H 1 35 LYS QE 6.100 . 6.100 4.600 4.122 5.352 . 0 0 "[ . 1 . 2]" 1
476 1 35 LYS H 1 35 LYS HG2 4.730 . 4.730 3.106 2.274 4.121 . 0 0 "[ . 1 . 2]" 1
477 1 35 LYS H 1 35 LYS QG 3.840 . 3.840 2.726 2.254 3.673 . 0 0 "[ . 1 . 2]" 1
478 1 35 LYS H 1 35 LYS HG3 4.730 . 4.730 3.537 2.561 4.201 . 0 0 "[ . 1 . 2]" 1
479 1 35 LYS H 1 36 ASN H 3.940 . 3.940 2.639 2.502 2.759 . 0 0 "[ . 1 . 2]" 1
480 1 35 LYS HA 1 35 LYS QD 3.780 . 3.780 2.704 2.040 4.013 0.233 7 0 "[ . 1 . 2]" 1
481 1 35 LYS HA 1 38 MET H 4.490 . 4.490 3.466 3.056 3.756 . 0 0 "[ . 1 . 2]" 1
482 1 35 LYS HA 1 38 MET HB2 4.350 . 4.350 2.955 2.549 3.528 . 0 0 "[ . 1 . 2]" 1
483 1 35 LYS HA 1 38 MET HB3 5.190 . 5.190 4.617 4.236 5.190 . 0 0 "[ . 1 . 2]" 1
484 1 35 LYS HA 1 38 MET ME 4.440 . 4.440 2.151 1.733 4.248 . 0 0 "[ . 1 . 2]" 1
485 1 35 LYS HA 1 38 MET HG2 5.400 . 5.400 5.131 4.697 5.515 0.115 17 0 "[ . 1 . 2]" 1
486 1 35 LYS HA 1 38 MET HG3 5.400 . 5.400 3.672 3.221 4.135 . 0 0 "[ . 1 . 2]" 1
487 1 35 LYS QB 1 36 ASN H 4.090 . 4.090 2.586 2.371 2.945 . 0 0 "[ . 1 . 2]" 1
488 1 35 LYS QB 1 44 ALA H 4.180 . 4.180 2.889 2.612 3.403 . 0 0 "[ . 1 . 2]" 1
489 1 35 LYS QB 1 44 ALA HA 4.210 . 4.210 2.604 2.222 3.362 . 0 0 "[ . 1 . 2]" 1
490 1 35 LYS QD 1 38 MET ME 4.760 . 4.760 2.810 1.984 4.538 . 0 0 "[ . 1 . 2]" 1
491 1 35 LYS QD 1 44 ALA H 6.100 . 6.100 4.628 3.716 5.806 . 0 0 "[ . 1 . 2]" 1
492 1 35 LYS QD 1 47 TYR QE 6.100 . 6.100 3.242 1.659 4.175 . 0 0 "[ . 1 . 2]" 1
493 1 35 LYS QE 1 43 GLU QB 4.790 . 4.790 3.256 2.533 4.298 . 0 0 "[ . 1 . 2]" 1
494 1 35 LYS QE 1 47 TYR QE 3.580 . 3.580 2.308 1.756 3.266 . 0 0 "[ . 1 . 2]" 1
495 1 35 LYS HE2 1 47 TYR QE 4.370 . 4.370 3.375 2.135 4.322 . 0 0 "[ . 1 . 2]" 1
496 1 35 LYS HE3 1 47 TYR QE 4.370 . 4.370 2.560 1.762 4.002 . 0 0 "[ . 1 . 2]" 1
497 1 35 LYS QG 1 36 ASN H 6.040 . 6.040 4.238 3.935 4.568 . 0 0 "[ . 1 . 2]" 1
498 1 35 LYS QG 1 44 ALA HA 5.280 . 5.280 3.641 2.954 5.026 . 0 0 "[ . 1 . 2]" 1
499 1 35 LYS QG 1 47 TYR QD 5.850 . 5.850 3.174 2.054 5.119 . 0 0 "[ . 1 . 2]" 1
500 1 36 ASN H 1 36 ASN HB2 3.970 . 3.970 2.416 2.252 2.568 . 0 0 "[ . 1 . 2]" 1
501 1 36 ASN H 1 36 ASN QB 3.390 . 3.390 2.235 2.161 2.268 . 0 0 "[ . 1 . 2]" 1
502 1 36 ASN H 1 36 ASN HB3 3.970 . 3.970 2.655 2.512 2.791 . 0 0 "[ . 1 . 2]" 1
503 1 36 ASN H 1 37 LYS H 4.060 . 4.060 2.625 2.494 2.710 . 0 0 "[ . 1 . 2]" 1
504 1 36 ASN H 1 38 MET H 5.970 . 5.970 4.098 3.962 4.296 . 0 0 "[ . 1 . 2]" 1
505 1 36 ASN H 1 44 ALA HA 6.080 . 6.080 4.164 3.792 4.747 . 0 0 "[ . 1 . 2]" 1
506 1 36 ASN H 1 44 ALA MB 4.070 . 4.070 2.568 2.305 2.895 . 0 0 "[ . 1 . 2]" 1
507 1 36 ASN H 1 48 PHE QE 6.250 . 6.250 4.927 4.475 5.604 . 0 0 "[ . 1 . 2]" 1
508 1 36 ASN H 1 48 PHE HZ 6.300 . 6.300 4.582 4.206 5.449 . 0 0 "[ . 1 . 2]" 1
509 1 36 ASN HA 1 38 MET H 5.260 . 5.260 4.238 4.026 4.405 . 0 0 "[ . 1 . 2]" 1
510 1 36 ASN HA 1 44 ALA MB 4.020 . 4.020 2.791 2.456 3.070 . 0 0 "[ . 1 . 2]" 1
511 1 36 ASN QB 1 37 LYS H 3.750 . 3.750 2.700 2.493 2.890 . 0 0 "[ . 1 . 2]" 1
512 1 36 ASN QB 1 37 LYS HA 5.890 . 5.890 4.202 4.060 4.329 . 0 0 "[ . 1 . 2]" 1
513 1 36 ASN QB 1 37 LYS QB 6.100 . 6.100 4.271 3.703 4.888 . 0 0 "[ . 1 . 2]" 1
514 1 36 ASN QB 1 44 ALA MB 3.640 . 3.640 2.101 1.927 2.264 . 0 0 "[ . 1 . 2]" 1
515 1 36 ASN QB 1 48 PHE QE 4.560 . 4.560 3.075 2.476 3.637 . 0 0 "[ . 1 . 2]" 1
516 1 36 ASN QB 1 74 ALA MB 5.970 . 5.970 3.595 3.046 4.568 . 0 0 "[ . 1 . 2]" 1
517 1 36 ASN HB2 1 37 LYS H 4.440 . 4.440 3.865 3.672 4.051 . 0 0 "[ . 1 . 2]" 1
518 1 36 ASN HB2 1 44 ALA MB 4.280 . 4.280 2.119 1.940 2.284 . 0 0 "[ . 1 . 2]" 1
519 1 36 ASN HB2 1 48 PHE HZ 5.500 . 5.500 3.312 2.859 4.338 . 0 0 "[ . 1 . 2]" 1
520 1 36 ASN HB3 1 37 LYS H 4.440 . 4.440 2.757 2.531 2.970 . 0 0 "[ . 1 . 2]" 1
521 1 36 ASN HB3 1 44 ALA MB 4.280 . 4.280 3.495 3.287 3.704 . 0 0 "[ . 1 . 2]" 1
522 1 36 ASN HB3 1 48 PHE HZ 5.500 . 5.500 3.723 3.256 4.562 . 0 0 "[ . 1 . 2]" 1
523 1 36 ASN HD21 1 44 ALA MB 5.970 . 5.970 3.896 2.273 4.976 . 0 0 "[ . 1 . 2]" 1
524 1 36 ASN HD21 1 73 GLU QB 6.300 . 6.300 5.021 3.652 6.304 0.004 9 0 "[ . 1 . 2]" 1
525 1 36 ASN HD21 1 74 ALA HA 6.300 . 6.300 4.318 2.957 5.678 . 0 0 "[ . 1 . 2]" 1
526 1 36 ASN HD21 1 74 ALA MB 6.040 . 6.040 3.795 2.418 5.344 . 0 0 "[ . 1 . 2]" 1
527 1 36 ASN HD22 1 44 ALA MB 5.760 . 5.760 4.559 3.671 5.250 . 0 0 "[ . 1 . 2]" 1
528 1 36 ASN HD22 1 74 ALA H 6.300 . 6.300 4.781 3.687 6.041 . 0 0 "[ . 1 . 2]" 1
529 1 36 ASN HD22 1 74 ALA HA 6.150 . 6.150 3.264 2.040 4.524 . 0 0 "[ . 1 . 2]" 1
530 1 36 ASN HD22 1 74 ALA MB 5.480 . 5.480 3.679 2.482 4.912 . 0 0 "[ . 1 . 2]" 1
531 1 36 ASN HD22 1 77 ALA MB 6.150 . 6.150 3.762 2.678 4.658 . 0 0 "[ . 1 . 2]" 1
532 1 37 LYS H 1 37 LYS QB 3.340 . 3.340 2.312 2.147 2.558 . 0 0 "[ . 1 . 2]" 1
533 1 37 LYS H 1 37 LYS HG2 4.790 . 4.790 3.730 2.280 4.615 . 0 0 "[ . 1 . 2]" 1
534 1 37 LYS H 1 37 LYS HG3 4.790 . 4.790 3.785 2.269 4.634 . 0 0 "[ . 1 . 2]" 1
535 1 37 LYS H 1 38 MET H 3.890 . 3.890 2.627 2.375 2.783 . 0 0 "[ . 1 . 2]" 1
536 1 37 LYS H 1 38 MET ME 6.300 . 6.300 5.055 4.743 6.506 0.206 4 0 "[ . 1 . 2]" 1
537 1 37 LYS H 1 38 MET QG 6.100 . 6.100 4.347 3.947 4.572 . 0 0 "[ . 1 . 2]" 1
538 1 37 LYS H 1 44 ALA MB 5.680 . 5.680 4.616 4.405 4.897 . 0 0 "[ . 1 . 2]" 1
539 1 37 LYS HA 1 37 LYS QE 6.300 . 6.300 4.250 2.396 5.151 . 0 0 "[ . 1 . 2]" 1
540 1 37 LYS HA 1 37 LYS QG 3.850 . 3.850 2.679 2.428 3.089 . 0 0 "[ . 1 . 2]" 1
541 1 37 LYS QB 1 38 MET H 4.150 . 4.150 2.746 2.522 2.932 . 0 0 "[ . 1 . 2]" 1
542 1 37 LYS QB 1 38 MET HG2 4.940 . 4.940 4.328 3.669 4.884 . 0 0 "[ . 1 . 2]" 1
543 1 37 LYS QB 1 38 MET QG 4.260 . 4.260 3.184 2.661 3.467 . 0 0 "[ . 1 . 2]" 1
544 1 37 LYS QB 1 38 MET HG3 4.940 . 4.940 3.281 2.732 3.568 . 0 0 "[ . 1 . 2]" 1
545 1 37 LYS QD 1 38 MET H 6.300 . 6.300 4.748 3.034 5.656 . 0 0 "[ . 1 . 2]" 1
546 1 37 LYS QG 1 38 MET H 5.250 . 5.250 4.040 3.445 4.411 . 0 0 "[ . 1 . 2]" 1
547 1 38 MET H 1 38 MET HB2 3.810 . 3.810 2.479 2.408 2.584 . 0 0 "[ . 1 . 2]" 1
548 1 38 MET H 1 38 MET HB3 4.390 . 4.390 3.646 3.604 3.702 . 0 0 "[ . 1 . 2]" 1
549 1 38 MET H 1 38 MET ME 5.730 . 5.730 3.670 3.499 4.763 . 0 0 "[ . 1 . 2]" 1
550 1 38 MET H 1 38 MET HG2 4.440 . 4.440 3.640 3.458 3.808 . 0 0 "[ . 1 . 2]" 1
551 1 38 MET H 1 38 MET QG 3.790 . 3.790 2.486 2.249 2.656 . 0 0 "[ . 1 . 2]" 1
552 1 38 MET H 1 38 MET HG3 4.440 . 4.440 2.532 2.279 2.712 . 0 0 "[ . 1 . 2]" 1
553 1 38 MET H 1 39 GLY H 3.910 . 3.910 2.527 2.349 2.721 . 0 0 "[ . 1 . 2]" 1
554 1 38 MET H 1 40 LYS H 5.230 . 5.230 3.609 3.386 4.106 . 0 0 "[ . 1 . 2]" 1
555 1 38 MET H 1 40 LYS QB 6.100 . 6.100 4.635 4.352 5.369 . 0 0 "[ . 1 . 2]" 1
556 1 38 MET H 1 40 LYS QG 5.720 . 5.720 4.741 3.853 5.735 0.015 10 0 "[ . 1 . 2]" 1
557 1 38 MET HA 1 38 MET ME 5.790 . 5.790 4.467 3.999 4.573 . 0 0 "[ . 1 . 2]" 1
558 1 38 MET HA 1 38 MET QG 3.810 . 3.810 2.465 2.414 2.573 . 0 0 "[ . 1 . 2]" 1
559 1 38 MET HB2 1 39 GLY H 5.260 . 5.260 3.562 3.165 3.851 . 0 0 "[ . 1 . 2]" 1
560 1 38 MET HB2 1 40 LYS H 5.640 . 5.640 3.008 2.592 3.433 . 0 0 "[ . 1 . 2]" 1
561 1 38 MET HB3 1 39 GLY H 6.000 . 6.000 4.287 4.075 4.405 . 0 0 "[ . 1 . 2]" 1
562 1 38 MET HB3 1 40 LYS H 5.420 . 5.420 3.933 3.558 4.227 . 0 0 "[ . 1 . 2]" 1
563 1 38 MET HB3 1 40 LYS QE 5.290 . 5.290 3.419 2.306 4.279 . 0 0 "[ . 1 . 2]" 1
564 1 38 MET HB3 1 40 LYS QG 5.150 . 5.150 3.271 2.657 4.119 . 0 0 "[ . 1 . 2]" 1
565 1 38 MET ME 1 40 LYS H 6.300 . 6.300 4.167 3.629 5.103 . 0 0 "[ . 1 . 2]" 1
566 1 38 MET ME 1 40 LYS HE2 4.850 . 4.850 3.767 2.231 5.027 0.177 8 0 "[ . 1 . 2]" 1
567 1 38 MET ME 1 40 LYS HE3 4.850 . 4.850 3.294 2.135 4.015 . 0 0 "[ . 1 . 2]" 1
568 1 38 MET ME 1 40 LYS QG 4.450 . 4.450 3.191 1.906 4.452 0.002 6 0 "[ . 1 . 2]" 1
569 1 38 MET QG 1 39 GLY H 5.450 . 5.450 4.415 4.244 4.544 . 0 0 "[ . 1 . 2]" 1
570 1 38 MET QG 1 40 LYS QG 5.930 . 5.930 4.688 3.797 5.599 . 0 0 "[ . 1 . 2]" 1
571 1 38 MET HG2 1 39 GLY H 6.300 . 6.300 5.268 5.134 5.357 . 0 0 "[ . 1 . 2]" 1
572 1 38 MET HG3 1 39 GLY H 6.300 . 6.300 4.740 4.503 4.919 . 0 0 "[ . 1 . 2]" 1
573 1 39 GLY H 1 40 LYS QB 5.860 . 5.860 4.598 4.388 4.873 . 0 0 "[ . 1 . 2]" 1
574 1 39 GLY H 1 40 LYS QG 6.130 . 6.130 4.372 3.903 4.783 . 0 0 "[ . 1 . 2]" 1
575 1 40 LYS H 1 40 LYS QB 3.810 . 3.810 2.479 2.408 2.636 . 0 0 "[ . 1 . 2]" 1
576 1 40 LYS H 1 40 LYS QE 6.100 . 6.100 4.350 3.293 4.906 . 0 0 "[ . 1 . 2]" 1
577 1 40 LYS H 1 40 LYS QG 3.930 . 3.930 2.331 2.111 2.557 . 0 0 "[ . 1 . 2]" 1
578 1 40 LYS H 1 41 ALA H 4.770 . 4.770 3.686 3.247 3.961 . 0 0 "[ . 1 . 2]" 1
579 1 40 LYS H 1 41 ALA MB 6.040 . 6.040 4.717 4.231 5.022 . 0 0 "[ . 1 . 2]" 1
580 1 40 LYS HA 1 40 LYS QD 4.640 . 4.640 3.689 2.256 4.176 . 0 0 "[ . 1 . 2]" 1
581 1 40 LYS HA 1 41 ALA MB 4.610 . 4.610 4.271 4.102 4.525 . 0 0 "[ . 1 . 2]" 1
582 1 40 LYS HB2 1 41 ALA H 5.100 . 5.100 4.446 4.293 4.518 . 0 0 "[ . 1 . 2]" 1
583 1 40 LYS HB2 1 44 ALA H 4.810 . 4.810 4.385 3.722 4.895 0.085 1 0 "[ . 1 . 2]" 1
584 1 40 LYS HB3 1 41 ALA H 5.100 . 5.100 4.324 4.143 4.518 . 0 0 "[ . 1 . 2]" 1
585 1 40 LYS HB3 1 44 ALA H 4.810 . 4.810 4.229 3.773 4.875 0.065 1 0 "[ . 1 . 2]" 1
586 1 40 LYS QE 1 40 LYS QG 3.480 . 3.480 2.330 2.162 2.462 . 0 0 "[ . 1 . 2]" 1
587 1 40 LYS QG 1 41 ALA H 5.320 . 5.320 4.615 4.401 4.984 . 0 0 "[ . 1 . 2]" 1
588 1 41 ALA H 1 41 ALA MB 3.280 . 3.280 2.243 2.192 2.291 . 0 0 "[ . 1 . 2]" 1
589 1 41 ALA H 1 42 ARG H 4.240 . 4.240 2.541 2.418 2.662 . 0 0 "[ . 1 . 2]" 1
590 1 41 ALA H 1 42 ARG QB 5.250 . 5.250 4.288 4.116 4.614 . 0 0 "[ . 1 . 2]" 1
591 1 41 ALA H 1 43 GLU H 5.850 . 5.850 4.423 4.133 4.966 . 0 0 "[ . 1 . 2]" 1
592 1 41 ALA H 1 43 GLU QB 6.180 . 6.180 5.407 4.994 6.144 . 0 0 "[ . 1 . 2]" 1
593 1 41 ALA H 1 44 ALA H 5.660 . 5.660 4.629 4.428 5.027 . 0 0 "[ . 1 . 2]" 1
594 1 41 ALA H 1 44 ALA MB 5.640 . 5.640 4.263 4.164 4.377 . 0 0 "[ . 1 . 2]" 1
595 1 41 ALA H 1 45 ALA H 6.300 . 6.300 5.930 5.724 6.092 . 0 0 "[ . 1 . 2]" 1
596 1 41 ALA H 1 78 ILE QG 5.960 . 5.960 4.239 3.771 4.794 . 0 0 "[ . 1 . 2]" 1
597 1 41 ALA HA 1 44 ALA H 4.300 . 4.300 3.133 2.717 3.423 . 0 0 "[ . 1 . 2]" 1
598 1 41 ALA HA 1 44 ALA MB 3.480 . 3.480 1.993 1.851 2.248 . 0 0 "[ . 1 . 2]" 1
599 1 41 ALA HA 1 45 ALA H 5.390 . 5.390 3.821 3.523 4.103 . 0 0 "[ . 1 . 2]" 1
600 1 41 ALA MB 1 42 ARG H 4.070 . 4.070 2.979 2.710 3.323 . 0 0 "[ . 1 . 2]" 1
601 1 41 ALA MB 1 44 ALA H 4.960 . 4.960 4.467 4.257 4.708 . 0 0 "[ . 1 . 2]" 1
602 1 41 ALA MB 1 75 ILE HA 5.810 . 5.810 4.269 3.787 4.572 . 0 0 "[ . 1 . 2]" 1
603 1 41 ALA MB 1 78 ILE H 4.330 . 4.330 3.152 2.871 3.350 . 0 0 "[ . 1 . 2]" 1
604 1 41 ALA MB 1 78 ILE HA 4.570 . 4.570 2.284 1.899 2.926 . 0 0 "[ . 1 . 2]" 1
605 1 41 ALA MB 1 78 ILE MD 4.030 . 4.030 3.730 3.378 4.160 0.130 3 0 "[ . 1 . 2]" 1
606 1 41 ALA MB 1 78 ILE HG12 4.000 . 4.000 2.634 2.265 3.064 . 0 0 "[ . 1 . 2]" 1
607 1 41 ALA MB 1 78 ILE QG 3.480 . 3.480 2.409 2.116 2.798 . 0 0 "[ . 1 . 2]" 1
608 1 41 ALA MB 1 78 ILE HG13 4.000 . 4.000 2.806 2.426 3.235 . 0 0 "[ . 1 . 2]" 1
609 1 42 ARG H 1 42 ARG HB2 3.940 . 3.940 2.568 2.185 2.807 . 0 0 "[ . 1 . 2]" 1
610 1 42 ARG H 1 42 ARG HB3 3.940 . 3.940 2.581 2.268 3.643 . 0 0 "[ . 1 . 2]" 1
611 1 42 ARG H 1 42 ARG QD 5.710 . 5.710 4.554 4.289 4.853 . 0 0 "[ . 1 . 2]" 1
612 1 42 ARG H 1 42 ARG QG 4.710 . 4.710 3.943 2.834 4.071 . 0 0 "[ . 1 . 2]" 1
613 1 42 ARG H 1 43 GLU H 4.090 . 4.090 2.670 2.505 2.905 . 0 0 "[ . 1 . 2]" 1
614 1 42 ARG H 1 44 ALA H 5.020 . 5.020 3.802 3.637 3.989 . 0 0 "[ . 1 . 2]" 1
615 1 42 ARG H 1 44 ALA MB 6.120 . 6.120 4.315 4.139 4.520 . 0 0 "[ . 1 . 2]" 1
616 1 42 ARG H 1 78 ILE MD 5.220 . 5.220 4.172 3.702 4.620 . 0 0 "[ . 1 . 2]" 1
617 1 42 ARG H 1 78 ILE QG 4.870 . 4.870 3.052 2.778 3.343 . 0 0 "[ . 1 . 2]" 1
618 1 42 ARG H 1 78 ILE MG 5.370 . 5.370 3.617 3.076 4.278 . 0 0 "[ . 1 . 2]" 1
619 1 42 ARG HA 1 42 ARG HD2 4.370 . 4.370 3.065 2.016 4.723 0.353 10 0 "[ . 1 . 2]" 1
620 1 42 ARG HA 1 42 ARG HD3 4.370 . 4.370 3.762 2.800 4.541 0.171 4 0 "[ . 1 . 2]" 1
621 1 42 ARG HA 1 45 ALA H 5.030 . 5.030 3.664 3.331 4.258 . 0 0 "[ . 1 . 2]" 1
622 1 42 ARG HA 1 78 ILE MD 3.700 . 3.700 2.375 2.038 2.785 . 0 0 "[ . 1 . 2]" 1
623 1 42 ARG HA 1 78 ILE QG 5.120 . 5.120 2.515 2.142 3.078 . 0 0 "[ . 1 . 2]" 1
624 1 42 ARG HA 1 78 ILE MG 4.680 . 4.680 3.325 2.647 4.081 . 0 0 "[ . 1 . 2]" 1
625 1 42 ARG QB 1 43 GLU H 3.660 . 3.660 2.438 2.242 2.619 . 0 0 "[ . 1 . 2]" 1
626 1 42 ARG QB 1 78 ILE MD 5.110 . 5.110 3.353 2.678 4.020 . 0 0 "[ . 1 . 2]" 1
627 1 42 ARG QB 1 83 GLY H 5.620 . 5.620 5.245 3.952 5.928 0.308 7 0 "[ . 1 . 2]" 1
628 1 42 ARG QD 1 45 ALA MB 4.870 . 4.870 4.047 3.298 5.093 0.223 10 0 "[ . 1 . 2]" 1
629 1 42 ARG QD 1 78 ILE MD 4.270 . 4.270 3.194 2.057 4.273 0.003 4 0 "[ . 1 . 2]" 1
630 1 42 ARG QD 1 87 ALA HA 6.100 . 6.100 5.149 4.136 6.289 0.189 3 0 "[ . 1 . 2]" 1
631 1 42 ARG QD 1 87 ALA MB 5.300 . 5.300 3.031 2.400 4.163 . 0 0 "[ . 1 . 2]" 1
632 1 42 ARG HD2 1 78 ILE MD 4.950 . 4.950 3.600 2.092 5.016 0.066 14 0 "[ . 1 . 2]" 1
633 1 42 ARG HD2 1 78 ILE MG 5.240 . 5.240 4.091 2.688 5.351 0.111 19 0 "[ . 1 . 2]" 1
634 1 42 ARG HD3 1 78 ILE MD 4.950 . 4.950 3.854 2.982 5.009 0.059 3 0 "[ . 1 . 2]" 1
635 1 42 ARG HD3 1 78 ILE MG 5.240 . 5.240 3.828 2.613 5.112 . 0 0 "[ . 1 . 2]" 1
636 1 42 ARG QG 1 78 ILE MD 5.420 . 5.420 3.479 1.833 4.649 . 0 0 "[ . 1 . 2]" 1
