NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
454272 |
2yul   |
11158 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2yul
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 2137
_Distance_constraint_stats_list.Viol_count 1469
_Distance_constraint_stats_list.Viol_total 539.155
_Distance_constraint_stats_list.Viol_max 0.191
_Distance_constraint_stats_list.Viol_rms 0.0057
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0006
_Distance_constraint_stats_list.Viol_average_violations_only 0.0184
_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 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ILE 0.005 0.005 10 0 "[ . 1 . 2]"
1 9 ARG 0.051 0.031 10 0 "[ . 1 . 2]"
1 10 ARG 0.106 0.053 10 0 "[ . 1 . 2]"
1 11 PRO 0.392 0.080 18 0 "[ . 1 . 2]"
1 12 MET 0.462 0.080 18 0 "[ . 1 . 2]"
1 13 ASN 0.939 0.101 10 0 "[ . 1 . 2]"
1 14 ALA 1.229 0.101 10 0 "[ . 1 . 2]"
1 15 PHE 0.238 0.022 10 0 "[ . 1 . 2]"
1 16 MET 0.253 0.028 18 0 "[ . 1 . 2]"
1 17 VAL 0.265 0.024 13 0 "[ . 1 . 2]"
1 18 TRP 0.191 0.017 19 0 "[ . 1 . 2]"
1 19 ALA 0.106 0.024 13 0 "[ . 1 . 2]"
1 20 LYS 0.139 0.031 20 0 "[ . 1 . 2]"
1 21 ASP 0.325 0.098 20 0 "[ . 1 . 2]"
1 22 GLU 0.433 0.116 7 0 "[ . 1 . 2]"
1 23 ARG 0.511 0.041 19 0 "[ . 1 . 2]"
1 24 LYS 2.549 0.191 19 0 "[ . 1 . 2]"
1 25 ARG 0.179 0.029 15 0 "[ . 1 . 2]"
1 26 LEU 0.507 0.107 19 0 "[ . 1 . 2]"
1 27 ALA 0.644 0.030 15 0 "[ . 1 . 2]"
1 28 GLN 0.420 0.030 19 0 "[ . 1 . 2]"
1 29 GLN 0.266 0.029 15 0 "[ . 1 . 2]"
1 30 ASN 1.208 0.027 9 0 "[ . 1 . 2]"
1 31 PRO 1.689 0.052 18 0 "[ . 1 . 2]"
1 32 ASP 1.093 0.052 18 0 "[ . 1 . 2]"
1 33 LEU 1.377 0.039 12 0 "[ . 1 . 2]"
1 34 HIS 1.456 0.163 16 0 "[ . 1 . 2]"
1 35 ASN 0.474 0.163 16 0 "[ . 1 . 2]"
1 36 ALA 0.354 0.151 16 0 "[ . 1 . 2]"
1 37 GLU 0.785 0.043 13 0 "[ . 1 . 2]"
1 38 LEU 1.330 0.052 5 0 "[ . 1 . 2]"
1 39 SER 4.206 0.167 14 0 "[ . 1 . 2]"
1 40 LYS 5.465 0.167 14 0 "[ . 1 . 2]"
1 41 MET 4.214 0.132 5 0 "[ . 1 . 2]"
1 42 LEU 0.398 0.021 12 0 "[ . 1 . 2]"
1 43 GLY 0.087 0.029 9 0 "[ . 1 . 2]"
1 44 LYS 0.181 0.029 9 0 "[ . 1 . 2]"
1 45 SER 0.118 0.014 19 0 "[ . 1 . 2]"
1 46 TRP 0.869 0.053 9 0 "[ . 1 . 2]"
1 47 LYS 1.081 0.059 16 0 "[ . 1 . 2]"
1 48 ALA 0.161 0.023 5 0 "[ . 1 . 2]"
1 49 LEU 0.056 0.012 11 0 "[ . 1 . 2]"
1 50 THR 0.014 0.005 1 0 "[ . 1 . 2]"
1 51 LEU 1.032 0.081 5 0 "[ . 1 . 2]"
1 52 ALA 1.047 0.081 5 0 "[ . 1 . 2]"
1 53 GLU 0.024 0.005 16 0 "[ . 1 . 2]"
1 54 LYS 0.454 0.036 12 0 "[ . 1 . 2]"
1 55 ARG 1.374 0.074 20 0 "[ . 1 . 2]"
1 56 PRO 0.088 0.010 18 0 "[ . 1 . 2]"
1 57 PHE 0.816 0.045 8 0 "[ . 1 . 2]"
1 58 VAL 1.819 0.074 20 0 "[ . 1 . 2]"
1 59 GLU 0.220 0.015 7 0 "[ . 1 . 2]"
1 60 GLU 0.683 0.045 8 0 "[ . 1 . 2]"
1 61 ALA 0.267 0.051 8 0 "[ . 1 . 2]"
1 62 GLU 0.364 0.056 10 0 "[ . 1 . 2]"
1 63 ARG 0.204 0.023 3 0 "[ . 1 . 2]"
1 64 LEU 0.236 0.040 3 0 "[ . 1 . 2]"
1 65 ARG 0.582 0.079 4 0 "[ . 1 . 2]"
1 66 VAL 0.215 0.047 5 0 "[ . 1 . 2]"
1 67 GLN 0.243 0.047 5 0 "[ . 1 . 2]"
1 68 HIS 0.199 0.060 16 0 "[ . 1 . 2]"
1 69 MET 0.543 0.080 17 0 "[ . 1 . 2]"
1 70 GLN 0.368 0.080 17 0 "[ . 1 . 2]"
1 71 ASP 0.120 0.039 18 0 "[ . 1 . 2]"
1 72 HIS 0.430 0.087 18 0 "[ . 1 . 2]"
1 73 PRO 0.365 0.053 18 0 "[ . 1 . 2]"
1 74 ASN 0.135 0.078 18 0 "[ . 1 . 2]"
1 75 TYR 0.330 0.087 18 0 "[ . 1 . 2]"
1 76 LYS 0.149 0.042 6 0 "[ . 1 . 2]"
1 77 SER 0.034 0.033 7 0 "[ . 1 . 2]"
1 78 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 7 GLY QA 1 8 ILE H . . 3.340 2.207 2.118 2.282 . 0 0 "[ . 1 . 2]" 1
2 1 7 GLY QA 1 8 ILE HB . . 4.900 4.468 4.323 4.662 . 0 0 "[ . 1 . 2]" 1
3 1 7 GLY QA 1 8 ILE MD . . 4.620 3.537 2.341 4.347 . 0 0 "[ . 1 . 2]" 1
4 1 7 GLY QA 1 8 ILE HG12 . . 5.220 4.614 3.254 5.204 . 0 0 "[ . 1 . 2]" 1
5 1 7 GLY QA 1 8 ILE QG . . 4.530 3.382 2.889 4.031 . 0 0 "[ . 1 . 2]" 1
6 1 7 GLY QA 1 8 ILE HG13 . . 5.220 3.617 2.960 5.157 . 0 0 "[ . 1 . 2]" 1
7 1 7 GLY QA 1 8 ILE MG . . 5.160 4.967 4.873 5.023 . 0 0 "[ . 1 . 2]" 1
8 1 8 ILE H 1 8 ILE HB . . 3.440 2.718 2.519 2.919 . 0 0 "[ . 1 . 2]" 1
9 1 8 ILE H 1 8 ILE MD . . 4.820 3.099 1.908 4.085 . 0 0 "[ . 1 . 2]" 1
10 1 8 ILE H 1 8 ILE HG12 . . 4.510 3.892 2.510 4.442 . 0 0 "[ . 1 . 2]" 1
11 1 8 ILE H 1 8 ILE QG . . 3.710 2.792 2.015 3.505 . 0 0 "[ . 1 . 2]" 1
12 1 8 ILE H 1 8 ILE HG13 . . 4.510 3.007 2.027 4.033 . 0 0 "[ . 1 . 2]" 1
13 1 8 ILE H 1 8 ILE MG . . 4.590 3.870 3.792 3.959 . 0 0 "[ . 1 . 2]" 1
14 1 8 ILE HA 1 8 ILE MD . . 4.130 3.544 2.080 3.966 . 0 0 "[ . 1 . 2]" 1
15 1 8 ILE HA 1 8 ILE HG12 . . 3.880 3.120 2.588 3.712 . 0 0 "[ . 1 . 2]" 1
16 1 8 ILE HA 1 8 ILE QG . . 3.260 2.539 2.309 3.150 . 0 0 "[ . 1 . 2]" 1
17 1 8 ILE HA 1 8 ILE HG13 . . 3.880 2.829 2.340 3.797 . 0 0 "[ . 1 . 2]" 1
18 1 8 ILE HA 1 8 ILE MG . . 3.100 2.300 2.151 2.456 . 0 0 "[ . 1 . 2]" 1
19 1 8 ILE HB 1 8 ILE MD . . 3.350 2.329 2.085 3.230 . 0 0 "[ . 1 . 2]" 1
20 1 8 ILE HB 1 9 ARG H . . 5.200 3.962 3.621 4.437 . 0 0 "[ . 1 . 2]" 1
21 1 8 ILE HB 1 9 ARG HA . . 5.500 5.072 4.725 5.451 . 0 0 "[ . 1 . 2]" 1
22 1 8 ILE HB 1 11 PRO HA . . 5.500 4.958 3.954 5.505 0.005 10 0 "[ . 1 . 2]" 1
23 1 8 ILE QG 1 8 ILE MG . . 2.950 2.133 1.982 2.307 . 0 0 "[ . 1 . 2]" 1
24 1 8 ILE HG12 1 8 ILE MG . . 3.390 2.284 2.036 3.185 . 0 0 "[ . 1 . 2]" 1
25 1 8 ILE HG13 1 8 ILE MG . . 3.390 2.884 2.228 3.197 . 0 0 "[ . 1 . 2]" 1
26 1 8 ILE MG 1 9 ARG H . . 4.770 2.281 1.912 3.231 . 0 0 "[ . 1 . 2]" 1
27 1 8 ILE MG 1 9 ARG HA . . 4.790 4.081 3.820 4.306 . 0 0 "[ . 1 . 2]" 1
28 1 8 ILE MG 1 9 ARG QD . . 5.500 4.990 3.207 5.490 . 0 0 "[ . 1 . 2]" 1
29 1 8 ILE MG 1 10 ARG HA . . 4.890 4.017 3.393 4.621 . 0 0 "[ . 1 . 2]" 1
30 1 8 ILE MG 1 10 ARG QD . . 4.890 4.087 2.165 4.878 . 0 0 "[ . 1 . 2]" 1
31 1 8 ILE MG 1 11 PRO HA . . 4.980 3.872 2.928 4.736 . 0 0 "[ . 1 . 2]" 1
32 1 9 ARG H 1 9 ARG QB . . 3.100 2.347 2.175 2.688 . 0 0 "[ . 1 . 2]" 1
33 1 9 ARG H 1 9 ARG HG2 . . 5.500 3.623 2.003 4.610 . 0 0 "[ . 1 . 2]" 1
34 1 9 ARG H 1 9 ARG QG . . 4.790 3.094 1.986 4.023 . 0 0 "[ . 1 . 2]" 1
35 1 9 ARG H 1 9 ARG HG3 . . 5.500 3.642 2.407 4.687 . 0 0 "[ . 1 . 2]" 1
36 1 9 ARG HA 1 9 ARG HG2 . . 4.140 3.055 2.232 3.849 . 0 0 "[ . 1 . 2]" 1
37 1 9 ARG HA 1 9 ARG QG . . 3.540 2.539 2.209 3.343 . 0 0 "[ . 1 . 2]" 1
38 1 9 ARG HA 1 9 ARG HG3 . . 4.140 3.075 2.286 3.882 . 0 0 "[ . 1 . 2]" 1
39 1 9 ARG HA 1 10 ARG QD . . 3.890 3.826 3.589 3.921 0.031 10 0 "[ . 1 . 2]" 1
40 1 9 ARG QB 1 10 ARG H . . 4.360 2.543 2.014 4.007 . 0 0 "[ . 1 . 2]" 1
41 1 9 ARG QB 1 10 ARG QD . . 3.650 2.273 1.840 3.528 . 0 0 "[ . 1 . 2]" 1
42 1 9 ARG QD 1 10 ARG QD . . 4.920 3.708 1.773 4.880 . 0 0 "[ . 1 . 2]" 1
43 1 10 ARG H 1 10 ARG QB . . 3.640 2.710 2.298 3.437 . 0 0 "[ . 1 . 2]" 1
44 1 10 ARG H 1 10 ARG QG . . 4.410 3.308 2.261 3.987 . 0 0 "[ . 1 . 2]" 1
45 1 10 ARG HA 1 10 ARG QG . . 3.630 2.772 2.199 3.461 . 0 0 "[ . 1 . 2]" 1
46 1 10 ARG HA 1 11 PRO HB3 . . 5.350 4.846 4.835 4.879 . 0 0 "[ . 1 . 2]" 1
47 1 10 ARG HA 1 11 PRO HD2 . . 3.020 2.395 2.330 2.547 . 0 0 "[ . 1 . 2]" 1
48 1 10 ARG HA 1 11 PRO HD3 . . 3.090 2.298 2.275 2.367 . 0 0 "[ . 1 . 2]" 1
49 1 10 ARG HA 1 11 PRO HG2 . . 5.000 4.509 4.455 4.634 . 0 0 "[ . 1 . 2]" 1
50 1 10 ARG HA 1 11 PRO HG3 . . 4.630 4.469 4.430 4.567 . 0 0 "[ . 1 . 2]" 1
51 1 10 ARG HA 1 68 HIS HE1 . . 4.820 3.911 3.372 4.808 . 0 0 "[ . 1 . 2]" 1
52 1 10 ARG QB 1 10 ARG QD . . 3.170 2.389 2.077 2.841 . 0 0 "[ . 1 . 2]" 1
53 1 10 ARG QB 1 11 PRO HD2 . . 3.180 2.090 1.924 2.223 . 0 0 "[ . 1 . 2]" 1
54 1 10 ARG QB 1 11 PRO HD3 . . 5.340 3.416 3.152 3.546 . 0 0 "[ . 1 . 2]" 1
55 1 10 ARG QB 1 68 HIS HE1 . . 5.340 4.724 4.043 5.320 . 0 0 "[ . 1 . 2]" 1
56 1 10 ARG HB2 1 11 PRO HD2 . . 3.890 3.193 1.977 3.791 . 0 0 "[ . 1 . 2]" 1
57 1 10 ARG HB3 1 11 PRO HD2 . . 3.890 2.428 2.030 3.363 . 0 0 "[ . 1 . 2]" 1
58 1 10 ARG QG 1 11 PRO HD2 . . 3.880 3.265 2.496 3.933 0.053 10 0 "[ . 1 . 2]" 1
59 1 10 ARG QG 1 11 PRO HD3 . . 5.500 4.161 3.391 5.011 . 0 0 "[ . 1 . 2]" 1
60 1 11 PRO HA 1 12 MET H . . 2.750 2.454 2.276 2.644 . 0 0 "[ . 1 . 2]" 1
61 1 11 PRO HA 1 12 MET HB2 . . 5.140 4.975 4.865 5.068 . 0 0 "[ . 1 . 2]" 1
62 1 11 PRO HA 1 12 MET HB3 . . 5.500 5.515 5.491 5.580 0.080 18 0 "[ . 1 . 2]" 1
63 1 11 PRO HA 1 12 MET ME . . 5.480 5.399 5.202 5.487 0.007 10 0 "[ . 1 . 2]" 1
64 1 11 PRO HA 1 12 MET HG2 . . 4.850 3.586 3.376 3.777 . 0 0 "[ . 1 . 2]" 1
65 1 11 PRO HA 1 12 MET HG3 . . 4.350 3.482 3.319 3.621 . 0 0 "[ . 1 . 2]" 1
66 1 11 PRO HA 1 64 LEU QD . . 4.770 3.718 3.249 4.062 . 0 0 "[ . 1 . 2]" 1
67 1 11 PRO HB2 1 12 MET H . . 4.150 2.502 2.061 2.964 . 0 0 "[ . 1 . 2]" 1
68 1 11 PRO HB2 1 12 MET HA . . 4.670 4.158 4.038 4.322 . 0 0 "[ . 1 . 2]" 1
69 1 11 PRO HB2 1 64 LEU QD . . 4.970 4.513 3.916 4.962 . 0 0 "[ . 1 . 2]" 1
70 1 11 PRO HB2 1 65 ARG HA . . 2.930 2.348 1.999 2.805 . 0 0 "[ . 1 . 2]" 1
71 1 11 PRO HB3 1 12 MET H . . 4.390 3.406 3.205 3.645 . 0 0 "[ . 1 . 2]" 1
72 1 11 PRO HB3 1 65 ARG HA . . 3.520 2.493 2.116 2.943 . 0 0 "[ . 1 . 2]" 1
73 1 11 PRO HB3 1 68 HIS HA . . 5.500 4.782 4.600 4.978 . 0 0 "[ . 1 . 2]" 1
74 1 11 PRO HB3 1 68 HIS HB2 . . 4.320 2.537 2.214 2.748 . 0 0 "[ . 1 . 2]" 1
75 1 11 PRO HB3 1 68 HIS HB3 . . 4.360 3.076 2.722 3.394 . 0 0 "[ . 1 . 2]" 1
76 1 11 PRO HG2 1 12 MET H . . 4.810 4.322 3.947 4.667 . 0 0 "[ . 1 . 2]" 1
77 1 11 PRO HG2 1 12 MET HA . . 5.500 4.753 4.569 4.937 . 0 0 "[ . 1 . 2]" 1
78 1 11 PRO HG2 1 65 ARG HA . . 3.790 3.707 3.446 3.792 0.002 6 0 "[ . 1 . 2]" 1
79 1 11 PRO HG2 1 68 HIS HB2 . . 4.520 4.087 3.780 4.500 . 0 0 "[ . 1 . 2]" 1
80 1 11 PRO HG2 1 68 HIS HB3 . . 4.420 4.004 3.824 4.219 . 0 0 "[ . 1 . 2]" 1
81 1 11 PRO HG2 1 68 HIS HD2 . . 4.920 4.549 4.115 4.922 0.002 18 0 "[ . 1 . 2]" 1
82 1 12 MET H 1 12 MET HB2 . . 3.550 3.044 2.911 3.149 . 0 0 "[ . 1 . 2]" 1
83 1 12 MET H 1 12 MET HB3 . . 4.070 3.885 3.793 3.963 . 0 0 "[ . 1 . 2]" 1
84 1 12 MET H 1 12 MET ME . . 4.710 4.356 4.136 4.566 . 0 0 "[ . 1 . 2]" 1
85 1 12 MET H 1 12 MET HG2 . . 3.850 3.172 3.016 3.348 . 0 0 "[ . 1 . 2]" 1
86 1 12 MET H 1 12 MET HG3 . . 3.510 2.763 2.497 2.973 . 0 0 "[ . 1 . 2]" 1
87 1 12 MET H 1 13 ASN H . . 4.620 4.420 4.359 4.486 . 0 0 "[ . 1 . 2]" 1
88 1 12 MET H 1 16 MET ME . . 5.450 5.060 4.108 5.365 . 0 0 "[ . 1 . 2]" 1
89 1 12 MET H 1 64 LEU HB2 . . 4.720 2.745 2.589 3.094 . 0 0 "[ . 1 . 2]" 1
90 1 12 MET H 1 64 LEU HB3 . . 3.760 3.164 2.861 3.545 . 0 0 "[ . 1 . 2]" 1
91 1 12 MET H 1 64 LEU QD . . 4.500 2.802 2.386 3.211 . 0 0 "[ . 1 . 2]" 1
92 1 12 MET HA 1 12 MET ME . . 4.580 4.450 4.365 4.564 . 0 0 "[ . 1 . 2]" 1
93 1 12 MET HA 1 12 MET HG2 . . 3.540 2.780 2.653 2.799 . 0 0 "[ . 1 . 2]" 1
94 1 12 MET HA 1 12 MET HG3 . . 3.810 3.646 3.586 3.714 . 0 0 "[ . 1 . 2]" 1
95 1 12 MET HA 1 13 ASN H . . 3.190 2.296 2.227 2.401 . 0 0 "[ . 1 . 2]" 1
96 1 12 MET HA 1 16 MET H . . 5.380 5.288 5.073 5.394 0.014 18 0 "[ . 1 . 2]" 1
97 1 12 MET HA 1 16 MET QB . . 3.870 3.026 2.729 3.226 . 0 0 "[ . 1 . 2]" 1
98 1 12 MET HA 1 16 MET ME . . 3.620 2.988 1.813 3.436 . 0 0 "[ . 1 . 2]" 1
99 1 12 MET HA 1 16 MET QG . . 4.380 3.563 2.874 4.176 . 0 0 "[ . 1 . 2]" 1
100 1 12 MET HA 1 17 VAL MG2 . . 4.600 4.334 4.007 4.554 . 0 0 "[ . 1 . 2]" 1
101 1 12 MET HA 1 64 LEU QD . . 5.160 4.651 4.294 4.928 . 0 0 "[ . 1 . 2]" 1
102 1 12 MET HB2 1 13 ASN H . . 4.030 3.465 3.202 3.646 . 0 0 "[ . 1 . 2]" 1
103 1 12 MET HB2 1 17 VAL MG2 . . 3.150 2.078 1.962 2.253 . 0 0 "[ . 1 . 2]" 1
104 1 12 MET HB2 1 61 ALA MB . . 4.000 3.607 3.480 3.754 . 0 0 "[ . 1 . 2]" 1
105 1 12 MET HB2 1 64 LEU QD . . 4.050 2.851 2.425 3.055 . 0 0 "[ . 1 . 2]" 1
106 1 12 MET HB3 1 13 ASN H . . 4.610 2.871 2.654 3.053 . 0 0 "[ . 1 . 2]" 1
107 1 12 MET HB3 1 17 VAL MG2 . . 3.760 3.082 2.561 3.422 . 0 0 "[ . 1 . 2]" 1
108 1 12 MET HB3 1 64 LEU QD . . 4.560 4.226 3.853 4.450 . 0 0 "[ . 1 . 2]" 1
109 1 12 MET ME 1 12 MET HG2 . . 3.570 3.375 3.364 3.394 . 0 0 "[ . 1 . 2]" 1
110 1 12 MET ME 1 12 MET HG3 . . 3.360 2.481 2.344 2.568 . 0 0 "[ . 1 . 2]" 1
111 1 12 MET ME 1 13 ASN H . . 4.990 4.881 4.581 4.989 . 0 0 "[ . 1 . 2]" 1
112 1 12 MET ME 1 17 VAL H . . 4.090 3.483 2.946 3.870 . 0 0 "[ . 1 . 2]" 1
113 1 12 MET ME 1 17 VAL HA . . 3.220 2.042 1.907 2.238 . 0 0 "[ . 1 . 2]" 1
114 1 12 MET ME 1 17 VAL MG1 . . 3.500 3.077 2.842 3.393 . 0 0 "[ . 1 . 2]" 1
115 1 12 MET ME 1 17 VAL MG2 . . 3.080 2.240 2.003 2.410 . 0 0 "[ . 1 . 2]" 1
116 1 12 MET ME 1 18 TRP H . . 5.160 4.991 4.749 5.146 . 0 0 "[ . 1 . 2]" 1
117 1 12 MET ME 1 20 LYS H . . 4.590 3.825 3.393 4.315 . 0 0 "[ . 1 . 2]" 1
118 1 12 MET ME 1 20 LYS HA . . 4.850 4.286 3.830 4.822 . 0 0 "[ . 1 . 2]" 1
119 1 12 MET ME 1 20 LYS QD . . 3.860 2.683 2.334 3.389 . 0 0 "[ . 1 . 2]" 1
120 1 12 MET ME 1 20 LYS QE . . 3.650 2.490 2.118 3.320 . 0 0 "[ . 1 . 2]" 1
121 1 12 MET ME 1 20 LYS HG2 . . 4.810 4.422 4.270 4.788 . 0 0 "[ . 1 . 2]" 1
122 1 12 MET ME 1 20 LYS HG3 . . 4.910 4.417 4.168 4.797 . 0 0 "[ . 1 . 2]" 1
123 1 12 MET ME 1 61 ALA HA . . 4.840 4.762 4.602 4.845 0.005 20 0 "[ . 1 . 2]" 1
124 1 12 MET ME 1 64 LEU QD . . 3.170 2.774 2.493 3.081 . 0 0 "[ . 1 . 2]" 1
125 1 12 MET HG2 1 13 ASN H . . 4.820 4.728 4.608 4.774 . 0 0 "[ . 1 . 2]" 1
126 1 12 MET HG2 1 16 MET QB . . 3.980 3.887 3.779 4.005 0.025 18 0 "[ . 1 . 2]" 1
127 1 12 MET HG2 1 16 MET ME . . 3.450 2.982 2.461 3.437 . 0 0 "[ . 1 . 2]" 1
128 1 12 MET HG2 1 64 LEU QD . . 4.240 3.986 3.657 4.241 0.001 3 0 "[ . 1 . 2]" 1
129 1 12 MET HG3 1 13 ASN H . . 5.470 5.192 5.052 5.293 . 0 0 "[ . 1 . 2]" 1
130 1 12 MET HG3 1 17 VAL MG1 . . 5.500 5.489 5.396 5.519 0.019 10 0 "[ . 1 . 2]" 1
131 1 12 MET HG3 1 17 VAL MG2 . . 3.950 3.770 3.592 3.881 . 0 0 "[ . 1 . 2]" 1
132 1 12 MET HG3 1 61 ALA MB . . 5.500 5.316 5.156 5.513 0.013 18 0 "[ . 1 . 2]" 1
133 1 12 MET HG3 1 64 LEU MD1 . . 5.260 2.583 2.334 2.903 . 0 0 "[ . 1 . 2]" 1
134 1 12 MET HG3 1 64 LEU QD . . 4.020 2.572 2.326 2.882 . 0 0 "[ . 1 . 2]" 1
135 1 12 MET HG3 1 64 LEU MD2 . . 5.260 4.769 4.343 5.140 . 0 0 "[ . 1 . 2]" 1
136 1 13 ASN H 1 14 ALA H . . 5.110 4.458 4.422 4.502 . 0 0 "[ . 1 . 2]" 1
137 1 13 ASN H 1 16 MET H . . 3.990 3.300 3.153 3.419 . 0 0 "[ . 1 . 2]" 1
138 1 13 ASN H 1 16 MET QB . . 3.590 1.975 1.887 2.113 . 0 0 "[ . 1 . 2]" 1
139 1 13 ASN H 1 16 MET ME . . 4.170 3.800 2.416 4.143 . 0 0 "[ . 1 . 2]" 1
140 1 13 ASN H 1 16 MET QG . . 3.890 2.587 2.254 3.041 . 0 0 "[ . 1 . 2]" 1
141 1 13 ASN H 1 17 VAL H . . 4.710 3.718 3.565 3.901 . 0 0 "[ . 1 . 2]" 1
142 1 13 ASN H 1 17 VAL MG2 . . 5.310 3.783 3.483 3.929 . 0 0 "[ . 1 . 2]" 1
143 1 13 ASN H 1 61 ALA MB . . 4.660 3.752 3.615 3.908 . 0 0 "[ . 1 . 2]" 1
144 1 13 ASN QB 1 14 ALA MB . . 4.250 3.503 3.372 3.661 . 0 0 "[ . 1 . 2]" 1
145 1 13 ASN QB 1 15 PHE H . . 3.980 2.983 2.577 3.548 . 0 0 "[ . 1 . 2]" 1
146 1 13 ASN QB 1 16 MET H . . 4.760 3.580 2.861 4.030 . 0 0 "[ . 1 . 2]" 1
147 1 13 ASN QB 1 16 MET QB . . 4.640 3.980 3.652 4.224 . 0 0 "[ . 1 . 2]" 1
148 1 13 ASN QB 1 61 ALA MB . . 3.870 3.426 3.313 3.581 . 0 0 "[ . 1 . 2]" 1
149 1 13 ASN HB2 1 14 ALA H . . 3.700 2.187 1.950 2.628 . 0 0 "[ . 1 . 2]" 1
150 1 13 ASN HB2 1 14 ALA MB . . 5.020 3.652 3.450 3.902 . 0 0 "[ . 1 . 2]" 1
151 1 13 ASN HB2 1 15 PHE H . . 4.700 3.052 2.621 3.682 . 0 0 "[ . 1 . 2]" 1
152 1 13 ASN HB2 1 16 MET QB . . 5.410 4.509 3.762 5.090 . 0 0 "[ . 1 . 2]" 1
153 1 13 ASN HB2 1 61 ALA MB . . 4.410 3.787 3.569 4.059 . 0 0 "[ . 1 . 2]" 1
154 1 13 ASN HB3 1 14 ALA H . . 3.700 3.208 2.307 3.716 0.016 10 0 "[ . 1 . 2]" 1
155 1 13 ASN HB3 1 14 ALA MB . . 5.020 4.735 3.885 5.121 0.101 10 0 "[ . 1 . 2]" 1
156 1 13 ASN HB3 1 15 PHE H . . 4.700 4.372 3.811 4.644 . 0 0 "[ . 1 . 2]" 1
157 1 13 ASN HB3 1 16 MET QB . . 5.410 4.595 4.119 5.002 . 0 0 "[ . 1 . 2]" 1
158 1 13 ASN HB3 1 61 ALA MB . . 4.410 3.977 3.530 4.216 . 0 0 "[ . 1 . 2]" 1
159 1 13 ASN QD 1 14 ALA H . . 5.340 3.900 3.246 4.459 . 0 0 "[ . 1 . 2]" 1
160 1 13 ASN QD 1 14 ALA MB . . 5.130 4.523 3.771 5.219 0.089 7 0 "[ . 1 . 2]" 1
161 1 13 ASN QD 1 15 PHE H . . 4.990 2.900 1.782 4.410 . 0 0 "[ . 1 . 2]" 1
162 1 13 ASN QD 1 15 PHE HB3 . . 4.750 2.407 1.769 4.076 . 0 0 "[ . 1 . 2]" 1
163 1 13 ASN QD 1 15 PHE QD . . 5.020 2.698 1.880 4.730 . 0 0 "[ . 1 . 2]" 1
164 1 13 ASN QD 1 16 MET H . . 4.650 2.397 1.697 4.272 . 0 0 "[ . 1 . 2]" 1
165 1 13 ASN QD 1 16 MET QB . . 4.560 3.194 2.296 4.570 0.010 7 0 "[ . 1 . 2]" 1
166 1 13 ASN QD 1 16 MET ME . . 4.710 4.338 3.709 4.715 0.005 8 0 "[ . 1 . 2]" 1
167 1 13 ASN QD 1 16 MET QG . . 3.570 2.127 1.682 3.540 . 0 0 "[ . 1 . 2]" 1
168 1 13 ASN HD21 1 16 MET QB . . 5.340 3.579 2.394 5.069 . 0 0 "[ . 1 . 2]" 1
169 1 13 ASN HD22 1 16 MET QB . . 5.340 3.677 2.951 5.215 . 0 0 "[ . 1 . 2]" 1
170 1 14 ALA H 1 14 ALA MB . . 3.210 2.172 2.093 2.235 . 0 0 "[ . 1 . 2]" 1
171 1 14 ALA H 1 15 PHE H . . 3.690 2.784 2.695 2.853 . 0 0 "[ . 1 . 2]" 1
172 1 14 ALA H 1 15 PHE HB2 . . 5.500 5.501 5.474 5.522 0.022 17 0 "[ . 1 . 2]" 1
173 1 14 ALA H 1 15 PHE HB3 . . 4.910 4.777 4.643 4.882 . 0 0 "[ . 1 . 2]" 1
174 1 14 ALA H 1 16 MET H . . 4.910 4.366 4.195 4.539 . 0 0 "[ . 1 . 2]" 1
175 1 14 ALA H 1 17 VAL MG2 . . 4.790 4.267 4.123 4.372 . 0 0 "[ . 1 . 2]" 1
176 1 14 ALA H 1 58 VAL HA . . 4.950 4.365 4.086 4.516 . 0 0 "[ . 1 . 2]" 1
177 1 14 ALA H 1 61 ALA MB . . 3.590 2.723 2.659 2.799 . 0 0 "[ . 1 . 2]" 1
178 1 14 ALA HA 1 16 MET H . . 4.790 4.751 4.456 4.818 0.028 18 0 "[ . 1 . 2]" 1
179 1 14 ALA HA 1 17 VAL H . . 4.060 3.938 3.822 4.072 0.012 10 0 "[ . 1 . 2]" 1
180 1 14 ALA HA 1 17 VAL HB . . 3.580 3.057 2.778 3.231 . 0 0 "[ . 1 . 2]" 1
181 1 14 ALA HA 1 17 VAL MG1 . . 4.460 4.279 3.980 4.464 0.004 11 0 "[ . 1 . 2]" 1
182 1 14 ALA HA 1 17 VAL MG2 . . 3.420 3.053 2.824 3.328 . 0 0 "[ . 1 . 2]" 1
183 1 14 ALA HA 1 18 TRP H . . 4.960 3.932 3.800 4.035 . 0 0 "[ . 1 . 2]" 1
184 1 14 ALA HA 1 46 TRP HH2 . . 5.200 3.761 3.571 3.957 . 0 0 "[ . 1 . 2]" 1
185 1 14 ALA HA 1 57 PHE HB2 . . 4.590 3.960 3.734 4.130 . 0 0 "[ . 1 . 2]" 1
186 1 14 ALA HA 1 57 PHE QD . . 5.500 5.275 5.120 5.378 . 0 0 "[ . 1 . 2]" 1
187 1 14 ALA HA 1 58 VAL MG1 . . 5.160 5.137 5.090 5.164 0.004 5 0 "[ . 1 . 2]" 1
188 1 14 ALA HA 1 61 ALA H . . 4.440 3.884 3.801 3.949 . 0 0 "[ . 1 . 2]" 1
189 1 14 ALA HA 1 61 ALA MB . . 2.870 2.320 2.165 2.525 . 0 0 "[ . 1 . 2]" 1
190 1 14 ALA MB 1 15 PHE H . . 3.250 2.572 2.493 2.643 . 0 0 "[ . 1 . 2]" 1
191 1 14 ALA MB 1 15 PHE HA . . 4.330 3.795 3.720 3.860 . 0 0 "[ . 1 . 2]" 1
192 1 14 ALA MB 1 15 PHE HB2 . . 4.350 4.249 4.183 4.312 . 0 0 "[ . 1 . 2]" 1
193 1 14 ALA MB 1 15 PHE HB3 . . 5.010 4.400 4.302 4.522 . 0 0 "[ . 1 . 2]" 1
194 1 14 ALA MB 1 16 MET H . . 4.810 4.662 4.523 4.749 . 0 0 "[ . 1 . 2]" 1
195 1 14 ALA MB 1 17 VAL H . . 5.500 4.982 4.861 5.121 . 0 0 "[ . 1 . 2]" 1
196 1 14 ALA MB 1 17 VAL HB . . 4.920 4.481 4.293 4.599 . 0 0 "[ . 1 . 2]" 1
197 1 14 ALA MB 1 18 TRP H . . 5.120 4.657 4.515 4.727 . 0 0 "[ . 1 . 2]" 1
198 1 14 ALA MB 1 18 TRP HB2 . . 5.320 5.023 4.685 5.206 . 0 0 "[ . 1 . 2]" 1
199 1 14 ALA MB 1 46 TRP HE1 . . 4.850 4.064 3.836 4.189 . 0 0 "[ . 1 . 2]" 1
200 1 14 ALA MB 1 46 TRP HH2 . . 3.080 2.110 1.976 2.405 . 0 0 "[ . 1 . 2]" 1
201 1 14 ALA MB 1 46 TRP HZ2 . . 3.170 1.976 1.897 2.054 . 0 0 "[ . 1 . 2]" 1
202 1 14 ALA MB 1 46 TRP HZ3 . . 4.530 4.238 4.079 4.531 0.001 1 0 "[ . 1 . 2]" 1
203 1 14 ALA MB 1 54 LYS HA . . 4.510 4.272 4.079 4.448 . 0 0 "[ . 1 . 2]" 1
204 1 14 ALA MB 1 54 LYS QD . . 4.750 4.205 3.687 4.734 . 0 0 "[ . 1 . 2]" 1
205 1 14 ALA MB 1 57 PHE HA . . 4.830 4.820 4.758 4.839 0.009 7 0 "[ . 1 . 2]" 1
206 1 14 ALA MB 1 57 PHE HB2 . . 3.530 3.384 3.251 3.526 . 0 0 "[ . 1 . 2]" 1
207 1 14 ALA MB 1 57 PHE HB3 . . 4.090 3.777 3.711 3.889 . 0 0 "[ . 1 . 2]" 1
208 1 14 ALA MB 1 57 PHE QD . . 5.500 4.769 4.603 4.869 . 0 0 "[ . 1 . 2]" 1
209 1 14 ALA MB 1 58 VAL H . . 4.140 4.018 3.835 4.092 . 0 0 "[ . 1 . 2]" 1
210 1 14 ALA MB 1 58 VAL HA . . 2.760 2.123 2.014 2.250 . 0 0 "[ . 1 . 2]" 1
211 1 14 ALA MB 1 58 VAL HB . . 4.300 4.129 3.956 4.214 . 0 0 "[ . 1 . 2]" 1
212 1 14 ALA MB 1 58 VAL MG1 . . 3.340 3.340 3.284 3.347 0.007 6 0 "[ . 1 . 2]" 1
213 1 14 ALA MB 1 58 VAL MG2 . . 2.870 2.013 1.861 2.118 . 0 0 "[ . 1 . 2]" 1
214 1 14 ALA MB 1 59 GLU H . . 5.200 5.154 5.052 5.201 0.001 16 0 "[ . 1 . 2]" 1
215 1 14 ALA MB 1 61 ALA H . . 4.830 4.561 4.468 4.706 . 0 0 "[ . 1 . 2]" 1
216 1 14 ALA MB 1 61 ALA MB . . 3.160 3.072 2.943 3.153 . 0 0 "[ . 1 . 2]" 1
217 1 15 PHE H 1 15 PHE HB2 . . 3.110 2.816 2.738 2.920 . 0 0 "[ . 1 . 2]" 1
218 1 15 PHE H 1 15 PHE HB3 . . 3.020 2.288 2.217 2.339 . 0 0 "[ . 1 . 2]" 1
219 1 15 PHE H 1 15 PHE QD . . 4.120 4.046 3.929 4.119 . 0 0 "[ . 1 . 2]" 1
220 1 15 PHE H 1 16 MET H . . 3.280 2.708 2.590 2.823 . 0 0 "[ . 1 . 2]" 1
221 1 15 PHE H 1 16 MET HA . . 5.500 5.297 5.212 5.387 . 0 0 "[ . 1 . 2]" 1
222 1 15 PHE H 1 16 MET QB . . 4.640 4.564 4.409 4.648 0.008 7 0 "[ . 1 . 2]" 1
223 1 15 PHE H 1 17 VAL MG2 . . 5.000 4.969 4.836 5.022 0.022 10 0 "[ . 1 . 2]" 1
224 1 15 PHE H 1 46 TRP HE1 . . 5.320 4.349 4.137 4.477 . 0 0 "[ . 1 . 2]" 1
225 1 15 PHE H 1 46 TRP HH2 . . 4.790 4.509 4.335 4.776 . 0 0 "[ . 1 . 2]" 1
226 1 15 PHE H 1 46 TRP HZ2 . . 4.020 3.533 3.417 3.644 . 0 0 "[ . 1 . 2]" 1
227 1 15 PHE H 1 61 ALA MB . . 4.510 4.473 4.411 4.522 0.012 7 0 "[ . 1 . 2]" 1
228 1 15 PHE HA 1 15 PHE QD . . 3.760 3.062 2.865 3.199 . 0 0 "[ . 1 . 2]" 1
229 1 15 PHE HA 1 18 TRP H . . 4.440 4.138 3.954 4.303 . 0 0 "[ . 1 . 2]" 1
230 1 15 PHE HA 1 18 TRP HB3 . . 4.360 3.177 2.950 3.326 . 0 0 "[ . 1 . 2]" 1
231 1 15 PHE HA 1 18 TRP HE3 . . 4.600 3.160 3.018 3.315 . 0 0 "[ . 1 . 2]" 1
232 1 15 PHE HA 1 19 ALA MB . . 5.150 4.325 4.151 4.452 . 0 0 "[ . 1 . 2]" 1
233 1 15 PHE HA 1 46 TRP HH2 . . 4.850 3.825 3.643 3.982 . 0 0 "[ . 1 . 2]" 1
234 1 15 PHE HA 1 46 TRP HZ2 . . 4.630 3.636 3.479 3.771 . 0 0 "[ . 1 . 2]" 1
