NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
549571 |
2lvk   |
18573 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lvk
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 1921
_Distance_constraint_stats_list.Viol_count 2376
_Distance_constraint_stats_list.Viol_total 3963.916
_Distance_constraint_stats_list.Viol_max 0.674
_Distance_constraint_stats_list.Viol_rms 0.0340
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0052
_Distance_constraint_stats_list.Viol_average_violations_only 0.0834
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ASP 0.012 0.005 4 0 "[ . 1 . 2]"
1 3 ASP 0.199 0.031 15 0 "[ . 1 . 2]"
1 4 MET 0.753 0.056 20 0 "[ . 1 . 2]"
1 5 GLU 0.157 0.018 9 0 "[ . 1 . 2]"
1 6 ARG 0.283 0.031 15 0 "[ . 1 . 2]"
1 7 ILE 0.976 0.044 20 0 "[ . 1 . 2]"
1 8 PHE 0.640 0.056 20 0 "[ . 1 . 2]"
1 9 LYS 0.195 0.032 1 0 "[ . 1 . 2]"
1 10 ARG 1.413 0.062 8 0 "[ . 1 . 2]"
1 11 PHE 3.318 0.117 15 0 "[ . 1 . 2]"
1 12 ASP 4.664 0.203 8 0 "[ . 1 . 2]"
1 13 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ASN 8.273 0.231 16 0 "[ . 1 . 2]"
1 15 GLY 0.323 0.044 14 0 "[ . 1 . 2]"
1 16 ASP 9.921 0.466 13 0 "[ . 1 . 2]"
1 17 GLY 1.363 0.071 13 0 "[ . 1 . 2]"
1 18 LYS 5.206 0.128 3 0 "[ . 1 . 2]"
1 19 ILE 10.730 0.203 8 0 "[ . 1 . 2]"
1 20 SER 4.691 0.164 12 0 "[ . 1 . 2]"
1 21 LEU 4.568 0.161 9 0 "[ . 1 . 2]"
1 22 SER 0.166 0.081 3 0 "[ . 1 . 2]"
1 23 GLU 4.898 0.155 6 0 "[ . 1 . 2]"
1 24 LEU 1.692 0.127 3 0 "[ . 1 . 2]"
1 25 THR 2.847 0.157 2 0 "[ . 1 . 2]"
1 26 ASP 1.765 0.123 17 0 "[ . 1 . 2]"
1 27 ALA 3.576 0.160 14 0 "[ . 1 . 2]"
1 28 LEU 5.368 0.317 2 0 "[ . 1 . 2]"
1 29 ARG 4.511 0.230 13 0 "[ . 1 . 2]"
1 30 THR 1.441 0.382 3 0 "[ . 1 . 2]"
1 31 LEU 11.097 0.189 20 0 "[ . 1 . 2]"
1 32 GLY 1.190 0.078 4 0 "[ . 1 . 2]"
1 33 SER 0.877 0.382 3 0 "[ . 1 . 2]"
1 34 THR 8.098 0.317 2 0 "[ . 1 . 2]"
1 35 SER 2.346 0.147 5 0 "[ . 1 . 2]"
1 36 ALA 3.598 0.093 13 0 "[ . 1 . 2]"
1 37 ASP 0.762 0.058 12 0 "[ . 1 . 2]"
1 38 GLU 1.098 0.122 3 0 "[ . 1 . 2]"
1 39 VAL 4.384 0.147 5 0 "[ . 1 . 2]"
1 40 GLN 3.928 0.123 20 0 "[ . 1 . 2]"
1 41 ARG 2.859 0.123 20 0 "[ . 1 . 2]"
1 42 MET 3.323 0.081 4 0 "[ . 1 . 2]"
1 43 MET 4.308 0.161 9 0 "[ . 1 . 2]"
1 44 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 GLU 0.356 0.028 8 0 "[ . 1 . 2]"
1 46 ILE 3.290 0.134 12 0 "[ . 1 . 2]"
1 47 ASP 4.219 0.202 17 0 "[ . 1 . 2]"
1 48 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 ASP 19.144 0.282 17 0 "[ . 1 . 2]"
1 50 GLY 13.362 0.417 6 0 "[ . 1 . 2]"
1 51 ASP 11.482 0.417 6 0 "[ . 1 . 2]"
1 52 GLY 2.334 0.080 3 0 "[ . 1 . 2]"
1 53 PHE 4.345 0.149 3 0 "[ . 1 . 2]"
1 54 ILE 1.136 0.093 3 0 "[ . 1 . 2]"
1 55 ASP 2.176 0.128 3 0 "[ . 1 . 2]"
1 56 PHE 1.907 0.078 14 0 "[ . 1 . 2]"
1 57 ASN 3.179 0.078 14 0 "[ . 1 . 2]"
1 58 GLU 0.310 0.028 17 0 "[ . 1 . 2]"
1 59 PHE 2.823 0.093 3 0 "[ . 1 . 2]"
1 60 ILE 1.471 0.052 14 0 "[ . 1 . 2]"
1 61 SER 1.770 0.066 8 0 "[ . 1 . 2]"
1 62 PHE 3.296 0.081 4 0 "[ . 1 . 2]"
1 63 CYS 4.477 0.134 12 0 "[ . 1 . 2]"
1 64 ASN 1.791 0.044 4 0 "[ . 1 . 2]"
1 65 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 ASN 2.731 0.096 4 0 "[ . 1 . 2]"
1 67 PRO 5.353 0.125 2 0 "[ . 1 . 2]"
1 68 GLY 1.944 0.105 20 0 "[ . 1 . 2]"
1 69 LEU 9.105 0.301 16 0 "[ . 1 . 2]"
1 70 MET 22.982 0.498 14 0 "[ . 1 . 2]"
1 71 LYS 15.653 0.477 15 0 "[ . 1 . 2]"
1 72 ASP 7.241 0.305 10 0 "[ . 1 . 2]"
1 73 VAL 43.659 0.674 10 20 [*********+*********-]
1 74 ALA 16.398 0.674 10 20 [*********+*********-]
1 75 LYS 10.258 0.279 10 0 "[ . 1 . 2]"
1 76 VAL 2.862 0.109 8 0 "[ . 1 . 2]"
1 77 PHE 11.006 0.189 20 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ASP HA 1 3 ASP HA . . 5.440 4.499 4.355 4.702 . 0 0 "[ . 1 . 2]" 1
2 1 2 ASP HA 1 4 MET H . . 3.800 3.577 3.170 3.805 0.005 4 0 "[ . 1 . 2]" 1
3 1 2 ASP HA 1 5 GLU H . . 4.420 4.069 3.391 4.423 0.003 18 0 "[ . 1 . 2]" 1
4 1 2 ASP QB 1 5 GLU H . . 4.280 3.002 2.384 4.010 . 0 0 "[ . 1 . 2]" 1
5 1 2 ASP HB2 1 5 GLU H . . 4.880 4.062 3.033 4.879 . 0 0 "[ . 1 . 2]" 1
6 1 2 ASP HB2 1 5 GLU HB2 . . 5.500 3.437 2.323 4.815 . 0 0 "[ . 1 . 2]" 1
7 1 2 ASP HB2 1 5 GLU HB3 . . 5.500 3.485 2.975 3.961 . 0 0 "[ . 1 . 2]" 1
8 1 2 ASP HB2 1 6 ARG H . . 5.500 5.281 4.920 5.504 0.004 2 0 "[ . 1 . 2]" 1
9 1 2 ASP HB3 1 5 GLU H . . 4.880 3.111 2.420 4.268 . 0 0 "[ . 1 . 2]" 1
10 1 2 ASP HB3 1 5 GLU HB2 . . 5.500 2.970 2.292 3.599 . 0 0 "[ . 1 . 2]" 1
11 1 2 ASP HB3 1 5 GLU HB3 . . 5.500 3.280 1.998 4.188 . 0 0 "[ . 1 . 2]" 1
12 1 2 ASP HB3 1 6 ARG H . . 5.500 4.945 3.752 5.389 . 0 0 "[ . 1 . 2]" 1
13 1 3 ASP H 1 3 ASP HB2 . . 3.740 2.988 2.233 3.596 . 0 0 "[ . 1 . 2]" 1
14 1 3 ASP H 1 3 ASP QB . . 3.260 2.596 2.178 2.715 . 0 0 "[ . 1 . 2]" 1
15 1 3 ASP H 1 3 ASP HB3 . . 3.740 3.213 2.547 3.608 . 0 0 "[ . 1 . 2]" 1
16 1 3 ASP H 1 6 ARG H . . 5.500 5.478 5.292 5.531 0.031 15 0 "[ . 1 . 2]" 1
17 1 3 ASP HA 1 4 MET HA . . 4.830 4.797 4.742 4.841 0.011 19 0 "[ . 1 . 2]" 1
18 1 3 ASP HA 1 6 ARG H . . 4.110 3.648 3.485 3.852 . 0 0 "[ . 1 . 2]" 1
19 1 3 ASP HA 1 6 ARG HB3 . . 4.830 4.734 4.542 4.843 0.013 12 0 "[ . 1 . 2]" 1
20 1 3 ASP HA 1 6 ARG HG3 . . 5.500 3.471 3.310 3.688 . 0 0 "[ . 1 . 2]" 1
21 1 3 ASP QB 1 4 MET H . . 3.890 3.009 2.596 3.580 . 0 0 "[ . 1 . 2]" 1
22 1 3 ASP QB 1 6 ARG H . . 5.340 5.081 4.833 5.307 . 0 0 "[ . 1 . 2]" 1
23 1 3 ASP QB 1 7 ILE MD . . 3.700 2.332 2.007 2.964 . 0 0 "[ . 1 . 2]" 1
24 1 3 ASP QB 1 74 ALA MB . . 5.340 2.862 2.501 3.393 . 0 0 "[ . 1 . 2]" 1
25 1 3 ASP HB2 1 4 MET H . . 4.580 3.216 2.633 3.948 . 0 0 "[ . 1 . 2]" 1
26 1 3 ASP HB2 1 7 ILE MD . . 4.230 2.811 2.053 3.619 . 0 0 "[ . 1 . 2]" 1
27 1 3 ASP HB2 1 7 ILE HG13 . . 5.500 4.731 3.686 5.509 0.009 2 0 "[ . 1 . 2]" 1
28 1 3 ASP HB2 1 74 ALA MB . . 5.500 3.464 2.675 4.260 . 0 0 "[ . 1 . 2]" 1
29 1 3 ASP HB3 1 4 MET H . . 4.580 3.923 2.896 4.188 . 0 0 "[ . 1 . 2]" 1
30 1 3 ASP HB3 1 7 ILE MD . . 4.230 2.962 2.106 3.798 . 0 0 "[ . 1 . 2]" 1
31 1 3 ASP HB3 1 7 ILE HG13 . . 5.500 4.684 3.650 5.509 0.009 7 0 "[ . 1 . 2]" 1
32 1 3 ASP HB3 1 74 ALA MB . . 5.500 3.324 2.591 3.959 . 0 0 "[ . 1 . 2]" 1
33 1 4 MET H 1 4 MET HB2 . . 3.540 2.501 2.379 2.572 . 0 0 "[ . 1 . 2]" 1
34 1 4 MET H 1 4 MET HB3 . . 3.760 3.590 3.578 3.598 . 0 0 "[ . 1 . 2]" 1
35 1 4 MET H 1 4 MET ME . . 5.500 4.697 4.633 4.800 . 0 0 "[ . 1 . 2]" 1
36 1 4 MET H 1 4 MET HG2 . . 3.570 2.169 2.016 2.434 . 0 0 "[ . 1 . 2]" 1
37 1 4 MET H 1 4 MET HG3 . . 3.730 3.509 3.420 3.644 . 0 0 "[ . 1 . 2]" 1
38 1 4 MET H 1 6 ARG H . . 5.120 4.728 4.469 4.918 . 0 0 "[ . 1 . 2]" 1
39 1 4 MET H 1 6 ARG HG3 . . 5.500 5.475 5.322 5.517 0.017 4 0 "[ . 1 . 2]" 1
40 1 4 MET H 1 7 ILE MD . . 5.500 3.821 3.536 4.172 . 0 0 "[ . 1 . 2]" 1
41 1 4 MET HA 1 4 MET HB3 . . 2.540 2.475 2.441 2.531 . 0 0 "[ . 1 . 2]" 1
42 1 4 MET HA 1 4 MET ME . . 4.300 3.447 3.368 3.594 . 0 0 "[ . 1 . 2]" 1
43 1 4 MET HA 1 4 MET HG2 . . 3.200 2.948 2.848 2.991 . 0 0 "[ . 1 . 2]" 1
44 1 4 MET HA 1 7 ILE H . . 3.630 3.504 3.314 3.651 0.021 2 0 "[ . 1 . 2]" 1
45 1 4 MET HA 1 7 ILE HB . . 3.300 2.421 2.224 2.670 . 0 0 "[ . 1 . 2]" 1
46 1 4 MET HA 1 7 ILE MD . . 5.020 2.372 2.245 2.461 . 0 0 "[ . 1 . 2]" 1
47 1 4 MET HA 1 7 ILE HG12 . . 5.500 4.870 4.718 5.087 . 0 0 "[ . 1 . 2]" 1
48 1 4 MET HA 1 7 ILE HG13 . . 4.560 4.096 3.870 4.407 . 0 0 "[ . 1 . 2]" 1
49 1 4 MET HA 1 7 ILE MG . . 4.970 3.766 3.562 3.986 . 0 0 "[ . 1 . 2]" 1
50 1 4 MET HA 1 8 PHE H . . 4.040 3.704 3.522 3.917 . 0 0 "[ . 1 . 2]" 1
51 1 4 MET HA 1 60 ILE MD . . 5.500 5.178 5.156 5.190 . 0 0 "[ . 1 . 2]" 1
52 1 4 MET HB2 1 4 MET HG2 . . 2.990 2.518 2.490 2.547 . 0 0 "[ . 1 . 2]" 1
53 1 4 MET HB2 1 5 GLU H . . 5.040 3.037 3.000 3.107 . 0 0 "[ . 1 . 2]" 1
54 1 4 MET HB2 1 5 GLU HA . . 4.700 4.331 4.263 4.455 . 0 0 "[ . 1 . 2]" 1
55 1 4 MET HB2 1 5 GLU HB3 . . 5.450 5.275 5.216 5.346 . 0 0 "[ . 1 . 2]" 1
56 1 4 MET HB2 1 56 PHE HE1 . . 4.300 3.133 3.039 3.238 . 0 0 "[ . 1 . 2]" 1
57 1 4 MET HB2 1 60 ILE MD . . 3.850 2.739 2.673 2.782 . 0 0 "[ . 1 . 2]" 1
58 1 4 MET HB2 1 60 ILE MG . . 5.500 4.080 4.013 4.123 . 0 0 "[ . 1 . 2]" 1
59 1 4 MET HB3 1 7 ILE MD . . 4.870 4.502 4.316 4.634 . 0 0 "[ . 1 . 2]" 1
60 1 4 MET HB3 1 8 PHE H . . 4.820 4.612 4.518 4.774 . 0 0 "[ . 1 . 2]" 1
61 1 4 MET HB3 1 8 PHE HA . . 5.500 5.527 5.512 5.556 0.056 20 0 "[ . 1 . 2]" 1
62 1 4 MET HB3 1 8 PHE HB2 . . 5.500 3.885 3.809 3.956 . 0 0 "[ . 1 . 2]" 1
63 1 4 MET HB3 1 56 PHE HE1 . . 4.050 3.515 3.255 3.694 . 0 0 "[ . 1 . 2]" 1
64 1 4 MET HB3 1 60 ILE MD . . 3.420 3.202 3.153 3.276 . 0 0 "[ . 1 . 2]" 1
65 1 4 MET HB3 1 60 ILE HG12 . . 3.970 3.043 2.990 3.110 . 0 0 "[ . 1 . 2]" 1
66 1 4 MET HB3 1 60 ILE HG13 . . 4.520 4.475 4.424 4.523 0.003 4 0 "[ . 1 . 2]" 1
67 1 4 MET HB3 1 60 ILE MG . . 4.610 4.085 4.004 4.158 . 0 0 "[ . 1 . 2]" 1
68 1 4 MET ME 1 59 PHE HB3 . . 5.500 3.286 3.187 3.341 . 0 0 "[ . 1 . 2]" 1
69 1 4 MET ME 1 60 ILE HA . . 3.390 2.073 2.024 2.094 . 0 0 "[ . 1 . 2]" 1
70 1 4 MET ME 1 60 ILE MD . . 3.940 3.278 3.212 3.337 . 0 0 "[ . 1 . 2]" 1
71 1 4 MET ME 1 60 ILE HG12 . . 4.640 2.102 2.006 2.160 . 0 0 "[ . 1 . 2]" 1
72 1 4 MET ME 1 60 ILE HG13 . . 5.500 3.403 3.325 3.451 . 0 0 "[ . 1 . 2]" 1
73 1 4 MET ME 1 60 ILE MG . . 3.500 2.501 2.388 2.604 . 0 0 "[ . 1 . 2]" 1
74 1 4 MET ME 1 61 SER H . . 5.500 4.973 4.923 5.000 . 0 0 "[ . 1 . 2]" 1
75 1 4 MET ME 1 63 CYS H . . 5.500 4.210 4.149 4.251 . 0 0 "[ . 1 . 2]" 1
76 1 4 MET ME 1 63 CYS HB2 . . 3.510 2.877 2.805 2.935 . 0 0 "[ . 1 . 2]" 1
77 1 4 MET ME 1 64 ASN H . . 4.780 4.260 4.197 4.288 . 0 0 "[ . 1 . 2]" 1
78 1 4 MET ME 1 64 ASN HA . . 5.390 5.025 4.951 5.068 . 0 0 "[ . 1 . 2]" 1
79 1 4 MET HG2 1 7 ILE MD . . 5.500 3.950 3.755 4.214 . 0 0 "[ . 1 . 2]" 1
80 1 4 MET HG2 1 56 PHE HE1 . . 5.500 5.454 5.319 5.512 0.012 2 0 "[ . 1 . 2]" 1
81 1 4 MET HG2 1 60 ILE MD . . 4.250 4.047 4.007 4.061 . 0 0 "[ . 1 . 2]" 1
82 1 4 MET HG2 1 60 ILE HG12 . . 5.240 4.509 4.444 4.566 . 0 0 "[ . 1 . 2]" 1
83 1 4 MET HG2 1 60 ILE MG . . 4.310 3.762 3.667 3.842 . 0 0 "[ . 1 . 2]" 1
84 1 4 MET HG3 1 56 PHE HE1 . . 5.500 4.446 4.298 4.511 . 0 0 "[ . 1 . 2]" 1
85 1 4 MET HG3 1 60 ILE HB . . 5.500 4.929 4.845 4.993 . 0 0 "[ . 1 . 2]" 1
86 1 4 MET HG3 1 60 ILE MD . . 5.030 2.763 2.734 2.795 . 0 0 "[ . 1 . 2]" 1
87 1 4 MET HG3 1 60 ILE HG12 . . 5.460 2.840 2.759 2.909 . 0 0 "[ . 1 . 2]" 1
88 1 4 MET HG3 1 60 ILE HG13 . . 5.500 4.510 4.446 4.568 . 0 0 "[ . 1 . 2]" 1
89 1 4 MET HG3 1 60 ILE MG . . 5.160 2.326 2.223 2.400 . 0 0 "[ . 1 . 2]" 1
90 1 5 GLU H 1 5 GLU HB2 . . 3.870 2.650 2.617 2.688 . 0 0 "[ . 1 . 2]" 1
91 1 5 GLU H 1 5 GLU HB3 . . 2.430 2.412 2.378 2.447 0.017 1 0 "[ . 1 . 2]" 1
92 1 5 GLU H 1 5 GLU HG3 . . 4.630 4.498 4.461 4.529 . 0 0 "[ . 1 . 2]" 1
93 1 5 GLU H 1 6 ARG H . . 3.470 2.790 2.685 2.871 . 0 0 "[ . 1 . 2]" 1
94 1 5 GLU H 1 6 ARG HA . . 5.500 5.353 5.290 5.400 . 0 0 "[ . 1 . 2]" 1
95 1 5 GLU H 1 6 ARG HG2 . . 4.560 3.912 3.765 4.052 . 0 0 "[ . 1 . 2]" 1
96 1 5 GLU H 1 7 ILE H . . 5.500 3.919 3.827 3.994 . 0 0 "[ . 1 . 2]" 1
97 1 5 GLU HA 1 5 GLU HG2 . . 3.870 3.283 3.209 3.514 . 0 0 "[ . 1 . 2]" 1
98 1 5 GLU HA 1 5 GLU HG3 . . 2.790 2.609 2.535 2.696 . 0 0 "[ . 1 . 2]" 1