637 1 43 GLU H 1 43 GLU QB 3.810 . 3.810 2.457 2.342 2.563 . 0 0 "[ . 1 . 2]" 1
638 1 43 GLU H 1 43 GLU HG2 4.480 . 4.480 3.534 2.523 4.011 . 0 0 "[ . 1 . 2]" 1
639 1 43 GLU H 1 43 GLU QG 3.760 . 3.760 2.560 2.106 3.437 . 0 0 "[ . 1 . 2]" 1
640 1 43 GLU H 1 43 GLU HG3 4.480 . 4.480 2.715 2.126 3.898 . 0 0 "[ . 1 . 2]" 1
641 1 43 GLU H 1 44 ALA H 3.810 . 3.810 2.607 2.425 2.707 . 0 0 "[ . 1 . 2]" 1
642 1 43 GLU H 1 44 ALA MB 5.090 . 5.090 4.245 4.106 4.384 . 0 0 "[ . 1 . 2]" 1
643 1 43 GLU H 1 45 ALA MB 6.010 . 6.010 4.916 4.639 5.209 . 0 0 "[ . 1 . 2]" 1
644 1 43 GLU H 1 78 ILE MG 6.050 . 6.050 5.421 4.969 6.051 0.001 2 0 "[ . 1 . 2]" 1
645 1 43 GLU HA 1 43 GLU QG 3.690 . 3.690 2.485 2.369 2.991 . 0 0 "[ . 1 . 2]" 1
646 1 43 GLU HA 1 46 GLU H 4.570 . 4.570 3.488 3.230 3.765 . 0 0 "[ . 1 . 2]" 1
647 1 43 GLU HA 1 46 GLU QG 5.000 . 5.000 2.920 1.900 4.970 . 0 0 "[ . 1 . 2]" 1
648 1 43 GLU QB 1 44 ALA H 3.790 . 3.790 2.651 2.437 2.901 . 0 0 "[ . 1 . 2]" 1
649 1 43 GLU QB 1 47 TYR QD 5.150 . 5.150 3.454 2.612 4.187 . 0 0 "[ . 1 . 2]" 1
650 1 43 GLU QB 1 47 TYR QE 3.940 . 3.940 2.652 2.074 3.572 . 0 0 "[ . 1 . 2]" 1
651 1 43 GLU QG 1 44 ALA H 4.960 . 4.960 4.232 3.919 4.646 . 0 0 "[ . 1 . 2]" 1
652 1 43 GLU QG 1 47 TYR QD 5.760 . 5.760 5.200 4.204 5.798 0.038 14 0 "[ . 1 . 2]" 1
653 1 43 GLU QG 1 47 TYR QE 5.530 . 5.530 4.180 3.198 4.993 . 0 0 "[ . 1 . 2]" 1
654 1 43 GLU HG2 1 44 ALA H 5.760 . 5.760 5.042 4.521 5.327 . 0 0 "[ . 1 . 2]" 1
655 1 43 GLU HG2 1 47 TYR QE 6.300 . 6.300 4.471 3.387 5.419 . 0 0 "[ . 1 . 2]" 1
656 1 43 GLU HG3 1 44 ALA H 5.760 . 5.760 4.583 4.129 5.307 . 0 0 "[ . 1 . 2]" 1
657 1 43 GLU HG3 1 47 TYR QE 6.300 . 6.300 5.202 3.928 6.374 0.074 15 0 "[ . 1 . 2]" 1
658 1 44 ALA H 1 44 ALA MB 3.460 . 3.460 2.238 2.194 2.266 . 0 0 "[ . 1 . 2]" 1
659 1 44 ALA H 1 45 ALA H 3.910 . 3.910 2.771 2.584 2.898 . 0 0 "[ . 1 . 2]" 1
660 1 44 ALA H 1 45 ALA MB 5.020 . 5.020 4.382 4.222 4.507 . 0 0 "[ . 1 . 2]" 1
661 1 44 ALA H 1 46 GLU H 6.060 . 6.060 4.201 3.937 4.529 . 0 0 "[ . 1 . 2]" 1
662 1 44 ALA H 1 47 TYR H 6.300 . 6.300 4.937 4.781 5.189 . 0 0 "[ . 1 . 2]" 1
663 1 44 ALA H 1 47 TYR HB2 6.300 . 6.300 5.372 4.675 5.817 . 0 0 "[ . 1 . 2]" 1
664 1 44 ALA H 1 47 TYR QD 6.300 . 6.300 4.409 3.896 5.336 . 0 0 "[ . 1 . 2]" 1
665 1 44 ALA H 1 48 PHE QD 6.300 . 6.300 6.056 5.846 6.296 . 0 0 "[ . 1 . 2]" 1
666 1 44 ALA H 1 48 PHE QE 6.300 . 6.300 5.708 5.558 6.011 . 0 0 "[ . 1 . 2]" 1
667 1 44 ALA HA 1 45 ALA MB 6.230 . 6.230 5.059 5.037 5.077 . 0 0 "[ . 1 . 2]" 1
668 1 44 ALA HA 1 46 GLU H 5.860 . 5.860 4.427 4.201 4.677 . 0 0 "[ . 1 . 2]" 1
669 1 44 ALA HA 1 47 TYR H 5.100 . 5.100 3.620 3.385 3.876 . 0 0 "[ . 1 . 2]" 1
670 1 44 ALA HA 1 47 TYR HB2 5.300 . 5.300 2.972 2.196 3.500 . 0 0 "[ . 1 . 2]" 1
671 1 44 ALA HA 1 47 TYR HB3 5.600 . 5.600 4.607 3.717 5.204 . 0 0 "[ . 1 . 2]" 1
672 1 44 ALA HA 1 47 TYR QD 5.120 . 5.120 2.897 2.050 4.425 . 0 0 "[ . 1 . 2]" 1
673 1 44 ALA HA 1 48 PHE H 4.880 . 4.880 4.303 4.129 4.506 . 0 0 "[ . 1 . 2]" 1
674 1 44 ALA MB 1 45 ALA H 3.750 . 3.750 2.405 2.222 2.681 . 0 0 "[ . 1 . 2]" 1
675 1 44 ALA MB 1 46 GLU H 5.850 . 5.850 4.483 4.253 4.788 . 0 0 "[ . 1 . 2]" 1
676 1 44 ALA MB 1 48 PHE QD 4.430 . 4.430 3.524 3.265 3.862 . 0 0 "[ . 1 . 2]" 1
677 1 44 ALA MB 1 48 PHE QE 4.030 . 4.030 2.468 2.295 2.808 . 0 0 "[ . 1 . 2]" 1
678 1 44 ALA MB 1 48 PHE HZ 4.850 . 4.850 3.273 3.064 3.592 . 0 0 "[ . 1 . 2]" 1
679 1 45 ALA H 1 45 ALA MB 3.380 . 3.380 2.224 2.208 2.248 . 0 0 "[ . 1 . 2]" 1
680 1 45 ALA H 1 46 GLU H 4.190 . 4.190 2.740 2.625 2.870 . 0 0 "[ . 1 . 2]" 1
681 1 45 ALA H 1 46 GLU QB 5.270 . 5.270 4.716 4.321 5.122 . 0 0 "[ . 1 . 2]" 1
682 1 45 ALA H 1 47 TYR H 6.300 . 6.300 4.289 3.863 4.491 . 0 0 "[ . 1 . 2]" 1
683 1 45 ALA H 1 48 PHE HB2 6.300 . 6.300 5.183 4.855 5.631 . 0 0 "[ . 1 . 2]" 1
684 1 45 ALA H 1 48 PHE QD 5.250 . 5.250 4.172 3.809 4.567 . 0 0 "[ . 1 . 2]" 1
685 1 45 ALA H 1 74 ALA MB 4.510 . 4.510 3.104 2.598 3.693 . 0 0 "[ . 1 . 2]" 1
686 1 45 ALA H 1 78 ILE MD 5.400 . 5.400 4.151 3.629 4.752 . 0 0 "[ . 1 . 2]" 1
687 1 45 ALA HA 1 48 PHE H 4.590 . 4.590 3.533 3.210 3.819 . 0 0 "[ . 1 . 2]" 1
688 1 45 ALA HA 1 48 PHE HB2 4.530 . 4.530 2.719 2.321 3.249 . 0 0 "[ . 1 . 2]" 1
689 1 45 ALA HA 1 48 PHE HB3 5.060 . 5.060 4.330 3.877 4.960 . 0 0 "[ . 1 . 2]" 1
690 1 45 ALA HA 1 48 PHE QD 3.340 . 3.340 2.275 1.890 2.764 . 0 0 "[ . 1 . 2]" 1
691 1 45 ALA HA 1 49 PHE H 4.960 . 4.960 4.225 3.922 4.519 . 0 0 "[ . 1 . 2]" 1
692 1 45 ALA HA 1 71 LEU MD2 4.050 . 4.050 2.657 2.281 3.027 . 0 0 "[ . 1 . 2]" 1
693 1 45 ALA HA 1 74 ALA MB 4.050 . 4.050 2.895 2.561 3.234 . 0 0 "[ . 1 . 2]" 1
694 1 45 ALA MB 1 46 GLU H 3.920 . 3.920 2.615 2.388 2.766 . 0 0 "[ . 1 . 2]" 1
695 1 45 ALA MB 1 47 TYR H 6.020 . 6.020 4.636 4.292 4.818 . 0 0 "[ . 1 . 2]" 1
696 1 45 ALA MB 1 48 PHE HB2 5.240 . 5.240 4.158 3.829 4.658 . 0 0 "[ . 1 . 2]" 1
697 1 45 ALA MB 1 48 PHE HB3 6.300 . 6.300 5.487 5.073 6.086 . 0 0 "[ . 1 . 2]" 1
698 1 45 ALA MB 1 48 PHE QD 4.660 . 4.660 3.726 3.394 4.226 . 0 0 "[ . 1 . 2]" 1
699 1 45 ALA MB 1 49 PHE H 5.500 . 5.500 4.747 4.496 4.883 . 0 0 "[ . 1 . 2]" 1
700 1 45 ALA MB 1 71 LEU MD2 3.500 . 3.500 2.122 1.821 2.489 . 0 0 "[ . 1 . 2]" 1
701 1 45 ALA MB 1 74 ALA H 6.300 . 6.300 4.833 4.178 5.312 . 0 0 "[ . 1 . 2]" 1
702 1 45 ALA MB 1 75 ILE H 5.610 . 5.610 4.091 3.510 4.841 . 0 0 "[ . 1 . 2]" 1
703 1 45 ALA MB 1 75 ILE HA 5.430 . 5.430 3.810 3.176 4.404 . 0 0 "[ . 1 . 2]" 1
704 1 45 ALA MB 1 75 ILE MD 3.720 . 3.720 2.706 2.085 3.686 . 0 0 "[ . 1 . 2]" 1
705 1 45 ALA MB 1 78 ILE MD 3.710 . 3.710 2.418 1.964 3.135 . 0 0 "[ . 1 . 2]" 1
706 1 46 GLU H 1 46 GLU QB 3.440 . 3.440 2.444 2.154 2.638 . 0 0 "[ . 1 . 2]" 1
707 1 46 GLU H 1 46 GLU HG2 4.820 . 4.820 3.004 2.077 4.479 . 0 0 "[ . 1 . 2]" 1
708 1 46 GLU H 1 46 GLU QG 3.990 . 3.990 2.564 2.064 4.009 0.019 13 0 "[ . 1 . 2]" 1
709 1 46 GLU H 1 46 GLU HG3 4.820 . 4.820 3.379 2.160 4.535 . 0 0 "[ . 1 . 2]" 1
710 1 46 GLU H 1 47 TYR H 3.950 . 3.950 2.697 2.587 2.824 . 0 0 "[ . 1 . 2]" 1
711 1 46 GLU H 1 47 TYR HB2 5.820 . 5.820 4.796 4.596 5.044 . 0 0 "[ . 1 . 2]" 1
712 1 46 GLU H 1 48 PHE H 5.570 . 5.570 4.112 3.915 4.405 . 0 0 "[ . 1 . 2]" 1
713 1 46 GLU H 1 49 PHE H 6.300 . 6.300 4.734 4.564 4.881 . 0 0 "[ . 1 . 2]" 1
714 1 46 GLU H 1 71 LEU MD2 6.160 . 6.160 4.711 4.468 5.016 . 0 0 "[ . 1 . 2]" 1
715 1 46 GLU H 1 87 ALA MB 5.580 . 5.580 4.488 4.102 4.998 . 0 0 "[ . 1 . 2]" 1
716 1 46 GLU H 1 90 MET ME 4.620 . 4.620 3.205 2.976 3.552 . 0 0 "[ . 1 . 2]" 1
717 1 46 GLU HA 1 49 PHE H 4.630 . 4.630 3.599 3.137 3.887 . 0 0 "[ . 1 . 2]" 1
718 1 46 GLU HA 1 49 PHE HB2 4.590 . 4.590 3.511 2.919 3.921 . 0 0 "[ . 1 . 2]" 1
719 1 46 GLU HA 1 49 PHE HB3 4.360 . 4.360 2.866 2.371 3.250 . 0 0 "[ . 1 . 2]" 1
720 1 46 GLU HA 1 49 PHE QD 5.330 . 5.330 4.088 3.664 4.430 . 0 0 "[ . 1 . 2]" 1
721 1 46 GLU HA 1 90 MET ME 3.500 . 3.500 2.101 1.801 2.451 . 0 0 "[ . 1 . 2]" 1
722 1 46 GLU QB 1 47 TYR H 3.980 . 3.980 2.600 2.346 3.588 . 0 0 "[ . 1 . 2]" 1
723 1 46 GLU QB 1 47 TYR HA 4.900 . 4.900 3.971 3.750 4.525 . 0 0 "[ . 1 . 2]" 1
724 1 46 GLU QB 1 49 PHE H 5.200 . 5.200 4.887 4.632 5.056 . 0 0 "[ . 1 . 2]" 1
725 1 46 GLU QG 1 47 TYR H 5.600 . 5.600 3.894 2.338 4.506 . 0 0 "[ . 1 . 2]" 1
726 1 46 GLU QG 1 47 TYR QD 6.060 . 6.060 4.762 3.506 5.821 . 0 0 "[ . 1 . 2]" 1
727 1 46 GLU QG 1 90 MET ME 3.760 . 3.760 3.062 1.892 3.851 0.091 6 0 "[ . 1 . 2]" 1
728 1 47 TYR H 1 47 TYR HB2 3.940 . 3.940 2.395 2.292 2.560 . 0 0 "[ . 1 . 2]" 1
729 1 47 TYR H 1 47 TYR HB3 4.380 . 4.380 3.597 3.553 3.649 . 0 0 "[ . 1 . 2]" 1
730 1 47 TYR H 1 47 TYR QD 3.680 . 3.680 2.784 2.031 3.371 . 0 0 "[ . 1 . 2]" 1
731 1 47 TYR H 1 47 TYR QE 5.060 . 5.060 4.611 4.331 4.984 . 0 0 "[ . 1 . 2]" 1
732 1 47 TYR H 1 48 PHE H 3.860 . 3.860 2.601 2.495 2.776 . 0 0 "[ . 1 . 2]" 1
733 1 47 TYR H 1 49 PHE H 5.840 . 5.840 3.978 3.759 4.130 . 0 0 "[ . 1 . 2]" 1
734 1 47 TYR H 1 90 MET ME 5.660 . 5.660 4.765 4.509 5.158 . 0 0 "[ . 1 . 2]" 1
735 1 47 TYR HA 1 47 TYR QD 4.080 . 4.080 2.545 1.966 3.128 . 0 0 "[ . 1 . 2]" 1
736 1 47 TYR HA 1 47 TYR QE 5.500 . 5.500 4.462 4.183 4.625 . 0 0 "[ . 1 . 2]" 1
737 1 47 TYR HA 1 50 ARG H 4.800 . 4.800 3.497 3.301 3.791 . 0 0 "[ . 1 . 2]" 1
738 1 47 TYR HA 1 50 ARG HB2 4.390 . 4.390 2.861 2.620 3.223 . 0 0 "[ . 1 . 2]" 1
739 1 47 TYR HA 1 50 ARG HB3 4.880 . 4.880 4.516 4.242 4.914 0.034 15 0 "[ . 1 . 2]" 1
740 1 47 TYR HA 1 50 ARG HD2 5.120 . 5.120 3.595 2.305 5.175 0.055 20 0 "[ . 1 . 2]" 1
741 1 47 TYR HA 1 50 ARG QD 4.490 . 4.490 2.943 2.222 3.682 . 0 0 "[ . 1 . 2]" 1
742 1 47 TYR HA 1 50 ARG HD3 5.120 . 5.120 3.926 2.248 5.001 . 0 0 "[ . 1 . 2]" 1
743 1 47 TYR HA 1 50 ARG QG 5.340 . 5.340 3.675 2.734 4.137 . 0 0 "[ . 1 . 2]" 1
744 1 47 TYR HA 1 51 ALA H 5.720 . 5.720 3.894 3.619 4.146 . 0 0 "[ . 1 . 2]" 1
745 1 47 TYR HB2 1 48 PHE H 4.610 . 4.610 2.857 2.706 3.101 . 0 0 "[ . 1 . 2]" 1
746 1 47 TYR HB3 1 48 PHE H 5.540 . 5.540 3.693 3.389 3.842 . 0 0 "[ . 1 . 2]" 1
747 1 48 PHE H 1 48 PHE HB2 3.900 . 3.900 2.502 2.448 2.559 . 0 0 "[ . 1 . 2]" 1
748 1 48 PHE H 1 48 PHE QD 4.280 . 4.280 3.323 3.228 3.417 . 0 0 "[ . 1 . 2]" 1
749 1 48 PHE H 1 51 ALA H 5.650 . 5.650 4.705 4.565 4.902 . 0 0 "[ . 1 . 2]" 1
750 1 48 PHE H 1 51 ALA MB 5.670 . 5.670 4.506 4.374 4.730 . 0 0 "[ . 1 . 2]" 1
751 1 48 PHE H 1 71 LEU MD1 5.010 . 5.010 4.924 4.621 5.089 0.079 18 0 "[ . 1 . 2]" 1
752 1 48 PHE HA 1 51 ALA MB 3.980 . 3.980 2.491 2.242 2.782 . 0 0 "[ . 1 . 2]" 1
753 1 48 PHE HB2 1 49 PHE H 4.200 . 4.200 2.825 2.605 2.988 . 0 0 "[ . 1 . 2]" 1
754 1 48 PHE HB2 1 71 LEU H 5.420 . 5.420 4.384 4.015 4.771 . 0 0 "[ . 1 . 2]" 1
755 1 48 PHE HB2 1 71 LEU HB2 4.890 . 4.890 3.648 3.258 4.700 . 0 0 "[ . 1 . 2]" 1
756 1 48 PHE HB2 1 71 LEU MD1 4.680 . 4.680 3.404 3.016 3.637 . 0 0 "[ . 1 . 2]" 1
757 1 48 PHE HB2 1 71 LEU MD2 4.610 . 4.610 3.315 2.560 3.673 . 0 0 "[ . 1 . 2]" 1
758 1 48 PHE HB2 1 71 LEU HG 4.340 . 4.340 2.003 1.738 2.235 . 0 0 "[ . 1 . 2]" 1
759 1 48 PHE HB3 1 49 PHE H 4.530 . 4.530 3.796 3.624 3.948 . 0 0 "[ . 1 . 2]" 1
760 1 48 PHE HB3 1 67 ALA MB 5.210 . 5.210 3.087 2.716 3.527 . 0 0 "[ . 1 . 2]" 1
761 1 48 PHE HB3 1 71 LEU H 5.200 . 5.200 3.509 3.120 3.951 . 0 0 "[ . 1 . 2]" 1
762 1 48 PHE HB3 1 71 LEU HA 4.890 . 4.890 3.333 3.022 4.048 . 0 0 "[ . 1 . 2]" 1
763 1 48 PHE HB3 1 71 LEU HB2 4.770 . 4.770 3.072 2.574 4.384 . 0 0 "[ . 1 . 2]" 1
764 1 48 PHE HB3 1 71 LEU HB3 5.430 . 5.430 4.555 4.189 5.282 . 0 0 "[ . 1 . 2]" 1
765 1 48 PHE HB3 1 71 LEU MD1 4.750 . 4.750 3.361 3.060 3.761 . 0 0 "[ . 1 . 2]" 1
766 1 48 PHE HB3 1 71 LEU MD2 4.650 . 4.650 4.218 3.592 4.649 . 0 0 "[ . 1 . 2]" 1
767 1 48 PHE HB3 1 71 LEU HG 4.710 . 4.710 2.704 2.197 3.138 . 0 0 "[ . 1 . 2]" 1
768 1 48 PHE QD 1 49 PHE H 5.490 . 5.490 4.544 4.436 4.655 . 0 0 "[ . 1 . 2]" 1
769 1 48 PHE QD 1 51 ALA H 6.090 . 6.090 5.424 5.104 5.653 . 0 0 "[ . 1 . 2]" 1
770 1 48 PHE QD 1 67 ALA HA 5.640 . 5.640 3.715 3.270 4.154 . 0 0 "[ . 1 . 2]" 1
771 1 48 PHE QD 1 67 ALA MB 4.870 . 4.870 3.790 3.550 4.112 . 0 0 "[ . 1 . 2]" 1
772 1 48 PHE QD 1 70 SER H 6.300 . 6.300 5.441 5.224 5.677 . 0 0 "[ . 1 . 2]" 1
773 1 48 PHE QD 1 70 SER HB2 5.520 . 5.520 4.162 3.440 5.098 . 0 0 "[ . 1 . 2]" 1
774 1 48 PHE QD 1 70 SER QB 4.760 . 4.760 3.377 3.073 3.786 . 0 0 "[ . 1 . 2]" 1
775 1 48 PHE QD 1 70 SER HB3 5.520 . 5.520 3.725 3.353 5.017 . 0 0 "[ . 1 . 2]" 1
776 1 48 PHE QD 1 71 LEU H 5.390 . 5.390 4.066 3.711 4.346 . 0 0 "[ . 1 . 2]" 1
777 1 48 PHE QD 1 71 LEU HA 4.290 . 4.290 2.169 1.857 2.729 . 0 0 "[ . 1 . 2]" 1
778 1 48 PHE QD 1 71 LEU HB2 5.820 . 5.820 4.306 3.781 5.101 . 0 0 "[ . 1 . 2]" 1
779 1 48 PHE QD 1 71 LEU MD1 4.750 . 4.750 4.645 4.273 4.931 0.181 16 0 "[ . 1 . 2]" 1
780 1 48 PHE QD 1 71 LEU MD2 4.880 . 4.880 3.609 2.770 4.037 . 0 0 "[ . 1 . 2]" 1
781 1 48 PHE QD 1 74 ALA H 6.300 . 6.300 4.344 3.772 4.856 . 0 0 "[ . 1 . 2]" 1
782 1 48 PHE QD 1 74 ALA MB 3.870 . 3.870 2.572 2.317 2.926 . 0 0 "[ . 1 . 2]" 1
783 1 48 PHE QE 1 70 SER H 6.300 . 6.300 5.901 5.674 6.211 . 0 0 "[ . 1 . 2]" 1
784 1 48 PHE QE 1 70 SER HA 5.460 . 5.460 4.748 4.301 5.085 . 0 0 "[ . 1 . 2]" 1
785 1 48 PHE QE 1 70 SER QB 4.800 . 4.800 3.323 2.917 3.942 . 0 0 "[ . 1 . 2]" 1
786 1 48 PHE QE 1 74 ALA H 6.300 . 6.300 4.243 3.786 4.744 . 0 0 "[ . 1 . 2]" 1
787 1 48 PHE QE 1 74 ALA MB 4.080 . 4.080 2.064 1.717 2.513 . 0 0 "[ . 1 . 2]" 1
788 1 48 PHE HZ 1 70 SER QB 5.690 . 5.690 3.667 3.008 4.653 . 0 0 "[ . 1 . 2]" 1
789 1 49 PHE H 1 49 PHE HB2 3.710 . 3.710 2.589 2.517 2.693 . 0 0 "[ . 1 . 2]" 1
790 1 49 PHE H 1 49 PHE HB3 3.730 . 3.730 2.524 2.405 2.596 . 0 0 "[ . 1 . 2]" 1
791 1 49 PHE H 1 49 PHE QD 4.790 . 4.790 4.229 4.202 4.256 . 0 0 "[ . 1 . 2]" 1
792 1 49 PHE H 1 50 ARG H 4.020 . 4.020 2.639 2.567 2.758 . 0 0 "[ . 1 . 2]" 1
793 1 49 PHE H 1 51 ALA H 5.090 . 5.090 3.930 3.802 4.134 . 0 0 "[ . 1 . 2]" 1
794 1 49 PHE H 1 71 LEU MD1 4.170 . 4.170 3.326 3.099 3.440 . 0 0 "[ . 1 . 2]" 1
795 1 49 PHE H 1 71 LEU MD2 4.620 . 4.620 3.861 2.903 4.116 . 0 0 "[ . 1 . 2]" 1
796 1 49 PHE H 1 71 LEU HG 4.810 . 4.810 3.320 3.008 4.000 . 0 0 "[ . 1 . 2]" 1
797 1 49 PHE H 1 90 MET HB3 5.740 . 5.740 5.119 4.598 5.747 0.007 12 0 "[ . 1 . 2]" 1
798 1 49 PHE H 1 90 MET ME 5.000 . 5.000 3.986 3.692 4.388 . 0 0 "[ . 1 . 2]" 1
799 1 49 PHE HA 1 49 PHE QD 3.660 . 3.660 2.316 2.130 2.548 . 0 0 "[ . 1 . 2]" 1