235 1 15 PHE HB2 1 16 MET H . . 4.140 3.929 3.854 4.064 . 0 0 "[ . 1 . 2]" 1
236 1 15 PHE HB2 1 46 TRP HD1 . . 4.730 3.490 3.117 3.752 . 0 0 "[ . 1 . 2]" 1
237 1 15 PHE HB2 1 46 TRP HE1 . . 4.340 2.896 2.685 3.115 . 0 0 "[ . 1 . 2]" 1
238 1 15 PHE HB2 1 46 TRP HZ2 . . 4.480 3.925 3.755 4.062 . 0 0 "[ . 1 . 2]" 1
239 1 15 PHE HB3 1 16 MET H . . 3.320 2.556 2.438 2.767 . 0 0 "[ . 1 . 2]" 1
240 1 15 PHE HB3 1 16 MET HA . . 4.970 4.509 4.439 4.631 . 0 0 "[ . 1 . 2]" 1
241 1 15 PHE HB3 1 46 TRP HE1 . . 4.760 4.383 4.055 4.661 . 0 0 "[ . 1 . 2]" 1
242 1 15 PHE HB3 1 46 TRP HZ2 . . 5.050 4.919 4.744 5.058 0.008 10 0 "[ . 1 . 2]" 1
243 1 15 PHE QD 1 16 MET H . . 3.880 2.590 2.280 2.803 . 0 0 "[ . 1 . 2]" 1
244 1 15 PHE QD 1 16 MET HA . . 4.140 2.841 2.603 3.125 . 0 0 "[ . 1 . 2]" 1
245 1 15 PHE QD 1 16 MET QB . . 4.290 3.836 3.474 4.108 . 0 0 "[ . 1 . 2]" 1
246 1 15 PHE QD 1 16 MET ME . . 5.110 4.842 4.400 5.101 . 0 0 "[ . 1 . 2]" 1
247 1 15 PHE QD 1 16 MET HG2 . . 4.030 2.535 2.099 3.047 . 0 0 "[ . 1 . 2]" 1
248 1 15 PHE QD 1 16 MET QG . . 3.540 2.302 2.090 2.597 . 0 0 "[ . 1 . 2]" 1
249 1 15 PHE QD 1 16 MET HG3 . . 4.030 3.159 2.419 3.935 . 0 0 "[ . 1 . 2]" 1
250 1 15 PHE QD 1 18 TRP HE3 . . 4.730 3.968 3.625 4.189 . 0 0 "[ . 1 . 2]" 1
251 1 15 PHE QD 1 18 TRP HZ3 . . 4.440 3.722 3.458 3.936 . 0 0 "[ . 1 . 2]" 1
252 1 15 PHE QD 1 19 ALA MB . . 4.270 3.756 3.526 3.902 . 0 0 "[ . 1 . 2]" 1
253 1 15 PHE QD 1 46 TRP H . . 4.890 4.736 4.568 4.890 0.000 10 0 "[ . 1 . 2]" 1
254 1 15 PHE QD 1 46 TRP HB2 . . 3.760 2.479 2.261 2.636 . 0 0 "[ . 1 . 2]" 1
255 1 15 PHE QD 1 46 TRP HB3 . . 4.060 2.807 2.630 2.920 . 0 0 "[ . 1 . 2]" 1
256 1 15 PHE QD 1 46 TRP HD1 . . 3.780 2.851 2.572 3.065 . 0 0 "[ . 1 . 2]" 1
257 1 15 PHE QD 1 46 TRP HE1 . . 5.010 3.953 3.748 4.128 . 0 0 "[ . 1 . 2]" 1
258 1 15 PHE QD 1 46 TRP HE3 . . 5.120 4.265 3.991 4.503 . 0 0 "[ . 1 . 2]" 1
259 1 15 PHE QE 1 16 MET H . . 5.140 4.754 4.460 4.961 . 0 0 "[ . 1 . 2]" 1
260 1 15 PHE QE 1 16 MET HA . . 4.510 3.626 3.357 3.933 . 0 0 "[ . 1 . 2]" 1
261 1 15 PHE QE 1 16 MET ME . . 5.400 5.084 4.556 5.409 0.009 18 0 "[ . 1 . 2]" 1
262 1 15 PHE QE 1 16 MET HG2 . . 5.180 3.525 2.567 3.783 . 0 0 "[ . 1 . 2]" 1
263 1 15 PHE QE 1 16 MET QG . . 4.500 3.414 2.530 3.651 . 0 0 "[ . 1 . 2]" 1
264 1 15 PHE QE 1 16 MET HG3 . . 5.180 4.674 3.842 5.187 0.007 17 0 "[ . 1 . 2]" 1
265 1 15 PHE QE 1 18 TRP HZ3 . . 3.410 3.153 2.761 3.414 0.004 18 0 "[ . 1 . 2]" 1
266 1 15 PHE QE 1 19 ALA MB . . 3.660 3.517 3.294 3.668 0.008 10 0 "[ . 1 . 2]" 1
267 1 15 PHE QE 1 42 LEU H . . 5.110 4.854 4.708 4.951 . 0 0 "[ . 1 . 2]" 1
268 1 15 PHE QE 1 42 LEU HA . . 4.380 4.274 4.048 4.383 0.003 9 0 "[ . 1 . 2]" 1
269 1 15 PHE QE 1 42 LEU HB2 . . 3.920 3.190 3.034 3.332 . 0 0 "[ . 1 . 2]" 1
270 1 15 PHE QE 1 42 LEU HB3 . . 3.600 3.057 2.824 3.185 . 0 0 "[ . 1 . 2]" 1
271 1 15 PHE QE 1 42 LEU MD1 . . 4.140 3.535 3.218 3.671 . 0 0 "[ . 1 . 2]" 1
272 1 15 PHE QE 1 42 LEU MD2 . . 4.690 4.590 4.416 4.690 . 0 0 "[ . 1 . 2]" 1
273 1 15 PHE QE 1 43 GLY H . . 4.120 3.414 3.246 3.541 . 0 0 "[ . 1 . 2]" 1
274 1 15 PHE QE 1 43 GLY HA2 . . 3.810 2.020 1.998 2.072 . 0 0 "[ . 1 . 2]" 1
275 1 15 PHE QE 1 43 GLY HA3 . . 4.060 3.275 3.136 3.378 . 0 0 "[ . 1 . 2]" 1
276 1 15 PHE QE 1 44 LYS H . . 5.130 5.098 5.008 5.135 0.005 11 0 "[ . 1 . 2]" 1
277 1 15 PHE QE 1 45 SER H . . 5.500 5.396 5.181 5.496 . 0 0 "[ . 1 . 2]" 1
278 1 15 PHE QE 1 46 TRP H . . 4.420 4.238 4.021 4.385 . 0 0 "[ . 1 . 2]" 1
279 1 15 PHE QE 1 46 TRP HB2 . . 3.640 3.013 2.777 3.265 . 0 0 "[ . 1 . 2]" 1
280 1 15 PHE QE 1 46 TRP HB3 . . 4.010 3.278 3.150 3.509 . 0 0 "[ . 1 . 2]" 1
281 1 15 PHE HZ 1 39 SER HA . . 5.130 3.117 2.865 3.348 . 0 0 "[ . 1 . 2]" 1
282 1 15 PHE HZ 1 39 SER HB2 . . 5.430 4.622 4.337 4.935 . 0 0 "[ . 1 . 2]" 1
283 1 15 PHE HZ 1 39 SER HB3 . . 5.500 4.718 4.493 4.933 . 0 0 "[ . 1 . 2]" 1
284 1 15 PHE HZ 1 42 LEU H . . 5.380 4.622 4.468 4.758 . 0 0 "[ . 1 . 2]" 1
285 1 15 PHE HZ 1 42 LEU HA . . 5.050 4.919 4.804 5.057 0.007 18 0 "[ . 1 . 2]" 1
286 1 15 PHE HZ 1 42 LEU HB2 . . 3.840 2.354 2.221 2.475 . 0 0 "[ . 1 . 2]" 1
287 1 15 PHE HZ 1 42 LEU HB3 . . 3.700 2.934 2.796 3.191 . 0 0 "[ . 1 . 2]" 1
288 1 15 PHE HZ 1 42 LEU MD1 . . 3.860 3.069 2.896 3.267 . 0 0 "[ . 1 . 2]" 1
289 1 15 PHE HZ 1 42 LEU MD2 . . 4.820 4.659 4.511 4.817 . 0 0 "[ . 1 . 2]" 1
290 1 15 PHE HZ 1 42 LEU HG . . 4.750 4.677 4.497 4.753 0.003 17 0 "[ . 1 . 2]" 1
291 1 15 PHE HZ 1 43 GLY H . . 4.670 4.058 3.828 4.225 . 0 0 "[ . 1 . 2]" 1
292 1 15 PHE HZ 1 43 GLY HA2 . . 4.460 4.108 3.940 4.269 . 0 0 "[ . 1 . 2]" 1
293 1 15 PHE HZ 1 43 GLY HA3 . . 5.500 4.598 4.400 4.761 . 0 0 "[ . 1 . 2]" 1
294 1 15 PHE HZ 1 46 TRP HB2 . . 5.500 5.258 5.149 5.419 . 0 0 "[ . 1 . 2]" 1
295 1 16 MET H 1 16 MET QB . . 2.900 2.357 2.238 2.498 . 0 0 "[ . 1 . 2]" 1
296 1 16 MET H 1 16 MET HG2 . . 3.520 3.019 2.285 3.541 0.021 13 0 "[ . 1 . 2]" 1
297 1 16 MET H 1 16 MET QG . . 3.080 2.399 2.134 2.671 . 0 0 "[ . 1 . 2]" 1
298 1 16 MET H 1 16 MET HG3 . . 3.520 2.828 2.163 3.525 0.005 5 0 "[ . 1 . 2]" 1
299 1 16 MET H 1 17 VAL MG2 . . 4.440 4.285 4.197 4.385 . 0 0 "[ . 1 . 2]" 1
300 1 16 MET H 1 19 ALA MB . . 4.600 4.287 4.162 4.447 . 0 0 "[ . 1 . 2]" 1
301 1 16 MET H 1 61 ALA MB . . 4.980 4.762 4.538 4.952 . 0 0 "[ . 1 . 2]" 1
302 1 16 MET HA 1 16 MET ME . . 4.130 3.756 3.307 4.139 0.009 18 0 "[ . 1 . 2]" 1
303 1 16 MET HA 1 16 MET HG2 . . 3.820 2.460 2.214 2.702 . 0 0 "[ . 1 . 2]" 1
304 1 16 MET HA 1 16 MET QG . . 3.260 2.398 2.171 2.644 . 0 0 "[ . 1 . 2]" 1
305 1 16 MET HA 1 16 MET HG3 . . 3.820 3.363 2.945 3.750 . 0 0 "[ . 1 . 2]" 1
306 1 16 MET HA 1 18 TRP H . . 5.500 5.103 4.829 5.258 . 0 0 "[ . 1 . 2]" 1
307 1 16 MET HA 1 18 TRP HE3 . . 5.500 4.783 4.606 5.060 . 0 0 "[ . 1 . 2]" 1
308 1 16 MET HA 1 19 ALA H . . 4.250 3.617 3.363 3.744 . 0 0 "[ . 1 . 2]" 1
309 1 16 MET HA 1 19 ALA MB . . 3.140 2.344 2.104 2.468 . 0 0 "[ . 1 . 2]" 1
310 1 16 MET HA 1 20 LYS H . . 4.840 4.207 4.043 4.390 . 0 0 "[ . 1 . 2]" 1
311 1 16 MET QB 1 17 VAL H . . 3.350 2.328 2.207 2.488 . 0 0 "[ . 1 . 2]" 1
312 1 16 MET QB 1 17 VAL HA . . 4.530 3.784 3.728 3.835 . 0 0 "[ . 1 . 2]" 1
313 1 16 MET QB 1 17 VAL MG2 . . 4.450 3.119 3.020 3.290 . 0 0 "[ . 1 . 2]" 1
314 1 16 MET QB 1 19 ALA MB . . 4.090 3.991 3.810 4.085 . 0 0 "[ . 1 . 2]" 1
315 1 16 MET ME 1 16 MET HG2 . . 3.670 2.812 2.230 3.392 . 0 0 "[ . 1 . 2]" 1
316 1 16 MET ME 1 16 MET QG . . 3.170 2.315 2.175 2.613 . 0 0 "[ . 1 . 2]" 1
317 1 16 MET ME 1 16 MET HG3 . . 3.670 2.910 2.205 3.396 . 0 0 "[ . 1 . 2]" 1
318 1 16 MET QG 1 19 ALA MB . . 4.580 4.164 3.787 4.360 . 0 0 "[ . 1 . 2]" 1
319 1 16 MET HG2 1 17 VAL H . . 4.960 4.700 4.383 4.918 . 0 0 "[ . 1 . 2]" 1
320 1 16 MET HG3 1 17 VAL H . . 4.960 4.462 4.150 4.711 . 0 0 "[ . 1 . 2]" 1
321 1 17 VAL H 1 17 VAL HB . . 3.080 2.628 2.528 2.742 . 0 0 "[ . 1 . 2]" 1
322 1 17 VAL H 1 17 VAL MG1 . . 3.910 3.767 3.757 3.781 . 0 0 "[ . 1 . 2]" 1
323 1 17 VAL H 1 17 VAL MG2 . . 2.920 2.052 1.889 2.289 . 0 0 "[ . 1 . 2]" 1
324 1 17 VAL H 1 18 TRP H . . 3.250 3.123 2.976 3.252 0.002 15 0 "[ . 1 . 2]" 1
325 1 17 VAL H 1 18 TRP HB3 . . 5.060 4.918 4.780 5.061 0.001 10 0 "[ . 1 . 2]" 1
326 1 17 VAL H 1 19 ALA H . . 4.560 3.990 3.889 4.163 . 0 0 "[ . 1 . 2]" 1
327 1 17 VAL H 1 20 LYS QD . . 5.500 4.787 4.628 5.012 . 0 0 "[ . 1 . 2]" 1
328 1 17 VAL H 1 61 ALA MB . . 4.360 3.624 3.471 3.851 . 0 0 "[ . 1 . 2]" 1
329 1 17 VAL HA 1 17 VAL MG1 . . 3.130 2.435 2.389 2.485 . 0 0 "[ . 1 . 2]" 1
330 1 17 VAL HA 1 17 VAL MG2 . . 2.870 2.375 2.261 2.435 . 0 0 "[ . 1 . 2]" 1
331 1 17 VAL HA 1 20 LYS H . . 4.240 3.374 3.277 3.494 . 0 0 "[ . 1 . 2]" 1
332 1 17 VAL HA 1 20 LYS HA . . 5.470 5.102 4.866 5.276 . 0 0 "[ . 1 . 2]" 1
333 1 17 VAL HA 1 20 LYS HB3 . . 3.880 2.710 2.538 2.905 . 0 0 "[ . 1 . 2]" 1
334 1 17 VAL HA 1 20 LYS QD . . 3.990 2.248 2.046 2.462 . 0 0 "[ . 1 . 2]" 1
335 1 17 VAL HA 1 20 LYS QE . . 3.900 3.657 3.529 3.904 0.004 13 0 "[ . 1 . 2]" 1
336 1 17 VAL HA 1 20 LYS HG2 . . 4.410 4.191 4.092 4.371 . 0 0 "[ . 1 . 2]" 1
337 1 17 VAL HA 1 20 LYS HG3 . . 5.200 4.982 4.828 5.199 . 0 0 "[ . 1 . 2]" 1
338 1 17 VAL HA 1 61 ALA MB . . 5.180 4.912 4.701 5.090 . 0 0 "[ . 1 . 2]" 1
339 1 17 VAL HA 1 64 LEU QD . . 4.800 4.366 4.048 4.635 . 0 0 "[ . 1 . 2]" 1
340 1 17 VAL HB 1 18 TRP H . . 3.210 2.058 1.930 2.250 . 0 0 "[ . 1 . 2]" 1
341 1 17 VAL HB 1 18 TRP HA . . 4.980 4.173 4.058 4.293 . 0 0 "[ . 1 . 2]" 1
342 1 17 VAL HB 1 18 TRP HB3 . . 4.800 4.208 4.122 4.278 . 0 0 "[ . 1 . 2]" 1
343 1 17 VAL HB 1 20 LYS QD . . 5.230 4.193 3.958 4.514 . 0 0 "[ . 1 . 2]" 1
344 1 17 VAL HB 1 57 PHE HA . . 4.070 3.821 3.743 3.931 . 0 0 "[ . 1 . 2]" 1
345 1 17 VAL HB 1 57 PHE HB2 . . 4.600 4.526 4.422 4.602 0.002 11 0 "[ . 1 . 2]" 1
346 1 17 VAL HB 1 57 PHE HB3 . . 4.460 2.884 2.790 2.950 . 0 0 "[ . 1 . 2]" 1
347 1 17 VAL HB 1 57 PHE QD . . 3.990 3.918 3.764 3.993 0.003 18 0 "[ . 1 . 2]" 1
348 1 17 VAL HB 1 61 ALA MB . . 3.680 3.377 3.022 3.602 . 0 0 "[ . 1 . 2]" 1
349 1 17 VAL MG1 1 18 TRP H . . 3.890 2.932 2.796 3.067 . 0 0 "[ . 1 . 2]" 1
350 1 17 VAL MG1 1 18 TRP HA . . 4.050 3.189 3.082 3.341 . 0 0 "[ . 1 . 2]" 1
351 1 17 VAL MG1 1 18 TRP HB3 . . 4.780 4.645 4.518 4.771 . 0 0 "[ . 1 . 2]" 1
352 1 17 VAL MG1 1 19 ALA MB . . 5.500 5.492 5.437 5.524 0.024 13 0 "[ . 1 . 2]" 1
353 1 17 VAL MG1 1 20 LYS H . . 4.760 4.420 4.293 4.617 . 0 0 "[ . 1 . 2]" 1
354 1 17 VAL MG1 1 20 LYS QD . . 4.090 2.203 1.937 2.497 . 0 0 "[ . 1 . 2]" 1
355 1 17 VAL MG1 1 20 LYS QE . . 3.970 3.137 2.834 3.797 . 0 0 "[ . 1 . 2]" 1
356 1 17 VAL MG1 1 20 LYS HG2 . . 4.340 3.870 3.684 4.155 . 0 0 "[ . 1 . 2]" 1
357 1 17 VAL MG1 1 57 PHE HA . . 3.590 2.857 2.592 3.050 . 0 0 "[ . 1 . 2]" 1
358 1 17 VAL MG1 1 57 PHE HB2 . . 4.840 4.625 4.351 4.832 . 0 0 "[ . 1 . 2]" 1
359 1 17 VAL MG1 1 57 PHE HB3 . . 3.950 3.229 2.974 3.445 . 0 0 "[ . 1 . 2]" 1
360 1 17 VAL MG1 1 57 PHE QD . . 3.030 2.639 2.423 2.742 . 0 0 "[ . 1 . 2]" 1
361 1 17 VAL MG1 1 57 PHE QE . . 4.180 4.161 4.058 4.185 0.005 13 0 "[ . 1 . 2]" 1
362 1 17 VAL MG1 1 60 GLU H . . 4.990 4.645 4.393 4.805 . 0 0 "[ . 1 . 2]" 1
363 1 17 VAL MG1 1 60 GLU HA . . 5.280 5.143 4.995 5.279 . 0 0 "[ . 1 . 2]" 1
364 1 17 VAL MG1 1 60 GLU HB2 . . 4.080 3.851 3.636 4.021 . 0 0 "[ . 1 . 2]" 1
365 1 17 VAL MG1 1 60 GLU HB3 . . 3.670 2.810 2.555 2.942 . 0 0 "[ . 1 . 2]" 1
366 1 17 VAL MG1 1 60 GLU HG2 . . 3.200 2.384 2.246 2.540 . 0 0 "[ . 1 . 2]" 1
367 1 17 VAL MG1 1 60 GLU HG3 . . 4.090 3.741 3.588 3.926 . 0 0 "[ . 1 . 2]" 1
368 1 17 VAL MG1 1 61 ALA H . . 4.320 3.663 3.358 3.976 . 0 0 "[ . 1 . 2]" 1
369 1 17 VAL MG1 1 61 ALA HA . . 4.530 4.303 4.068 4.471 . 0 0 "[ . 1 . 2]" 1
370 1 17 VAL MG1 1 61 ALA MB . . 4.630 3.746 3.545 3.971 . 0 0 "[ . 1 . 2]" 1
371 1 17 VAL MG1 1 64 LEU QD . . 3.720 3.322 3.050 3.525 . 0 0 "[ . 1 . 2]" 1
372 1 17 VAL MG2 1 18 TRP H . . 3.760 3.631 3.524 3.760 0.000 18 0 "[ . 1 . 2]" 1
373 1 17 VAL MG2 1 19 ALA MB . . 5.500 5.445 5.362 5.516 0.016 5 0 "[ . 1 . 2]" 1
374 1 17 VAL MG2 1 20 LYS HB3 . . 5.020 4.597 4.473 4.768 . 0 0 "[ . 1 . 2]" 1
375 1 17 VAL MG2 1 20 LYS QD . . 3.950 3.660 3.541 3.813 . 0 0 "[ . 1 . 2]" 1
376 1 17 VAL MG2 1 20 LYS QE . . 4.550 4.223 3.922 4.545 . 0 0 "[ . 1 . 2]" 1
377 1 17 VAL MG2 1 57 PHE HA . . 4.420 4.334 4.208 4.400 . 0 0 "[ . 1 . 2]" 1
378 1 17 VAL MG2 1 57 PHE HB2 . . 5.500 5.451 5.324 5.507 0.007 19 0 "[ . 1 . 2]" 1
379 1 17 VAL MG2 1 57 PHE HB3 . . 4.760 4.228 4.125 4.281 . 0 0 "[ . 1 . 2]" 1
380 1 17 VAL MG2 1 57 PHE QD . . 4.870 4.842 4.794 4.871 0.001 16 0 "[ . 1 . 2]" 1
381 1 17 VAL MG2 1 60 GLU HA . . 5.290 5.198 5.040 5.294 0.004 7 0 "[ . 1 . 2]" 1
382 1 17 VAL MG2 1 60 GLU HB2 . . 5.030 4.802 4.636 4.985 . 0 0 "[ . 1 . 2]" 1
383 1 17 VAL MG2 1 60 GLU HB3 . . 4.040 3.648 3.490 3.798 . 0 0 "[ . 1 . 2]" 1
384 1 17 VAL MG2 1 60 GLU HG2 . . 3.510 2.402 2.095 2.663 . 0 0 "[ . 1 . 2]" 1
385 1 17 VAL MG2 1 60 GLU HG3 . . 4.080 3.796 3.502 3.989 . 0 0 "[ . 1 . 2]" 1
386 1 17 VAL MG2 1 61 ALA H . . 3.830 2.901 2.614 3.123 . 0 0 "[ . 1 . 2]" 1
387 1 17 VAL MG2 1 61 ALA HA . . 3.280 2.493 2.152 2.650 . 0 0 "[ . 1 . 2]" 1
388 1 17 VAL MG2 1 61 ALA MB . . 2.950 1.852 1.792 1.924 . 0 0 "[ . 1 . 2]" 1
389 1 17 VAL MG2 1 62 GLU H . . 5.350 4.747 4.547 4.907 . 0 0 "[ . 1 . 2]" 1
390 1 17 VAL MG2 1 64 LEU HB2 . . 4.550 4.307 4.019 4.552 0.002 7 0 "[ . 1 . 2]" 1
391 1 17 VAL MG2 1 64 LEU HB3 . . 5.280 5.049 4.726 5.271 . 0 0 "[ . 1 . 2]" 1
392 1 17 VAL MG2 1 64 LEU QD . . 3.410 2.189 1.893 2.393 . 0 0 "[ . 1 . 2]" 1
393 1 18 TRP H 1 18 TRP HB2 . . 3.180 2.813 2.763 2.901 . 0 0 "[ . 1 . 2]" 1
394 1 18 TRP H 1 18 TRP HB3 . . 3.010 2.290 2.212 2.351 . 0 0 "[ . 1 . 2]" 1
395 1 18 TRP H 1 18 TRP HD1 . . 5.340 5.243 5.199 5.303 . 0 0 "[ . 1 . 2]" 1
396 1 18 TRP H 1 18 TRP HE3 . . 4.270 4.122 3.905 4.265 . 0 0 "[ . 1 . 2]" 1
397 1 18 TRP H 1 19 ALA H . . 3.360 2.799 2.661 2.923 . 0 0 "[ . 1 . 2]" 1
398 1 18 TRP H 1 19 ALA MB . . 4.560 4.417 4.271 4.533 . 0 0 "[ . 1 . 2]" 1
399 1 18 TRP H 1 20 LYS H . . 4.550 4.284 4.183 4.409 . 0 0 "[ . 1 . 2]" 1
400 1 18 TRP H 1 20 LYS QD . . 5.450 4.414 4.178 4.672 . 0 0 "[ . 1 . 2]" 1
401 1 18 TRP H 1 46 TRP HH2 . . 5.500 4.495 4.386 4.614 . 0 0 "[ . 1 . 2]" 1
402 1 18 TRP H 1 46 TRP HZ3 . . 4.470 4.106 3.949 4.250 . 0 0 "[ . 1 . 2]" 1
403 1 18 TRP H 1 57 PHE HB2 . . 4.660 4.237 4.146 4.405 . 0 0 "[ . 1 . 2]" 1
404 1 18 TRP H 1 57 PHE HB3 . . 4.070 2.733 2.633 2.938 . 0 0 "[ . 1 . 2]" 1
405 1 18 TRP H 1 57 PHE QD . . 4.140 3.785 3.617 3.957 . 0 0 "[ . 1 . 2]" 1
406 1 18 TRP HA 1 18 TRP HD1 . . 4.230 3.452 3.340 3.537 . 0 0 "[ . 1 . 2]" 1
407 1 18 TRP HA 1 18 TRP HE1 . . 5.500 5.426 5.377 5.476 . 0 0 "[ . 1 . 2]" 1
408 1 18 TRP HA 1 18 TRP HE3 . . 4.890 4.592 4.514 4.720 . 0 0 "[ . 1 . 2]" 1
409 1 18 TRP HA 1 57 PHE QD . . 3.850 2.977 2.816 3.167 . 0 0 "[ . 1 . 2]" 1
410 1 18 TRP HA 1 57 PHE QE . . 3.880 3.347 3.173 3.517 . 0 0 "[ . 1 . 2]" 1
411 1 18 TRP HA 1 57 PHE HZ . . 4.850 4.608 4.480 4.779 . 0 0 "[ . 1 . 2]" 1
412 1 18 TRP HB2 1 19 ALA H . . 4.400 4.184 4.095 4.268 . 0 0 "[ . 1 . 2]" 1
413 1 18 TRP HB2 1 46 TRP HH2 . . 4.750 3.733 3.433 3.913 . 0 0 "[ . 1 . 2]" 1
414 1 18 TRP HB2 1 46 TRP HZ3 . . 4.300 2.197 2.095 2.331 . 0 0 "[ . 1 . 2]" 1
415 1 18 TRP HB2 1 57 PHE HB2 . . 4.650 3.156 2.935 3.320 . 0 0 "[ . 1 . 2]" 1
416 1 18 TRP HB2 1 57 PHE HB3 . . 4.710 2.608 2.503 2.733 . 0 0 "[ . 1 . 2]" 1
417 1 18 TRP HB2 1 57 PHE QD . . 4.010 2.893 2.835 3.000 . 0 0 "[ . 1 . 2]" 1
418 1 18 TRP HB2 1 57 PHE QE . . 4.880 3.680 3.553 3.820 . 0 0 "[ . 1 . 2]" 1
419 1 18 TRP HB3 1 18 TRP HE3 . . 3.860 2.624 2.555 2.670 . 0 0 "[ . 1 . 2]" 1
420 1 18 TRP HB3 1 19 ALA H . . 4.000 2.967 2.819 3.115 . 0 0 "[ . 1 . 2]" 1
421 1 18 TRP HB3 1 19 ALA MB . . 4.960 4.288 4.235 4.384 . 0 0 "[ . 1 . 2]" 1
422 1 18 TRP HB3 1 46 TRP HZ3 . . 4.300 2.224 2.087 2.389 . 0 0 "[ . 1 . 2]" 1
423 1 18 TRP HB3 1 57 PHE HB2 . . 4.940 4.042 3.949 4.162 . 0 0 "[ . 1 . 2]" 1
424 1 18 TRP HB3 1 57 PHE HB3 . . 4.810 3.353 3.246 3.488 . 0 0 "[ . 1 . 2]" 1
425 1 18 TRP HB3 1 57 PHE QD . . 4.750 4.097 3.974 4.233 . 0 0 "[ . 1 . 2]" 1
426 1 18 TRP HD1 1 49 LEU MD1 . . 4.770 2.701 2.402 3.007 . 0 0 "[ . 1 . 2]" 1
427 1 18 TRP HD1 1 49 LEU MD2 . . 4.710 3.975 3.606 4.200 . 0 0 "[ . 1 . 2]" 1
428 1 18 TRP HD1 1 57 PHE QD . . 4.460 3.535 3.219 3.706 . 0 0 "[ . 1 . 2]" 1
429 1 18 TRP HD1 1 57 PHE QE . . 3.810 2.726 2.517 2.963 . 0 0 "[ . 1 . 2]" 1
430 1 18 TRP HD1 1 57 PHE HZ . . 4.110 3.015 2.796 3.279 . 0 0 "[ . 1 . 2]" 1
431 1 18 TRP HE1 1 22 GLU QG . . 4.390 3.352 2.865 3.830 . 0 0 "[ . 1 . 2]" 1
432 1 18 TRP HE1 1 49 LEU MD1 . . 3.610 2.207 2.045 2.380 . 0 0 "[ . 1 . 2]" 1
433 1 18 TRP HE1 1 49 LEU MD2 . . 3.930 2.911 2.550 3.184 . 0 0 "[ . 1 . 2]" 1
434 1 18 TRP HE1 1 57 PHE QE . . 4.900 4.397 4.221 4.657 . 0 0 "[ . 1 . 2]" 1
435 1 18 TRP HE1 1 57 PHE HZ . . 5.410 4.860 4.624 5.188 . 0 0 "[ . 1 . 2]" 1
436 1 18 TRP HE3 1 19 ALA H . . 3.800 2.543 2.200 2.721 . 0 0 "[ . 1 . 2]" 1
437 1 18 TRP HE3 1 19 ALA HA . . 4.230 3.043 2.804 3.307 . 0 0 "[ . 1 . 2]" 1
438 1 18 TRP HE3 1 19 ALA MB . . 3.390 2.571 2.321 2.712 . 0 0 "[ . 1 . 2]" 1
439 1 18 TRP HE3 1 42 LEU HB3 . . 4.740 4.151 3.953 4.258 . 0 0 "[ . 1 . 2]" 1
440 1 18 TRP HE3 1 42 LEU MD2 . . 4.830 4.318 4.219 4.452 . 0 0 "[ . 1 . 2]" 1
441 1 18 TRP HE3 1 46 TRP HB2 . . 4.940 3.688 3.521 3.815 . 0 0 "[ . 1 . 2]" 1
442 1 18 TRP HE3 1 46 TRP HE3 . . 4.960 3.119 2.984 3.227 . 0 0 "[ . 1 . 2]" 1
443 1 18 TRP HH2 1 19 ALA MB . . 4.990 4.436 4.212 4.753 . 0 0 "[ . 1 . 2]" 1
444 1 18 TRP HH2 1 22 GLU HG2 . . 4.710 4.116 2.833 4.664 . 0 0 "[ . 1 . 2]" 1
445 1 18 TRP HH2 1 22 GLU QG . . 3.940 3.119 2.793 3.482 . 0 0 "[ . 1 . 2]" 1
446 1 18 TRP HH2 1 22 GLU HG3 . . 4.710 3.519 2.822 4.589 . 0 0 "[ . 1 . 2]" 1
447 1 18 TRP HH2 1 42 LEU HA . . 3.460 2.230 2.093 2.346 . 0 0 "[ . 1 . 2]" 1
448 1 18 TRP HH2 1 42 LEU HB3 . . 4.700 3.538 3.362 3.695 . 0 0 "[ . 1 . 2]" 1
449 1 18 TRP HH2 1 42 LEU MD1 . . 5.500 5.108 4.983 5.237 . 0 0 "[ . 1 . 2]" 1
450 1 18 TRP HH2 1 42 LEU MD2 . . 3.570 2.985 2.871 3.136 . 0 0 "[ . 1 . 2]" 1
451 1 18 TRP HH2 1 45 SER H . . 3.940 3.660 3.594 3.715 . 0 0 "[ . 1 . 2]" 1
452 1 18 TRP HH2 1 45 SER HA . . 4.740 4.706 4.610 4.754 0.014 19 0 "[ . 1 . 2]" 1
453 1 18 TRP HH2 1 45 SER HB2 . . 3.500 2.056 1.995 2.191 . 0 0 "[ . 1 . 2]" 1
454 1 18 TRP HH2 1 45 SER HB3 . . 3.360 2.914 2.734 3.037 . 0 0 "[ . 1 . 2]" 1
455 1 18 TRP HH2 1 46 TRP H . . 4.740 3.159 3.006 3.266 . 0 0 "[ . 1 . 2]" 1
456 1 18 TRP HH2 1 46 TRP HA . . 4.920 4.033 3.929 4.173 . 0 0 "[ . 1 . 2]" 1
457 1 18 TRP HH2 1 46 TRP HB2 . . 4.560 3.478 3.290 3.617 . 0 0 "[ . 1 . 2]" 1
458 1 18 TRP HH2 1 46 TRP HB3 . . 4.870 4.707 4.502 4.841 . 0 0 "[ . 1 . 2]" 1
459 1 18 TRP HZ2 1 22 GLU QG . . 3.520 2.316 2.093 2.462 . 0 0 "[ . 1 . 2]" 1
460 1 18 TRP HZ2 1 42 LEU MD2 . . 4.480 4.436 4.203 4.497 0.017 19 0 "[ . 1 . 2]" 1
461 1 18 TRP HZ2 1 45 SER HB2 . . 3.590 2.888 2.706 3.058 . 0 0 "[ . 1 . 2]" 1
462 1 18 TRP HZ2 1 45 SER HB3 . . 3.880 2.023 1.994 2.130 . 0 0 "[ . 1 . 2]" 1
463 1 18 TRP HZ2 1 46 TRP H . . 4.710 4.338 4.152 4.518 . 0 0 "[ . 1 . 2]" 1
464 1 18 TRP HZ2 1 46 TRP HA . . 4.980 3.974 3.753 4.201 . 0 0 "[ . 1 . 2]" 1
465 1 18 TRP HZ2 1 49 LEU MD1 . . 3.990 3.346 3.026 3.725 . 0 0 "[ . 1 . 2]" 1
466 1 18 TRP HZ2 1 49 LEU MD2 . . 4.370 4.271 4.115 4.375 0.005 13 0 "[ . 1 . 2]" 1
467 1 18 TRP HZ2 1 49 LEU HG . . 5.020 4.208 3.948 4.407 . 0 0 "[ . 1 . 2]" 1
468 1 18 TRP HZ3 1 19 ALA H . . 4.940 4.530 4.225 4.715 . 0 0 "[ . 1 . 2]" 1
469 1 18 TRP HZ3 1 19 ALA HA . . 4.320 3.509 3.156 3.842 . 0 0 "[ . 1 . 2]" 1
470 1 18 TRP HZ3 1 19 ALA MB . . 3.720 2.593 2.237 2.905 . 0 0 "[ . 1 . 2]" 1
471 1 18 TRP HZ3 1 22 GLU QB . . 5.340 3.930 3.712 4.212 . 0 0 "[ . 1 . 2]" 1
472 1 18 TRP HZ3 1 26 LEU MD1 . . 5.500 5.423 5.281 5.509 0.009 19 0 "[ . 1 . 2]" 1
473 1 18 TRP HZ3 1 42 LEU H . . 5.250 5.205 5.140 5.261 0.011 20 0 "[ . 1 . 2]" 1
474 1 18 TRP HZ3 1 42 LEU HA . . 3.880 3.017 2.878 3.207 . 0 0 "[ . 1 . 2]" 1
475 1 18 TRP HZ3 1 42 LEU HB2 . . 4.290 3.749 3.527 3.837 . 0 0 "[ . 1 . 2]" 1
476 1 18 TRP HZ3 1 42 LEU HB3 . . 3.730 2.154 2.021 2.236 . 0 0 "[ . 1 . 2]" 1
477 1 18 TRP HZ3 1 42 LEU MD1 . . 4.180 3.962 3.825 4.132 . 0 0 "[ . 1 . 2]" 1
478 1 18 TRP HZ3 1 42 LEU MD2 . . 3.480 2.992 2.878 3.171 . 0 0 "[ . 1 . 2]" 1
479 1 18 TRP HZ3 1 42 LEU HG . . 4.910 4.903 4.857 4.920 0.010 11 0 "[ . 1 . 2]" 1
480 1 18 TRP HZ3 1 43 GLY H . . 5.060 4.891 4.769 5.034 . 0 0 "[ . 1 . 2]" 1
481 1 18 TRP HZ3 1 43 GLY HA2 . . 5.350 4.370 4.206 4.548 . 0 0 "[ . 1 . 2]" 1
482 1 18 TRP HZ3 1 45 SER H . . 5.500 5.332 5.211 5.477 . 0 0 "[ . 1 . 2]" 1
483 1 18 TRP HZ3 1 45 SER HB2 . . 4.760 4.388 4.254 4.531 . 0 0 "[ . 1 . 2]" 1
484 1 18 TRP HZ3 1 45 SER HB3 . . 5.500 5.230 5.047 5.372 . 0 0 "[ . 1 . 2]" 1
485 1 18 TRP HZ3 1 46 TRP H . . 4.340 4.133 3.987 4.253 . 0 0 "[ . 1 . 2]" 1
486 1 18 TRP HZ3 1 46 TRP HA . . 4.930 4.426 4.187 4.564 . 0 0 "[ . 1 . 2]" 1
487 1 18 TRP HZ3 1 46 TRP HB2 . . 3.520 2.761 2.594 2.904 . 0 0 "[ . 1 . 2]" 1
488 1 18 TRP HZ3 1 46 TRP HB3 . . 4.460 4.316 4.105 4.461 0.001 20 0 "[ . 1 . 2]" 1
489 1 18 TRP HZ3 1 46 TRP HE3 . . 5.200 4.017 3.825 4.156 . 0 0 "[ . 1 . 2]" 1
490 1 19 ALA H 1 19 ALA MB . . 3.090 2.121 2.067 2.219 . 0 0 "[ . 1 . 2]" 1
491 1 19 ALA H 1 20 LYS H . . 3.740 2.528 2.403 2.616 . 0 0 "[ . 1 . 2]" 1
492 1 19 ALA H 1 20 LYS HA . . 5.160 5.090 4.981 5.174 0.014 20 0 "[ . 1 . 2]" 1
493 1 19 ALA H 1 42 LEU MD2 . . 5.100 4.872 4.679 5.102 0.002 17 0 "[ . 1 . 2]" 1
494 1 19 ALA HA 1 22 GLU H . . 4.240 2.889 2.725 3.227 . 0 0 "[ . 1 . 2]" 1
495 1 19 ALA HA 1 22 GLU HA . . 5.330 4.795 4.648 5.009 . 0 0 "[ . 1 . 2]" 1
496 1 19 ALA HA 1 22 GLU HB2 . . 4.220 2.195 1.990 2.854 . 0 0 "[ . 1 . 2]" 1
497 1 19 ALA HA 1 22 GLU QB . . 3.520 2.132 1.980 2.477 . 0 0 "[ . 1 . 2]" 1
498 1 19 ALA HA 1 22 GLU HB3 . . 4.220 3.581 2.604 4.081 . 0 0 "[ . 1 . 2]" 1
499 1 19 ALA HA 1 22 GLU HG2 . . 5.310 3.377 2.274 5.306 . 0 0 "[ . 1 . 2]" 1
500 1 19 ALA HA 1 22 GLU QG . . 4.480 3.152 2.246 4.295 . 0 0 "[ . 1 . 2]" 1
501 1 19 ALA HA 1 22 GLU HG3 . . 5.310 4.144 3.481 5.092 . 0 0 "[ . 1 . 2]" 1
502 1 19 ALA HA 1 23 ARG H . . 4.180 2.995 2.842 3.126 . 0 0 "[ . 1 . 2]" 1
503 1 19 ALA HA 1 23 ARG HB2 . . 5.500 4.250 4.031 4.543 . 0 0 "[ . 1 . 2]" 1
504 1 19 ALA HA 1 23 ARG HB3 . . 5.500 5.132 4.854 5.497 . 0 0 "[ . 1 . 2]" 1
505 1 19 ALA HA 1 42 LEU HB3 . . 5.490 4.045 3.732 4.239 . 0 0 "[ . 1 . 2]" 1
506 1 19 ALA HA 1 42 LEU MD1 . . 4.310 3.791 3.390 4.036 . 0 0 "[ . 1 . 2]" 1
507 1 19 ALA HA 1 42 LEU MD2 . . 3.580 2.716 2.576 2.884 . 0 0 "[ . 1 . 2]" 1