99 1 5 GLU HA 1 8 PHE H . . 4.480 3.615 3.365 3.779 . 0 0 "[ . 1 . 2]" 1
100 1 5 GLU HA 1 8 PHE HB3 . . 3.920 2.914 2.510 3.227 . 0 0 "[ . 1 . 2]" 1
101 1 5 GLU HA 1 9 LYS HD3 . . 5.060 4.610 4.494 4.675 . 0 0 "[ . 1 . 2]" 1
102 1 5 GLU HA 1 56 PHE HD2 . . 5.130 4.677 4.446 4.856 . 0 0 "[ . 1 . 2]" 1
103 1 5 GLU HA 1 56 PHE HE2 . . 3.020 2.242 2.006 2.422 . 0 0 "[ . 1 . 2]" 1
104 1 5 GLU HB2 1 56 PHE HE2 . . 4.630 4.179 3.715 4.396 . 0 0 "[ . 1 . 2]" 1
105 1 5 GLU HB3 1 6 ARG H . . 3.000 2.316 2.175 2.527 . 0 0 "[ . 1 . 2]" 1
106 1 5 GLU HB3 1 8 PHE H . . 5.500 5.413 5.204 5.518 0.018 9 0 "[ . 1 . 2]" 1
107 1 5 GLU HG2 1 6 ARG H . . 3.400 3.170 2.934 3.392 . 0 0 "[ . 1 . 2]" 1
108 1 5 GLU HG2 1 8 PHE HB3 . . 5.270 5.101 4.638 5.278 0.008 10 0 "[ . 1 . 2]" 1
109 1 5 GLU HG2 1 9 LYS HG2 . . 5.500 4.167 3.833 4.342 . 0 0 "[ . 1 . 2]" 1
110 1 5 GLU HG3 1 6 ARG H . . 5.090 4.286 3.907 4.469 . 0 0 "[ . 1 . 2]" 1
111 1 5 GLU HG3 1 8 PHE HB3 . . 5.190 4.555 4.018 5.008 . 0 0 "[ . 1 . 2]" 1
112 1 5 GLU HG3 1 9 LYS HG2 . . 5.080 4.831 4.118 5.087 0.007 19 0 "[ . 1 . 2]" 1
113 1 5 GLU HG3 1 56 PHE HE2 . . 4.540 3.591 3.091 3.917 . 0 0 "[ . 1 . 2]" 1
114 1 6 ARG H 1 6 ARG HB3 . . 2.820 2.717 2.676 2.740 . 0 0 "[ . 1 . 2]" 1
115 1 6 ARG H 1 6 ARG HD2 . . 4.830 4.358 4.071 4.643 . 0 0 "[ . 1 . 2]" 1
116 1 6 ARG H 1 6 ARG QD . . 4.210 3.902 3.747 4.039 . 0 0 "[ . 1 . 2]" 1
117 1 6 ARG H 1 6 ARG HD3 . . 4.830 4.423 4.023 4.653 . 0 0 "[ . 1 . 2]" 1
118 1 6 ARG H 1 6 ARG HG2 . . 3.650 1.963 1.932 2.018 . 0 0 "[ . 1 . 2]" 1
119 1 6 ARG H 1 6 ARG HG3 . . 3.960 2.866 2.772 3.005 . 0 0 "[ . 1 . 2]" 1
120 1 6 ARG H 1 9 LYS HD3 . . 5.500 5.481 5.400 5.509 0.009 8 0 "[ . 1 . 2]" 1
121 1 6 ARG HA 1 6 ARG HG2 . . 3.850 3.737 3.701 3.776 . 0 0 "[ . 1 . 2]" 1
122 1 6 ARG HA 1 7 ILE HG13 . . 5.500 5.220 5.135 5.280 . 0 0 "[ . 1 . 2]" 1
123 1 6 ARG HA 1 9 LYS HG2 . . 3.500 2.293 2.138 2.493 . 0 0 "[ . 1 . 2]" 1
124 1 6 ARG HA 1 9 LYS HG3 . . 3.210 2.880 2.672 3.143 . 0 0 "[ . 1 . 2]" 1
125 1 6 ARG HB2 1 6 ARG QD . . 3.660 2.490 2.200 2.923 . 0 0 "[ . 1 . 2]" 1
126 1 6 ARG HB2 1 6 ARG HG3 . . 2.820 2.502 2.466 2.539 . 0 0 "[ . 1 . 2]" 1
127 1 6 ARG HB3 1 6 ARG HG2 . . 2.550 2.387 2.355 2.419 . 0 0 "[ . 1 . 2]" 1
128 1 6 ARG QD 1 7 ILE H . . 5.340 4.038 3.831 4.236 . 0 0 "[ . 1 . 2]" 1
129 1 6 ARG QD 1 7 ILE MD . . 5.340 3.768 3.372 4.097 . 0 0 "[ . 1 . 2]" 1
130 1 6 ARG QD 1 7 ILE HG13 . . 4.700 3.473 3.016 3.796 . 0 0 "[ . 1 . 2]" 1
131 1 6 ARG QD 1 74 ALA HA . . 5.340 5.023 4.552 5.334 . 0 0 "[ . 1 . 2]" 1
132 1 6 ARG HD2 1 7 ILE HG13 . . 5.500 4.102 3.078 4.913 . 0 0 "[ . 1 . 2]" 1
133 1 6 ARG HD3 1 7 ILE HG13 . . 5.500 4.014 3.644 4.833 . 0 0 "[ . 1 . 2]" 1
134 1 6 ARG HG2 1 7 ILE HA . . 5.500 5.240 5.140 5.438 . 0 0 "[ . 1 . 2]" 1
135 1 6 ARG HG2 1 7 ILE HG13 . . 3.850 3.653 3.521 3.852 0.002 8 0 "[ . 1 . 2]" 1
136 1 6 ARG HG3 1 7 ILE H . . 4.180 2.054 1.949 2.119 . 0 0 "[ . 1 . 2]" 1
137 1 6 ARG HG3 1 7 ILE HA . . 5.500 3.647 3.571 3.812 . 0 0 "[ . 1 . 2]" 1
138 1 6 ARG HG3 1 8 PHE H . . 4.670 4.583 4.445 4.671 0.001 12 0 "[ . 1 . 2]" 1
139 1 7 ILE H 1 7 ILE HB . . 2.900 2.483 2.465 2.499 . 0 0 "[ . 1 . 2]" 1
140 1 7 ILE H 1 7 ILE MD . . 4.110 3.252 3.137 3.343 . 0 0 "[ . 1 . 2]" 1
141 1 7 ILE H 1 7 ILE HG12 . . 3.850 3.725 3.653 3.801 . 0 0 "[ . 1 . 2]" 1
142 1 7 ILE H 1 7 ILE HG13 . . 3.120 2.270 2.209 2.343 . 0 0 "[ . 1 . 2]" 1
143 1 7 ILE H 1 8 PHE H . . 2.870 2.558 2.480 2.624 . 0 0 "[ . 1 . 2]" 1
144 1 7 ILE H 1 8 PHE HA . . 5.500 5.169 5.095 5.228 . 0 0 "[ . 1 . 2]" 1
145 1 7 ILE H 1 8 PHE HB3 . . 5.270 4.736 4.587 4.858 . 0 0 "[ . 1 . 2]" 1
146 1 7 ILE H 1 10 ARG HG2 . . 5.500 5.220 4.981 5.387 . 0 0 "[ . 1 . 2]" 1
147 1 7 ILE HA 1 7 ILE HG12 . . 3.180 2.767 2.694 2.846 . 0 0 "[ . 1 . 2]" 1
148 1 7 ILE HA 1 7 ILE HG13 . . 3.060 2.690 2.610 2.750 . 0 0 "[ . 1 . 2]" 1
149 1 7 ILE HA 1 7 ILE MG . . 3.130 2.337 2.315 2.352 . 0 0 "[ . 1 . 2]" 1
150 1 7 ILE HA 1 9 LYS H . . 4.610 3.878 3.799 4.005 . 0 0 "[ . 1 . 2]" 1
151 1 7 ILE HA 1 10 ARG H . . 3.830 3.548 3.409 3.632 . 0 0 "[ . 1 . 2]" 1
152 1 7 ILE HA 1 10 ARG HB2 . . 4.200 3.859 3.641 3.994 . 0 0 "[ . 1 . 2]" 1
153 1 7 ILE HA 1 10 ARG QD . . 5.340 4.499 4.128 4.907 . 0 0 "[ . 1 . 2]" 1
154 1 7 ILE HA 1 10 ARG HG2 . . 3.900 2.818 2.564 3.033 . 0 0 "[ . 1 . 2]" 1
155 1 7 ILE HA 1 11 PHE H . . 5.380 4.794 4.634 4.894 . 0 0 "[ . 1 . 2]" 1
156 1 7 ILE HA 1 77 PHE HA . . 5.500 4.579 4.471 4.657 . 0 0 "[ . 1 . 2]" 1
157 1 7 ILE HA 1 77 PHE HB2 . . 5.030 5.023 4.917 5.061 0.031 15 0 "[ . 1 . 2]" 1
158 1 7 ILE HA 1 77 PHE HB3 . . 3.540 3.525 3.272 3.572 0.032 12 0 "[ . 1 . 2]" 1
159 1 7 ILE HA 1 77 PHE HD2 . . 5.500 5.074 4.465 5.210 . 0 0 "[ . 1 . 2]" 1
160 1 7 ILE HB 1 7 ILE MD . . 2.400 2.127 2.087 2.166 . 0 0 "[ . 1 . 2]" 1
161 1 7 ILE HB 1 7 ILE HG13 . . 2.850 2.633 2.596 2.678 . 0 0 "[ . 1 . 2]" 1
162 1 7 ILE HB 1 8 PHE H . . 3.090 2.755 2.640 2.852 . 0 0 "[ . 1 . 2]" 1
163 1 7 ILE HB 1 8 PHE HA . . 4.940 4.279 4.253 4.298 . 0 0 "[ . 1 . 2]" 1
164 1 7 ILE HB 1 8 PHE HB2 . . 5.500 4.498 4.392 4.606 . 0 0 "[ . 1 . 2]" 1
165 1 7 ILE HB 1 8 PHE HB3 . . 5.500 5.106 4.990 5.282 . 0 0 "[ . 1 . 2]" 1
166 1 7 ILE HB 1 10 ARG H . . 5.500 5.458 5.393 5.505 0.005 8 0 "[ . 1 . 2]" 1
167 1 7 ILE MD 1 8 PHE H . . 5.500 4.402 4.355 4.439 . 0 0 "[ . 1 . 2]" 1
168 1 7 ILE MD 1 70 MET HA . . 5.500 4.167 4.055 4.294 . 0 0 "[ . 1 . 2]" 1
169 1 7 ILE MD 1 73 VAL H . . 5.500 5.129 5.065 5.179 . 0 0 "[ . 1 . 2]" 1
170 1 7 ILE MD 1 73 VAL HA . . 5.500 5.168 5.082 5.182 . 0 0 "[ . 1 . 2]" 1
171 1 7 ILE MD 1 73 VAL HB . . 5.500 5.006 4.907 5.053 . 0 0 "[ . 1 . 2]" 1
172 1 7 ILE MD 1 74 ALA H . . 4.220 3.346 3.262 3.458 . 0 0 "[ . 1 . 2]" 1
173 1 7 ILE MD 1 74 ALA HA . . 3.630 2.287 2.208 2.395 . 0 0 "[ . 1 . 2]" 1
174 1 7 ILE MD 1 74 ALA MB . . 4.070 2.002 1.875 2.256 . 0 0 "[ . 1 . 2]" 1
175 1 7 ILE MD 1 77 PHE HB2 . . 5.500 4.781 4.532 4.861 . 0 0 "[ . 1 . 2]" 1
176 1 7 ILE MD 1 77 PHE HB3 . . 5.500 4.585 4.206 4.702 . 0 0 "[ . 1 . 2]" 1
177 1 7 ILE HG12 1 8 PHE H . . 5.260 5.172 5.098 5.231 . 0 0 "[ . 1 . 2]" 1
178 1 7 ILE HG12 1 74 ALA HA . . 4.450 2.495 2.342 2.816 . 0 0 "[ . 1 . 2]" 1
179 1 7 ILE HG12 1 76 VAL H . . 5.500 5.524 5.507 5.544 0.044 20 0 "[ . 1 . 2]" 1
180 1 7 ILE HG12 1 77 PHE HB2 . . 4.330 4.035 3.668 4.216 . 0 0 "[ . 1 . 2]" 1
181 1 7 ILE HG12 1 77 PHE HB3 . . 4.120 3.445 2.872 3.695 . 0 0 "[ . 1 . 2]" 1
182 1 7 ILE HG13 1 7 ILE MG . . 3.480 3.153 3.131 3.168 . 0 0 "[ . 1 . 2]" 1
183 1 7 ILE HG13 1 8 PHE H . . 4.600 4.347 4.306 4.391 . 0 0 "[ . 1 . 2]" 1
184 1 7 ILE HG13 1 74 ALA HA . . 4.320 3.549 3.461 3.702 . 0 0 "[ . 1 . 2]" 1
185 1 7 ILE HG13 1 77 PHE HB3 . . 5.500 4.875 4.303 5.146 . 0 0 "[ . 1 . 2]" 1
186 1 7 ILE MG 1 8 PHE H . . 4.100 3.537 3.448 3.640 . 0 0 "[ . 1 . 2]" 1
187 1 7 ILE MG 1 8 PHE HA . . 4.800 3.553 3.501 3.622 . 0 0 "[ . 1 . 2]" 1
188 1 7 ILE MG 1 9 LYS H . . 5.500 4.670 4.615 4.752 . 0 0 "[ . 1 . 2]" 1
189 1 7 ILE MG 1 10 ARG H . . 4.590 3.988 3.928 4.073 . 0 0 "[ . 1 . 2]" 1
190 1 7 ILE MG 1 10 ARG HB2 . . 3.830 3.259 3.094 3.392 . 0 0 "[ . 1 . 2]" 1
191 1 7 ILE MG 1 11 PHE H . . 5.330 3.735 3.632 3.838 . 0 0 "[ . 1 . 2]" 1
192 1 7 ILE MG 1 74 ALA HA . . 5.240 3.719 3.538 4.051 . 0 0 "[ . 1 . 2]" 1
193 1 7 ILE MG 1 77 PHE HB2 . . 4.200 3.270 3.198 3.322 . 0 0 "[ . 1 . 2]" 1
194 1 7 ILE MG 1 77 PHE HB3 . . 3.580 2.249 2.092 2.331 . 0 0 "[ . 1 . 2]" 1
195 1 8 PHE H 1 8 PHE HB2 . . 3.340 2.585 2.453 2.699 . 0 0 "[ . 1 . 2]" 1
196 1 8 PHE H 1 8 PHE HB3 . . 3.520 2.479 2.374 2.610 . 0 0 "[ . 1 . 2]" 1
197 1 8 PHE H 1 9 LYS H . . 2.830 2.646 2.611 2.714 . 0 0 "[ . 1 . 2]" 1
198 1 8 PHE H 1 9 LYS HG2 . . 5.500 3.824 3.743 3.966 . 0 0 "[ . 1 . 2]" 1
199 1 8 PHE H 1 10 ARG H . . 5.150 4.200 4.136 4.311 . 0 0 "[ . 1 . 2]" 1
200 1 8 PHE H 1 10 ARG HG2 . . 5.290 5.120 4.880 5.281 . 0 0 "[ . 1 . 2]" 1
201 1 8 PHE HA 1 8 PHE HB2 . . 2.720 2.429 2.379 2.496 . 0 0 "[ . 1 . 2]" 1
202 1 8 PHE HA 1 9 LYS HG2 . . 5.380 5.305 5.262 5.385 0.005 8 0 "[ . 1 . 2]" 1
203 1 8 PHE HA 1 10 ARG H . . 5.420 3.781 3.720 4.125 . 0 0 "[ . 1 . 2]" 1
204 1 8 PHE HA 1 11 PHE H . . 3.920 3.387 3.308 3.512 . 0 0 "[ . 1 . 2]" 1
205 1 8 PHE HA 1 11 PHE HB2 . . 3.740 2.794 2.734 2.941 . 0 0 "[ . 1 . 2]" 1
206 1 8 PHE HA 1 11 PHE HD1 . . 3.810 3.304 3.081 3.607 . 0 0 "[ . 1 . 2]" 1
207 1 8 PHE HA 1 12 ASP H . . 4.880 3.982 3.886 4.134 . 0 0 "[ . 1 . 2]" 1
208 1 8 PHE HB3 1 9 LYS H . . 3.680 2.960 2.805 3.049 . 0 0 "[ . 1 . 2]" 1
209 1 8 PHE HB3 1 9 LYS HD2 . . 5.500 3.320 3.190 3.432 . 0 0 "[ . 1 . 2]" 1
210 1 8 PHE HB3 1 9 LYS HG2 . . 4.480 3.846 3.779 3.898 . 0 0 "[ . 1 . 2]" 1
211 1 8 PHE HB3 1 10 ARG H . . 5.310 5.035 4.976 5.132 . 0 0 "[ . 1 . 2]" 1
212 1 9 LYS H 1 9 LYS HB2 . . 2.740 2.702 2.690 2.714 . 0 0 "[ . 1 . 2]" 1
213 1 9 LYS H 1 9 LYS HD2 . . 3.590 2.792 2.667 2.847 . 0 0 "[ . 1 . 2]" 1
214 1 9 LYS H 1 9 LYS HE2 . . 5.500 4.613 4.370 5.199 . 0 0 "[ . 1 . 2]" 1
215 1 9 LYS H 1 9 LYS HE3 . . 5.500 4.881 4.407 5.167 . 0 0 "[ . 1 . 2]" 1
216 1 9 LYS H 1 9 LYS HG2 . . 3.170 1.945 1.936 1.966 . 0 0 "[ . 1 . 2]" 1
217 1 9 LYS H 1 9 LYS HG3 . . 3.610 3.512 3.504 3.530 . 0 0 "[ . 1 . 2]" 1
218 1 9 LYS H 1 10 ARG H . . 2.800 2.594 2.514 2.691 . 0 0 "[ . 1 . 2]" 1
219 1 9 LYS H 1 10 ARG HG2 . . 4.840 3.851 3.703 3.995 . 0 0 "[ . 1 . 2]" 1
220 1 9 LYS H 1 11 PHE HB2 . . 5.500 5.495 5.429 5.532 0.032 1 0 "[ . 1 . 2]" 1
221 1 9 LYS H 1 11 PHE HD1 . . 5.500 5.197 5.083 5.392 . 0 0 "[ . 1 . 2]" 1
222 1 9 LYS H 1 12 ASP H . . 5.020 4.854 4.727 4.919 . 0 0 "[ . 1 . 2]" 1
223 1 9 LYS HA 1 9 LYS HB3 . . 2.440 2.378 2.365 2.388 . 0 0 "[ . 1 . 2]" 1
224 1 9 LYS HA 1 9 LYS HD2 . . 3.390 2.204 2.173 2.242 . 0 0 "[ . 1 . 2]" 1
225 1 9 LYS HA 1 9 LYS QE . . 3.530 2.413 2.332 2.956 . 0 0 "[ . 1 . 2]" 1
226 1 9 LYS HA 1 10 ARG QD . . 5.340 5.189 4.914 5.335 . 0 0 "[ . 1 . 2]" 1
227 1 9 LYS HA 1 11 PHE H . . 5.120 4.990 4.797 5.054 . 0 0 "[ . 1 . 2]" 1
228 1 9 LYS HA 1 12 ASP H . . 4.010 3.844 3.569 3.900 . 0 0 "[ . 1 . 2]" 1
229 1 9 LYS HA 1 12 ASP HB3 . . 3.470 3.051 2.684 3.127 . 0 0 "[ . 1 . 2]" 1
230 1 9 LYS HB2 1 10 ARG H . . 3.450 3.004 2.699 3.032 . 0 0 "[ . 1 . 2]" 1
231 1 9 LYS HB2 1 10 ARG QD . . 4.010 3.376 2.938 3.650 . 0 0 "[ . 1 . 2]" 1
232 1 9 LYS HB3 1 9 LYS QE . . 3.120 2.085 1.994 2.175 . 0 0 "[ . 1 . 2]" 1
233 1 9 LYS HD2 1 10 ARG H . . 5.080 4.785 4.731 4.823 . 0 0 "[ . 1 . 2]" 1
234 1 9 LYS QE 1 9 LYS HG2 . . 3.720 3.433 3.304 3.523 . 0 0 "[ . 1 . 2]" 1
235 1 9 LYS QE 1 9 LYS HG3 . . 3.540 2.743 2.313 2.993 . 0 0 "[ . 1 . 2]" 1
236 1 9 LYS QE 1 12 ASP HB3 . . 4.780 4.515 4.294 4.798 0.018 8 0 "[ . 1 . 2]" 1
237 1 9 LYS HE2 1 9 LYS HG3 . . 4.180 2.906 2.350 3.243 . 0 0 "[ . 1 . 2]" 1
238 1 9 LYS HE3 1 9 LYS HG3 . . 4.180 3.489 2.434 3.723 . 0 0 "[ . 1 . 2]" 1
239 1 10 ARG H 1 10 ARG HB2 . . 2.710 2.622 2.587 2.672 . 0 0 "[ . 1 . 2]" 1
240 1 10 ARG H 1 10 ARG HB3 . . 3.660 3.630 3.590 3.638 . 0 0 "[ . 1 . 2]" 1
241 1 10 ARG H 1 10 ARG QD . . 3.930 3.353 3.072 3.517 . 0 0 "[ . 1 . 2]" 1