800 1 49 PHE HA 1 49 PHE QE 4.650 . 4.650 4.441 4.332 4.613 . 0 0 "[ . 1 . 2]" 1
801 1 49 PHE HA 1 51 ALA H 6.090 . 6.090 4.472 4.297 4.628 . 0 0 "[ . 1 . 2]" 1
802 1 49 PHE HA 1 52 ALA H 4.410 . 4.410 3.436 3.282 3.569 . 0 0 "[ . 1 . 2]" 1
803 1 49 PHE HA 1 52 ALA MB 3.820 . 3.820 2.549 2.373 2.696 . 0 0 "[ . 1 . 2]" 1
804 1 49 PHE HA 1 53 ILE H 5.850 . 5.850 4.324 4.146 4.470 . 0 0 "[ . 1 . 2]" 1
805 1 49 PHE HA 1 67 ALA MB 5.800 . 5.800 4.385 3.960 4.796 . 0 0 "[ . 1 . 2]" 1
806 1 49 PHE HA 1 71 LEU MD1 4.170 . 4.170 2.177 1.994 2.319 . 0 0 "[ . 1 . 2]" 1
807 1 49 PHE HA 1 71 LEU MD2 4.400 . 4.400 4.140 3.372 4.424 0.024 10 0 "[ . 1 . 2]" 1
808 1 49 PHE HA 1 90 MET ME 5.160 . 5.160 4.755 4.305 5.192 0.032 2 0 "[ . 1 . 2]" 1
809 1 49 PHE HA 1 94 ALA MB 5.630 . 5.630 3.613 3.109 4.001 . 0 0 "[ . 1 . 2]" 1
810 1 49 PHE HB2 1 50 ARG H 4.680 . 4.680 3.775 3.693 3.841 . 0 0 "[ . 1 . 2]" 1
811 1 49 PHE HB2 1 71 LEU MD1 4.530 . 4.530 2.247 1.959 2.883 . 0 0 "[ . 1 . 2]" 1
812 1 49 PHE HB2 1 71 LEU MD2 4.340 . 4.340 2.892 2.301 3.115 . 0 0 "[ . 1 . 2]" 1
813 1 49 PHE HB2 1 90 MET HB2 6.180 . 6.180 3.528 3.266 3.863 . 0 0 "[ . 1 . 2]" 1
814 1 49 PHE HB2 1 90 MET HB3 5.510 . 5.510 2.567 2.062 3.106 . 0 0 "[ . 1 . 2]" 1
815 1 49 PHE HB2 1 90 MET ME 4.190 . 4.190 2.617 2.102 3.019 . 0 0 "[ . 1 . 2]" 1
816 1 49 PHE HB3 1 50 ARG H 4.230 . 4.230 2.421 2.336 2.546 . 0 0 "[ . 1 . 2]" 1
817 1 49 PHE HB3 1 71 LEU MD1 4.710 . 4.710 3.717 3.505 4.173 . 0 0 "[ . 1 . 2]" 1
818 1 49 PHE HB3 1 71 LEU MD2 4.450 . 4.450 4.316 3.566 4.551 0.101 4 0 "[ . 1 . 2]" 1
819 1 49 PHE HB3 1 90 MET HB3 6.160 . 6.160 3.775 3.436 4.396 . 0 0 "[ . 1 . 2]" 1
820 1 49 PHE HB3 1 90 MET ME 3.910 . 3.910 3.283 2.710 3.664 . 0 0 "[ . 1 . 2]" 1
821 1 49 PHE QD 1 50 ARG H 5.010 . 5.010 3.748 3.441 3.999 . 0 0 "[ . 1 . 2]" 1
822 1 49 PHE QD 1 50 ARG HA 5.500 . 5.500 4.079 3.781 4.488 . 0 0 "[ . 1 . 2]" 1
823 1 49 PHE QD 1 50 ARG QG 6.100 . 6.100 3.172 2.520 4.096 . 0 0 "[ . 1 . 2]" 1
824 1 49 PHE QD 1 52 ALA MB 4.380 . 4.380 3.432 3.009 3.924 . 0 0 "[ . 1 . 2]" 1
825 1 49 PHE QD 1 53 ILE MD 4.230 . 4.230 3.234 2.715 3.481 . 0 0 "[ . 1 . 2]" 1
826 1 49 PHE QD 1 53 ILE HG12 6.300 . 6.300 4.867 4.601 4.956 . 0 0 "[ . 1 . 2]" 1
827 1 49 PHE QD 1 53 ILE HG13 6.300 . 6.300 4.039 3.804 4.212 . 0 0 "[ . 1 . 2]" 1
828 1 49 PHE QD 1 71 LEU MD1 4.020 . 4.020 2.313 1.940 2.997 . 0 0 "[ . 1 . 2]" 1
829 1 49 PHE QD 1 71 LEU MD2 4.270 . 4.270 4.003 3.576 4.281 0.011 14 0 "[ . 1 . 2]" 1
830 1 49 PHE QD 1 90 MET HA 5.200 . 5.200 3.787 3.330 4.330 . 0 0 "[ . 1 . 2]" 1
831 1 49 PHE QD 1 90 MET HB2 5.800 . 5.800 4.095 3.725 4.246 . 0 0 "[ . 1 . 2]" 1
832 1 49 PHE QD 1 90 MET HB3 4.420 . 4.420 2.709 2.222 2.939 . 0 0 "[ . 1 . 2]" 1
833 1 49 PHE QD 1 90 MET ME 4.050 . 4.050 3.763 3.283 4.156 0.106 20 0 "[ . 1 . 2]" 1
834 1 49 PHE QD 1 90 MET HG2 5.620 . 5.620 3.914 3.515 4.401 . 0 0 "[ . 1 . 2]" 1
835 1 49 PHE QD 1 90 MET HG3 6.120 . 6.120 4.894 4.648 5.147 . 0 0 "[ . 1 . 2]" 1
836 1 49 PHE QD 1 94 ALA MB 4.680 . 4.680 3.064 2.520 3.559 . 0 0 "[ . 1 . 2]" 1
837 1 49 PHE QE 1 53 ILE MD 3.930 . 3.930 2.783 2.497 3.137 . 0 0 "[ . 1 . 2]" 1
838 1 49 PHE QE 1 53 ILE HG12 6.150 . 6.150 4.242 4.003 4.501 . 0 0 "[ . 1 . 2]" 1
839 1 49 PHE QE 1 53 ILE HG13 6.150 . 6.150 4.166 3.837 4.448 . 0 0 "[ . 1 . 2]" 1
840 1 49 PHE QE 1 53 ILE MG 5.530 . 5.530 5.377 5.158 5.569 0.039 3 0 "[ . 1 . 2]" 1
841 1 49 PHE QE 1 71 LEU MD1 5.200 . 5.200 4.105 3.729 4.771 . 0 0 "[ . 1 . 2]" 1
842 1 49 PHE QE 1 90 MET HA 4.180 . 4.180 3.258 2.993 3.563 . 0 0 "[ . 1 . 2]" 1
843 1 49 PHE QE 1 90 MET HB3 4.890 . 4.890 3.614 3.136 4.007 . 0 0 "[ . 1 . 2]" 1
844 1 49 PHE QE 1 90 MET HG2 6.030 . 6.030 3.755 3.491 4.169 . 0 0 "[ . 1 . 2]" 1
845 1 49 PHE QE 1 93 LYS HB2 4.080 . 4.080 2.036 1.593 2.392 . 0 0 "[ . 1 . 2]" 1
846 1 49 PHE QE 1 93 LYS HB3 4.200 . 4.200 2.183 1.775 2.548 . 0 0 "[ . 1 . 2]" 1
847 1 49 PHE QE 1 93 LYS HG2 5.600 . 5.600 3.984 3.464 4.409 . 0 0 "[ . 1 . 2]" 1
848 1 49 PHE QE 1 93 LYS HG3 5.600 . 5.600 2.890 2.319 3.563 . 0 0 "[ . 1 . 2]" 1
849 1 49 PHE QE 1 94 ALA H 4.650 . 4.650 3.604 2.928 4.099 . 0 0 "[ . 1 . 2]" 1
850 1 49 PHE QE 1 94 ALA MB 4.890 . 4.890 3.988 3.299 4.641 . 0 0 "[ . 1 . 2]" 1
851 1 49 PHE QE 1 97 TRP HZ3 4.420 . 4.420 3.581 3.355 4.139 . 0 0 "[ . 1 . 2]" 1
852 1 49 PHE HZ 1 53 ILE MD 4.910 . 4.910 3.565 3.138 4.153 . 0 0 "[ . 1 . 2]" 1
853 1 49 PHE HZ 1 53 ILE HG12 6.300 . 6.300 4.433 4.056 4.824 . 0 0 "[ . 1 . 2]" 1
854 1 49 PHE HZ 1 53 ILE HG13 5.620 . 5.620 4.801 4.333 5.172 . 0 0 "[ . 1 . 2]" 1
855 1 49 PHE HZ 1 90 MET HA 4.940 . 4.940 4.087 3.693 4.747 . 0 0 "[ . 1 . 2]" 1
856 1 49 PHE HZ 1 90 MET HB3 5.950 . 5.950 4.666 4.093 5.221 . 0 0 "[ . 1 . 2]" 1
857 1 49 PHE HZ 1 93 LYS HB2 4.650 . 4.650 3.720 3.051 4.344 . 0 0 "[ . 1 . 2]" 1
858 1 49 PHE HZ 1 93 LYS HB3 4.750 . 4.750 3.512 2.948 3.814 . 0 0 "[ . 1 . 2]" 1
859 1 49 PHE HZ 1 93 LYS HD2 5.010 . 5.010 3.828 3.555 4.217 . 0 0 "[ . 1 . 2]" 1
860 1 49 PHE HZ 1 93 LYS QD 4.320 . 4.320 3.704 3.496 3.864 . 0 0 "[ . 1 . 2]" 1
861 1 49 PHE HZ 1 93 LYS HD3 5.010 . 5.010 5.098 3.820 5.231 0.221 5 0 "[ . 1 . 2]" 1
862 1 49 PHE HZ 1 93 LYS QE 5.230 . 5.230 4.297 3.520 5.373 0.143 11 0 "[ . 1 . 2]" 1
863 1 49 PHE HZ 1 93 LYS QG 4.740 . 4.740 2.717 2.348 3.340 . 0 0 "[ . 1 . 2]" 1
864 1 49 PHE HZ 1 97 TRP HH2 3.500 . 3.500 3.058 2.901 3.187 . 0 0 "[ . 1 . 2]" 1
865 1 49 PHE HZ 1 97 TRP HZ3 5.090 . 5.090 5.054 4.805 5.186 0.096 1 0 "[ . 1 . 2]" 1
866 1 50 ARG H 1 50 ARG HB2 3.890 . 3.890 2.491 2.297 2.642 . 0 0 "[ . 1 . 2]" 1
867 1 50 ARG H 1 50 ARG HB3 4.270 . 4.270 3.595 3.558 3.619 . 0 0 "[ . 1 . 2]" 1
868 1 50 ARG H 1 50 ARG HD2 5.750 . 5.750 4.201 3.762 4.856 . 0 0 "[ . 1 . 2]" 1
869 1 50 ARG H 1 50 ARG QD 5.050 . 5.050 3.756 3.557 4.045 . 0 0 "[ . 1 . 2]" 1
870 1 50 ARG H 1 50 ARG HD3 5.750 . 5.750 4.457 3.723 4.857 . 0 0 "[ . 1 . 2]" 1
871 1 50 ARG H 1 50 ARG HG2 4.340 . 4.340 3.509 3.279 3.853 . 0 0 "[ . 1 . 2]" 1
872 1 50 ARG H 1 50 ARG QG 3.700 . 3.700 2.230 1.965 2.679 . 0 0 "[ . 1 . 2]" 1
873 1 50 ARG H 1 50 ARG HG3 4.340 . 4.340 2.257 1.981 2.733 . 0 0 "[ . 1 . 2]" 1
874 1 50 ARG H 1 51 ALA H 3.950 . 3.950 2.620 2.497 2.798 . 0 0 "[ . 1 . 2]" 1
875 1 50 ARG H 1 53 ILE MD 5.710 . 5.710 4.232 4.073 4.545 . 0 0 "[ . 1 . 2]" 1
876 1 50 ARG H 1 71 LEU MD1 5.660 . 5.660 4.842 4.660 5.095 . 0 0 "[ . 1 . 2]" 1
877 1 50 ARG HA 1 50 ARG QG 3.780 . 3.780 2.506 2.383 2.645 . 0 0 "[ . 1 . 2]" 1
878 1 50 ARG HA 1 53 ILE H 4.670 . 4.670 3.402 3.153 3.783 . 0 0 "[ . 1 . 2]" 1
879 1 50 ARG HA 1 53 ILE HB 4.570 . 4.570 2.889 2.564 3.486 . 0 0 "[ . 1 . 2]" 1
880 1 50 ARG HA 1 53 ILE MD 3.740 . 3.740 2.053 1.877 2.332 . 0 0 "[ . 1 . 2]" 1
881 1 50 ARG HA 1 53 ILE HG12 6.250 . 6.250 4.315 4.040 4.761 . 0 0 "[ . 1 . 2]" 1
882 1 50 ARG HA 1 53 ILE HG13 4.760 . 4.760 2.938 2.641 3.424 . 0 0 "[ . 1 . 2]" 1
883 1 50 ARG HA 1 53 ILE MG 4.880 . 4.880 4.119 3.923 4.602 . 0 0 "[ . 1 . 2]" 1
884 1 50 ARG HA 1 54 VAL H 6.270 . 6.270 4.541 4.205 5.053 . 0 0 "[ . 1 . 2]" 1
885 1 50 ARG HA 1 54 VAL MG2 4.890 . 4.890 4.281 4.059 4.601 . 0 0 "[ . 1 . 2]" 1
886 1 50 ARG HB2 1 51 ALA H 5.290 . 5.290 2.709 2.348 2.929 . 0 0 "[ . 1 . 2]" 1
887 1 50 ARG HB3 1 51 ALA H 4.910 . 4.910 3.733 3.332 3.890 . 0 0 "[ . 1 . 2]" 1
888 1 50 ARG HB3 1 53 ILE MD 5.380 . 5.380 3.809 3.500 4.399 . 0 0 "[ . 1 . 2]" 1
889 1 50 ARG QG 1 53 ILE MD 5.310 . 5.310 3.039 2.572 3.804 . 0 0 "[ . 1 . 2]" 1
890 1 51 ALA H 1 51 ALA MB 3.350 . 3.350 2.247 2.212 2.276 . 0 0 "[ . 1 . 2]" 1
891 1 51 ALA H 1 52 ALA H 3.800 . 3.800 2.662 2.594 2.739 . 0 0 "[ . 1 . 2]" 1
892 1 51 ALA H 1 52 ALA HA 6.300 . 6.300 5.291 5.229 5.357 . 0 0 "[ . 1 . 2]" 1
893 1 51 ALA H 1 52 ALA MB 4.970 . 4.970 4.332 4.264 4.410 . 0 0 "[ . 1 . 2]" 1
894 1 51 ALA H 1 53 ILE H 5.680 . 5.680 4.110 4.018 4.230 . 0 0 "[ . 1 . 2]" 1
895 1 51 ALA H 1 54 VAL H 5.430 . 5.430 4.963 4.838 5.176 . 0 0 "[ . 1 . 2]" 1
896 1 51 ALA HA 1 54 VAL H 4.660 . 4.660 3.579 3.334 3.823 . 0 0 "[ . 1 . 2]" 1
897 1 51 ALA HA 1 54 VAL HB 4.600 . 4.600 3.141 2.751 3.636 . 0 0 "[ . 1 . 2]" 1
898 1 51 ALA HA 1 54 VAL MG2 4.560 . 4.560 3.015 2.585 3.369 . 0 0 "[ . 1 . 2]" 1
899 1 51 ALA HA 1 55 PHE H 6.050 . 6.050 4.346 4.186 4.769 . 0 0 "[ . 1 . 2]" 1
900 1 51 ALA HA 1 55 PHE QE 5.870 . 5.870 4.301 3.944 4.556 . 0 0 "[ . 1 . 2]" 1
901 1 51 ALA MB 1 52 ALA H 3.640 . 3.640 2.457 2.335 2.646 . 0 0 "[ . 1 . 2]" 1
902 1 51 ALA MB 1 55 PHE H 6.080 . 6.080 4.615 4.503 4.885 . 0 0 "[ . 1 . 2]" 1
903 1 51 ALA MB 1 55 PHE QD 4.430 . 4.430 3.265 2.974 3.799 . 0 0 "[ . 1 . 2]" 1
904 1 51 ALA MB 1 55 PHE QE 4.170 . 4.170 2.274 2.101 2.645 . 0 0 "[ . 1 . 2]" 1
905 1 51 ALA MB 1 55 PHE HZ 4.760 . 4.760 3.643 2.507 4.100 . 0 0 "[ . 1 . 2]" 1
906 1 52 ALA H 1 52 ALA MB 3.270 . 3.270 2.254 2.221 2.287 . 0 0 "[ . 1 . 2]" 1
907 1 52 ALA H 1 53 ILE H 4.070 . 4.070 2.716 2.666 2.785 . 0 0 "[ . 1 . 2]" 1
908 1 52 ALA H 1 53 ILE HA 5.450 . 5.450 5.351 5.315 5.395 . 0 0 "[ . 1 . 2]" 1
909 1 52 ALA H 1 53 ILE MD 6.070 . 6.070 5.287 5.143 5.409 . 0 0 "[ . 1 . 2]" 1
910 1 52 ALA H 1 53 ILE HG13 4.880 . 4.880 4.422 4.273 4.605 . 0 0 "[ . 1 . 2]" 1
911 1 52 ALA H 1 54 VAL H 4.950 . 4.950 4.300 4.084 4.478 . 0 0 "[ . 1 . 2]" 1
912 1 52 ALA H 1 55 PHE QD 5.690 . 5.690 3.947 3.708 4.187 . 0 0 "[ . 1 . 2]" 1
913 1 52 ALA H 1 67 ALA MB 4.060 . 4.060 3.080 2.814 3.552 . 0 0 "[ . 1 . 2]" 1
914 1 52 ALA H 1 71 LEU MD1 5.850 . 5.850 4.529 4.282 4.801 . 0 0 "[ . 1 . 2]" 1
915 1 52 ALA H 1 97 TRP HZ3 6.300 . 6.300 4.528 4.252 4.940 . 0 0 "[ . 1 . 2]" 1
916 1 52 ALA HA 1 54 VAL H 6.300 . 6.300 4.421 4.175 4.634 . 0 0 "[ . 1 . 2]" 1
917 1 52 ALA HA 1 55 PHE H 4.850 . 4.850 3.420 3.220 3.740 . 0 0 "[ . 1 . 2]" 1
918 1 52 ALA HA 1 55 PHE HB2 4.380 . 4.380 2.575 2.254 2.998 . 0 0 "[ . 1 . 2]" 1
919 1 52 ALA HA 1 55 PHE QD 3.960 . 3.960 2.214 1.830 2.546 . 0 0 "[ . 1 . 2]" 1
920 1 52 ALA HA 1 55 PHE QE 4.570 . 4.570 4.268 3.693 4.640 0.070 13 0 "[ . 1 . 2]" 1
921 1 52 ALA HA 1 56 TYR H 5.040 . 5.040 4.005 3.745 4.160 . 0 0 "[ . 1 . 2]" 1
922 1 52 ALA HA 1 64 LEU MD1 4.090 . 4.090 2.813 2.567 3.075 . 0 0 "[ . 1 . 2]" 1
923 1 52 ALA HA 1 67 ALA MB 4.240 . 4.240 2.754 2.444 3.232 . 0 0 "[ . 1 . 2]" 1
924 1 52 ALA MB 1 53 ILE H 3.600 . 3.600 2.715 2.592 2.806 . 0 0 "[ . 1 . 2]" 1
925 1 52 ALA MB 1 53 ILE HA 5.000 . 5.000 4.018 3.953 4.071 . 0 0 "[ . 1 . 2]" 1
926 1 52 ALA MB 1 55 PHE HB2 5.880 . 5.880 4.026 3.763 4.438 . 0 0 "[ . 1 . 2]" 1
927 1 52 ALA MB 1 56 TYR H 5.230 . 5.230 4.569 4.392 4.683 . 0 0 "[ . 1 . 2]" 1
928 1 52 ALA MB 1 64 LEU MD1 3.220 . 3.220 2.057 1.837 2.381 . 0 0 "[ . 1 . 2]" 1
929 1 52 ALA MB 1 68 ALA H 5.100 . 5.100 3.949 3.684 4.348 . 0 0 "[ . 1 . 2]" 1
930 1 52 ALA MB 1 71 LEU MD1 4.070 . 4.070 2.986 2.659 3.250 . 0 0 "[ . 1 . 2]" 1
931 1 52 ALA MB 1 94 ALA HA 4.650 . 4.650 3.274 2.959 3.731 . 0 0 "[ . 1 . 2]" 1
932 1 52 ALA MB 1 97 TRP HE3 4.140 . 4.140 2.640 2.328 3.153 . 0 0 "[ . 1 . 2]" 1
933 1 52 ALA MB 1 97 TRP HH2 4.630 . 4.630 4.180 3.989 4.462 . 0 0 "[ . 1 . 2]" 1
934 1 52 ALA MB 1 97 TRP HZ3 3.850 . 3.850 2.218 2.006 2.615 . 0 0 "[ . 1 . 2]" 1
935 1 53 ILE H 1 53 ILE HB 3.830 . 3.830 2.519 2.442 2.632 . 0 0 "[ . 1 . 2]" 1
936 1 53 ILE H 1 53 ILE MD 4.330 . 4.330 3.623 3.561 3.691 . 0 0 "[ . 1 . 2]" 1
937 1 53 ILE H 1 53 ILE HG12 4.540 . 4.540 3.517 3.399 3.661 . 0 0 "[ . 1 . 2]" 1
938 1 53 ILE H 1 53 ILE HG13 3.700 . 3.700 2.246 2.125 2.378 . 0 0 "[ . 1 . 2]" 1
939 1 53 ILE H 1 53 ILE MG 4.250 . 4.250 3.817 3.798 3.846 . 0 0 "[ . 1 . 2]" 1
940 1 53 ILE H 1 54 VAL H 3.940 . 3.940 2.741 2.644 2.841 . 0 0 "[ . 1 . 2]" 1
941 1 53 ILE H 1 54 VAL HA 5.790 . 5.790 5.368 5.306 5.439 . 0 0 "[ . 1 . 2]" 1
942 1 53 ILE H 1 54 VAL MG2 5.420 . 5.420 4.081 3.852 4.299 . 0 0 "[ . 1 . 2]" 1
943 1 53 ILE H 1 55 PHE H 5.660 . 5.660 4.213 4.018 4.432 . 0 0 "[ . 1 . 2]" 1
944 1 53 ILE H 1 56 TYR H 5.750 . 5.750 4.706 4.571 4.820 . 0 0 "[ . 1 . 2]" 1
945 1 53 ILE H 1 67 ALA MB 5.890 . 5.890 5.025 4.831 5.522 . 0 0 "[ . 1 . 2]" 1
946 1 53 ILE H 1 97 TRP HH2 4.940 . 4.940 4.354 4.142 4.655 . 0 0 "[ . 1 . 2]" 1
947 1 53 ILE H 1 97 TRP HZ3 4.790 . 4.790 3.196 2.979 3.583 . 0 0 "[ . 1 . 2]" 1
948 1 53 ILE HA 1 53 ILE MD 4.510 . 4.510 3.904 3.870 3.933 . 0 0 "[ . 1 . 2]" 1
949 1 53 ILE HA 1 53 ILE HG13 4.300 . 4.300 2.996 2.922 3.109 . 0 0 "[ . 1 . 2]" 1
950 1 53 ILE HA 1 53 ILE MG 3.700 . 3.700 2.539 2.454 2.594 . 0 0 "[ . 1 . 2]" 1
951 1 53 ILE HA 1 56 TYR H 5.250 . 5.250 3.674 3.474 3.992 . 0 0 "[ . 1 . 2]" 1
952 1 53 ILE HA 1 56 TYR HB3 4.610 . 4.610 2.732 2.467 3.187 . 0 0 "[ . 1 . 2]" 1
953 1 53 ILE HA 1 56 TYR QD 4.430 . 4.430 3.765 3.111 4.241 . 0 0 "[ . 1 . 2]" 1
954 1 53 ILE HA 1 57 LYS H 5.830 . 5.830 4.161 3.905 4.332 . 0 0 "[ . 1 . 2]" 1
955 1 53 ILE HA 1 97 TRP HH2 4.470 . 4.470 3.729 3.350 4.257 . 0 0 "[ . 1 . 2]" 1
956 1 53 ILE HA 1 97 TRP HZ2 5.170 . 5.170 4.901 4.586 5.199 0.029 16 0 "[ . 1 . 2]" 1
957 1 53 ILE HA 1 97 TRP HZ3 4.160 . 4.160 3.275 2.698 3.871 . 0 0 "[ . 1 . 2]" 1
958 1 53 ILE HB 1 53 ILE MD 3.600 . 3.600 2.458 2.426 2.493 . 0 0 "[ . 1 . 2]" 1
959 1 53 ILE HB 1 54 VAL H 3.620 . 3.620 2.571 2.400 2.697 . 0 0 "[ . 1 . 2]" 1
960 1 53 ILE HB 1 54 VAL MG2 4.980 . 4.980 3.076 2.905 3.268 . 0 0 "[ . 1 . 2]" 1
961 1 53 ILE HB 1 97 TRP HZ3 6.120 . 6.120 4.889 4.593 5.240 . 0 0 "[ . 1 . 2]" 1