508 1 19 ALA MB 1 20 LYS H . . 3.630 2.729 2.571 2.860 . 0 0 "[ . 1 . 2]" 1
509 1 19 ALA MB 1 20 LYS HA . . 4.190 3.816 3.742 3.886 . 0 0 "[ . 1 . 2]" 1
510 1 19 ALA MB 1 20 LYS HB3 . . 4.800 4.417 4.332 4.506 . 0 0 "[ . 1 . 2]" 1
511 1 19 ALA MB 1 22 GLU H . . 5.050 4.211 3.870 4.599 . 0 0 "[ . 1 . 2]" 1
512 1 19 ALA MB 1 22 GLU QB . . 4.450 3.309 3.099 3.616 . 0 0 "[ . 1 . 2]" 1
513 1 19 ALA MB 1 23 ARG H . . 4.240 3.191 2.995 3.498 . 0 0 "[ . 1 . 2]" 1
514 1 19 ALA MB 1 23 ARG HB2 . . 4.120 2.789 2.509 3.055 . 0 0 "[ . 1 . 2]" 1
515 1 19 ALA MB 1 23 ARG HB3 . . 4.280 3.917 3.474 4.217 . 0 0 "[ . 1 . 2]" 1
516 1 19 ALA MB 1 23 ARG QD . . 4.620 4.004 3.660 4.314 . 0 0 "[ . 1 . 2]" 1
517 1 19 ALA MB 1 42 LEU HB2 . . 5.320 3.797 3.583 4.001 . 0 0 "[ . 1 . 2]" 1
518 1 19 ALA MB 1 42 LEU HB3 . . 3.580 2.533 2.406 2.801 . 0 0 "[ . 1 . 2]" 1
519 1 19 ALA MB 1 42 LEU MD2 . . 2.900 2.455 2.224 2.800 . 0 0 "[ . 1 . 2]" 1
520 1 20 LYS H 1 20 LYS HB3 . . 2.960 2.216 2.189 2.256 . 0 0 "[ . 1 . 2]" 1
521 1 20 LYS H 1 20 LYS QD . . 4.110 3.458 3.343 3.569 . 0 0 "[ . 1 . 2]" 1
522 1 20 LYS H 1 20 LYS QE . . 4.940 4.753 4.649 4.919 . 0 0 "[ . 1 . 2]" 1
523 1 20 LYS H 1 20 LYS HG2 . . 4.030 3.009 2.866 3.173 . 0 0 "[ . 1 . 2]" 1
524 1 20 LYS H 1 20 LYS HG3 . . 4.450 4.213 4.130 4.313 . 0 0 "[ . 1 . 2]" 1
525 1 20 LYS H 1 21 ASP H . . 3.590 2.921 2.820 2.983 . 0 0 "[ . 1 . 2]" 1
526 1 20 LYS H 1 21 ASP HB2 . . 5.500 5.294 5.054 5.391 . 0 0 "[ . 1 . 2]" 1
527 1 20 LYS H 1 21 ASP HB3 . . 5.500 5.421 5.325 5.491 . 0 0 "[ . 1 . 2]" 1
528 1 20 LYS HA 1 20 LYS QE . . 4.730 4.549 4.437 4.649 . 0 0 "[ . 1 . 2]" 1
529 1 20 LYS HA 1 20 LYS HG2 . . 3.850 3.644 3.626 3.665 . 0 0 "[ . 1 . 2]" 1
530 1 20 LYS HA 1 20 LYS HG3 . . 3.890 3.763 3.725 3.811 . 0 0 "[ . 1 . 2]" 1
531 1 20 LYS HA 1 21 ASP HA . . 4.940 4.632 4.622 4.646 . 0 0 "[ . 1 . 2]" 1
532 1 20 LYS HA 1 23 ARG H . . 4.790 4.504 4.297 4.694 . 0 0 "[ . 1 . 2]" 1
533 1 20 LYS HA 1 23 ARG HB2 . . 4.540 4.292 3.971 4.571 0.031 20 0 "[ . 1 . 2]" 1
534 1 20 LYS HA 1 23 ARG HB3 . . 4.160 3.640 3.381 3.910 . 0 0 "[ . 1 . 2]" 1
535 1 20 LYS HA 1 23 ARG QD . . 4.580 4.058 3.740 4.357 . 0 0 "[ . 1 . 2]" 1
536 1 20 LYS HB2 1 20 LYS QE . . 4.040 2.455 2.258 2.632 . 0 0 "[ . 1 . 2]" 1
537 1 20 LYS HB2 1 21 ASP H . . 4.460 4.070 3.977 4.199 . 0 0 "[ . 1 . 2]" 1
538 1 20 LYS HB2 1 21 ASP HA . . 4.990 4.924 4.846 4.986 . 0 0 "[ . 1 . 2]" 1
539 1 20 LYS HB2 1 21 ASP HB2 . . 5.500 5.331 5.190 5.468 . 0 0 "[ . 1 . 2]" 1
540 1 20 LYS HB3 1 20 LYS QE . . 3.870 2.873 2.767 3.096 . 0 0 "[ . 1 . 2]" 1
541 1 20 LYS HB3 1 21 ASP H . . 4.130 3.759 3.703 3.868 . 0 0 "[ . 1 . 2]" 1
542 1 20 LYS HB3 1 21 ASP HB2 . . 5.500 5.429 5.373 5.500 . 0 0 "[ . 1 . 2]" 1
543 1 20 LYS QD 1 20 LYS HG2 . . 2.690 2.165 2.158 2.176 . 0 0 "[ . 1 . 2]" 1
544 1 20 LYS QD 1 21 ASP H . . 4.740 3.855 3.750 4.079 . 0 0 "[ . 1 . 2]" 1
545 1 20 LYS QD 1 21 ASP HB3 . . 5.500 5.110 4.938 5.438 . 0 0 "[ . 1 . 2]" 1
546 1 20 LYS QD 1 57 PHE QD . . 4.810 4.494 4.163 4.803 . 0 0 "[ . 1 . 2]" 1
547 1 20 LYS QE 1 20 LYS HG2 . . 3.560 3.395 3.254 3.489 . 0 0 "[ . 1 . 2]" 1
548 1 20 LYS QE 1 20 LYS HG3 . . 2.960 2.423 2.117 2.695 . 0 0 "[ . 1 . 2]" 1
549 1 20 LYS QE 1 21 ASP H . . 5.160 5.077 4.800 5.166 0.006 11 0 "[ . 1 . 2]" 1
550 1 20 LYS QE 1 64 LEU QD . . 5.240 4.173 3.783 4.669 . 0 0 "[ . 1 . 2]" 1
551 1 20 LYS HG2 1 21 ASP H . . 4.390 2.027 1.920 2.293 . 0 0 "[ . 1 . 2]" 1
552 1 20 LYS HG2 1 21 ASP HA . . 4.900 3.760 3.626 3.962 . 0 0 "[ . 1 . 2]" 1
553 1 20 LYS HG2 1 21 ASP HB2 . . 5.220 2.864 2.768 2.978 . 0 0 "[ . 1 . 2]" 1
554 1 20 LYS HG3 1 21 ASP H . . 4.310 3.283 3.073 3.528 . 0 0 "[ . 1 . 2]" 1
555 1 20 LYS HG3 1 21 ASP HA . . 4.800 3.680 3.628 3.744 . 0 0 "[ . 1 . 2]" 1
556 1 20 LYS HG3 1 21 ASP HB2 . . 4.930 3.421 3.173 3.673 . 0 0 "[ . 1 . 2]" 1
557 1 21 ASP H 1 21 ASP HB2 . . 3.530 2.621 2.568 2.670 . 0 0 "[ . 1 . 2]" 1
558 1 21 ASP H 1 21 ASP HB3 . . 3.960 2.641 2.572 2.710 . 0 0 "[ . 1 . 2]" 1
559 1 21 ASP H 1 22 GLU H . . 3.540 2.337 2.198 2.541 . 0 0 "[ . 1 . 2]" 1
560 1 21 ASP H 1 22 GLU HA . . 5.500 4.982 4.874 5.095 . 0 0 "[ . 1 . 2]" 1
561 1 21 ASP H 1 22 GLU QB . . 5.340 4.211 4.032 4.396 . 0 0 "[ . 1 . 2]" 1
562 1 21 ASP H 1 23 ARG H . . 4.690 4.137 3.972 4.369 . 0 0 "[ . 1 . 2]" 1
563 1 21 ASP HA 1 24 LYS QB . . 3.540 3.518 3.388 3.638 0.098 20 0 "[ . 1 . 2]" 1
564 1 21 ASP HA 1 24 LYS QD . . 4.230 3.381 2.400 4.241 0.011 5 0 "[ . 1 . 2]" 1
565 1 21 ASP HA 1 24 LYS QG . . 4.080 2.464 2.105 2.938 . 0 0 "[ . 1 . 2]" 1
566 1 21 ASP HB3 1 22 GLU H . . 3.890 2.549 2.119 3.135 . 0 0 "[ . 1 . 2]" 1
567 1 21 ASP HB3 1 22 GLU HA . . 4.410 4.105 4.002 4.316 . 0 0 "[ . 1 . 2]" 1
568 1 21 ASP HB3 1 22 GLU QG . . 5.340 4.115 3.363 5.036 . 0 0 "[ . 1 . 2]" 1
569 1 22 GLU H 1 22 GLU HB2 . . 3.860 2.368 2.141 2.578 . 0 0 "[ . 1 . 2]" 1
570 1 22 GLU H 1 22 GLU QB . . 3.340 2.331 2.101 2.523 . 0 0 "[ . 1 . 2]" 1
571 1 22 GLU H 1 22 GLU HB3 . . 3.860 3.491 3.046 3.648 . 0 0 "[ . 1 . 2]" 1
572 1 22 GLU H 1 22 GLU HG2 . . 4.170 3.067 2.325 4.181 0.011 11 0 "[ . 1 . 2]" 1
573 1 22 GLU H 1 22 GLU HG3 . . 4.170 3.983 3.747 4.286 0.116 7 0 "[ . 1 . 2]" 1
574 1 22 GLU H 1 23 ARG H . . 3.680 2.835 2.562 3.077 . 0 0 "[ . 1 . 2]" 1
575 1 22 GLU H 1 42 LEU MD1 . . 5.500 5.400 5.106 5.510 0.010 7 0 "[ . 1 . 2]" 1
576 1 22 GLU HA 1 22 GLU HG2 . . 3.880 3.268 2.146 3.642 . 0 0 "[ . 1 . 2]" 1
577 1 22 GLU HA 1 22 GLU QG . . 3.210 2.803 2.126 3.156 . 0 0 "[ . 1 . 2]" 1
578 1 22 GLU HA 1 22 GLU HG3 . . 3.880 3.300 2.423 3.652 . 0 0 "[ . 1 . 2]" 1
579 1 22 GLU HA 1 24 LYS H . . 4.840 4.368 4.198 4.571 . 0 0 "[ . 1 . 2]" 1
580 1 22 GLU HA 1 25 ARG H . . 3.650 3.511 3.365 3.642 . 0 0 "[ . 1 . 2]" 1
581 1 22 GLU HA 1 25 ARG QB . . 4.090 3.371 3.219 3.606 . 0 0 "[ . 1 . 2]" 1
582 1 22 GLU HA 1 25 ARG HD2 . . 4.030 2.704 2.000 3.681 . 0 0 "[ . 1 . 2]" 1
583 1 22 GLU HA 1 25 ARG QD . . 3.490 2.115 1.920 2.427 . 0 0 "[ . 1 . 2]" 1
584 1 22 GLU HA 1 25 ARG HD3 . . 4.030 2.693 1.991 3.589 . 0 0 "[ . 1 . 2]" 1
585 1 22 GLU HA 1 25 ARG HE . . 5.150 4.397 3.164 5.148 . 0 0 "[ . 1 . 2]" 1
586 1 22 GLU HA 1 25 ARG HG2 . . 4.190 3.732 3.321 3.956 . 0 0 "[ . 1 . 2]" 1
587 1 22 GLU HA 1 25 ARG QH1 . . 5.340 4.174 2.706 5.325 . 0 0 "[ . 1 . 2]" 1
588 1 22 GLU HA 1 26 LEU H . . 5.010 4.850 4.700 4.982 . 0 0 "[ . 1 . 2]" 1
589 1 22 GLU HA 1 26 LEU MD2 . . 4.900 4.758 4.358 4.905 0.005 5 0 "[ . 1 . 2]" 1
590 1 22 GLU HA 1 42 LEU MD2 . . 4.320 3.957 3.727 4.150 . 0 0 "[ . 1 . 2]" 1
591 1 22 GLU QB 1 23 ARG H . . 3.860 2.242 2.116 2.383 . 0 0 "[ . 1 . 2]" 1
592 1 22 GLU QB 1 42 LEU MD2 . . 3.490 1.914 1.746 2.068 . 0 0 "[ . 1 . 2]" 1
593 1 22 GLU QG 1 42 LEU MD2 . . 3.340 3.164 3.012 3.317 . 0 0 "[ . 1 . 2]" 1
594 1 22 GLU QG 1 45 SER HB2 . . 4.750 3.990 3.460 4.415 . 0 0 "[ . 1 . 2]" 1
595 1 22 GLU HG2 1 42 LEU MD2 . . 3.840 3.662 3.176 3.853 0.013 5 0 "[ . 1 . 2]" 1
596 1 22 GLU HG3 1 42 LEU MD2 . . 3.840 3.514 3.210 3.841 0.001 4 0 "[ . 1 . 2]" 1
597 1 23 ARG H 1 23 ARG HB2 . . 3.210 2.359 2.232 2.467 . 0 0 "[ . 1 . 2]" 1
598 1 23 ARG H 1 23 ARG HB3 . . 3.260 2.762 2.602 2.939 . 0 0 "[ . 1 . 2]" 1
599 1 23 ARG H 1 23 ARG QD . . 4.570 4.502 4.389 4.589 0.019 20 0 "[ . 1 . 2]" 1
600 1 23 ARG H 1 23 ARG HG2 . . 4.660 4.496 4.442 4.556 . 0 0 "[ . 1 . 2]" 1
601 1 23 ARG H 1 23 ARG HG3 . . 4.460 4.333 4.140 4.467 0.007 20 0 "[ . 1 . 2]" 1
602 1 23 ARG H 1 24 LYS H . . 3.680 3.007 2.863 3.118 . 0 0 "[ . 1 . 2]" 1
603 1 23 ARG H 1 24 LYS QB . . 5.240 4.974 4.859 5.075 . 0 0 "[ . 1 . 2]" 1
604 1 23 ARG H 1 24 LYS QG . . 5.270 4.447 4.133 4.725 . 0 0 "[ . 1 . 2]" 1
605 1 23 ARG H 1 25 ARG H . . 4.830 4.432 4.199 4.556 . 0 0 "[ . 1 . 2]" 1
606 1 23 ARG H 1 25 ARG QD . . 5.340 4.743 4.491 5.067 . 0 0 "[ . 1 . 2]" 1
607 1 23 ARG H 1 26 LEU MD1 . . 4.530 4.009 3.841 4.272 . 0 0 "[ . 1 . 2]" 1
608 1 23 ARG H 1 42 LEU MD1 . . 4.240 3.298 3.183 3.377 . 0 0 "[ . 1 . 2]" 1
609 1 23 ARG H 1 42 LEU MD2 . . 3.850 2.076 1.868 2.380 . 0 0 "[ . 1 . 2]" 1
610 1 23 ARG HA 1 23 ARG QD . . 4.340 4.112 4.001 4.214 . 0 0 "[ . 1 . 2]" 1
611 1 23 ARG HA 1 23 ARG HG2 . . 3.750 2.811 2.681 3.005 . 0 0 "[ . 1 . 2]" 1
612 1 23 ARG HA 1 23 ARG HG3 . . 3.500 2.717 2.511 2.908 . 0 0 "[ . 1 . 2]" 1
613 1 23 ARG HA 1 25 ARG H . . 5.030 4.226 3.971 4.370 . 0 0 "[ . 1 . 2]" 1
614 1 23 ARG HA 1 26 LEU H . . 3.920 3.155 3.039 3.246 . 0 0 "[ . 1 . 2]" 1
615 1 23 ARG HA 1 26 LEU HB2 . . 3.560 2.699 2.513 2.862 . 0 0 "[ . 1 . 2]" 1
616 1 23 ARG HA 1 26 LEU HB3 . . 4.330 4.065 3.927 4.223 . 0 0 "[ . 1 . 2]" 1
617 1 23 ARG HA 1 26 LEU MD1 . . 3.450 2.136 1.966 2.362 . 0 0 "[ . 1 . 2]" 1
618 1 23 ARG HA 1 26 LEU MD2 . . 4.590 3.824 3.692 3.934 . 0 0 "[ . 1 . 2]" 1
619 1 23 ARG HA 1 27 ALA H . . 4.510 4.207 4.012 4.333 . 0 0 "[ . 1 . 2]" 1
620 1 23 ARG HA 1 38 LEU MD1 . . 4.010 3.671 3.427 3.883 . 0 0 "[ . 1 . 2]" 1
621 1 23 ARG HA 1 42 LEU MD1 . . 3.610 2.832 2.571 3.160 . 0 0 "[ . 1 . 2]" 1
622 1 23 ARG HA 1 42 LEU MD2 . . 3.550 2.230 1.980 2.426 . 0 0 "[ . 1 . 2]" 1
623 1 23 ARG HB2 1 23 ARG HD2 . . 3.770 3.085 2.568 3.779 0.009 20 0 "[ . 1 . 2]" 1
624 1 23 ARG HB2 1 23 ARG QD . . 3.210 2.613 2.449 2.746 . 0 0 "[ . 1 . 2]" 1
625 1 23 ARG HB2 1 23 ARG HD3 . . 3.770 3.067 2.561 3.803 0.033 2 0 "[ . 1 . 2]" 1
626 1 23 ARG HB2 1 24 LYS H . . 4.110 3.733 3.612 3.887 . 0 0 "[ . 1 . 2]" 1
627 1 23 ARG HB2 1 26 LEU MD1 . . 4.240 3.661 3.331 3.905 . 0 0 "[ . 1 . 2]" 1
628 1 23 ARG HB2 1 42 LEU MD1 . . 2.920 2.028 1.784 2.223 . 0 0 "[ . 1 . 2]" 1
629 1 23 ARG HB2 1 42 LEU MD2 . . 3.150 2.506 2.321 2.696 . 0 0 "[ . 1 . 2]" 1
630 1 23 ARG HB3 1 23 ARG HD2 . . 3.850 3.093 2.247 3.637 . 0 0 "[ . 1 . 2]" 1
631 1 23 ARG HB3 1 23 ARG HD3 . . 3.850 2.507 2.187 3.510 . 0 0 "[ . 1 . 2]" 1
632 1 23 ARG HB3 1 24 LYS H . . 3.820 2.448 2.256 2.672 . 0 0 "[ . 1 . 2]" 1
633 1 23 ARG HB3 1 24 LYS HA . . 4.950 4.072 3.933 4.210 . 0 0 "[ . 1 . 2]" 1
634 1 23 ARG HB3 1 25 ARG H . . 5.230 4.988 4.857 5.090 . 0 0 "[ . 1 . 2]" 1
635 1 23 ARG HB3 1 26 LEU MD1 . . 4.760 4.627 4.401 4.771 0.011 9 0 "[ . 1 . 2]" 1
636 1 23 ARG HB3 1 42 LEU MD1 . . 3.910 3.523 3.220 3.719 . 0 0 "[ . 1 . 2]" 1
637 1 23 ARG HB3 1 42 LEU MD2 . . 4.540 3.726 3.404 3.935 . 0 0 "[ . 1 . 2]" 1
638 1 23 ARG QD 1 24 LYS H . . 4.690 4.310 3.924 4.523 . 0 0 "[ . 1 . 2]" 1
639 1 23 ARG QD 1 38 LEU MD1 . . 3.830 3.113 2.629 3.745 . 0 0 "[ . 1 . 2]" 1
640 1 23 ARG QD 1 42 LEU MD1 . . 3.920 3.211 2.838 3.543 . 0 0 "[ . 1 . 2]" 1
641 1 23 ARG QD 1 42 LEU MD2 . . 4.690 4.460 4.194 4.633 . 0 0 "[ . 1 . 2]" 1
642 1 23 ARG HD2 1 23 ARG HG2 . . 3.010 2.812 2.561 3.015 0.005 16 0 "[ . 1 . 2]" 1
643 1 23 ARG HD2 1 24 LYS H . . 5.500 5.334 4.507 5.541 0.041 19 0 "[ . 1 . 2]" 1
644 1 23 ARG HD2 1 38 LEU MD1 . . 4.470 3.494 2.676 4.151 . 0 0 "[ . 1 . 2]" 1
645 1 23 ARG HD2 1 42 LEU MD1 . . 4.510 3.532 2.905 4.240 . 0 0 "[ . 1 . 2]" 1
646 1 23 ARG HD2 1 42 LEU MD2 . . 5.500 5.011 4.461 5.516 0.016 5 0 "[ . 1 . 2]" 1
647 1 23 ARG HD3 1 23 ARG HG2 . . 3.010 2.647 2.274 3.000 . 0 0 "[ . 1 . 2]" 1
648 1 23 ARG HD3 1 24 LYS H . . 5.500 4.658 4.050 5.504 0.004 2 0 "[ . 1 . 2]" 1
649 1 23 ARG HD3 1 38 LEU MD1 . . 4.470 3.793 2.683 4.261 . 0 0 "[ . 1 . 2]" 1
650 1 23 ARG HD3 1 42 LEU MD1 . . 4.510 3.929 3.323 4.402 . 0 0 "[ . 1 . 2]" 1
651 1 23 ARG HD3 1 42 LEU MD2 . . 5.500 5.122 4.653 5.500 . 0 0 "[ . 1 . 2]" 1
652 1 23 ARG HG2 1 24 LYS H . . 4.730 3.883 3.653 4.146 . 0 0 "[ . 1 . 2]" 1
653 1 23 ARG HG2 1 24 LYS HA . . 4.810 3.995 3.817 4.331 . 0 0 "[ . 1 . 2]" 1
654 1 23 ARG HG2 1 26 LEU MD1 . . 3.980 3.872 3.638 3.987 0.007 18 0 "[ . 1 . 2]" 1
655 1 23 ARG HG2 1 27 ALA H . . 4.370 3.780 3.320 4.177 . 0 0 "[ . 1 . 2]" 1
656 1 23 ARG HG2 1 38 LEU MD1 . . 3.740 2.284 2.039 2.547 . 0 0 "[ . 1 . 2]" 1
657 1 23 ARG HG2 1 42 LEU MD1 . . 4.000 3.628 3.377 3.969 . 0 0 "[ . 1 . 2]" 1
658 1 23 ARG HG2 1 42 LEU MD2 . . 4.880 4.367 4.243 4.478 . 0 0 "[ . 1 . 2]" 1
659 1 23 ARG HG3 1 24 LYS H . . 4.940 4.863 4.704 4.965 0.025 15 0 "[ . 1 . 2]" 1
660 1 23 ARG HG3 1 27 ALA H . . 5.240 5.059 4.776 5.247 0.007 11 0 "[ . 1 . 2]" 1
661 1 23 ARG HG3 1 38 LEU MD1 . . 4.040 2.212 1.980 2.522 . 0 0 "[ . 1 . 2]" 1
662 1 23 ARG HG3 1 42 LEU MD1 . . 3.550 2.224 1.971 2.697 . 0 0 "[ . 1 . 2]" 1
663 1 23 ARG HG3 1 42 LEU MD2 . . 4.250 3.648 3.471 3.825 . 0 0 "[ . 1 . 2]" 1
664 1 24 LYS H 1 24 LYS QB . . 3.000 2.526 2.299 2.643 . 0 0 "[ . 1 . 2]" 1
665 1 24 LYS H 1 24 LYS QD . . 4.140 3.980 3.347 4.203 0.063 20 0 "[ . 1 . 2]" 1
666 1 24 LYS H 1 24 LYS QE . . 4.870 4.480 3.264 4.929 0.059 15 0 "[ . 1 . 2]" 1
667 1 24 LYS H 1 24 LYS HG2 . . 4.230 2.500 1.892 2.928 . 0 0 "[ . 1 . 2]" 1
668 1 24 LYS H 1 24 LYS QG . . 3.460 2.176 1.878 2.544 . 0 0 "[ . 1 . 2]" 1
669 1 24 LYS H 1 24 LYS HG3 . . 4.230 2.775 2.150 3.404 . 0 0 "[ . 1 . 2]" 1
670 1 24 LYS H 1 25 ARG H . . 3.300 2.900 2.643 2.998 . 0 0 "[ . 1 . 2]" 1
671 1 24 LYS H 1 26 LEU H . . 4.520 4.077 3.881 4.209 . 0 0 "[ . 1 . 2]" 1
672 1 24 LYS H 1 27 ALA H . . 5.290 4.890 4.805 5.056 . 0 0 "[ . 1 . 2]" 1
673 1 24 LYS H 1 27 ALA MB . . 5.390 4.912 4.746 5.243 . 0 0 "[ . 1 . 2]" 1
674 1 24 LYS HA 1 24 LYS QD . . 4.170 3.676 2.156 4.361 0.191 19 0 "[ . 1 . 2]" 1
675 1 24 LYS HA 1 24 LYS QE . . 5.190 3.475 1.931 4.297 . 0 0 "[ . 1 . 2]" 1
676 1 24 LYS HA 1 24 LYS HG2 . . 3.840 2.834 2.328 3.961 0.121 20 0 "[ . 1 . 2]" 1
677 1 24 LYS HA 1 24 LYS QG . . 3.260 2.667 2.289 3.343 0.083 19 0 "[ . 1 . 2]" 1
678 1 24 LYS HA 1 24 LYS HG3 . . 3.840 3.565 3.371 3.839 . 0 0 "[ . 1 . 2]" 1
679 1 24 LYS HA 1 27 ALA H . . 3.740 3.615 3.513 3.712 . 0 0 "[ . 1 . 2]" 1
680 1 24 LYS HA 1 27 ALA MB . . 3.880 2.915 2.708 3.161 . 0 0 "[ . 1 . 2]" 1
681 1 24 LYS QB 1 24 LYS QD . . 3.410 2.231 1.993 2.582 . 0 0 "[ . 1 . 2]" 1
682 1 24 LYS QB 1 24 LYS QE . . 3.760 2.470 1.991 3.610 . 0 0 "[ . 1 . 2]" 1
683 1 24 LYS QB 1 26 LEU H . . 4.780 4.579 4.427 4.887 0.107 19 0 "[ . 1 . 2]" 1
684 1 24 LYS QB 1 27 ALA MB . . 4.590 4.355 4.240 4.472 . 0 0 "[ . 1 . 2]" 1
685 1 24 LYS QD 1 24 LYS QG . . 2.400 2.030 2.017 2.068 . 0 0 "[ . 1 . 2]" 1
686 1 24 LYS QE 1 24 LYS HG2 . . 3.670 2.627 2.062 3.382 . 0 0 "[ . 1 . 2]" 1
687 1 24 LYS QE 1 24 LYS HG3 . . 3.670 2.884 2.220 3.477 . 0 0 "[ . 1 . 2]" 1
688 1 24 LYS QE 1 27 ALA MB . . 5.480 4.906 3.437 5.510 0.030 15 0 "[ . 1 . 2]" 1
689 1 24 LYS QG 1 25 ARG H . . 4.120 3.581 1.873 4.066 . 0 0 "[ . 1 . 2]" 1
690 1 24 LYS HG2 1 25 ARG H . . 4.790 4.240 2.797 4.798 0.008 9 0 "[ . 1 . 2]" 1
691 1 24 LYS HG3 1 25 ARG H . . 4.790 3.949 1.888 4.679 . 0 0 "[ . 1 . 2]" 1
692 1 25 ARG H 1 25 ARG QB . . 2.820 2.230 2.198 2.302 . 0 0 "[ . 1 . 2]" 1
693 1 25 ARG H 1 25 ARG HD2 . . 4.600 3.801 3.387 4.571 . 0 0 "[ . 1 . 2]" 1
694 1 25 ARG H 1 25 ARG HD3 . . 4.600 4.057 3.418 4.611 0.011 17 0 "[ . 1 . 2]" 1
695 1 25 ARG H 1 25 ARG HG2 . . 3.600 2.843 2.801 2.888 . 0 0 "[ . 1 . 2]" 1
696 1 25 ARG H 1 25 ARG HG3 . . 4.170 4.111 4.084 4.137 . 0 0 "[ . 1 . 2]" 1
697 1 25 ARG H 1 26 LEU H . . 3.210 2.536 2.354 2.620 . 0 0 "[ . 1 . 2]" 1
698 1 25 ARG H 1 26 LEU HB2 . . 4.980 4.870 4.653 4.981 0.001 1 0 "[ . 1 . 2]" 1
699 1 25 ARG H 1 26 LEU MD2 . . 5.010 4.478 4.291 4.598 . 0 0 "[ . 1 . 2]" 1
700 1 25 ARG H 1 26 LEU HG . . 5.330 3.980 3.667 4.086 . 0 0 "[ . 1 . 2]" 1
701 1 25 ARG H 1 27 ALA H . . 4.350 4.285 4.181 4.349 . 0 0 "[ . 1 . 2]" 1
702 1 25 ARG H 1 27 ALA MB . . 5.080 4.938 4.857 5.034 . 0 0 "[ . 1 . 2]" 1
703 1 25 ARG HA 1 25 ARG QB . . 2.780 2.161 2.158 2.163 . 0 0 "[ . 1 . 2]" 1
704 1 25 ARG HA 1 25 ARG QD . . 4.870 4.345 4.264 4.466 . 0 0 "[ . 1 . 2]" 1
705 1 25 ARG HA 1 25 ARG HG3 . . 3.780 3.728 3.677 3.747 . 0 0 "[ . 1 . 2]" 1
706 1 25 ARG HA 1 26 LEU MD2 . . 5.210 4.869 4.782 4.945 . 0 0 "[ . 1 . 2]" 1
707 1 25 ARG HA 1 28 GLN H . . 4.410 3.735 3.660 3.816 . 0 0 "[ . 1 . 2]" 1
708 1 25 ARG HA 1 28 GLN HE21 . . 4.960 2.311 2.001 2.540 . 0 0 "[ . 1 . 2]" 1
709 1 25 ARG HA 1 28 GLN HE22 . . 5.080 3.507 3.275 3.700 . 0 0 "[ . 1 . 2]" 1
710 1 25 ARG HA 1 28 GLN HG2 . . 3.950 2.092 1.999 2.350 . 0 0 "[ . 1 . 2]" 1
711 1 25 ARG HA 1 28 GLN QG . . 3.160 2.058 1.968 2.304 . 0 0 "[ . 1 . 2]" 1
712 1 25 ARG HA 1 28 GLN HG3 . . 3.950 3.063 2.884 3.318 . 0 0 "[ . 1 . 2]" 1
713 1 25 ARG HA 1 29 GLN H . . 4.770 4.190 4.072 4.336 . 0 0 "[ . 1 . 2]" 1
714 1 25 ARG QB 1 25 ARG HD2 . . 3.740 2.189 2.042 2.460 . 0 0 "[ . 1 . 2]" 1
715 1 25 ARG QB 1 25 ARG QD . . 2.970 2.102 2.020 2.234 . 0 0 "[ . 1 . 2]" 1
716 1 25 ARG QB 1 25 ARG HD3 . . 3.740 2.958 2.280 3.292 . 0 0 "[ . 1 . 2]" 1
717 1 25 ARG QB 1 25 ARG HG2 . . 2.710 2.469 2.443 2.480 . 0 0 "[ . 1 . 2]" 1
718 1 25 ARG QB 1 28 GLN QB . . 5.500 5.331 5.253 5.462 . 0 0 "[ . 1 . 2]" 1
719 1 25 ARG QB 1 28 GLN HE21 . . 4.840 2.466 2.282 2.673 . 0 0 "[ . 1 . 2]" 1
720 1 25 ARG QB 1 28 GLN HE22 . . 4.930 3.491 3.329 3.678 . 0 0 "[ . 1 . 2]" 1
721 1 25 ARG QB 1 28 GLN QG . . 5.250 3.560 3.489 3.689 . 0 0 "[ . 1 . 2]" 1
722 1 25 ARG QB 1 29 GLN H . . 5.170 5.058 4.941 5.178 0.008 20 0 "[ . 1 . 2]" 1
723 1 25 ARG QB 1 29 GLN HB2 . . 5.500 4.969 4.839 5.192 . 0 0 "[ . 1 . 2]" 1
724 1 25 ARG QB 1 29 GLN HG3 . . 5.500 3.954 3.704 4.205 . 0 0 "[ . 1 . 2]" 1
725 1 25 ARG QD 1 42 LEU MD2 . . 5.340 4.030 3.750 4.409 . 0 0 "[ . 1 . 2]" 1
726 1 25 ARG HD2 1 26 LEU H . . 5.270 4.652 4.169 5.292 0.022 19 0 "[ . 1 . 2]" 1
727 1 25 ARG HD3 1 26 LEU H . . 5.270 4.302 3.987 4.754 . 0 0 "[ . 1 . 2]" 1
728 1 25 ARG HG2 1 26 LEU H . . 3.790 2.175 1.994 2.657 . 0 0 "[ . 1 . 2]" 1
729 1 25 ARG HG2 1 28 GLN HE21 . . 4.970 4.808 4.697 4.970 0.000 1 0 "[ . 1 . 2]" 1
730 1 25 ARG HG2 1 28 GLN QG . . 5.340 4.772 4.721 4.858 . 0 0 "[ . 1 . 2]" 1
731 1 25 ARG HG2 1 29 GLN H . . 5.500 5.492 5.449 5.529 0.029 15 0 "[ . 1 . 2]" 1
732 1 25 ARG HG2 1 29 GLN HB2 . . 5.100 4.874 4.820 4.938 . 0 0 "[ . 1 . 2]" 1
733 1 25 ARG HG2 1 29 GLN HG3 . . 5.500 5.045 4.752 5.460 . 0 0 "[ . 1 . 2]" 1
734 1 25 ARG HG3 1 26 LEU H . . 4.440 3.540 3.362 4.038 . 0 0 "[ . 1 . 2]" 1
735 1 25 ARG HG3 1 26 LEU HA . . 4.340 3.586 3.468 3.864 . 0 0 "[ . 1 . 2]" 1
736 1 25 ARG HG3 1 26 LEU MD2 . . 4.130 2.463 2.293 2.767 . 0 0 "[ . 1 . 2]" 1
737 1 25 ARG HG3 1 28 GLN HE21 . . 5.280 3.980 3.806 4.154 . 0 0 "[ . 1 . 2]" 1
738 1 25 ARG HG3 1 29 GLN HB2 . . 4.740 4.260 4.071 4.434 . 0 0 "[ . 1 . 2]" 1
739 1 25 ARG HG3 1 29 GLN QE . . 5.320 2.715 1.992 4.224 . 0 0 "[ . 1 . 2]" 1
740 1 25 ARG HG3 1 29 GLN HG2 . . 5.500 5.337 5.153 5.495 . 0 0 "[ . 1 . 2]" 1
741 1 25 ARG HG3 1 29 GLN HG3 . . 4.550 3.837 3.622 4.315 . 0 0 "[ . 1 . 2]" 1
742 1 26 LEU H 1 26 LEU HB2 . . 2.980 2.565 2.488 2.627 . 0 0 "[ . 1 . 2]" 1
743 1 26 LEU H 1 26 LEU HB3 . . 3.650 3.596 3.587 3.620 . 0 0 "[ . 1 . 2]" 1
744 1 26 LEU H 1 26 LEU MD1 . . 4.030 3.753 3.685 3.841 . 0 0 "[ . 1 . 2]" 1
745 1 26 LEU H 1 26 LEU MD2 . . 3.290 2.883 2.697 3.126 . 0 0 "[ . 1 . 2]" 1
746 1 26 LEU H 1 26 LEU HG . . 3.110 2.238 2.119 2.379 . 0 0 "[ . 1 . 2]" 1
747 1 26 LEU H 1 27 ALA H . . 3.160 2.585 2.392 2.680 . 0 0 "[ . 1 . 2]" 1
748 1 26 LEU H 1 27 ALA MB . . 4.320 4.153 3.968 4.258 . 0 0 "[ . 1 . 2]" 1
749 1 26 LEU H 1 28 GLN H . . 5.190 4.305 4.166 4.450 . 0 0 "[ . 1 . 2]" 1
750 1 26 LEU H 1 29 GLN H . . 5.500 4.647 4.596 4.732 . 0 0 "[ . 1 . 2]" 1
751 1 26 LEU H 1 29 GLN HB2 . . 5.390 4.652 4.577 4.756 . 0 0 "[ . 1 . 2]" 1
752 1 26 LEU H 1 38 LEU MD1 . . 4.820 4.630 4.452 4.824 0.004 5 0 "[ . 1 . 2]" 1
753 1 26 LEU H 1 38 LEU MD2 . . 5.500 4.730 4.622 4.859 . 0 0 "[ . 1 . 2]" 1
754 1 26 LEU H 1 42 LEU MD2 . . 5.010 4.283 4.060 4.439 . 0 0 "[ . 1 . 2]" 1
755 1 26 LEU HA 1 26 LEU MD1 . . 3.900 3.803 3.753 3.834 . 0 0 "[ . 1 . 2]" 1
756 1 26 LEU HA 1 26 LEU MD2 . . 2.700 2.082 1.982 2.171 . 0 0 "[ . 1 . 2]" 1
757 1 26 LEU HA 1 26 LEU HG . . 3.750 3.355 3.304 3.411 . 0 0 "[ . 1 . 2]" 1
758 1 26 LEU HA 1 28 GLN HG2 . . 5.500 5.070 4.958 5.207 . 0 0 "[ . 1 . 2]" 1
759 1 26 LEU HA 1 28 GLN QG . . 4.760 4.286 4.193 4.375 . 0 0 "[ . 1 . 2]" 1
760 1 26 LEU HA 1 28 GLN HG3 . . 5.500 4.624 4.523 4.740 . 0 0 "[ . 1 . 2]" 1
761 1 26 LEU HA 1 29 GLN H . . 3.890 3.419 3.355 3.517 . 0 0 "[ . 1 . 2]" 1
762 1 26 LEU HA 1 29 GLN HB2 . . 3.720 2.355 2.287 2.413 . 0 0 "[ . 1 . 2]" 1
763 1 26 LEU HA 1 29 GLN HB3 . . 3.960 3.739 3.691 3.795 . 0 0 "[ . 1 . 2]" 1
764 1 26 LEU HA 1 29 GLN QE . . 4.950 3.788 2.434 4.471 . 0 0 "[ . 1 . 2]" 1
765 1 26 LEU HA 1 29 GLN HG2 . . 5.500 5.159 5.068 5.219 . 0 0 "[ . 1 . 2]" 1
766 1 26 LEU HA 1 29 GLN HG3 . . 5.390 4.053 3.851 4.346 . 0 0 "[ . 1 . 2]" 1
767 1 26 LEU HA 1 30 ASN HD21 . . 3.630 3.502 3.262 3.637 0.007 20 0 "[ . 1 . 2]" 1
768 1 26 LEU HA 1 30 ASN HD22 . . 4.580 4.351 4.028 4.496 . 0 0 "[ . 1 . 2]" 1
769 1 26 LEU HA 1 41 MET ME . . 4.320 3.998 3.692 4.258 . 0 0 "[ . 1 . 2]" 1
770 1 26 LEU HB2 1 26 LEU MD1 . . 2.880 2.474 2.434 2.511 . 0 0 "[ . 1 . 2]" 1
771 1 26 LEU HB2 1 27 ALA H . . 3.200 2.520 2.431 2.660 . 0 0 "[ . 1 . 2]" 1
772 1 26 LEU HB2 1 27 ALA HA . . 4.910 4.121 4.067 4.198 . 0 0 "[ . 1 . 2]" 1
773 1 26 LEU HB2 1 30 ASN HD21 . . 5.120 4.816 4.570 4.984 . 0 0 "[ . 1 . 2]" 1
774 1 26 LEU HB2 1 41 MET ME . . 4.650 4.065 3.798 4.416 . 0 0 "[ . 1 . 2]" 1
775 1 26 LEU HB3 1 26 LEU MD1 . . 2.970 2.213 2.179 2.263 . 0 0 "[ . 1 . 2]" 1
776 1 26 LEU HB3 1 26 LEU MD2 . . 2.980 2.460 2.390 2.510 . 0 0 "[ . 1 . 2]" 1
777 1 26 LEU HB3 1 27 ALA H . . 3.910 3.690 3.616 3.806 . 0 0 "[ . 1 . 2]" 1
778 1 26 LEU HB3 1 30 ASN HD21 . . 4.160 3.252 3.065 3.403 . 0 0 "[ . 1 . 2]" 1
779 1 26 LEU HB3 1 30 ASN HD22 . . 4.910 4.573 4.315 4.742 . 0 0 "[ . 1 . 2]" 1
780 1 26 LEU HB3 1 41 MET ME . . 4.530 2.574 2.231 2.944 . 0 0 "[ . 1 . 2]" 1
781 1 26 LEU HB3 1 42 LEU MD2 . . 4.990 4.572 4.444 4.768 . 0 0 "[ . 1 . 2]" 1