242 1 10 ARG H 1 10 ARG HG2 . . 3.170 2.113 1.950 2.182 . 0 0 "[ . 1 . 2]" 1
243 1 10 ARG H 1 11 PHE H . . 3.060 2.539 2.505 2.709 . 0 0 "[ . 1 . 2]" 1
244 1 10 ARG H 1 11 PHE HA . . 5.500 5.141 5.114 5.299 . 0 0 "[ . 1 . 2]" 1
245 1 10 ARG H 1 11 PHE HB2 . . 5.070 4.443 4.403 4.670 . 0 0 "[ . 1 . 2]" 1
246 1 10 ARG H 1 11 PHE HD1 . . 5.500 3.680 3.604 3.875 . 0 0 "[ . 1 . 2]" 1
247 1 10 ARG HA 1 10 ARG HB3 . . 2.550 2.393 2.370 2.408 . 0 0 "[ . 1 . 2]" 1
248 1 10 ARG HA 1 10 ARG QD . . 2.550 2.104 2.010 2.283 . 0 0 "[ . 1 . 2]" 1
249 1 10 ARG HA 1 10 ARG HG2 . . 3.680 3.178 3.103 3.268 . 0 0 "[ . 1 . 2]" 1
250 1 10 ARG HA 1 11 PHE HA . . 4.910 4.802 4.773 4.816 . 0 0 "[ . 1 . 2]" 1
251 1 10 ARG HA 1 11 PHE HD1 . . 5.390 5.173 4.994 5.221 . 0 0 "[ . 1 . 2]" 1
252 1 10 ARG HA 1 12 ASP HB3 . . 5.500 5.526 5.508 5.562 0.062 8 0 "[ . 1 . 2]" 1
253 1 10 ARG HB2 1 10 ARG HG2 . . 2.990 2.483 2.431 2.510 . 0 0 "[ . 1 . 2]" 1
254 1 10 ARG HB2 1 11 PHE H . . 3.570 2.264 2.218 2.320 . 0 0 "[ . 1 . 2]" 1
255 1 10 ARG HB2 1 11 PHE HB2 . . 5.500 4.493 4.453 4.539 . 0 0 "[ . 1 . 2]" 1
256 1 10 ARG HB2 1 11 PHE HB3 . . 5.500 5.529 5.514 5.550 0.050 12 0 "[ . 1 . 2]" 1
257 1 10 ARG HB2 1 11 PHE HD1 . . 4.290 2.734 2.501 2.817 . 0 0 "[ . 1 . 2]" 1
258 1 10 ARG HB2 1 27 ALA MB . . 5.400 4.521 4.349 4.610 . 0 0 "[ . 1 . 2]" 1
259 1 10 ARG HB2 1 77 PHE HB2 . . 5.340 4.874 4.740 5.103 . 0 0 "[ . 1 . 2]" 1
260 1 10 ARG HB2 1 77 PHE HB3 . . 4.450 3.283 3.112 3.643 . 0 0 "[ . 1 . 2]" 1
261 1 10 ARG HB2 1 77 PHE HD2 . . 4.370 2.690 2.478 2.797 . 0 0 "[ . 1 . 2]" 1
262 1 10 ARG HB3 1 10 ARG QD . . 3.660 2.554 2.321 2.897 . 0 0 "[ . 1 . 2]" 1
263 1 10 ARG HB3 1 10 ARG HG3 . . 2.590 2.472 2.421 2.500 . 0 0 "[ . 1 . 2]" 1
264 1 10 ARG HB3 1 11 PHE H . . 3.760 3.538 3.491 3.583 . 0 0 "[ . 1 . 2]" 1
265 1 10 ARG HB3 1 11 PHE HD1 . . 4.570 4.354 4.060 4.460 . 0 0 "[ . 1 . 2]" 1
266 1 10 ARG HB3 1 27 ALA HA . . 5.500 5.476 5.269 5.528 0.028 18 0 "[ . 1 . 2]" 1
267 1 10 ARG HB3 1 77 PHE HD2 . . 4.270 3.336 3.168 3.440 . 0 0 "[ . 1 . 2]" 1
268 1 10 ARG QD 1 10 ARG HG2 . . 2.600 2.209 2.145 2.422 . 0 0 "[ . 1 . 2]" 1
269 1 10 ARG QD 1 77 PHE HD2 . . 5.340 5.225 4.920 5.347 0.007 8 0 "[ . 1 . 2]" 1
270 1 10 ARG HG2 1 11 PHE HD1 . . 5.040 4.510 4.364 4.633 . 0 0 "[ . 1 . 2]" 1
271 1 10 ARG HG3 1 11 PHE HD1 . . 5.500 4.703 4.579 4.796 . 0 0 "[ . 1 . 2]" 1
272 1 10 ARG HG3 1 77 PHE HA . . 5.500 2.616 2.457 2.886 . 0 0 "[ . 1 . 2]" 1
273 1 10 ARG HG3 1 77 PHE HB2 . . 4.500 4.357 4.223 4.507 0.007 3 0 "[ . 1 . 2]" 1
274 1 10 ARG HG3 1 77 PHE HB3 . . 4.720 2.944 2.804 3.099 . 0 0 "[ . 1 . 2]" 1
275 1 10 ARG HG3 1 77 PHE HD2 . . 4.310 3.761 3.497 3.887 . 0 0 "[ . 1 . 2]" 1
276 1 11 PHE H 1 11 PHE HB2 . . 3.020 2.368 2.327 2.391 . 0 0 "[ . 1 . 2]" 1
277 1 11 PHE H 1 11 PHE HB3 . . 3.630 3.572 3.562 3.577 . 0 0 "[ . 1 . 2]" 1
278 1 11 PHE H 1 11 PHE HD1 . . 4.980 1.945 1.930 1.982 . 0 0 "[ . 1 . 2]" 1
279 1 11 PHE H 1 11 PHE HE1 . . 5.310 4.260 4.224 4.328 . 0 0 "[ . 1 . 2]" 1
280 1 11 PHE H 1 12 ASP H . . 2.850 2.704 2.627 2.736 . 0 0 "[ . 1 . 2]" 1
281 1 11 PHE H 1 12 ASP HA . . 5.500 5.324 5.262 5.350 . 0 0 "[ . 1 . 2]" 1
282 1 11 PHE H 1 12 ASP HB3 . . 5.210 4.942 4.855 4.997 . 0 0 "[ . 1 . 2]" 1
283 1 11 PHE H 1 19 ILE MD . . 4.600 4.131 4.013 4.201 . 0 0 "[ . 1 . 2]" 1
284 1 11 PHE H 1 19 ILE MG . . 5.500 4.931 4.894 4.955 . 0 0 "[ . 1 . 2]" 1
285 1 11 PHE H 1 27 ALA MB . . 5.500 4.535 4.436 4.610 . 0 0 "[ . 1 . 2]" 1
286 1 11 PHE HA 1 11 PHE HB3 . . 2.700 2.568 2.555 2.582 . 0 0 "[ . 1 . 2]" 1
287 1 11 PHE HA 1 11 PHE HD1 . . 3.910 3.573 3.406 3.648 . 0 0 "[ . 1 . 2]" 1
288 1 11 PHE HA 1 11 PHE HD2 . . 4.120 3.392 3.332 3.545 . 0 0 "[ . 1 . 2]" 1
289 1 11 PHE HA 1 19 ILE MD . . 4.500 3.877 3.721 3.972 . 0 0 "[ . 1 . 2]" 1
290 1 11 PHE HA 1 27 ALA MB . . 3.980 2.962 2.791 3.014 . 0 0 "[ . 1 . 2]" 1
291 1 11 PHE HB2 1 11 PHE HD1 . . 3.650 2.561 2.535 2.633 . 0 0 "[ . 1 . 2]" 1
292 1 11 PHE HB2 1 12 ASP H . . 3.240 2.929 2.880 2.995 . 0 0 "[ . 1 . 2]" 1
293 1 11 PHE HB2 1 19 ILE HB . . 5.500 5.592 5.570 5.617 0.117 15 0 "[ . 1 . 2]" 1
294 1 11 PHE HB2 1 19 ILE MD . . 3.050 2.559 2.402 2.636 . 0 0 "[ . 1 . 2]" 1
295 1 11 PHE HB2 1 19 ILE HG13 . . 3.300 3.336 3.312 3.374 0.074 4 0 "[ . 1 . 2]" 1
296 1 11 PHE HB2 1 19 ILE MG . . 4.020 3.485 3.457 3.515 . 0 0 "[ . 1 . 2]" 1
297 1 11 PHE HB2 1 27 ALA MB . . 5.500 4.761 4.732 4.777 . 0 0 "[ . 1 . 2]" 1
298 1 11 PHE HB3 1 12 ASP H . . 3.720 3.715 3.671 3.746 0.026 8 0 "[ . 1 . 2]" 1
299 1 11 PHE HB3 1 12 ASP HA . . 5.500 4.375 4.345 4.392 . 0 0 "[ . 1 . 2]" 1
300 1 11 PHE HB3 1 13 THR H . . 5.500 5.129 5.083 5.174 . 0 0 "[ . 1 . 2]" 1
301 1 11 PHE HB3 1 19 ILE MD . . 2.940 2.497 2.313 2.569 . 0 0 "[ . 1 . 2]" 1
302 1 11 PHE HB3 1 19 ILE HG12 . . 4.640 4.129 3.987 4.193 . 0 0 "[ . 1 . 2]" 1
303 1 11 PHE HB3 1 19 ILE HG13 . . 4.360 2.488 2.345 2.588 . 0 0 "[ . 1 . 2]" 1
304 1 11 PHE HB3 1 19 ILE MG . . 3.910 1.949 1.939 1.961 . 0 0 "[ . 1 . 2]" 1
305 1 11 PHE HB3 1 27 ALA MB . . 5.500 4.089 4.032 4.178 . 0 0 "[ . 1 . 2]" 1
306 1 11 PHE HD1 1 12 ASP H . . 5.500 4.391 4.354 4.450 . 0 0 "[ . 1 . 2]" 1
307 1 11 PHE HD2 1 19 ILE HB . . 5.160 4.897 4.673 5.052 . 0 0 "[ . 1 . 2]" 1
308 1 11 PHE HD2 1 19 ILE HG13 . . 4.070 3.881 3.652 4.039 . 0 0 "[ . 1 . 2]" 1
309 1 11 PHE HD2 1 19 ILE MG . . 3.430 2.829 2.725 2.916 . 0 0 "[ . 1 . 2]" 1
310 1 11 PHE HE1 1 77 PHE HB2 . . 4.500 3.563 3.375 3.753 . 0 0 "[ . 1 . 2]" 1
311 1 11 PHE HE1 1 77 PHE HB3 . . 3.970 2.852 2.638 3.088 . 0 0 "[ . 1 . 2]" 1
312 1 12 ASP H 1 12 ASP HB2 . . 3.450 2.844 2.803 2.867 . 0 0 "[ . 1 . 2]" 1
313 1 12 ASP H 1 12 ASP HB3 . . 3.120 2.438 2.416 2.457 . 0 0 "[ . 1 . 2]" 1
314 1 12 ASP H 1 19 ILE MD . . 3.170 2.740 2.688 2.757 . 0 0 "[ . 1 . 2]" 1
315 1 12 ASP H 1 19 ILE HG12 . . 5.500 5.667 5.572 5.703 0.203 8 0 "[ . 1 . 2]" 1
316 1 12 ASP H 1 19 ILE HG13 . . 5.100 4.898 4.845 4.959 . 0 0 "[ . 1 . 2]" 1
317 1 12 ASP HA 1 13 THR H . . 3.030 2.517 2.505 2.527 . 0 0 "[ . 1 . 2]" 1
318 1 12 ASP HA 1 14 ASN H . . 3.880 3.107 3.096 3.128 . 0 0 "[ . 1 . 2]" 1
319 1 12 ASP HA 1 14 ASN HB3 . . 5.500 4.236 4.228 4.248 . 0 0 "[ . 1 . 2]" 1
320 1 12 ASP HA 1 18 LYS HA . . 5.500 5.533 5.481 5.553 0.053 16 0 "[ . 1 . 2]" 1
321 1 12 ASP HA 1 19 ILE HA . . 5.500 3.174 3.086 3.214 . 0 0 "[ . 1 . 2]" 1
322 1 12 ASP HA 1 19 ILE MD . . 3.330 1.848 1.831 1.881 . 0 0 "[ . 1 . 2]" 1
323 1 12 ASP HA 1 19 ILE MG . . 5.500 3.234 3.125 3.325 . 0 0 "[ . 1 . 2]" 1
324 1 12 ASP HA 1 20 SER H . . 5.500 4.708 4.588 4.757 . 0 0 "[ . 1 . 2]" 1
325 1 12 ASP HB2 1 13 THR H . . 4.770 4.647 4.642 4.650 . 0 0 "[ . 1 . 2]" 1
326 1 12 ASP HB2 1 17 GLY H . . 5.190 4.053 3.937 4.143 . 0 0 "[ . 1 . 2]" 1
327 1 12 ASP HB2 1 18 LYS H . . 5.000 3.846 3.725 3.964 . 0 0 "[ . 1 . 2]" 1
328 1 12 ASP HB3 1 13 THR H . . 4.580 4.445 4.436 4.457 . 0 0 "[ . 1 . 2]" 1
329 1 12 ASP HB3 1 15 GLY H . . 4.730 3.831 3.804 3.869 . 0 0 "[ . 1 . 2]" 1
330 1 12 ASP HB3 1 15 GLY HA2 . . 5.500 3.735 3.703 3.789 . 0 0 "[ . 1 . 2]" 1
331 1 12 ASP HB3 1 16 ASP H . . 5.500 4.691 4.650 4.733 . 0 0 "[ . 1 . 2]" 1
332 1 12 ASP HB3 1 17 GLY H . . 5.300 4.400 4.286 4.491 . 0 0 "[ . 1 . 2]" 1
333 1 12 ASP HB3 1 19 ILE MD . . 4.840 3.206 3.174 3.226 . 0 0 "[ . 1 . 2]" 1
334 1 13 THR H 1 13 THR HB . . 3.670 2.454 2.436 2.464 . 0 0 "[ . 1 . 2]" 1
335 1 13 THR H 1 14 ASN HA . . 5.480 5.282 5.278 5.288 . 0 0 "[ . 1 . 2]" 1
336 1 13 THR H 1 14 ASN HB3 . . 5.500 4.793 4.788 4.805 . 0 0 "[ . 1 . 2]" 1
337 1 13 THR H 1 19 ILE MD . . 5.500 3.704 3.627 3.752 . 0 0 "[ . 1 . 2]" 1
338 1 13 THR H 1 19 ILE MG . . 5.500 3.867 3.772 3.941 . 0 0 "[ . 1 . 2]" 1
339 1 13 THR H 1 23 GLU HB3 . . 3.380 1.938 1.923 1.946 . 0 0 "[ . 1 . 2]" 1
340 1 13 THR H 1 23 GLU QG . . 3.120 3.075 3.026 3.112 . 0 0 "[ . 1 . 2]" 1
341 1 13 THR HA 1 13 THR MG . . 2.860 2.473 2.465 2.489 . 0 0 "[ . 1 . 2]" 1
342 1 13 THR HA 1 15 GLY H . . 5.500 3.707 3.673 3.727 . 0 0 "[ . 1 . 2]" 1
343 1 13 THR HA 1 23 GLU HA . . 5.500 5.307 5.263 5.349 . 0 0 "[ . 1 . 2]" 1
344 1 13 THR HB 1 14 ASN H . . 3.550 3.108 3.087 3.118 . 0 0 "[ . 1 . 2]" 1
345 1 13 THR HB 1 14 ASN HB2 . . 5.100 4.640 4.629 4.655 . 0 0 "[ . 1 . 2]" 1
346 1 13 THR HB 1 19 ILE MG . . 5.500 5.094 5.017 5.146 . 0 0 "[ . 1 . 2]" 1
347 1 13 THR HB 1 23 GLU HB3 . . 4.670 2.640 2.606 2.678 . 0 0 "[ . 1 . 2]" 1
348 1 13 THR HB 1 23 GLU QG . . 3.010 2.207 2.174 2.239 . 0 0 "[ . 1 . 2]" 1
349 1 13 THR MG 1 14 ASN H . . 4.950 3.621 3.571 3.642 . 0 0 "[ . 1 . 2]" 1
350 1 13 THR MG 1 14 ASN HA . . 5.500 3.419 3.372 3.440 . 0 0 "[ . 1 . 2]" 1
351 1 13 THR MG 1 14 ASN HB2 . . 5.500 4.414 4.365 4.446 . 0 0 "[ . 1 . 2]" 1
352 1 13 THR MG 1 14 ASN HB3 . . 5.500 5.102 5.061 5.123 . 0 0 "[ . 1 . 2]" 1
353 1 13 THR MG 1 15 GLY H . . 5.310 4.609 4.570 4.633 . 0 0 "[ . 1 . 2]" 1
354 1 13 THR MG 1 23 GLU HA . . 3.990 3.670 3.648 3.690 . 0 0 "[ . 1 . 2]" 1
355 1 13 THR MG 1 23 GLU HG2 . . 5.110 3.365 3.334 3.383 . 0 0 "[ . 1 . 2]" 1
356 1 13 THR MG 1 23 GLU QG . . 4.300 3.290 3.263 3.304 . 0 0 "[ . 1 . 2]" 1
357 1 13 THR MG 1 23 GLU HG3 . . 5.110 4.639 4.629 4.655 . 0 0 "[ . 1 . 2]" 1
358 1 14 ASN H 1 14 ASN HB2 . . 3.540 2.871 2.851 2.884 . 0 0 "[ . 1 . 2]" 1
359 1 14 ASN H 1 14 ASN HB3 . . 3.140 2.325 2.322 2.329 . 0 0 "[ . 1 . 2]" 1
360 1 14 ASN H 1 14 ASN QD . . 5.020 4.326 4.320 4.329 . 0 0 "[ . 1 . 2]" 1
361 1 14 ASN H 1 15 GLY H . . 2.550 2.409 2.392 2.434 . 0 0 "[ . 1 . 2]" 1
362 1 14 ASN H 1 17 GLY H . . 5.500 5.545 5.485 5.571 0.071 13 0 "[ . 1 . 2]" 1
363 1 14 ASN H 1 23 GLU HA . . 5.100 4.741 4.702 4.765 . 0 0 "[ . 1 . 2]" 1
364 1 14 ASN H 1 23 GLU HG2 . . 4.050 2.394 2.297 2.435 . 0 0 "[ . 1 . 2]" 1
365 1 14 ASN H 1 23 GLU HG3 . . 4.050 3.832 3.752 3.864 . 0 0 "[ . 1 . 2]" 1
366 1 14 ASN HA 1 16 ASP H . . 5.270 4.813 4.770 4.834 . 0 0 "[ . 1 . 2]" 1
367 1 14 ASN HB2 1 14 ASN QD . . 3.080 2.781 2.778 2.788 . 0 0 "[ . 1 . 2]" 1
368 1 14 ASN HB2 1 15 GLY H . . 4.460 4.351 4.347 4.358 . 0 0 "[ . 1 . 2]" 1
369 1 14 ASN HB2 1 16 ASP H . . 5.500 4.894 4.852 4.917 . 0 0 "[ . 1 . 2]" 1
370 1 14 ASN HB2 1 16 ASP QB . . 4.910 4.244 4.194 4.260 . 0 0 "[ . 1 . 2]" 1
371 1 14 ASN HB2 1 23 GLU HA . . 5.500 5.638 5.582 5.655 0.155 6 0 "[ . 1 . 2]" 1
372 1 14 ASN HB2 1 23 GLU HG2 . . 4.320 2.915 2.883 2.945 . 0 0 "[ . 1 . 2]" 1
373 1 14 ASN HB2 1 23 GLU QG . . 3.750 2.751 2.710 2.776 . 0 0 "[ . 1 . 2]" 1
374 1 14 ASN HB2 1 23 GLU HG3 . . 4.320 3.376 3.296 3.407 . 0 0 "[ . 1 . 2]" 1
375 1 14 ASN HB3 1 14 ASN QD . . 3.080 3.310 3.308 3.311 0.231 16 0 "[ . 1 . 2]" 1
376 1 14 ASN HB3 1 15 GLY H . . 3.690 3.345 3.337 3.362 . 0 0 "[ . 1 . 2]" 1
377 1 14 ASN HB3 1 15 GLY HA2 . . 5.500 5.078 5.067 5.094 . 0 0 "[ . 1 . 2]" 1
378 1 14 ASN HB3 1 15 GLY HA3 . . 5.500 5.361 5.358 5.365 . 0 0 "[ . 1 . 2]" 1
379 1 14 ASN HB3 1 16 ASP H . . 3.580 3.357 3.308 3.381 . 0 0 "[ . 1 . 2]" 1
380 1 14 ASN QD 1 15 GLY H . . 5.500 4.347 4.343 4.349 . 0 0 "[ . 1 . 2]" 1
381 1 14 ASN QD 1 16 ASP H . . 4.870 4.332 4.322 4.349 . 0 0 "[ . 1 . 2]" 1
382 1 14 ASN QD 1 16 ASP QB . . 3.070 2.854 2.804 2.944 . 0 0 "[ . 1 . 2]" 1