962 1 53 ILE MD 1 54 VAL H 5.180 . 5.180 4.600 4.473 4.680 . 0 0 "[ . 1 . 2]" 1
963 1 53 ILE MD 1 97 TRP HH2 3.910 . 3.910 3.008 2.759 3.156 . 0 0 "[ . 1 . 2]" 1
964 1 53 ILE MD 1 97 TRP HZ2 5.130 . 5.130 4.407 4.079 4.646 . 0 0 "[ . 1 . 2]" 1
965 1 53 ILE MD 1 97 TRP HZ3 4.980 . 4.980 4.275 4.008 4.427 . 0 0 "[ . 1 . 2]" 1
966 1 53 ILE HG12 1 54 VAL H 6.300 . 6.300 5.039 4.929 5.094 . 0 0 "[ . 1 . 2]" 1
967 1 53 ILE HG12 1 97 TRP HH2 3.480 . 3.480 2.088 1.960 2.289 . 0 0 "[ . 1 . 2]" 1
968 1 53 ILE HG12 1 97 TRP HZ2 4.530 . 4.530 3.626 3.369 3.817 . 0 0 "[ . 1 . 2]" 1
969 1 53 ILE HG12 1 97 TRP HZ3 4.470 . 4.470 3.346 3.157 3.513 . 0 0 "[ . 1 . 2]" 1
970 1 53 ILE HG13 1 54 VAL H 5.300 . 5.300 4.344 4.199 4.442 . 0 0 "[ . 1 . 2]" 1
971 1 53 ILE HG13 1 97 TRP HH2 3.760 . 3.760 2.664 2.569 2.861 . 0 0 "[ . 1 . 2]" 1
972 1 53 ILE HG13 1 97 TRP HZ2 4.820 . 4.820 4.892 4.821 4.970 0.150 11 0 "[ . 1 . 2]" 1
973 1 53 ILE HG13 1 97 TRP HZ3 4.140 . 4.140 2.922 2.668 3.208 . 0 0 "[ . 1 . 2]" 1
974 1 53 ILE MG 1 54 VAL H 4.230 . 4.230 3.314 3.123 3.520 . 0 0 "[ . 1 . 2]" 1
975 1 53 ILE MG 1 54 VAL HA 4.390 . 4.390 3.349 3.149 3.525 . 0 0 "[ . 1 . 2]" 1
976 1 53 ILE MG 1 55 PHE H 6.160 . 6.160 5.094 4.860 5.292 . 0 0 "[ . 1 . 2]" 1
977 1 53 ILE MG 1 56 TYR H 6.030 . 6.030 4.845 4.700 5.190 . 0 0 "[ . 1 . 2]" 1
978 1 53 ILE MG 1 56 TYR QD 4.950 . 4.950 3.981 3.244 4.722 . 0 0 "[ . 1 . 2]" 1
979 1 53 ILE MG 1 57 LYS H 5.760 . 5.760 4.162 4.042 4.355 . 0 0 "[ . 1 . 2]" 1
980 1 53 ILE MG 1 57 LYS QD 4.510 . 4.510 2.988 2.175 4.184 . 0 0 "[ . 1 . 2]" 1
981 1 53 ILE MG 1 57 LYS QE 4.640 . 4.640 2.606 1.776 4.695 0.055 19 0 "[ . 1 . 2]" 1
982 1 53 ILE MG 1 57 LYS HG2 5.340 . 5.340 3.879 3.336 4.492 . 0 0 "[ . 1 . 2]" 1
983 1 53 ILE MG 1 57 LYS QG 4.670 . 4.670 3.691 2.921 4.102 . 0 0 "[ . 1 . 2]" 1
984 1 53 ILE MG 1 57 LYS HG3 5.340 . 5.340 4.828 3.007 5.410 0.070 14 0 "[ . 1 . 2]" 1
985 1 53 ILE MG 1 97 TRP HH2 5.160 . 5.160 4.116 3.933 4.353 . 0 0 "[ . 1 . 2]" 1
986 1 54 VAL H 1 54 VAL HB 3.890 . 3.890 2.580 2.439 2.668 . 0 0 "[ . 1 . 2]" 1
987 1 54 VAL H 1 54 VAL MG1 4.370 . 4.370 3.817 3.763 3.843 . 0 0 "[ . 1 . 2]" 1
988 1 54 VAL H 1 54 VAL MG2 3.510 . 3.510 2.058 1.914 2.166 . 0 0 "[ . 1 . 2]" 1
989 1 54 VAL H 1 55 PHE H 3.730 . 3.730 2.673 2.499 2.799 . 0 0 "[ . 1 . 2]" 1
990 1 54 VAL H 1 55 PHE HA 6.300 . 6.300 5.316 5.187 5.400 . 0 0 "[ . 1 . 2]" 1
991 1 54 VAL H 1 55 PHE HB2 6.300 . 6.300 4.823 4.583 4.994 . 0 0 "[ . 1 . 2]" 1
992 1 54 VAL H 1 56 TYR H 5.310 . 5.310 4.032 3.751 4.359 . 0 0 "[ . 1 . 2]" 1
993 1 54 VAL H 1 57 LYS H 5.170 . 5.170 4.861 4.636 5.037 . 0 0 "[ . 1 . 2]" 1
994 1 54 VAL HA 1 54 VAL MG1 3.750 . 3.750 2.454 2.409 2.515 . 0 0 "[ . 1 . 2]" 1
995 1 54 VAL HA 1 54 VAL MG2 3.600 . 3.600 2.451 2.383 2.501 . 0 0 "[ . 1 . 2]" 1
996 1 54 VAL HA 1 56 TYR H 5.740 . 5.740 4.348 4.065 4.745 . 0 0 "[ . 1 . 2]" 1
997 1 54 VAL HA 1 57 LYS H 4.960 . 4.960 3.685 3.419 3.927 . 0 0 "[ . 1 . 2]" 1
998 1 54 VAL HA 1 57 LYS QB 4.510 . 4.510 3.183 2.388 4.300 . 0 0 "[ . 1 . 2]" 1
999 1 54 VAL HA 1 57 LYS QD 5.250 . 5.250 3.281 2.216 5.080 . 0 0 "[ . 1 . 2]" 1
1000 1 54 VAL HA 1 57 LYS QE 6.230 . 6.230 4.265 1.828 6.001 . 0 0 "[ . 1 . 2]" 1
1001 1 54 VAL HA 1 57 LYS QG 5.020 . 5.020 3.317 1.949 4.452 . 0 0 "[ . 1 . 2]" 1
1002 1 54 VAL HB 1 55 PHE H 3.800 . 3.800 2.623 2.441 2.822 . 0 0 "[ . 1 . 2]" 1
1003 1 54 VAL MG1 1 55 PHE H 4.550 . 4.550 3.520 3.283 3.684 . 0 0 "[ . 1 . 2]" 1
1004 1 54 VAL MG1 1 55 PHE HA 5.270 . 5.270 3.638 3.355 3.843 . 0 0 "[ . 1 . 2]" 1
1005 1 54 VAL MG1 1 56 TYR H 6.300 . 6.300 5.067 4.842 5.373 . 0 0 "[ . 1 . 2]" 1
1006 1 54 VAL MG1 1 58 GLU H 5.890 . 5.890 4.339 4.130 4.636 . 0 0 "[ . 1 . 2]" 1
1007 1 54 VAL MG1 1 58 GLU QB 4.660 . 4.660 3.863 3.264 4.342 . 0 0 "[ . 1 . 2]" 1
1008 1 54 VAL MG1 1 58 GLU QG 4.560 . 4.560 3.190 2.373 4.846 0.286 4 0 "[ . 1 . 2]" 1
1009 1 54 VAL MG2 1 55 PHE H 4.920 . 4.920 3.821 3.644 3.955 . 0 0 "[ . 1 . 2]" 1
1010 1 55 PHE H 1 55 PHE HB2 3.980 . 3.980 2.488 2.397 2.592 . 0 0 "[ . 1 . 2]" 1
1011 1 55 PHE H 1 55 PHE HB3 4.260 . 4.260 3.627 3.607 3.653 . 0 0 "[ . 1 . 2]" 1
1012 1 55 PHE H 1 64 LEU MD1 5.640 . 5.640 4.458 4.180 4.902 . 0 0 "[ . 1 . 2]" 1
1013 1 55 PHE HA 1 55 PHE QD 3.800 . 3.800 2.241 2.093 2.395 . 0 0 "[ . 1 . 2]" 1
1014 1 55 PHE HA 1 55 PHE QE 4.470 . 4.470 4.432 4.341 4.479 0.009 16 0 "[ . 1 . 2]" 1
1015 1 55 PHE HA 1 58 GLU H 5.120 . 5.120 3.584 3.264 3.822 . 0 0 "[ . 1 . 2]" 1
1016 1 55 PHE HA 1 58 GLU HB2 5.440 . 5.440 3.087 2.503 4.897 . 0 0 "[ . 1 . 2]" 1
1017 1 55 PHE HA 1 58 GLU QB 4.760 . 4.760 2.852 2.485 4.057 . 0 0 "[ . 1 . 2]" 1
1018 1 55 PHE HA 1 58 GLU HB3 5.440 . 5.440 4.210 2.616 4.799 . 0 0 "[ . 1 . 2]" 1
1019 1 55 PHE HA 1 60 ASP H 5.400 . 5.400 3.536 3.259 3.759 . 0 0 "[ . 1 . 2]" 1
1020 1 55 PHE HA 1 60 ASP HB2 5.030 . 5.030 3.894 2.979 4.533 . 0 0 "[ . 1 . 2]" 1
1021 1 55 PHE HA 1 60 ASP HB3 5.160 . 5.160 2.894 2.468 4.549 . 0 0 "[ . 1 . 2]" 1
1022 1 55 PHE HB2 1 56 TYR H 4.360 . 4.360 2.815 2.478 3.066 . 0 0 "[ . 1 . 2]" 1
1023 1 55 PHE HB2 1 64 LEU H 5.270 . 5.270 3.673 3.250 3.984 . 0 0 "[ . 1 . 2]" 1
1024 1 55 PHE HB2 1 64 LEU HA 4.570 . 4.570 2.739 2.439 3.065 . 0 0 "[ . 1 . 2]" 1
1025 1 55 PHE HB2 1 64 LEU HB2 5.190 . 5.190 2.817 2.631 3.098 . 0 0 "[ . 1 . 2]" 1
1026 1 55 PHE HB2 1 64 LEU HB3 6.300 . 6.300 4.386 4.149 4.670 . 0 0 "[ . 1 . 2]" 1
1027 1 55 PHE HB2 1 64 LEU MD1 5.000 . 5.000 3.066 2.648 3.629 . 0 0 "[ . 1 . 2]" 1
1028 1 55 PHE HB2 1 67 ALA MB 5.610 . 5.610 4.111 3.645 4.413 . 0 0 "[ . 1 . 2]" 1
1029 1 55 PHE HB3 1 56 TYR H 4.880 . 4.880 3.752 3.424 3.970 . 0 0 "[ . 1 . 2]" 1
1030 1 55 PHE HB3 1 60 ASP H 5.460 . 5.460 3.898 3.473 4.137 . 0 0 "[ . 1 . 2]" 1
1031 1 55 PHE HB3 1 60 ASP HB2 4.970 . 4.970 4.394 2.057 4.766 . 0 0 "[ . 1 . 2]" 1
1032 1 55 PHE HB3 1 60 ASP HB3 5.250 . 5.250 2.820 2.521 3.334 . 0 0 "[ . 1 . 2]" 1
1033 1 55 PHE HB3 1 63 GLY H 5.780 . 5.780 4.141 3.791 4.417 . 0 0 "[ . 1 . 2]" 1
1034 1 55 PHE HB3 1 64 LEU H 3.850 . 3.850 2.641 2.417 2.927 . 0 0 "[ . 1 . 2]" 1
1035 1 55 PHE HB3 1 64 LEU HA 4.980 . 4.980 3.275 2.765 3.744 . 0 0 "[ . 1 . 2]" 1
1036 1 55 PHE HB3 1 64 LEU HB2 4.570 . 4.570 2.547 2.074 3.241 . 0 0 "[ . 1 . 2]" 1
1037 1 55 PHE HB3 1 64 LEU MD1 4.560 . 4.560 3.904 3.385 4.431 . 0 0 "[ . 1 . 2]" 1
1038 1 55 PHE HB3 1 67 ALA MB 5.670 . 5.670 4.926 4.449 5.385 . 0 0 "[ . 1 . 2]" 1
1039 1 55 PHE QD 1 56 TYR H 5.530 . 5.530 4.504 4.267 4.635 . 0 0 "[ . 1 . 2]" 1
1040 1 55 PHE QD 1 60 ASP H 5.920 . 5.920 4.607 4.281 5.161 . 0 0 "[ . 1 . 2]" 1
1041 1 55 PHE QD 1 60 ASP HB2 4.480 . 4.480 3.743 3.255 4.467 . 0 0 "[ . 1 . 2]" 1
1042 1 55 PHE QD 1 60 ASP HB3 4.820 . 4.820 2.694 2.126 4.559 . 0 0 "[ . 1 . 2]" 1
1043 1 55 PHE QD 1 63 GLY H 6.040 . 6.040 4.504 4.173 5.340 . 0 0 "[ . 1 . 2]" 1
1044 1 55 PHE QD 1 63 GLY HA2 6.260 . 6.260 4.445 4.215 4.628 . 0 0 "[ . 1 . 2]" 1
1045 1 55 PHE QD 1 63 GLY HA3 5.570 . 5.570 3.302 3.082 3.599 . 0 0 "[ . 1 . 2]" 1
1046 1 55 PHE QD 1 64 LEU H 5.150 . 5.150 3.973 3.694 4.316 . 0 0 "[ . 1 . 2]" 1
1047 1 55 PHE QD 1 64 LEU HA 4.210 . 4.210 2.949 2.122 3.363 . 0 0 "[ . 1 . 2]" 1
1048 1 55 PHE QD 1 67 ALA H 5.920 . 5.920 4.394 3.828 4.959 . 0 0 "[ . 1 . 2]" 1
1049 1 55 PHE QD 1 67 ALA MB 4.050 . 4.050 2.631 2.130 3.207 . 0 0 "[ . 1 . 2]" 1
1050 1 55 PHE QE 1 63 GLY HA2 5.830 . 5.830 4.260 4.041 4.570 . 0 0 "[ . 1 . 2]" 1
1051 1 55 PHE QE 1 63 GLY HA3 5.660 . 5.660 3.537 3.189 4.457 . 0 0 "[ . 1 . 2]" 1
1052 1 55 PHE QE 1 67 ALA H 6.300 . 6.300 4.644 4.085 5.342 . 0 0 "[ . 1 . 2]" 1
1053 1 55 PHE QE 1 67 ALA MB 4.180 . 4.180 2.627 1.889 3.676 . 0 0 "[ . 1 . 2]" 1
1054 1 56 TYR H 1 56 TYR HB2 3.730 . 3.730 2.666 2.563 2.736 . 0 0 "[ . 1 . 2]" 1
1055 1 56 TYR H 1 56 TYR HB3 3.690 . 3.690 2.408 2.318 2.497 . 0 0 "[ . 1 . 2]" 1
1056 1 56 TYR H 1 56 TYR QD 4.400 . 4.400 4.220 4.179 4.255 . 0 0 "[ . 1 . 2]" 1
1057 1 56 TYR H 1 57 LYS H 4.090 . 4.090 2.686 2.594 2.830 . 0 0 "[ . 1 . 2]" 1
1058 1 56 TYR H 1 57 LYS QB 5.240 . 5.240 4.566 4.245 5.010 . 0 0 "[ . 1 . 2]" 1
1059 1 56 TYR H 1 58 GLU H 5.840 . 5.840 3.995 3.823 4.212 . 0 0 "[ . 1 . 2]" 1
1060 1 56 TYR H 1 64 LEU HB2 5.050 . 5.050 3.981 3.262 4.298 . 0 0 "[ . 1 . 2]" 1
1061 1 56 TYR H 1 64 LEU MD1 4.550 . 4.550 3.079 2.777 3.512 . 0 0 "[ . 1 . 2]" 1
1062 1 56 TYR H 1 64 LEU MD2 5.040 . 5.040 4.220 3.864 4.573 . 0 0 "[ . 1 . 2]" 1
1063 1 56 TYR HA 1 56 TYR QD 3.170 . 3.170 2.529 2.318 2.741 . 0 0 "[ . 1 . 2]" 1
1064 1 56 TYR HA 1 58 GLU H 6.070 . 6.070 4.367 4.162 4.481 . 0 0 "[ . 1 . 2]" 1
1065 1 56 TYR HA 1 59 HIS H 4.590 . 4.590 3.309 3.059 3.567 . 0 0 "[ . 1 . 2]" 1
1066 1 56 TYR HA 1 60 ASP H 5.850 . 5.850 4.110 3.544 4.377 . 0 0 "[ . 1 . 2]" 1
1067 1 56 TYR HA 1 64 LEU MD1 4.860 . 4.860 3.226 2.969 3.573 . 0 0 "[ . 1 . 2]" 1
1068 1 56 TYR HA 1 64 LEU MD2 4.300 . 4.300 2.535 2.212 2.995 . 0 0 "[ . 1 . 2]" 1
1069 1 56 TYR HB2 1 57 LYS H 4.860 . 4.860 3.896 3.801 4.041 . 0 0 "[ . 1 . 2]" 1
1070 1 56 TYR HB2 1 64 LEU MD1 4.460 . 4.460 2.112 1.925 2.434 . 0 0 "[ . 1 . 2]" 1
1071 1 56 TYR HB2 1 64 LEU MD2 4.630 . 4.630 2.903 2.305 3.284 . 0 0 "[ . 1 . 2]" 1
1072 1 56 TYR HB2 1 97 TRP HE3 4.760 . 4.760 3.247 2.747 3.812 . 0 0 "[ . 1 . 2]" 1
1073 1 56 TYR HB3 1 57 LYS H 4.230 . 4.230 2.526 2.374 2.767 . 0 0 "[ . 1 . 2]" 1
1074 1 56 TYR HB3 1 64 LEU MD1 5.020 . 5.020 3.474 3.128 3.776 . 0 0 "[ . 1 . 2]" 1
1075 1 56 TYR HB3 1 64 LEU MD2 5.510 . 5.510 4.310 3.837 4.647 . 0 0 "[ . 1 . 2]" 1
1076 1 56 TYR HB3 1 97 TRP HE3 5.610 . 5.610 4.286 3.792 4.854 . 0 0 "[ . 1 . 2]" 1
1077 1 56 TYR QD 1 57 LYS H 4.770 . 4.770 3.523 3.374 3.690 . 0 0 "[ . 1 . 2]" 1
1078 1 56 TYR QD 1 57 LYS HA 5.880 . 5.880 4.015 3.746 4.307 . 0 0 "[ . 1 . 2]" 1
1079 1 56 TYR QD 1 57 LYS QE 5.940 . 5.940 4.123 2.174 6.172 0.232 19 0 "[ . 1 . 2]" 1
1080 1 56 TYR QD 1 58 GLU H 6.240 . 6.240 5.637 5.533 5.748 . 0 0 "[ . 1 . 2]" 1
1081 1 56 TYR QD 1 59 HIS H 6.050 . 6.050 5.017 4.804 5.197 . 0 0 "[ . 1 . 2]" 1
1082 1 56 TYR QD 1 61 THR MG 6.150 . 6.150 5.637 5.063 6.032 . 0 0 "[ . 1 . 2]" 1
1083 1 56 TYR QD 1 64 LEU MD1 4.500 . 4.500 3.435 3.246 3.589 . 0 0 "[ . 1 . 2]" 1
1084 1 56 TYR QD 1 64 LEU MD2 3.650 . 3.650 2.324 1.901 2.657 . 0 0 "[ . 1 . 2]" 1
1085 1 56 TYR QD 1 64 LEU HG 5.850 . 5.850 5.019 4.633 5.318 . 0 0 "[ . 1 . 2]" 1
1086 1 56 TYR QD 1 97 TRP H 6.160 . 6.160 5.678 5.482 5.914 . 0 0 "[ . 1 . 2]" 1
1087 1 56 TYR QD 1 97 TRP HB2 4.770 . 4.770 3.963 3.835 4.127 . 0 0 "[ . 1 . 2]" 1
1088 1 56 TYR QD 1 97 TRP HB3 3.860 . 3.860 2.370 2.184 2.670 . 0 0 "[ . 1 . 2]" 1
1089 1 56 TYR QD 1 98 LEU H 6.300 . 6.300 5.441 5.163 5.678 . 0 0 "[ . 1 . 2]" 1
1090 1 56 TYR QD 1 100 ALA MB 6.200 . 6.200 4.436 3.851 5.232 . 0 0 "[ . 1 . 2]" 1
1091 1 56 TYR QD 1 101 GLU H 6.300 . 6.300 5.139 4.421 5.487 . 0 0 "[ . 1 . 2]" 1
1092 1 56 TYR QD 1 101 GLU HG2 4.910 . 4.910 3.086 2.322 3.938 . 0 0 "[ . 1 . 2]" 1
1093 1 56 TYR QD 1 101 GLU HG3 4.910 . 4.910 3.285 2.440 3.997 . 0 0 "[ . 1 . 2]" 1
1094 1 56 TYR QE 1 57 LYS H 5.220 . 5.220 5.418 5.353 5.508 0.288 14 0 "[ . 1 . 2]" 1
1095 1 56 TYR QE 1 59 HIS HE1 4.940 . 4.940 4.244 3.596 4.786 . 0 0 "[ . 1 . 2]" 1
1096 1 56 TYR QE 1 64 LEU MD1 4.900 . 4.900 5.055 4.894 5.183 0.283 15 0 "[ . 1 . 2]" 1
1097 1 56 TYR QE 1 64 LEU MD2 4.230 . 4.230 3.923 3.539 4.256 0.026 12 0 "[ . 1 . 2]" 1
1098 1 56 TYR QE 1 97 TRP H 6.300 . 6.300 5.683 5.454 5.823 . 0 0 "[ . 1 . 2]" 1
1099 1 56 TYR QE 1 97 TRP HA 3.620 . 3.620 3.212 2.824 3.452 . 0 0 "[ . 1 . 2]" 1
1100 1 56 TYR QE 1 97 TRP HB2 4.830 . 4.830 4.844 4.659 4.967 0.137 6 0 "[ . 1 . 2]" 1
1101 1 56 TYR QE 1 97 TRP HB3 3.970 . 3.970 3.310 3.076 3.527 . 0 0 "[ . 1 . 2]" 1
1102 1 56 TYR QE 1 97 TRP HE1 4.580 . 4.580 4.319 3.889 4.663 0.083 10 0 "[ . 1 . 2]" 1
1103 1 56 TYR QE 1 100 ALA MB 3.990 . 3.990 2.862 1.969 3.787 . 0 0 "[ . 1 . 2]" 1
1104 1 56 TYR QE 1 101 GLU H 6.300 . 6.300 4.411 3.371 4.957 . 0 0 "[ . 1 . 2]" 1
1105 1 56 TYR QE 1 101 GLU QG 3.720 . 3.720 3.006 2.353 3.609 . 0 0 "[ . 1 . 2]" 1
1106 1 57 LYS H 1 57 LYS QB 3.510 . 3.510 2.344 2.154 2.613 . 0 0 "[ . 1 . 2]" 1
1107 1 57 LYS H 1 57 LYS HG2 5.040 . 5.040 3.445 2.063 4.587 . 0 0 "[ . 1 . 2]" 1
1108 1 57 LYS H 1 57 LYS QG 4.360 . 4.360 3.079 2.047 4.065 . 0 0 "[ . 1 . 2]" 1
1109 1 57 LYS H 1 57 LYS HG3 5.040 . 5.040 3.764 2.135 4.554 . 0 0 "[ . 1 . 2]" 1
1110 1 57 LYS HA 1 57 LYS QD 4.710 . 4.710 3.319 2.101 4.625 . 0 0 "[ . 1 . 2]" 1
1111 1 57 LYS HA 1 57 LYS QE 6.300 . 6.300 4.215 2.552 5.091 . 0 0 "[ . 1 . 2]" 1
1112 1 57 LYS HA 1 59 HIS H 4.860 . 4.860 3.888 3.620 4.048 . 0 0 "[ . 1 . 2]" 1
1113 1 57 LYS QB 1 58 GLU H 3.870 . 3.870 3.008 2.490 3.722 . 0 0 "[ . 1 . 2]" 1
1114 1 57 LYS QG 1 58 GLU H 6.100 . 6.100 3.745 2.293 4.651 . 0 0 "[ . 1 . 2]" 1
1115 1 57 LYS QG 1 58 GLU HA 5.490 . 5.490 4.873 3.553 5.804 0.314 10 0 "[ . 1 . 2]" 1
1116 1 58 GLU H 1 58 GLU HB2 4.380 . 4.380 2.553 2.250 3.679 . 0 0 "[ . 1 . 2]" 1
1117 1 58 GLU H 1 58 GLU QB 3.630 . 3.630 2.426 2.226 2.608 . 0 0 "[ . 1 . 2]" 1
1118 1 58 GLU H 1 58 GLU HB3 4.380 . 4.380 3.429 2.531 3.698 . 0 0 "[ . 1 . 2]" 1
1119 1 58 GLU H 1 58 GLU QG 4.640 . 4.640 2.798 2.150 4.115 . 0 0 "[ . 1 . 2]" 1
1120 1 58 GLU H 1 59 HIS H 3.830 . 3.830 2.397 2.308 2.489 . 0 0 "[ . 1 . 2]" 1
1121 1 58 GLU H 1 60 ASP H 5.940 . 5.940 3.887 3.612 4.291 . 0 0 "[ . 1 . 2]" 1