782 1 26 LEU MD1 1 27 ALA H . . 4.610 4.548 4.456 4.627 0.017 19 0 "[ . 1 . 2]" 1
783 1 26 LEU MD1 1 38 LEU HA . . 3.110 2.258 2.104 2.339 . 0 0 "[ . 1 . 2]" 1
784 1 26 LEU MD1 1 38 LEU HB3 . . 3.150 1.933 1.839 2.015 . 0 0 "[ . 1 . 2]" 1
785 1 26 LEU MD1 1 39 SER H . . 4.290 4.105 3.953 4.174 . 0 0 "[ . 1 . 2]" 1
786 1 26 LEU MD1 1 40 LYS H . . 5.190 5.132 4.984 5.217 0.027 9 0 "[ . 1 . 2]" 1
787 1 26 LEU MD1 1 40 LYS QB . . 5.200 5.154 5.053 5.218 0.018 14 0 "[ . 1 . 2]" 1
788 1 26 LEU MD1 1 41 MET H . . 4.000 3.462 3.357 3.552 . 0 0 "[ . 1 . 2]" 1
789 1 26 LEU MD1 1 41 MET HA . . 5.000 4.455 4.196 4.598 . 0 0 "[ . 1 . 2]" 1
790 1 26 LEU MD1 1 41 MET QB . . 3.240 2.001 1.759 2.125 . 0 0 "[ . 1 . 2]" 1
791 1 26 LEU MD1 1 41 MET HG2 . . 4.890 4.379 4.096 4.476 . 0 0 "[ . 1 . 2]" 1
792 1 26 LEU MD1 1 41 MET HG3 . . 4.020 3.584 3.279 3.688 . 0 0 "[ . 1 . 2]" 1
793 1 26 LEU MD1 1 42 LEU H . . 4.230 2.828 2.586 2.983 . 0 0 "[ . 1 . 2]" 1
794 1 26 LEU MD1 1 42 LEU HA . . 3.750 3.370 3.228 3.546 . 0 0 "[ . 1 . 2]" 1
795 1 26 LEU MD1 1 42 LEU MD2 . . 3.060 1.855 1.785 2.037 . 0 0 "[ . 1 . 2]" 1
796 1 26 LEU MD1 1 42 LEU HG . . 3.370 1.834 1.775 1.964 . 0 0 "[ . 1 . 2]" 1
797 1 26 LEU MD2 1 27 ALA H . . 4.780 4.469 4.401 4.542 . 0 0 "[ . 1 . 2]" 1
798 1 26 LEU MD2 1 28 GLN HE21 . . 5.500 5.475 5.418 5.502 0.002 17 0 "[ . 1 . 2]" 1
799 1 26 LEU MD2 1 29 GLN H . . 5.500 4.870 4.788 4.920 . 0 0 "[ . 1 . 2]" 1
800 1 26 LEU MD2 1 29 GLN HB2 . . 4.070 3.650 3.513 3.735 . 0 0 "[ . 1 . 2]" 1
801 1 26 LEU MD2 1 29 GLN HB3 . . 4.870 4.462 4.312 4.564 . 0 0 "[ . 1 . 2]" 1
802 1 26 LEU MD2 1 29 GLN HE21 . . 4.820 3.688 2.557 4.711 . 0 0 "[ . 1 . 2]" 1
803 1 26 LEU MD2 1 29 GLN QE . . 4.220 3.305 2.359 3.858 . 0 0 "[ . 1 . 2]" 1
804 1 26 LEU MD2 1 29 GLN HE22 . . 4.820 3.841 2.751 4.369 . 0 0 "[ . 1 . 2]" 1
805 1 26 LEU MD2 1 29 GLN HG3 . . 5.180 4.558 4.378 4.894 . 0 0 "[ . 1 . 2]" 1
806 1 26 LEU MD2 1 30 ASN HD21 . . 4.020 3.778 3.639 3.886 . 0 0 "[ . 1 . 2]" 1
807 1 26 LEU MD2 1 30 ASN HD22 . . 4.210 4.118 3.998 4.214 0.004 18 0 "[ . 1 . 2]" 1
808 1 26 LEU MD2 1 38 LEU HA . . 4.310 4.022 3.936 4.097 . 0 0 "[ . 1 . 2]" 1
809 1 26 LEU MD2 1 41 MET HA . . 5.460 4.799 4.555 4.979 . 0 0 "[ . 1 . 2]" 1
810 1 26 LEU MD2 1 41 MET QB . . 3.550 2.439 2.298 2.580 . 0 0 "[ . 1 . 2]" 1
811 1 26 LEU MD2 1 41 MET ME . . 3.130 3.079 2.888 3.150 0.020 9 0 "[ . 1 . 2]" 1
812 1 26 LEU MD2 1 41 MET HG2 . . 4.210 4.111 3.895 4.217 0.007 19 0 "[ . 1 . 2]" 1
813 1 26 LEU MD2 1 41 MET HG3 . . 4.230 4.081 3.971 4.216 . 0 0 "[ . 1 . 2]" 1
814 1 26 LEU MD2 1 42 LEU H . . 4.890 4.477 4.307 4.627 . 0 0 "[ . 1 . 2]" 1
815 1 26 LEU MD2 1 42 LEU HA . . 4.680 4.479 4.208 4.676 . 0 0 "[ . 1 . 2]" 1
816 1 26 LEU HG 1 27 ALA H . . 5.500 4.119 4.012 4.236 . 0 0 "[ . 1 . 2]" 1
817 1 26 LEU HG 1 41 MET QB . . 4.390 4.195 3.949 4.323 . 0 0 "[ . 1 . 2]" 1
818 1 26 LEU HG 1 42 LEU MD2 . . 4.580 2.524 2.269 2.758 . 0 0 "[ . 1 . 2]" 1
819 1 27 ALA H 1 27 ALA MB . . 2.670 2.105 2.053 2.129 . 0 0 "[ . 1 . 2]" 1
820 1 27 ALA H 1 28 GLN H . . 3.080 2.848 2.809 2.941 . 0 0 "[ . 1 . 2]" 1
821 1 27 ALA H 1 28 GLN HA . . 5.500 5.413 5.386 5.475 . 0 0 "[ . 1 . 2]" 1
822 1 27 ALA H 1 28 GLN QB . . 5.500 5.109 5.071 5.145 . 0 0 "[ . 1 . 2]" 1
823 1 27 ALA H 1 28 GLN QG . . 4.850 4.003 3.902 4.093 . 0 0 "[ . 1 . 2]" 1
824 1 27 ALA H 1 29 GLN HB2 . . 4.990 4.868 4.824 4.908 . 0 0 "[ . 1 . 2]" 1
825 1 27 ALA H 1 30 ASN H . . 4.890 4.599 4.543 4.648 . 0 0 "[ . 1 . 2]" 1
826 1 27 ALA H 1 38 LEU MD1 . . 3.490 3.291 3.031 3.470 . 0 0 "[ . 1 . 2]" 1
827 1 27 ALA H 1 38 LEU MD2 . . 4.730 3.759 3.627 3.872 . 0 0 "[ . 1 . 2]" 1
828 1 27 ALA HA 1 28 GLN QB . . 5.500 5.509 5.503 5.526 0.026 19 0 "[ . 1 . 2]" 1
829 1 27 ALA HA 1 29 GLN HB2 . . 5.500 5.457 5.384 5.509 0.009 15 0 "[ . 1 . 2]" 1
830 1 27 ALA HA 1 30 ASN H . . 3.850 3.532 3.436 3.642 . 0 0 "[ . 1 . 2]" 1
831 1 27 ALA HA 1 30 ASN HB2 . . 4.180 4.049 3.878 4.156 . 0 0 "[ . 1 . 2]" 1
832 1 27 ALA HA 1 30 ASN HB3 . . 5.500 5.427 5.312 5.511 0.011 15 0 "[ . 1 . 2]" 1
833 1 27 ALA HA 1 31 PRO HA . . 4.700 4.309 4.224 4.385 . 0 0 "[ . 1 . 2]" 1
834 1 27 ALA HA 1 33 LEU HB2 . . 4.990 4.924 4.783 4.994 0.004 20 0 "[ . 1 . 2]" 1
835 1 27 ALA HA 1 38 LEU MD1 . . 3.340 2.930 2.649 3.131 . 0 0 "[ . 1 . 2]" 1
836 1 27 ALA MB 1 28 GLN H . . 2.920 2.494 2.305 2.563 . 0 0 "[ . 1 . 2]" 1
837 1 27 ALA MB 1 28 GLN HA . . 3.720 3.725 3.692 3.750 0.030 19 0 "[ . 1 . 2]" 1
838 1 27 ALA MB 1 28 GLN QB . . 4.010 3.885 3.746 3.934 . 0 0 "[ . 1 . 2]" 1
839 1 27 ALA MB 1 28 GLN QG . . 4.040 3.886 3.805 3.954 . 0 0 "[ . 1 . 2]" 1
840 1 27 ALA MB 1 30 ASN H . . 4.700 4.555 4.446 4.656 . 0 0 "[ . 1 . 2]" 1
841 1 27 ALA MB 1 30 ASN HB2 . . 5.500 5.420 5.281 5.504 0.004 19 0 "[ . 1 . 2]" 1
842 1 27 ALA MB 1 31 PRO HA . . 4.570 4.470 4.401 4.535 . 0 0 "[ . 1 . 2]" 1
843 1 27 ALA MB 1 38 LEU MD1 . . 2.890 2.858 2.708 2.905 0.015 20 0 "[ . 1 . 2]" 1
844 1 28 GLN H 1 28 GLN HA . . 2.910 2.823 2.798 2.836 . 0 0 "[ . 1 . 2]" 1
845 1 28 GLN H 1 28 GLN QB . . 2.850 2.558 2.489 2.603 . 0 0 "[ . 1 . 2]" 1
846 1 28 GLN H 1 28 GLN QG . . 3.230 2.140 2.042 2.220 . 0 0 "[ . 1 . 2]" 1
847 1 28 GLN H 1 38 LEU MD2 . . 5.500 5.488 5.428 5.515 0.015 16 0 "[ . 1 . 2]" 1
848 1 28 GLN HA 1 28 GLN QB . . 2.750 2.180 2.178 2.180 . 0 0 "[ . 1 . 2]" 1
849 1 28 GLN HA 1 28 GLN HG2 . . 4.200 3.859 3.807 3.896 . 0 0 "[ . 1 . 2]" 1
850 1 28 GLN HA 1 28 GLN QG . . 3.580 3.337 3.333 3.338 . 0 0 "[ . 1 . 2]" 1
851 1 28 GLN HA 1 28 GLN HG3 . . 4.200 3.652 3.629 3.683 . 0 0 "[ . 1 . 2]" 1
852 1 28 GLN HA 1 30 ASN H . . 5.500 4.248 4.160 4.374 . 0 0 "[ . 1 . 2]" 1
853 1 28 GLN HA 1 31 PRO HA . . 4.980 4.584 4.481 4.708 . 0 0 "[ . 1 . 2]" 1
854 1 28 GLN HA 1 31 PRO HB3 . . 4.540 4.177 4.064 4.284 . 0 0 "[ . 1 . 2]" 1
855 1 28 GLN HA 1 31 PRO HD3 . . 4.710 4.185 4.079 4.289 . 0 0 "[ . 1 . 2]" 1
856 1 28 GLN HE21 1 29 GLN HB2 . . 5.500 4.558 4.435 4.715 . 0 0 "[ . 1 . 2]" 1
857 1 28 GLN HE21 1 29 GLN HG3 . . 4.500 2.909 2.674 3.042 . 0 0 "[ . 1 . 2]" 1
858 1 28 GLN HE22 1 29 GLN HG2 . . 5.500 5.280 5.036 5.478 . 0 0 "[ . 1 . 2]" 1
859 1 28 GLN HE22 1 29 GLN HG3 . . 4.760 4.215 3.972 4.428 . 0 0 "[ . 1 . 2]" 1
860 1 28 GLN QG 1 30 ASN H . . 4.810 4.244 4.196 4.317 . 0 0 "[ . 1 . 2]" 1
861 1 28 GLN HG2 1 29 GLN H . . 3.680 3.074 2.971 3.170 . 0 0 "[ . 1 . 2]" 1
862 1 28 GLN HG2 1 30 ASN H . . 5.500 5.385 5.283 5.501 0.001 1 0 "[ . 1 . 2]" 1
863 1 28 GLN HG3 1 29 GLN H . . 3.680 1.978 1.898 2.153 . 0 0 "[ . 1 . 2]" 1
864 1 28 GLN HG3 1 30 ASN H . . 5.500 4.443 4.382 4.545 . 0 0 "[ . 1 . 2]" 1
865 1 29 GLN H 1 29 GLN HB2 . . 3.170 2.177 2.173 2.187 . 0 0 "[ . 1 . 2]" 1
866 1 29 GLN H 1 29 GLN HB3 . . 3.600 3.484 3.478 3.494 . 0 0 "[ . 1 . 2]" 1
867 1 29 GLN H 1 30 ASN H . . 3.160 2.514 2.411 2.610 . 0 0 "[ . 1 . 2]" 1
868 1 29 GLN H 1 38 LEU MD2 . . 5.500 5.355 5.267 5.449 . 0 0 "[ . 1 . 2]" 1
869 1 29 GLN HA 1 29 GLN HG2 . . 3.260 2.253 2.157 2.452 . 0 0 "[ . 1 . 2]" 1
870 1 29 GLN HA 1 29 GLN HG3 . . 3.460 2.970 2.700 3.124 . 0 0 "[ . 1 . 2]" 1
871 1 29 GLN HA 1 30 ASN HA . . 4.750 4.522 4.516 4.531 . 0 0 "[ . 1 . 2]" 1
872 1 29 GLN HA 1 31 PRO HD2 . . 5.320 5.044 5.003 5.075 . 0 0 "[ . 1 . 2]" 1
873 1 29 GLN HA 1 31 PRO HD3 . . 4.310 4.037 3.987 4.075 . 0 0 "[ . 1 . 2]" 1
874 1 29 GLN HB2 1 29 GLN QE . . 4.330 3.135 2.178 3.701 . 0 0 "[ . 1 . 2]" 1
875 1 29 GLN HB2 1 30 ASN H . . 3.820 2.993 2.875 3.059 . 0 0 "[ . 1 . 2]" 1
876 1 29 GLN HB2 1 30 ASN HA . . 5.310 5.111 5.061 5.134 . 0 0 "[ . 1 . 2]" 1
877 1 29 GLN HB2 1 30 ASN HB2 . . 4.760 4.616 4.583 4.674 . 0 0 "[ . 1 . 2]" 1
878 1 29 GLN HB2 1 30 ASN HD22 . . 4.860 4.075 3.878 4.167 . 0 0 "[ . 1 . 2]" 1
879 1 29 GLN HB3 1 29 GLN QE . . 4.440 3.344 2.202 3.987 . 0 0 "[ . 1 . 2]" 1
880 1 29 GLN HB3 1 30 ASN H . . 3.720 3.475 3.354 3.555 . 0 0 "[ . 1 . 2]" 1
881 1 29 GLN HB3 1 30 ASN HA . . 4.760 4.497 4.432 4.532 . 0 0 "[ . 1 . 2]" 1
882 1 29 GLN HB3 1 30 ASN HB2 . . 4.890 4.666 4.624 4.760 . 0 0 "[ . 1 . 2]" 1
883 1 29 GLN HB3 1 30 ASN HD21 . . 3.710 3.715 3.702 3.722 0.012 13 0 "[ . 1 . 2]" 1
884 1 29 GLN HB3 1 30 ASN HD22 . . 3.980 3.309 3.215 3.359 . 0 0 "[ . 1 . 2]" 1
885 1 29 GLN HG2 1 30 ASN H . . 5.270 5.062 4.976 5.163 . 0 0 "[ . 1 . 2]" 1
886 1 29 GLN HG3 1 30 ASN H . . 5.500 4.868 4.811 4.923 . 0 0 "[ . 1 . 2]" 1
887 1 30 ASN H 1 30 ASN HB2 . . 3.570 2.728 2.674 2.772 . 0 0 "[ . 1 . 2]" 1
888 1 30 ASN H 1 30 ASN HB3 . . 3.880 3.829 3.798 3.852 . 0 0 "[ . 1 . 2]" 1
889 1 30 ASN H 1 31 PRO HA . . 4.840 4.539 4.509 4.602 . 0 0 "[ . 1 . 2]" 1
890 1 30 ASN H 1 31 PRO HD2 . . 4.600 4.157 4.127 4.197 . 0 0 "[ . 1 . 2]" 1
891 1 30 ASN H 1 31 PRO HD3 . . 3.960 3.449 3.406 3.510 . 0 0 "[ . 1 . 2]" 1
892 1 30 ASN H 1 33 LEU HB2 . . 5.010 4.722 4.679 4.764 . 0 0 "[ . 1 . 2]" 1
893 1 30 ASN H 1 38 LEU MD2 . . 4.430 4.190 4.114 4.251 . 0 0 "[ . 1 . 2]" 1
894 1 30 ASN HA 1 30 ASN HD21 . . 4.610 4.266 4.249 4.281 . 0 0 "[ . 1 . 2]" 1
895 1 30 ASN HA 1 30 ASN HD22 . . 4.800 4.588 4.579 4.598 . 0 0 "[ . 1 . 2]" 1
896 1 30 ASN HA 1 31 PRO HB2 . . 5.500 5.520 5.515 5.527 0.027 9 0 "[ . 1 . 2]" 1
897 1 30 ASN HA 1 31 PRO HB3 . . 5.140 5.151 5.142 5.163 0.023 9 0 "[ . 1 . 2]" 1
898 1 30 ASN HA 1 31 PRO HD2 . . 2.730 1.983 1.976 1.993 . 0 0 "[ . 1 . 2]" 1
899 1 30 ASN HA 1 31 PRO HD3 . . 2.980 2.753 2.739 2.772 . 0 0 "[ . 1 . 2]" 1
900 1 30 ASN HA 1 31 PRO HG2 . . 4.190 4.149 4.145 4.155 . 0 0 "[ . 1 . 2]" 1
901 1 30 ASN HA 1 31 PRO HG3 . . 4.560 4.540 4.529 4.553 . 0 0 "[ . 1 . 2]" 1
902 1 30 ASN HA 1 32 ASP H . . 3.980 3.151 3.140 3.160 . 0 0 "[ . 1 . 2]" 1
903 1 30 ASN HA 1 33 LEU H . . 4.970 3.833 3.805 3.861 . 0 0 "[ . 1 . 2]" 1
904 1 30 ASN HA 1 33 LEU HB2 . . 5.050 4.263 4.244 4.286 . 0 0 "[ . 1 . 2]" 1
905 1 30 ASN HA 1 33 LEU MD1 . . 4.600 4.185 3.952 4.353 . 0 0 "[ . 1 . 2]" 1
906 1 30 ASN HA 1 33 LEU MD2 . . 5.500 5.446 5.406 5.483 . 0 0 "[ . 1 . 2]" 1
907 1 30 ASN HA 1 33 LEU HG . . 5.100 4.078 4.027 4.117 . 0 0 "[ . 1 . 2]" 1
908 1 30 ASN HB2 1 30 ASN HD21 . . 3.090 2.116 2.114 2.121 . 0 0 "[ . 1 . 2]" 1
909 1 30 ASN HB2 1 30 ASN HD22 . . 3.550 3.434 3.433 3.437 . 0 0 "[ . 1 . 2]" 1
910 1 30 ASN HB2 1 31 PRO HD2 . . 5.030 4.799 4.792 4.804 . 0 0 "[ . 1 . 2]" 1
911 1 30 ASN HB2 1 31 PRO HD3 . . 5.120 5.052 5.043 5.058 . 0 0 "[ . 1 . 2]" 1
912 1 30 ASN HB2 1 32 ASP H . . 5.040 4.356 4.315 4.372 . 0 0 "[ . 1 . 2]" 1
913 1 30 ASN HB2 1 33 LEU H . . 4.250 3.481 3.431 3.504 . 0 0 "[ . 1 . 2]" 1
914 1 30 ASN HB2 1 33 LEU HA . . 5.500 5.137 5.091 5.164 . 0 0 "[ . 1 . 2]" 1
915 1 30 ASN HB2 1 33 LEU HB2 . . 3.470 2.185 2.151 2.215 . 0 0 "[ . 1 . 2]" 1
916 1 30 ASN HB2 1 33 LEU HB3 . . 4.350 3.692 3.655 3.724 . 0 0 "[ . 1 . 2]" 1
917 1 30 ASN HB2 1 33 LEU MD1 . . 3.380 2.584 2.388 2.717 . 0 0 "[ . 1 . 2]" 1
918 1 30 ASN HB2 1 33 LEU HG . . 3.940 3.504 3.471 3.532 . 0 0 "[ . 1 . 2]" 1
919 1 30 ASN HB2 1 38 LEU MD2 . . 3.540 2.855 2.764 2.931 . 0 0 "[ . 1 . 2]" 1
920 1 30 ASN HB2 1 41 MET ME . . 4.680 3.386 3.075 3.536 . 0 0 "[ . 1 . 2]" 1
921 1 30 ASN HB3 1 30 ASN HD21 . . 3.480 3.275 3.257 3.306 . 0 0 "[ . 1 . 2]" 1
922 1 30 ASN HB3 1 30 ASN HD22 . . 4.010 3.954 3.945 3.969 . 0 0 "[ . 1 . 2]" 1
923 1 30 ASN HB3 1 31 PRO HD2 . . 4.350 4.094 4.074 4.117 . 0 0 "[ . 1 . 2]" 1
924 1 30 ASN HB3 1 31 PRO HD3 . . 5.060 4.956 4.945 4.968 . 0 0 "[ . 1 . 2]" 1
925 1 30 ASN HB3 1 32 ASP H . . 5.050 3.304 3.262 3.327 . 0 0 "[ . 1 . 2]" 1
926 1 30 ASN HB3 1 33 LEU H . . 3.710 2.530 2.502 2.561 . 0 0 "[ . 1 . 2]" 1
927 1 30 ASN HB3 1 33 LEU HA . . 4.610 4.259 4.249 4.267 . 0 0 "[ . 1 . 2]" 1
928 1 30 ASN HB3 1 33 LEU HB2 . . 3.450 1.997 1.990 2.052 . 0 0 "[ . 1 . 2]" 1
929 1 30 ASN HB3 1 33 LEU HB3 . . 4.210 3.519 3.505 3.544 . 0 0 "[ . 1 . 2]" 1
930 1 30 ASN HB3 1 33 LEU MD1 . . 3.200 2.366 2.170 2.532 . 0 0 "[ . 1 . 2]" 1
931 1 30 ASN HB3 1 33 LEU MD2 . . 3.700 3.668 3.647 3.690 . 0 0 "[ . 1 . 2]" 1
932 1 30 ASN HB3 1 33 LEU HG . . 3.380 1.993 1.986 2.018 . 0 0 "[ . 1 . 2]" 1
933 1 30 ASN HB3 1 38 LEU MD2 . . 4.070 3.860 3.775 3.936 . 0 0 "[ . 1 . 2]" 1
934 1 30 ASN HB3 1 41 MET ME . . 4.750 4.092 3.776 4.249 . 0 0 "[ . 1 . 2]" 1
935 1 30 ASN HD21 1 33 LEU HB2 . . 4.220 3.714 3.689 3.741 . 0 0 "[ . 1 . 2]" 1
936 1 30 ASN HD21 1 33 LEU HB3 . . 5.320 4.614 4.556 4.672 . 0 0 "[ . 1 . 2]" 1
937 1 30 ASN HD21 1 33 LEU MD1 . . 3.500 2.545 2.495 2.617 . 0 0 "[ . 1 . 2]" 1
938 1 30 ASN HD21 1 33 LEU HG . . 5.500 4.615 4.505 4.761 . 0 0 "[ . 1 . 2]" 1
939 1 30 ASN HD21 1 38 LEU HA . . 5.010 4.392 4.269 4.465 . 0 0 "[ . 1 . 2]" 1
940 1 30 ASN HD21 1 38 LEU HB3 . . 5.500 5.443 5.320 5.508 0.008 13 0 "[ . 1 . 2]" 1
941 1 30 ASN HD21 1 38 LEU MD2 . . 4.030 3.088 2.967 3.171 . 0 0 "[ . 1 . 2]" 1
942 1 30 ASN HD21 1 41 MET ME . . 3.770 2.182 1.882 2.401 . 0 0 "[ . 1 . 2]" 1
943 1 30 ASN HD22 1 33 LEU HB2 . . 4.870 4.880 4.858 4.892 0.022 19 0 "[ . 1 . 2]" 1
944 1 30 ASN HD22 1 33 LEU MD1 . . 4.360 2.906 2.854 2.969 . 0 0 "[ . 1 . 2]" 1
945 1 30 ASN HD22 1 33 LEU MD2 . . 5.500 5.505 5.463 5.522 0.022 13 0 "[ . 1 . 2]" 1
946 1 30 ASN HD22 1 38 LEU HA . . 5.500 5.464 5.302 5.506 0.006 3 0 "[ . 1 . 2]" 1
947 1 30 ASN HD22 1 38 LEU MD2 . . 4.700 4.432 4.283 4.528 . 0 0 "[ . 1 . 2]" 1
948 1 30 ASN HD22 1 41 MET ME . . 3.770 2.653 2.282 2.853 . 0 0 "[ . 1 . 2]" 1
949 1 31 PRO HA 1 32 ASP H . . 3.530 3.365 3.356 3.372 . 0 0 "[ . 1 . 2]" 1
950 1 31 PRO HA 1 33 LEU H . . 4.730 4.172 4.122 4.225 . 0 0 "[ . 1 . 2]" 1
951 1 31 PRO HA 1 38 LEU MD2 . . 5.500 5.517 5.509 5.535 0.035 9 0 "[ . 1 . 2]" 1
952 1 31 PRO HB2 1 32 ASP H . . 4.090 3.839 3.824 3.859 . 0 0 "[ . 1 . 2]" 1
953 1 31 PRO HB2 1 32 ASP QB . . 5.340 4.701 4.392 4.904 . 0 0 "[ . 1 . 2]" 1
954 1 31 PRO HB2 1 33 LEU H . . 5.500 5.487 5.453 5.519 0.019 12 0 "[ . 1 . 2]" 1
955 1 31 PRO HB3 1 32 ASP H . . 4.430 4.433 4.425 4.445 0.015 16 0 "[ . 1 . 2]" 1
956 1 31 PRO HD2 1 32 ASP H . . 3.710 2.880 2.865 2.901 . 0 0 "[ . 1 . 2]" 1
957 1 31 PRO HD2 1 32 ASP QB . . 4.460 4.007 3.994 4.042 . 0 0 "[ . 1 . 2]" 1
958 1 31 PRO HD3 1 32 ASP H . . 4.160 3.965 3.958 3.977 . 0 0 "[ . 1 . 2]" 1
959 1 31 PRO HG2 1 32 ASP H . . 4.110 3.117 3.091 3.152 . 0 0 "[ . 1 . 2]" 1
960 1 31 PRO HG2 1 32 ASP HB2 . . 5.350 3.734 3.460 3.902 . 0 0 "[ . 1 . 2]" 1
961 1 31 PRO HG2 1 32 ASP QB . . 4.650 3.651 3.391 3.817 . 0 0 "[ . 1 . 2]" 1
962 1 31 PRO HG2 1 32 ASP HB3 . . 5.350 5.158 4.684 5.402 0.052 18 0 "[ . 1 . 2]" 1
963 1 31 PRO HG3 1 32 ASP H . . 4.480 4.442 4.423 4.470 . 0 0 "[ . 1 . 2]" 1
964 1 32 ASP H 1 32 ASP HB2 . . 3.580 2.468 2.325 2.767 . 0 0 "[ . 1 . 2]" 1
965 1 32 ASP H 1 32 ASP QB . . 2.900 2.353 2.295 2.442 . 0 0 "[ . 1 . 2]" 1
966 1 32 ASP H 1 32 ASP HB3 . . 3.580 3.243 2.714 3.535 . 0 0 "[ . 1 . 2]" 1
967 1 32 ASP H 1 33 LEU H . . 2.970 2.012 1.996 2.029 . 0 0 "[ . 1 . 2]" 1
968 1 32 ASP H 1 33 LEU HA . . 4.830 4.700 4.686 4.709 . 0 0 "[ . 1 . 2]" 1
969 1 32 ASP H 1 33 LEU HB2 . . 4.630 4.076 4.049 4.104 . 0 0 "[ . 1 . 2]" 1
970 1 32 ASP H 1 33 LEU HB3 . . 5.500 5.521 5.502 5.535 0.035 5 0 "[ . 1 . 2]" 1
971 1 32 ASP H 1 33 LEU MD2 . . 4.870 4.765 4.713 4.863 . 0 0 "[ . 1 . 2]" 1
972 1 32 ASP H 1 33 LEU HG . . 4.960 3.899 3.825 3.950 . 0 0 "[ . 1 . 2]" 1
973 1 32 ASP QB 1 33 LEU H . . 3.750 3.097 3.040 3.150 . 0 0 "[ . 1 . 2]" 1
974 1 32 ASP QB 1 33 LEU HA . . 5.340 4.037 3.988 4.150 . 0 0 "[ . 1 . 2]" 1
975 1 32 ASP QB 1 33 LEU MD2 . . 3.800 3.596 3.435 3.694 . 0 0 "[ . 1 . 2]" 1
976 1 32 ASP QB 1 33 LEU HG . . 4.340 3.685 3.509 3.793 . 0 0 "[ . 1 . 2]" 1
977 1 32 ASP HB2 1 33 LEU H . . 4.330 3.579 3.278 4.044 . 0 0 "[ . 1 . 2]" 1
978 1 32 ASP HB3 1 33 LEU H . . 4.330 3.543 3.165 3.809 . 0 0 "[ . 1 . 2]" 1
979 1 33 LEU H 1 33 LEU HB2 . . 2.920 2.344 2.328 2.370 . 0 0 "[ . 1 . 2]" 1
980 1 33 LEU H 1 33 LEU HB3 . . 3.610 3.588 3.582 3.599 . 0 0 "[ . 1 . 2]" 1
981 1 33 LEU H 1 33 LEU MD1 . . 4.140 3.918 3.787 3.990 . 0 0 "[ . 1 . 2]" 1
982 1 33 LEU H 1 33 LEU MD2 . . 3.600 3.571 3.522 3.635 0.035 12 0 "[ . 1 . 2]" 1
983 1 33 LEU H 1 33 LEU HG . . 3.350 2.757 2.643 2.834 . 0 0 "[ . 1 . 2]" 1
984 1 33 LEU H 1 34 HIS H . . 4.670 4.595 4.588 4.602 . 0 0 "[ . 1 . 2]" 1
985 1 33 LEU H 1 37 GLU QG . . 5.500 5.435 5.363 5.506 0.006 12 0 "[ . 1 . 2]" 1
986 1 33 LEU H 1 38 LEU MD2 . . 4.760 4.214 4.099 4.280 . 0 0 "[ . 1 . 2]" 1
987 1 33 LEU HA 1 33 LEU MD1 . . 3.810 3.801 3.771 3.849 0.039 12 0 "[ . 1 . 2]" 1
988 1 33 LEU HA 1 33 LEU MD2 . . 2.760 1.952 1.925 2.040 . 0 0 "[ . 1 . 2]" 1
989 1 33 LEU HA 1 34 HIS H . . 2.890 2.328 2.275 2.375 . 0 0 "[ . 1 . 2]" 1
990 1 33 LEU HA 1 34 HIS HA . . 4.570 4.408 4.388 4.420 . 0 0 "[ . 1 . 2]" 1
991 1 33 LEU HA 1 34 HIS HB3 . . 4.690 4.487 4.390 4.520 . 0 0 "[ . 1 . 2]" 1
992 1 33 LEU HA 1 34 HIS HD2 . . 4.840 3.273 3.153 3.418 . 0 0 "[ . 1 . 2]" 1
993 1 33 LEU HA 1 37 GLU HB2 . . 4.470 3.554 3.398 3.604 . 0 0 "[ . 1 . 2]" 1
994 1 33 LEU HA 1 37 GLU HB3 . . 4.210 4.148 3.881 4.232 0.022 12 0 "[ . 1 . 2]" 1
995 1 33 LEU HA 1 37 GLU QG . . 4.480 2.891 2.804 3.166 . 0 0 "[ . 1 . 2]" 1
996 1 33 LEU HB2 1 33 LEU MD1 . . 3.090 2.320 2.235 2.377 . 0 0 "[ . 1 . 2]" 1
997 1 33 LEU HB2 1 34 HIS H . . 4.160 3.848 3.753 3.948 . 0 0 "[ . 1 . 2]" 1
998 1 33 LEU HB2 1 34 HIS HA . . 5.450 4.877 4.835 4.940 . 0 0 "[ . 1 . 2]" 1
999 1 33 LEU HB2 1 37 GLU HB2 . . 4.270 3.757 3.684 3.824 . 0 0 "[ . 1 . 2]" 1
1000 1 33 LEU HB2 1 37 GLU HB3 . . 5.080 4.010 3.818 4.231 . 0 0 "[ . 1 . 2]" 1
1001 1 33 LEU HB2 1 37 GLU QG . . 5.120 4.513 4.403 4.588 . 0 0 "[ . 1 . 2]" 1
1002 1 33 LEU HB2 1 38 LEU H . . 5.420 5.075 5.009 5.122 . 0 0 "[ . 1 . 2]" 1
1003 1 33 LEU HB2 1 38 LEU MD2 . . 3.410 2.639 2.522 2.694 . 0 0 "[ . 1 . 2]" 1
1004 1 33 LEU HB2 1 41 MET ME . . 5.240 3.756 3.491 3.970 . 0 0 "[ . 1 . 2]" 1
1005 1 33 LEU HB3 1 33 LEU MD1 . . 3.050 2.362 2.320 2.430 . 0 0 "[ . 1 . 2]" 1
1006 1 33 LEU HB3 1 33 LEU MD2 . . 2.930 2.386 2.348 2.414 . 0 0 "[ . 1 . 2]" 1
1007 1 33 LEU HB3 1 34 HIS H . . 3.860 2.601 2.477 2.748 . 0 0 "[ . 1 . 2]" 1
1008 1 33 LEU HB3 1 34 HIS HA . . 5.220 4.426 4.378 4.504 . 0 0 "[ . 1 . 2]" 1
1009 1 33 LEU HB3 1 37 GLU H . . 5.500 4.362 4.304 4.443 . 0 0 "[ . 1 . 2]" 1
1010 1 33 LEU HB3 1 37 GLU HB2 . . 3.920 2.046 1.996 2.110 . 0 0 "[ . 1 . 2]" 1
1011 1 33 LEU HB3 1 37 GLU HB3 . . 3.950 2.438 2.232 2.623 . 0 0 "[ . 1 . 2]" 1
1012 1 33 LEU HB3 1 37 GLU QG . . 4.440 3.021 2.883 3.136 . 0 0 "[ . 1 . 2]" 1
1013 1 33 LEU HB3 1 38 LEU H . . 4.860 3.868 3.821 3.918 . 0 0 "[ . 1 . 2]" 1
1014 1 33 LEU HB3 1 38 LEU MD2 . . 2.950 2.541 2.381 2.715 . 0 0 "[ . 1 . 2]" 1
1015 1 33 LEU MD1 1 34 HIS H . . 5.090 4.392 4.277 4.588 . 0 0 "[ . 1 . 2]" 1
1016 1 33 LEU MD1 1 37 GLU HA . . 4.810 4.271 4.014 4.646 . 0 0 "[ . 1 . 2]" 1
1017 1 33 LEU MD1 1 37 GLU HB2 . . 3.980 3.322 3.234 3.551 . 0 0 "[ . 1 . 2]" 1
1018 1 33 LEU MD1 1 37 GLU HB3 . . 3.670 2.192 1.972 2.574 . 0 0 "[ . 1 . 2]" 1
1019 1 33 LEU MD1 1 37 GLU QG . . 3.640 3.647 3.591 3.660 0.020 14 0 "[ . 1 . 2]" 1
1020 1 33 LEU MD1 1 41 MET ME . . 2.520 2.053 1.851 2.272 . 0 0 "[ . 1 . 2]" 1
1021 1 33 LEU MD2 1 34 HIS H . . 3.800 3.010 2.945 3.180 . 0 0 "[ . 1 . 2]" 1
1022 1 33 LEU MD2 1 34 HIS HB3 . . 5.500 5.475 5.347 5.527 0.027 12 0 "[ . 1 . 2]" 1
1023 1 33 LEU MD2 1 37 GLU H . . 4.860 4.764 4.668 4.889 0.029 14 0 "[ . 1 . 2]" 1
1024 1 33 LEU MD2 1 37 GLU HB2 . . 3.680 2.950 2.836 3.040 . 0 0 "[ . 1 . 2]" 1
1025 1 33 LEU MD2 1 37 GLU HB3 . . 3.120 2.523 2.244 2.648 . 0 0 "[ . 1 . 2]" 1
1026 1 33 LEU MD2 1 37 GLU QG . . 3.330 1.952 1.906 1.963 . 0 0 "[ . 1 . 2]" 1
1027 1 33 LEU MD2 1 38 LEU H . . 5.350 5.145 5.035 5.218 . 0 0 "[ . 1 . 2]" 1
1028 1 33 LEU HG 1 34 HIS H . . 5.500 4.906 4.851 4.966 . 0 0 "[ . 1 . 2]" 1
1029 1 33 LEU HG 1 37 GLU QG . . 5.500 4.629 4.516 4.707 . 0 0 "[ . 1 . 2]" 1
1030 1 34 HIS H 1 34 HIS HB2 . . 3.740 3.733 3.702 3.778 0.038 13 0 "[ . 1 . 2]" 1
1031 1 34 HIS H 1 34 HIS HB3 . . 3.200 3.147 3.065 3.179 . 0 0 "[ . 1 . 2]" 1
1032 1 34 HIS H 1 34 HIS HD2 . . 4.530 2.515 2.337 2.702 . 0 0 "[ . 1 . 2]" 1
1033 1 34 HIS H 1 37 GLU H . . 4.700 3.322 3.214 3.474 . 0 0 "[ . 1 . 2]" 1
1034 1 34 HIS H 1 37 GLU HB2 . . 4.250 2.193 1.921 2.431 . 0 0 "[ . 1 . 2]" 1
1035 1 34 HIS H 1 37 GLU HB3 . . 4.520 3.628 3.366 3.794 . 0 0 "[ . 1 . 2]" 1
1036 1 34 HIS H 1 37 GLU QG . . 4.320 2.249 2.132 2.389 . 0 0 "[ . 1 . 2]" 1
1037 1 34 HIS H 1 38 LEU H . . 4.830 4.141 4.017 4.283 . 0 0 "[ . 1 . 2]" 1
1038 1 34 HIS H 1 38 LEU MD2 . . 5.000 3.853 3.702 3.976 . 0 0 "[ . 1 . 2]" 1
1039 1 34 HIS H 1 38 LEU HG . . 5.500 4.274 4.168 4.383 . 0 0 "[ . 1 . 2]" 1
1040 1 34 HIS HA 1 34 HIS HD2 . . 4.470 4.375 4.324 4.434 . 0 0 "[ . 1 . 2]" 1
1041 1 34 HIS HB2 1 35 ASN QB . . 4.860 3.760 3.567 4.447 . 0 0 "[ . 1 . 2]" 1
1042 1 34 HIS HB2 1 36 ALA MB . . 4.380 4.289 4.167 4.531 0.151 16 0 "[ . 1 . 2]" 1
1043 1 34 HIS HB2 1 37 GLU H . . 4.410 4.369 4.330 4.453 0.043 13 0 "[ . 1 . 2]" 1
1044 1 34 HIS HB2 1 37 GLU HB2 . . 5.500 5.149 5.048 5.247 . 0 0 "[ . 1 . 2]" 1
1045 1 34 HIS HB2 1 37 GLU QG . . 4.970 4.910 4.644 4.979 0.009 4 0 "[ . 1 . 2]" 1
1046 1 34 HIS HB2 1 38 LEU H . . 5.500 5.512 5.494 5.533 0.033 12 0 "[ . 1 . 2]" 1
1047 1 34 HIS HB3 1 34 HIS HD2 . . 3.580 2.883 2.836 2.918 . 0 0 "[ . 1 . 2]" 1
1048 1 34 HIS HB3 1 36 ALA MB . . 5.280 5.204 5.128 5.304 0.024 16 0 "[ . 1 . 2]" 1
1049 1 34 HIS HB3 1 37 GLU H . . 5.110 5.071 4.981 5.129 0.019 9 0 "[ . 1 . 2]" 1
1050 1 34 HIS HB3 1 37 GLU HB2 . . 5.500 5.118 4.856 5.235 . 0 0 "[ . 1 . 2]" 1
1051 1 34 HIS HB3 1 37 GLU QG . . 4.750 4.643 4.479 4.731 . 0 0 "[ . 1 . 2]" 1
1052 1 34 HIS HD2 1 36 ALA MB . . 5.050 4.772 4.591 4.873 . 0 0 "[ . 1 . 2]" 1
1053 1 34 HIS HE1 1 35 ASN QB . . 5.500 5.518 5.460 5.663 0.163 16 0 "[ . 1 . 2]" 1