383 1 15 GLY H 1 15 GLY HA2 . . 2.400 2.301 2.300 2.303 . 0 0 "[ . 1 . 2]" 1
384 1 15 GLY H 1 16 ASP H . . 3.000 2.918 2.895 2.933 . 0 0 "[ . 1 . 2]" 1
385 1 15 GLY H 1 17 GLY H . . 4.400 4.279 4.246 4.297 . 0 0 "[ . 1 . 2]" 1
386 1 15 GLY HA2 1 16 ASP H . . 3.320 2.773 2.761 2.798 . 0 0 "[ . 1 . 2]" 1
387 1 15 GLY HA2 1 16 ASP HA . . 5.290 4.451 4.446 4.458 . 0 0 "[ . 1 . 2]" 1
388 1 15 GLY HA2 1 17 GLY H . . 3.510 3.526 3.512 3.554 0.044 14 0 "[ . 1 . 2]" 1
389 1 15 GLY HA2 1 17 GLY QA . . 5.340 4.897 4.884 4.901 . 0 0 "[ . 1 . 2]" 1
390 1 15 GLY HA3 1 16 ASP HA . . 5.500 4.533 4.531 4.535 . 0 0 "[ . 1 . 2]" 1
391 1 16 ASP H 1 16 ASP HB2 . . 3.260 3.707 3.625 3.726 0.466 13 0 "[ . 1 . 2]" 1
392 1 16 ASP H 1 16 ASP QB . . 2.730 2.483 2.402 2.507 . 0 0 "[ . 1 . 2]" 1
393 1 16 ASP H 1 16 ASP HB3 . . 3.260 2.522 2.437 2.548 . 0 0 "[ . 1 . 2]" 1
394 1 16 ASP H 1 17 GLY H . . 2.820 1.900 1.893 1.915 . 0 0 "[ . 1 . 2]" 1
395 1 16 ASP H 1 17 GLY HA2 . . 5.170 4.298 4.294 4.312 . 0 0 "[ . 1 . 2]" 1
396 1 16 ASP H 1 17 GLY QA . . 4.410 3.970 3.965 3.983 . 0 0 "[ . 1 . 2]" 1
397 1 16 ASP H 1 17 GLY HA3 . . 5.170 4.667 4.660 4.681 . 0 0 "[ . 1 . 2]" 1
398 1 16 ASP H 1 18 LYS QB . . 5.500 5.190 5.166 5.233 . 0 0 "[ . 1 . 2]" 1
399 1 16 ASP H 1 18 LYS HG3 . . 5.500 5.330 5.279 5.368 . 0 0 "[ . 1 . 2]" 1
400 1 16 ASP HA 1 17 GLY H . . 3.550 3.377 3.372 3.385 . 0 0 "[ . 1 . 2]" 1
401 1 16 ASP HA 1 17 GLY QA . . 5.340 4.180 4.178 4.183 . 0 0 "[ . 1 . 2]" 1
402 1 16 ASP HA 1 18 LYS QE . . 5.340 5.389 5.362 5.459 0.119 3 0 "[ . 1 . 2]" 1
403 1 16 ASP QB 1 17 GLY H . . 4.170 3.570 3.470 3.595 . 0 0 "[ . 1 . 2]" 1
404 1 16 ASP QB 1 18 LYS H . . 4.380 3.965 3.773 4.005 . 0 0 "[ . 1 . 2]" 1
405 1 16 ASP QB 1 18 LYS QE . . 5.180 3.997 3.907 4.135 . 0 0 "[ . 1 . 2]" 1
406 1 16 ASP HB2 1 17 GLY H . . 4.780 4.451 4.446 4.462 . 0 0 "[ . 1 . 2]" 1
407 1 16 ASP HB3 1 17 GLY H . . 4.780 3.759 3.618 3.795 . 0 0 "[ . 1 . 2]" 1
408 1 17 GLY H 1 17 GLY HA2 . . 2.950 2.413 2.411 2.416 . 0 0 "[ . 1 . 2]" 1
409 1 17 GLY H 1 17 GLY QA . . 2.580 2.309 2.308 2.311 . 0 0 "[ . 1 . 2]" 1
410 1 17 GLY H 1 17 GLY HA3 . . 2.950 2.947 2.946 2.948 . 0 0 "[ . 1 . 2]" 1
411 1 17 GLY H 1 18 LYS H . . 2.890 2.091 2.083 2.102 . 0 0 "[ . 1 . 2]" 1
412 1 17 GLY H 1 18 LYS HA . . 5.500 4.754 4.744 4.765 . 0 0 "[ . 1 . 2]" 1
413 1 17 GLY H 1 18 LYS QB . . 5.500 4.713 4.686 4.738 . 0 0 "[ . 1 . 2]" 1
414 1 17 GLY H 1 18 LYS HG2 . . 5.500 5.429 5.355 5.477 . 0 0 "[ . 1 . 2]" 1
415 1 17 GLY H 1 18 LYS HG3 . . 5.500 4.292 4.258 4.318 . 0 0 "[ . 1 . 2]" 1
416 1 17 GLY QA 1 18 LYS HG2 . . 5.090 3.929 3.875 3.967 . 0 0 "[ . 1 . 2]" 1
417 1 17 GLY QA 1 18 LYS HG3 . . 5.340 3.304 3.250 3.364 . 0 0 "[ . 1 . 2]" 1
418 1 17 GLY HA2 1 18 LYS H . . 3.400 3.118 3.103 3.136 . 0 0 "[ . 1 . 2]" 1
419 1 17 GLY HA3 1 18 LYS H . . 3.400 3.405 3.393 3.416 0.016 12 0 "[ . 1 . 2]" 1
420 1 18 LYS H 1 18 LYS QB . . 3.060 2.939 2.913 2.955 . 0 0 "[ . 1 . 2]" 1
421 1 18 LYS H 1 18 LYS QE . . 5.340 4.319 4.254 4.517 . 0 0 "[ . 1 . 2]" 1
422 1 18 LYS H 1 18 LYS HG2 . . 4.140 3.904 3.848 3.933 . 0 0 "[ . 1 . 2]" 1
423 1 18 LYS H 1 18 LYS HG3 . . 4.290 3.005 2.955 3.039 . 0 0 "[ . 1 . 2]" 1
424 1 18 LYS H 1 19 ILE H . . 4.710 4.385 4.372 4.393 . 0 0 "[ . 1 . 2]" 1
425 1 18 LYS H 1 19 ILE HA . . 4.780 4.671 4.659 4.691 . 0 0 "[ . 1 . 2]" 1
426 1 18 LYS H 1 53 PHE HB3 . . 5.500 5.600 5.579 5.618 0.118 12 0 "[ . 1 . 2]" 1
427 1 18 LYS H 1 55 ASP HA . . 5.200 5.147 5.117 5.200 . 3 0 "[ . 1 . 2]" 1
428 1 18 LYS HA 1 18 LYS QE . . 5.340 4.827 4.786 5.077 . 0 0 "[ . 1 . 2]" 1
429 1 18 LYS HA 1 18 LYS HG2 . . 4.090 2.688 2.664 2.731 . 0 0 "[ . 1 . 2]" 1
430 1 18 LYS HA 1 18 LYS HG3 . . 3.580 3.314 3.287 3.354 . 0 0 "[ . 1 . 2]" 1
431 1 18 LYS HA 1 19 ILE H . . 2.980 2.375 2.340 2.409 . 0 0 "[ . 1 . 2]" 1
432 1 18 LYS HA 1 19 ILE HA . . 4.670 4.410 4.395 4.424 . 0 0 "[ . 1 . 2]" 1
433 1 18 LYS HA 1 19 ILE HB . . 5.080 4.965 4.943 4.991 . 0 0 "[ . 1 . 2]" 1
434 1 18 LYS HA 1 19 ILE MD . . 4.240 3.112 3.069 3.200 . 0 0 "[ . 1 . 2]" 1
435 1 18 LYS HA 1 19 ILE HG12 . . 3.830 3.294 3.269 3.319 . 0 0 "[ . 1 . 2]" 1
436 1 18 LYS HA 1 53 PHE HB3 . . 4.540 4.201 4.161 4.241 . 0 0 "[ . 1 . 2]" 1
437 1 18 LYS HA 1 54 ILE H . . 4.530 4.264 4.118 4.401 . 0 0 "[ . 1 . 2]" 1
438 1 18 LYS HA 1 54 ILE HB . . 5.500 4.803 4.710 4.873 . 0 0 "[ . 1 . 2]" 1
439 1 18 LYS HA 1 55 ASP HB2 . . 5.500 5.570 5.541 5.628 0.128 3 0 "[ . 1 . 2]" 1
440 1 18 LYS HA 1 55 ASP HB3 . . 5.010 4.848 4.806 4.891 . 0 0 "[ . 1 . 2]" 1
441 1 18 LYS HA 1 56 PHE H . . 5.500 4.649 4.607 4.793 . 0 0 "[ . 1 . 2]" 1
442 1 18 LYS QB 1 18 LYS HD2 . . 2.720 2.155 2.140 2.200 . 0 0 "[ . 1 . 2]" 1
443 1 18 LYS QB 1 18 LYS HE2 . . 4.430 3.270 2.866 3.769 . 0 0 "[ . 1 . 2]" 1
444 1 18 LYS QB 1 18 LYS HE3 . . 4.430 3.025 2.792 3.527 . 0 0 "[ . 1 . 2]" 1
445 1 18 LYS QB 1 19 ILE H . . 3.220 2.504 2.435 2.576 . 0 0 "[ . 1 . 2]" 1
446 1 18 LYS QB 1 20 SER H . . 5.500 4.747 4.697 4.787 . 0 0 "[ . 1 . 2]" 1
447 1 18 LYS QB 1 53 PHE H . . 5.500 5.280 5.264 5.309 . 0 0 "[ . 1 . 2]" 1
448 1 18 LYS QB 1 53 PHE HB2 . . 3.670 3.206 3.140 3.268 . 0 0 "[ . 1 . 2]" 1
449 1 18 LYS QB 1 53 PHE HB3 . . 2.590 1.883 1.861 1.894 . 0 0 "[ . 1 . 2]" 1
450 1 18 LYS QB 1 53 PHE QD . . 2.900 2.649 2.612 2.706 . 0 0 "[ . 1 . 2]" 1
451 1 18 LYS QB 1 53 PHE QE . . 5.430 4.262 4.230 4.326 . 0 0 "[ . 1 . 2]" 1
452 1 18 LYS QB 1 54 ILE H . . 5.500 3.173 3.067 3.380 . 0 0 "[ . 1 . 2]" 1
453 1 18 LYS QB 1 55 ASP HA . . 4.450 3.380 3.319 3.466 . 0 0 "[ . 1 . 2]" 1
454 1 18 LYS QB 1 55 ASP HB3 . . 5.430 5.224 5.195 5.262 . 0 0 "[ . 1 . 2]" 1
455 1 18 LYS HD2 1 19 ILE H . . 4.930 4.847 4.746 4.947 0.017 3 0 "[ . 1 . 2]" 1
456 1 18 LYS HD2 1 53 PHE H . . 5.470 5.316 5.260 5.435 . 0 0 "[ . 1 . 2]" 1
457 1 18 LYS HD2 1 53 PHE HB2 . . 3.090 2.536 2.470 2.614 . 0 0 "[ . 1 . 2]" 1
458 1 18 LYS HD2 1 53 PHE HB3 . . 3.090 2.347 2.262 2.431 . 0 0 "[ . 1 . 2]" 1
459 1 18 LYS HD2 1 53 PHE QD . . 4.600 3.525 3.504 3.546 . 0 0 "[ . 1 . 2]" 1
460 1 18 LYS HD3 1 53 PHE HB2 . . 4.050 3.806 3.716 3.999 . 0 0 "[ . 1 . 2]" 1
461 1 18 LYS HD3 1 53 PHE HB3 . . 4.360 3.892 3.781 4.083 . 0 0 "[ . 1 . 2]" 1
462 1 18 LYS HD3 1 53 PHE QD . . 5.500 4.908 4.888 4.915 . 0 0 "[ . 1 . 2]" 1
463 1 18 LYS QE 1 53 PHE HB2 . . 5.260 4.114 4.056 4.315 . 0 0 "[ . 1 . 2]" 1
464 1 18 LYS QE 1 53 PHE HB3 . . 5.070 3.922 3.811 4.305 . 0 0 "[ . 1 . 2]" 1
465 1 18 LYS QE 1 53 PHE QD . . 5.340 3.940 3.800 4.250 . 0 0 "[ . 1 . 2]" 1
466 1 18 LYS QE 1 53 PHE QE . . 5.340 4.521 4.385 4.778 . 0 0 "[ . 1 . 2]" 1
467 1 18 LYS HE2 1 53 PHE QD . . 5.500 5.166 4.527 5.231 . 0 0 "[ . 1 . 2]" 1
468 1 18 LYS HE3 1 53 PHE QD . . 5.500 4.118 3.904 5.153 . 0 0 "[ . 1 . 2]" 1
469 1 18 LYS HG2 1 53 PHE HB3 . . 4.130 4.018 3.973 4.094 . 0 0 "[ . 1 . 2]" 1
470 1 18 LYS HG2 1 53 PHE QD . . 5.500 5.247 5.221 5.292 . 0 0 "[ . 1 . 2]" 1
471 1 18 LYS HG2 1 55 ASP HA . . 3.920 2.671 2.527 2.810 . 0 0 "[ . 1 . 2]" 1
472 1 18 LYS HG2 1 55 ASP HB2 . . 5.500 5.120 4.994 5.202 . 0 0 "[ . 1 . 2]" 1
473 1 18 LYS HG3 1 19 ILE H . . 5.080 5.010 4.977 5.049 . 0 0 "[ . 1 . 2]" 1
474 1 18 LYS HG3 1 53 PHE QD . . 5.500 5.024 4.980 5.079 . 0 0 "[ . 1 . 2]" 1
475 1 18 LYS HG3 1 55 ASP HA . . 5.500 4.275 4.137 4.364 . 0 0 "[ . 1 . 2]" 1
476 1 19 ILE H 1 19 ILE HB . . 2.980 2.879 2.846 2.895 . 0 0 "[ . 1 . 2]" 1
477 1 19 ILE H 1 19 ILE MD . . 3.660 3.084 3.033 3.141 . 0 0 "[ . 1 . 2]" 1
478 1 19 ILE H 1 19 ILE HG12 . . 3.080 2.367 2.276 2.451 . 0 0 "[ . 1 . 2]" 1
479 1 19 ILE H 1 19 ILE HG13 . . 4.260 3.907 3.829 3.976 . 0 0 "[ . 1 . 2]" 1
480 1 19 ILE H 1 20 SER H . . 4.400 4.283 4.240 4.313 . 0 0 "[ . 1 . 2]" 1
481 1 19 ILE H 1 43 MET ME . . 5.500 4.917 4.900 4.932 . 0 0 "[ . 1 . 2]" 1
482 1 19 ILE H 1 53 PHE HB2 . . 5.330 5.067 4.919 5.227 . 0 0 "[ . 1 . 2]" 1
483 1 19 ILE H 1 53 PHE HB3 . . 3.820 3.451 3.311 3.608 . 0 0 "[ . 1 . 2]" 1
484 1 19 ILE H 1 53 PHE QD . . 4.850 3.986 3.877 4.131 . 0 0 "[ . 1 . 2]" 1
485 1 19 ILE H 1 54 ILE H . . 3.320 2.265 2.181 2.427 . 0 0 "[ . 1 . 2]" 1
486 1 19 ILE H 1 54 ILE HB . . 3.050 2.861 2.753 2.930 . 0 0 "[ . 1 . 2]" 1
487 1 19 ILE H 1 54 ILE MG . . 4.150 3.738 3.625 3.796 . 0 0 "[ . 1 . 2]" 1
488 1 19 ILE H 1 55 ASP H . . 4.780 4.552 4.532 4.590 . 0 0 "[ . 1 . 2]" 1
489 1 19 ILE H 1 55 ASP HA . . 4.330 3.975 3.887 4.023 . 0 0 "[ . 1 . 2]" 1
490 1 19 ILE HA 1 19 ILE MD . . 3.120 2.130 2.064 2.302 . 0 0 "[ . 1 . 2]" 1
491 1 19 ILE HA 1 20 SER H . . 2.910 2.140 2.139 2.140 . 0 0 "[ . 1 . 2]" 1
492 1 19 ILE HA 1 23 GLU H . . 4.990 4.778 4.740 4.821 . 0 0 "[ . 1 . 2]" 1
493 1 19 ILE HA 1 23 GLU HA . . 5.500 5.606 5.568 5.630 0.130 13 0 "[ . 1 . 2]" 1
494 1 19 ILE HA 1 23 GLU HB2 . . 4.350 2.650 2.605 2.678 . 0 0 "[ . 1 . 2]" 1
495 1 19 ILE HA 1 24 LEU H . . 4.560 4.088 4.050 4.165 . 0 0 "[ . 1 . 2]" 1
496 1 19 ILE HB 1 20 SER H . . 4.400 4.073 4.039 4.106 . 0 0 "[ . 1 . 2]" 1
497 1 19 ILE HB 1 23 GLU HB2 . . 4.920 4.543 4.485 4.582 . 0 0 "[ . 1 . 2]" 1
498 1 19 ILE HB 1 24 LEU HG . . 4.970 4.330 4.274 4.467 . 0 0 "[ . 1 . 2]" 1
499 1 19 ILE HB 1 54 ILE H . . 3.660 3.284 3.242 3.330 . 0 0 "[ . 1 . 2]" 1
500 1 19 ILE HB 1 54 ILE HB . . 2.490 1.943 1.931 1.955 . 0 0 "[ . 1 . 2]" 1
501 1 19 ILE HB 1 54 ILE HG13 . . 4.030 3.646 3.567 3.715 . 0 0 "[ . 1 . 2]" 1
502 1 19 ILE HB 1 54 ILE MG . . 3.610 3.176 3.115 3.219 . 0 0 "[ . 1 . 2]" 1
503 1 19 ILE HB 1 59 PHE HD1 . . 5.500 4.612 4.528 4.745 . 0 0 "[ . 1 . 2]" 1
504 1 19 ILE MD 1 19 ILE MG . . 2.870 2.183 2.101 2.221 . 0 0 "[ . 1 . 2]" 1
505 1 19 ILE MD 1 20 SER H . . 5.500 3.968 3.924 4.057 . 0 0 "[ . 1 . 2]" 1
506 1 19 ILE MD 1 23 GLU HB2 . . 5.500 3.512 3.461 3.561 . 0 0 "[ . 1 . 2]" 1
507 1 19 ILE MD 1 23 GLU HB3 . . 5.500 3.594 3.506 3.670 . 0 0 "[ . 1 . 2]" 1
508 1 19 ILE MD 1 24 LEU H . . 5.500 4.809 4.718 4.845 . 0 0 "[ . 1 . 2]" 1
509 1 19 ILE MD 1 24 LEU HA . . 5.500 4.783 4.636 4.868 . 0 0 "[ . 1 . 2]" 1
510 1 19 ILE MD 1 54 ILE H . . 5.500 4.822 4.774 4.933 . 0 0 "[ . 1 . 2]" 1
511 1 19 ILE HG12 1 20 SER H . . 5.400 5.291 5.268 5.304 . 0 0 "[ . 1 . 2]" 1
512 1 19 ILE HG12 1 54 ILE MG . . 3.080 2.814 2.735 2.891 . 0 0 "[ . 1 . 2]" 1
513 1 19 ILE HG12 1 55 ASP H . . 5.500 5.357 5.323 5.417 . 0 0 "[ . 1 . 2]" 1
514 1 19 ILE HG12 1 55 ASP HA . . 5.500 4.613 4.525 4.695 . 0 0 "[ . 1 . 2]" 1
515 1 19 ILE HG12 1 59 PHE HD1 . . 4.620 4.193 4.123 4.266 . 0 0 "[ . 1 . 2]" 1
516 1 19 ILE HG13 1 20 SER H . . 5.500 5.635 5.615 5.664 0.164 12 0 "[ . 1 . 2]" 1
517 1 19 ILE HG13 1 54 ILE HB . . 5.500 3.523 3.398 3.589 . 0 0 "[ . 1 . 2]" 1
518 1 19 ILE HG13 1 54 ILE MG . . 5.380 3.177 3.073 3.245 . 0 0 "[ . 1 . 2]" 1
519 1 19 ILE HG13 1 59 PHE HD1 . . 4.630 3.781 3.695 3.852 . 0 0 "[ . 1 . 2]" 1
520 1 19 ILE MG 1 20 SER H . . 3.410 2.819 2.778 2.853 . 0 0 "[ . 1 . 2]" 1
521 1 19 ILE MG 1 20 SER QB . . 5.340 4.620 4.452 4.848 . 0 0 "[ . 1 . 2]" 1
522 1 19 ILE MG 1 21 LEU HA . . 5.500 5.051 5.028 5.071 . 0 0 "[ . 1 . 2]" 1
523 1 19 ILE MG 1 23 GLU H . . 4.960 3.943 3.910 3.990 . 0 0 "[ . 1 . 2]" 1
524 1 19 ILE MG 1 23 GLU HA . . 4.590 4.216 4.186 4.257 . 0 0 "[ . 1 . 2]" 1