1122 1 58 GLU HA 1 58 GLU QG 3.830 . 3.830 2.942 2.451 3.371 . 0 0 "[ . 1 . 2]" 1
1123 1 58 GLU QB 1 59 HIS H 4.550 . 4.550 3.279 3.157 3.763 . 0 0 "[ . 1 . 2]" 1
1124 1 58 GLU QB 1 60 ASP HB2 6.010 . 6.010 3.122 2.650 3.983 . 0 0 "[ . 1 . 2]" 1
1125 1 58 GLU QB 1 60 ASP HB3 5.690 . 5.690 3.543 2.933 5.226 . 0 0 "[ . 1 . 2]" 1
1126 1 58 GLU HB2 1 59 HIS H 5.170 . 5.170 3.564 3.280 4.251 . 0 0 "[ . 1 . 2]" 1
1127 1 58 GLU HB2 1 60 ASP H 5.260 . 5.260 3.359 2.740 4.867 . 0 0 "[ . 1 . 2]" 1
1128 1 58 GLU HB3 1 59 HIS H 5.170 . 5.170 4.058 3.299 4.309 . 0 0 "[ . 1 . 2]" 1
1129 1 58 GLU HB3 1 60 ASP H 5.260 . 5.260 3.776 2.769 4.839 . 0 0 "[ . 1 . 2]" 1
1130 1 59 HIS H 1 59 HIS HD2 4.700 . 4.700 3.617 3.313 3.947 . 0 0 "[ . 1 . 2]" 1
1131 1 59 HIS H 1 60 ASP H 4.140 . 4.140 2.633 2.545 2.838 . 0 0 "[ . 1 . 2]" 1
1132 1 59 HIS H 1 60 ASP HB2 6.300 . 6.300 4.950 4.732 5.179 . 0 0 "[ . 1 . 2]" 1
1133 1 59 HIS HA 1 59 HIS HD2 4.230 . 4.230 4.155 3.892 4.303 0.073 15 0 "[ . 1 . 2]" 1
1134 1 59 HIS QB 1 59 HIS HD2 3.420 . 3.420 2.769 2.700 2.877 . 0 0 "[ . 1 . 2]" 1
1135 1 59 HIS QB 1 60 ASP H 5.660 . 5.660 3.839 3.799 3.946 . 0 0 "[ . 1 . 2]" 1
1136 1 60 ASP H 1 60 ASP HB2 4.220 . 4.220 2.641 2.408 3.042 . 0 0 "[ . 1 . 2]" 1
1137 1 60 ASP H 1 60 ASP HB3 4.300 . 4.300 2.548 2.316 3.607 . 0 0 "[ . 1 . 2]" 1
1138 1 60 ASP HA 1 61 THR H 3.360 . 3.360 2.213 2.147 2.321 . 0 0 "[ . 1 . 2]" 1
1139 1 60 ASP HB2 1 61 THR H 6.230 . 6.230 4.555 4.446 4.625 . 0 0 "[ . 1 . 2]" 1
1140 1 60 ASP HB2 1 63 GLY H 6.080 . 6.080 4.770 3.503 5.130 . 0 0 "[ . 1 . 2]" 1
1141 1 60 ASP HB3 1 61 THR H 5.060 . 5.060 4.446 3.897 4.526 . 0 0 "[ . 1 . 2]" 1
1142 1 60 ASP HB3 1 63 GLY H 6.300 . 6.300 3.747 2.135 4.080 . 0 0 "[ . 1 . 2]" 1
1143 1 61 THR H 1 61 THR HB 3.930 . 3.930 3.360 2.558 3.624 . 0 0 "[ . 1 . 2]" 1
1144 1 61 THR H 1 61 THR MG 4.350 . 4.350 2.779 2.236 3.792 . 0 0 "[ . 1 . 2]" 1
1145 1 61 THR H 1 62 ASP H 3.910 . 3.910 2.725 2.569 2.868 . 0 0 "[ . 1 . 2]" 1
1146 1 61 THR H 1 101 GLU QG 5.800 . 5.800 5.081 4.544 5.961 0.161 8 0 "[ . 1 . 2]" 1
1147 1 61 THR HA 1 61 THR MG 3.600 . 3.600 2.339 2.264 2.441 . 0 0 "[ . 1 . 2]" 1
1148 1 61 THR HA 1 63 GLY H 6.300 . 6.300 4.710 4.537 4.901 . 0 0 "[ . 1 . 2]" 1
1149 1 61 THR HA 1 64 LEU H 4.780 . 4.780 3.653 3.215 3.899 . 0 0 "[ . 1 . 2]" 1
1150 1 61 THR HA 1 64 LEU HB2 4.430 . 4.430 3.581 3.135 4.055 . 0 0 "[ . 1 . 2]" 1
1151 1 61 THR HA 1 64 LEU HB3 4.030 . 4.030 2.437 1.943 2.864 . 0 0 "[ . 1 . 2]" 1
1152 1 61 THR HA 1 64 LEU MD2 4.590 . 4.590 2.949 2.557 3.312 . 0 0 "[ . 1 . 2]" 1
1153 1 61 THR HA 1 64 LEU HG 5.250 . 5.250 4.514 4.180 4.890 . 0 0 "[ . 1 . 2]" 1
1154 1 61 THR HA 1 65 ARG H 5.430 . 5.430 3.850 3.389 4.293 . 0 0 "[ . 1 . 2]" 1
1155 1 61 THR HA 1 98 LEU MD1 4.950 . 4.950 3.680 3.206 4.202 . 0 0 "[ . 1 . 2]" 1
1156 1 61 THR HB 1 62 ASP H 4.030 . 4.030 3.518 2.647 3.994 . 0 0 "[ . 1 . 2]" 1
1157 1 61 THR HB 1 98 LEU MD1 4.980 . 4.980 3.836 3.065 5.086 0.106 17 0 "[ . 1 . 2]" 1
1158 1 61 THR HB 1 102 GLN HE21 5.910 . 5.910 4.405 2.291 5.980 0.070 6 0 "[ . 1 . 2]" 1
1159 1 61 THR HB 1 102 GLN QG 6.100 . 6.100 4.822 3.062 6.187 0.087 20 0 "[ . 1 . 2]" 1
1160 1 61 THR MG 1 62 ASP H 5.110 . 5.110 4.090 3.595 4.292 . 0 0 "[ . 1 . 2]" 1
1161 1 61 THR MG 1 62 ASP HA 5.730 . 5.730 5.083 3.516 5.597 . 0 0 "[ . 1 . 2]" 1
1162 1 61 THR MG 1 64 LEU HG 5.730 . 5.730 5.188 4.233 5.809 0.079 11 0 "[ . 1 . 2]" 1
1163 1 61 THR MG 1 65 ARG H 5.690 . 5.690 4.973 3.646 5.586 . 0 0 "[ . 1 . 2]" 1
1164 1 61 THR MG 1 65 ARG QB 4.820 . 4.820 4.451 2.789 5.026 0.206 16 0 "[ . 1 . 2]" 1
1165 1 61 THR MG 1 65 ARG QD 5.480 . 5.480 5.110 2.642 5.788 0.308 1 0 "[ . 1 . 2]" 1
1166 1 61 THR MG 1 98 LEU MD1 3.430 . 3.430 3.155 2.065 3.625 0.195 19 0 "[ . 1 . 2]" 1
1167 1 61 THR MG 1 101 GLU H 6.040 . 6.040 4.654 4.273 5.002 . 0 0 "[ . 1 . 2]" 1
1168 1 61 THR MG 1 101 GLU HA 5.230 . 5.230 4.109 3.658 5.065 . 0 0 "[ . 1 . 2]" 1
1169 1 61 THR MG 1 101 GLU HB2 4.370 . 4.370 2.616 2.168 3.022 . 0 0 "[ . 1 . 2]" 1
1170 1 61 THR MG 1 101 GLU QB 3.790 . 3.790 1.943 1.631 2.535 . 0 0 "[ . 1 . 2]" 1
1171 1 61 THR MG 1 101 GLU HB3 4.370 . 4.370 2.053 1.643 3.025 . 0 0 "[ . 1 . 2]" 1
1172 1 61 THR MG 1 101 GLU HG2 5.040 . 5.040 4.070 3.702 4.716 . 0 0 "[ . 1 . 2]" 1
1173 1 61 THR MG 1 101 GLU QG 4.330 . 4.330 2.914 2.267 3.647 . 0 0 "[ . 1 . 2]" 1
1174 1 61 THR MG 1 101 GLU HG3 5.040 . 5.040 2.996 2.287 3.796 . 0 0 "[ . 1 . 2]" 1
1175 1 61 THR MG 1 102 GLN H 5.260 . 5.260 4.247 3.095 4.862 . 0 0 "[ . 1 . 2]" 1
1176 1 61 THR MG 1 102 GLN HA 5.280 . 5.280 4.213 3.405 4.827 . 0 0 "[ . 1 . 2]" 1
1177 1 61 THR MG 1 102 GLN HE21 6.300 . 6.300 3.824 2.209 5.958 . 0 0 "[ . 1 . 2]" 1
1178 1 61 THR MG 1 102 GLN QG 4.700 . 4.700 3.546 2.086 4.856 0.156 2 0 "[ . 1 . 2]" 1
1179 1 62 ASP H 1 62 ASP HB2 3.830 . 3.830 2.582 2.360 2.773 . 0 0 "[ . 1 . 2]" 1
1180 1 62 ASP H 1 62 ASP QB 3.280 . 3.280 2.310 2.210 2.521 . 0 0 "[ . 1 . 2]" 1
1181 1 62 ASP H 1 62 ASP HB3 3.830 . 3.830 2.815 2.362 3.659 . 0 0 "[ . 1 . 2]" 1
1182 1 62 ASP H 1 63 GLY H 4.090 . 4.090 2.738 2.573 2.873 . 0 0 "[ . 1 . 2]" 1
1183 1 62 ASP H 1 63 GLY HA3 5.670 . 5.670 4.995 4.858 5.154 . 0 0 "[ . 1 . 2]" 1
1184 1 62 ASP HA 1 65 ARG H 4.820 . 4.820 3.836 3.327 4.366 . 0 0 "[ . 1 . 2]" 1
1185 1 62 ASP HA 1 65 ARG QB 4.030 . 4.030 2.921 2.197 3.670 . 0 0 "[ . 1 . 2]" 1
1186 1 62 ASP HA 1 65 ARG QD 4.890 . 4.890 3.593 2.139 4.794 . 0 0 "[ . 1 . 2]" 1
1187 1 62 ASP HB2 1 63 GLY H 4.350 . 4.350 3.433 2.322 3.969 . 0 0 "[ . 1 . 2]" 1
1188 1 62 ASP HB3 1 63 GLY H 4.350 . 4.350 2.729 2.259 3.731 . 0 0 "[ . 1 . 2]" 1
1189 1 63 GLY H 1 64 LEU HB3 5.920 . 5.920 4.653 4.459 4.894 . 0 0 "[ . 1 . 2]" 1
1190 1 63 GLY H 1 65 ARG H 5.600 . 5.600 4.112 3.861 4.405 . 0 0 "[ . 1 . 2]" 1
1191 1 63 GLY HA2 1 66 ARG H 4.870 . 4.870 3.408 3.152 3.719 . 0 0 "[ . 1 . 2]" 1
1192 1 63 GLY HA2 1 66 ARG QB 4.590 . 4.590 2.532 2.172 3.246 . 0 0 "[ . 1 . 2]" 1
1193 1 63 GLY HA2 1 67 ALA H 5.880 . 5.880 4.003 3.852 4.201 . 0 0 "[ . 1 . 2]" 1
1194 1 63 GLY HA3 1 66 ARG H 6.260 . 6.260 4.611 4.373 4.856 . 0 0 "[ . 1 . 2]" 1
1195 1 63 GLY HA3 1 67 ALA H 5.600 . 5.600 4.868 4.716 5.054 . 0 0 "[ . 1 . 2]" 1
1196 1 64 LEU H 1 64 LEU HB2 3.660 . 3.660 2.550 2.448 2.636 . 0 0 "[ . 1 . 2]" 1
1197 1 64 LEU H 1 64 LEU HB3 3.530 . 3.530 2.427 2.348 2.501 . 0 0 "[ . 1 . 2]" 1
1198 1 64 LEU H 1 64 LEU MD1 4.320 . 4.320 4.227 4.161 4.275 . 0 0 "[ . 1 . 2]" 1
1199 1 64 LEU H 1 64 LEU MD2 4.890 . 4.890 4.262 4.187 4.313 . 0 0 "[ . 1 . 2]" 1
1200 1 64 LEU H 1 64 LEU HG 5.180 . 5.180 4.484 4.441 4.529 . 0 0 "[ . 1 . 2]" 1
1201 1 64 LEU H 1 65 ARG H 4.050 . 4.050 2.662 2.504 2.727 . 0 0 "[ . 1 . 2]" 1
1202 1 64 LEU H 1 66 ARG H 5.130 . 5.130 4.086 3.797 4.397 . 0 0 "[ . 1 . 2]" 1
1203 1 64 LEU H 1 67 ALA H 5.610 . 5.610 4.706 4.527 4.829 . 0 0 "[ . 1 . 2]" 1
1204 1 64 LEU H 1 67 ALA MB 6.160 . 6.160 4.688 4.447 5.017 . 0 0 "[ . 1 . 2]" 1
1205 1 64 LEU H 1 98 LEU MD1 6.040 . 6.040 4.986 4.620 5.396 . 0 0 "[ . 1 . 2]" 1
1206 1 64 LEU HA 1 64 LEU MD1 3.390 . 3.390 2.281 2.227 2.354 . 0 0 "[ . 1 . 2]" 1
1207 1 64 LEU HA 1 67 ALA H 5.550 . 5.550 3.630 3.423 3.823 . 0 0 "[ . 1 . 2]" 1
1208 1 64 LEU HB2 1 65 ARG H 5.440 . 5.440 3.899 3.834 4.035 . 0 0 "[ . 1 . 2]" 1
1209 1 64 LEU HB3 1 65 ARG H 4.950 . 4.950 2.596 2.456 2.777 . 0 0 "[ . 1 . 2]" 1
1210 1 64 LEU HB3 1 98 LEU MD1 4.940 . 4.940 3.398 3.040 3.883 . 0 0 "[ . 1 . 2]" 1
1211 1 64 LEU MD1 1 65 ARG H 5.350 . 5.350 4.526 4.372 4.686 . 0 0 "[ . 1 . 2]" 1
1212 1 64 LEU MD1 1 68 ALA H 6.220 . 6.220 4.227 3.954 4.560 . 0 0 "[ . 1 . 2]" 1
1213 1 64 LEU MD1 1 94 ALA HA 5.090 . 5.090 3.021 2.483 3.463 . 0 0 "[ . 1 . 2]" 1
1214 1 64 LEU MD1 1 97 TRP HB2 4.650 . 4.650 2.252 1.983 2.471 . 0 0 "[ . 1 . 2]" 1
1215 1 64 LEU MD1 1 97 TRP HB3 4.910 . 4.910 2.744 2.508 3.128 . 0 0 "[ . 1 . 2]" 1
1216 1 64 LEU MD1 1 97 TRP HE3 3.720 . 3.720 2.049 1.862 2.385 . 0 0 "[ . 1 . 2]" 1
1217 1 64 LEU MD1 1 97 TRP HZ3 4.620 . 4.620 3.725 3.423 4.063 . 0 0 "[ . 1 . 2]" 1
1218 1 64 LEU MD1 1 98 LEU H 5.600 . 5.600 3.822 3.556 4.107 . 0 0 "[ . 1 . 2]" 1
1219 1 64 LEU MD2 1 65 ARG H 5.340 . 5.340 4.261 4.018 4.437 . 0 0 "[ . 1 . 2]" 1
1220 1 64 LEU MD2 1 68 ALA MB 5.240 . 5.240 4.551 4.203 4.889 . 0 0 "[ . 1 . 2]" 1
1221 1 64 LEU MD2 1 94 ALA HA 4.950 . 4.950 4.700 4.006 4.968 0.018 19 0 "[ . 1 . 2]" 1
1222 1 64 LEU MD2 1 97 TRP H 5.390 . 5.390 4.512 4.218 4.688 . 0 0 "[ . 1 . 2]" 1
1223 1 64 LEU MD2 1 97 TRP HA 5.320 . 5.320 3.847 3.715 3.971 . 0 0 "[ . 1 . 2]" 1
1224 1 64 LEU MD2 1 97 TRP HB2 4.530 . 4.530 2.662 2.274 2.983 . 0 0 "[ . 1 . 2]" 1
1225 1 64 LEU MD2 1 97 TRP HB3 4.550 . 4.550 2.298 2.066 2.557 . 0 0 "[ . 1 . 2]" 1
1226 1 64 LEU MD2 1 97 TRP HD1 5.540 . 5.540 5.168 5.036 5.358 . 0 0 "[ . 1 . 2]" 1
1227 1 64 LEU MD2 1 97 TRP HE3 4.570 . 4.570 3.896 3.416 4.246 . 0 0 "[ . 1 . 2]" 1
1228 1 64 LEU MD2 1 98 LEU H 4.530 . 4.530 3.183 2.771 3.378 . 0 0 "[ . 1 . 2]" 1
1229 1 64 LEU MD2 1 98 LEU HA 3.760 . 3.760 2.353 2.068 2.594 . 0 0 "[ . 1 . 2]" 1
1230 1 64 LEU MD2 1 100 ALA H 6.290 . 6.290 4.992 4.726 5.322 . 0 0 "[ . 1 . 2]" 1
1231 1 64 LEU MD2 1 101 GLU H 6.000 . 6.000 4.031 3.691 4.220 . 0 0 "[ . 1 . 2]" 1
1232 1 64 LEU MD2 1 101 GLU QB 5.730 . 5.730 2.976 2.585 3.257 . 0 0 "[ . 1 . 2]" 1
1233 1 64 LEU MD2 1 101 GLU HG2 5.300 . 5.300 2.801 2.510 4.302 . 0 0 "[ . 1 . 2]" 1
1234 1 64 LEU MD2 1 101 GLU QG 4.500 . 4.500 2.030 1.763 2.967 . 0 0 "[ . 1 . 2]" 1
1235 1 64 LEU MD2 1 101 GLU HG3 5.300 . 5.300 2.087 1.792 3.024 . 0 0 "[ . 1 . 2]" 1
1236 1 64 LEU HG 1 65 ARG H 5.070 . 5.070 3.757 3.447 3.975 . 0 0 "[ . 1 . 2]" 1
1237 1 65 ARG H 1 65 ARG QB 3.310 . 3.310 2.231 2.121 2.484 . 0 0 "[ . 1 . 2]" 1
1238 1 65 ARG H 1 65 ARG QD 6.030 . 6.030 4.417 3.869 4.780 . 0 0 "[ . 1 . 2]" 1
1239 1 65 ARG H 1 65 ARG QG 4.900 . 4.900 3.916 2.332 4.029 . 0 0 "[ . 1 . 2]" 1
1240 1 65 ARG H 1 66 ARG H 4.030 . 4.030 2.594 2.407 2.696 . 0 0 "[ . 1 . 2]" 1
1241 1 65 ARG H 1 98 LEU MD1 4.810 . 4.810 3.226 2.790 3.532 . 0 0 "[ . 1 . 2]" 1
1242 1 65 ARG H 1 98 LEU MD2 5.640 . 5.640 4.644 4.063 5.062 . 0 0 "[ . 1 . 2]" 1
1243 1 65 ARG HA 1 65 ARG HG2 4.230 . 4.230 3.201 2.608 3.478 . 0 0 "[ . 1 . 2]" 1
1244 1 65 ARG HA 1 65 ARG QG 3.660 . 3.660 2.561 2.412 2.749 . 0 0 "[ . 1 . 2]" 1
1245 1 65 ARG HA 1 65 ARG HG3 4.230 . 4.230 2.718 2.513 3.090 . 0 0 "[ . 1 . 2]" 1
1246 1 65 ARG HA 1 68 ALA H 5.320 . 5.320 3.595 3.306 3.845 . 0 0 "[ . 1 . 2]" 1
1247 1 65 ARG HA 1 98 LEU MD1 3.600 . 3.600 2.439 1.952 2.836 . 0 0 "[ . 1 . 2]" 1
1248 1 65 ARG HA 1 98 LEU MD2 3.940 . 3.940 2.437 1.944 2.912 . 0 0 "[ . 1 . 2]" 1
1249 1 65 ARG QB 1 66 ARG H 3.780 . 3.780 2.527 2.324 2.843 . 0 0 "[ . 1 . 2]" 1
1250 1 65 ARG QB 1 98 LEU MD1 4.140 . 4.140 2.220 1.887 3.483 . 0 0 "[ . 1 . 2]" 1
1251 1 65 ARG QD 1 66 ARG H 5.940 . 5.940 4.587 4.068 5.420 . 0 0 "[ . 1 . 2]" 1
1252 1 65 ARG QD 1 98 LEU MD1 4.550 . 4.550 3.159 2.354 4.061 . 0 0 "[ . 1 . 2]" 1
1253 1 65 ARG QD 1 98 LEU MD2 5.310 . 5.310 3.722 2.863 4.651 . 0 0 "[ . 1 . 2]" 1
1254 1 65 ARG HD2 1 98 LEU MD2 6.170 . 6.170 3.999 2.992 4.879 . 0 0 "[ . 1 . 2]" 1
1255 1 65 ARG HD3 1 98 LEU MD2 6.170 . 6.170 4.642 3.027 5.862 . 0 0 "[ . 1 . 2]" 1
1256 1 65 ARG QG 1 66 ARG H 5.150 . 5.150 3.657 3.265 4.060 . 0 0 "[ . 1 . 2]" 1
1257 1 65 ARG HG2 1 66 ARG H 5.950 . 5.950 3.840 3.349 4.975 . 0 0 "[ . 1 . 2]" 1
1258 1 65 ARG HG3 1 66 ARG H 5.950 . 5.950 4.719 4.304 4.974 . 0 0 "[ . 1 . 2]" 1
1259 1 66 ARG H 1 66 ARG QB 3.280 . 3.280 2.252 2.071 2.543 . 0 0 "[ . 1 . 2]" 1
1260 1 66 ARG H 1 66 ARG QD 6.010 . 6.010 4.333 3.542 4.809 . 0 0 "[ . 1 . 2]" 1
1261 1 66 ARG H 1 66 ARG QG 4.330 . 4.330 3.452 1.987 4.071 . 0 0 "[ . 1 . 2]" 1
1262 1 66 ARG H 1 67 ALA H 3.940 . 3.940 2.606 2.445 2.731 . 0 0 "[ . 1 . 2]" 1
1263 1 66 ARG H 1 67 ALA MB 5.570 . 5.570 4.298 4.168 4.394 . 0 0 "[ . 1 . 2]" 1
1264 1 66 ARG H 1 68 ALA H 5.750 . 5.750 4.011 3.786 4.200 . 0 0 "[ . 1 . 2]" 1
1265 1 66 ARG HA 1 66 ARG HD2 5.540 . 5.540 4.152 2.943 4.960 . 0 0 "[ . 1 . 2]" 1
1266 1 66 ARG HA 1 66 ARG QD 4.750 . 4.750 3.513 1.996 4.329 . 0 0 "[ . 1 . 2]" 1
1267 1 66 ARG HA 1 66 ARG HD3 5.540 . 5.540 3.929 2.024 4.937 . 0 0 "[ . 1 . 2]" 1
1268 1 66 ARG HA 1 66 ARG QG 3.910 . 3.910 2.572 2.326 2.992 . 0 0 "[ . 1 . 2]" 1
1269 1 66 ARG QB 1 66 ARG QD 3.430 . 3.430 2.343 2.121 2.438 . 0 0 "[ . 1 . 2]" 1
1270 1 66 ARG QB 1 67 ALA H 3.980 . 3.980 2.619 2.370 2.897 . 0 0 "[ . 1 . 2]" 1
1271 1 66 ARG QG 1 67 ALA H 5.080 . 5.080 4.057 3.585 4.578 . 0 0 "[ . 1 . 2]" 1
1272 1 67 ALA H 1 67 ALA MB 3.640 . 3.640 2.253 2.200 2.294 . 0 0 "[ . 1 . 2]" 1
1273 1 67 ALA H 1 68 ALA H 4.040 . 4.040 2.528 2.451 2.680 . 0 0 "[ . 1 . 2]" 1
1274 1 67 ALA H 1 68 ALA MB 6.160 . 6.160 4.218 4.107 4.345 . 0 0 "[ . 1 . 2]" 1
1275 1 67 ALA H 1 69 LYS H 6.120 . 6.120 4.143 3.946 4.449 . 0 0 "[ . 1 . 2]" 1
1276 1 67 ALA H 1 70 SER H 6.300 . 6.300 4.750 4.623 4.891 . 0 0 "[ . 1 . 2]" 1
1277 1 67 ALA HA 1 70 SER H 4.870 . 4.870 3.622 3.272 3.924 . 0 0 "[ . 1 . 2]" 1
1278 1 67 ALA HA 1 70 SER QB 4.530 . 4.530 2.809 2.249 3.787 . 0 0 "[ . 1 . 2]" 1
1279 1 67 ALA MB 1 68 ALA H 3.760 . 3.760 2.682 2.508 2.815 . 0 0 "[ . 1 . 2]" 1
1280 1 67 ALA MB 1 71 LEU H 5.820 . 5.820 4.645 4.477 4.780 . 0 0 "[ . 1 . 2]" 1