1054 1 34 HIS HE1 1 36 ALA MB . . 3.460 1.867 1.754 1.926 . 0 0 "[ . 1 . 2]" 1
1055 1 34 HIS HE1 1 37 GLU H . . 4.540 3.933 3.784 4.021 . 0 0 "[ . 1 . 2]" 1
1056 1 34 HIS HE1 1 37 GLU HB2 . . 5.500 5.481 5.342 5.520 0.020 13 0 "[ . 1 . 2]" 1
1057 1 34 HIS HE1 1 37 GLU QG . . 4.770 3.511 3.249 3.782 . 0 0 "[ . 1 . 2]" 1
1058 1 35 ASN HA 1 37 GLU H . . 4.860 4.112 4.002 4.208 . 0 0 "[ . 1 . 2]" 1
1059 1 35 ASN HA 1 38 LEU H . . 3.550 3.155 3.098 3.195 . 0 0 "[ . 1 . 2]" 1
1060 1 35 ASN HA 1 38 LEU HB2 . . 3.420 2.574 2.541 2.607 . 0 0 "[ . 1 . 2]" 1
1061 1 35 ASN HA 1 38 LEU HB3 . . 4.060 4.058 4.024 4.081 0.021 9 0 "[ . 1 . 2]" 1
1062 1 35 ASN HA 1 38 LEU MD1 . . 3.290 2.413 2.162 2.616 . 0 0 "[ . 1 . 2]" 1
1063 1 35 ASN HA 1 38 LEU HG . . 3.610 2.325 2.232 2.425 . 0 0 "[ . 1 . 2]" 1
1064 1 35 ASN HA 1 39 SER H . . 4.350 3.569 3.500 3.670 . 0 0 "[ . 1 . 2]" 1
1065 1 35 ASN QB 1 36 ALA HA . . 4.640 3.741 3.685 3.828 . 0 0 "[ . 1 . 2]" 1
1066 1 35 ASN QB 1 36 ALA MB . . 4.240 3.609 3.535 3.903 . 0 0 "[ . 1 . 2]" 1
1067 1 35 ASN QB 1 38 LEU H . . 4.830 4.623 4.552 4.709 . 0 0 "[ . 1 . 2]" 1
1068 1 35 ASN QB 1 38 LEU HB2 . . 4.840 4.396 4.148 4.640 . 0 0 "[ . 1 . 2]" 1
1069 1 35 ASN QB 1 38 LEU MD1 . . 4.440 3.871 3.585 4.076 . 0 0 "[ . 1 . 2]" 1
1070 1 35 ASN QB 1 39 SER H . . 4.830 4.461 4.173 4.831 0.001 3 0 "[ . 1 . 2]" 1
1071 1 36 ALA HA 1 38 LEU H . . 4.900 4.714 4.573 4.768 . 0 0 "[ . 1 . 2]" 1
1072 1 36 ALA HA 1 39 SER H . . 4.110 3.990 3.881 4.045 . 0 0 "[ . 1 . 2]" 1
1073 1 36 ALA HA 1 39 SER HB2 . . 3.480 3.285 3.134 3.372 . 0 0 "[ . 1 . 2]" 1
1074 1 36 ALA MB 1 37 GLU H . . 3.360 2.662 2.571 2.775 . 0 0 "[ . 1 . 2]" 1
1075 1 36 ALA MB 1 37 GLU HB2 . . 4.750 4.459 4.391 4.609 . 0 0 "[ . 1 . 2]" 1
1076 1 36 ALA MB 1 37 GLU HB3 . . 5.210 5.181 5.166 5.207 . 0 0 "[ . 1 . 2]" 1
1077 1 36 ALA MB 1 37 GLU QG . . 3.800 3.031 2.956 3.381 . 0 0 "[ . 1 . 2]" 1
1078 1 36 ALA MB 1 38 LEU H . . 4.750 4.600 4.531 4.649 . 0 0 "[ . 1 . 2]" 1
1079 1 36 ALA MB 1 39 SER H . . 5.060 4.981 4.917 5.026 . 0 0 "[ . 1 . 2]" 1
1080 1 36 ALA MB 1 39 SER HB2 . . 5.050 4.773 4.639 4.847 . 0 0 "[ . 1 . 2]" 1
1081 1 36 ALA MB 1 39 SER HB3 . . 5.360 5.040 4.971 5.096 . 0 0 "[ . 1 . 2]" 1
1082 1 36 ALA MB 1 40 LYS QE . . 4.980 4.839 4.096 4.985 0.005 10 0 "[ . 1 . 2]" 1
1083 1 37 GLU H 1 37 GLU HB2 . . 3.170 2.385 2.344 2.471 . 0 0 "[ . 1 . 2]" 1
1084 1 37 GLU H 1 37 GLU HB3 . . 3.640 3.592 3.580 3.617 . 0 0 "[ . 1 . 2]" 1
1085 1 37 GLU H 1 37 GLU QG . . 3.360 2.529 2.341 2.627 . 0 0 "[ . 1 . 2]" 1
1086 1 37 GLU H 1 38 LEU H . . 2.930 2.476 2.434 2.500 . 0 0 "[ . 1 . 2]" 1
1087 1 37 GLU H 1 38 LEU HB2 . . 4.990 4.882 4.840 4.907 . 0 0 "[ . 1 . 2]" 1
1088 1 37 GLU H 1 38 LEU MD2 . . 4.600 4.268 4.177 4.326 . 0 0 "[ . 1 . 2]" 1
1089 1 37 GLU H 1 38 LEU HG . . 5.500 3.756 3.698 3.867 . 0 0 "[ . 1 . 2]" 1
1090 1 37 GLU H 1 39 SER H . . 4.500 4.137 3.984 4.193 . 0 0 "[ . 1 . 2]" 1
1091 1 37 GLU HA 1 37 GLU HB3 . . 2.980 2.521 2.470 2.546 . 0 0 "[ . 1 . 2]" 1
1092 1 37 GLU HA 1 37 GLU QG . . 3.080 2.629 2.561 3.059 . 0 0 "[ . 1 . 2]" 1
1093 1 37 GLU HA 1 39 SER H . . 5.040 4.602 4.447 4.697 . 0 0 "[ . 1 . 2]" 1
1094 1 37 GLU HA 1 40 LYS QE . . 4.330 4.061 2.594 4.342 0.012 5 0 "[ . 1 . 2]" 1
1095 1 37 GLU HA 1 41 MET HG3 . . 5.500 5.465 5.290 5.525 0.025 5 0 "[ . 1 . 2]" 1
1096 1 37 GLU HB2 1 37 GLU QG . . 2.640 2.143 2.140 2.160 . 0 0 "[ . 1 . 2]" 1
1097 1 37 GLU HB2 1 38 LEU H . . 3.300 2.609 2.566 2.705 . 0 0 "[ . 1 . 2]" 1
1098 1 37 GLU HB2 1 38 LEU HG . . 4.650 3.592 3.503 3.691 . 0 0 "[ . 1 . 2]" 1
1099 1 37 GLU HB2 1 39 SER H . . 5.500 5.178 5.050 5.235 . 0 0 "[ . 1 . 2]" 1
1100 1 37 GLU HB3 1 37 GLU QG . . 2.780 2.448 2.218 2.470 . 0 0 "[ . 1 . 2]" 1
1101 1 37 GLU HB3 1 38 LEU H . . 3.690 3.545 3.490 3.631 . 0 0 "[ . 1 . 2]" 1
1102 1 37 GLU QG 1 38 LEU H . . 4.210 4.097 3.985 4.159 . 0 0 "[ . 1 . 2]" 1
1103 1 37 GLU QG 1 38 LEU MD2 . . 4.900 4.466 4.310 4.544 . 0 0 "[ . 1 . 2]" 1
1104 1 37 GLU QG 1 40 LYS QE . . 5.500 5.318 4.128 5.517 0.017 4 0 "[ . 1 . 2]" 1
1105 1 38 LEU H 1 38 LEU HB2 . . 2.920 2.739 2.675 2.763 . 0 0 "[ . 1 . 2]" 1
1106 1 38 LEU H 1 38 LEU MD1 . . 4.850 3.618 3.568 3.698 . 0 0 "[ . 1 . 2]" 1
1107 1 38 LEU H 1 38 LEU MD2 . . 3.380 2.558 2.493 2.622 . 0 0 "[ . 1 . 2]" 1
1108 1 38 LEU H 1 38 LEU HG . . 3.030 1.965 1.903 2.082 . 0 0 "[ . 1 . 2]" 1
1109 1 38 LEU H 1 39 SER H . . 3.140 2.764 2.710 2.805 . 0 0 "[ . 1 . 2]" 1
1110 1 38 LEU H 1 39 SER HB2 . . 4.680 4.655 4.583 4.696 0.016 17 0 "[ . 1 . 2]" 1
1111 1 38 LEU H 1 41 MET ME . . 4.390 3.681 3.563 3.963 . 0 0 "[ . 1 . 2]" 1
1112 1 38 LEU HA 1 38 LEU MD2 . . 2.920 2.261 2.205 2.294 . 0 0 "[ . 1 . 2]" 1
1113 1 38 LEU HA 1 38 LEU HG . . 3.560 3.424 3.401 3.452 . 0 0 "[ . 1 . 2]" 1
1114 1 38 LEU HA 1 40 LYS H . . 4.940 4.627 4.543 4.900 . 0 0 "[ . 1 . 2]" 1
1115 1 38 LEU HA 1 41 MET QB . . 3.690 3.573 3.103 3.695 0.005 20 0 "[ . 1 . 2]" 1
1116 1 38 LEU HA 1 41 MET ME . . 3.380 1.841 1.771 2.002 . 0 0 "[ . 1 . 2]" 1
1117 1 38 LEU HA 1 41 MET HG2 . . 5.220 4.954 4.643 5.102 . 0 0 "[ . 1 . 2]" 1
1118 1 38 LEU HA 1 41 MET HG3 . . 3.550 3.420 3.034 3.494 . 0 0 "[ . 1 . 2]" 1
1119 1 38 LEU HA 1 42 LEU H . . 4.820 4.569 4.371 4.646 . 0 0 "[ . 1 . 2]" 1
1120 1 38 LEU HB2 1 38 LEU MD1 . . 2.990 2.365 2.275 2.446 . 0 0 "[ . 1 . 2]" 1
1121 1 38 LEU HB2 1 38 LEU MD2 . . 3.310 3.191 3.185 3.194 . 0 0 "[ . 1 . 2]" 1
1122 1 38 LEU HB2 1 39 SER H . . 3.480 2.404 2.342 2.540 . 0 0 "[ . 1 . 2]" 1
1123 1 38 LEU HB2 1 39 SER HA . . 4.350 3.938 3.905 3.980 . 0 0 "[ . 1 . 2]" 1
1124 1 38 LEU HB2 1 39 SER HB2 . . 4.700 4.207 4.159 4.346 . 0 0 "[ . 1 . 2]" 1
1125 1 38 LEU HB2 1 39 SER HB3 . . 5.500 5.389 5.341 5.523 0.023 14 0 "[ . 1 . 2]" 1
1126 1 38 LEU HB2 1 41 MET QB . . 5.500 5.379 5.030 5.464 . 0 0 "[ . 1 . 2]" 1
1127 1 38 LEU HB3 1 38 LEU MD1 . . 3.310 2.266 2.199 2.389 . 0 0 "[ . 1 . 2]" 1
1128 1 38 LEU HB3 1 39 SER H . . 3.910 3.709 3.659 3.816 . 0 0 "[ . 1 . 2]" 1
1129 1 38 LEU HB3 1 39 SER HA . . 4.710 4.658 4.593 4.722 0.012 14 0 "[ . 1 . 2]" 1
1130 1 38 LEU HB3 1 41 MET H . . 5.500 5.065 5.009 5.199 . 0 0 "[ . 1 . 2]" 1
1131 1 38 LEU HB3 1 41 MET QB . . 4.580 4.405 4.058 4.512 . 0 0 "[ . 1 . 2]" 1
1132 1 38 LEU HB3 1 41 MET HG3 . . 5.370 5.365 5.039 5.422 0.052 5 0 "[ . 1 . 2]" 1
1133 1 38 LEU MD2 1 41 MET QB . . 5.290 4.710 4.367 4.837 . 0 0 "[ . 1 . 2]" 1
1134 1 38 LEU MD2 1 41 MET ME . . 3.740 2.276 1.986 2.686 . 0 0 "[ . 1 . 2]" 1
1135 1 38 LEU HG 1 39 SER H . . 4.150 3.848 3.802 3.934 . 0 0 "[ . 1 . 2]" 1
1136 1 39 SER H 1 39 SER HB2 . . 3.070 2.159 2.146 2.164 . 0 0 "[ . 1 . 2]" 1
1137 1 39 SER H 1 39 SER HB3 . . 3.530 3.061 3.049 3.094 . 0 0 "[ . 1 . 2]" 1
1138 1 39 SER H 1 40 LYS H . . 3.510 3.062 3.004 3.220 . 0 0 "[ . 1 . 2]" 1
1139 1 39 SER H 1 40 LYS QB . . 5.100 4.861 4.788 5.135 0.035 14 0 "[ . 1 . 2]" 1
1140 1 39 SER H 1 41 MET H . . 4.420 4.239 4.201 4.441 0.021 9 0 "[ . 1 . 2]" 1
1141 1 39 SER H 1 41 MET QB . . 5.440 5.442 5.108 5.502 0.062 7 0 "[ . 1 . 2]" 1
1142 1 39 SER H 1 42 LEU H . . 4.810 4.541 4.498 4.696 . 0 0 "[ . 1 . 2]" 1
1143 1 39 SER H 1 42 LEU HB2 . . 5.500 4.700 4.605 5.119 . 0 0 "[ . 1 . 2]" 1
1144 1 39 SER H 1 42 LEU MD1 . . 4.590 3.548 3.386 3.786 . 0 0 "[ . 1 . 2]" 1
1145 1 39 SER HA 1 39 SER HB2 . . 2.750 2.675 2.670 2.689 . 0 0 "[ . 1 . 2]" 1
1146 1 39 SER HA 1 40 LYS QG . . 5.340 5.355 5.042 5.429 0.089 6 0 "[ . 1 . 2]" 1
1147 1 39 SER HA 1 41 MET H . . 4.510 3.830 3.725 4.332 . 0 0 "[ . 1 . 2]" 1
1148 1 39 SER HA 1 42 LEU H . . 4.130 2.871 2.785 3.192 . 0 0 "[ . 1 . 2]" 1
1149 1 39 SER HA 1 42 LEU HB2 . . 3.760 2.094 1.994 2.543 . 0 0 "[ . 1 . 2]" 1
1150 1 39 SER HA 1 42 LEU HB3 . . 4.300 3.756 3.650 4.181 . 0 0 "[ . 1 . 2]" 1
1151 1 39 SER HA 1 42 LEU MD1 . . 3.260 2.289 2.068 2.478 . 0 0 "[ . 1 . 2]" 1
1152 1 39 SER HA 1 42 LEU MD2 . . 4.940 4.285 4.141 4.487 . 0 0 "[ . 1 . 2]" 1
1153 1 39 SER HA 1 42 LEU HG . . 4.490 2.952 2.688 3.226 . 0 0 "[ . 1 . 2]" 1
1154 1 39 SER HA 1 43 GLY H . . 5.000 3.851 3.715 4.266 . 0 0 "[ . 1 . 2]" 1
1155 1 39 SER HB2 1 40 LYS H . . 3.890 3.349 3.212 3.392 . 0 0 "[ . 1 . 2]" 1
1156 1 39 SER HB2 1 40 LYS QB . . 5.500 5.586 5.560 5.667 0.167 14 0 "[ . 1 . 2]" 1
1157 1 39 SER HB2 1 40 LYS QG . . 4.780 4.693 4.300 4.783 0.003 6 0 "[ . 1 . 2]" 1
1158 1 39 SER HB2 1 42 LEU H . . 5.500 5.280 5.210 5.521 0.021 12 0 "[ . 1 . 2]" 1
1159 1 39 SER HB2 1 42 LEU HB2 . . 5.220 4.651 4.540 5.149 . 0 0 "[ . 1 . 2]" 1
1160 1 39 SER HB2 1 42 LEU MD1 . . 4.140 3.898 3.729 4.121 . 0 0 "[ . 1 . 2]" 1
1161 1 39 SER HB3 1 40 LYS H . . 3.520 2.273 2.033 2.365 . 0 0 "[ . 1 . 2]" 1
1162 1 39 SER HB3 1 40 LYS QB . . 4.770 4.559 4.525 4.583 . 0 0 "[ . 1 . 2]" 1
1163 1 39 SER HB3 1 40 LYS QD . . 5.030 4.973 4.855 5.125 0.095 9 0 "[ . 1 . 2]" 1
1164 1 39 SER HB3 1 40 LYS QE . . 5.500 5.362 5.019 5.548 0.048 9 0 "[ . 1 . 2]" 1
1165 1 39 SER HB3 1 40 LYS QG . . 4.970 3.417 3.105 3.494 . 0 0 "[ . 1 . 2]" 1
1166 1 39 SER HB3 1 41 MET H . . 4.950 4.641 4.604 4.792 . 0 0 "[ . 1 . 2]" 1
1167 1 39 SER HB3 1 42 LEU H . . 5.320 4.962 4.882 5.145 . 0 0 "[ . 1 . 2]" 1
1168 1 39 SER HB3 1 42 LEU HB2 . . 5.050 4.732 4.618 5.054 0.004 14 0 "[ . 1 . 2]" 1
1169 1 39 SER HB3 1 42 LEU MD1 . . 4.840 4.743 4.580 4.830 . 0 0 "[ . 1 . 2]" 1
1170 1 40 LYS H 1 40 LYS QB . . 2.860 2.546 2.478 2.803 . 0 0 "[ . 1 . 2]" 1
1171 1 40 LYS H 1 40 LYS QD . . 4.760 3.922 3.873 3.994 . 0 0 "[ . 1 . 2]" 1
1172 1 40 LYS H 1 40 LYS QE . . 5.070 4.492 4.036 4.620 . 0 0 "[ . 1 . 2]" 1
1173 1 40 LYS H 1 40 LYS HG2 . . 4.050 2.229 2.117 2.354 . 0 0 "[ . 1 . 2]" 1
1174 1 40 LYS H 1 40 LYS QG . . 3.310 2.169 1.960 2.238 . 0 0 "[ . 1 . 2]" 1
1175 1 40 LYS H 1 40 LYS HG3 . . 4.050 3.144 2.263 3.312 . 0 0 "[ . 1 . 2]" 1
1176 1 40 LYS H 1 41 MET H . . 3.170 2.959 2.916 3.084 . 0 0 "[ . 1 . 2]" 1
1177 1 40 LYS H 1 41 MET QB . . 5.350 5.182 5.068 5.213 . 0 0 "[ . 1 . 2]" 1
1178 1 40 LYS H 1 41 MET HG3 . . 4.820 4.469 4.374 4.835 0.015 12 0 "[ . 1 . 2]" 1
1179 1 40 LYS H 1 42 LEU H . . 4.700 4.256 4.161 4.437 . 0 0 "[ . 1 . 2]" 1
1180 1 40 LYS HA 1 40 LYS QB . . 2.690 2.396 2.284 2.419 . 0 0 "[ . 1 . 2]" 1
1181 1 40 LYS HA 1 40 LYS QD . . 3.530 2.685 2.453 3.638 0.108 9 0 "[ . 1 . 2]" 1
1182 1 40 LYS HA 1 40 LYS QG . . 3.280 2.543 2.479 2.563 . 0 0 "[ . 1 . 2]" 1
1183 1 40 LYS QB 1 40 LYS QD . . 3.000 2.097 2.008 2.185 . 0 0 "[ . 1 . 2]" 1
1184 1 40 LYS QB 1 40 LYS QE . . 4.000 3.499 2.540 3.675 . 0 0 "[ . 1 . 2]" 1
1185 1 40 LYS QB 1 41 MET H . . 3.030 2.742 2.397 2.826 . 0 0 "[ . 1 . 2]" 1
1186 1 40 LYS QB 1 41 MET HG2 . . 5.500 3.906 3.847 3.994 . 0 0 "[ . 1 . 2]" 1
1187 1 40 LYS QB 1 41 MET HG3 . . 3.910 2.958 2.896 3.219 . 0 0 "[ . 1 . 2]" 1
1188 1 40 LYS QB 1 42 LEU H . . 5.020 4.715 4.604 4.801 . 0 0 "[ . 1 . 2]" 1
1189 1 40 LYS QD 1 41 MET H . . 5.340 5.101 4.972 5.126 . 0 0 "[ . 1 . 2]" 1
1190 1 40 LYS QD 1 41 MET HG3 . . 5.500 5.586 5.519 5.632 0.132 5 0 "[ . 1 . 2]" 1
1191 1 40 LYS QE 1 40 LYS HG2 . . 3.910 2.652 2.464 3.206 . 0 0 "[ . 1 . 2]" 1
1192 1 40 LYS QE 1 40 LYS QG . . 3.060 2.107 2.051 2.202 . 0 0 "[ . 1 . 2]" 1
1193 1 40 LYS QE 1 40 LYS HG3 . . 3.910 2.226 2.110 2.401 . 0 0 "[ . 1 . 2]" 1
1194 1 40 LYS QG 1 41 MET H . . 4.310 4.150 3.691 4.253 . 0 0 "[ . 1 . 2]" 1
1195 1 41 MET H 1 41 MET QB . . 2.770 2.559 2.433 2.587 . 0 0 "[ . 1 . 2]" 1
1196 1 41 MET H 1 41 MET ME . . 4.080 3.335 3.216 3.616 . 0 0 "[ . 1 . 2]" 1
1197 1 41 MET H 1 41 MET HG2 . . 3.500 3.501 3.289 3.542 0.042 13 0 "[ . 1 . 2]" 1
1198 1 41 MET H 1 41 MET HG3 . . 2.990 2.215 2.070 2.283 . 0 0 "[ . 1 . 2]" 1
1199 1 41 MET H 1 42 LEU H . . 3.150 2.288 2.194 2.630 . 0 0 "[ . 1 . 2]" 1
1200 1 41 MET H 1 42 LEU MD1 . . 5.500 4.911 4.754 5.154 . 0 0 "[ . 1 . 2]" 1
1201 1 41 MET H 1 42 LEU MD2 . . 5.500 5.061 4.845 5.372 . 0 0 "[ . 1 . 2]" 1
1202 1 41 MET H 1 42 LEU HG . . 4.810 4.000 3.905 4.304 . 0 0 "[ . 1 . 2]" 1
1203 1 41 MET H 1 44 LYS QE . . 5.300 4.472 4.154 4.816 . 0 0 "[ . 1 . 2]" 1
1204 1 41 MET H 1 44 LYS HG2 . . 5.500 4.683 4.596 4.771 . 0 0 "[ . 1 . 2]" 1
1205 1 41 MET HA 1 41 MET HG2 . . 3.120 2.721 2.490 2.776 . 0 0 "[ . 1 . 2]" 1
1206 1 41 MET HA 1 41 MET HG3 . . 3.510 3.132 3.086 3.201 . 0 0 "[ . 1 . 2]" 1
1207 1 41 MET HA 1 42 LEU H . . 3.560 3.518 3.496 3.549 . 0 0 "[ . 1 . 2]" 1
1208 1 41 MET HA 1 43 GLY H . . 3.990 3.925 3.829 3.983 . 0 0 "[ . 1 . 2]" 1
1209 1 41 MET HA 1 44 LYS QD . . 3.820 3.011 2.889 3.108 . 0 0 "[ . 1 . 2]" 1
1210 1 41 MET HA 1 44 LYS QE . . 3.660 2.100 1.981 2.259 . 0 0 "[ . 1 . 2]" 1
1211 1 41 MET HA 1 44 LYS HG2 . . 3.280 2.104 2.027 2.236 . 0 0 "[ . 1 . 2]" 1
1212 1 41 MET HA 1 44 LYS HG3 . . 4.110 3.627 3.446 3.762 . 0 0 "[ . 1 . 2]" 1
1213 1 41 MET QB 1 41 MET ME . . 3.070 3.078 2.994 3.111 0.041 11 0 "[ . 1 . 2]" 1
1214 1 41 MET QB 1 42 LEU H . . 3.210 2.654 2.464 2.765 . 0 0 "[ . 1 . 2]" 1
1215 1 41 MET QB 1 42 LEU HA . . 4.490 3.869 3.852 3.900 . 0 0 "[ . 1 . 2]" 1
1216 1 41 MET QB 1 42 LEU MD2 . . 4.830 3.678 3.497 3.811 . 0 0 "[ . 1 . 2]" 1
1217 1 41 MET QB 1 42 LEU HG . . 4.130 3.381 3.162 3.564 . 0 0 "[ . 1 . 2]" 1
1218 1 41 MET QB 1 44 LYS H . . 5.170 5.107 5.011 5.177 0.007 9 0 "[ . 1 . 2]" 1
1219 1 41 MET QB 1 44 LYS QD . . 4.410 3.894 3.497 4.250 . 0 0 "[ . 1 . 2]" 1
1220 1 41 MET QB 1 44 LYS HG2 . . 5.490 3.695 3.552 3.882 . 0 0 "[ . 1 . 2]" 1
1221 1 41 MET QB 1 45 SER H . . 5.060 4.906 4.676 5.069 0.009 9 0 "[ . 1 . 2]" 1
1222 1 41 MET ME 1 41 MET HG2 . . 3.110 3.118 3.103 3.138 0.028 12 0 "[ . 1 . 2]" 1
1223 1 41 MET ME 1 41 MET HG3 . . 3.350 2.022 1.987 2.155 . 0 0 "[ . 1 . 2]" 1
1224 1 41 MET ME 1 42 LEU H . . 4.930 4.686 4.586 4.929 . 0 0 "[ . 1 . 2]" 1
1225 1 41 MET ME 1 42 LEU MD2 . . 5.250 5.226 5.062 5.267 0.017 5 0 "[ . 1 . 2]" 1
1226 1 41 MET HG2 1 42 LEU H . . 4.980 4.961 4.873 5.001 0.021 3 0 "[ . 1 . 2]" 1
1227 1 41 MET HG2 1 44 LYS QD . . 4.230 4.123 3.945 4.233 0.003 8 0 "[ . 1 . 2]" 1
1228 1 41 MET HG2 1 44 LYS HG2 . . 4.790 4.603 4.471 4.713 . 0 0 "[ . 1 . 2]" 1
1229 1 41 MET HG3 1 42 LEU H . . 4.530 4.047 4.004 4.244 . 0 0 "[ . 1 . 2]" 1
1230 1 41 MET HG3 1 44 LYS QD . . 5.500 5.303 5.136 5.483 . 0 0 "[ . 1 . 2]" 1
1231 1 42 LEU H 1 42 LEU HB2 . . 3.420 2.465 2.428 2.527 . 0 0 "[ . 1 . 2]" 1
1232 1 42 LEU H 1 42 LEU HB3 . . 3.760 3.585 3.582 3.592 . 0 0 "[ . 1 . 2]" 1
1233 1 42 LEU H 1 42 LEU MD1 . . 3.690 3.576 3.411 3.708 0.018 7 0 "[ . 1 . 2]" 1
1234 1 42 LEU H 1 42 LEU MD2 . . 4.050 3.428 3.245 3.555 . 0 0 "[ . 1 . 2]" 1
1235 1 42 LEU H 1 42 LEU HG . . 3.150 2.290 2.163 2.384 . 0 0 "[ . 1 . 2]" 1
1236 1 42 LEU H 1 43 GLY H . . 3.390 2.577 2.496 2.635 . 0 0 "[ . 1 . 2]" 1
1237 1 42 LEU H 1 43 GLY HA3 . . 5.130 4.876 4.789 4.929 . 0 0 "[ . 1 . 2]" 1
1238 1 42 LEU H 1 44 LYS H . . 4.810 4.555 4.360 4.752 . 0 0 "[ . 1 . 2]" 1
1239 1 42 LEU HA 1 42 LEU MD1 . . 3.940 3.884 3.844 3.923 . 0 0 "[ . 1 . 2]" 1
1240 1 42 LEU HA 1 42 LEU MD2 . . 2.990 2.022 1.970 2.186 . 0 0 "[ . 1 . 2]" 1
1241 1 42 LEU HA 1 42 LEU HG . . 3.930 3.077 3.024 3.149 . 0 0 "[ . 1 . 2]" 1
1242 1 42 LEU HA 1 44 LYS H . . 5.170 4.916 4.757 5.053 . 0 0 "[ . 1 . 2]" 1
1243 1 42 LEU HA 1 45 SER H . . 3.950 3.866 3.791 3.925 . 0 0 "[ . 1 . 2]" 1
1244 1 42 LEU HB2 1 42 LEU MD1 . . 3.140 2.277 2.172 2.364 . 0 0 "[ . 1 . 2]" 1
1245 1 42 LEU HB2 1 42 LEU MD2 . . 3.560 3.180 3.171 3.195 . 0 0 "[ . 1 . 2]" 1
1246 1 42 LEU HB2 1 43 GLY H . . 3.400 2.989 2.902 3.073 . 0 0 "[ . 1 . 2]" 1
1247 1 42 LEU HB2 1 43 GLY HA2 . . 5.270 4.387 4.314 4.443 . 0 0 "[ . 1 . 2]" 1
1248 1 42 LEU HB2 1 43 GLY HA3 . . 4.880 4.659 4.615 4.698 . 0 0 "[ . 1 . 2]" 1
1249 1 42 LEU HB3 1 42 LEU MD2 . . 3.320 2.329 2.258 2.396 . 0 0 "[ . 1 . 2]" 1
1250 1 42 LEU HB3 1 43 GLY H . . 4.090 3.936 3.856 4.001 . 0 0 "[ . 1 . 2]" 1
1251 1 42 LEU MD1 1 43 GLY H . . 5.060 4.775 4.683 4.846 . 0 0 "[ . 1 . 2]" 1
1252 1 42 LEU MD2 1 43 GLY H . . 4.870 4.738 4.663 4.804 . 0 0 "[ . 1 . 2]" 1
1253 1 42 LEU MD2 1 45 SER H . . 5.500 5.354 5.247 5.460 . 0 0 "[ . 1 . 2]" 1
1254 1 42 LEU MD2 1 45 SER HB2 . . 4.840 4.158 4.039 4.263 . 0 0 "[ . 1 . 2]" 1
1255 1 42 LEU MD2 1 45 SER HB3 . . 5.140 5.089 4.970 5.151 0.011 5 0 "[ . 1 . 2]" 1
1256 1 42 LEU MD2 1 46 TRP H . . 5.500 5.481 5.413 5.503 0.003 3 0 "[ . 1 . 2]" 1
1257 1 42 LEU HG 1 43 GLY H . . 5.500 4.472 4.397 4.539 . 0 0 "[ . 1 . 2]" 1
1258 1 43 GLY H 1 43 GLY HA3 . . 2.880 2.318 2.309 2.329 . 0 0 "[ . 1 . 2]" 1
1259 1 43 GLY H 1 44 LYS H . . 3.180 2.609 2.474 2.710 . 0 0 "[ . 1 . 2]" 1
1260 1 43 GLY H 1 44 LYS QB . . 4.880 4.697 4.568 4.837 . 0 0 "[ . 1 . 2]" 1
1261 1 43 GLY H 1 44 LYS QE . . 5.500 5.149 4.881 5.455 . 0 0 "[ . 1 . 2]" 1
1262 1 43 GLY H 1 44 LYS HG2 . . 4.470 3.922 3.821 4.014 . 0 0 "[ . 1 . 2]" 1
1263 1 43 GLY H 1 45 SER H . . 4.470 3.882 3.793 4.014 . 0 0 "[ . 1 . 2]" 1
1264 1 43 GLY H 1 46 TRP H . . 5.040 4.471 4.421 4.520 . 0 0 "[ . 1 . 2]" 1
1265 1 43 GLY HA2 1 44 LYS QB . . 5.500 5.479 5.445 5.529 0.029 9 0 "[ . 1 . 2]" 1
1266 1 43 GLY HA2 1 45 SER H . . 4.870 4.254 4.153 4.370 . 0 0 "[ . 1 . 2]" 1
1267 1 43 GLY HA2 1 46 TRP H . . 4.390 3.256 3.199 3.365 . 0 0 "[ . 1 . 2]" 1
1268 1 43 GLY HA2 1 46 TRP HB2 . . 4.380 3.202 3.107 3.302 . 0 0 "[ . 1 . 2]" 1
1269 1 43 GLY HA2 1 46 TRP HB3 . . 4.160 2.491 2.382 2.582 . 0 0 "[ . 1 . 2]" 1
1270 1 43 GLY HA2 1 46 TRP HD1 . . 4.780 4.113 3.986 4.176 . 0 0 "[ . 1 . 2]" 1
1271 1 43 GLY HA2 1 47 LYS H . . 5.140 3.681 3.544 3.865 . 0 0 "[ . 1 . 2]" 1
1272 1 43 GLY HA3 1 44 LYS H . . 3.140 2.662 2.605 2.742 . 0 0 "[ . 1 . 2]" 1
1273 1 43 GLY HA3 1 44 LYS QB . . 4.730 4.629 4.578 4.699 . 0 0 "[ . 1 . 2]" 1
1274 1 43 GLY HA3 1 45 SER H . . 4.980 4.490 4.394 4.608 . 0 0 "[ . 1 . 2]" 1
1275 1 43 GLY HA3 1 46 TRP H . . 4.970 4.364 4.304 4.481 . 0 0 "[ . 1 . 2]" 1
1276 1 43 GLY HA3 1 46 TRP HB2 . . 5.100 4.917 4.828 5.002 . 0 0 "[ . 1 . 2]" 1
1277 1 43 GLY HA3 1 46 TRP HB3 . . 4.530 4.070 3.961 4.146 . 0 0 "[ . 1 . 2]" 1
1278 1 43 GLY HA3 1 46 TRP HD1 . . 5.500 5.466 5.310 5.503 0.003 20 0 "[ . 1 . 2]" 1
1279 1 44 LYS H 1 44 LYS QB . . 2.710 2.387 2.338 2.461 . 0 0 "[ . 1 . 2]" 1
1280 1 44 LYS H 1 44 LYS QD . . 4.300 4.143 3.884 4.305 0.005 11 0 "[ . 1 . 2]" 1
1281 1 44 LYS H 1 44 LYS QE . . 5.190 3.991 3.446 4.543 . 0 0 "[ . 1 . 2]" 1
1282 1 44 LYS H 1 44 LYS HG2 . . 3.950 2.361 2.236 2.466 . 0 0 "[ . 1 . 2]" 1
1283 1 44 LYS H 1 44 LYS HG3 . . 3.820 3.409 3.237 3.522 . 0 0 "[ . 1 . 2]" 1
1284 1 44 LYS H 1 45 SER H . . 3.120 2.764 2.679 2.843 . 0 0 "[ . 1 . 2]" 1
1285 1 44 LYS H 1 46 TRP H . . 4.770 4.046 3.972 4.102 . 0 0 "[ . 1 . 2]" 1
1286 1 44 LYS H 1 47 LYS H . . 5.350 5.195 5.106 5.266 . 0 0 "[ . 1 . 2]" 1
1287 1 44 LYS H 1 47 LYS QE . . 5.500 4.284 3.949 4.939 . 0 0 "[ . 1 . 2]" 1
1288 1 44 LYS HA 1 45 SER H . . 3.550 3.518 3.503 3.536 . 0 0 "[ . 1 . 2]" 1
1289 1 44 LYS HA 1 46 TRP H . . 5.290 4.292 4.223 4.357 . 0 0 "[ . 1 . 2]" 1
1290 1 44 LYS HA 1 47 LYS H . . 4.280 4.271 4.199 4.288 0.008 6 0 "[ . 1 . 2]" 1
1291 1 44 LYS HA 1 47 LYS QB . . 3.490 3.435 3.351 3.497 0.007 13 0 "[ . 1 . 2]" 1
1292 1 44 LYS HA 1 47 LYS QD . . 4.710 4.561 4.209 4.709 . 0 0 "[ . 1 . 2]" 1
1293 1 44 LYS HA 1 47 LYS QE . . 3.990 3.106 2.958 3.333 . 0 0 "[ . 1 . 2]" 1
1294 1 44 LYS HA 1 48 ALA H . . 5.040 4.352 4.188 4.525 . 0 0 "[ . 1 . 2]" 1
1295 1 44 LYS QB 1 44 LYS QD . . 3.230 2.178 2.110 2.271 . 0 0 "[ . 1 . 2]" 1
1296 1 44 LYS QB 1 44 LYS QE . . 4.120 2.907 2.066 3.644 . 0 0 "[ . 1 . 2]" 1
1297 1 44 LYS QB 1 45 SER H . . 3.580 3.449 3.370 3.497 . 0 0 "[ . 1 . 2]" 1
1298 1 44 LYS QB 1 46 TRP H . . 5.110 5.026 4.965 5.092 . 0 0 "[ . 1 . 2]" 1
1299 1 44 LYS QD 1 45 SER H . . 4.500 4.117 3.902 4.308 . 0 0 "[ . 1 . 2]" 1
1300 1 44 LYS QE 1 44 LYS HG2 . . 3.490 2.293 2.119 2.445 . 0 0 "[ . 1 . 2]" 1
1301 1 44 LYS QE 1 44 LYS HG3 . . 3.680 2.987 2.414 3.402 . 0 0 "[ . 1 . 2]" 1
1302 1 44 LYS QE 1 45 SER H . . 5.100 4.360 3.951 4.757 . 0 0 "[ . 1 . 2]" 1
1303 1 44 LYS HG2 1 45 SER H . . 4.140 2.618 2.434 2.842 . 0 0 "[ . 1 . 2]" 1
1304 1 44 LYS HG2 1 45 SER HB2 . . 5.080 4.239 4.068 4.465 . 0 0 "[ . 1 . 2]" 1
1305 1 44 LYS HG2 1 46 TRP H . . 5.500 4.908 4.774 5.071 . 0 0 "[ . 1 . 2]" 1
1306 1 44 LYS HG3 1 45 SER H . . 4.540 2.251 1.986 2.376 . 0 0 "[ . 1 . 2]" 1
1307 1 45 SER H 1 45 SER HB2 . . 3.060 2.277 2.234 2.314 . 0 0 "[ . 1 . 2]" 1
1308 1 45 SER H 1 45 SER HB3 . . 3.650 3.554 3.529 3.575 . 0 0 "[ . 1 . 2]" 1
1309 1 45 SER H 1 46 TRP HB2 . . 4.920 4.781 4.726 4.846 . 0 0 "[ . 1 . 2]" 1
1310 1 45 SER H 1 46 TRP HB3 . . 4.800 4.649 4.594 4.708 . 0 0 "[ . 1 . 2]" 1
1311 1 45 SER H 1 47 LYS QB . . 5.500 5.378 5.300 5.475 . 0 0 "[ . 1 . 2]" 1
1312 1 45 SER H 1 48 ALA MB . . 5.140 4.595 4.524 4.671 . 0 0 "[ . 1 . 2]" 1
1313 1 45 SER HA 1 46 TRP HA . . 5.200 4.768 4.742 4.781 . 0 0 "[ . 1 . 2]" 1
1314 1 45 SER HA 1 47 LYS H . . 5.360 5.263 5.209 5.329 . 0 0 "[ . 1 . 2]" 1
1315 1 45 SER HA 1 48 ALA H . . 4.120 3.827 3.761 3.907 . 0 0 "[ . 1 . 2]" 1
1316 1 45 SER HA 1 48 ALA MB . . 3.050 2.596 2.529 2.748 . 0 0 "[ . 1 . 2]" 1
1317 1 45 SER HB2 1 46 TRP H . . 4.280 2.967 2.900 3.043 . 0 0 "[ . 1 . 2]" 1
1318 1 45 SER HB2 1 46 TRP HA . . 5.500 4.584 4.516 4.645 . 0 0 "[ . 1 . 2]" 1
1319 1 45 SER HB2 1 46 TRP HB2 . . 5.130 4.631 4.549 4.696 . 0 0 "[ . 1 . 2]" 1
1320 1 45 SER HB2 1 48 ALA MB . . 5.500 5.018 4.959 5.129 . 0 0 "[ . 1 . 2]" 1
1321 1 45 SER HB3 1 46 TRP H . . 3.690 3.679 3.580 3.701 0.011 19 0 "[ . 1 . 2]" 1
1322 1 45 SER HB3 1 46 TRP HA . . 4.920 4.284 4.208 4.322 . 0 0 "[ . 1 . 2]" 1
1323 1 45 SER HB3 1 48 ALA MB . . 4.470 4.349 4.233 4.476 0.006 10 0 "[ . 1 . 2]" 1
1324 1 46 TRP H 1 46 TRP HB2 . . 3.110 2.601 2.556 2.639 . 0 0 "[ . 1 . 2]" 1