525 1 19 ILE MG 1 23 GLU HB2 . . 2.980 1.934 1.918 1.956 . 0 0 "[ . 1 . 2]" 1
526 1 19 ILE MG 1 23 GLU HB3 . . 3.340 2.772 2.708 2.846 . 0 0 "[ . 1 . 2]" 1
527 1 19 ILE MG 1 23 GLU HG2 . . 4.980 4.473 4.404 4.529 . 0 0 "[ . 1 . 2]" 1
528 1 19 ILE MG 1 23 GLU QG . . 4.120 3.858 3.810 3.902 . 0 0 "[ . 1 . 2]" 1
529 1 19 ILE MG 1 23 GLU HG3 . . 4.980 4.214 4.171 4.260 . 0 0 "[ . 1 . 2]" 1
530 1 19 ILE MG 1 24 LEU H . . 3.910 2.335 2.270 2.422 . 0 0 "[ . 1 . 2]" 1
531 1 19 ILE MG 1 24 LEU HA . . 3.880 2.306 2.262 2.406 . 0 0 "[ . 1 . 2]" 1
532 1 19 ILE MG 1 24 LEU HB2 . . 3.180 1.902 1.884 1.924 . 0 0 "[ . 1 . 2]" 1
533 1 19 ILE MG 1 24 LEU HG . . 5.220 2.755 2.678 2.846 . 0 0 "[ . 1 . 2]" 1
534 1 19 ILE MG 1 25 THR H . . 5.500 4.417 4.390 4.489 . 0 0 "[ . 1 . 2]" 1
535 1 19 ILE MG 1 43 MET HB3 . . 5.500 4.791 4.699 4.871 . 0 0 "[ . 1 . 2]" 1
536 1 19 ILE MG 1 43 MET ME . . 5.500 4.367 4.318 4.403 . 0 0 "[ . 1 . 2]" 1
537 1 19 ILE MG 1 54 ILE H . . 5.500 4.515 4.484 4.543 . 0 0 "[ . 1 . 2]" 1
538 1 20 SER H 1 20 SER QB . . 3.070 2.627 2.345 2.983 . 0 0 "[ . 1 . 2]" 1
539 1 20 SER H 1 22 SER H . . 5.500 4.292 4.244 4.393 . 0 0 "[ . 1 . 2]" 1
540 1 20 SER H 1 22 SER HB3 . . 5.500 5.385 5.320 5.497 . 0 0 "[ . 1 . 2]" 1
541 1 20 SER H 1 23 GLU H . . 3.170 3.108 3.089 3.141 . 0 0 "[ . 1 . 2]" 1
542 1 20 SER H 1 23 GLU HB2 . . 2.870 2.235 2.171 2.282 . 0 0 "[ . 1 . 2]" 1
543 1 20 SER H 1 23 GLU HG2 . . 4.550 4.131 4.077 4.181 . 0 0 "[ . 1 . 2]" 1
544 1 20 SER H 1 23 GLU QG . . 3.890 2.907 2.836 2.962 . 0 0 "[ . 1 . 2]" 1
545 1 20 SER H 1 23 GLU HG3 . . 4.550 2.970 2.893 3.030 . 0 0 "[ . 1 . 2]" 1
546 1 20 SER H 1 24 LEU H . . 3.780 3.230 3.191 3.311 . 0 0 "[ . 1 . 2]" 1
547 1 20 SER H 1 24 LEU HA . . 5.500 5.418 5.383 5.469 . 0 0 "[ . 1 . 2]" 1
548 1 20 SER H 1 24 LEU HB2 . . 4.820 4.226 4.209 4.297 . 0 0 "[ . 1 . 2]" 1
549 1 20 SER H 1 24 LEU HB3 . . 5.500 5.541 5.522 5.627 0.127 3 0 "[ . 1 . 2]" 1
550 1 20 SER H 1 43 MET ME . . 5.500 4.642 4.587 4.740 . 0 0 "[ . 1 . 2]" 1
551 1 20 SER H 1 53 PHE HB3 . . 5.500 5.389 5.252 5.495 . 0 0 "[ . 1 . 2]" 1
552 1 20 SER H 1 53 PHE QD . . 3.680 3.700 3.661 3.829 0.149 3 0 "[ . 1 . 2]" 1
553 1 20 SER H 1 53 PHE QE . . 5.140 4.430 4.332 4.691 . 0 0 "[ . 1 . 2]" 1
554 1 20 SER H 1 54 ILE HB . . 5.500 5.444 5.394 5.524 0.024 3 0 "[ . 1 . 2]" 1
555 1 20 SER HA 1 21 LEU H . . 3.430 2.723 2.651 2.733 . 0 0 "[ . 1 . 2]" 1
556 1 20 SER HA 1 53 PHE H . . 5.500 5.519 5.506 5.549 0.049 3 0 "[ . 1 . 2]" 1
557 1 20 SER HA 1 53 PHE QD . . 3.950 3.424 3.351 3.469 . 0 0 "[ . 1 . 2]" 1
558 1 20 SER HA 1 54 ILE H . . 4.600 3.754 3.679 3.922 . 0 0 "[ . 1 . 2]" 1
559 1 20 SER QB 1 21 LEU H . . 3.040 2.205 1.918 2.341 . 0 0 "[ . 1 . 2]" 1
560 1 20 SER QB 1 21 LEU HB2 . . 4.680 4.200 4.059 4.321 . 0 0 "[ . 1 . 2]" 1
561 1 20 SER QB 1 21 LEU HB3 . . 5.340 5.248 5.083 5.385 0.045 2 0 "[ . 1 . 2]" 1
562 1 20 SER QB 1 21 LEU MD2 . . 5.070 4.059 3.795 4.276 . 0 0 "[ . 1 . 2]" 1
563 1 20 SER QB 1 22 SER H . . 4.160 2.207 2.150 2.632 . 0 0 "[ . 1 . 2]" 1
564 1 20 SER QB 1 22 SER HB2 . . 3.760 3.412 3.275 3.769 0.009 3 0 "[ . 1 . 2]" 1
565 1 20 SER QB 1 22 SER HB3 . . 5.260 3.944 3.804 4.624 . 0 0 "[ . 1 . 2]" 1
566 1 20 SER QB 1 23 GLU H . . 4.710 3.023 2.885 3.665 . 0 0 "[ . 1 . 2]" 1
567 1 20 SER QB 1 23 GLU HB2 . . 4.640 4.146 3.869 4.573 . 0 0 "[ . 1 . 2]" 1
568 1 20 SER QB 1 23 GLU QG . . 4.760 3.285 2.997 3.846 . 0 0 "[ . 1 . 2]" 1
569 1 20 SER QB 1 43 MET ME . . 5.500 3.956 3.688 4.169 . 0 0 "[ . 1 . 2]" 1
570 1 20 SER QB 1 53 PHE HB3 . . 5.340 4.797 4.532 4.886 . 0 0 "[ . 1 . 2]" 1
571 1 20 SER QB 1 53 PHE QD . . 3.400 2.791 2.440 3.085 . 0 0 "[ . 1 . 2]" 1
572 1 20 SER QB 1 53 PHE QE . . 3.070 2.352 2.117 2.675 . 0 0 "[ . 1 . 2]" 1
573 1 20 SER QB 1 54 ILE H . . 5.340 5.046 4.973 5.130 . 0 0 "[ . 1 . 2]" 1
574 1 21 LEU H 1 21 LEU HA . . 2.850 2.847 2.835 2.850 0.000 1 0 "[ . 1 . 2]" 1
575 1 21 LEU H 1 21 LEU HB2 . . 2.970 2.766 2.743 2.780 . 0 0 "[ . 1 . 2]" 1
576 1 21 LEU H 1 21 LEU HB3 . . 3.640 3.574 3.571 3.577 . 0 0 "[ . 1 . 2]" 1
577 1 21 LEU H 1 21 LEU MD1 . . 4.540 3.650 3.633 3.669 . 0 0 "[ . 1 . 2]" 1
578 1 21 LEU H 1 21 LEU MD2 . . 3.400 2.607 2.592 2.625 . 0 0 "[ . 1 . 2]" 1
579 1 21 LEU H 1 21 LEU HG . . 3.370 1.994 1.969 2.023 . 0 0 "[ . 1 . 2]" 1
580 1 21 LEU H 1 22 SER H . . 3.160 2.508 2.497 2.553 . 0 0 "[ . 1 . 2]" 1
581 1 21 LEU H 1 22 SER HA . . 5.500 5.132 5.121 5.166 . 0 0 "[ . 1 . 2]" 1
582 1 21 LEU H 1 22 SER HB2 . . 4.740 4.388 4.348 4.433 . 0 0 "[ . 1 . 2]" 1
583 1 21 LEU H 1 23 GLU H . . 5.500 4.109 4.051 4.168 . 0 0 "[ . 1 . 2]" 1
584 1 21 LEU H 1 43 MET ME . . 3.910 3.444 3.423 3.472 . 0 0 "[ . 1 . 2]" 1
585 1 21 LEU H 1 53 PHE QD . . 5.500 5.351 5.301 5.375 . 0 0 "[ . 1 . 2]" 1
586 1 21 LEU H 1 53 PHE QE . . 5.500 5.101 5.034 5.184 . 0 0 "[ . 1 . 2]" 1
587 1 21 LEU HA 1 21 LEU HB3 . . 2.860 2.324 2.319 2.338 . 0 0 "[ . 1 . 2]" 1
588 1 21 LEU HA 1 21 LEU MD2 . . 2.570 2.066 2.029 2.081 . 0 0 "[ . 1 . 2]" 1
589 1 21 LEU HA 1 21 LEU HG . . 3.560 3.501 3.485 3.510 . 0 0 "[ . 1 . 2]" 1
590 1 21 LEU HA 1 24 LEU H . . 4.150 3.971 3.928 4.009 . 0 0 "[ . 1 . 2]" 1
591 1 21 LEU HA 1 24 LEU HB3 . . 5.500 3.134 3.102 3.175 . 0 0 "[ . 1 . 2]" 1
592 1 21 LEU HA 1 24 LEU MD1 . . 4.670 4.210 4.185 4.243 . 0 0 "[ . 1 . 2]" 1
593 1 21 LEU HA 1 25 THR H . . 4.120 3.505 3.449 3.587 . 0 0 "[ . 1 . 2]" 1
594 1 21 LEU HA 1 39 VAL HA . . 5.500 5.374 5.356 5.418 . 0 0 "[ . 1 . 2]" 1
595 1 21 LEU HA 1 40 GLN H . . 5.300 4.682 4.655 4.725 . 0 0 "[ . 1 . 2]" 1
596 1 21 LEU HA 1 43 MET HB3 . . 5.300 5.453 5.430 5.461 0.161 9 0 "[ . 1 . 2]" 1
597 1 21 LEU HA 1 43 MET ME . . 4.090 3.756 3.696 3.808 . 0 0 "[ . 1 . 2]" 1
598 1 21 LEU HB2 1 21 LEU MD1 . . 3.080 2.337 2.319 2.357 . 0 0 "[ . 1 . 2]" 1
599 1 21 LEU HB2 1 21 LEU HG . . 2.550 2.394 2.385 2.404 . 0 0 "[ . 1 . 2]" 1
600 1 21 LEU HB2 1 22 SER H . . 4.460 3.047 2.961 3.092 . 0 0 "[ . 1 . 2]" 1
601 1 21 LEU HB2 1 36 ALA HA . . 5.500 5.548 5.439 5.571 0.071 4 0 "[ . 1 . 2]" 1
602 1 21 LEU HB2 1 39 VAL HB . . 5.500 5.160 5.136 5.182 . 0 0 "[ . 1 . 2]" 1
603 1 21 LEU HB2 1 40 GLN HB3 . . 5.500 5.084 5.039 5.205 . 0 0 "[ . 1 . 2]" 1
604 1 21 LEU HB3 1 21 LEU MD1 . . 3.290 2.297 2.276 2.315 . 0 0 "[ . 1 . 2]" 1
605 1 21 LEU HB3 1 21 LEU MD2 . . 3.360 2.413 2.406 2.427 . 0 0 "[ . 1 . 2]" 1
606 1 21 LEU HB3 1 22 SER H . . 4.840 4.174 4.124 4.199 . 0 0 "[ . 1 . 2]" 1
607 1 21 LEU HB3 1 25 THR H . . 5.500 5.079 4.991 5.127 . 0 0 "[ . 1 . 2]" 1
608 1 21 LEU HB3 1 36 ALA HA . . 4.510 4.088 3.975 4.118 . 0 0 "[ . 1 . 2]" 1
609 1 21 LEU HB3 1 36 ALA MB . . 3.610 2.690 2.459 2.875 . 0 0 "[ . 1 . 2]" 1
610 1 21 LEU HB3 1 39 VAL HB . . 5.230 3.477 3.454 3.504 . 0 0 "[ . 1 . 2]" 1
611 1 21 LEU HB3 1 39 VAL MG1 . . 3.760 2.904 2.859 2.975 . 0 0 "[ . 1 . 2]" 1
612 1 21 LEU HB3 1 40 GLN H . . 4.380 4.020 3.953 4.095 . 0 0 "[ . 1 . 2]" 1
613 1 21 LEU HB3 1 40 GLN HA . . 4.750 4.592 4.528 4.705 . 0 0 "[ . 1 . 2]" 1
614 1 21 LEU HB3 1 40 GLN HB3 . . 4.570 3.840 3.792 3.971 . 0 0 "[ . 1 . 2]" 1
615 1 21 LEU MD1 1 21 LEU HG . . 2.580 2.087 2.086 2.089 . 0 0 "[ . 1 . 2]" 1
616 1 21 LEU MD1 1 22 SER H . . 5.500 4.820 4.749 4.886 . 0 0 "[ . 1 . 2]" 1
617 1 21 LEU MD1 1 40 GLN HA . . 5.010 3.476 3.427 3.539 . 0 0 "[ . 1 . 2]" 1
618 1 21 LEU MD1 1 40 GLN HB3 . . 2.840 1.975 1.963 2.019 . 0 0 "[ . 1 . 2]" 1
619 1 21 LEU MD1 1 40 GLN HE21 . . 5.500 4.719 4.706 4.749 . 0 0 "[ . 1 . 2]" 1
620 1 21 LEU MD1 1 40 GLN HE22 . . 5.500 5.134 5.112 5.170 . 0 0 "[ . 1 . 2]" 1
621 1 21 LEU MD1 1 40 GLN HG2 . . 4.110 3.551 3.512 3.588 . 0 0 "[ . 1 . 2]" 1
622 1 21 LEU MD2 1 22 SER H . . 5.500 4.374 4.358 4.392 . 0 0 "[ . 1 . 2]" 1
623 1 21 LEU MD2 1 25 THR H . . 5.500 5.068 5.008 5.096 . 0 0 "[ . 1 . 2]" 1
624 1 21 LEU MD2 1 40 GLN H . . 4.690 3.338 3.314 3.355 . 0 0 "[ . 1 . 2]" 1
625 1 21 LEU MD2 1 40 GLN HA . . 3.430 2.171 2.120 2.241 . 0 0 "[ . 1 . 2]" 1
626 1 21 LEU MD2 1 40 GLN HB3 . . 3.260 2.287 2.266 2.321 . 0 0 "[ . 1 . 2]" 1
627 1 21 LEU MD2 1 43 MET H . . 5.500 4.616 4.598 4.633 . 0 0 "[ . 1 . 2]" 1
628 1 21 LEU MD2 1 43 MET ME . . 2.750 2.023 1.991 2.061 . 0 0 "[ . 1 . 2]" 1
629 1 21 LEU MD2 1 43 MET HG2 . . 2.930 2.539 2.516 2.568 . 0 0 "[ . 1 . 2]" 1
630 1 21 LEU MD2 1 43 MET HG3 . . 4.660 3.401 3.380 3.427 . 0 0 "[ . 1 . 2]" 1
631 1 21 LEU HG 1 22 SER H . . 4.700 4.012 3.962 4.103 . 0 0 "[ . 1 . 2]" 1
632 1 21 LEU HG 1 22 SER HB2 . . 5.500 5.503 5.486 5.581 0.081 3 0 "[ . 1 . 2]" 1
633 1 21 LEU HG 1 40 GLN HB3 . . 4.780 4.566 4.549 4.600 . 0 0 "[ . 1 . 2]" 1
634 1 21 LEU HG 1 43 MET HG2 . . 5.500 5.283 5.243 5.324 . 0 0 "[ . 1 . 2]" 1
635 1 22 SER H 1 22 SER HB2 . . 3.510 2.236 2.191 2.264 . 0 0 "[ . 1 . 2]" 1
636 1 22 SER H 1 23 GLU H . . 2.860 2.358 2.323 2.392 . 0 0 "[ . 1 . 2]" 1
637 1 22 SER H 1 23 GLU HB2 . . 4.790 4.761 4.698 4.804 0.014 4 0 "[ . 1 . 2]" 1
638 1 22 SER H 1 24 LEU H . . 4.220 4.145 4.047 4.210 . 0 0 "[ . 1 . 2]" 1
639 1 22 SER HA 1 24 LEU H . . 5.500 5.125 5.012 5.173 . 0 0 "[ . 1 . 2]" 1
640 1 22 SER HA 1 25 THR H . . 4.470 4.300 4.212 4.334 . 0 0 "[ . 1 . 2]" 1
641 1 22 SER HA 1 25 THR MG . . 3.680 2.303 2.250 2.333 . 0 0 "[ . 1 . 2]" 1
642 1 22 SER HB2 1 23 GLU H . . 3.960 3.516 3.424 3.586 . 0 0 "[ . 1 . 2]" 1
643 1 22 SER HB3 1 23 GLU H . . 4.080 2.940 2.894 2.985 . 0 0 "[ . 1 . 2]" 1
644 1 22 SER HB3 1 23 GLU HA . . 5.500 4.012 3.974 4.036 . 0 0 "[ . 1 . 2]" 1
645 1 22 SER HB3 1 23 GLU HB2 . . 5.500 5.077 5.029 5.129 . 0 0 "[ . 1 . 2]" 1
646 1 22 SER HB3 1 23 GLU QG . . 3.920 2.934 2.891 3.010 . 0 0 "[ . 1 . 2]" 1
647 1 22 SER HB3 1 25 THR MG . . 5.500 4.385 4.252 4.439 . 0 0 "[ . 1 . 2]" 1
648 1 23 GLU H 1 23 GLU HB2 . . 2.690 2.613 2.594 2.625 . 0 0 "[ . 1 . 2]" 1
649 1 23 GLU H 1 23 GLU QG . . 3.370 2.119 2.094 2.156 . 0 0 "[ . 1 . 2]" 1
650 1 23 GLU H 1 24 LEU H . . 2.850 2.519 2.499 2.542 . 0 0 "[ . 1 . 2]" 1
651 1 23 GLU H 1 24 LEU HB2 . . 4.760 4.493 4.473 4.533 . 0 0 "[ . 1 . 2]" 1
652 1 23 GLU H 1 24 LEU HB3 . . 5.500 4.858 4.835 4.902 . 0 0 "[ . 1 . 2]" 1
653 1 23 GLU H 1 25 THR H . . 4.130 4.030 3.994 4.088 . 0 0 "[ . 1 . 2]" 1
654 1 23 GLU H 1 39 VAL MG1 . . 5.500 4.855 4.813 4.896 . 0 0 "[ . 1 . 2]" 1
655 1 23 GLU HA 1 23 GLU HB3 . . 2.780 2.397 2.391 2.405 . 0 0 "[ . 1 . 2]" 1
656 1 23 GLU HA 1 23 GLU HG2 . . 3.580 2.790 2.774 2.805 . 0 0 "[ . 1 . 2]" 1
657 1 23 GLU HA 1 23 GLU QG . . 3.050 2.586 2.574 2.596 . 0 0 "[ . 1 . 2]" 1
658 1 23 GLU HA 1 23 GLU HG3 . . 3.580 3.059 3.026 3.090 . 0 0 "[ . 1 . 2]" 1
659 1 23 GLU HA 1 24 LEU HA . . 5.500 4.855 4.842 4.859 . 0 0 "[ . 1 . 2]" 1
660 1 23 GLU HA 1 25 THR H . . 4.950 4.608 4.577 4.662 . 0 0 "[ . 1 . 2]" 1
661 1 23 GLU HA 1 26 ASP H . . 3.830 3.522 3.509 3.570 . 0 0 "[ . 1 . 2]" 1
662 1 23 GLU HA 1 26 ASP QB . . 3.670 2.935 2.580 3.245 . 0 0 "[ . 1 . 2]" 1
663 1 23 GLU HB2 1 24 LEU H . . 3.230 2.263 2.227 2.330 . 0 0 "[ . 1 . 2]" 1
664 1 23 GLU HB2 1 24 LEU HA . . 4.970 4.025 4.007 4.057 . 0 0 "[ . 1 . 2]" 1
665 1 23 GLU HB2 1 24 LEU HB2 . . 5.140 3.982 3.962 4.007 . 0 0 "[ . 1 . 2]" 1
666 1 23 GLU HB2 1 24 LEU HB3 . . 5.500 5.083 5.060 5.121 . 0 0 "[ . 1 . 2]" 1