1281 1 67 ALA MB 1 71 LEU MD1 4.910 . 4.910 3.807 3.217 4.159 . 0 0 "[ . 1 . 2]" 1
1282 1 68 ALA H 1 68 ALA MB 3.310 . 3.310 2.255 2.229 2.283 . 0 0 "[ . 1 . 2]" 1
1283 1 68 ALA H 1 69 LYS H 4.010 . 4.010 2.621 2.516 2.715 . 0 0 "[ . 1 . 2]" 1
1284 1 68 ALA H 1 70 SER H 6.030 . 6.030 4.142 3.850 4.320 . 0 0 "[ . 1 . 2]" 1
1285 1 68 ALA H 1 71 LEU H 6.300 . 6.300 4.603 4.478 4.818 . 0 0 "[ . 1 . 2]" 1
1286 1 68 ALA H 1 94 ALA MB 5.430 . 5.430 3.728 3.453 4.008 . 0 0 "[ . 1 . 2]" 1
1287 1 68 ALA H 1 98 LEU MD1 5.510 . 5.510 5.223 4.582 5.552 0.042 12 0 "[ . 1 . 2]" 1
1288 1 68 ALA HA 1 71 LEU H 4.560 . 4.560 3.619 3.391 4.033 . 0 0 "[ . 1 . 2]" 1
1289 1 68 ALA HA 1 71 LEU HB2 4.250 . 4.250 2.673 2.281 3.164 . 0 0 "[ . 1 . 2]" 1
1290 1 68 ALA HA 1 71 LEU HB3 4.050 . 4.050 3.352 2.974 3.902 . 0 0 "[ . 1 . 2]" 1
1291 1 68 ALA HA 1 71 LEU MD1 3.910 . 3.910 2.995 2.235 3.438 . 0 0 "[ . 1 . 2]" 1
1292 1 68 ALA HA 1 72 LYS H 4.730 . 4.730 4.388 3.997 4.822 0.092 5 0 "[ . 1 . 2]" 1
1293 1 68 ALA HA 1 94 ALA MB 4.050 . 4.050 2.180 1.824 2.648 . 0 0 "[ . 1 . 2]" 1
1294 1 68 ALA MB 1 69 LYS H 3.750 . 3.750 2.472 2.291 2.608 . 0 0 "[ . 1 . 2]" 1
1295 1 68 ALA MB 1 70 SER H 5.180 . 5.180 4.595 4.403 4.701 . 0 0 "[ . 1 . 2]" 1
1296 1 68 ALA MB 1 71 LEU H 5.220 . 5.220 4.641 4.500 4.942 . 0 0 "[ . 1 . 2]" 1
1297 1 68 ALA MB 1 71 LEU MD1 5.670 . 5.670 4.051 3.544 4.496 . 0 0 "[ . 1 . 2]" 1
1298 1 68 ALA MB 1 95 GLU QG 4.740 . 4.740 3.387 2.074 4.607 . 0 0 "[ . 1 . 2]" 1
1299 1 68 ALA MB 1 97 TRP HB2 5.760 . 5.760 4.867 4.381 5.267 . 0 0 "[ . 1 . 2]" 1
1300 1 68 ALA MB 1 97 TRP HE3 6.300 . 6.300 4.966 4.467 5.441 . 0 0 "[ . 1 . 2]" 1
1301 1 69 LYS H 1 69 LYS QB 3.260 . 3.260 2.299 2.176 2.555 . 0 0 "[ . 1 . 2]" 1
1302 1 69 LYS H 1 69 LYS QG 5.020 . 5.020 3.336 2.260 4.083 . 0 0 "[ . 1 . 2]" 1
1303 1 69 LYS H 1 71 LEU H 5.050 . 5.050 3.932 3.734 4.065 . 0 0 "[ . 1 . 2]" 1
1304 1 69 LYS H 1 71 LEU MD1 6.300 . 6.300 5.778 5.059 6.132 . 0 0 "[ . 1 . 2]" 1
1305 1 69 LYS H 1 98 LEU MD1 5.900 . 5.900 5.828 5.209 6.010 0.110 16 0 "[ . 1 . 2]" 1
1306 1 69 LYS HA 1 69 LYS QE 4.210 . 4.210 3.945 1.777 4.414 0.204 11 0 "[ . 1 . 2]" 1
1307 1 69 LYS HA 1 72 LYS H 5.040 . 5.040 3.812 3.374 4.349 . 0 0 "[ . 1 . 2]" 1
1308 1 69 LYS QB 1 70 SER H 3.720 . 3.720 2.465 2.273 2.756 . 0 0 "[ . 1 . 2]" 1
1309 1 69 LYS QB 1 71 LEU H 5.750 . 5.750 4.547 4.427 4.660 . 0 0 "[ . 1 . 2]" 1
1310 1 69 LYS QD 1 70 SER H 5.380 . 5.380 4.589 3.560 5.272 . 0 0 "[ . 1 . 2]" 1
1311 1 69 LYS QG 1 70 SER H 5.270 . 5.270 3.957 3.374 4.632 . 0 0 "[ . 1 . 2]" 1
1312 1 70 SER H 1 70 SER QB 3.640 . 3.640 2.369 2.226 2.536 . 0 0 "[ . 1 . 2]" 1
1313 1 70 SER H 1 71 LEU H 4.090 . 4.090 2.589 2.460 2.685 . 0 0 "[ . 1 . 2]" 1
1314 1 70 SER H 1 72 LYS H 5.850 . 5.850 4.429 4.058 4.693 . 0 0 "[ . 1 . 2]" 1
1315 1 70 SER HA 1 73 GLU H 4.540 . 4.540 3.464 3.122 3.888 . 0 0 "[ . 1 . 2]" 1
1316 1 70 SER HA 1 73 GLU QB 3.930 . 3.930 2.653 2.084 3.811 . 0 0 "[ . 1 . 2]" 1
1317 1 70 SER HA 1 73 GLU QG 5.670 . 5.670 3.255 1.930 4.681 . 0 0 "[ . 1 . 2]" 1
1318 1 70 SER HA 1 74 ALA MB 5.650 . 5.650 4.633 4.286 4.986 . 0 0 "[ . 1 . 2]" 1
1319 1 70 SER QB 1 71 LEU H 4.170 . 4.170 2.891 2.726 3.562 . 0 0 "[ . 1 . 2]" 1
1320 1 70 SER HB2 1 71 LEU H 4.990 . 4.990 3.440 2.829 4.037 . 0 0 "[ . 1 . 2]" 1
1321 1 70 SER HB3 1 71 LEU H 4.990 . 4.990 3.491 2.786 4.098 . 0 0 "[ . 1 . 2]" 1
1322 1 71 LEU H 1 71 LEU HB2 3.590 . 3.590 2.152 2.090 2.253 . 0 0 "[ . 1 . 2]" 1
1323 1 71 LEU H 1 71 LEU HB3 3.650 . 3.650 3.065 2.917 3.514 . 0 0 "[ . 1 . 2]" 1
1324 1 71 LEU H 1 71 LEU MD1 4.650 . 4.650 4.086 3.651 4.256 . 0 0 "[ . 1 . 2]" 1
1325 1 71 LEU H 1 71 LEU MD2 5.060 . 5.060 4.363 4.124 4.417 . 0 0 "[ . 1 . 2]" 1
1326 1 71 LEU H 1 71 LEU HG 4.860 . 4.860 3.990 3.120 4.268 . 0 0 "[ . 1 . 2]" 1
1327 1 71 LEU H 1 72 LYS H 3.990 . 3.990 2.740 2.644 2.820 . 0 0 "[ . 1 . 2]" 1
1328 1 71 LEU H 1 72 LYS QB 6.110 . 6.110 4.818 4.287 5.213 . 0 0 "[ . 1 . 2]" 1
1329 1 71 LEU HA 1 71 LEU MD1 3.660 . 3.660 3.826 3.777 3.873 0.213 9 0 "[ . 1 . 2]" 1
1330 1 71 LEU HA 1 71 LEU MD2 4.390 . 4.390 2.484 2.185 2.699 . 0 0 "[ . 1 . 2]" 1
1331 1 71 LEU HA 1 74 ALA MB 3.630 . 3.630 2.822 2.470 3.106 . 0 0 "[ . 1 . 2]" 1
1332 1 71 LEU HB2 1 72 LYS H 4.910 . 4.910 3.281 2.807 3.421 . 0 0 "[ . 1 . 2]" 1
1333 1 71 LEU HB3 1 72 LYS H 4.030 . 4.030 2.540 2.293 3.281 . 0 0 "[ . 1 . 2]" 1
1334 1 71 LEU HB3 1 91 ALA HA 4.370 . 4.370 2.722 2.022 3.447 . 0 0 "[ . 1 . 2]" 1
1335 1 71 LEU MD1 1 72 LYS H 5.730 . 5.730 4.536 4.322 4.744 . 0 0 "[ . 1 . 2]" 1
1336 1 71 LEU MD1 1 90 MET HB2 4.430 . 4.430 3.415 3.067 3.854 . 0 0 "[ . 1 . 2]" 1
1337 1 71 LEU MD1 1 94 ALA H 6.180 . 6.180 3.432 3.189 3.612 . 0 0 "[ . 1 . 2]" 1
1338 1 71 LEU MD1 1 94 ALA MB 3.450 . 3.450 2.123 1.902 2.398 . 0 0 "[ . 1 . 2]" 1
1339 1 71 LEU MD1 1 97 TRP HZ3 6.000 . 6.000 4.531 4.052 4.965 . 0 0 "[ . 1 . 2]" 1
1340 1 71 LEU MD2 1 72 LYS H 5.130 . 5.130 4.023 3.757 4.723 . 0 0 "[ . 1 . 2]" 1
1341 1 71 LEU MD2 1 74 ALA H 5.680 . 5.680 4.741 4.504 5.019 . 0 0 "[ . 1 . 2]" 1
1342 1 71 LEU MD2 1 74 ALA MB 4.220 . 4.220 3.352 2.939 3.768 . 0 0 "[ . 1 . 2]" 1
1343 1 71 LEU MD2 1 75 ILE H 6.300 . 6.300 4.306 4.046 4.918 . 0 0 "[ . 1 . 2]" 1
1344 1 71 LEU MD2 1 87 ALA HA 4.960 . 4.960 4.332 3.836 4.954 . 0 0 "[ . 1 . 2]" 1
1345 1 71 LEU MD2 1 90 MET H 5.290 . 5.290 4.331 3.856 4.678 . 0 0 "[ . 1 . 2]" 1
1346 1 71 LEU MD2 1 90 MET HB2 4.200 . 4.200 2.574 2.008 3.038 . 0 0 "[ . 1 . 2]" 1
1347 1 71 LEU MD2 1 90 MET HB3 4.810 . 4.810 3.169 2.610 3.907 . 0 0 "[ . 1 . 2]" 1
1348 1 71 LEU MD2 1 90 MET ME 3.710 . 3.710 2.358 1.830 2.950 . 0 0 "[ . 1 . 2]" 1
1349 1 71 LEU MD2 1 91 ALA H 5.260 . 5.260 2.866 2.370 3.453 . 0 0 "[ . 1 . 2]" 1
1350 1 71 LEU MD2 1 91 ALA HA 3.780 . 3.780 2.574 2.173 3.302 . 0 0 "[ . 1 . 2]" 1
1351 1 71 LEU MD2 1 91 ALA MB 3.540 . 3.540 2.247 1.812 3.381 . 0 0 "[ . 1 . 2]" 1
1352 1 71 LEU MD2 1 92 LYS H 6.090 . 6.090 4.838 4.469 5.546 . 0 0 "[ . 1 . 2]" 1
1353 1 71 LEU MD2 1 93 LYS H 6.300 . 6.300 5.677 5.411 6.032 . 0 0 "[ . 1 . 2]" 1
1354 1 71 LEU HG 1 72 LYS H 5.590 . 5.590 4.994 4.896 5.132 . 0 0 "[ . 1 . 2]" 1
1355 1 72 LYS H 1 72 LYS QB 3.300 . 3.300 2.464 2.169 2.689 . 0 0 "[ . 1 . 2]" 1
1356 1 72 LYS H 1 72 LYS QD 5.100 . 5.100 4.000 3.221 4.795 . 0 0 "[ . 1 . 2]" 1
1357 1 72 LYS H 1 72 LYS QE 6.010 . 6.010 4.506 3.585 5.891 . 0 0 "[ . 1 . 2]" 1
1358 1 72 LYS H 1 72 LYS HG2 4.420 . 4.420 2.957 2.022 4.476 0.056 13 0 "[ . 1 . 2]" 1
1359 1 72 LYS H 1 72 LYS HG3 4.420 . 4.420 3.312 2.111 4.547 0.127 3 0 "[ . 1 . 2]" 1
1360 1 72 LYS H 1 73 GLU H 3.860 . 3.860 2.648 2.559 2.757 . 0 0 "[ . 1 . 2]" 1
1361 1 72 LYS H 1 73 GLU QG 5.540 . 5.540 4.244 4.069 4.461 . 0 0 "[ . 1 . 2]" 1
1362 1 72 LYS H 1 75 ILE H 6.240 . 6.240 4.785 4.574 5.255 . 0 0 "[ . 1 . 2]" 1
1363 1 72 LYS H 1 75 ILE MD 6.000 . 6.000 4.459 3.551 5.230 . 0 0 "[ . 1 . 2]" 1
1364 1 72 LYS HA 1 72 LYS QE 6.240 . 6.240 4.665 3.936 5.795 . 0 0 "[ . 1 . 2]" 1
1365 1 72 LYS HA 1 72 LYS HG2 4.300 . 4.300 3.411 2.465 4.291 . 0 0 "[ . 1 . 2]" 1
1366 1 72 LYS HA 1 72 LYS QG 3.770 . 3.770 3.050 2.404 3.536 . 0 0 "[ . 1 . 2]" 1
1367 1 72 LYS HA 1 72 LYS HG3 4.300 . 4.300 3.569 2.655 3.879 . 0 0 "[ . 1 . 2]" 1
1368 1 72 LYS HA 1 75 ILE H 4.900 . 4.900 3.317 2.908 3.964 . 0 0 "[ . 1 . 2]" 1
1369 1 72 LYS HA 1 75 ILE HB 5.000 . 5.000 2.951 2.118 4.109 . 0 0 "[ . 1 . 2]" 1
1370 1 72 LYS HA 1 75 ILE MD 3.750 . 3.750 2.872 1.750 3.820 0.070 13 0 "[ . 1 . 2]" 1
1371 1 72 LYS HA 1 75 ILE QG 5.130 . 5.130 2.724 1.905 4.382 . 0 0 "[ . 1 . 2]" 1
1372 1 72 LYS QD 1 73 GLU H 5.520 . 5.520 4.382 2.422 5.387 . 0 0 "[ . 1 . 2]" 1
1373 1 72 LYS QG 1 73 GLU H 5.260 . 5.260 3.184 2.264 4.460 . 0 0 "[ . 1 . 2]" 1
1374 1 73 GLU H 1 73 GLU QB 3.350 . 3.350 2.469 2.304 2.633 . 0 0 "[ . 1 . 2]" 1
1375 1 73 GLU H 1 73 GLU HG2 4.240 . 4.240 3.048 2.193 3.797 . 0 0 "[ . 1 . 2]" 1
1376 1 73 GLU H 1 73 GLU QG 3.590 . 3.590 2.338 2.178 2.511 . 0 0 "[ . 1 . 2]" 1
1377 1 73 GLU H 1 73 GLU HG3 4.240 . 4.240 2.998 2.222 3.863 . 0 0 "[ . 1 . 2]" 1
1378 1 73 GLU H 1 74 ALA HA 6.030 . 6.030 5.180 5.002 5.318 . 0 0 "[ . 1 . 2]" 1
1379 1 73 GLU H 1 74 ALA MB 5.700 . 5.700 4.234 4.106 4.356 . 0 0 "[ . 1 . 2]" 1
1380 1 73 GLU H 1 75 ILE MD 6.300 . 6.300 5.238 4.360 5.941 . 0 0 "[ . 1 . 2]" 1
1381 1 73 GLU HA 1 73 GLU HG2 4.230 . 4.230 2.942 2.549 3.849 . 0 0 "[ . 1 . 2]" 1
1382 1 73 GLU HA 1 73 GLU QG 3.660 . 3.660 2.760 2.404 3.380 . 0 0 "[ . 1 . 2]" 1
1383 1 73 GLU HA 1 73 GLU HG3 4.230 . 4.230 3.367 2.847 3.824 . 0 0 "[ . 1 . 2]" 1
1384 1 73 GLU HA 1 75 ILE H 5.290 . 5.290 4.163 3.579 4.628 . 0 0 "[ . 1 . 2]" 1
1385 1 73 GLU HA 1 76 THR H 5.820 . 5.820 3.618 3.038 3.914 . 0 0 "[ . 1 . 2]" 1
1386 1 73 GLU QB 1 74 ALA H 3.860 . 3.860 2.887 2.487 3.574 . 0 0 "[ . 1 . 2]" 1
1387 1 73 GLU QG 1 74 ALA H 4.960 . 4.960 4.089 2.372 4.430 . 0 0 "[ . 1 . 2]" 1
1388 1 74 ALA H 1 74 ALA MB 3.380 . 3.380 2.274 2.242 2.305 . 0 0 "[ . 1 . 2]" 1
1389 1 74 ALA H 1 75 ILE H 4.050 . 4.050 2.559 2.415 2.760 . 0 0 "[ . 1 . 2]" 1
1390 1 74 ALA H 1 75 ILE HA 5.920 . 5.920 5.181 5.036 5.348 . 0 0 "[ . 1 . 2]" 1
1391 1 74 ALA H 1 75 ILE MD 5.290 . 5.290 4.605 3.341 5.105 . 0 0 "[ . 1 . 2]" 1
1392 1 74 ALA H 1 76 THR H 5.630 . 5.630 4.375 4.173 4.632 . 0 0 "[ . 1 . 2]" 1
1393 1 74 ALA H 1 77 ALA MB 6.300 . 6.300 4.752 4.342 5.369 . 0 0 "[ . 1 . 2]" 1
1394 1 74 ALA HA 1 77 ALA H 4.460 . 4.460 3.543 3.329 3.792 . 0 0 "[ . 1 . 2]" 1
1395 1 74 ALA HA 1 77 ALA MB 3.720 . 3.720 2.546 2.051 3.154 . 0 0 "[ . 1 . 2]" 1
1396 1 74 ALA MB 1 75 ILE H 4.130 . 4.130 2.735 2.497 2.949 . 0 0 "[ . 1 . 2]" 1
1397 1 74 ALA MB 1 75 ILE HA 5.000 . 5.000 3.886 3.776 4.001 . 0 0 "[ . 1 . 2]" 1
1398 1 74 ALA MB 1 76 THR H 5.470 . 5.470 4.763 4.564 4.944 . 0 0 "[ . 1 . 2]" 1
1399 1 74 ALA MB 1 77 ALA H 5.070 . 5.070 4.510 4.407 4.632 . 0 0 "[ . 1 . 2]" 1
1400 1 75 ILE H 1 75 ILE HB 3.690 . 3.690 2.572 2.351 2.749 . 0 0 "[ . 1 . 2]" 1
1401 1 75 ILE H 1 75 ILE MD 3.850 . 3.850 3.085 2.120 3.458 . 0 0 "[ . 1 . 2]" 1
1402 1 75 ILE H 1 75 ILE QG 3.660 . 3.660 2.237 2.030 3.439 . 0 0 "[ . 1 . 2]" 1
1403 1 75 ILE H 1 75 ILE MG 4.360 . 4.360 3.822 3.749 3.868 . 0 0 "[ . 1 . 2]" 1
1404 1 75 ILE H 1 76 THR H 4.260 . 4.260 2.723 2.572 2.889 . 0 0 "[ . 1 . 2]" 1
1405 1 75 ILE H 1 77 ALA MB 6.300 . 6.300 4.684 4.377 5.044 . 0 0 "[ . 1 . 2]" 1
1406 1 75 ILE H 1 78 ILE MD 5.420 . 5.420 4.149 3.741 4.352 . 0 0 "[ . 1 . 2]" 1
1407 1 75 ILE H 1 91 ALA MB 5.160 . 5.160 4.767 4.259 5.187 0.027 16 0 "[ . 1 . 2]" 1
1408 1 75 ILE HA 1 75 ILE MD 4.200 . 4.200 2.958 2.090 3.926 . 0 0 "[ . 1 . 2]" 1
1409 1 75 ILE HA 1 75 ILE QG 3.890 . 3.890 2.758 2.378 3.146 . 0 0 "[ . 1 . 2]" 1
1410 1 75 ILE HA 1 75 ILE MG 3.660 . 3.660 2.476 2.391 2.667 . 0 0 "[ . 1 . 2]" 1
1411 1 75 ILE HA 1 76 THR HA 5.260 . 5.260 4.798 4.726 4.837 . 0 0 "[ . 1 . 2]" 1
1412 1 75 ILE HA 1 77 ALA H 5.450 . 5.450 3.898 3.706 4.245 . 0 0 "[ . 1 . 2]" 1
1413 1 75 ILE HA 1 77 ALA MB 6.300 . 6.300 4.912 4.566 5.166 . 0 0 "[ . 1 . 2]" 1
1414 1 75 ILE HA 1 78 ILE H 4.990 . 4.990 3.285 2.999 3.580 . 0 0 "[ . 1 . 2]" 1
1415 1 75 ILE HA 1 78 ILE HB 4.810 . 4.810 3.253 2.530 3.776 . 0 0 "[ . 1 . 2]" 1
1416 1 75 ILE HA 1 78 ILE MD 3.750 . 3.750 2.047 1.848 2.172 . 0 0 "[ . 1 . 2]" 1
1417 1 75 ILE HA 1 78 ILE HG12 5.960 . 5.960 3.620 3.408 4.076 . 0 0 "[ . 1 . 2]" 1
1418 1 75 ILE HA 1 78 ILE QG 5.060 . 5.060 2.097 1.924 2.706 . 0 0 "[ . 1 . 2]" 1
1419 1 75 ILE HA 1 78 ILE HG13 5.960 . 5.960 2.111 1.935 2.747 . 0 0 "[ . 1 . 2]" 1
1420 1 75 ILE HA 1 87 ALA MB 4.600 . 4.600 3.938 3.659 4.319 . 0 0 "[ . 1 . 2]" 1
1421 1 75 ILE HB 1 75 ILE MD 3.520 . 3.520 2.832 2.378 3.282 . 0 0 "[ . 1 . 2]" 1
1422 1 75 ILE HB 1 76 THR H 3.930 . 3.930 2.639 2.364 2.942 . 0 0 "[ . 1 . 2]" 1
1423 1 75 ILE HB 1 76 THR HA 5.260 . 5.260 4.417 4.185 4.725 . 0 0 "[ . 1 . 2]" 1
1424 1 75 ILE HB 1 76 THR MG 4.660 . 4.660 3.578 2.932 4.252 . 0 0 "[ . 1 . 2]" 1
1425 1 75 ILE HB 1 77 ALA H 5.580 . 5.580 4.795 4.588 4.977 . 0 0 "[ . 1 . 2]" 1
1426 1 75 ILE MD 1 76 THR H 5.580 . 5.580 4.565 4.181 4.722 . 0 0 "[ . 1 . 2]" 1
1427 1 75 ILE MD 1 87 ALA HA 5.650 . 5.650 4.119 3.579 4.982 . 0 0 "[ . 1 . 2]" 1
1428 1 75 ILE MD 1 87 ALA MB 4.670 . 4.670 2.796 1.988 3.828 . 0 0 "[ . 1 . 2]" 1
1429 1 75 ILE MD 1 88 LYS H 5.250 . 5.250 3.505 2.891 4.001 . 0 0 "[ . 1 . 2]" 1
1430 1 75 ILE MD 1 88 LYS HA 3.890 . 3.890 2.051 1.530 2.825 . 0 0 "[ . 1 . 2]" 1
1431 1 75 ILE MD 1 88 LYS QE 5.370 . 5.370 4.886 3.458 5.545 0.175 6 0 "[ . 1 . 2]" 1
1432 1 75 ILE MD 1 91 ALA H 5.320 . 5.320 3.130 2.521 3.684 . 0 0 "[ . 1 . 2]" 1
1433 1 75 ILE MD 1 91 ALA HA 5.390 . 5.390 3.956 3.341 4.564 . 0 0 "[ . 1 . 2]" 1
1434 1 75 ILE MD 1 91 ALA MB 3.340 . 3.340 2.090 1.753 2.619 . 0 0 "[ . 1 . 2]" 1
1435 1 75 ILE MD 1 92 LYS H 6.020 . 6.020 4.928 4.213 5.648 . 0 0 "[ . 1 . 2]" 1
1436 1 75 ILE QG 1 88 LYS HA 5.400 . 5.400 2.730 1.931 3.677 . 0 0 "[ . 1 . 2]" 1
1437 1 75 ILE QG 1 91 ALA MB 3.810 . 3.810 2.901 1.883 3.760 . 0 0 "[ . 1 . 2]" 1
1438 1 75 ILE MG 1 76 THR H 4.460 . 4.460 3.444 3.244 3.770 . 0 0 "[ . 1 . 2]" 1
1439 1 75 ILE MG 1 76 THR HA 4.450 . 4.450 3.538 3.319 3.861 . 0 0 "[ . 1 . 2]" 1
1440 1 75 ILE MG 1 77 ALA H 5.430 . 5.430 4.735 4.589 4.917 . 0 0 "[ . 1 . 2]" 1
1441 1 75 ILE MG 1 84 ARG HD2 4.850 . 4.850 3.400 2.393 4.757 . 0 0 "[ . 1 . 2]" 1