1325 1 46 TRP H 1 46 TRP HB3 . . 3.080 2.482 2.451 2.519 . 0 0 "[ . 1 . 2]" 1
1326 1 46 TRP H 1 46 TRP HD1 . . 5.210 4.991 4.962 5.030 . 0 0 "[ . 1 . 2]" 1
1327 1 46 TRP H 1 46 TRP HE3 . . 4.810 4.647 4.588 4.691 . 0 0 "[ . 1 . 2]" 1
1328 1 46 TRP H 1 47 LYS H . . 3.320 2.919 2.878 2.950 . 0 0 "[ . 1 . 2]" 1
1329 1 46 TRP H 1 47 LYS HA . . 5.500 5.412 5.373 5.438 . 0 0 "[ . 1 . 2]" 1
1330 1 46 TRP H 1 47 LYS QB . . 4.470 4.449 4.381 4.482 0.012 15 0 "[ . 1 . 2]" 1
1331 1 46 TRP H 1 47 LYS QE . . 5.500 4.724 4.358 5.512 0.012 1 0 "[ . 1 . 2]" 1
1332 1 46 TRP H 1 48 ALA H . . 4.950 3.823 3.749 3.901 . 0 0 "[ . 1 . 2]" 1
1333 1 46 TRP H 1 48 ALA MB . . 5.450 4.351 4.279 4.492 . 0 0 "[ . 1 . 2]" 1
1334 1 46 TRP H 1 49 LEU MD1 . . 5.330 4.577 4.440 5.013 . 0 0 "[ . 1 . 2]" 1
1335 1 46 TRP H 1 49 LEU HG . . 5.010 4.916 4.848 5.009 . 0 0 "[ . 1 . 2]" 1
1336 1 46 TRP HA 1 46 TRP HD1 . . 4.850 4.608 4.559 4.653 . 0 0 "[ . 1 . 2]" 1
1337 1 46 TRP HA 1 46 TRP HE3 . . 3.560 2.296 2.236 2.394 . 0 0 "[ . 1 . 2]" 1
1338 1 46 TRP HA 1 48 ALA H . . 5.060 4.143 3.939 4.285 . 0 0 "[ . 1 . 2]" 1
1339 1 46 TRP HA 1 48 ALA MB . . 4.940 4.554 4.453 4.689 . 0 0 "[ . 1 . 2]" 1
1340 1 46 TRP HA 1 49 LEU H . . 4.360 3.445 3.371 3.539 . 0 0 "[ . 1 . 2]" 1
1341 1 46 TRP HA 1 49 LEU QB . . 4.440 3.304 3.188 3.460 . 0 0 "[ . 1 . 2]" 1
1342 1 46 TRP HA 1 49 LEU MD1 . . 3.630 2.218 1.985 2.568 . 0 0 "[ . 1 . 2]" 1
1343 1 46 TRP HA 1 49 LEU MD2 . . 4.550 4.385 4.284 4.454 . 0 0 "[ . 1 . 2]" 1
1344 1 46 TRP HA 1 49 LEU HG . . 3.660 2.964 2.763 3.085 . 0 0 "[ . 1 . 2]" 1
1345 1 46 TRP HB2 1 46 TRP HD1 . . 3.700 3.619 3.599 3.649 . 0 0 "[ . 1 . 2]" 1
1346 1 46 TRP HB2 1 46 TRP HE3 . . 4.070 2.936 2.885 2.972 . 0 0 "[ . 1 . 2]" 1
1347 1 46 TRP HB2 1 47 LYS H . . 3.810 3.564 3.542 3.583 . 0 0 "[ . 1 . 2]" 1
1348 1 46 TRP HB2 1 47 LYS QB . . 5.500 5.530 5.515 5.553 0.053 9 0 "[ . 1 . 2]" 1
1349 1 46 TRP HB2 1 49 LEU MD1 . . 5.120 3.992 3.807 4.274 . 0 0 "[ . 1 . 2]" 1
1350 1 46 TRP HB2 1 49 LEU HG . . 5.490 5.368 5.178 5.486 . 0 0 "[ . 1 . 2]" 1
1351 1 46 TRP HB3 1 46 TRP HD1 . . 3.280 2.549 2.547 2.553 . 0 0 "[ . 1 . 2]" 1
1352 1 46 TRP HB3 1 46 TRP HE1 . . 4.840 4.751 4.750 4.753 . 0 0 "[ . 1 . 2]" 1
1353 1 46 TRP HB3 1 47 LYS H . . 3.550 2.027 2.005 2.056 . 0 0 "[ . 1 . 2]" 1
1354 1 46 TRP HB3 1 47 LYS HA . . 4.960 4.204 4.149 4.256 . 0 0 "[ . 1 . 2]" 1
1355 1 46 TRP HB3 1 47 LYS QB . . 4.490 4.040 4.019 4.073 . 0 0 "[ . 1 . 2]" 1
1356 1 46 TRP HB3 1 47 LYS QD . . 5.500 4.820 2.766 5.434 . 0 0 "[ . 1 . 2]" 1
1357 1 46 TRP HB3 1 47 LYS HG3 . . 5.320 4.053 3.847 4.846 . 0 0 "[ . 1 . 2]" 1
1358 1 46 TRP HD1 1 47 LYS H . . 3.880 3.195 3.142 3.257 . 0 0 "[ . 1 . 2]" 1
1359 1 46 TRP HD1 1 47 LYS HA . . 4.120 3.704 3.570 3.789 . 0 0 "[ . 1 . 2]" 1
1360 1 46 TRP HD1 1 47 LYS QB . . 4.670 4.505 4.432 4.589 . 0 0 "[ . 1 . 2]" 1
1361 1 46 TRP HD1 1 47 LYS HG2 . . 5.030 4.659 4.474 5.032 0.002 16 0 "[ . 1 . 2]" 1
1362 1 46 TRP HD1 1 47 LYS HG3 . . 3.970 3.118 2.916 3.715 . 0 0 "[ . 1 . 2]" 1
1363 1 46 TRP HE1 1 54 LYS QD . . 4.910 4.446 3.831 4.913 0.003 12 0 "[ . 1 . 2]" 1
1364 1 46 TRP HE1 1 54 LYS QE . . 4.970 2.968 2.651 3.440 . 0 0 "[ . 1 . 2]" 1
1365 1 46 TRP HE3 1 49 LEU MD1 . . 3.810 1.998 1.956 2.096 . 0 0 "[ . 1 . 2]" 1
1366 1 46 TRP HE3 1 49 LEU MD2 . . 4.710 4.692 4.523 4.722 0.012 11 0 "[ . 1 . 2]" 1
1367 1 46 TRP HH2 1 49 LEU MD1 . . 5.030 4.148 4.019 4.276 . 0 0 "[ . 1 . 2]" 1
1368 1 46 TRP HH2 1 54 LYS HA . . 4.220 3.123 2.960 3.254 . 0 0 "[ . 1 . 2]" 1
1369 1 46 TRP HH2 1 54 LYS QB . . 4.360 2.882 2.651 3.074 . 0 0 "[ . 1 . 2]" 1
1370 1 46 TRP HH2 1 54 LYS QD . . 4.630 4.279 3.779 4.635 0.005 12 0 "[ . 1 . 2]" 1
1371 1 46 TRP HH2 1 54 LYS HE2 . . 5.500 4.163 3.280 5.246 . 0 0 "[ . 1 . 2]" 1
1372 1 46 TRP HH2 1 54 LYS HE3 . . 5.500 4.379 3.671 5.499 . 0 0 "[ . 1 . 2]" 1
1373 1 46 TRP HH2 1 54 LYS HG2 . . 4.840 2.996 2.783 3.290 . 0 0 "[ . 1 . 2]" 1
1374 1 46 TRP HH2 1 57 PHE HB2 . . 3.830 2.410 2.152 2.526 . 0 0 "[ . 1 . 2]" 1
1375 1 46 TRP HH2 1 57 PHE HB3 . . 4.120 3.264 3.028 3.408 . 0 0 "[ . 1 . 2]" 1
1376 1 46 TRP HH2 1 57 PHE QD . . 4.270 3.520 3.247 3.699 . 0 0 "[ . 1 . 2]" 1
1377 1 46 TRP HH2 1 58 VAL H . . 4.930 4.891 4.754 4.939 0.009 10 0 "[ . 1 . 2]" 1
1378 1 46 TRP HH2 1 58 VAL MG2 . . 3.980 3.186 3.051 3.348 . 0 0 "[ . 1 . 2]" 1
1379 1 46 TRP HH2 1 61 ALA MB . . 5.500 5.489 5.374 5.507 0.007 6 0 "[ . 1 . 2]" 1
1380 1 46 TRP HZ2 1 54 LYS HA . . 5.100 4.916 4.659 5.097 . 0 0 "[ . 1 . 2]" 1
1381 1 46 TRP HZ2 1 54 LYS QB . . 4.950 3.353 3.165 3.527 . 0 0 "[ . 1 . 2]" 1
1382 1 46 TRP HZ2 1 54 LYS QD . . 4.180 3.547 2.859 4.179 . 0 0 "[ . 1 . 2]" 1
1383 1 46 TRP HZ2 1 54 LYS HE2 . . 5.330 2.913 2.001 3.766 . 0 0 "[ . 1 . 2]" 1
1384 1 46 TRP HZ2 1 54 LYS QE . . 4.570 2.712 1.948 3.326 . 0 0 "[ . 1 . 2]" 1
1385 1 46 TRP HZ2 1 54 LYS HE3 . . 5.330 3.554 2.550 4.995 . 0 0 "[ . 1 . 2]" 1
1386 1 46 TRP HZ2 1 54 LYS HG2 . . 5.010 3.569 3.273 3.835 . 0 0 "[ . 1 . 2]" 1
1387 1 46 TRP HZ2 1 57 PHE HB2 . . 4.890 4.755 4.431 4.893 0.003 13 0 "[ . 1 . 2]" 1
1388 1 46 TRP HZ2 1 58 VAL MG2 . . 4.080 3.472 3.332 3.537 . 0 0 "[ . 1 . 2]" 1
1389 1 46 TRP HZ3 1 49 LEU MD1 . . 4.230 2.600 2.488 2.705 . 0 0 "[ . 1 . 2]" 1
1390 1 46 TRP HZ3 1 49 LEU MD2 . . 5.160 4.936 4.755 5.014 . 0 0 "[ . 1 . 2]" 1
1391 1 46 TRP HZ3 1 54 LYS HA . . 4.580 3.797 3.661 3.919 . 0 0 "[ . 1 . 2]" 1
1392 1 46 TRP HZ3 1 54 LYS QB . . 5.500 4.546 4.345 4.727 . 0 0 "[ . 1 . 2]" 1
1393 1 46 TRP HZ3 1 57 PHE HB2 . . 4.810 3.221 3.110 3.324 . 0 0 "[ . 1 . 2]" 1
1394 1 46 TRP HZ3 1 57 PHE HB3 . . 5.280 3.612 3.461 3.755 . 0 0 "[ . 1 . 2]" 1
1395 1 46 TRP HZ3 1 57 PHE QD . . 4.210 3.006 2.919 3.118 . 0 0 "[ . 1 . 2]" 1
1396 1 47 LYS H 1 47 LYS QB . . 2.830 2.237 2.223 2.258 . 0 0 "[ . 1 . 2]" 1
1397 1 47 LYS H 1 47 LYS QD . . 4.290 3.729 2.075 4.210 . 0 0 "[ . 1 . 2]" 1
1398 1 47 LYS H 1 47 LYS QE . . 4.280 3.022 2.562 3.833 . 0 0 "[ . 1 . 2]" 1
1399 1 47 LYS H 1 47 LYS HG2 . . 4.260 4.071 3.996 4.154 . 0 0 "[ . 1 . 2]" 1
1400 1 47 LYS H 1 47 LYS HG3 . . 3.890 2.893 2.732 3.504 . 0 0 "[ . 1 . 2]" 1
1401 1 47 LYS H 1 48 ALA H . . 3.480 2.870 2.830 2.899 . 0 0 "[ . 1 . 2]" 1
1402 1 47 LYS H 1 48 ALA MB . . 4.490 4.497 4.482 4.513 0.023 5 0 "[ . 1 . 2]" 1
1403 1 47 LYS HA 1 47 LYS QB . . 2.780 2.494 2.492 2.495 . 0 0 "[ . 1 . 2]" 1
1404 1 47 LYS HA 1 47 LYS QD . . 4.120 3.915 3.086 4.084 . 0 0 "[ . 1 . 2]" 1
1405 1 47 LYS HA 1 47 LYS QE . . 5.060 4.148 3.982 4.303 . 0 0 "[ . 1 . 2]" 1
1406 1 47 LYS HA 1 47 LYS HG2 . . 3.400 2.819 2.620 3.459 0.059 16 0 "[ . 1 . 2]" 1
1407 1 47 LYS HA 1 47 LYS HG3 . . 3.420 2.408 2.152 2.533 . 0 0 "[ . 1 . 2]" 1
1408 1 47 LYS HA 1 48 ALA HA . . 4.990 4.815 4.774 4.842 . 0 0 "[ . 1 . 2]" 1
1409 1 47 LYS HA 1 48 ALA MB . . 5.270 5.001 4.988 5.008 . 0 0 "[ . 1 . 2]" 1
1410 1 47 LYS HA 1 49 LEU H . . 4.870 4.276 4.088 4.692 . 0 0 "[ . 1 . 2]" 1
1411 1 47 LYS QB 1 47 LYS QE . . 3.930 1.993 1.850 2.181 . 0 0 "[ . 1 . 2]" 1
1412 1 47 LYS QB 1 48 ALA H . . 3.530 2.790 2.710 2.885 . 0 0 "[ . 1 . 2]" 1
1413 1 47 LYS QB 1 48 ALA HA . . 4.220 3.858 3.828 3.898 . 0 0 "[ . 1 . 2]" 1
1414 1 47 LYS QB 1 48 ALA MB . . 4.130 3.985 3.904 4.013 . 0 0 "[ . 1 . 2]" 1
1415 1 47 LYS QD 1 48 ALA H . . 5.460 5.083 4.511 5.261 . 0 0 "[ . 1 . 2]" 1
1416 1 47 LYS QE 1 47 LYS HG3 . . 3.910 2.678 2.176 3.415 . 0 0 "[ . 1 . 2]" 1
1417 1 47 LYS QE 1 48 ALA MB . . 5.500 5.397 5.011 5.506 0.006 9 0 "[ . 1 . 2]" 1
1418 1 48 ALA H 1 48 ALA MB . . 2.630 2.187 2.115 2.232 . 0 0 "[ . 1 . 2]" 1
1419 1 48 ALA H 1 49 LEU H . . 3.400 2.685 2.572 2.756 . 0 0 "[ . 1 . 2]" 1
1420 1 48 ALA H 1 49 LEU QB . . 4.890 4.620 4.511 4.702 . 0 0 "[ . 1 . 2]" 1
1421 1 48 ALA H 1 49 LEU HG . . 4.710 4.487 4.338 4.577 . 0 0 "[ . 1 . 2]" 1
1422 1 48 ALA HA 1 49 LEU QB . . 5.500 5.357 5.333 5.404 . 0 0 "[ . 1 . 2]" 1
1423 1 48 ALA MB 1 49 LEU H . . 3.380 2.621 2.463 2.695 . 0 0 "[ . 1 . 2]" 1
1424 1 48 ALA MB 1 49 LEU MD2 . . 4.170 3.945 3.694 4.111 . 0 0 "[ . 1 . 2]" 1
1425 1 48 ALA MB 1 49 LEU HG . . 3.800 3.632 3.420 3.741 . 0 0 "[ . 1 . 2]" 1
1426 1 49 LEU H 1 49 LEU QB . . 3.150 2.402 2.351 2.485 . 0 0 "[ . 1 . 2]" 1
1427 1 49 LEU H 1 49 LEU MD1 . . 4.260 3.551 3.423 3.712 . 0 0 "[ . 1 . 2]" 1
1428 1 49 LEU H 1 49 LEU MD2 . . 3.700 3.463 3.235 3.566 . 0 0 "[ . 1 . 2]" 1
1429 1 49 LEU H 1 49 LEU HG . . 3.340 2.323 2.209 2.426 . 0 0 "[ . 1 . 2]" 1
1430 1 49 LEU H 1 50 THR H . . 4.750 4.642 4.632 4.646 . 0 0 "[ . 1 . 2]" 1
1431 1 49 LEU HA 1 49 LEU MD1 . . 4.010 3.871 3.819 3.901 . 0 0 "[ . 1 . 2]" 1
1432 1 49 LEU HA 1 49 LEU MD2 . . 2.730 2.199 2.046 2.303 . 0 0 "[ . 1 . 2]" 1
1433 1 49 LEU HA 1 49 LEU HG . . 3.580 2.973 2.892 3.111 . 0 0 "[ . 1 . 2]" 1
1434 1 49 LEU HA 1 50 THR H . . 2.920 2.321 2.248 2.398 . 0 0 "[ . 1 . 2]" 1
1435 1 49 LEU HA 1 50 THR MG . . 3.760 3.455 3.292 3.694 . 0 0 "[ . 1 . 2]" 1
1436 1 49 LEU HA 1 53 GLU HB2 . . 3.760 3.649 3.419 3.765 0.005 16 0 "[ . 1 . 2]" 1
1437 1 49 LEU HA 1 53 GLU HB3 . . 4.320 4.085 3.861 4.216 . 0 0 "[ . 1 . 2]" 1
1438 1 49 LEU HA 1 53 GLU HG2 . . 5.430 4.888 4.575 5.171 . 0 0 "[ . 1 . 2]" 1
1439 1 49 LEU HA 1 53 GLU QG . . 4.570 3.367 3.066 3.997 . 0 0 "[ . 1 . 2]" 1
1440 1 49 LEU HA 1 53 GLU HG3 . . 5.430 3.440 3.108 4.160 . 0 0 "[ . 1 . 2]" 1
1441 1 49 LEU QB 1 49 LEU MD1 . . 3.200 2.070 2.020 2.100 . 0 0 "[ . 1 . 2]" 1
1442 1 49 LEU QB 1 49 LEU MD2 . . 2.910 2.197 2.140 2.307 . 0 0 "[ . 1 . 2]" 1
1443 1 49 LEU QB 1 50 THR H . . 3.810 2.576 2.386 2.772 . 0 0 "[ . 1 . 2]" 1
1444 1 49 LEU QB 1 50 THR HA . . 4.640 4.226 4.144 4.290 . 0 0 "[ . 1 . 2]" 1
1445 1 49 LEU QB 1 50 THR MG . . 4.850 4.402 4.242 4.588 . 0 0 "[ . 1 . 2]" 1
1446 1 49 LEU QB 1 53 GLU H . . 4.800 4.409 4.256 4.479 . 0 0 "[ . 1 . 2]" 1
1447 1 49 LEU QB 1 53 GLU HA . . 5.300 4.733 4.559 4.851 . 0 0 "[ . 1 . 2]" 1
1448 1 49 LEU QB 1 53 GLU HB2 . . 3.570 2.285 2.062 2.480 . 0 0 "[ . 1 . 2]" 1
1449 1 49 LEU QB 1 53 GLU HB3 . . 3.630 2.532 2.283 2.734 . 0 0 "[ . 1 . 2]" 1
1450 1 49 LEU QB 1 53 GLU HG2 . . 4.670 4.466 4.223 4.673 0.003 2 0 "[ . 1 . 2]" 1
1451 1 49 LEU QB 1 53 GLU QG . . 4.020 3.383 3.156 3.725 . 0 0 "[ . 1 . 2]" 1
1452 1 49 LEU QB 1 53 GLU HG3 . . 4.670 3.509 3.242 3.947 . 0 0 "[ . 1 . 2]" 1
1453 1 49 LEU QB 1 54 LYS H . . 4.580 3.973 3.747 4.071 . 0 0 "[ . 1 . 2]" 1
1454 1 49 LEU QB 1 54 LYS QE . . 4.000 3.094 2.215 3.897 . 0 0 "[ . 1 . 2]" 1
1455 1 49 LEU QB 1 54 LYS HG2 . . 4.020 3.076 2.802 3.276 . 0 0 "[ . 1 . 2]" 1
1456 1 49 LEU QB 1 57 PHE QD . . 5.500 4.633 4.438 4.835 . 0 0 "[ . 1 . 2]" 1
1457 1 49 LEU QB 1 57 PHE QE . . 5.110 4.723 4.515 4.914 . 0 0 "[ . 1 . 2]" 1
1458 1 49 LEU MD1 1 53 GLU HB2 . . 4.420 3.870 3.503 4.155 . 0 0 "[ . 1 . 2]" 1
1459 1 49 LEU MD1 1 53 GLU HB3 . . 4.270 3.111 2.849 3.344 . 0 0 "[ . 1 . 2]" 1
1460 1 49 LEU MD1 1 54 LYS H . . 5.000 4.793 4.444 4.921 . 0 0 "[ . 1 . 2]" 1
1461 1 49 LEU MD1 1 54 LYS HA . . 4.380 3.965 3.598 4.138 . 0 0 "[ . 1 . 2]" 1
1462 1 49 LEU MD1 1 54 LYS QE . . 4.730 3.765 3.066 4.291 . 0 0 "[ . 1 . 2]" 1
1463 1 49 LEU MD1 1 54 LYS HG2 . . 4.310 3.175 2.901 3.385 . 0 0 "[ . 1 . 2]" 1
1464 1 49 LEU MD1 1 54 LYS HG3 . . 4.360 3.776 3.506 3.989 . 0 0 "[ . 1 . 2]" 1
1465 1 49 LEU MD1 1 57 PHE QD . . 4.830 3.358 2.976 3.519 . 0 0 "[ . 1 . 2]" 1
1466 1 49 LEU MD1 1 57 PHE QE . . 4.790 3.207 2.921 3.445 . 0 0 "[ . 1 . 2]" 1
1467 1 49 LEU MD2 1 50 THR H . . 3.700 3.169 3.002 3.402 . 0 0 "[ . 1 . 2]" 1
1468 1 49 LEU MD2 1 50 THR MG . . 4.730 4.435 4.215 4.657 . 0 0 "[ . 1 . 2]" 1
1469 1 49 LEU MD2 1 53 GLU H . . 4.990 4.939 4.833 4.990 . 19 0 "[ . 1 . 2]" 1
1470 1 49 LEU MD2 1 53 GLU HA . . 4.380 4.310 4.165 4.383 0.003 6 0 "[ . 1 . 2]" 1
1471 1 49 LEU MD2 1 53 GLU HB2 . . 3.230 2.951 2.843 3.066 . 0 0 "[ . 1 . 2]" 1
1472 1 49 LEU MD2 1 53 GLU HB3 . . 3.160 2.133 1.992 2.380 . 0 0 "[ . 1 . 2]" 1
1473 1 49 LEU MD2 1 53 GLU HG2 . . 4.640 3.766 3.586 3.946 . 0 0 "[ . 1 . 2]" 1
1474 1 49 LEU MD2 1 53 GLU QG . . 4.000 2.648 2.175 3.299 . 0 0 "[ . 1 . 2]" 1
1475 1 49 LEU MD2 1 53 GLU HG3 . . 4.640 2.772 2.192 3.677 . 0 0 "[ . 1 . 2]" 1
1476 1 49 LEU MD2 1 54 LYS H . . 5.170 5.112 5.029 5.169 . 0 0 "[ . 1 . 2]" 1
1477 1 49 LEU MD2 1 54 LYS HA . . 5.470 5.379 5.300 5.451 . 0 0 "[ . 1 . 2]" 1
1478 1 49 LEU MD2 1 54 LYS HG2 . . 5.030 4.972 4.799 5.031 0.001 8 0 "[ . 1 . 2]" 1
1479 1 49 LEU MD2 1 54 LYS HG3 . . 4.880 4.707 4.555 4.857 . 0 0 "[ . 1 . 2]" 1
1480 1 49 LEU MD2 1 57 PHE QD . . 5.500 4.750 4.606 4.857 . 0 0 "[ . 1 . 2]" 1
1481 1 49 LEU MD2 1 57 PHE QE . . 4.290 3.722 3.339 3.915 . 0 0 "[ . 1 . 2]" 1
1482 1 49 LEU HG 1 50 THR H . . 5.060 4.826 4.738 4.942 . 0 0 "[ . 1 . 2]" 1
1483 1 50 THR H 1 50 THR MG . . 3.110 2.521 2.252 2.754 . 0 0 "[ . 1 . 2]" 1
1484 1 50 THR H 1 51 LEU H . . 5.290 4.526 4.485 4.549 . 0 0 "[ . 1 . 2]" 1
1485 1 50 THR H 1 53 GLU H . . 4.290 3.509 3.380 3.678 . 0 0 "[ . 1 . 2]" 1
1486 1 50 THR H 1 53 GLU HA . . 4.970 4.850 4.695 4.972 0.002 20 0 "[ . 1 . 2]" 1
1487 1 50 THR H 1 53 GLU HB2 . . 3.600 2.096 1.953 2.334 . 0 0 "[ . 1 . 2]" 1
1488 1 50 THR H 1 53 GLU HB3 . . 4.050 3.378 3.234 3.510 . 0 0 "[ . 1 . 2]" 1
1489 1 50 THR H 1 53 GLU HG2 . . 4.470 3.355 2.747 3.813 . 0 0 "[ . 1 . 2]" 1
1490 1 50 THR H 1 53 GLU QG . . 3.910 2.246 1.944 2.430 . 0 0 "[ . 1 . 2]" 1
1491 1 50 THR H 1 53 GLU HG3 . . 4.470 2.290 1.967 2.492 . 0 0 "[ . 1 . 2]" 1
1492 1 50 THR H 1 54 LYS H . . 5.030 4.474 4.257 4.695 . 0 0 "[ . 1 . 2]" 1
1493 1 50 THR HA 1 50 THR HB . . 2.960 2.427 2.317 2.524 . 0 0 "[ . 1 . 2]" 1
1494 1 50 THR HA 1 50 THR MG . . 2.880 2.380 2.232 2.535 . 0 0 "[ . 1 . 2]" 1
1495 1 50 THR HA 1 51 LEU H . . 3.120 2.459 2.355 2.557 . 0 0 "[ . 1 . 2]" 1
1496 1 50 THR HA 1 51 LEU HA . . 4.450 4.297 4.294 4.304 . 0 0 "[ . 1 . 2]" 1
1497 1 50 THR HA 1 51 LEU HB2 . . 5.260 4.695 4.592 4.794 . 0 0 "[ . 1 . 2]" 1
1498 1 50 THR HA 1 51 LEU QB . . 4.410 4.321 4.263 4.367 . 0 0 "[ . 1 . 2]" 1
1499 1 50 THR HA 1 51 LEU HB3 . . 5.260 5.053 4.956 5.178 . 0 0 "[ . 1 . 2]" 1
1500 1 50 THR HA 1 52 ALA H . . 4.930 4.791 4.620 4.935 0.005 1 0 "[ . 1 . 2]" 1
1501 1 50 THR HA 1 53 GLU H . . 4.640 4.518 4.428 4.608 . 0 0 "[ . 1 . 2]" 1
1502 1 50 THR HA 1 53 GLU HB2 . . 4.660 4.245 4.171 4.385 . 0 0 "[ . 1 . 2]" 1
1503 1 50 THR HA 1 53 GLU QG . . 5.340 4.635 4.185 4.894 . 0 0 "[ . 1 . 2]" 1
1504 1 50 THR HA 1 54 LYS QD . . 4.630 4.210 3.787 4.527 . 0 0 "[ . 1 . 2]" 1
1505 1 50 THR HA 1 54 LYS HG3 . . 5.140 4.475 4.260 4.867 . 0 0 "[ . 1 . 2]" 1
1506 1 50 THR HB 1 51 LEU H . . 3.480 2.309 2.053 2.578 . 0 0 "[ . 1 . 2]" 1
1507 1 50 THR HB 1 51 LEU HA . . 5.030 4.794 4.569 5.032 0.002 18 0 "[ . 1 . 2]" 1
1508 1 50 THR HB 1 51 LEU QB . . 4.190 3.791 3.639 3.977 . 0 0 "[ . 1 . 2]" 1
1509 1 50 THR HB 1 51 LEU MD1 . . 5.500 5.326 5.046 5.505 0.005 19 0 "[ . 1 . 2]" 1
1510 1 50 THR HB 1 52 ALA H . . 3.750 3.433 3.192 3.737 . 0 0 "[ . 1 . 2]" 1
1511 1 50 THR HB 1 52 ALA MB . . 4.370 4.160 3.957 4.369 . 0 0 "[ . 1 . 2]" 1
1512 1 50 THR HB 1 53 GLU H . . 4.600 4.048 3.711 4.390 . 0 0 "[ . 1 . 2]" 1
1513 1 50 THR HG1 1 52 ALA H . . 4.930 3.424 2.270 4.398 . 0 0 "[ . 1 . 2]" 1
1514 1 50 THR HG1 1 52 ALA MB . . 4.810 3.122 2.439 3.745 . 0 0 "[ . 1 . 2]" 1
1515 1 50 THR HG1 1 53 GLU H . . 4.920 2.763 1.923 3.573 . 0 0 "[ . 1 . 2]" 1
1516 1 50 THR MG 1 51 LEU H . . 4.040 3.712 3.427 3.967 . 0 0 "[ . 1 . 2]" 1
1517 1 50 THR MG 1 52 ALA H . . 4.820 4.729 4.548 4.805 . 0 0 "[ . 1 . 2]" 1
1518 1 50 THR MG 1 53 GLU H . . 4.770 4.454 4.199 4.608 . 0 0 "[ . 1 . 2]" 1
1519 1 50 THR MG 1 53 GLU HB2 . . 4.730 4.160 3.939 4.353 . 0 0 "[ . 1 . 2]" 1
1520 1 50 THR MG 1 53 GLU HB3 . . 5.500 5.262 4.946 5.474 . 0 0 "[ . 1 . 2]" 1
1521 1 50 THR MG 1 53 GLU HG2 . . 4.490 4.162 3.589 4.470 . 0 0 "[ . 1 . 2]" 1
1522 1 50 THR MG 1 53 GLU QG . . 3.780 3.277 2.754 3.684 . 0 0 "[ . 1 . 2]" 1
1523 1 50 THR MG 1 53 GLU HG3 . . 4.490 3.467 2.793 3.922 . 0 0 "[ . 1 . 2]" 1
1524 1 51 LEU H 1 51 LEU HB2 . . 3.620 2.409 2.309 2.510 . 0 0 "[ . 1 . 2]" 1
1525 1 51 LEU H 1 51 LEU QB . . 3.050 2.224 2.201 2.241 . 0 0 "[ . 1 . 2]" 1
1526 1 51 LEU H 1 51 LEU HB3 . . 3.620 2.626 2.501 2.774 . 0 0 "[ . 1 . 2]" 1
1527 1 51 LEU H 1 51 LEU MD1 . . 4.530 4.180 4.052 4.321 . 0 0 "[ . 1 . 2]" 1
1528 1 51 LEU H 1 51 LEU MD2 . . 4.260 3.957 3.836 4.047 . 0 0 "[ . 1 . 2]" 1
1529 1 51 LEU H 1 52 ALA H . . 3.780 3.010 2.871 3.121 . 0 0 "[ . 1 . 2]" 1
1530 1 51 LEU H 1 52 ALA MB . . 4.820 4.571 4.405 4.669 . 0 0 "[ . 1 . 2]" 1
1531 1 51 LEU H 1 53 GLU H . . 5.270 4.055 3.890 4.155 . 0 0 "[ . 1 . 2]" 1
1532 1 51 LEU H 1 54 LYS QD . . 5.500 4.314 3.999 4.712 . 0 0 "[ . 1 . 2]" 1
1533 1 51 LEU HA 1 51 LEU MD1 . . 3.590 3.352 3.285 3.415 . 0 0 "[ . 1 . 2]" 1
1534 1 51 LEU HA 1 51 LEU MD2 . . 3.310 1.957 1.913 2.039 . 0 0 "[ . 1 . 2]" 1
1535 1 51 LEU HA 1 51 LEU HG . . 4.040 3.645 3.587 3.713 . 0 0 "[ . 1 . 2]" 1
1536 1 51 LEU HA 1 52 ALA MB . . 5.080 5.039 5.030 5.043 . 0 0 "[ . 1 . 2]" 1
1537 1 51 LEU HA 1 53 GLU H . . 4.620 4.065 3.965 4.133 . 0 0 "[ . 1 . 2]" 1
1538 1 51 LEU HA 1 54 LYS H . . 4.010 3.264 3.203 3.414 . 0 0 "[ . 1 . 2]" 1
1539 1 51 LEU HA 1 54 LYS QB . . 3.690 2.848 2.680 3.224 . 0 0 "[ . 1 . 2]" 1
1540 1 51 LEU HA 1 54 LYS QD . . 3.200 2.871 2.613 3.196 . 0 0 "[ . 1 . 2]" 1
1541 1 51 LEU HA 1 54 LYS QE . . 5.340 4.905 4.535 5.282 . 0 0 "[ . 1 . 2]" 1
1542 1 51 LEU HA 1 54 LYS HG3 . . 4.160 3.536 3.272 3.728 . 0 0 "[ . 1 . 2]" 1
1543 1 51 LEU HA 1 55 ARG H . . 5.130 4.392 4.193 4.722 . 0 0 "[ . 1 . 2]" 1
1544 1 51 LEU QB 1 51 LEU MD1 . . 2.830 2.031 1.978 2.142 . 0 0 "[ . 1 . 2]" 1
1545 1 51 LEU QB 1 52 ALA H . . 3.380 2.211 2.133 2.368 . 0 0 "[ . 1 . 2]" 1
1546 1 51 LEU QB 1 54 LYS H . . 5.340 4.786 4.710 4.897 . 0 0 "[ . 1 . 2]" 1
1547 1 51 LEU HB2 1 51 LEU MD1 . . 3.260 3.123 3.102 3.147 . 0 0 "[ . 1 . 2]" 1
1548 1 51 LEU HB2 1 51 LEU MD2 . . 3.200 2.578 2.529 2.620 . 0 0 "[ . 1 . 2]" 1
1549 1 51 LEU HB2 1 52 ALA H . . 3.980 3.659 3.587 3.795 . 0 0 "[ . 1 . 2]" 1
1550 1 51 LEU HB2 1 52 ALA HA . . 5.500 5.551 5.533 5.581 0.081 5 0 "[ . 1 . 2]" 1
1551 1 51 LEU HB2 1 53 GLU H . . 5.500 5.459 5.360 5.501 0.001 2 0 "[ . 1 . 2]" 1
1552 1 51 LEU HB3 1 51 LEU MD1 . . 3.260 2.058 2.001 2.182 . 0 0 "[ . 1 . 2]" 1
1553 1 51 LEU HB3 1 51 LEU MD2 . . 3.200 3.158 3.143 3.178 . 0 0 "[ . 1 . 2]" 1
1554 1 51 LEU HB3 1 52 ALA H . . 3.980 2.230 2.149 2.392 . 0 0 "[ . 1 . 2]" 1
1555 1 51 LEU HB3 1 52 ALA HA . . 5.500 4.148 4.049 4.267 . 0 0 "[ . 1 . 2]" 1
1556 1 51 LEU HB3 1 53 GLU H . . 5.500 4.629 4.553 4.692 . 0 0 "[ . 1 . 2]" 1
1557 1 51 LEU MD1 1 52 ALA H . . 4.610 2.677 2.355 3.020 . 0 0 "[ . 1 . 2]" 1
1558 1 51 LEU MD1 1 52 ALA HA . . 3.930 2.639 2.358 2.863 . 0 0 "[ . 1 . 2]" 1
1559 1 51 LEU MD1 1 52 ALA MB . . 4.180 3.217 2.969 3.496 . 0 0 "[ . 1 . 2]" 1
1560 1 51 LEU MD1 1 53 GLU H . . 5.320 4.490 4.324 4.719 . 0 0 "[ . 1 . 2]" 1
1561 1 51 LEU MD1 1 54 LYS H . . 5.020 4.548 4.380 4.686 . 0 0 "[ . 1 . 2]" 1
1562 1 51 LEU MD1 1 55 ARG H . . 5.350 3.944 3.714 4.212 . 0 0 "[ . 1 . 2]" 1
1563 1 51 LEU MD1 1 55 ARG QB . . 4.580 3.075 2.752 3.408 . 0 0 "[ . 1 . 2]" 1
1564 1 51 LEU MD1 1 55 ARG HD2 . . 3.960 2.183 1.978 2.581 . 0 0 "[ . 1 . 2]" 1
1565 1 51 LEU MD1 1 55 ARG HD3 . . 5.470 2.131 1.864 2.521 . 0 0 "[ . 1 . 2]" 1
1566 1 51 LEU MD2 1 53 GLU H . . 4.930 4.797 4.634 4.929 . 0 0 "[ . 1 . 2]" 1
1567 1 51 LEU MD2 1 54 LYS H . . 5.340 3.823 3.736 4.001 . 0 0 "[ . 1 . 2]" 1
1568 1 51 LEU MD2 1 55 ARG H . . 5.020 3.741 3.425 4.098 . 0 0 "[ . 1 . 2]" 1
1569 1 51 LEU MD2 1 55 ARG HA . . 4.390 3.693 3.302 4.244 . 0 0 "[ . 1 . 2]" 1
1570 1 51 LEU MD2 1 55 ARG HD2 . . 5.090 2.787 2.260 3.397 . 0 0 "[ . 1 . 2]" 1
1571 1 51 LEU HG 1 52 ALA H . . 5.430 4.567 4.404 4.705 . 0 0 "[ . 1 . 2]" 1
1572 1 52 ALA H 1 52 ALA MB . . 2.840 2.168 2.040 2.227 . 0 0 "[ . 1 . 2]" 1
1573 1 52 ALA H 1 53 GLU H . . 3.420 2.770 2.706 2.834 . 0 0 "[ . 1 . 2]" 1
1574 1 52 ALA H 1 53 GLU HB2 . . 5.500 4.892 4.713 5.152 . 0 0 "[ . 1 . 2]" 1
1575 1 52 ALA H 1 53 GLU QG . . 5.340 4.604 4.322 4.891 . 0 0 "[ . 1 . 2]" 1
1576 1 52 ALA H 1 54 LYS H . . 4.720 4.214 4.100 4.303 . 0 0 "[ . 1 . 2]" 1
1577 1 52 ALA H 1 55 ARG QB . . 4.840 4.547 4.444 4.681 . 0 0 "[ . 1 . 2]" 1
1578 1 52 ALA HA 1 54 LYS H . . 4.680 4.316 4.172 4.410 . 0 0 "[ . 1 . 2]" 1
1579 1 52 ALA HA 1 55 ARG H . . 4.060 3.430 3.324 3.503 . 0 0 "[ . 1 . 2]" 1
1580 1 52 ALA HA 1 55 ARG QB . . 3.200 2.300 2.182 2.411 . 0 0 "[ . 1 . 2]" 1
1581 1 52 ALA HA 1 55 ARG HD2 . . 3.990 3.830 3.687 3.975 . 0 0 "[ . 1 . 2]" 1
1582 1 52 ALA HA 1 55 ARG HD3 . . 3.740 3.147 2.950 3.408 . 0 0 "[ . 1 . 2]" 1
1583 1 52 ALA HA 1 55 ARG HG2 . . 4.460 3.954 3.821 4.156 . 0 0 "[ . 1 . 2]" 1
1584 1 52 ALA HA 1 56 PRO HD2 . . 5.040 4.750 4.637 4.819 . 0 0 "[ . 1 . 2]" 1
1585 1 52 ALA HA 1 56 PRO HD3 . . 4.750 4.411 4.238 4.558 . 0 0 "[ . 1 . 2]" 1
1586 1 52 ALA MB 1 53 GLU H . . 3.330 2.757 2.690 2.909 . 0 0 "[ . 1 . 2]" 1
1587 1 52 ALA MB 1 53 GLU HA . . 4.500 3.847 3.784 3.874 . 0 0 "[ . 1 . 2]" 1
1588 1 52 ALA MB 1 53 GLU HB2 . . 5.300 4.557 4.422 4.730 . 0 0 "[ . 1 . 2]" 1
1589 1 52 ALA MB 1 53 GLU HB3 . . 5.500 5.317 5.235 5.410 . 0 0 "[ . 1 . 2]" 1
1590 1 52 ALA MB 1 53 GLU QG . . 3.460 3.294 3.170 3.464 0.004 8 0 "[ . 1 . 2]" 1
1591 1 52 ALA MB 1 54 LYS H . . 4.610 4.554 4.439 4.616 0.006 16 0 "[ . 1 . 2]" 1
1592 1 52 ALA MB 1 55 ARG H . . 5.010 4.490 4.406 4.570 . 0 0 "[ . 1 . 2]" 1
1593 1 52 ALA MB 1 55 ARG QB . . 3.810 3.682 3.502 3.767 . 0 0 "[ . 1 . 2]" 1
1594 1 52 ALA MB 1 55 ARG HD3 . . 4.850 4.404 4.132 4.641 . 0 0 "[ . 1 . 2]" 1
1595 1 52 ALA MB 1 56 PRO HD3 . . 5.000 4.787 4.621 4.896 . 0 0 "[ . 1 . 2]" 1
1596 1 53 GLU H 1 53 GLU HB2 . . 3.000 2.344 2.221 2.533 . 0 0 "[ . 1 . 2]" 1