667 1 23 GLU HB2 1 25 THR H . . 5.340 4.987 4.950 5.040 . 0 0 "[ . 1 . 2]" 1
668 1 23 GLU HB3 1 24 LEU HA . . 5.350 4.510 4.492 4.522 . 0 0 "[ . 1 . 2]" 1
669 1 23 GLU QG 1 24 LEU H . . 4.970 3.786 3.754 3.828 . 0 0 "[ . 1 . 2]" 1
670 1 24 LEU H 1 24 LEU HB2 . . 2.830 2.202 2.192 2.210 . 0 0 "[ . 1 . 2]" 1
671 1 24 LEU H 1 24 LEU HB3 . . 2.960 2.872 2.853 2.891 . 0 0 "[ . 1 . 2]" 1
672 1 24 LEU H 1 24 LEU MD2 . . 4.850 4.326 4.317 4.335 . 0 0 "[ . 1 . 2]" 1
673 1 24 LEU H 1 24 LEU HG . . 4.750 4.227 4.210 4.241 . 0 0 "[ . 1 . 2]" 1
674 1 24 LEU H 1 25 THR H . . 3.160 2.935 2.905 2.957 . 0 0 "[ . 1 . 2]" 1
675 1 24 LEU H 1 26 ASP H . . 4.670 4.246 4.106 4.279 . 0 0 "[ . 1 . 2]" 1
676 1 24 LEU H 1 27 ALA H . . 5.500 5.185 5.041 5.209 . 0 0 "[ . 1 . 2]" 1
677 1 24 LEU H 1 27 ALA MB . . 5.500 5.167 5.007 5.197 . 0 0 "[ . 1 . 2]" 1
678 1 24 LEU H 1 39 VAL MG1 . . 5.500 3.792 3.743 3.815 . 0 0 "[ . 1 . 2]" 1
679 1 24 LEU H 1 43 MET ME . . 5.500 5.054 4.990 5.114 . 0 0 "[ . 1 . 2]" 1
680 1 24 LEU HA 1 24 LEU MD1 . . 4.580 3.597 3.593 3.601 . 0 0 "[ . 1 . 2]" 1
681 1 24 LEU HA 1 24 LEU MD2 . . 3.800 3.102 3.084 3.116 . 0 0 "[ . 1 . 2]" 1
682 1 24 LEU HA 1 24 LEU HG . . 3.440 2.319 2.315 2.324 . 0 0 "[ . 1 . 2]" 1
683 1 24 LEU HA 1 26 ASP H . . 4.340 4.251 4.099 4.346 0.006 3 0 "[ . 1 . 2]" 1
684 1 24 LEU HA 1 27 ALA H . . 3.930 3.555 3.431 3.571 . 0 0 "[ . 1 . 2]" 1
685 1 24 LEU HA 1 27 ALA MB . . 3.290 2.977 2.851 3.000 . 0 0 "[ . 1 . 2]" 1
686 1 24 LEU HA 1 28 LEU MD1 . . 5.500 5.158 5.140 5.176 . 0 0 "[ . 1 . 2]" 1
687 1 24 LEU HA 1 28 LEU HG . . 4.570 4.450 4.396 4.472 . 0 0 "[ . 1 . 2]" 1
688 1 24 LEU HB2 1 24 LEU MD1 . . 3.630 1.999 1.996 2.002 . 0 0 "[ . 1 . 2]" 1
689 1 24 LEU HB2 1 25 THR H . . 3.650 3.520 3.504 3.541 . 0 0 "[ . 1 . 2]" 1
690 1 24 LEU HB2 1 39 VAL MG1 . . 3.860 2.951 2.880 2.978 . 0 0 "[ . 1 . 2]" 1
691 1 24 LEU HB2 1 43 MET HB3 . . 4.300 4.173 4.125 4.226 . 0 0 "[ . 1 . 2]" 1
692 1 24 LEU HB3 1 24 LEU MD1 . . 2.910 2.657 2.654 2.660 . 0 0 "[ . 1 . 2]" 1
693 1 24 LEU HB3 1 24 LEU MD2 . . 3.190 2.205 2.199 2.211 . 0 0 "[ . 1 . 2]" 1
694 1 24 LEU HB3 1 25 THR H . . 3.440 2.345 2.325 2.365 . 0 0 "[ . 1 . 2]" 1
695 1 24 LEU HB3 1 25 THR HA . . 4.270 3.908 3.898 3.919 . 0 0 "[ . 1 . 2]" 1
696 1 24 LEU HB3 1 27 ALA H . . 5.500 5.173 5.139 5.185 . 0 0 "[ . 1 . 2]" 1
697 1 24 LEU HB3 1 28 LEU MD1 . . 4.630 4.116 4.070 4.236 . 0 0 "[ . 1 . 2]" 1
698 1 24 LEU HB3 1 39 VAL HB . . 4.550 4.327 4.213 4.356 . 0 0 "[ . 1 . 2]" 1
699 1 24 LEU HB3 1 39 VAL MG1 . . 3.930 1.799 1.785 1.817 . 0 0 "[ . 1 . 2]" 1
700 1 24 LEU HB3 1 43 MET HB3 . . 4.820 4.587 4.560 4.640 . 0 0 "[ . 1 . 2]" 1
701 1 24 LEU HB3 1 43 MET HG2 . . 5.500 4.371 4.338 4.411 . 0 0 "[ . 1 . 2]" 1
702 1 24 LEU MD1 1 25 THR H . . 5.500 4.595 4.578 4.613 . 0 0 "[ . 1 . 2]" 1
703 1 24 LEU MD1 1 39 VAL HA . . 3.620 3.664 3.626 3.675 0.055 16 0 "[ . 1 . 2]" 1
704 1 24 LEU MD1 1 42 MET HG2 . . 4.360 2.991 2.873 3.124 . 0 0 "[ . 1 . 2]" 1
705 1 24 LEU MD1 1 43 MET H . . 4.680 3.084 2.988 3.181 . 0 0 "[ . 1 . 2]" 1
706 1 24 LEU MD1 1 43 MET HA . . 4.790 3.211 3.190 3.246 . 0 0 "[ . 1 . 2]" 1
707 1 24 LEU MD1 1 43 MET HB3 . . 3.080 1.859 1.844 1.904 . 0 0 "[ . 1 . 2]" 1
708 1 24 LEU MD1 1 43 MET HG2 . . 4.920 2.775 2.751 2.805 . 0 0 "[ . 1 . 2]" 1
709 1 24 LEU MD2 1 27 ALA H . . 5.500 4.168 4.149 4.218 . 0 0 "[ . 1 . 2]" 1
710 1 24 LEU MD2 1 39 VAL HA . . 5.500 2.411 2.346 2.445 . 0 0 "[ . 1 . 2]" 1
711 1 24 LEU MD2 1 43 MET HG2 . . 5.500 4.013 3.998 4.026 . 0 0 "[ . 1 . 2]" 1
712 1 24 LEU HG 1 25 THR H . . 4.920 4.707 4.690 4.719 . 0 0 "[ . 1 . 2]" 1
713 1 24 LEU HG 1 27 ALA H . . 5.500 5.131 5.078 5.149 . 0 0 "[ . 1 . 2]" 1
714 1 24 LEU HG 1 27 ALA MB . . 5.500 3.846 3.766 3.880 . 0 0 "[ . 1 . 2]" 1
715 1 24 LEU HG 1 39 VAL HA . . 5.500 5.435 5.363 5.472 . 0 0 "[ . 1 . 2]" 1
716 1 25 THR H 1 25 THR HB . . 2.980 2.480 2.391 2.536 . 0 0 "[ . 1 . 2]" 1
717 1 25 THR H 1 25 THR MG . . 4.060 2.215 2.077 2.408 . 0 0 "[ . 1 . 2]" 1
718 1 25 THR H 1 26 ASP H . . 3.130 2.820 2.758 2.844 . 0 0 "[ . 1 . 2]" 1
719 1 25 THR H 1 26 ASP HA . . 5.500 5.386 5.342 5.410 . 0 0 "[ . 1 . 2]" 1
720 1 25 THR H 1 27 ALA H . . 5.500 4.154 4.099 4.169 . 0 0 "[ . 1 . 2]" 1
721 1 25 THR H 1 27 ALA MB . . 5.500 4.990 4.910 5.008 . 0 0 "[ . 1 . 2]" 1
722 1 25 THR H 1 28 LEU HB2 . . 5.500 5.566 5.546 5.657 0.157 2 0 "[ . 1 . 2]" 1
723 1 25 THR H 1 39 VAL HA . . 5.500 5.514 5.464 5.541 0.041 20 0 "[ . 1 . 2]" 1
724 1 25 THR H 1 39 VAL MG1 . . 3.750 2.544 2.497 2.650 . 0 0 "[ . 1 . 2]" 1
725 1 25 THR H 1 39 VAL MG2 . . 4.330 2.700 2.544 2.726 . 0 0 "[ . 1 . 2]" 1
726 1 25 THR HA 1 26 ASP HA . . 4.870 4.845 4.785 4.852 . 0 0 "[ . 1 . 2]" 1
727 1 25 THR HA 1 26 ASP QB . . 5.340 5.328 5.191 5.463 0.123 17 0 "[ . 1 . 2]" 1
728 1 25 THR HA 1 27 ALA H . . 4.370 3.794 3.782 3.884 . 0 0 "[ . 1 . 2]" 1
729 1 25 THR HA 1 28 LEU HB2 . . 3.620 3.016 2.990 3.135 . 0 0 "[ . 1 . 2]" 1
730 1 25 THR HA 1 28 LEU HB3 . . 4.810 4.728 4.701 4.826 0.016 2 0 "[ . 1 . 2]" 1
731 1 25 THR HA 1 28 LEU MD1 . . 5.500 3.547 3.515 3.575 . 0 0 "[ . 1 . 2]" 1
732 1 25 THR HA 1 29 ARG H . . 4.840 3.799 3.645 3.826 . 0 0 "[ . 1 . 2]" 1
733 1 25 THR HA 1 39 VAL HA . . 5.010 4.817 4.790 4.871 . 0 0 "[ . 1 . 2]" 1
734 1 25 THR HA 1 39 VAL HB . . 5.500 4.485 4.440 4.530 . 0 0 "[ . 1 . 2]" 1
735 1 25 THR HA 1 39 VAL MG1 . . 4.680 3.591 3.565 3.748 . 0 0 "[ . 1 . 2]" 1
736 1 25 THR HA 1 39 VAL MG2 . . 2.890 1.909 1.895 1.949 . 0 0 "[ . 1 . 2]" 1
737 1 25 THR HB 1 26 ASP H . . 4.180 3.897 3.885 3.911 . 0 0 "[ . 1 . 2]" 1
738 1 25 THR HB 1 39 VAL MG1 . . 5.190 3.053 2.912 3.259 . 0 0 "[ . 1 . 2]" 1
739 1 25 THR MG 1 26 ASP H . . 3.980 1.924 1.892 1.988 . 0 0 "[ . 1 . 2]" 1
740 1 25 THR MG 1 26 ASP HA . . 3.460 3.184 3.151 3.202 . 0 0 "[ . 1 . 2]" 1
741 1 25 THR MG 1 26 ASP QB . . 4.400 3.418 3.109 3.738 . 0 0 "[ . 1 . 2]" 1
742 1 25 THR MG 1 27 ALA H . . 5.500 4.109 4.092 4.124 . 0 0 "[ . 1 . 2]" 1
743 1 25 THR MG 1 29 ARG H . . 5.500 4.962 4.923 5.011 . 0 0 "[ . 1 . 2]" 1
744 1 25 THR MG 1 29 ARG HB3 . . 5.000 4.187 4.095 4.533 . 0 0 "[ . 1 . 2]" 1
745 1 25 THR MG 1 29 ARG HG2 . . 4.070 3.567 3.476 3.899 . 0 0 "[ . 1 . 2]" 1
746 1 25 THR MG 1 29 ARG HG3 . . 5.500 4.703 4.627 4.976 . 0 0 "[ . 1 . 2]" 1
747 1 25 THR MG 1 36 ALA HA . . 5.160 4.361 4.180 4.404 . 0 0 "[ . 1 . 2]" 1
748 1 25 THR MG 1 39 VAL HB . . 5.500 4.892 4.783 4.935 . 0 0 "[ . 1 . 2]" 1
749 1 26 ASP H 1 26 ASP QB . . 2.750 2.307 2.044 2.580 . 0 0 "[ . 1 . 2]" 1
750 1 26 ASP H 1 27 ALA MB . . 4.630 4.312 4.182 4.332 . 0 0 "[ . 1 . 2]" 1
751 1 26 ASP H 1 28 LEU H . . 5.350 4.714 4.651 4.808 . 0 0 "[ . 1 . 2]" 1
752 1 26 ASP H 1 29 ARG H . . 5.060 4.804 4.794 4.889 . 0 0 "[ . 1 . 2]" 1
753 1 26 ASP H 1 29 ARG HG3 . . 5.020 4.651 4.617 4.892 . 0 0 "[ . 1 . 2]" 1
754 1 26 ASP HA 1 28 LEU H . . 5.500 5.204 5.176 5.259 . 0 0 "[ . 1 . 2]" 1
755 1 26 ASP HA 1 29 ARG H . . 4.490 3.934 3.912 4.066 . 0 0 "[ . 1 . 2]" 1
756 1 26 ASP HA 1 29 ARG HD2 . . 3.800 3.602 3.434 3.832 0.032 2 0 "[ . 1 . 2]" 1
757 1 26 ASP QB 1 27 ALA H . . 3.430 2.942 2.896 3.014 . 0 0 "[ . 1 . 2]" 1
758 1 26 ASP QB 1 27 ALA HA . . 4.920 3.954 3.906 3.998 . 0 0 "[ . 1 . 2]" 1
759 1 26 ASP QB 1 29 ARG H . . 5.340 5.124 5.078 5.325 . 0 0 "[ . 1 . 2]" 1
760 1 26 ASP QB 1 30 THR H . . 5.340 5.298 5.220 5.377 0.037 1 0 "[ . 1 . 2]" 1
761 1 26 ASP QB 1 30 THR HB . . 5.340 5.233 5.116 5.319 . 0 0 "[ . 1 . 2]" 1
762 1 26 ASP HB2 1 27 ALA H . . 3.990 3.241 2.970 3.536 . 0 0 "[ . 1 . 2]" 1
763 1 26 ASP HB2 1 27 ALA MB . . 5.500 4.307 3.921 4.723 . 0 0 "[ . 1 . 2]" 1
764 1 26 ASP HB3 1 27 ALA H . . 3.990 3.622 3.198 4.020 0.030 17 0 "[ . 1 . 2]" 1
765 1 26 ASP HB3 1 27 ALA MB . . 5.500 4.479 4.025 4.919 . 0 0 "[ . 1 . 2]" 1
766 1 27 ALA H 1 27 ALA MB . . 2.840 2.126 2.117 2.153 . 0 0 "[ . 1 . 2]" 1
767 1 27 ALA H 1 28 LEU H . . 3.240 2.604 2.580 2.678 . 0 0 "[ . 1 . 2]" 1
768 1 27 ALA H 1 28 LEU HB2 . . 5.060 4.800 4.747 4.816 . 0 0 "[ . 1 . 2]" 1
769 1 27 ALA H 1 28 LEU MD2 . . 4.930 4.523 4.477 4.646 . 0 0 "[ . 1 . 2]" 1
770 1 27 ALA H 1 28 LEU HG . . 4.200 4.084 4.049 4.157 . 0 0 "[ . 1 . 2]" 1
771 1 27 ALA H 1 29 ARG H . . 3.860 3.510 3.478 3.740 . 0 0 "[ . 1 . 2]" 1
772 1 27 ALA H 1 29 ARG HG2 . . 5.500 4.638 4.616 4.650 . 0 0 "[ . 1 . 2]" 1
773 1 27 ALA H 1 30 THR HB . . 5.340 5.159 5.121 5.171 . 0 0 "[ . 1 . 2]" 1
774 1 27 ALA HA 1 28 LEU HG . . 5.500 5.510 5.492 5.569 0.069 2 0 "[ . 1 . 2]" 1
775 1 27 ALA HA 1 29 ARG H . . 4.980 3.967 3.909 4.387 . 0 0 "[ . 1 . 2]" 1
776 1 27 ALA HA 1 29 ARG HD2 . . 5.500 5.509 5.499 5.519 0.019 20 0 "[ . 1 . 2]" 1
777 1 27 ALA HA 1 30 THR H . . 3.890 3.298 3.277 3.417 . 0 0 "[ . 1 . 2]" 1
778 1 27 ALA HA 1 30 THR HB . . 3.870 2.723 2.702 2.753 . 0 0 "[ . 1 . 2]" 1
779 1 27 ALA HA 1 31 LEU H . . 4.460 4.124 3.859 4.203 . 0 0 "[ . 1 . 2]" 1
780 1 27 ALA HA 1 31 LEU HB2 . . 5.500 5.632 5.558 5.660 0.160 14 0 "[ . 1 . 2]" 1
781 1 27 ALA HA 1 31 LEU MD1 . . 5.500 4.222 4.169 4.437 . 0 0 "[ . 1 . 2]" 1
782 1 27 ALA HA 1 31 LEU MD2 . . 4.820 3.714 3.616 4.004 . 0 0 "[ . 1 . 2]" 1
783 1 27 ALA HA 1 31 LEU HG . . 5.500 3.495 3.474 3.561 . 0 0 "[ . 1 . 2]" 1
784 1 27 ALA HA 1 77 PHE HE2 . . 3.630 2.144 1.991 2.642 . 0 0 "[ . 1 . 2]" 1
785 1 27 ALA MB 1 28 LEU H . . 3.810 2.280 2.142 2.322 . 0 0 "[ . 1 . 2]" 1
786 1 27 ALA MB 1 28 LEU HA . . 4.250 3.607 3.591 3.614 . 0 0 "[ . 1 . 2]" 1
787 1 27 ALA MB 1 28 LEU HB2 . . 5.400 4.555 4.490 4.585 . 0 0 "[ . 1 . 2]" 1
788 1 27 ALA MB 1 28 LEU HB3 . . 5.500 4.945 4.920 4.983 . 0 0 "[ . 1 . 2]" 1
789 1 27 ALA MB 1 28 LEU HG . . 3.820 3.307 3.255 3.338 . 0 0 "[ . 1 . 2]" 1
790 1 27 ALA MB 1 29 ARG H . . 5.240 4.075 4.045 4.272 . 0 0 "[ . 1 . 2]" 1
791 1 27 ALA MB 1 77 PHE HD2 . . 5.500 3.012 2.921 3.427 . 0 0 "[ . 1 . 2]" 1
792 1 27 ALA MB 1 77 PHE HE2 . . 4.210 1.957 1.952 1.973 . 0 0 "[ . 1 . 2]" 1
793 1 28 LEU H 1 28 LEU HB2 . . 3.110 2.712 2.688 2.728 . 0 0 "[ . 1 . 2]" 1
794 1 28 LEU H 1 28 LEU HB3 . . 3.690 3.570 3.567 3.577 . 0 0 "[ . 1 . 2]" 1
795 1 28 LEU H 1 28 LEU MD2 . . 4.900 2.506 2.480 2.572 . 0 0 "[ . 1 . 2]" 1
796 1 28 LEU H 1 28 LEU HG . . 2.980 2.036 2.011 2.069 . 0 0 "[ . 1 . 2]" 1
797 1 28 LEU H 1 29 ARG H . . 3.010 2.693 2.672 2.823 . 0 0 "[ . 1 . 2]" 1
798 1 28 LEU H 1 29 ARG HA . . 5.500 5.289 5.270 5.402 . 0 0 "[ . 1 . 2]" 1
799 1 28 LEU H 1 29 ARG HB3 . . 4.990 4.863 4.830 5.053 0.063 2 0 "[ . 1 . 2]" 1
800 1 28 LEU H 1 30 THR H . . 4.200 4.094 4.066 4.100 . 0 0 "[ . 1 . 2]" 1
801 1 28 LEU HA 1 28 LEU HB3 . . 2.770 2.372 2.366 2.398 . 0 0 "[ . 1 . 2]" 1
802 1 28 LEU HA 1 28 LEU MD2 . . 3.000 2.205 2.143 2.225 . 0 0 "[ . 1 . 2]" 1
803 1 28 LEU HA 1 31 LEU H . . 4.050 3.503 3.442 3.524 . 0 0 "[ . 1 . 2]" 1
804 1 28 LEU HA 1 31 LEU HB2 . . 3.710 3.535 2.843 3.679 . 0 0 "[ . 1 . 2]" 1
805 1 28 LEU HA 1 31 LEU HG . . 5.500 3.763 3.208 3.841 . 0 0 "[ . 1 . 2]" 1
806 1 28 LEU HA 1 32 GLY H . . 4.320 3.407 3.273 4.194 . 0 0 "[ . 1 . 2]" 1
807 1 28 LEU HA 1 33 SER H . . 5.500 4.394 4.358 4.703 . 0 0 "[ . 1 . 2]" 1