1442 1 75 ILE MG 1 84 ARG QD 4.200 . 4.200 3.024 2.350 4.123 . 0 0 "[ . 1 . 2]" 1
1443 1 75 ILE MG 1 84 ARG HD3 4.850 . 4.850 3.646 2.397 4.995 0.145 19 0 "[ . 1 . 2]" 1
1444 1 75 ILE MG 1 88 LYS H 4.730 . 4.730 3.588 3.052 4.496 . 0 0 "[ . 1 . 2]" 1
1445 1 75 ILE MG 1 88 LYS HA 4.180 . 4.180 2.529 1.766 3.705 . 0 0 "[ . 1 . 2]" 1
1446 1 75 ILE MG 1 88 LYS HB2 4.920 . 4.920 2.490 1.993 3.477 . 0 0 "[ . 1 . 2]" 1
1447 1 75 ILE MG 1 88 LYS HB3 4.920 . 4.920 3.785 3.454 4.451 . 0 0 "[ . 1 . 2]" 1
1448 1 75 ILE MG 1 88 LYS QD 3.920 . 3.920 2.983 1.608 4.077 0.157 1 0 "[ . 1 . 2]" 1
1449 1 75 ILE MG 1 88 LYS HE2 4.980 . 4.980 3.997 2.868 5.104 0.124 11 0 "[ . 1 . 2]" 1
1450 1 75 ILE MG 1 88 LYS QE 4.250 . 4.250 3.461 1.840 4.344 0.094 2 0 "[ . 1 . 2]" 1
1451 1 75 ILE MG 1 88 LYS HE3 4.980 . 4.980 4.006 1.861 5.006 0.026 2 0 "[ . 1 . 2]" 1
1452 1 75 ILE MG 1 88 LYS QG 4.020 . 4.020 2.398 1.637 3.768 . 0 0 "[ . 1 . 2]" 1
1453 1 76 THR H 1 76 THR HB 4.150 . 4.150 3.358 2.568 3.656 . 0 0 "[ . 1 . 2]" 1
1454 1 76 THR H 1 76 THR MG 3.770 . 3.770 2.314 2.073 2.639 . 0 0 "[ . 1 . 2]" 1
1455 1 76 THR H 1 77 ALA H 3.810 . 3.810 2.583 2.483 2.648 . 0 0 "[ . 1 . 2]" 1
1456 1 76 THR H 1 77 ALA MB 5.220 . 5.220 4.266 4.194 4.380 . 0 0 "[ . 1 . 2]" 1
1457 1 76 THR HA 1 76 THR MG 3.530 . 3.530 2.584 2.287 3.267 . 0 0 "[ . 1 . 2]" 1
1458 1 76 THR HA 1 78 ILE H 4.970 . 4.970 4.004 3.829 4.203 . 0 0 "[ . 1 . 2]" 1
1459 1 76 THR HA 1 84 ARG QD 5.640 . 5.640 4.552 3.346 5.692 0.052 11 0 "[ . 1 . 2]" 1
1460 1 76 THR HB 1 77 ALA H 4.580 . 4.580 4.084 3.773 4.272 . 0 0 "[ . 1 . 2]" 1
1461 1 76 THR MG 1 77 ALA H 4.770 . 4.770 3.803 2.404 4.319 . 0 0 "[ . 1 . 2]" 1
1462 1 77 ALA H 1 77 ALA MB 3.300 . 3.300 2.312 2.264 2.368 . 0 0 "[ . 1 . 2]" 1
1463 1 77 ALA H 1 78 ILE HB 5.970 . 5.970 4.723 4.368 5.007 . 0 0 "[ . 1 . 2]" 1
1464 1 77 ALA H 1 78 ILE MD 5.730 . 5.730 4.954 4.778 5.081 . 0 0 "[ . 1 . 2]" 1
1465 1 77 ALA H 1 78 ILE QG 4.840 . 4.840 3.700 3.577 3.841 . 0 0 "[ . 1 . 2]" 1
1466 1 77 ALA MB 1 78 ILE H 4.750 . 4.750 3.172 2.961 3.399 . 0 0 "[ . 1 . 2]" 1
1467 1 78 ILE H 1 78 ILE HB 3.710 . 3.710 2.584 2.391 2.757 . 0 0 "[ . 1 . 2]" 1
1468 1 78 ILE H 1 78 ILE MD 4.380 . 4.380 3.736 3.605 3.872 . 0 0 "[ . 1 . 2]" 1
1469 1 78 ILE H 1 78 ILE HG12 4.580 . 4.580 3.534 3.366 3.715 . 0 0 "[ . 1 . 2]" 1
1470 1 78 ILE H 1 78 ILE QG 3.650 . 3.650 2.290 2.071 2.512 . 0 0 "[ . 1 . 2]" 1
1471 1 78 ILE H 1 78 ILE HG13 4.580 . 4.580 2.320 2.090 2.554 . 0 0 "[ . 1 . 2]" 1
1472 1 78 ILE H 1 78 ILE MG 4.780 . 4.780 3.851 3.780 3.896 . 0 0 "[ . 1 . 2]" 1
1473 1 78 ILE HA 1 78 ILE MD 4.290 . 4.290 3.907 3.805 4.015 . 0 0 "[ . 1 . 2]" 1
1474 1 78 ILE HA 1 79 PRO QD 3.600 . 3.600 2.033 1.897 2.088 . 0 0 "[ . 1 . 2]" 1
1475 1 78 ILE HB 1 78 ILE MD 3.490 . 3.490 2.479 2.428 2.517 . 0 0 "[ . 1 . 2]" 1
1476 1 78 ILE HB 1 79 PRO QD 5.270 . 5.270 4.205 4.041 4.371 . 0 0 "[ . 1 . 2]" 1
1477 1 78 ILE MD 1 78 ILE MG 3.370 . 3.370 1.992 1.958 2.051 . 0 0 "[ . 1 . 2]" 1
1478 1 78 ILE MD 1 79 PRO QD 4.990 . 4.990 4.606 4.239 4.925 . 0 0 "[ . 1 . 2]" 1
1479 1 78 ILE MD 1 87 ALA H 5.490 . 5.490 4.036 3.627 4.608 . 0 0 "[ . 1 . 2]" 1
1480 1 78 ILE MD 1 87 ALA MB 3.400 . 3.400 2.091 1.924 2.291 . 0 0 "[ . 1 . 2]" 1
1481 1 78 ILE MD 1 88 LYS HA 4.460 . 4.460 4.633 4.261 4.834 0.374 18 0 "[ . 1 . 2]" 1
1482 1 78 ILE MD 1 90 MET ME 4.530 . 4.530 4.286 3.530 4.622 0.092 8 0 "[ . 1 . 2]" 1
1483 1 78 ILE QG 1 79 PRO QD 5.800 . 5.800 3.623 3.280 3.944 . 0 0 "[ . 1 . 2]" 1
1484 1 78 ILE MG 1 79 PRO QD 3.810 . 3.810 2.400 2.135 2.724 . 0 0 "[ . 1 . 2]" 1
1485 1 78 ILE MG 1 83 GLY H 5.750 . 5.750 3.839 2.527 4.832 . 0 0 "[ . 1 . 2]" 1
1486 1 78 ILE MG 1 83 GLY QA 4.840 . 4.840 2.995 1.651 4.994 0.154 16 0 "[ . 1 . 2]" 1
1487 1 78 ILE MG 1 87 ALA H 5.730 . 5.730 5.106 4.374 5.836 0.106 1 0 "[ . 1 . 2]" 1
1488 1 83 GLY H 1 86 GLU QG 5.160 . 5.160 4.483 2.969 5.485 0.325 2 0 "[ . 1 . 2]" 1
1489 1 83 GLY QA 1 86 GLU QB 4.140 . 4.140 3.408 1.984 4.343 0.203 13 0 "[ . 1 . 2]" 1
1490 1 83 GLY QA 1 86 GLU QG 4.610 . 4.610 2.887 2.065 4.385 . 0 0 "[ . 1 . 2]" 1
1491 1 84 ARG QB 1 84 ARG QD 3.330 . 3.330 2.495 2.181 2.863 . 0 0 "[ . 1 . 2]" 1
1492 1 86 GLU HB2 1 87 ALA H 4.620 . 4.620 3.696 3.520 3.957 . 0 0 "[ . 1 . 2]" 1
1493 1 86 GLU HB3 1 87 ALA H 4.620 . 4.620 3.175 1.980 4.085 . 0 0 "[ . 1 . 2]" 1
1494 1 86 GLU QG 1 87 ALA H 4.950 . 4.950 2.463 1.834 3.528 . 0 0 "[ . 1 . 2]" 1
1495 1 86 GLU QG 1 87 ALA HA 4.230 . 4.230 3.556 2.832 4.340 0.110 14 0 "[ . 1 . 2]" 1
1496 1 87 ALA H 1 88 LYS H 4.440 . 4.440 2.535 2.402 2.723 . 0 0 "[ . 1 . 2]" 1
1497 1 87 ALA H 1 88 LYS HA 5.610 . 5.610 5.133 4.997 5.280 . 0 0 "[ . 1 . 2]" 1
1498 1 87 ALA H 1 90 MET ME 4.810 . 4.810 4.244 3.633 4.596 . 0 0 "[ . 1 . 2]" 1
1499 1 87 ALA HA 1 89 GLU H 5.450 . 5.450 4.197 3.937 4.443 . 0 0 "[ . 1 . 2]" 1
1500 1 87 ALA HA 1 90 MET H 4.540 . 4.540 3.444 3.069 3.905 . 0 0 "[ . 1 . 2]" 1
1501 1 87 ALA HA 1 90 MET HA 6.300 . 6.300 5.458 4.878 6.023 . 0 0 "[ . 1 . 2]" 1
1502 1 87 ALA HA 1 90 MET HB2 4.180 . 4.180 3.236 2.338 3.940 . 0 0 "[ . 1 . 2]" 1
1503 1 87 ALA HA 1 90 MET HB3 5.460 . 5.460 4.603 3.837 5.248 . 0 0 "[ . 1 . 2]" 1
1504 1 87 ALA HA 1 90 MET ME 3.340 . 3.340 1.860 1.692 2.311 . 0 0 "[ . 1 . 2]" 1
1505 1 87 ALA HA 1 90 MET HG2 5.800 . 5.800 4.197 3.794 4.551 . 0 0 "[ . 1 . 2]" 1
1506 1 87 ALA HA 1 90 MET HG3 5.620 . 5.620 2.531 2.127 2.961 . 0 0 "[ . 1 . 2]" 1
1507 1 87 ALA MB 1 88 LYS H 4.040 . 4.040 2.833 2.629 3.001 . 0 0 "[ . 1 . 2]" 1
1508 1 87 ALA MB 1 88 LYS HA 4.140 . 4.140 3.929 3.821 4.004 . 0 0 "[ . 1 . 2]" 1
1509 1 87 ALA MB 1 89 GLU H 5.130 . 5.130 4.616 4.386 4.786 . 0 0 "[ . 1 . 2]" 1
1510 1 87 ALA MB 1 90 MET H 6.290 . 6.290 4.505 4.343 4.717 . 0 0 "[ . 1 . 2]" 1
1511 1 87 ALA MB 1 90 MET ME 3.640 . 3.640 2.326 2.015 2.541 . 0 0 "[ . 1 . 2]" 1
1512 1 88 LYS H 1 88 LYS HB2 4.260 . 4.260 2.422 2.161 2.587 . 0 0 "[ . 1 . 2]" 1
1513 1 88 LYS H 1 88 LYS QB 3.730 . 3.730 2.227 2.122 2.321 . 0 0 "[ . 1 . 2]" 1
1514 1 88 LYS H 1 88 LYS HB3 4.260 . 4.260 2.655 2.440 3.099 . 0 0 "[ . 1 . 2]" 1
1515 1 88 LYS H 1 88 LYS QD 4.740 . 4.740 4.439 4.228 4.594 . 0 0 "[ . 1 . 2]" 1
1516 1 88 LYS H 1 88 LYS QG 4.400 . 4.400 3.987 3.729 4.088 . 0 0 "[ . 1 . 2]" 1
1517 1 88 LYS H 1 89 GLU H 4.070 . 4.070 2.626 2.522 2.793 . 0 0 "[ . 1 . 2]" 1
1518 1 88 LYS H 1 90 MET ME 5.080 . 5.080 4.785 4.521 4.900 . 0 0 "[ . 1 . 2]" 1
1519 1 88 LYS H 1 91 ALA MB 5.530 . 5.530 5.068 4.499 5.613 0.083 20 0 "[ . 1 . 2]" 1
1520 1 88 LYS HA 1 88 LYS QD 3.720 . 3.720 3.302 2.187 3.956 0.236 5 0 "[ . 1 . 2]" 1
1521 1 88 LYS HA 1 88 LYS QE 5.510 . 5.510 4.401 2.865 5.050 . 0 0 "[ . 1 . 2]" 1
1522 1 88 LYS HA 1 88 LYS HG2 4.220 . 4.220 3.002 2.466 3.879 . 0 0 "[ . 1 . 2]" 1
1523 1 88 LYS HA 1 88 LYS QG 3.310 . 3.310 2.524 2.318 3.109 . 0 0 "[ . 1 . 2]" 1
1524 1 88 LYS HA 1 88 LYS HG3 4.220 . 4.220 3.126 2.384 3.731 . 0 0 "[ . 1 . 2]" 1
1525 1 88 LYS HA 1 91 ALA H 4.840 . 4.840 3.410 2.906 3.768 . 0 0 "[ . 1 . 2]" 1
1526 1 88 LYS HA 1 91 ALA MB 3.340 . 3.340 2.879 2.241 3.445 0.105 5 0 "[ . 1 . 2]" 1
1527 1 88 LYS QB 1 89 GLU H 3.810 . 3.810 2.721 2.516 2.856 . 0 0 "[ . 1 . 2]" 1
1528 1 88 LYS HB2 1 89 GLU H 4.710 . 4.710 3.863 3.460 4.058 . 0 0 "[ . 1 . 2]" 1
1529 1 88 LYS HB3 1 89 GLU H 4.710 . 4.710 2.784 2.556 2.926 . 0 0 "[ . 1 . 2]" 1
1530 1 88 LYS QD 1 89 GLU H 5.420 . 5.420 4.448 3.491 5.140 . 0 0 "[ . 1 . 2]" 1
1531 1 88 LYS QE 1 88 LYS QG 3.440 . 3.440 2.276 2.158 2.865 . 0 0 "[ . 1 . 2]" 1
1532 1 88 LYS QE 1 91 ALA MB 5.010 . 5.010 4.335 3.604 5.173 0.163 2 0 "[ . 1 . 2]" 1
1533 1 88 LYS QG 1 89 GLU H 5.050 . 5.050 4.144 3.666 4.606 . 0 0 "[ . 1 . 2]" 1
1534 1 88 LYS HG2 1 89 GLU H 5.910 . 5.910 4.590 3.933 5.139 . 0 0 "[ . 1 . 2]" 1
1535 1 88 LYS HG3 1 89 GLU H 5.910 . 5.910 4.851 3.811 5.291 . 0 0 "[ . 1 . 2]" 1
1536 1 89 GLU H 1 89 GLU HB2 4.150 . 4.150 2.571 2.274 3.552 . 0 0 "[ . 1 . 2]" 1
1537 1 89 GLU H 1 89 GLU QB 3.440 . 3.440 2.456 2.158 2.947 . 0 0 "[ . 1 . 2]" 1
1538 1 89 GLU H 1 89 GLU HB3 4.150 . 4.150 3.333 2.468 3.641 . 0 0 "[ . 1 . 2]" 1
1539 1 89 GLU H 1 89 GLU HG2 4.670 . 4.670 3.051 2.007 4.532 . 0 0 "[ . 1 . 2]" 1
1540 1 89 GLU H 1 89 GLU QG 4.020 . 4.020 2.655 1.996 4.001 . 0 0 "[ . 1 . 2]" 1
1541 1 89 GLU H 1 89 GLU HG3 4.670 . 4.670 3.558 2.096 4.589 . 0 0 "[ . 1 . 2]" 1
1542 1 89 GLU H 1 90 MET HA 6.060 . 6.060 5.272 5.151 5.370 . 0 0 "[ . 1 . 2]" 1
1543 1 89 GLU H 1 90 MET HG2 5.490 . 5.490 5.461 5.291 5.545 0.055 17 0 "[ . 1 . 2]" 1
1544 1 89 GLU H 1 91 ALA H 5.330 . 5.330 4.174 3.835 4.506 . 0 0 "[ . 1 . 2]" 1
1545 1 89 GLU H 1 91 ALA MB 5.660 . 5.660 4.849 4.503 5.237 . 0 0 "[ . 1 . 2]" 1
1546 1 89 GLU HA 1 89 GLU QG 3.540 . 3.540 2.816 2.438 3.542 0.002 5 0 "[ . 1 . 2]" 1
1547 1 89 GLU QB 1 90 MET H 4.170 . 4.170 2.808 2.589 3.568 . 0 0 "[ . 1 . 2]" 1
1548 1 90 MET H 1 90 MET HB2 4.400 . 4.400 2.543 2.488 2.652 . 0 0 "[ . 1 . 2]" 1
1549 1 90 MET H 1 90 MET ME 4.430 . 4.430 3.808 3.558 3.994 . 0 0 "[ . 1 . 2]" 1
1550 1 90 MET H 1 90 MET HG2 4.440 . 4.440 3.239 3.130 3.333 . 0 0 "[ . 1 . 2]" 1
1551 1 90 MET H 1 90 MET HG3 3.900 . 3.900 2.288 2.162 2.426 . 0 0 "[ . 1 . 2]" 1
1552 1 90 MET H 1 91 ALA H 4.420 . 4.420 2.596 2.472 2.728 . 0 0 "[ . 1 . 2]" 1
1553 1 90 MET HA 1 90 MET ME 5.720 . 5.720 4.445 4.364 4.539 . 0 0 "[ . 1 . 2]" 1
1554 1 90 MET HA 1 90 MET HG2 4.050 . 4.050 2.555 2.437 2.627 . 0 0 "[ . 1 . 2]" 1
1555 1 90 MET HA 1 90 MET HG3 4.260 . 4.260 3.313 3.237 3.365 . 0 0 "[ . 1 . 2]" 1
1556 1 90 MET HA 1 92 LYS H 6.300 . 6.300 4.245 3.959 4.448 . 0 0 "[ . 1 . 2]" 1
1557 1 90 MET HA 1 92 LYS QB 6.180 . 6.180 4.737 4.413 5.115 . 0 0 "[ . 1 . 2]" 1
1558 1 90 MET HA 1 93 LYS H 4.920 . 4.920 3.254 3.063 3.424 . 0 0 "[ . 1 . 2]" 1
1559 1 90 MET HA 1 93 LYS HB2 4.490 . 4.490 2.634 2.108 3.486 . 0 0 "[ . 1 . 2]" 1
1560 1 90 MET HA 1 93 LYS HB3 5.040 . 5.040 4.177 3.681 4.940 . 0 0 "[ . 1 . 2]" 1
1561 1 90 MET HA 1 93 LYS QG 4.900 . 4.900 2.879 2.347 3.407 . 0 0 "[ . 1 . 2]" 1
1562 1 90 MET HA 1 94 ALA H 5.290 . 5.290 4.354 4.056 4.861 . 0 0 "[ . 1 . 2]" 1
1563 1 90 MET HB2 1 90 MET ME 3.130 . 3.130 2.144 2.050 2.289 . 0 0 "[ . 1 . 2]" 1
1564 1 90 MET HB2 1 91 ALA H 4.710 . 4.710 2.718 2.578 2.880 . 0 0 "[ . 1 . 2]" 1
1565 1 90 MET HB2 1 93 LYS H 5.330 . 5.330 5.444 5.322 5.544 0.214 9 0 "[ . 1 . 2]" 1
1566 1 90 MET HB3 1 91 ALA H 5.700 . 5.700 3.799 3.680 3.921 . 0 0 "[ . 1 . 2]" 1
1567 1 90 MET ME 1 90 MET HG2 3.640 . 3.640 3.425 3.407 3.445 . 0 0 "[ . 1 . 2]" 1
1568 1 90 MET ME 1 90 MET HG3 3.950 . 3.950 2.618 2.572 2.705 . 0 0 "[ . 1 . 2]" 1
1569 1 90 MET ME 1 91 ALA H 5.540 . 5.540 4.274 4.014 4.630 . 0 0 "[ . 1 . 2]" 1
1570 1 91 ALA H 1 91 ALA MB 3.660 . 3.660 2.258 2.225 2.291 . 0 0 "[ . 1 . 2]" 1
1571 1 91 ALA H 1 92 LYS H 4.160 . 4.160 2.672 2.547 2.844 . 0 0 "[ . 1 . 2]" 1
1572 1 91 ALA H 1 93 LYS H 5.950 . 5.950 4.141 3.957 4.367 . 0 0 "[ . 1 . 2]" 1
1573 1 91 ALA HA 1 93 LYS H 6.030 . 6.030 4.395 4.194 4.537 . 0 0 "[ . 1 . 2]" 1
1574 1 91 ALA HA 1 94 ALA H 5.000 . 5.000 3.577 3.296 3.929 . 0 0 "[ . 1 . 2]" 1
1575 1 91 ALA MB 1 92 LYS H 3.730 . 3.730 2.597 2.394 2.921 . 0 0 "[ . 1 . 2]" 1
1576 1 91 ALA MB 1 93 LYS H 5.340 . 5.340 4.575 4.454 4.712 . 0 0 "[ . 1 . 2]" 1
1577 1 92 LYS H 1 92 LYS QB 3.270 . 3.270 2.393 2.139 2.571 . 0 0 "[ . 1 . 2]" 1
1578 1 92 LYS H 1 92 LYS QE 6.300 . 6.300 4.893 3.944 6.276 . 0 0 "[ . 1 . 2]" 1
1579 1 92 LYS H 1 92 LYS HG2 5.500 . 5.500 3.796 2.813 4.587 . 0 0 "[ . 1 . 2]" 1
1580 1 92 LYS H 1 92 LYS QG 4.680 . 4.680 3.013 2.102 4.031 . 0 0 "[ . 1 . 2]" 1
1581 1 92 LYS H 1 92 LYS HG3 5.500 . 5.500 3.322 2.129 4.528 . 0 0 "[ . 1 . 2]" 1
1582 1 92 LYS H 1 93 LYS H 3.930 . 3.930 2.675 2.519 2.771 . 0 0 "[ . 1 . 2]" 1
1583 1 92 LYS H 1 93 LYS HA 6.300 . 6.300 5.309 5.173 5.386 . 0 0 "[ . 1 . 2]" 1
1584 1 92 LYS H 1 93 LYS QG 6.100 . 6.100 4.697 4.379 5.169 . 0 0 "[ . 1 . 2]" 1
1585 1 92 LYS HA 1 92 LYS QE 5.660 . 5.660 4.433 3.812 5.139 . 0 0 "[ . 1 . 2]" 1
1586 1 92 LYS HA 1 92 LYS QG 3.580 . 3.580 2.528 2.375 2.983 . 0 0 "[ . 1 . 2]" 1
1587 1 92 LYS QB 1 93 LYS H 3.900 . 3.900 2.614 2.442 2.894 . 0 0 "[ . 1 . 2]" 1
1588 1 92 LYS QB 1 94 ALA H 5.120 . 5.120 4.868 4.699 5.053 . 0 0 "[ . 1 . 2]" 1
1589 1 93 LYS H 1 93 LYS HB2 3.780 . 3.780 2.333 2.143 2.491 . 0 0 "[ . 1 . 2]" 1
1590 1 93 LYS H 1 93 LYS HB3 4.300 . 4.300 3.576 3.458 3.631 . 0 0 "[ . 1 . 2]" 1
1591 1 93 LYS H 1 93 LYS QE 6.300 . 6.300 4.866 3.623 5.637 . 0 0 "[ . 1 . 2]" 1
1592 1 93 LYS H 1 93 LYS HG2 4.690 . 4.690 2.652 2.320 3.122 . 0 0 "[ . 1 . 2]" 1
1593 1 93 LYS H 1 93 LYS QG 4.090 . 4.090 2.599 2.293 3.021 . 0 0 "[ . 1 . 2]" 1
1594 1 93 LYS H 1 93 LYS HG3 4.690 . 4.690 3.768 3.598 4.028 . 0 0 "[ . 1 . 2]" 1
1595 1 93 LYS H 1 94 ALA H 3.840 . 3.840 2.758 2.628 2.871 . 0 0 "[ . 1 . 2]" 1
1596 1 93 LYS H 1 94 ALA MB 5.630 . 5.630 4.384 4.255 4.535 . 0 0 "[ . 1 . 2]" 1
1597 1 93 LYS H 1 95 GLU H 5.510 . 5.510 4.086 3.940 4.292 . 0 0 "[ . 1 . 2]" 1
1598 1 93 LYS HA 1 93 LYS HD2 4.900 . 4.900 3.369 3.141 4.102 . 0 0 "[ . 1 . 2]" 1
1599 1 93 LYS HA 1 93 LYS QD 4.140 . 4.140 2.204 2.025 3.195 . 0 0 "[ . 1 . 2]" 1
1600 1 93 LYS HA 1 93 LYS HD3 4.900 . 4.900 2.238 2.044 3.332 . 0 0 "[ . 1 . 2]" 1
1601 1 93 LYS HA 1 93 LYS QE 5.430 . 5.430 3.923 1.724 4.246 . 0 0 "[ . 1 . 2]" 1