1597 1 53 GLU H 1 53 GLU HB3 . . 3.680 3.569 3.516 3.611 . 0 0 "[ . 1 . 2]" 1
1598 1 53 GLU H 1 53 GLU HG2 . . 3.820 2.822 2.429 3.364 . 0 0 "[ . 1 . 2]" 1
1599 1 53 GLU H 1 53 GLU QG . . 3.130 2.586 2.300 2.845 . 0 0 "[ . 1 . 2]" 1
1600 1 53 GLU H 1 53 GLU HG3 . . 3.820 3.420 2.385 3.798 . 0 0 "[ . 1 . 2]" 1
1601 1 53 GLU H 1 54 LYS H . . 3.210 2.461 2.374 2.524 . 0 0 "[ . 1 . 2]" 1
1602 1 53 GLU H 1 54 LYS QB . . 4.830 4.642 4.559 4.707 . 0 0 "[ . 1 . 2]" 1
1603 1 53 GLU H 1 54 LYS HG3 . . 4.130 4.000 3.875 4.121 . 0 0 "[ . 1 . 2]" 1
1604 1 53 GLU HA 1 53 GLU HB3 . . 2.890 2.551 2.443 2.636 . 0 0 "[ . 1 . 2]" 1
1605 1 53 GLU HA 1 53 GLU HG2 . . 3.770 2.629 2.329 3.038 . 0 0 "[ . 1 . 2]" 1
1606 1 53 GLU HA 1 53 GLU QG . . 3.080 2.568 2.287 2.909 . 0 0 "[ . 1 . 2]" 1
1607 1 53 GLU HA 1 53 GLU HG3 . . 3.770 3.619 3.334 3.739 . 0 0 "[ . 1 . 2]" 1
1608 1 53 GLU HA 1 54 LYS HG3 . . 5.500 5.094 4.976 5.214 . 0 0 "[ . 1 . 2]" 1
1609 1 53 GLU HA 1 55 ARG H . . 4.530 3.870 3.839 3.921 . 0 0 "[ . 1 . 2]" 1
1610 1 53 GLU HB2 1 54 LYS H . . 3.570 2.834 2.717 2.949 . 0 0 "[ . 1 . 2]" 1
1611 1 53 GLU HB2 1 55 ARG H . . 5.100 4.811 4.733 4.899 . 0 0 "[ . 1 . 2]" 1
1612 1 53 GLU HB3 1 54 LYS H . . 4.220 3.662 3.470 3.835 . 0 0 "[ . 1 . 2]" 1
1613 1 53 GLU QG 1 54 LYS H . . 4.560 4.223 3.972 4.355 . 0 0 "[ . 1 . 2]" 1
1614 1 53 GLU HG2 1 54 LYS H . . 5.310 4.660 4.422 4.879 . 0 0 "[ . 1 . 2]" 1
1615 1 53 GLU HG3 1 54 LYS H . . 5.310 4.904 4.250 5.138 . 0 0 "[ . 1 . 2]" 1
1616 1 54 LYS H 1 54 LYS QB . . 3.060 2.515 2.458 2.552 . 0 0 "[ . 1 . 2]" 1
1617 1 54 LYS H 1 54 LYS QD . . 4.060 3.687 3.521 3.852 . 0 0 "[ . 1 . 2]" 1
1618 1 54 LYS H 1 54 LYS HG2 . . 4.020 3.533 3.436 3.683 . 0 0 "[ . 1 . 2]" 1
1619 1 54 LYS H 1 54 LYS HG3 . . 3.330 2.239 2.139 2.374 . 0 0 "[ . 1 . 2]" 1
1620 1 54 LYS H 1 55 ARG H . . 3.340 2.369 2.327 2.384 . 0 0 "[ . 1 . 2]" 1
1621 1 54 LYS H 1 55 ARG QB . . 4.600 4.027 3.988 4.039 . 0 0 "[ . 1 . 2]" 1
1622 1 54 LYS H 1 56 PRO HD2 . . 4.840 3.547 3.494 3.584 . 0 0 "[ . 1 . 2]" 1
1623 1 54 LYS H 1 56 PRO HD3 . . 4.950 4.839 4.784 4.877 . 0 0 "[ . 1 . 2]" 1
1624 1 54 LYS H 1 58 VAL MG2 . . 4.770 4.390 4.354 4.459 . 0 0 "[ . 1 . 2]" 1
1625 1 54 LYS HA 1 54 LYS QD . . 5.040 4.140 4.036 4.252 . 0 0 "[ . 1 . 2]" 1
1626 1 54 LYS HA 1 54 LYS HG2 . . 3.460 2.705 2.606 2.818 . 0 0 "[ . 1 . 2]" 1
1627 1 54 LYS HA 1 54 LYS HG3 . . 3.380 3.096 2.984 3.170 . 0 0 "[ . 1 . 2]" 1
1628 1 54 LYS HA 1 56 PRO HD2 . . 4.240 3.231 3.207 3.275 . 0 0 "[ . 1 . 2]" 1
1629 1 54 LYS HA 1 57 PHE H . . 4.250 3.077 3.063 3.103 . 0 0 "[ . 1 . 2]" 1
1630 1 54 LYS HA 1 57 PHE HB2 . . 4.220 2.601 2.589 2.619 . 0 0 "[ . 1 . 2]" 1
1631 1 54 LYS HA 1 57 PHE HB3 . . 4.400 4.329 4.316 4.339 . 0 0 "[ . 1 . 2]" 1
1632 1 54 LYS HA 1 57 PHE QD . . 2.920 2.056 2.013 2.084 . 0 0 "[ . 1 . 2]" 1
1633 1 54 LYS HA 1 57 PHE QE . . 4.160 4.137 4.053 4.165 0.005 11 0 "[ . 1 . 2]" 1
1634 1 54 LYS HA 1 58 VAL HA . . 5.500 5.520 5.506 5.536 0.036 12 0 "[ . 1 . 2]" 1
1635 1 54 LYS HA 1 58 VAL MG2 . . 3.720 3.352 3.327 3.380 . 0 0 "[ . 1 . 2]" 1
1636 1 54 LYS QB 1 54 LYS QD . . 3.080 2.120 2.081 2.144 . 0 0 "[ . 1 . 2]" 1
1637 1 54 LYS QB 1 55 ARG H . . 3.590 3.233 3.191 3.275 . 0 0 "[ . 1 . 2]" 1
1638 1 54 LYS QB 1 56 PRO HD2 . . 4.450 4.347 4.320 4.366 . 0 0 "[ . 1 . 2]" 1
1639 1 54 LYS QB 1 57 PHE HB2 . . 4.490 3.654 3.582 3.742 . 0 0 "[ . 1 . 2]" 1
1640 1 54 LYS QB 1 57 PHE QD . . 4.990 4.039 3.995 4.081 . 0 0 "[ . 1 . 2]" 1
1641 1 54 LYS QB 1 58 VAL H . . 4.640 4.108 4.070 4.144 . 0 0 "[ . 1 . 2]" 1
1642 1 54 LYS QB 1 58 VAL HB . . 4.900 3.729 3.715 3.752 . 0 0 "[ . 1 . 2]" 1
1643 1 54 LYS QB 1 58 VAL MG2 . . 3.090 1.923 1.894 1.964 . 0 0 "[ . 1 . 2]" 1
1644 1 54 LYS QE 1 54 LYS HG3 . . 3.640 2.965 2.533 3.273 . 0 0 "[ . 1 . 2]" 1
1645 1 54 LYS HG2 1 57 PHE QD . . 5.080 3.886 3.741 4.084 . 0 0 "[ . 1 . 2]" 1
1646 1 54 LYS HG2 1 58 VAL MG2 . . 4.950 3.953 3.849 4.008 . 0 0 "[ . 1 . 2]" 1
1647 1 54 LYS HG3 1 55 ARG H . . 4.810 4.367 4.290 4.460 . 0 0 "[ . 1 . 2]" 1
1648 1 54 LYS HG3 1 57 PHE QD . . 5.500 4.519 4.353 4.613 . 0 0 "[ . 1 . 2]" 1
1649 1 55 ARG H 1 55 ARG QB . . 2.950 2.104 2.098 2.110 . 0 0 "[ . 1 . 2]" 1
1650 1 55 ARG H 1 55 ARG HD2 . . 4.470 3.669 3.605 3.761 . 0 0 "[ . 1 . 2]" 1
1651 1 55 ARG H 1 55 ARG HG2 . . 4.810 4.582 4.569 4.590 . 0 0 "[ . 1 . 2]" 1
1652 1 55 ARG H 1 55 ARG HG3 . . 4.480 4.430 4.411 4.447 . 0 0 "[ . 1 . 2]" 1
1653 1 55 ARG H 1 56 PRO HA . . 5.500 5.480 5.464 5.493 . 0 0 "[ . 1 . 2]" 1
1654 1 55 ARG H 1 56 PRO HD2 . . 3.430 2.038 2.014 2.056 . 0 0 "[ . 1 . 2]" 1
1655 1 55 ARG H 1 56 PRO HD3 . . 3.500 2.968 2.946 2.988 . 0 0 "[ . 1 . 2]" 1
1656 1 55 ARG H 1 56 PRO QG . . 4.810 3.947 3.926 3.963 . 0 0 "[ . 1 . 2]" 1
1657 1 55 ARG H 1 58 VAL H . . 4.960 4.525 4.503 4.550 . 0 0 "[ . 1 . 2]" 1
1658 1 55 ARG H 1 58 VAL HB . . 4.810 4.451 4.442 4.463 . 0 0 "[ . 1 . 2]" 1
1659 1 55 ARG H 1 58 VAL MG1 . . 5.500 5.558 5.542 5.574 0.074 20 0 "[ . 1 . 2]" 1
1660 1 55 ARG H 1 58 VAL MG2 . . 4.420 4.059 4.021 4.095 . 0 0 "[ . 1 . 2]" 1
1661 1 55 ARG HA 1 55 ARG HD2 . . 3.770 2.300 2.207 2.371 . 0 0 "[ . 1 . 2]" 1
1662 1 55 ARG HA 1 55 ARG HG2 . . 3.690 3.627 3.620 3.635 . 0 0 "[ . 1 . 2]" 1
1663 1 55 ARG HA 1 55 ARG HG3 . . 3.470 2.482 2.442 2.522 . 0 0 "[ . 1 . 2]" 1
1664 1 55 ARG HA 1 57 PHE H . . 4.890 4.344 4.214 4.434 . 0 0 "[ . 1 . 2]" 1
1665 1 55 ARG HA 1 58 VAL H . . 3.580 3.538 3.478 3.578 . 0 0 "[ . 1 . 2]" 1
1666 1 55 ARG HA 1 58 VAL HA . . 5.500 5.425 5.383 5.460 . 0 0 "[ . 1 . 2]" 1
1667 1 55 ARG HA 1 58 VAL HB . . 3.250 2.526 2.493 2.558 . 0 0 "[ . 1 . 2]" 1
1668 1 55 ARG HA 1 58 VAL MG1 . . 3.900 3.721 3.705 3.743 . 0 0 "[ . 1 . 2]" 1
1669 1 55 ARG HA 1 58 VAL MG2 . . 3.550 3.409 3.385 3.441 . 0 0 "[ . 1 . 2]" 1
1670 1 55 ARG HA 1 59 GLU H . . 4.510 3.947 3.884 4.007 . 0 0 "[ . 1 . 2]" 1
1671 1 55 ARG QB 1 55 ARG HD2 . . 3.600 2.481 2.407 2.563 . 0 0 "[ . 1 . 2]" 1
1672 1 55 ARG QB 1 55 ARG HD3 . . 3.410 2.582 2.503 2.666 . 0 0 "[ . 1 . 2]" 1
1673 1 55 ARG QB 1 56 PRO HD2 . . 3.130 2.772 2.766 2.781 . 0 0 "[ . 1 . 2]" 1
1674 1 55 ARG QB 1 56 PRO HD3 . . 2.850 1.909 1.905 1.916 . 0 0 "[ . 1 . 2]" 1
1675 1 55 ARG QB 1 58 VAL MG2 . . 4.940 4.812 4.795 4.836 . 0 0 "[ . 1 . 2]" 1
1676 1 55 ARG HD2 1 56 PRO HD3 . . 5.500 5.207 5.155 5.260 . 0 0 "[ . 1 . 2]" 1
1677 1 55 ARG HD2 1 58 VAL MG1 . . 4.670 4.564 4.424 4.672 0.002 19 0 "[ . 1 . 2]" 1
1678 1 55 ARG HD2 1 58 VAL MG2 . . 4.870 4.568 4.491 4.625 . 0 0 "[ . 1 . 2]" 1
1679 1 55 ARG HD2 1 59 GLU HG2 . . 4.930 4.813 4.655 4.938 0.008 6 0 "[ . 1 . 2]" 1
1680 1 55 ARG HD2 1 59 GLU HG3 . . 5.430 5.333 5.196 5.436 0.006 3 0 "[ . 1 . 2]" 1
1681 1 55 ARG HD3 1 56 PRO HD3 . . 5.500 5.419 5.345 5.496 . 0 0 "[ . 1 . 2]" 1
1682 1 55 ARG HG2 1 59 GLU HG2 . . 5.130 5.013 4.941 5.080 . 0 0 "[ . 1 . 2]" 1
1683 1 55 ARG HG2 1 59 GLU HG3 . . 4.470 4.480 4.472 4.485 0.015 7 0 "[ . 1 . 2]" 1
1684 1 55 ARG HG3 1 56 PRO HA . . 4.980 4.810 4.770 4.848 . 0 0 "[ . 1 . 2]" 1
1685 1 55 ARG HG3 1 56 PRO HD3 . . 4.510 4.396 4.377 4.417 . 0 0 "[ . 1 . 2]" 1
1686 1 55 ARG HG3 1 59 GLU HG2 . . 4.430 3.283 3.202 3.332 . 0 0 "[ . 1 . 2]" 1
1687 1 55 ARG HG3 1 59 GLU HG3 . . 3.880 3.057 2.987 3.129 . 0 0 "[ . 1 . 2]" 1
1688 1 56 PRO HA 1 57 PHE QD . . 5.500 5.465 5.402 5.501 0.001 3 0 "[ . 1 . 2]" 1
1689 1 56 PRO HA 1 58 VAL H . . 4.840 4.049 4.015 4.091 . 0 0 "[ . 1 . 2]" 1
1690 1 56 PRO HA 1 59 GLU H . . 3.940 3.839 3.767 3.935 . 0 0 "[ . 1 . 2]" 1
1691 1 56 PRO HA 1 59 GLU HB2 . . 3.690 3.556 3.448 3.663 . 0 0 "[ . 1 . 2]" 1
1692 1 56 PRO HA 1 59 GLU HG2 . . 4.660 4.503 4.412 4.639 . 0 0 "[ . 1 . 2]" 1
1693 1 56 PRO HA 1 59 GLU HG3 . . 4.150 3.982 3.805 4.100 . 0 0 "[ . 1 . 2]" 1
1694 1 56 PRO HA 1 60 GLU H . . 5.030 4.818 4.679 4.956 . 0 0 "[ . 1 . 2]" 1
1695 1 56 PRO HB2 1 57 PHE H . . 4.280 3.377 3.308 3.476 . 0 0 "[ . 1 . 2]" 1
1696 1 56 PRO HB2 1 57 PHE HA . . 4.770 4.189 4.155 4.243 . 0 0 "[ . 1 . 2]" 1
1697 1 56 PRO HB2 1 57 PHE QD . . 5.000 4.093 4.008 4.146 . 0 0 "[ . 1 . 2]" 1
1698 1 56 PRO HB2 1 57 PHE QE . . 5.120 4.193 4.077 4.258 . 0 0 "[ . 1 . 2]" 1
1699 1 56 PRO HB2 1 57 PHE HZ . . 5.500 4.856 4.761 4.922 . 0 0 "[ . 1 . 2]" 1
1700 1 56 PRO HB2 1 58 VAL H . . 5.210 5.101 5.047 5.174 . 0 0 "[ . 1 . 2]" 1
1701 1 56 PRO HB3 1 57 PHE H . . 4.290 4.166 4.125 4.223 . 0 0 "[ . 1 . 2]" 1
1702 1 56 PRO HB3 1 57 PHE QD . . 5.430 5.395 5.374 5.412 . 0 0 "[ . 1 . 2]" 1
1703 1 56 PRO HB3 1 57 PHE QE . . 5.500 5.412 5.349 5.454 . 0 0 "[ . 1 . 2]" 1
1704 1 56 PRO HD2 1 57 PHE H . . 3.710 2.650 2.646 2.664 . 0 0 "[ . 1 . 2]" 1
1705 1 56 PRO HD2 1 57 PHE QE . . 4.670 4.475 4.445 4.491 . 0 0 "[ . 1 . 2]" 1
1706 1 56 PRO HD2 1 58 VAL H . . 4.830 4.085 4.056 4.118 . 0 0 "[ . 1 . 2]" 1
1707 1 56 PRO HD3 1 57 PHE H . . 4.090 3.840 3.835 3.850 . 0 0 "[ . 1 . 2]" 1
1708 1 56 PRO HD3 1 57 PHE QE . . 5.500 5.498 5.462 5.510 0.010 18 0 "[ . 1 . 2]" 1
1709 1 56 PRO QG 1 57 PHE H . . 3.750 2.403 2.318 2.528 . 0 0 "[ . 1 . 2]" 1
1710 1 56 PRO QG 1 57 PHE QD . . 4.410 3.003 2.918 3.097 . 0 0 "[ . 1 . 2]" 1
1711 1 56 PRO QG 1 57 PHE QE . . 3.990 3.112 3.047 3.162 . 0 0 "[ . 1 . 2]" 1
1712 1 56 PRO HG2 1 57 PHE H . . 4.560 2.425 2.337 2.555 . 0 0 "[ . 1 . 2]" 1
1713 1 56 PRO HG2 1 57 PHE QD . . 5.260 3.050 2.960 3.150 . 0 0 "[ . 1 . 2]" 1
1714 1 56 PRO HG2 1 57 PHE QE . . 4.880 3.228 3.154 3.283 . 0 0 "[ . 1 . 2]" 1
1715 1 56 PRO HG3 1 57 PHE H . . 4.560 3.922 3.857 4.019 . 0 0 "[ . 1 . 2]" 1
1716 1 56 PRO HG3 1 57 PHE QD . . 5.260 4.495 4.426 4.575 . 0 0 "[ . 1 . 2]" 1
1717 1 56 PRO HG3 1 57 PHE QE . . 4.880 4.081 4.014 4.131 . 0 0 "[ . 1 . 2]" 1
1718 1 57 PHE H 1 57 PHE HB2 . . 3.630 2.612 2.598 2.635 . 0 0 "[ . 1 . 2]" 1
1719 1 57 PHE H 1 57 PHE QD . . 3.370 2.953 2.905 3.044 . 0 0 "[ . 1 . 2]" 1
1720 1 57 PHE H 1 57 PHE QE . . 4.540 4.450 4.398 4.519 . 0 0 "[ . 1 . 2]" 1
1721 1 57 PHE H 1 58 VAL H . . 3.000 2.257 2.181 2.307 . 0 0 "[ . 1 . 2]" 1
1722 1 57 PHE H 1 58 VAL HA . . 4.900 4.868 4.801 4.909 0.009 19 0 "[ . 1 . 2]" 1
1723 1 57 PHE H 1 58 VAL HB . . 4.510 4.242 4.150 4.298 . 0 0 "[ . 1 . 2]" 1
1724 1 57 PHE H 1 58 VAL MG1 . . 5.500 5.464 5.390 5.508 0.008 9 0 "[ . 1 . 2]" 1
1725 1 57 PHE H 1 58 VAL MG2 . . 4.660 4.026 3.990 4.070 . 0 0 "[ . 1 . 2]" 1
1726 1 57 PHE H 1 59 GLU H . . 4.450 4.030 3.920 4.093 . 0 0 "[ . 1 . 2]" 1
1727 1 57 PHE HA 1 57 PHE QD . . 3.220 2.504 2.460 2.542 . 0 0 "[ . 1 . 2]" 1
1728 1 57 PHE HA 1 57 PHE QE . . 4.750 4.592 4.584 4.600 . 0 0 "[ . 1 . 2]" 1
1729 1 57 PHE HA 1 58 VAL MG2 . . 5.130 4.922 4.901 4.937 . 0 0 "[ . 1 . 2]" 1
1730 1 57 PHE HA 1 60 GLU H . . 3.830 3.670 3.618 3.711 . 0 0 "[ . 1 . 2]" 1
1731 1 57 PHE HA 1 60 GLU HB2 . . 4.540 4.031 3.852 4.185 . 0 0 "[ . 1 . 2]" 1
1732 1 57 PHE HA 1 60 GLU HB3 . . 3.430 2.799 2.720 2.872 . 0 0 "[ . 1 . 2]" 1
1733 1 57 PHE HA 1 60 GLU HG2 . . 5.090 4.437 4.324 4.623 . 0 0 "[ . 1 . 2]" 1
1734 1 57 PHE HA 1 61 ALA H . . 4.390 4.012 3.896 4.110 . 0 0 "[ . 1 . 2]" 1
1735 1 57 PHE HB2 1 58 VAL H . . 3.560 3.337 3.284 3.386 . 0 0 "[ . 1 . 2]" 1
1736 1 57 PHE HB2 1 58 VAL HA . . 5.030 4.395 4.360 4.415 . 0 0 "[ . 1 . 2]" 1
1737 1 57 PHE HB2 1 58 VAL MG2 . . 4.170 3.447 3.402 3.490 . 0 0 "[ . 1 . 2]" 1
1738 1 57 PHE HB3 1 58 VAL H . . 4.380 4.266 4.242 4.290 . 0 0 "[ . 1 . 2]" 1
1739 1 57 PHE HB3 1 60 GLU H . . 5.500 5.527 5.511 5.545 0.045 8 0 "[ . 1 . 2]" 1
1740 1 57 PHE QD 1 58 VAL H . . 4.610 4.467 4.434 4.496 . 0 0 "[ . 1 . 2]" 1
1741 1 58 VAL H 1 58 VAL HB . . 2.930 2.346 2.339 2.353 . 0 0 "[ . 1 . 2]" 1
1742 1 58 VAL H 1 58 VAL MG1 . . 3.750 3.682 3.675 3.689 . 0 0 "[ . 1 . 2]" 1
1743 1 58 VAL H 1 58 VAL MG2 . . 2.920 2.858 2.816 2.898 . 0 0 "[ . 1 . 2]" 1
1744 1 58 VAL H 1 59 GLU H . . 3.150 2.231 2.194 2.270 . 0 0 "[ . 1 . 2]" 1
1745 1 58 VAL H 1 59 GLU HB2 . . 5.100 4.525 4.488 4.574 . 0 0 "[ . 1 . 2]" 1
1746 1 58 VAL H 1 59 GLU HG2 . . 4.470 3.900 3.794 3.973 . 0 0 "[ . 1 . 2]" 1
1747 1 58 VAL H 1 59 GLU HG3 . . 5.070 4.992 4.938 5.051 . 0 0 "[ . 1 . 2]" 1
1748 1 58 VAL H 1 60 GLU HB3 . . 5.500 4.698 4.623 4.768 . 0 0 "[ . 1 . 2]" 1
1749 1 58 VAL HA 1 58 VAL MG1 . . 2.930 2.549 2.514 2.565 . 0 0 "[ . 1 . 2]" 1
1750 1 58 VAL HA 1 58 VAL MG2 . . 2.880 2.235 2.208 2.263 . 0 0 "[ . 1 . 2]" 1
1751 1 58 VAL HA 1 59 GLU HA . . 4.810 4.709 4.685 4.738 . 0 0 "[ . 1 . 2]" 1
1752 1 58 VAL HA 1 60 GLU H . . 4.560 3.811 3.754 3.892 . 0 0 "[ . 1 . 2]" 1
1753 1 58 VAL HA 1 60 GLU HB3 . . 5.190 5.094 5.014 5.186 . 0 0 "[ . 1 . 2]" 1
1754 1 58 VAL HA 1 61 ALA H . . 4.110 3.785 3.655 3.882 . 0 0 "[ . 1 . 2]" 1
1755 1 58 VAL HA 1 61 ALA MB . . 3.250 3.199 3.030 3.258 0.008 14 0 "[ . 1 . 2]" 1
1756 1 58 VAL HA 1 62 GLU H . . 4.600 4.170 3.994 4.418 . 0 0 "[ . 1 . 2]" 1
1757 1 58 VAL HB 1 59 GLU H . . 3.150 2.825 2.772 2.918 . 0 0 "[ . 1 . 2]" 1
1758 1 58 VAL MG1 1 59 GLU H . . 3.580 3.194 3.140 3.290 . 0 0 "[ . 1 . 2]" 1
1759 1 58 VAL MG1 1 59 GLU HA . . 3.610 3.132 3.087 3.191 . 0 0 "[ . 1 . 2]" 1
1760 1 58 VAL MG1 1 59 GLU HG2 . . 4.450 3.068 3.000 3.178 . 0 0 "[ . 1 . 2]" 1
1761 1 58 VAL MG1 1 59 GLU HG3 . . 4.840 4.622 4.551 4.733 . 0 0 "[ . 1 . 2]" 1
1762 1 58 VAL MG1 1 60 GLU H . . 4.540 4.471 4.419 4.541 0.001 20 0 "[ . 1 . 2]" 1
1763 1 58 VAL MG1 1 61 ALA MB . . 4.430 4.385 4.269 4.440 0.010 20 0 "[ . 1 . 2]" 1
1764 1 58 VAL MG1 1 62 GLU H . . 5.170 4.353 4.197 4.506 . 0 0 "[ . 1 . 2]" 1
1765 1 58 VAL MG1 1 62 GLU HA . . 5.500 5.465 5.329 5.512 0.012 8 0 "[ . 1 . 2]" 1
1766 1 58 VAL MG1 1 62 GLU HB2 . . 4.040 3.808 3.598 3.926 . 0 0 "[ . 1 . 2]" 1
1767 1 58 VAL MG1 1 62 GLU HB3 . . 4.500 4.404 4.195 4.507 0.007 7 0 "[ . 1 . 2]" 1
1768 1 58 VAL MG2 1 59 GLU H . . 4.250 4.073 4.051 4.103 . 0 0 "[ . 1 . 2]" 1
1769 1 59 GLU H 1 59 GLU HB2 . . 3.140 2.550 2.522 2.592 . 0 0 "[ . 1 . 2]" 1
1770 1 59 GLU H 1 59 GLU HB3 . . 3.650 3.615 3.603 3.629 . 0 0 "[ . 1 . 2]" 1
1771 1 59 GLU H 1 59 GLU HG2 . . 3.560 2.213 2.133 2.305 . 0 0 "[ . 1 . 2]" 1
1772 1 59 GLU H 1 59 GLU HG3 . . 3.480 3.320 3.274 3.364 . 0 0 "[ . 1 . 2]" 1
1773 1 59 GLU H 1 60 GLU H . . 3.510 2.462 2.398 2.517 . 0 0 "[ . 1 . 2]" 1
1774 1 59 GLU HA 1 59 GLU HG2 . . 3.130 2.831 2.785 2.879 . 0 0 "[ . 1 . 2]" 1
1775 1 59 GLU HA 1 59 GLU HG3 . . 3.860 3.834 3.814 3.857 . 0 0 "[ . 1 . 2]" 1
1776 1 59 GLU HA 1 60 GLU HA . . 4.840 4.642 4.618 4.680 . 0 0 "[ . 1 . 2]" 1
1777 1 59 GLU HG2 1 60 GLU H . . 4.470 4.379 4.333 4.418 . 0 0 "[ . 1 . 2]" 1
1778 1 59 GLU HG3 1 60 GLU H . . 5.430 5.132 5.084 5.173 . 0 0 "[ . 1 . 2]" 1
1779 1 60 GLU H 1 60 GLU HB2 . . 3.050 3.008 2.899 3.047 . 0 0 "[ . 1 . 2]" 1
1780 1 60 GLU H 1 60 GLU HB3 . . 2.820 2.299 2.241 2.365 . 0 0 "[ . 1 . 2]" 1
1781 1 60 GLU H 1 60 GLU HG2 . . 4.320 4.200 4.114 4.315 . 0 0 "[ . 1 . 2]" 1
1782 1 60 GLU H 1 60 GLU HG3 . . 4.800 4.460 4.425 4.509 . 0 0 "[ . 1 . 2]" 1
1783 1 60 GLU H 1 61 ALA H . . 3.080 2.485 2.367 2.615 . 0 0 "[ . 1 . 2]" 1
1784 1 60 GLU HA 1 60 GLU HG2 . . 3.790 3.622 3.532 3.683 . 0 0 "[ . 1 . 2]" 1
1785 1 60 GLU HA 1 60 GLU HG3 . . 3.650 2.659 2.558 2.733 . 0 0 "[ . 1 . 2]" 1
1786 1 60 GLU HA 1 61 ALA HA . . 5.500 4.836 4.796 4.902 . 0 0 "[ . 1 . 2]" 1
1787 1 60 GLU HA 1 63 ARG QB . . 3.570 3.323 2.909 3.536 . 0 0 "[ . 1 . 2]" 1
1788 1 60 GLU HA 1 63 ARG HD2 . . 3.950 3.163 2.124 3.899 . 0 0 "[ . 1 . 2]" 1
1789 1 60 GLU HA 1 63 ARG QD . . 3.310 2.341 2.024 2.776 . 0 0 "[ . 1 . 2]" 1
1790 1 60 GLU HA 1 63 ARG HD3 . . 3.950 2.695 2.044 3.894 . 0 0 "[ . 1 . 2]" 1
1791 1 60 GLU HA 1 63 ARG HG2 . . 4.960 4.870 4.682 4.961 0.001 4 0 "[ . 1 . 2]" 1
1792 1 60 GLU HA 1 63 ARG QG . . 4.250 3.495 3.225 3.735 . 0 0 "[ . 1 . 2]" 1
1793 1 60 GLU HA 1 63 ARG HG3 . . 4.960 3.584 3.286 3.864 . 0 0 "[ . 1 . 2]" 1
1794 1 60 GLU HA 1 64 LEU H . . 4.840 4.678 4.520 4.867 0.027 8 0 "[ . 1 . 2]" 1
1795 1 60 GLU HA 1 64 LEU MD1 . . 5.190 4.851 4.657 5.119 . 0 0 "[ . 1 . 2]" 1
1796 1 60 GLU HA 1 64 LEU QD . . 4.440 4.189 4.004 4.418 . 0 0 "[ . 1 . 2]" 1
1797 1 60 GLU HA 1 64 LEU MD2 . . 5.190 4.592 4.276 4.849 . 0 0 "[ . 1 . 2]" 1
1798 1 60 GLU HB2 1 61 ALA H . . 4.040 3.823 3.737 3.915 . 0 0 "[ . 1 . 2]" 1
1799 1 60 GLU HB2 1 61 ALA MB . . 5.500 5.305 5.278 5.338 . 0 0 "[ . 1 . 2]" 1
1800 1 60 GLU HB2 1 63 ARG QD . . 4.560 4.153 3.980 4.451 . 0 0 "[ . 1 . 2]" 1
1801 1 60 GLU HB2 1 64 LEU QD . . 5.330 4.628 4.448 4.813 . 0 0 "[ . 1 . 2]" 1
1802 1 60 GLU HB3 1 60 GLU HG2 . . 2.980 2.286 2.271 2.325 . 0 0 "[ . 1 . 2]" 1
1803 1 60 GLU HB3 1 61 ALA H . . 3.320 2.411 2.319 2.535 . 0 0 "[ . 1 . 2]" 1
1804 1 60 GLU HB3 1 61 ALA MB . . 4.480 3.959 3.916 4.055 . 0 0 "[ . 1 . 2]" 1
1805 1 60 GLU HB3 1 64 LEU QD . . 4.710 4.367 4.236 4.581 . 0 0 "[ . 1 . 2]" 1
1806 1 60 GLU HG2 1 61 ALA H . . 3.550 2.919 2.603 3.289 . 0 0 "[ . 1 . 2]" 1
1807 1 60 GLU HG2 1 61 ALA HA . . 4.250 3.305 3.160 3.496 . 0 0 "[ . 1 . 2]" 1
1808 1 60 GLU HG2 1 61 ALA MB . . 4.150 3.833 3.712 4.065 . 0 0 "[ . 1 . 2]" 1
1809 1 60 GLU HG2 1 64 LEU MD1 . . 4.190 2.664 2.340 2.936 . 0 0 "[ . 1 . 2]" 1
1810 1 60 GLU HG2 1 64 LEU QD . . 3.270 2.628 2.324 2.880 . 0 0 "[ . 1 . 2]" 1
1811 1 60 GLU HG2 1 64 LEU MD2 . . 4.190 4.060 3.745 4.192 0.002 19 0 "[ . 1 . 2]" 1
1812 1 60 GLU HG2 1 64 LEU HG . . 3.970 3.614 3.478 3.789 . 0 0 "[ . 1 . 2]" 1
1813 1 60 GLU HG3 1 61 ALA H . . 4.130 3.788 3.482 4.103 . 0 0 "[ . 1 . 2]" 1
1814 1 60 GLU HG3 1 61 ALA HA . . 4.440 4.002 3.773 4.332 . 0 0 "[ . 1 . 2]" 1
1815 1 60 GLU HG3 1 61 ALA MB . . 5.500 4.832 4.677 5.083 . 0 0 "[ . 1 . 2]" 1
1816 1 60 GLU HG3 1 63 ARG H . . 5.250 5.019 4.688 5.269 0.019 8 0 "[ . 1 . 2]" 1
1817 1 60 GLU HG3 1 63 ARG QD . . 4.340 3.981 3.666 4.342 0.002 17 0 "[ . 1 . 2]" 1
1818 1 60 GLU HG3 1 64 LEU HB2 . . 5.500 5.421 5.176 5.501 0.001 17 0 "[ . 1 . 2]" 1
1819 1 60 GLU HG3 1 64 LEU MD1 . . 4.230 3.042 2.664 3.270 . 0 0 "[ . 1 . 2]" 1
1820 1 60 GLU HG3 1 64 LEU QD . . 3.460 2.777 2.527 2.951 . 0 0 "[ . 1 . 2]" 1
1821 1 60 GLU HG3 1 64 LEU MD2 . . 4.230 3.230 2.914 3.481 . 0 0 "[ . 1 . 2]" 1
1822 1 60 GLU HG3 1 64 LEU HG . . 4.480 3.123 2.956 3.198 . 0 0 "[ . 1 . 2]" 1
1823 1 61 ALA H 1 61 ALA MB . . 2.800 2.050 2.025 2.134 . 0 0 "[ . 1 . 2]" 1
1824 1 61 ALA H 1 62 GLU H . . 3.210 2.834 2.672 3.161 . 0 0 "[ . 1 . 2]" 1
1825 1 61 ALA H 1 62 GLU HB3 . . 5.190 4.895 4.762 5.054 . 0 0 "[ . 1 . 2]" 1
1826 1 61 ALA H 1 64 LEU QD . . 4.630 3.925 3.745 4.184 . 0 0 "[ . 1 . 2]" 1
1827 1 61 ALA HA 1 62 GLU HA . . 5.030 4.842 4.781 4.926 . 0 0 "[ . 1 . 2]" 1
1828 1 61 ALA HA 1 64 LEU HB2 . . 3.360 2.976 2.808 3.102 . 0 0 "[ . 1 . 2]" 1
1829 1 61 ALA HA 1 64 LEU QD . . 3.120 2.237 2.051 2.664 . 0 0 "[ . 1 . 2]" 1
1830 1 61 ALA HA 1 64 LEU HG . . 3.840 2.655 2.471 3.072 . 0 0 "[ . 1 . 2]" 1
1831 1 61 ALA HA 1 65 ARG H . . 4.500 4.034 3.702 4.344 . 0 0 "[ . 1 . 2]" 1
1832 1 61 ALA MB 1 62 GLU H . . 3.070 2.686 2.369 2.938 . 0 0 "[ . 1 . 2]" 1
1833 1 61 ALA MB 1 62 GLU HA . . 3.890 3.698 3.577 3.793 . 0 0 "[ . 1 . 2]" 1
1834 1 61 ALA MB 1 62 GLU HB2 . . 4.700 4.299 4.177 4.416 . 0 0 "[ . 1 . 2]" 1
1835 1 61 ALA MB 1 65 ARG H . . 5.500 4.345 3.881 4.678 . 0 0 "[ . 1 . 2]" 1
1836 1 61 ALA MB 1 65 ARG HD2 . . 5.500 5.394 5.124 5.551 0.051 8 0 "[ . 1 . 2]" 1
1837 1 62 GLU H 1 62 GLU HB2 . . 2.990 2.648 2.542 2.732 . 0 0 "[ . 1 . 2]" 1
1838 1 62 GLU H 1 62 GLU HB3 . . 3.000 2.418 2.345 2.520 . 0 0 "[ . 1 . 2]" 1
1839 1 62 GLU H 1 62 GLU HG2 . . 5.000 4.433 4.347 4.592 . 0 0 "[ . 1 . 2]" 1
1840 1 62 GLU H 1 62 GLU HG3 . . 5.000 4.444 4.401 4.466 . 0 0 "[ . 1 . 2]" 1
1841 1 62 GLU H 1 64 LEU HB2 . . 5.500 5.436 5.254 5.509 0.009 5 0 "[ . 1 . 2]" 1
1842 1 62 GLU H 1 64 LEU QD . . 5.440 4.874 4.762 4.970 . 0 0 "[ . 1 . 2]" 1
1843 1 62 GLU HA 1 62 GLU HG2 . . 3.800 3.616 3.456 3.856 0.056 10 0 "[ . 1 . 2]" 1
1844 1 62 GLU HA 1 62 GLU QG . . 3.320 2.573 2.492 2.787 . 0 0 "[ . 1 . 2]" 1
1845 1 62 GLU HA 1 62 GLU HG3 . . 3.800 2.633 2.545 2.859 . 0 0 "[ . 1 . 2]" 1
1846 1 62 GLU HA 1 63 ARG HA . . 5.500 4.788 4.716 4.859 . 0 0 "[ . 1 . 2]" 1
1847 1 62 GLU HA 1 65 ARG H . . 3.690 3.577 3.350 3.696 0.006 19 0 "[ . 1 . 2]" 1
1848 1 62 GLU HA 1 65 ARG HB2 . . 5.080 3.975 3.537 4.601 . 0 0 "[ . 1 . 2]" 1
1849 1 62 GLU HA 1 65 ARG HB3 . . 3.500 2.778 2.523 2.972 . 0 0 "[ . 1 . 2]" 1
1850 1 62 GLU HA 1 65 ARG HD2 . . 4.700 3.277 2.788 3.648 . 0 0 "[ . 1 . 2]" 1
1851 1 62 GLU HA 1 65 ARG HD3 . . 4.760 4.404 4.226 4.550 . 0 0 "[ . 1 . 2]" 1
1852 1 62 GLU HA 1 66 VAL H . . 4.420 3.964 3.600 4.251 . 0 0 "[ . 1 . 2]" 1
1853 1 62 GLU HA 1 66 VAL MG1 . . 4.380 3.832 2.989 4.386 0.006 12 0 "[ . 1 . 2]" 1
1854 1 62 GLU HB3 1 63 ARG H . . 3.450 2.552 2.203 2.891 . 0 0 "[ . 1 . 2]" 1
1855 1 62 GLU HB3 1 63 ARG QG . . 4.520 3.247 3.121 3.534 . 0 0 "[ . 1 . 2]" 1
1856 1 62 GLU QG 1 63 ARG H . . 4.140 3.270 2.740 3.587 . 0 0 "[ . 1 . 2]" 1
1857 1 62 GLU QG 1 63 ARG HA . . 3.820 3.397 3.127 3.559 . 0 0 "[ . 1 . 2]" 1
1858 1 62 GLU QG 1 63 ARG QG . . 4.340 3.392 3.126 3.583 . 0 0 "[ . 1 . 2]" 1
1859 1 62 GLU QG 1 65 ARG H . . 5.340 4.967 4.637 5.233 . 0 0 "[ . 1 . 2]" 1
1860 1 62 GLU QG 1 66 VAL MG1 . . 3.380 2.533 1.924 3.050 . 0 0 "[ . 1 . 2]" 1
1861 1 62 GLU HG2 1 63 ARG HA . . 4.430 3.751 3.216 4.450 0.020 7 0 "[ . 1 . 2]" 1
1862 1 62 GLU HG2 1 66 VAL MG1 . . 3.950 3.343 2.464 3.907 . 0 0 "[ . 1 . 2]" 1
1863 1 62 GLU HG3 1 63 ARG HA . . 4.430 4.155 3.422 4.408 . 0 0 "[ . 1 . 2]" 1
1864 1 62 GLU HG3 1 66 VAL MG1 . . 3.950 2.638 2.008 3.207 . 0 0 "[ . 1 . 2]" 1
1865 1 63 ARG H 1 63 ARG QB . . 2.870 2.496 2.320 2.607 . 0 0 "[ . 1 . 2]" 1
1866 1 63 ARG H 1 63 ARG HD2 . . 4.620 4.067 3.335 4.598 . 0 0 "[ . 1 . 2]" 1
1867 1 63 ARG H 1 63 ARG QD . . 3.810 3.422 3.146 3.781 . 0 0 "[ . 1 . 2]" 1
1868 1 63 ARG H 1 63 ARG HD3 . . 4.620 3.786 3.269 4.487 . 0 0 "[ . 1 . 2]" 1