808 1 28 LEU HA 1 34 THR MG . . 4.960 3.722 3.702 3.772 . 0 0 "[ . 1 . 2]" 1
809 1 28 LEU HB2 1 28 LEU MD1 . . 2.860 2.451 2.409 2.464 . 0 0 "[ . 1 . 2]" 1
810 1 28 LEU HB2 1 29 ARG H . . 3.430 3.025 2.601 3.085 . 0 0 "[ . 1 . 2]" 1
811 1 28 LEU HB2 1 29 ARG HA . . 4.480 4.252 4.125 4.275 . 0 0 "[ . 1 . 2]" 1
812 1 28 LEU HB2 1 33 SER H . . 5.500 5.206 5.094 5.232 . 0 0 "[ . 1 . 2]" 1
813 1 28 LEU HB2 1 34 THR HA . . 5.500 5.685 5.666 5.817 0.317 2 0 "[ . 1 . 2]" 1
814 1 28 LEU HB2 1 34 THR HB . . 5.040 4.121 4.100 4.155 . 0 0 "[ . 1 . 2]" 1
815 1 28 LEU HB2 1 34 THR MG . . 3.940 1.918 1.890 1.923 . 0 0 "[ . 1 . 2]" 1
816 1 28 LEU HB2 1 39 VAL MG2 . . 4.650 3.133 3.077 3.419 . 0 0 "[ . 1 . 2]" 1
817 1 28 LEU HB3 1 28 LEU MD1 . . 2.960 2.170 2.160 2.205 . 0 0 "[ . 1 . 2]" 1
818 1 28 LEU HB3 1 28 LEU MD2 . . 2.630 2.421 2.399 2.436 . 0 0 "[ . 1 . 2]" 1
819 1 28 LEU HB3 1 29 ARG H . . 4.390 4.104 3.796 4.149 . 0 0 "[ . 1 . 2]" 1
820 1 28 LEU HB3 1 32 GLY H . . 5.500 4.759 4.661 5.416 . 0 0 "[ . 1 . 2]" 1
821 1 28 LEU HB3 1 33 SER H . . 5.150 4.971 4.478 5.054 . 0 0 "[ . 1 . 2]" 1
822 1 28 LEU HB3 1 34 THR HB . . 3.990 3.493 3.470 3.661 . 0 0 "[ . 1 . 2]" 1
823 1 28 LEU HB3 1 34 THR MG . . 3.280 1.955 1.936 2.043 . 0 0 "[ . 1 . 2]" 1
824 1 28 LEU HB3 1 39 VAL MG2 . . 5.500 4.140 4.077 4.406 . 0 0 "[ . 1 . 2]" 1
825 1 28 LEU MD1 1 34 THR HB . . 4.400 4.250 4.099 4.283 . 0 0 "[ . 1 . 2]" 1
826 1 28 LEU MD1 1 38 GLU H . . 5.500 4.908 4.878 4.963 . 0 0 "[ . 1 . 2]" 1
827 1 28 LEU MD1 1 39 VAL H . . 5.500 3.967 3.828 4.132 . 0 0 "[ . 1 . 2]" 1
828 1 28 LEU MD1 1 39 VAL HA . . 3.070 2.347 2.307 2.519 . 0 0 "[ . 1 . 2]" 1
829 1 28 LEU MD1 1 42 MET H . . 5.500 4.429 4.375 4.603 . 0 0 "[ . 1 . 2]" 1
830 1 28 LEU MD1 1 42 MET HG2 . . 5.500 3.337 3.202 3.768 . 0 0 "[ . 1 . 2]" 1
831 1 28 LEU MD1 1 42 MET HG3 . . 5.500 4.259 4.199 4.450 . 0 0 "[ . 1 . 2]" 1
832 1 28 LEU MD2 1 29 ARG H . . 5.500 4.420 4.401 4.466 . 0 0 "[ . 1 . 2]" 1
833 1 28 LEU HG 1 29 ARG H . . 5.300 4.205 4.070 4.235 . 0 0 "[ . 1 . 2]" 1
834 1 29 ARG H 1 29 ARG HB3 . . 2.920 2.531 2.392 2.555 . 0 0 "[ . 1 . 2]" 1
835 1 29 ARG H 1 29 ARG HD2 . . 4.900 4.468 4.347 4.725 . 0 0 "[ . 1 . 2]" 1
836 1 29 ARG H 1 29 ARG HD3 . . 5.270 4.511 4.427 4.653 . 0 0 "[ . 1 . 2]" 1
837 1 29 ARG H 1 29 ARG HG2 . . 3.840 3.378 3.248 3.395 . 0 0 "[ . 1 . 2]" 1
838 1 29 ARG H 1 29 ARG HG3 . . 3.110 2.384 2.361 2.516 . 0 0 "[ . 1 . 2]" 1
839 1 29 ARG H 1 30 THR H . . 3.120 2.299 2.259 2.571 . 0 0 "[ . 1 . 2]" 1
840 1 29 ARG H 1 30 THR HA . . 5.340 4.970 4.936 5.207 . 0 0 "[ . 1 . 2]" 1
841 1 29 ARG H 1 31 LEU H . . 4.240 3.877 3.829 4.271 0.031 3 0 "[ . 1 . 2]" 1
842 1 29 ARG H 1 32 GLY H . . 5.500 4.261 4.168 4.852 . 0 0 "[ . 1 . 2]" 1
843 1 29 ARG H 1 34 THR MG . . 5.500 3.476 2.948 3.548 . 0 0 "[ . 1 . 2]" 1
844 1 29 ARG HA 1 29 ARG HD3 . . 3.860 3.688 3.629 3.842 . 0 0 "[ . 1 . 2]" 1
845 1 29 ARG HA 1 29 ARG HG3 . . 3.700 3.629 3.603 3.632 . 0 0 "[ . 1 . 2]" 1
846 1 29 ARG HA 1 31 LEU H . . 4.860 4.355 4.240 4.815 . 0 0 "[ . 1 . 2]" 1
847 1 29 ARG HA 1 32 GLY H . . 4.110 3.569 3.501 3.819 . 0 0 "[ . 1 . 2]" 1
848 1 29 ARG HA 1 33 SER H . . 3.820 2.228 2.048 3.128 . 0 0 "[ . 1 . 2]" 1
849 1 29 ARG HA 1 33 SER HA . . 5.160 2.034 1.952 2.113 . 0 0 "[ . 1 . 2]" 1
850 1 29 ARG HA 1 34 THR H . . 5.500 1.922 1.894 2.173 . 0 0 "[ . 1 . 2]" 1
851 1 29 ARG HA 1 34 THR MG . . 3.750 3.169 2.847 3.212 . 0 0 "[ . 1 . 2]" 1
852 1 29 ARG HB2 1 29 ARG HD3 . . 2.730 2.123 2.002 2.239 . 0 0 "[ . 1 . 2]" 1
853 1 29 ARG HB2 1 30 THR H . . 4.510 4.163 4.072 4.178 . 0 0 "[ . 1 . 2]" 1
854 1 29 ARG HB2 1 30 THR HA . . 5.120 4.854 4.785 4.864 . 0 0 "[ . 1 . 2]" 1
855 1 29 ARG HB2 1 33 SER H . . 5.500 4.333 4.161 5.368 . 0 0 "[ . 1 . 2]" 1
856 1 29 ARG HB3 1 29 ARG HG2 . . 2.400 2.258 2.235 2.260 . 0 0 "[ . 1 . 2]" 1
857 1 29 ARG HB3 1 29 ARG HG3 . . 2.740 2.663 2.657 2.710 . 0 0 "[ . 1 . 2]" 1
858 1 29 ARG HB3 1 30 THR H . . 4.780 3.976 3.924 3.986 . 0 0 "[ . 1 . 2]" 1
859 1 29 ARG HB3 1 33 SER H . . 5.500 4.701 4.539 5.593 0.093 3 0 "[ . 1 . 2]" 1
860 1 29 ARG HB3 1 34 THR HB . . 5.500 5.694 5.441 5.730 0.230 13 0 "[ . 1 . 2]" 1
861 1 29 ARG HB3 1 34 THR MG . . 3.640 3.413 3.167 3.447 . 0 0 "[ . 1 . 2]" 1
862 1 29 ARG HD2 1 29 ARG HG3 . . 2.890 2.232 2.219 2.268 . 0 0 "[ . 1 . 2]" 1
863 1 29 ARG HD2 1 30 THR H . . 4.690 3.485 3.327 3.621 . 0 0 "[ . 1 . 2]" 1
864 1 29 ARG HD2 1 30 THR HA . . 4.390 3.055 2.803 3.349 . 0 0 "[ . 1 . 2]" 1
865 1 29 ARG HD2 1 30 THR MG . . 5.500 4.176 4.081 4.280 . 0 0 "[ . 1 . 2]" 1
866 1 29 ARG HD3 1 30 THR H . . 5.220 3.969 3.650 4.195 . 0 0 "[ . 1 . 2]" 1
867 1 29 ARG HD3 1 30 THR HA . . 4.850 3.522 3.212 3.823 . 0 0 "[ . 1 . 2]" 1
868 1 29 ARG HG2 1 30 THR H . . 4.310 4.025 3.849 4.054 . 0 0 "[ . 1 . 2]" 1
869 1 29 ARG HG2 1 30 THR HA . . 5.500 5.260 5.235 5.270 . 0 0 "[ . 1 . 2]" 1
870 1 29 ARG HG3 1 30 THR H . . 4.920 2.303 2.116 2.334 . 0 0 "[ . 1 . 2]" 1
871 1 29 ARG HG3 1 30 THR HA . . 5.500 3.857 3.789 3.875 . 0 0 "[ . 1 . 2]" 1
872 1 29 ARG HG3 1 30 THR HB . . 5.500 3.916 3.833 3.940 . 0 0 "[ . 1 . 2]" 1
873 1 29 ARG HG3 1 34 THR MG . . 5.500 5.166 4.841 5.208 . 0 0 "[ . 1 . 2]" 1
874 1 30 THR H 1 30 THR HB . . 3.210 2.436 2.422 2.441 . 0 0 "[ . 1 . 2]" 1
875 1 30 THR H 1 30 THR MG . . 4.380 3.761 3.755 3.764 . 0 0 "[ . 1 . 2]" 1
876 1 30 THR H 1 31 LEU H . . 3.230 2.289 2.254 2.438 . 0 0 "[ . 1 . 2]" 1
877 1 30 THR H 1 31 LEU MD2 . . 5.500 3.928 3.812 4.481 . 0 0 "[ . 1 . 2]" 1
878 1 30 THR H 1 31 LEU HG . . 4.910 3.805 3.760 3.989 . 0 0 "[ . 1 . 2]" 1
879 1 30 THR HA 1 30 THR MG . . 3.270 2.440 2.380 2.453 . 0 0 "[ . 1 . 2]" 1
880 1 30 THR HA 1 31 LEU HG . . 5.500 5.248 5.182 5.553 0.053 3 0 "[ . 1 . 2]" 1
881 1 30 THR HA 1 32 GLY H . . 4.870 4.408 3.825 4.500 . 0 0 "[ . 1 . 2]" 1
882 1 30 THR HA 1 33 SER H . . 5.500 4.433 4.255 5.882 0.382 3 0 "[ . 1 . 2]" 1
883 1 30 THR HA 1 77 PHE HE1 . . 5.500 5.487 5.323 5.539 0.039 14 0 "[ . 1 . 2]" 1
884 1 30 THR HB 1 31 LEU H . . 3.460 2.883 2.514 2.998 . 0 0 "[ . 1 . 2]" 1
885 1 30 THR HB 1 31 LEU MD2 . . 3.520 2.376 2.174 3.140 . 0 0 "[ . 1 . 2]" 1
886 1 30 THR HB 1 31 LEU HG . . 4.390 3.207 3.167 3.500 . 0 0 "[ . 1 . 2]" 1
887 1 30 THR HB 1 77 PHE HE1 . . 3.720 3.473 3.382 3.508 . 0 0 "[ . 1 . 2]" 1
888 1 30 THR MG 1 31 LEU H . . 3.990 3.524 3.238 3.604 . 0 0 "[ . 1 . 2]" 1
889 1 30 THR MG 1 31 LEU HA . . 3.940 3.524 3.281 3.584 . 0 0 "[ . 1 . 2]" 1
890 1 30 THR MG 1 31 LEU MD2 . . 3.070 1.928 1.850 2.538 . 0 0 "[ . 1 . 2]" 1
891 1 30 THR MG 1 31 LEU HG . . 5.500 3.775 3.646 4.112 . 0 0 "[ . 1 . 2]" 1
892 1 30 THR MG 1 32 GLY H . . 5.500 4.960 4.538 5.024 . 0 0 "[ . 1 . 2]" 1
893 1 30 THR MG 1 77 PHE HE1 . . 4.360 1.967 1.849 2.076 . 0 0 "[ . 1 . 2]" 1
894 1 31 LEU H 1 31 LEU HB2 . . 2.910 2.831 2.620 2.878 . 0 0 "[ . 1 . 2]" 1
895 1 31 LEU H 1 31 LEU MD1 . . 5.500 3.906 3.734 3.931 . 0 0 "[ . 1 . 2]" 1
896 1 31 LEU H 1 31 LEU MD2 . . 2.770 2.783 2.690 2.890 0.120 20 0 "[ . 1 . 2]" 1
897 1 31 LEU H 1 31 LEU HG . . 3.220 2.349 2.148 2.419 . 0 0 "[ . 1 . 2]" 1
898 1 31 LEU H 1 32 GLY H . . 2.700 2.067 1.996 2.616 . 0 0 "[ . 1 . 2]" 1
899 1 31 LEU H 1 32 GLY QA . . 5.340 4.121 4.057 4.597 . 0 0 "[ . 1 . 2]" 1
900 1 31 LEU H 1 33 SER H . . 5.500 3.431 3.247 5.022 . 0 0 "[ . 1 . 2]" 1
901 1 31 LEU H 1 77 PHE HE1 . . 5.500 5.520 4.886 5.659 0.159 17 0 "[ . 1 . 2]" 1
902 1 31 LEU H 1 77 PHE HE2 . . 5.500 5.601 5.460 5.630 0.130 14 0 "[ . 1 . 2]" 1
903 1 31 LEU HA 1 31 LEU HB3 . . 2.790 2.306 2.287 2.398 . 0 0 "[ . 1 . 2]" 1
904 1 31 LEU HA 1 31 LEU MD2 . . 3.570 2.074 2.031 2.205 . 0 0 "[ . 1 . 2]" 1
905 1 31 LEU HA 1 31 LEU HG . . 3.610 3.579 3.405 3.620 0.010 7 0 "[ . 1 . 2]" 1
906 1 31 LEU HA 1 77 PHE HE1 . . 5.500 5.575 4.780 5.689 0.189 20 0 "[ . 1 . 2]" 1
907 1 31 LEU HB2 1 32 GLY H . . 3.070 3.130 3.079 3.148 0.078 4 0 "[ . 1 . 2]" 1
908 1 31 LEU HB2 1 32 GLY QA . . 5.340 3.843 3.819 3.968 . 0 0 "[ . 1 . 2]" 1
909 1 31 LEU HB2 1 33 SER H . . 5.500 4.960 4.750 5.012 . 0 0 "[ . 1 . 2]" 1
910 1 31 LEU HB3 1 32 GLY H . . 4.410 4.237 4.132 4.264 . 0 0 "[ . 1 . 2]" 1
911 1 31 LEU HB3 1 32 GLY QA . . 5.050 4.650 4.454 4.692 . 0 0 "[ . 1 . 2]" 1
912 1 31 LEU MD1 1 32 GLY H . . 5.500 4.877 4.852 4.995 . 0 0 "[ . 1 . 2]" 1
913 1 31 LEU MD2 1 77 PHE HA . . 5.500 4.767 4.440 4.912 . 0 0 "[ . 1 . 2]" 1
914 1 31 LEU MD2 1 77 PHE HE1 . . 5.200 2.466 2.357 2.813 . 0 0 "[ . 1 . 2]" 1
915 1 31 LEU HG 1 32 GLY H . . 5.500 3.982 3.902 4.355 . 0 0 "[ . 1 . 2]" 1
916 1 31 LEU HG 1 77 PHE HE1 . . 5.300 4.682 4.620 4.839 . 0 0 "[ . 1 . 2]" 1
917 1 32 GLY H 1 32 GLY QA . . 2.570 2.389 2.370 2.490 . 0 0 "[ . 1 . 2]" 1
918 1 32 GLY H 1 33 SER H . . 3.410 1.952 1.811 2.826 . 0 0 "[ . 1 . 2]" 1
919 1 32 GLY H 1 33 SER HA . . 4.940 4.092 4.025 4.119 . 0 0 "[ . 1 . 2]" 1
920 1 32 GLY H 1 34 THR MG . . 5.500 4.786 4.727 5.172 . 0 0 "[ . 1 . 2]" 1
921 1 32 GLY QA 1 33 SER H . . 2.930 2.790 2.352 2.844 . 0 0 "[ . 1 . 2]" 1
922 1 33 SER H 1 34 THR MG . . 5.500 4.190 3.808 4.263 . 0 0 "[ . 1 . 2]" 1
923 1 33 SER HA 1 34 THR H . . 3.190 2.825 2.138 2.913 . 0 0 "[ . 1 . 2]" 1
924 1 33 SER HA 1 34 THR HA . . 4.780 4.591 4.390 4.620 . 0 0 "[ . 1 . 2]" 1
925 1 33 SER HA 1 34 THR MG . . 5.500 4.627 3.979 4.711 . 0 0 "[ . 1 . 2]" 1
926 1 34 THR H 1 34 THR HB . . 4.000 2.609 2.510 3.426 . 0 0 "[ . 1 . 2]" 1
927 1 34 THR H 1 34 THR MG . . 3.160 2.401 2.327 2.846 . 0 0 "[ . 1 . 2]" 1
928 1 34 THR HA 1 34 THR HB . . 2.720 2.591 2.551 2.596 . 0 0 "[ . 1 . 2]" 1
929 1 34 THR HA 1 35 SER H . . 3.220 2.680 2.526 2.696 . 0 0 "[ . 1 . 2]" 1
930 1 34 THR HA 1 35 SER QB . . 5.340 4.468 3.969 4.692 . 0 0 "[ . 1 . 2]" 1
931 1 34 THR HA 1 38 GLU HG2 . . 5.500 5.053 4.882 5.622 0.122 3 0 "[ . 1 . 2]" 1
932 1 34 THR HA 1 38 GLU HG3 . . 5.500 4.691 4.128 4.871 . 0 0 "[ . 1 . 2]" 1
933 1 34 THR HB 1 35 SER H . . 3.750 3.602 3.580 3.766 0.016 3 0 "[ . 1 . 2]" 1
934 1 34 THR HB 1 38 GLU HB3 . . 5.500 5.384 5.237 5.550 0.050 17 0 "[ . 1 . 2]" 1
935 1 34 THR MG 1 35 SER H . . 3.730 2.336 2.294 2.697 . 0 0 "[ . 1 . 2]" 1
936 1 34 THR MG 1 35 SER HA . . 5.500 3.420 3.348 3.451 . 0 0 "[ . 1 . 2]" 1
937 1 34 THR MG 1 36 ALA HA . . 5.480 4.413 4.350 4.656 . 0 0 "[ . 1 . 2]" 1
938 1 34 THR MG 1 38 GLU H . . 4.720 3.784 3.675 4.325 . 0 0 "[ . 1 . 2]" 1
939 1 34 THR MG 1 38 GLU HB2 . . 4.270 2.732 2.605 3.181 . 0 0 "[ . 1 . 2]" 1
940 1 34 THR MG 1 38 GLU HB3 . . 5.500 4.062 3.930 4.477 . 0 0 "[ . 1 . 2]" 1
941 1 34 THR MG 1 39 VAL H . . 5.500 3.937 3.770 4.422 . 0 0 "[ . 1 . 2]" 1
942 1 34 THR MG 1 39 VAL HA . . 5.500 4.396 4.340 4.613 . 0 0 "[ . 1 . 2]" 1
943 1 35 SER H 1 35 SER HB2 . . 3.840 2.781 2.480 2.949 . 0 0 "[ . 1 . 2]" 1
944 1 35 SER H 1 35 SER HB3 . . 3.840 3.605 2.788 3.849 0.009 2 0 "[ . 1 . 2]" 1
945 1 35 SER H 1 36 ALA H . . 5.500 4.379 4.353 4.443 . 0 0 "[ . 1 . 2]" 1
946 1 35 SER H 1 38 GLU H . . 5.500 3.738 3.696 3.783 . 0 0 "[ . 1 . 2]" 1
947 1 35 SER H 1 38 GLU QG . . 5.340 2.857 2.427 2.963 . 0 0 "[ . 1 . 2]" 1
948 1 35 SER H 1 39 VAL MG2 . . 5.500 4.445 4.305 4.566 . 0 0 "[ . 1 . 2]" 1
949 1 35 SER HA 1 36 ALA H . . 3.260 2.670 2.545 2.715 . 0 0 "[ . 1 . 2]" 1