1602 1 93 LYS HA 1 93 LYS HG2 4.350 . 4.350 2.817 2.665 2.993 . 0 0 "[ . 1 . 2]" 1
1603 1 93 LYS HA 1 93 LYS QG 3.790 . 3.790 2.741 2.607 2.885 . 0 0 "[ . 1 . 2]" 1
1604 1 93 LYS HA 1 93 LYS HG3 4.350 . 4.350 3.765 3.678 3.862 . 0 0 "[ . 1 . 2]" 1
1605 1 93 LYS HA 1 95 GLU H 6.010 . 6.010 4.354 4.244 4.546 . 0 0 "[ . 1 . 2]" 1
1606 1 93 LYS HA 1 96 GLU H 4.510 . 4.510 3.446 3.221 3.607 . 0 0 "[ . 1 . 2]" 1
1607 1 93 LYS HA 1 96 GLU HB2 4.760 . 4.760 2.762 2.479 3.143 . 0 0 "[ . 1 . 2]" 1
1608 1 93 LYS HA 1 96 GLU QB 4.070 . 4.070 2.732 2.457 3.100 . 0 0 "[ . 1 . 2]" 1
1609 1 93 LYS HA 1 96 GLU HB3 4.760 . 4.760 4.316 4.005 4.718 . 0 0 "[ . 1 . 2]" 1
1610 1 93 LYS HA 1 96 GLU HG2 5.420 . 5.420 3.289 2.464 4.802 . 0 0 "[ . 1 . 2]" 1
1611 1 93 LYS HA 1 96 GLU QG 4.650 . 4.650 2.888 2.211 3.506 . 0 0 "[ . 1 . 2]" 1
1612 1 93 LYS HA 1 96 GLU HG3 5.420 . 5.420 3.301 2.501 3.810 . 0 0 "[ . 1 . 2]" 1
1613 1 93 LYS HA 1 97 TRP H 5.540 . 5.540 4.233 4.065 4.432 . 0 0 "[ . 1 . 2]" 1
1614 1 93 LYS HB2 1 94 ALA H 4.030 . 4.030 2.588 2.376 2.933 . 0 0 "[ . 1 . 2]" 1
1615 1 93 LYS HB2 1 97 TRP HH2 5.320 . 5.320 4.503 3.754 5.171 . 0 0 "[ . 1 . 2]" 1
1616 1 93 LYS HB3 1 94 ALA H 4.130 . 4.130 3.297 3.115 3.502 . 0 0 "[ . 1 . 2]" 1
1617 1 93 LYS HB3 1 95 GLU H 5.760 . 5.760 5.358 5.243 5.553 . 0 0 "[ . 1 . 2]" 1
1618 1 93 LYS HB3 1 96 GLU H 6.150 . 6.150 5.311 5.107 5.476 . 0 0 "[ . 1 . 2]" 1
1619 1 93 LYS HB3 1 97 TRP HE1 5.160 . 5.160 4.255 3.827 4.793 . 0 0 "[ . 1 . 2]" 1
1620 1 93 LYS HB3 1 97 TRP HH2 4.580 . 4.580 3.571 3.233 4.033 . 0 0 "[ . 1 . 2]" 1
1621 1 93 LYS HB3 1 97 TRP HZ2 3.940 . 3.940 3.229 2.778 3.659 . 0 0 "[ . 1 . 2]" 1
1622 1 93 LYS HB3 1 97 TRP HZ3 6.280 . 6.280 4.361 3.862 4.891 . 0 0 "[ . 1 . 2]" 1
1623 1 93 LYS QD 1 97 TRP HE1 4.960 . 4.960 3.360 2.493 3.758 . 0 0 "[ . 1 . 2]" 1
1624 1 93 LYS QD 1 97 TRP HH2 5.440 . 5.440 4.452 3.979 4.850 . 0 0 "[ . 1 . 2]" 1
1625 1 93 LYS QD 1 97 TRP HZ2 3.890 . 3.890 2.935 2.464 3.122 . 0 0 "[ . 1 . 2]" 1
1626 1 93 LYS HD2 1 97 TRP HE1 5.720 . 5.720 3.611 2.560 5.394 . 0 0 "[ . 1 . 2]" 1
1627 1 93 LYS HD2 1 97 TRP HZ2 4.570 . 4.570 3.054 2.482 4.629 0.059 11 0 "[ . 1 . 2]" 1
1628 1 93 LYS HD3 1 97 TRP HE1 5.720 . 5.720 4.182 3.438 4.626 . 0 0 "[ . 1 . 2]" 1
1629 1 93 LYS HD3 1 97 TRP HZ2 4.570 . 4.570 4.418 3.072 4.624 0.054 12 0 "[ . 1 . 2]" 1
1630 1 93 LYS QE 1 97 TRP HE1 5.480 . 5.480 4.901 3.722 5.631 0.151 1 0 "[ . 1 . 2]" 1
1631 1 93 LYS QE 1 97 TRP HZ2 4.590 . 4.590 4.591 4.030 4.802 0.212 10 0 "[ . 1 . 2]" 1
1632 1 93 LYS QG 1 94 ALA H 5.450 . 5.450 4.212 4.007 4.486 . 0 0 "[ . 1 . 2]" 1
1633 1 93 LYS QG 1 97 TRP HE1 5.940 . 5.940 5.304 4.564 5.717 . 0 0 "[ . 1 . 2]" 1
1634 1 93 LYS QG 1 97 TRP HZ2 4.550 . 4.550 4.176 3.819 4.642 0.092 13 0 "[ . 1 . 2]" 1
1635 1 93 LYS HG2 1 94 ALA H 6.300 . 6.300 4.593 4.324 4.932 . 0 0 "[ . 1 . 2]" 1
1636 1 93 LYS HG3 1 94 ALA H 6.300 . 6.300 4.899 4.677 5.157 . 0 0 "[ . 1 . 2]" 1
1637 1 94 ALA H 1 94 ALA MB 3.370 . 3.370 2.226 2.200 2.255 . 0 0 "[ . 1 . 2]" 1
1638 1 94 ALA H 1 95 GLU QB 4.860 . 4.860 4.598 4.306 4.771 . 0 0 "[ . 1 . 2]" 1
1639 1 94 ALA HA 1 97 TRP H 4.850 . 4.850 3.624 3.381 3.811 . 0 0 "[ . 1 . 2]" 1
1640 1 94 ALA HA 1 97 TRP HB2 4.390 . 4.390 2.890 2.632 3.229 . 0 0 "[ . 1 . 2]" 1
1641 1 94 ALA HA 1 97 TRP HB3 5.440 . 5.440 4.470 4.161 4.868 . 0 0 "[ . 1 . 2]" 1
1642 1 94 ALA HA 1 97 TRP HE3 3.640 . 3.640 2.328 2.057 2.784 . 0 0 "[ . 1 . 2]" 1
1643 1 94 ALA HA 1 97 TRP HZ3 4.830 . 4.830 3.589 3.272 4.063 . 0 0 "[ . 1 . 2]" 1
1644 1 94 ALA MB 1 95 GLU H 3.970 . 3.970 2.699 2.548 2.784 . 0 0 "[ . 1 . 2]" 1
1645 1 94 ALA MB 1 96 GLU H 5.290 . 5.290 4.628 4.474 4.770 . 0 0 "[ . 1 . 2]" 1
1646 1 94 ALA MB 1 97 TRP HB2 5.460 . 5.460 4.267 3.974 4.575 . 0 0 "[ . 1 . 2]" 1
1647 1 94 ALA MB 1 97 TRP HE3 4.700 . 4.700 3.493 3.088 3.854 . 0 0 "[ . 1 . 2]" 1
1648 1 94 ALA MB 1 97 TRP HZ3 5.490 . 5.490 3.640 3.252 4.129 . 0 0 "[ . 1 . 2]" 1
1649 1 94 ALA MB 1 98 LEU H 6.080 . 6.080 4.791 4.653 4.911 . 0 0 "[ . 1 . 2]" 1
1650 1 95 GLU H 1 95 GLU QB 3.590 . 3.590 2.372 2.165 2.515 . 0 0 "[ . 1 . 2]" 1
1651 1 95 GLU H 1 95 GLU HG2 4.570 . 4.570 3.392 2.211 4.428 . 0 0 "[ . 1 . 2]" 1
1652 1 95 GLU H 1 95 GLU QG 3.980 . 3.980 2.725 2.193 4.012 0.032 20 0 "[ . 1 . 2]" 1
1653 1 95 GLU H 1 95 GLU HG3 4.570 . 4.570 3.299 2.255 4.589 0.019 20 0 "[ . 1 . 2]" 1
1654 1 95 GLU HA 1 95 GLU HG2 4.140 . 4.140 2.730 2.448 3.213 . 0 0 "[ . 1 . 2]" 1
1655 1 95 GLU HA 1 95 GLU HG3 4.140 . 4.140 3.453 2.988 3.857 . 0 0 "[ . 1 . 2]" 1
1656 1 95 GLU HA 1 98 LEU H 4.060 . 4.060 3.447 3.124 3.857 . 0 0 "[ . 1 . 2]" 1
1657 1 95 GLU HA 1 98 LEU HB2 4.290 . 4.290 3.276 2.797 3.926 . 0 0 "[ . 1 . 2]" 1
1658 1 95 GLU HA 1 98 LEU QB 3.540 . 3.540 2.542 2.160 2.923 . 0 0 "[ . 1 . 2]" 1
1659 1 95 GLU HA 1 98 LEU HB3 4.290 . 4.290 2.654 2.237 3.016 . 0 0 "[ . 1 . 2]" 1
1660 1 95 GLU HA 1 98 LEU MD2 4.250 . 4.250 3.313 2.940 3.600 . 0 0 "[ . 1 . 2]" 1
1661 1 95 GLU QB 1 96 GLU H 3.330 . 3.330 2.634 2.355 2.839 . 0 0 "[ . 1 . 2]" 1
1662 1 95 GLU QB 1 99 GLN QE 5.720 . 5.720 3.936 1.931 5.396 . 0 0 "[ . 1 . 2]" 1
1663 1 96 GLU H 1 96 GLU QB 3.780 . 3.780 2.462 2.370 2.544 . 0 0 "[ . 1 . 2]" 1
1664 1 96 GLU H 1 96 GLU HG2 4.600 . 4.600 2.504 2.223 3.704 . 0 0 "[ . 1 . 2]" 1
1665 1 96 GLU H 1 96 GLU QG 3.750 . 3.750 2.354 2.205 2.535 . 0 0 "[ . 1 . 2]" 1
1666 1 96 GLU H 1 96 GLU HG3 4.600 . 4.600 3.621 2.353 3.903 . 0 0 "[ . 1 . 2]" 1
1667 1 96 GLU H 1 97 TRP H 3.790 . 3.790 2.634 2.514 2.790 . 0 0 "[ . 1 . 2]" 1
1668 1 96 GLU H 1 97 TRP HB2 6.300 . 6.300 4.763 4.577 5.002 . 0 0 "[ . 1 . 2]" 1
1669 1 96 GLU H 1 98 LEU MD2 6.300 . 6.300 6.165 5.830 6.404 0.104 2 0 "[ . 1 . 2]" 1
1670 1 96 GLU HA 1 99 GLN H 4.390 . 4.390 3.571 3.248 3.953 . 0 0 "[ . 1 . 2]" 1
1671 1 96 GLU HA 1 99 GLN QB 4.140 . 4.140 2.976 2.483 3.351 . 0 0 "[ . 1 . 2]" 1
1672 1 96 GLU HA 1 99 GLN QE 6.100 . 6.100 4.716 2.300 6.118 0.018 8 0 "[ . 1 . 2]" 1
1673 1 96 GLU HA 1 99 GLN HG2 5.400 . 5.400 4.091 2.928 5.732 0.332 18 0 "[ . 1 . 2]" 1
1674 1 96 GLU HA 1 99 GLN QG 4.750 . 4.750 3.264 2.729 4.246 . 0 0 "[ . 1 . 2]" 1
1675 1 96 GLU HA 1 99 GLN HG3 5.400 . 5.400 3.601 2.765 4.508 . 0 0 "[ . 1 . 2]" 1
1676 1 96 GLU QB 1 97 TRP HD1 4.030 . 4.030 3.563 3.203 3.965 . 0 0 "[ . 1 . 2]" 1
1677 1 96 GLU QB 1 97 TRP HE1 5.790 . 5.790 4.357 3.884 4.763 . 0 0 "[ . 1 . 2]" 1
1678 1 96 GLU HB2 1 97 TRP HD1 4.690 . 4.690 3.870 3.493 4.338 . 0 0 "[ . 1 . 2]" 1
1679 1 96 GLU HB3 1 97 TRP HD1 4.690 . 4.690 4.179 3.723 4.587 . 0 0 "[ . 1 . 2]" 1
1680 1 96 GLU QG 1 97 TRP H 5.420 . 5.420 4.079 3.915 4.263 . 0 0 "[ . 1 . 2]" 1
1681 1 96 GLU QG 1 97 TRP HD1 5.910 . 5.910 5.449 5.053 5.878 . 0 0 "[ . 1 . 2]" 1
1682 1 97 TRP H 1 97 TRP HB2 3.830 . 3.830 2.487 2.428 2.535 . 0 0 "[ . 1 . 2]" 1
1683 1 97 TRP H 1 97 TRP HB3 4.280 . 4.280 3.597 3.562 3.634 . 0 0 "[ . 1 . 2]" 1
1684 1 97 TRP H 1 97 TRP HD1 3.980 . 3.980 3.375 3.175 3.633 . 0 0 "[ . 1 . 2]" 1
1685 1 97 TRP H 1 97 TRP HE1 6.150 . 6.150 4.910 4.749 5.157 . 0 0 "[ . 1 . 2]" 1
1686 1 97 TRP H 1 97 TRP HE3 4.950 . 4.950 4.437 4.205 4.672 . 0 0 "[ . 1 . 2]" 1
1687 1 97 TRP H 1 98 LEU MD1 6.300 . 6.300 6.278 6.178 6.345 0.045 14 0 "[ . 1 . 2]" 1
1688 1 97 TRP H 1 100 ALA MB 5.640 . 5.640 4.644 4.334 5.088 . 0 0 "[ . 1 . 2]" 1
1689 1 97 TRP HA 1 97 TRP HD1 3.010 . 3.010 2.271 2.226 2.321 . 0 0 "[ . 1 . 2]" 1
1690 1 97 TRP HA 1 97 TRP HE1 4.940 . 4.940 4.769 4.726 4.815 . 0 0 "[ . 1 . 2]" 1
1691 1 97 TRP HA 1 100 ALA MB 4.280 . 4.280 2.558 2.179 3.008 . 0 0 "[ . 1 . 2]" 1
1692 1 97 TRP HB2 1 97 TRP HE3 3.860 . 3.860 2.586 2.473 2.675 . 0 0 "[ . 1 . 2]" 1
1693 1 97 TRP HB2 1 98 LEU H 4.260 . 4.260 2.625 2.511 2.828 . 0 0 "[ . 1 . 2]" 1
1694 1 97 TRP HB2 1 98 LEU MD1 6.300 . 6.300 5.367 5.091 5.666 . 0 0 "[ . 1 . 2]" 1
1695 1 97 TRP HB3 1 98 LEU H 4.580 . 4.580 3.662 3.542 3.828 . 0 0 "[ . 1 . 2]" 1
1696 1 97 TRP HD1 1 100 ALA MB 4.540 . 4.540 3.853 3.376 4.410 . 0 0 "[ . 1 . 2]" 1
1697 1 98 LEU H 1 98 LEU HB2 3.960 . 3.960 2.481 2.408 2.530 . 0 0 "[ . 1 . 2]" 1
1698 1 98 LEU H 1 98 LEU QB 3.320 . 3.320 2.233 2.209 2.266 . 0 0 "[ . 1 . 2]" 1
1699 1 98 LEU H 1 98 LEU HB3 3.960 . 3.960 2.538 2.465 2.609 . 0 0 "[ . 1 . 2]" 1
1700 1 98 LEU H 1 98 LEU MD1 4.560 . 4.560 4.113 4.030 4.173 . 0 0 "[ . 1 . 2]" 1
1701 1 98 LEU H 1 98 LEU MD2 4.550 . 4.550 4.304 4.255 4.353 . 0 0 "[ . 1 . 2]" 1
1702 1 98 LEU H 1 98 LEU HG 5.260 . 5.260 4.535 4.505 4.575 . 0 0 "[ . 1 . 2]" 1
1703 1 98 LEU HA 1 98 LEU MD1 3.540 . 3.540 2.104 2.007 2.192 . 0 0 "[ . 1 . 2]" 1
1704 1 98 LEU HA 1 98 LEU MD2 4.030 . 4.030 3.929 3.880 3.948 . 0 0 "[ . 1 . 2]" 1
1705 1 98 LEU HA 1 101 GLU H 4.550 . 4.550 3.545 3.361 3.919 . 0 0 "[ . 1 . 2]" 1
1706 1 98 LEU HA 1 101 GLU QB 4.790 . 4.790 2.840 2.408 3.543 . 0 0 "[ . 1 . 2]" 1
1707 1 98 LEU HA 1 101 GLU QG 5.630 . 5.630 3.262 2.709 4.201 . 0 0 "[ . 1 . 2]" 1
1708 1 98 LEU HA 1 102 GLN HE21 6.250 . 6.250 4.959 3.692 6.003 . 0 0 "[ . 1 . 2]" 1
1709 1 98 LEU HA 1 102 GLN QG 6.100 . 6.100 3.983 3.374 4.458 . 0 0 "[ . 1 . 2]" 1
1710 1 98 LEU QB 1 99 GLN H 4.430 . 4.430 2.602 2.417 2.786 . 0 0 "[ . 1 . 2]" 1
1711 1 98 LEU QB 1 99 GLN QG 5.260 . 5.260 3.350 2.991 3.604 . 0 0 "[ . 1 . 2]" 1
1712 1 98 LEU MD1 1 99 GLN H 5.400 . 5.400 4.535 4.364 4.723 . 0 0 "[ . 1 . 2]" 1
1713 1 98 LEU MD1 1 99 GLN QG 6.100 . 6.100 5.336 4.897 5.686 . 0 0 "[ . 1 . 2]" 1
1714 1 98 LEU MD1 1 101 GLU H 6.070 . 6.070 4.606 4.339 4.992 . 0 0 "[ . 1 . 2]" 1
1715 1 98 LEU MD1 1 102 GLN HE21 6.010 . 6.010 2.506 1.795 3.358 . 0 0 "[ . 1 . 2]" 1
1716 1 98 LEU MD1 1 102 GLN HE22 6.140 . 6.140 3.162 2.466 4.075 . 0 0 "[ . 1 . 2]" 1
1717 1 98 LEU MD1 1 102 GLN HG2 6.300 . 6.300 3.310 2.346 4.104 . 0 0 "[ . 1 . 2]" 1
1718 1 98 LEU MD1 1 102 GLN HG3 6.300 . 6.300 3.484 2.556 4.797 . 0 0 "[ . 1 . 2]" 1
1719 1 98 LEU MD2 1 99 GLN H 5.690 . 5.690 4.437 4.124 4.660 . 0 0 "[ . 1 . 2]" 1
1720 1 98 LEU MD2 1 99 GLN QE 5.960 . 5.960 4.500 2.955 5.967 0.007 15 0 "[ . 1 . 2]" 1
1721 1 98 LEU MD2 1 99 GLN HG2 6.300 . 6.300 4.718 4.073 5.457 . 0 0 "[ . 1 . 2]" 1
1722 1 98 LEU MD2 1 99 GLN HG3 6.300 . 6.300 5.216 3.942 6.138 . 0 0 "[ . 1 . 2]" 1
1723 1 98 LEU MD2 1 102 GLN HE21 6.300 . 6.300 3.973 3.065 5.133 . 0 0 "[ . 1 . 2]" 1
1724 1 98 LEU MD2 1 102 GLN HE22 6.300 . 6.300 4.407 2.770 5.990 . 0 0 "[ . 1 . 2]" 1
1725 1 98 LEU MD2 1 102 GLN HG2 6.300 . 6.300 4.965 4.282 6.002 . 0 0 "[ . 1 . 2]" 1
1726 1 98 LEU MD2 1 102 GLN HG3 6.300 . 6.300 4.614 3.831 5.309 . 0 0 "[ . 1 . 2]" 1
1727 1 98 LEU HG 1 99 GLN H 5.690 . 5.690 3.922 3.571 4.185 . 0 0 "[ . 1 . 2]" 1
1728 1 98 LEU HG 1 102 GLN HE21 5.930 . 5.930 3.486 2.347 5.164 . 0 0 "[ . 1 . 2]" 1
1729 1 98 LEU HG 1 102 GLN HE22 5.780 . 5.780 4.440 3.070 5.782 0.002 17 0 "[ . 1 . 2]" 1
1730 1 98 LEU HG 1 102 GLN HG2 6.300 . 6.300 3.799 2.968 5.412 . 0 0 "[ . 1 . 2]" 1
1731 1 98 LEU HG 1 102 GLN QG 5.380 . 5.380 3.150 2.580 3.931 . 0 0 "[ . 1 . 2]" 1
1732 1 98 LEU HG 1 102 GLN HG3 6.300 . 6.300 3.517 2.787 4.251 . 0 0 "[ . 1 . 2]" 1
1733 1 99 GLN H 1 99 GLN QB 3.330 . 3.330 2.486 2.373 2.578 . 0 0 "[ . 1 . 2]" 1
1734 1 99 GLN H 1 99 GLN HG2 4.610 . 4.610 2.862 2.212 3.620 . 0 0 "[ . 1 . 2]" 1
1735 1 99 GLN H 1 99 GLN QG 3.980 . 3.980 2.289 2.117 2.477 . 0 0 "[ . 1 . 2]" 1
1736 1 99 GLN H 1 99 GLN HG3 4.610 . 4.610 3.085 2.138 3.850 . 0 0 "[ . 1 . 2]" 1
1737 1 99 GLN H 1 100 ALA H 3.660 . 3.660 2.591 2.475 2.708 . 0 0 "[ . 1 . 2]" 1
1738 1 99 GLN HA 1 99 GLN QG 3.780 . 3.780 2.792 2.428 3.159 . 0 0 "[ . 1 . 2]" 1
1739 1 99 GLN QB 1 100 ALA H 3.780 . 3.780 2.707 2.379 2.916 . 0 0 "[ . 1 . 2]" 1
1740 1 99 GLN QG 1 100 ALA H 5.060 . 5.060 4.131 3.959 4.250 . 0 0 "[ . 1 . 2]" 1
1741 1 99 GLN HG2 1 100 ALA H 5.870 . 5.870 4.692 4.308 5.141 . 0 0 "[ . 1 . 2]" 1
1742 1 99 GLN HG3 1 100 ALA H 5.870 . 5.870 4.771 4.163 5.255 . 0 0 "[ . 1 . 2]" 1
1743 1 100 ALA H 1 100 ALA MB 3.240 . 3.240 2.252 2.225 2.271 . 0 0 "[ . 1 . 2]" 1
1744 1 100 ALA H 1 101 GLU H 3.960 . 3.960 2.591 2.490 2.693 . 0 0 "[ . 1 . 2]" 1
1745 1 100 ALA MB 1 101 GLU H 3.960 . 3.960 2.675 2.473 2.833 . 0 0 "[ . 1 . 2]" 1
1746 1 100 ALA MB 1 101 GLU HA 5.720 . 5.720 3.979 3.850 4.086 . 0 0 "[ . 1 . 2]" 1
1747 1 100 ALA MB 1 101 GLU QG 5.690 . 5.690 3.312 3.092 3.828 . 0 0 "[ . 1 . 2]" 1
1748 1 101 GLU H 1 101 GLU HB2 3.910 . 3.910 2.421 2.334 2.484 . 0 0 "[ . 1 . 2]" 1
1749 1 101 GLU H 1 101 GLU QB 3.390 . 3.390 2.386 2.306 2.442 . 0 0 "[ . 1 . 2]" 1
1750 1 101 GLU H 1 101 GLU HB3 3.910 . 3.910 3.600 3.576 3.637 . 0 0 "[ . 1 . 2]" 1
1751 1 101 GLU H 1 101 GLU HG2 4.410 . 4.410 2.559 2.267 3.415 . 0 0 "[ . 1 . 2]" 1
1752 1 101 GLU H 1 101 GLU QG 3.690 . 3.690 2.463 2.247 2.838 . 0 0 "[ . 1 . 2]" 1
1753 1 101 GLU H 1 101 GLU HG3 4.410 . 4.410 3.693 2.670 3.931 . 0 0 "[ . 1 . 2]" 1
1754 1 102 GLN H 1 102 GLN QB 3.650 . 3.650 2.570 2.369 3.329 . 0 0 "[ . 1 . 2]" 1
1755 1 102 GLN H 1 102 GLN HE21 6.120 . 6.120 4.806 3.853 5.494 . 0 0 "[ . 1 . 2]" 1
1756 1 102 GLN H 1 102 GLN HG2 5.040 . 5.040 2.823 2.227 3.868 . 0 0 "[ . 1 . 2]" 1
1757 1 102 GLN H 1 102 GLN QG 4.300 . 4.300 2.450 2.208 2.709 . 0 0 "[ . 1 . 2]" 1
1758 1 102 GLN H 1 102 GLN HG3 5.040 . 5.040 3.366 2.437 3.928 . 0 0 "[ . 1 . 2]" 1
1759 1 102 GLN HA 1 102 GLN QG 3.770 . 3.770 2.907 2.416 3.418 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Saturday, May 18, 2024 4:51:31 AM GMT (wattos1)