1869 1 63 ARG H 1 63 ARG HG2 . . 3.790 3.525 3.293 3.718 . 0 0 "[ . 1 . 2]" 1
1870 1 63 ARG H 1 63 ARG HG3 . . 3.790 2.115 1.899 2.500 . 0 0 "[ . 1 . 2]" 1
1871 1 63 ARG H 1 64 LEU H . . 3.230 2.678 2.457 2.929 . 0 0 "[ . 1 . 2]" 1
1872 1 63 ARG H 1 64 LEU HB2 . . 5.500 5.106 4.812 5.461 . 0 0 "[ . 1 . 2]" 1
1873 1 63 ARG H 1 64 LEU MD1 . . 5.500 5.207 4.939 5.474 . 0 0 "[ . 1 . 2]" 1
1874 1 63 ARG H 1 64 LEU QD . . 4.340 4.318 4.273 4.346 0.006 5 0 "[ . 1 . 2]" 1
1875 1 63 ARG H 1 64 LEU MD2 . . 5.500 4.623 4.507 4.742 . 0 0 "[ . 1 . 2]" 1
1876 1 63 ARG H 1 64 LEU HG . . 5.500 4.009 3.816 4.216 . 0 0 "[ . 1 . 2]" 1
1877 1 63 ARG H 1 66 VAL MG2 . . 5.470 3.986 3.762 4.232 . 0 0 "[ . 1 . 2]" 1
1878 1 63 ARG HA 1 63 ARG QB . . 2.790 2.358 2.338 2.419 . 0 0 "[ . 1 . 2]" 1
1879 1 63 ARG HA 1 63 ARG HD2 . . 4.920 4.857 4.674 4.931 0.011 4 0 "[ . 1 . 2]" 1
1880 1 63 ARG HA 1 63 ARG HD3 . . 4.920 4.566 4.467 4.650 . 0 0 "[ . 1 . 2]" 1
1881 1 63 ARG HA 1 63 ARG HG2 . . 3.370 2.749 2.518 2.909 . 0 0 "[ . 1 . 2]" 1
1882 1 63 ARG HA 1 63 ARG HG3 . . 3.370 2.906 2.773 3.049 . 0 0 "[ . 1 . 2]" 1
1883 1 63 ARG HA 1 66 VAL H . . 4.110 3.882 3.616 4.133 0.023 3 0 "[ . 1 . 2]" 1
1884 1 63 ARG HA 1 66 VAL MG1 . . 3.740 3.487 3.099 3.758 0.018 19 0 "[ . 1 . 2]" 1
1885 1 63 ARG HA 1 66 VAL MG2 . . 3.490 2.019 1.914 2.276 . 0 0 "[ . 1 . 2]" 1
1886 1 63 ARG HA 1 67 GLN HE21 . . 5.500 3.638 2.882 4.381 . 0 0 "[ . 1 . 2]" 1
1887 1 63 ARG QB 1 63 ARG HD2 . . 3.330 3.122 2.514 3.292 . 0 0 "[ . 1 . 2]" 1
1888 1 63 ARG QB 1 63 ARG QD . . 2.900 2.160 2.099 2.250 . 0 0 "[ . 1 . 2]" 1
1889 1 63 ARG QB 1 63 ARG HD3 . . 3.330 2.217 2.128 2.302 . 0 0 "[ . 1 . 2]" 1
1890 1 63 ARG QB 1 64 LEU H . . 3.130 2.633 2.384 2.943 . 0 0 "[ . 1 . 2]" 1
1891 1 63 ARG QB 1 64 LEU QD . . 3.220 2.861 2.512 3.097 . 0 0 "[ . 1 . 2]" 1
1892 1 63 ARG QB 1 67 GLN HE22 . . 5.500 3.104 2.116 3.987 . 0 0 "[ . 1 . 2]" 1
1893 1 63 ARG QD 1 64 LEU QD . . 4.630 4.092 3.764 4.441 . 0 0 "[ . 1 . 2]" 1
1894 1 63 ARG QG 1 64 LEU H . . 4.550 4.071 3.940 4.275 . 0 0 "[ . 1 . 2]" 1
1895 1 63 ARG QG 1 66 VAL MG2 . . 4.160 3.732 3.593 3.918 . 0 0 "[ . 1 . 2]" 1
1896 1 63 ARG HG2 1 64 LEU H . . 5.220 5.091 4.968 5.227 0.007 2 0 "[ . 1 . 2]" 1
1897 1 63 ARG HG2 1 66 VAL MG2 . . 4.870 4.052 3.854 4.297 . 0 0 "[ . 1 . 2]" 1
1898 1 63 ARG HG3 1 64 LEU H . . 5.220 4.282 4.132 4.562 . 0 0 "[ . 1 . 2]" 1
1899 1 63 ARG HG3 1 66 VAL MG2 . . 4.870 4.384 4.150 4.628 . 0 0 "[ . 1 . 2]" 1
1900 1 64 LEU H 1 64 LEU HB2 . . 3.570 2.684 2.593 2.786 . 0 0 "[ . 1 . 2]" 1
1901 1 64 LEU H 1 64 LEU HB3 . . 3.610 3.590 3.555 3.650 0.040 3 0 "[ . 1 . 2]" 1
1902 1 64 LEU H 1 64 LEU MD1 . . 4.170 3.596 3.494 3.764 . 0 0 "[ . 1 . 2]" 1
1903 1 64 LEU H 1 64 LEU QD . . 3.400 2.777 2.439 2.968 . 0 0 "[ . 1 . 2]" 1
1904 1 64 LEU H 1 64 LEU MD2 . . 4.170 2.898 2.481 3.186 . 0 0 "[ . 1 . 2]" 1
1905 1 64 LEU H 1 64 LEU HG . . 3.970 2.024 1.899 2.264 . 0 0 "[ . 1 . 2]" 1
1906 1 64 LEU H 1 65 ARG H . . 3.340 2.635 2.474 2.828 . 0 0 "[ . 1 . 2]" 1
1907 1 64 LEU H 1 65 ARG HB2 . . 5.500 5.279 4.947 5.507 0.007 4 0 "[ . 1 . 2]" 1
1908 1 64 LEU H 1 66 VAL H . . 4.710 4.295 3.559 4.666 . 0 0 "[ . 1 . 2]" 1
1909 1 64 LEU HA 1 64 LEU QD . . 2.740 2.267 2.190 2.353 . 0 0 "[ . 1 . 2]" 1
1910 1 64 LEU HA 1 64 LEU HG . . 3.710 3.339 3.248 3.440 . 0 0 "[ . 1 . 2]" 1
1911 1 64 LEU HA 1 67 GLN H . . 4.020 3.561 3.229 3.782 . 0 0 "[ . 1 . 2]" 1
1912 1 64 LEU HA 1 67 GLN HE21 . . 5.410 3.431 1.986 4.609 . 0 0 "[ . 1 . 2]" 1
1913 1 64 LEU HA 1 67 GLN HE22 . . 5.500 3.760 2.654 5.374 . 0 0 "[ . 1 . 2]" 1
1914 1 64 LEU HB2 1 64 LEU MD1 . . 3.410 2.333 2.170 2.384 . 0 0 "[ . 1 . 2]" 1
1915 1 64 LEU HB2 1 64 LEU MD2 . . 3.410 3.184 3.176 3.189 . 0 0 "[ . 1 . 2]" 1
1916 1 64 LEU HB2 1 65 ARG H . . 3.440 2.462 2.042 2.919 . 0 0 "[ . 1 . 2]" 1
1917 1 64 LEU HB2 1 67 GLN H . . 5.500 5.399 5.040 5.512 0.012 20 0 "[ . 1 . 2]" 1
1918 1 64 LEU HB3 1 64 LEU MD1 . . 3.490 2.293 2.231 2.447 . 0 0 "[ . 1 . 2]" 1
1919 1 64 LEU HB3 1 64 LEU QD . . 2.990 2.039 2.028 2.058 . 0 0 "[ . 1 . 2]" 1
1920 1 64 LEU HB3 1 64 LEU MD2 . . 3.490 2.288 2.202 2.354 . 0 0 "[ . 1 . 2]" 1
1921 1 64 LEU HB3 1 65 ARG H . . 4.340 3.726 3.359 4.052 . 0 0 "[ . 1 . 2]" 1
1922 1 64 LEU HB3 1 67 GLN H . . 5.500 5.366 4.982 5.495 . 0 0 "[ . 1 . 2]" 1
1923 1 64 LEU QD 1 65 ARG H . . 4.260 3.938 3.740 4.135 . 0 0 "[ . 1 . 2]" 1
1924 1 64 LEU QD 1 67 GLN HE21 . . 4.640 3.714 2.865 4.616 . 0 0 "[ . 1 . 2]" 1
1925 1 64 LEU QD 1 67 GLN QG . . 5.050 4.451 3.952 4.785 . 0 0 "[ . 1 . 2]" 1
1926 1 64 LEU MD1 1 65 ARG H . . 4.930 4.340 4.042 4.644 . 0 0 "[ . 1 . 2]" 1
1927 1 64 LEU MD2 1 65 ARG H . . 4.930 4.519 4.394 4.639 . 0 0 "[ . 1 . 2]" 1
1928 1 64 LEU HG 1 65 ARG H . . 5.430 3.918 3.660 4.095 . 0 0 "[ . 1 . 2]" 1
1929 1 65 ARG H 1 65 ARG HB2 . . 3.090 2.763 2.614 3.045 . 0 0 "[ . 1 . 2]" 1
1930 1 65 ARG H 1 65 ARG HB3 . . 2.880 2.321 2.145 2.434 . 0 0 "[ . 1 . 2]" 1
1931 1 65 ARG H 1 65 ARG HD2 . . 4.640 4.355 3.749 4.631 . 0 0 "[ . 1 . 2]" 1
1932 1 65 ARG H 1 65 ARG HD3 . . 5.400 5.068 4.431 5.479 0.079 4 0 "[ . 1 . 2]" 1
1933 1 65 ARG H 1 65 ARG HG2 . . 4.630 4.342 3.984 4.423 . 0 0 "[ . 1 . 2]" 1
1934 1 65 ARG H 1 65 ARG QG . . 4.000 3.966 3.748 4.026 0.026 3 0 "[ . 1 . 2]" 1
1935 1 65 ARG H 1 65 ARG HG3 . . 4.630 4.590 4.556 4.645 0.015 3 0 "[ . 1 . 2]" 1
1936 1 65 ARG H 1 66 VAL HA . . 5.480 5.396 5.275 5.495 0.015 20 0 "[ . 1 . 2]" 1
1937 1 65 ARG H 1 66 VAL MG1 . . 4.790 4.463 4.129 4.666 . 0 0 "[ . 1 . 2]" 1
1938 1 65 ARG H 1 66 VAL MG2 . . 4.850 3.791 3.490 4.046 . 0 0 "[ . 1 . 2]" 1
1939 1 65 ARG HA 1 65 ARG HD2 . . 4.760 4.471 4.020 4.635 . 0 0 "[ . 1 . 2]" 1
1940 1 65 ARG HA 1 65 ARG HD3 . . 5.440 4.692 4.060 5.192 . 0 0 "[ . 1 . 2]" 1
1941 1 65 ARG HA 1 65 ARG HG2 . . 4.030 2.942 2.761 3.425 . 0 0 "[ . 1 . 2]" 1
1942 1 65 ARG HA 1 65 ARG QG . . 3.420 2.677 2.599 2.822 . 0 0 "[ . 1 . 2]" 1
1943 1 65 ARG HA 1 65 ARG HG3 . . 4.030 3.192 2.920 3.744 . 0 0 "[ . 1 . 2]" 1
1944 1 65 ARG HA 1 66 VAL HA . . 5.290 4.806 4.727 4.903 . 0 0 "[ . 1 . 2]" 1
1945 1 65 ARG HA 1 68 HIS HB2 . . 3.970 3.803 3.210 3.970 . 0 0 "[ . 1 . 2]" 1
1946 1 65 ARG HA 1 68 HIS HB3 . . 3.660 3.050 2.119 3.656 . 0 0 "[ . 1 . 2]" 1
1947 1 65 ARG HB2 1 65 ARG HD2 . . 3.600 2.945 2.657 3.546 . 0 0 "[ . 1 . 2]" 1
1948 1 65 ARG HB2 1 66 VAL H . . 4.300 3.882 3.682 4.204 . 0 0 "[ . 1 . 2]" 1
1949 1 65 ARG HB2 1 66 VAL MG1 . . 5.170 4.865 4.719 5.006 . 0 0 "[ . 1 . 2]" 1
1950 1 65 ARG HB3 1 65 ARG HD2 . . 3.140 2.269 2.078 2.371 . 0 0 "[ . 1 . 2]" 1
1951 1 65 ARG HB3 1 65 ARG HD3 . . 3.750 2.962 2.685 3.542 . 0 0 "[ . 1 . 2]" 1
1952 1 65 ARG HB3 1 66 VAL H . . 3.530 2.510 2.189 3.013 . 0 0 "[ . 1 . 2]" 1
1953 1 65 ARG HB3 1 66 VAL HA . . 5.000 4.514 4.297 4.834 . 0 0 "[ . 1 . 2]" 1
1954 1 65 ARG HB3 1 66 VAL MG1 . . 4.230 3.471 3.192 3.853 . 0 0 "[ . 1 . 2]" 1
1955 1 65 ARG HD2 1 66 VAL H . . 4.750 3.716 2.199 4.347 . 0 0 "[ . 1 . 2]" 1
1956 1 65 ARG HD2 1 66 VAL MG1 . . 4.600 3.436 1.914 4.219 . 0 0 "[ . 1 . 2]" 1
1957 1 65 ARG HD2 1 66 VAL MG2 . . 5.500 5.005 3.450 5.510 0.010 20 0 "[ . 1 . 2]" 1
1958 1 65 ARG HD2 1 69 MET ME . . 4.310 3.638 3.165 4.321 0.011 17 0 "[ . 1 . 2]" 1
1959 1 65 ARG HD3 1 66 VAL H . . 4.890 3.571 2.535 4.290 . 0 0 "[ . 1 . 2]" 1
1960 1 65 ARG HD3 1 66 VAL MG1 . . 5.180 2.784 2.068 3.327 . 0 0 "[ . 1 . 2]" 1
1961 1 65 ARG HD3 1 66 VAL MG2 . . 5.240 4.779 3.948 5.251 0.011 12 0 "[ . 1 . 2]" 1
1962 1 65 ARG HD3 1 69 MET ME . . 3.810 2.337 1.932 2.784 . 0 0 "[ . 1 . 2]" 1
1963 1 65 ARG QG 1 66 VAL H . . 4.000 3.228 2.416 3.711 . 0 0 "[ . 1 . 2]" 1
1964 1 65 ARG QG 1 66 VAL HA . . 4.290 3.326 2.766 3.734 . 0 0 "[ . 1 . 2]" 1
1965 1 65 ARG QG 1 66 VAL MG1 . . 4.010 3.506 2.548 3.877 . 0 0 "[ . 1 . 2]" 1
1966 1 65 ARG QG 1 66 VAL MG2 . . 5.190 4.644 3.826 5.088 . 0 0 "[ . 1 . 2]" 1
1967 1 65 ARG QG 1 69 MET ME . . 3.480 2.480 1.825 3.500 0.020 18 0 "[ . 1 . 2]" 1
1968 1 65 ARG QG 1 69 MET QG . . 3.960 2.823 2.322 3.610 . 0 0 "[ . 1 . 2]" 1
1969 1 65 ARG HG2 1 66 VAL H . . 4.790 3.322 2.440 3.871 . 0 0 "[ . 1 . 2]" 1
1970 1 65 ARG HG2 1 66 VAL HA . . 5.140 3.382 2.809 3.845 . 0 0 "[ . 1 . 2]" 1
1971 1 65 ARG HG2 1 69 MET HG2 . . 5.500 3.902 2.363 5.446 . 0 0 "[ . 1 . 2]" 1
1972 1 65 ARG HG2 1 69 MET HG3 . . 5.500 3.293 2.503 4.216 . 0 0 "[ . 1 . 2]" 1
1973 1 65 ARG HG3 1 66 VAL H . . 4.790 4.458 3.878 4.763 . 0 0 "[ . 1 . 2]" 1
1974 1 65 ARG HG3 1 66 VAL HA . . 5.140 4.965 4.094 5.137 . 0 0 "[ . 1 . 2]" 1
1975 1 65 ARG HG3 1 69 MET HG2 . . 5.500 4.915 3.841 5.503 0.003 19 0 "[ . 1 . 2]" 1
1976 1 65 ARG HG3 1 69 MET HG3 . . 5.500 4.599 3.436 5.521 0.021 18 0 "[ . 1 . 2]" 1
1977 1 66 VAL H 1 66 VAL HB . . 3.660 3.616 3.605 3.638 . 0 0 "[ . 1 . 2]" 1
1978 1 66 VAL H 1 66 VAL MG1 . . 2.850 2.274 2.043 2.474 . 0 0 "[ . 1 . 2]" 1
1979 1 66 VAL H 1 66 VAL MG2 . . 3.420 2.038 1.875 2.285 . 0 0 "[ . 1 . 2]" 1
1980 1 66 VAL H 1 69 MET ME . . 4.850 4.118 3.593 4.647 . 0 0 "[ . 1 . 2]" 1
1981 1 66 VAL HA 1 66 VAL MG1 . . 2.920 2.299 2.190 2.431 . 0 0 "[ . 1 . 2]" 1
1982 1 66 VAL HA 1 66 VAL MG2 . . 3.300 3.199 3.191 3.203 . 0 0 "[ . 1 . 2]" 1
1983 1 66 VAL HA 1 67 GLN HA . . 5.500 4.776 4.715 4.871 . 0 0 "[ . 1 . 2]" 1
1984 1 66 VAL HA 1 68 HIS H . . 5.220 4.036 3.583 5.085 . 0 0 "[ . 1 . 2]" 1
1985 1 66 VAL HA 1 69 MET H . . 4.410 3.398 3.103 3.955 . 0 0 "[ . 1 . 2]" 1
1986 1 66 VAL HA 1 69 MET ME . . 3.630 2.602 1.800 3.224 . 0 0 "[ . 1 . 2]" 1
1987 1 66 VAL HA 1 69 MET HG2 . . 4.780 4.146 2.482 4.776 . 0 0 "[ . 1 . 2]" 1
1988 1 66 VAL HA 1 69 MET QG . . 4.050 2.691 1.931 3.106 . 0 0 "[ . 1 . 2]" 1
1989 1 66 VAL HA 1 69 MET HG3 . . 4.780 2.731 1.997 3.148 . 0 0 "[ . 1 . 2]" 1
1990 1 66 VAL MG1 1 67 GLN H . . 4.310 3.969 3.785 4.113 . 0 0 "[ . 1 . 2]" 1
1991 1 66 VAL MG1 1 69 MET ME . . 4.030 2.900 1.908 3.211 . 0 0 "[ . 1 . 2]" 1
1992 1 66 VAL MG1 1 69 MET QG . . 4.670 4.165 3.537 4.559 . 0 0 "[ . 1 . 2]" 1
1993 1 66 VAL MG2 1 67 GLN H . . 3.750 2.095 1.819 2.347 . 0 0 "[ . 1 . 2]" 1
1994 1 66 VAL MG2 1 67 GLN HA . . 4.130 3.255 3.099 3.431 . 0 0 "[ . 1 . 2]" 1
1995 1 66 VAL MG2 1 67 GLN HE21 . . 4.400 3.343 2.700 3.921 . 0 0 "[ . 1 . 2]" 1
1996 1 66 VAL MG2 1 67 GLN HE22 . . 4.970 4.338 1.894 4.971 0.001 4 0 "[ . 1 . 2]" 1
1997 1 66 VAL MG2 1 67 GLN HG2 . . 4.110 3.818 2.990 4.104 . 0 0 "[ . 1 . 2]" 1
1998 1 66 VAL MG2 1 67 GLN QG . . 3.400 2.599 1.973 3.447 0.047 5 0 "[ . 1 . 2]" 1
1999 1 66 VAL MG2 1 67 GLN HG3 . . 4.110 2.720 2.002 4.087 . 0 0 "[ . 1 . 2]" 1
2000 1 66 VAL MG2 1 68 HIS H . . 5.080 4.210 3.817 4.659 . 0 0 "[ . 1 . 2]" 1
2001 1 66 VAL MG2 1 69 MET ME . . 5.000 4.640 3.819 5.014 0.014 19 0 "[ . 1 . 2]" 1
2002 1 67 GLN H 1 67 GLN QB . . 2.790 2.227 2.157 2.375 . 0 0 "[ . 1 . 2]" 1
2003 1 67 GLN H 1 67 GLN QG . . 3.680 2.808 2.377 3.509 . 0 0 "[ . 1 . 2]" 1
2004 1 67 GLN H 1 68 HIS H . . 3.670 2.625 2.475 2.864 . 0 0 "[ . 1 . 2]" 1
2005 1 67 GLN H 1 68 HIS HB2 . . 5.290 5.103 4.883 5.296 0.006 17 0 "[ . 1 . 2]" 1
2006 1 67 GLN HA 1 67 GLN QB . . 2.790 2.462 2.391 2.492 . 0 0 "[ . 1 . 2]" 1
2007 1 67 GLN HA 1 67 GLN HE21 . . 5.500 4.733 4.394 5.079 . 0 0 "[ . 1 . 2]" 1
2008 1 67 GLN HA 1 67 GLN HG2 . . 3.920 2.728 2.414 3.653 . 0 0 "[ . 1 . 2]" 1
2009 1 67 GLN HA 1 67 GLN QG . . 3.150 2.378 2.285 2.677 . 0 0 "[ . 1 . 2]" 1
2010 1 67 GLN HA 1 67 GLN HG3 . . 3.920 2.702 2.518 3.076 . 0 0 "[ . 1 . 2]" 1
2011 1 67 GLN HA 1 68 HIS HA . . 5.500 4.715 4.612 4.911 . 0 0 "[ . 1 . 2]" 1
2012 1 67 GLN HA 1 69 MET H . . 4.690 4.293 3.717 4.711 0.021 16 0 "[ . 1 . 2]" 1
2013 1 67 GLN HA 1 70 GLN H . . 4.550 3.545 3.039 4.047 . 0 0 "[ . 1 . 2]" 1
2014 1 67 GLN HA 1 70 GLN HE21 . . 5.500 4.089 2.806 5.135 . 0 0 "[ . 1 . 2]" 1
2015 1 67 GLN HA 1 70 GLN HE22 . . 4.590 4.062 3.247 4.588 . 0 0 "[ . 1 . 2]" 1
2016 1 67 GLN HA 1 70 GLN QG . . 3.500 2.582 2.005 3.520 0.020 16 0 "[ . 1 . 2]" 1
2017 1 67 GLN QB 1 68 HIS H . . 3.570 2.898 2.260 3.188 . 0 0 "[ . 1 . 2]" 1
2018 1 67 GLN QB 1 68 HIS HB2 . . 4.620 4.332 4.169 4.624 0.004 2 0 "[ . 1 . 2]" 1
2019 1 67 GLN QB 1 68 HIS HB3 . . 5.500 4.755 4.511 4.982 . 0 0 "[ . 1 . 2]" 1
2020 1 67 GLN QG 1 68 HIS H . . 4.760 4.424 4.144 4.794 0.034 18 0 "[ . 1 . 2]" 1
2021 1 67 GLN QG 1 70 GLN HE22 . . 4.600 3.632 1.962 4.500 . 0 0 "[ . 1 . 2]" 1
2022 1 68 HIS H 1 68 HIS HB2 . . 3.340 2.810 2.531 3.056 . 0 0 "[ . 1 . 2]" 1
2023 1 68 HIS H 1 68 HIS HB3 . . 3.430 2.412 2.223 2.562 . 0 0 "[ . 1 . 2]" 1
2024 1 68 HIS H 1 68 HIS HD2 . . 5.150 4.869 4.509 5.152 0.002 16 0 "[ . 1 . 2]" 1
2025 1 68 HIS H 1 69 MET H . . 3.990 2.449 2.170 2.908 . 0 0 "[ . 1 . 2]" 1
2026 1 68 HIS HA 1 68 HIS HD2 . . 4.570 4.490 4.350 4.562 . 0 0 "[ . 1 . 2]" 1
2027 1 68 HIS HA 1 70 GLN H . . 4.700 4.447 3.751 4.701 0.001 6 0 "[ . 1 . 2]" 1
2028 1 68 HIS HA 1 70 GLN QG . . 5.330 4.185 3.588 5.390 0.060 16 0 "[ . 1 . 2]" 1
2029 1 68 HIS HB2 1 69 MET H . . 4.170 4.056 3.764 4.202 0.032 2 0 "[ . 1 . 2]" 1
2030 1 68 HIS HB3 1 69 MET H . . 3.810 2.818 2.361 3.123 . 0 0 "[ . 1 . 2]" 1
2031 1 68 HIS HB3 1 69 MET HA . . 4.960 4.502 4.270 4.856 . 0 0 "[ . 1 . 2]" 1
2032 1 68 HIS HB3 1 69 MET ME . . 5.500 5.049 4.302 5.506 0.006 17 0 "[ . 1 . 2]" 1
2033 1 68 HIS HD2 1 69 MET H . . 5.250 3.866 3.263 4.561 . 0 0 "[ . 1 . 2]" 1
2034 1 68 HIS HD2 1 69 MET HA . . 4.640 3.574 3.034 4.002 . 0 0 "[ . 1 . 2]" 1
2035 1 68 HIS HD2 1 69 MET ME . . 5.480 5.127 4.208 5.484 0.004 17 0 "[ . 1 . 2]" 1
2036 1 68 HIS HD2 1 69 MET HG2 . . 5.180 3.193 2.635 4.048 . 0 0 "[ . 1 . 2]" 1
2037 1 68 HIS HD2 1 69 MET QG . . 4.560 3.083 2.584 3.857 . 0 0 "[ . 1 . 2]" 1
2038 1 68 HIS HD2 1 69 MET HG3 . . 5.180 4.171 3.691 4.856 . 0 0 "[ . 1 . 2]" 1
2039 1 68 HIS HD2 1 75 TYR QB . . 5.500 5.087 4.327 5.431 . 0 0 "[ . 1 . 2]" 1
2040 1 69 MET H 1 69 MET QB . . 3.190 2.601 2.357 3.027 . 0 0 "[ . 1 . 2]" 1
2041 1 69 MET H 1 69 MET ME . . 5.200 4.032 3.655 4.396 . 0 0 "[ . 1 . 2]" 1
2042 1 69 MET H 1 69 MET HG2 . . 4.140 2.871 2.114 3.462 . 0 0 "[ . 1 . 2]" 1
2043 1 69 MET H 1 69 MET HG3 . . 4.140 2.267 1.904 2.628 . 0 0 "[ . 1 . 2]" 1
2044 1 69 MET H 1 70 GLN H . . 4.040 2.456 2.086 2.637 . 0 0 "[ . 1 . 2]" 1
2045 1 69 MET HA 1 69 MET ME . . 5.020 4.764 4.473 5.065 0.045 17 0 "[ . 1 . 2]" 1
2046 1 69 MET HA 1 69 MET HG2 . . 3.930 2.764 2.318 3.728 . 0 0 "[ . 1 . 2]" 1
2047 1 69 MET HA 1 69 MET QG . . 3.340 2.620 2.279 3.264 . 0 0 "[ . 1 . 2]" 1
2048 1 69 MET HA 1 69 MET HG3 . . 3.930 3.446 3.102 3.721 . 0 0 "[ . 1 . 2]" 1
2049 1 69 MET HA 1 72 HIS H . . 4.390 3.417 3.224 3.824 . 0 0 "[ . 1 . 2]" 1
2050 1 69 MET HA 1 72 HIS HB2 . . 5.450 5.451 5.407 5.518 0.068 18 0 "[ . 1 . 2]" 1
2051 1 69 MET HA 1 75 TYR QB . . 4.840 3.761 3.238 4.651 . 0 0 "[ . 1 . 2]" 1
2052 1 69 MET HA 1 75 TYR QD . . 4.600 3.493 2.707 4.152 . 0 0 "[ . 1 . 2]" 1
2053 1 69 MET QB 1 70 GLN H . . 3.830 2.810 2.422 3.598 . 0 0 "[ . 1 . 2]" 1
2054 1 69 MET QB 1 70 GLN HA . . 4.080 3.912 3.777 4.160 0.080 17 0 "[ . 1 . 2]" 1
2055 1 69 MET QB 1 75 TYR QB . . 4.960 2.918 2.304 3.573 . 0 0 "[ . 1 . 2]" 1
2056 1 69 MET QB 1 75 TYR QD . . 4.770 2.604 1.971 3.064 . 0 0 "[ . 1 . 2]" 1
2057 1 69 MET QB 1 75 TYR QE . . 4.790 3.114 2.644 3.544 . 0 0 "[ . 1 . 2]" 1
2058 1 69 MET ME 1 69 MET QG . . 3.340 2.157 2.005 2.465 . 0 0 "[ . 1 . 2]" 1
2059 1 69 MET ME 1 75 TYR QB . . 4.290 3.824 2.669 4.296 0.006 17 0 "[ . 1 . 2]" 1
2060 1 69 MET ME 1 75 TYR QD . . 4.690 3.709 2.389 4.487 . 0 0 "[ . 1 . 2]" 1
2061 1 69 MET ME 1 75 TYR QE . . 5.150 4.118 2.797 5.014 . 0 0 "[ . 1 . 2]" 1
2062 1 69 MET QG 1 70 GLN H . . 5.020 3.589 2.328 4.109 . 0 0 "[ . 1 . 2]" 1
2063 1 70 GLN H 1 70 GLN QB . . 3.210 2.303 2.120 2.464 . 0 0 "[ . 1 . 2]" 1
2064 1 70 GLN H 1 70 GLN HG2 . . 4.280 2.616 2.172 3.892 . 0 0 "[ . 1 . 2]" 1
2065 1 70 GLN H 1 70 GLN QG . . 3.590 2.557 2.147 3.618 0.028 16 0 "[ . 1 . 2]" 1
2066 1 70 GLN H 1 70 GLN HG3 . . 4.280 3.680 3.181 4.301 0.021 16 0 "[ . 1 . 2]" 1
2067 1 70 GLN HA 1 70 GLN QB . . 2.730 2.174 2.161 2.193 . 0 0 "[ . 1 . 2]" 1
2068 1 70 GLN HA 1 70 GLN HE21 . . 5.500 5.164 4.135 5.482 . 0 0 "[ . 1 . 2]" 1
2069 1 70 GLN HA 1 70 GLN QG . . 3.530 3.291 2.825 3.340 . 0 0 "[ . 1 . 2]" 1
2070 1 70 GLN HA 1 71 ASP HA . . 5.100 4.818 4.774 4.853 . 0 0 "[ . 1 . 2]" 1
2071 1 70 GLN HA 1 72 HIS H . . 4.960 4.033 3.547 4.314 . 0 0 "[ . 1 . 2]" 1
2072 1 70 GLN HA 1 73 PRO HA . . 5.500 4.861 4.654 4.960 . 0 0 "[ . 1 . 2]" 1
2073 1 70 GLN HA 1 73 PRO HD3 . . 5.500 5.492 5.383 5.553 0.053 18 0 "[ . 1 . 2]" 1
2074 1 70 GLN HA 1 75 TYR QD . . 5.500 5.064 4.532 5.500 . 0 0 "[ . 1 . 2]" 1
2075 1 70 GLN HA 1 75 TYR QE . . 4.890 3.509 2.690 3.886 . 0 0 "[ . 1 . 2]" 1
2076 1 70 GLN QB 1 70 GLN HE22 . . 4.380 3.701 3.238 3.886 . 0 0 "[ . 1 . 2]" 1
2077 1 70 GLN QB 1 71 ASP HA . . 4.720 4.495 4.338 4.631 . 0 0 "[ . 1 . 2]" 1
2078 1 70 GLN HE21 1 71 ASP HA . . 5.500 4.632 3.934 5.492 . 0 0 "[ . 1 . 2]" 1
2079 1 70 GLN HE22 1 70 GLN QG . . 3.580 3.278 3.233 3.432 . 0 0 "[ . 1 . 2]" 1
2080 1 70 GLN QG 1 71 ASP H . . 3.720 2.176 1.926 2.548 . 0 0 "[ . 1 . 2]" 1
2081 1 70 GLN QG 1 71 ASP HA . . 4.440 3.038 2.857 3.239 . 0 0 "[ . 1 . 2]" 1
2082 1 70 GLN HG2 1 71 ASP H . . 4.410 2.454 1.953 2.936 . 0 0 "[ . 1 . 2]" 1
2083 1 70 GLN HG3 1 71 ASP H . . 4.410 2.593 2.231 3.346 . 0 0 "[ . 1 . 2]" 1
2084 1 71 ASP H 1 71 ASP HB2 . . 3.850 2.345 2.205 2.495 . 0 0 "[ . 1 . 2]" 1
2085 1 71 ASP H 1 71 ASP QB . . 3.170 2.272 2.184 2.408 . 0 0 "[ . 1 . 2]" 1
2086 1 71 ASP H 1 71 ASP HB3 . . 3.850 3.226 2.585 3.587 . 0 0 "[ . 1 . 2]" 1
2087 1 71 ASP HA 1 72 HIS HB3 . . 5.500 5.290 5.155 5.514 0.014 2 0 "[ . 1 . 2]" 1
2088 1 71 ASP HA 1 72 HIS HD2 . . 4.800 4.572 4.194 4.736 . 0 0 "[ . 1 . 2]" 1
2089 1 71 ASP HA 1 73 PRO HD3 . . 5.500 5.440 4.983 5.514 0.014 8 0 "[ . 1 . 2]" 1
2090 1 71 ASP QB 1 72 HIS H . . 3.600 2.779 2.539 3.109 . 0 0 "[ . 1 . 2]" 1
2091 1 71 ASP QB 1 72 HIS HD2 . . 3.840 2.130 1.966 2.313 . 0 0 "[ . 1 . 2]" 1
2092 1 71 ASP QB 1 72 HIS HE1 . . 5.340 5.198 4.890 5.379 0.039 18 0 "[ . 1 . 2]" 1
2093 1 71 ASP HB2 1 72 HIS H . . 4.270 3.294 2.679 4.069 . 0 0 "[ . 1 . 2]" 1
2094 1 71 ASP HB2 1 72 HIS HD2 . . 4.540 2.944 2.047 3.858 . 0 0 "[ . 1 . 2]" 1
2095 1 71 ASP HB3 1 72 HIS H . . 4.270 3.317 2.585 4.043 . 0 0 "[ . 1 . 2]" 1
2096 1 71 ASP HB3 1 72 HIS HD2 . . 4.540 2.396 2.026 3.034 . 0 0 "[ . 1 . 2]" 1
2097 1 72 HIS H 1 72 HIS HB2 . . 3.870 3.778 3.663 3.862 . 0 0 "[ . 1 . 2]" 1
2098 1 72 HIS H 1 72 HIS HB3 . . 3.710 3.523 3.395 3.650 . 0 0 "[ . 1 . 2]" 1
2099 1 72 HIS H 1 72 HIS HD2 . . 4.560 3.196 2.846 3.476 . 0 0 "[ . 1 . 2]" 1
2100 1 72 HIS H 1 73 PRO HD2 . . 4.700 4.674 4.617 4.709 0.009 20 0 "[ . 1 . 2]" 1
2101 1 72 HIS H 1 73 PRO HD3 . . 4.450 4.329 4.210 4.404 . 0 0 "[ . 1 . 2]" 1
2102 1 72 HIS HB2 1 72 HIS HE1 . . 5.230 4.748 4.725 4.759 . 0 0 "[ . 1 . 2]" 1
2103 1 72 HIS HB2 1 73 PRO HA . . 5.300 5.028 4.988 5.056 . 0 0 "[ . 1 . 2]" 1
2104 1 72 HIS HB2 1 73 PRO HD2 . . 4.420 3.245 3.166 3.503 . 0 0 "[ . 1 . 2]" 1
2105 1 72 HIS HB2 1 73 PRO HD3 . . 4.600 4.421 4.372 4.591 . 0 0 "[ . 1 . 2]" 1
2106 1 72 HIS HB2 1 75 TYR QD . . 5.420 4.999 4.323 5.507 0.087 18 0 "[ . 1 . 2]" 1
2107 1 72 HIS HB3 1 73 PRO HD2 . . 4.170 3.649 3.549 3.764 . 0 0 "[ . 1 . 2]" 1
2108 1 72 HIS HB3 1 73 PRO HD3 . . 4.680 4.591 4.529 4.679 . 0 0 "[ . 1 . 2]" 1
2109 1 72 HIS HE1 1 74 ASN QB . . 4.560 4.412 4.164 4.638 0.078 18 0 "[ . 1 . 2]" 1
2110 1 73 PRO HA 1 74 ASN HD21 . . 5.500 4.995 3.952 5.363 . 0 0 "[ . 1 . 2]" 1
2111 1 73 PRO HA 1 75 TYR QE . . 4.110 2.101 1.985 2.634 . 0 0 "[ . 1 . 2]" 1
2112 1 73 PRO QB 1 74 ASN HD21 . . 5.340 4.778 4.153 5.366 0.026 18 0 "[ . 1 . 2]" 1
2113 1 73 PRO QB 1 75 TYR QD . . 5.340 4.415 3.971 5.116 . 0 0 "[ . 1 . 2]" 1
2114 1 73 PRO QB 1 75 TYR QE . . 4.630 3.558 3.279 3.974 . 0 0 "[ . 1 . 2]" 1
2115 1 73 PRO HD2 1 74 ASN QB . . 5.340 4.806 4.461 5.286 . 0 0 "[ . 1 . 2]" 1
2116 1 73 PRO HD3 1 75 TYR QE . . 4.930 4.911 4.693 4.966 0.036 8 0 "[ . 1 . 2]" 1
2117 1 73 PRO QG 1 75 TYR QE . . 5.350 5.103 4.980 5.312 . 0 0 "[ . 1 . 2]" 1
2118 1 75 TYR H 1 75 TYR QB . . 3.250 2.474 2.297 3.111 . 0 0 "[ . 1 . 2]" 1
2119 1 75 TYR H 1 75 TYR QD . . 4.640 2.209 1.855 3.088 . 0 0 "[ . 1 . 2]" 1
2120 1 75 TYR HA 1 75 TYR QD . . 3.790 3.721 3.659 3.739 . 0 0 "[ . 1 . 2]" 1
2121 1 75 TYR HA 1 76 LYS QB . . 5.340 4.493 4.212 4.847 . 0 0 "[ . 1 . 2]" 1
2122 1 75 TYR QB 1 76 LYS H . . 4.150 2.790 2.100 3.288 . 0 0 "[ . 1 . 2]" 1
2123 1 75 TYR QB 1 76 LYS HA . . 5.500 4.767 4.495 4.979 . 0 0 "[ . 1 . 2]" 1
2124 1 75 TYR QD 1 76 LYS HA . . 4.860 4.427 3.767 4.867 0.007 2 0 "[ . 1 . 2]" 1
2125 1 75 TYR QD 1 76 LYS HB2 . . 5.500 4.028 1.998 5.493 . 0 0 "[ . 1 . 2]" 1
2126 1 75 TYR QD 1 76 LYS HB3 . . 5.500 4.030 2.004 5.414 . 0 0 "[ . 1 . 2]" 1
2127 1 75 TYR QD 1 76 LYS QD . . 5.500 4.488 2.201 5.382 . 0 0 "[ . 1 . 2]" 1
2128 1 75 TYR QD 1 76 LYS QG . . 4.990 3.447 1.940 4.643 . 0 0 "[ . 1 . 2]" 1
2129 1 75 TYR QD 1 77 SER QB . . 5.120 4.731 3.700 5.153 0.033 7 0 "[ . 1 . 2]" 1
2130 1 75 TYR QE 1 76 LYS QG . . 5.500 4.451 2.357 5.542 0.042 6 0 "[ . 1 . 2]" 1
2131 1 75 TYR QE 1 77 SER HA . . 5.490 4.209 2.235 5.487 . 0 0 "[ . 1 . 2]" 1
2132 1 75 TYR QE 1 77 SER QB . . 4.770 4.279 3.277 4.768 . 0 0 "[ . 1 . 2]" 1
2133 1 76 LYS H 1 76 LYS QD . . 5.310 4.233 1.839 5.270 . 0 0 "[ . 1 . 2]" 1
2134 1 76 LYS HA 1 76 LYS QD . . 4.370 3.719 2.067 4.407 0.037 14 0 "[ . 1 . 2]" 1
2135 1 76 LYS HA 1 76 LYS QE . . 5.120 4.530 3.359 5.160 0.040 6 0 "[ . 1 . 2]" 1
2136 1 76 LYS HA 1 76 LYS QG . . 3.500 2.901 2.115 3.442 . 0 0 "[ . 1 . 2]" 1
2137 1 77 SER QB 1 78 GLY H . . 5.500 3.394 2.187 3.944 . 0 0 "[ . 1 . 2]" 1
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