950 1 35 SER HA 1 36 ALA MB . . 4.910 4.223 4.170 4.253 . 0 0 "[ . 1 . 2]" 1
951 1 35 SER HA 1 37 ASP H . . 4.380 4.350 4.225 4.394 0.014 10 0 "[ . 1 . 2]" 1
952 1 35 SER HA 1 38 GLU H . . 5.070 5.039 4.982 5.102 0.032 1 0 "[ . 1 . 2]" 1
953 1 35 SER HA 1 39 VAL H . . 5.500 5.611 5.539 5.647 0.147 5 0 "[ . 1 . 2]" 1
954 1 35 SER QB 1 36 ALA MB . . 5.340 3.664 3.475 4.212 . 0 0 "[ . 1 . 2]" 1
955 1 35 SER QB 1 37 ASP H . . 3.780 2.452 2.360 2.519 . 0 0 "[ . 1 . 2]" 1
956 1 35 SER QB 1 37 ASP QB . . 4.090 2.836 2.682 2.944 . 0 0 "[ . 1 . 2]" 1
957 1 35 SER QB 1 38 GLU H . . 3.820 3.718 3.659 3.777 . 0 0 "[ . 1 . 2]" 1
958 1 35 SER QB 1 38 GLU QG . . 3.780 3.674 3.582 3.722 . 0 0 "[ . 1 . 2]" 1
959 1 35 SER HB2 1 37 ASP H . . 4.320 2.932 2.445 4.174 . 0 0 "[ . 1 . 2]" 1
960 1 35 SER HB3 1 37 ASP H . . 4.320 2.965 2.420 3.302 . 0 0 "[ . 1 . 2]" 1
961 1 36 ALA H 1 36 ALA MB . . 3.580 2.095 2.034 2.142 . 0 0 "[ . 1 . 2]" 1
962 1 36 ALA H 1 37 ASP H . . 3.490 2.532 2.498 2.619 . 0 0 "[ . 1 . 2]" 1
963 1 36 ALA H 1 39 VAL H . . 5.150 4.713 4.696 4.728 . 0 0 "[ . 1 . 2]" 1
964 1 36 ALA HA 1 36 ALA MB . . 2.400 2.093 2.083 2.102 . 0 0 "[ . 1 . 2]" 1
965 1 36 ALA HA 1 38 GLU H . . 4.400 3.630 3.579 3.730 . 0 0 "[ . 1 . 2]" 1
966 1 36 ALA HA 1 38 GLU QG . . 5.340 5.362 5.151 5.387 0.047 20 0 "[ . 1 . 2]" 1
967 1 36 ALA HA 1 39 VAL H . . 3.300 2.706 2.686 2.729 . 0 0 "[ . 1 . 2]" 1
968 1 36 ALA HA 1 39 VAL HA . . 5.500 4.425 4.398 4.439 . 0 0 "[ . 1 . 2]" 1
969 1 36 ALA HA 1 39 VAL HB . . 2.960 1.936 1.881 1.949 . 0 0 "[ . 1 . 2]" 1
970 1 36 ALA HA 1 39 VAL MG1 . . 4.380 3.446 3.401 3.463 . 0 0 "[ . 1 . 2]" 1
971 1 36 ALA HA 1 39 VAL MG2 . . 3.690 1.961 1.953 1.977 . 0 0 "[ . 1 . 2]" 1
972 1 36 ALA HA 1 40 GLN H . . 4.630 3.608 3.560 3.647 . 0 0 "[ . 1 . 2]" 1
973 1 36 ALA HA 1 40 GLN HB3 . . 5.500 5.561 5.531 5.584 0.084 20 0 "[ . 1 . 2]" 1
974 1 36 ALA HA 1 40 GLN HG2 . . 5.090 4.444 4.353 4.535 . 0 0 "[ . 1 . 2]" 1
975 1 36 ALA HA 1 40 GLN HG3 . . 5.500 5.534 5.480 5.593 0.093 13 0 "[ . 1 . 2]" 1
976 1 36 ALA MB 1 37 ASP H . . 3.760 2.924 2.894 2.967 . 0 0 "[ . 1 . 2]" 1
977 1 36 ALA MB 1 37 ASP HA . . 4.140 3.787 3.776 3.808 . 0 0 "[ . 1 . 2]" 1
978 1 36 ALA MB 1 37 ASP QB . . 5.340 4.387 4.190 4.606 . 0 0 "[ . 1 . 2]" 1
979 1 36 ALA MB 1 38 GLU H . . 5.010 4.348 4.312 4.422 . 0 0 "[ . 1 . 2]" 1
980 1 36 ALA MB 1 39 VAL H . . 5.500 3.975 3.937 4.035 . 0 0 "[ . 1 . 2]" 1
981 1 36 ALA MB 1 39 VAL HB . . 4.190 2.960 2.927 3.024 . 0 0 "[ . 1 . 2]" 1
982 1 36 ALA MB 1 40 GLN H . . 5.500 3.759 3.703 3.796 . 0 0 "[ . 1 . 2]" 1
983 1 36 ALA MB 1 40 GLN HG2 . . 4.140 3.542 3.381 3.671 . 0 0 "[ . 1 . 2]" 1
984 1 37 ASP H 1 37 ASP QB . . 2.970 2.206 2.060 2.374 . 0 0 "[ . 1 . 2]" 1
985 1 37 ASP H 1 38 GLU H . . 3.020 2.750 2.730 2.788 . 0 0 "[ . 1 . 2]" 1
986 1 37 ASP H 1 38 GLU QG . . 5.340 4.006 3.971 4.073 . 0 0 "[ . 1 . 2]" 1
987 1 37 ASP H 1 39 VAL H . . 5.070 3.893 3.875 3.945 . 0 0 "[ . 1 . 2]" 1
988 1 37 ASP H 1 39 VAL HB . . 5.020 4.893 4.831 4.921 . 0 0 "[ . 1 . 2]" 1
989 1 37 ASP H 1 40 GLN H . . 5.500 5.273 5.211 5.306 . 0 0 "[ . 1 . 2]" 1
990 1 37 ASP HA 1 37 ASP QB . . 2.550 2.471 2.428 2.525 . 0 0 "[ . 1 . 2]" 1
991 1 37 ASP HA 1 39 VAL H . . 5.500 4.314 4.250 4.468 . 0 0 "[ . 1 . 2]" 1
992 1 37 ASP HA 1 40 GLN H . . 4.770 4.608 4.518 4.655 . 0 0 "[ . 1 . 2]" 1
993 1 37 ASP HA 1 40 GLN HE22 . . 5.500 5.537 5.510 5.558 0.058 12 0 "[ . 1 . 2]" 1
994 1 37 ASP HA 1 40 GLN HG2 . . 5.500 3.328 3.201 3.418 . 0 0 "[ . 1 . 2]" 1
995 1 37 ASP HA 1 40 GLN HG3 . . 3.880 3.794 3.771 3.811 . 0 0 "[ . 1 . 2]" 1
996 1 37 ASP HA 1 41 ARG QG . . 5.340 4.079 3.955 4.277 . 0 0 "[ . 1 . 2]" 1
997 1 37 ASP QB 1 38 GLU H . . 3.310 2.895 2.789 2.968 . 0 0 "[ . 1 . 2]" 1
998 1 37 ASP HB2 1 39 VAL H . . 5.500 5.179 4.863 5.462 . 0 0 "[ . 1 . 2]" 1
999 1 37 ASP HB3 1 39 VAL H . . 5.500 5.166 4.852 5.478 . 0 0 "[ . 1 . 2]" 1
1000 1 38 GLU H 1 38 GLU HB2 . . 2.920 2.773 2.744 2.894 . 0 0 "[ . 1 . 2]" 1
1001 1 38 GLU H 1 38 GLU HB3 . . 3.840 3.718 3.687 3.733 . 0 0 "[ . 1 . 2]" 1
1002 1 38 GLU H 1 38 GLU QG . . 3.280 2.222 2.150 2.260 . 0 0 "[ . 1 . 2]" 1
1003 1 38 GLU H 1 39 VAL H . . 2.850 2.061 2.028 2.119 . 0 0 "[ . 1 . 2]" 1
1004 1 38 GLU H 1 39 VAL HA . . 4.800 4.681 4.646 4.749 . 0 0 "[ . 1 . 2]" 1
1005 1 38 GLU H 1 39 VAL HB . . 5.080 4.202 4.170 4.265 . 0 0 "[ . 1 . 2]" 1
1006 1 38 GLU H 1 39 VAL MG2 . . 4.560 3.677 3.596 3.797 . 0 0 "[ . 1 . 2]" 1
1007 1 38 GLU H 1 40 GLN HG2 . . 5.500 4.811 4.764 4.841 . 0 0 "[ . 1 . 2]" 1
1008 1 38 GLU H 1 40 GLN HG3 . . 5.500 4.931 4.877 4.971 . 0 0 "[ . 1 . 2]" 1
1009 1 38 GLU H 1 41 ARG QG . . 5.340 4.331 4.179 4.640 . 0 0 "[ . 1 . 2]" 1
1010 1 38 GLU HA 1 38 GLU HB3 . . 2.540 2.341 2.293 2.347 . 0 0 "[ . 1 . 2]" 1
1011 1 38 GLU HA 1 38 GLU QG . . 3.490 3.121 2.720 3.157 . 0 0 "[ . 1 . 2]" 1
1012 1 38 GLU HA 1 40 GLN H . . 5.500 4.847 4.742 4.932 . 0 0 "[ . 1 . 2]" 1
1013 1 38 GLU HA 1 41 ARG HB2 . . 3.610 2.938 2.859 2.983 . 0 0 "[ . 1 . 2]" 1
1014 1 38 GLU HA 1 41 ARG QD . . 4.580 3.600 1.980 4.531 . 0 0 "[ . 1 . 2]" 1
1015 1 38 GLU HA 1 41 ARG QG . . 3.480 2.567 2.416 2.831 . 0 0 "[ . 1 . 2]" 1
1016 1 38 GLU HB2 1 39 VAL H . . 3.310 3.194 3.012 3.272 . 0 0 "[ . 1 . 2]" 1
1017 1 38 GLU QG 1 39 VAL H . . 4.840 3.877 3.699 3.925 . 0 0 "[ . 1 . 2]" 1
1018 1 39 VAL H 1 39 VAL HB . . 2.690 2.395 2.366 2.418 . 0 0 "[ . 1 . 2]" 1
1019 1 39 VAL H 1 39 VAL MG2 . . 3.070 2.471 2.389 2.564 . 0 0 "[ . 1 . 2]" 1
1020 1 39 VAL H 1 41 ARG QD . . 5.340 5.268 4.963 5.426 0.086 6 0 "[ . 1 . 2]" 1
1021 1 39 VAL H 1 41 ARG QG . . 5.340 4.147 3.975 4.505 . 0 0 "[ . 1 . 2]" 1
1022 1 39 VAL HA 1 39 VAL MG1 . . 3.200 2.447 2.431 2.485 . 0 0 "[ . 1 . 2]" 1
1023 1 39 VAL HA 1 39 VAL MG2 . . 3.420 2.287 2.215 2.310 . 0 0 "[ . 1 . 2]" 1
1024 1 39 VAL HA 1 40 GLN HA . . 5.410 4.811 4.805 4.819 . 0 0 "[ . 1 . 2]" 1
1025 1 39 VAL HA 1 41 ARG H . . 4.370 3.929 3.906 3.952 . 0 0 "[ . 1 . 2]" 1
1026 1 39 VAL HA 1 42 MET H . . 3.580 3.201 3.186 3.218 . 0 0 "[ . 1 . 2]" 1
1027 1 39 VAL HA 1 42 MET QB . . 3.280 2.545 2.503 2.593 . 0 0 "[ . 1 . 2]" 1
1028 1 39 VAL HA 1 42 MET ME . . 5.500 5.020 4.941 5.065 . 0 0 "[ . 1 . 2]" 1
1029 1 39 VAL HA 1 42 MET HG2 . . 5.230 4.423 4.362 4.567 . 0 0 "[ . 1 . 2]" 1
1030 1 39 VAL HA 1 43 MET H . . 4.350 3.891 3.847 3.961 . 0 0 "[ . 1 . 2]" 1
1031 1 39 VAL HA 1 43 MET HG2 . . 4.990 4.428 4.370 4.488 . 0 0 "[ . 1 . 2]" 1
1032 1 39 VAL HB 1 40 GLN H . . 2.560 2.266 2.227 2.338 . 0 0 "[ . 1 . 2]" 1
1033 1 39 VAL MG1 1 40 GLN H . . 3.400 2.785 2.748 2.809 . 0 0 "[ . 1 . 2]" 1
1034 1 39 VAL MG1 1 41 ARG H . . 5.500 4.393 4.366 4.408 . 0 0 "[ . 1 . 2]" 1
1035 1 39 VAL MG1 1 42 MET H . . 5.500 4.290 4.245 4.340 . 0 0 "[ . 1 . 2]" 1
1036 1 39 VAL MG1 1 43 MET H . . 5.500 3.694 3.605 3.736 . 0 0 "[ . 1 . 2]" 1
1037 1 39 VAL MG1 1 43 MET HB3 . . 4.660 3.494 3.411 3.571 . 0 0 "[ . 1 . 2]" 1
1038 1 39 VAL MG1 1 43 MET HG2 . . 4.840 2.468 2.362 2.503 . 0 0 "[ . 1 . 2]" 1
1039 1 40 GLN H 1 40 GLN HB3 . . 2.850 2.726 2.714 2.737 . 0 0 "[ . 1 . 2]" 1
1040 1 40 GLN H 1 40 GLN HG2 . . 3.430 2.169 2.124 2.209 . 0 0 "[ . 1 . 2]" 1
1041 1 40 GLN H 1 40 GLN HG3 . . 3.470 2.548 2.529 2.572 . 0 0 "[ . 1 . 2]" 1
1042 1 40 GLN H 1 41 ARG QD . . 5.340 4.704 4.254 5.463 0.123 20 0 "[ . 1 . 2]" 1
1043 1 40 GLN H 1 41 ARG QG . . 4.370 3.843 3.808 3.918 . 0 0 "[ . 1 . 2]" 1
1044 1 40 GLN H 1 43 MET HG3 . . 4.950 4.513 4.483 4.543 . 0 0 "[ . 1 . 2]" 1
1045 1 40 GLN HA 1 40 GLN HE21 . . 5.500 4.328 4.288 4.363 . 0 0 "[ . 1 . 2]" 1
1046 1 40 GLN HA 1 40 GLN HG2 . . 4.050 3.800 3.779 3.819 . 0 0 "[ . 1 . 2]" 1
1047 1 40 GLN HA 1 40 GLN HG3 . . 3.770 3.646 3.635 3.657 . 0 0 "[ . 1 . 2]" 1
1048 1 40 GLN HA 1 43 MET H . . 4.000 3.697 3.648 3.739 . 0 0 "[ . 1 . 2]" 1
1049 1 40 GLN HA 1 43 MET HB3 . . 4.570 4.591 4.560 4.612 0.042 3 0 "[ . 1 . 2]" 1
1050 1 40 GLN HA 1 43 MET HG2 . . 3.110 2.527 2.485 2.567 . 0 0 "[ . 1 . 2]" 1
1051 1 40 GLN HA 1 43 MET HG3 . . 4.160 2.325 2.293 2.361 . 0 0 "[ . 1 . 2]" 1
1052 1 40 GLN HA 1 44 ALA H . . 4.220 3.948 3.863 3.997 . 0 0 "[ . 1 . 2]" 1
1053 1 40 GLN HB2 1 40 GLN HG3 . . 2.670 2.628 2.610 2.644 . 0 0 "[ . 1 . 2]" 1
1054 1 40 GLN HB2 1 41 ARG H . . 3.940 3.807 3.785 3.821 . 0 0 "[ . 1 . 2]" 1
1055 1 40 GLN HB2 1 43 MET HG3 . . 5.500 4.446 4.415 4.468 . 0 0 "[ . 1 . 2]" 1
1056 1 40 GLN HB3 1 40 GLN HG2 . . 2.560 2.288 2.277 2.299 . 0 0 "[ . 1 . 2]" 1
1057 1 40 GLN HB3 1 43 MET HG3 . . 5.500 4.651 4.608 4.693 . 0 0 "[ . 1 . 2]" 1
1058 1 40 GLN HE21 1 41 ARG HA . . 4.460 4.077 4.003 4.183 . 0 0 "[ . 1 . 2]" 1
1059 1 40 GLN HG2 1 41 ARG H . . 3.930 3.618 3.585 3.646 . 0 0 "[ . 1 . 2]" 1
1060 1 40 GLN HG3 1 41 ARG H . . 5.010 2.299 2.248 2.350 . 0 0 "[ . 1 . 2]" 1
1061 1 40 GLN HG3 1 41 ARG HA . . 4.100 4.016 4.006 4.032 . 0 0 "[ . 1 . 2]" 1
1062 1 40 GLN HG3 1 41 ARG QD . . 4.340 2.711 1.971 4.106 . 0 0 "[ . 1 . 2]" 1
1063 1 41 ARG H 1 41 ARG HB2 . . 2.930 2.730 2.655 2.774 . 0 0 "[ . 1 . 2]" 1
1064 1 41 ARG H 1 41 ARG HD2 . . 5.100 3.681 3.443 3.996 . 0 0 "[ . 1 . 2]" 1
1065 1 41 ARG H 1 41 ARG QD . . 4.420 3.170 2.805 3.754 . 0 0 "[ . 1 . 2]" 1
1066 1 41 ARG H 1 41 ARG HD3 . . 5.100 3.570 2.907 4.577 . 0 0 "[ . 1 . 2]" 1
1067 1 41 ARG H 1 41 ARG HG2 . . 3.630 2.428 1.956 3.303 . 0 0 "[ . 1 . 2]" 1
1068 1 41 ARG H 1 41 ARG HG3 . . 3.630 3.033 2.040 3.568 . 0 0 "[ . 1 . 2]" 1
1069 1 41 ARG H 1 42 MET H . . 2.590 2.331 2.322 2.348 . 0 0 "[ . 1 . 2]" 1
1070 1 41 ARG H 1 43 MET H . . 4.570 3.994 3.937 4.052 . 0 0 "[ . 1 . 2]" 1
1071 1 41 ARG H 1 43 MET HG2 . . 5.270 4.944 4.888 4.988 . 0 0 "[ . 1 . 2]" 1
1072 1 41 ARG H 1 43 MET HG3 . . 4.890 4.224 4.169 4.272 . 0 0 "[ . 1 . 2]" 1
1073 1 41 ARG HA 1 41 ARG HB3 . . 2.770 2.346 2.329 2.377 . 0 0 "[ . 1 . 2]" 1
1074 1 41 ARG HA 1 41 ARG QD . . 4.100 2.813 2.082 4.092 . 0 0 "[ . 1 . 2]" 1
1075 1 41 ARG HA 1 41 ARG HG2 . . 4.060 3.172 2.723 3.417 . 0 0 "[ . 1 . 2]" 1
1076 1 41 ARG HA 1 41 ARG QG . . 3.470 2.988 2.595 3.202 . 0 0 "[ . 1 . 2]" 1
1077 1 41 ARG HA 1 41 ARG HG3 . . 4.060 3.655 3.230 3.878 . 0 0 "[ . 1 . 2]" 1
1078 1 41 ARG HA 1 43 MET H . . 5.480 4.585 4.483 4.671 . 0 0 "[ . 1 . 2]" 1
1079 1 41 ARG HA 1 44 ALA H . . 3.810 3.529 3.460 3.589 . 0 0 "[ . 1 . 2]" 1
1080 1 41 ARG HB2 1 41 ARG HG2 . . 2.930 2.626 2.415 3.011 0.081 15 0 "[ . 1 . 2]" 1
1081 1 41 ARG HB2 1 41 ARG QG . . 2.350 2.232 2.167 2.363 0.013 16 0 "[ . 1 . 2]" 1
1082 1 41 ARG HB2 1 41 ARG HG3 . . 2.930 2.451 2.439 2.471 . 0 0 "[ . 1 . 2]" 1
1083 1 41 ARG HB2 1 42 MET H . . 3.060 2.863 2.754 2.945 . 0 0 "[ . 1 . 2]" 1
1084 1 41 ARG HB3 1 41 ARG QD . . 2.900 2.384 2.304 2.445 . 0 0 "[ . 1 . 2]" 1
1085 1 41 ARG HD2 1 42 MET H . . 5.500 5.080 4.973 5.259 . 0 0 "[ . 1 . 2]" 1
1086 1 41 ARG HD3 1 42 MET H . . 5.500 5.248 4.978 5.504 0.004 3 0 "[ . 1 . 2]" 1
1087 1 41 ARG QG 1 42 MET H . . 3.740 3.739 3.658 3.810 0.070 16 0 "[ . 1 . 2]" 1
1088 1 42 MET H 1 42 MET HB2 . . 3.240 2.774 2.728 2.809 . 0 0 "[ . 1 . 2]" 1
1089 1 42 MET H 1 42 MET QB . . 2.740 2.233 2.225 2.240 . 0 0 "[ . 1 . 2]" 1
1090 1 42 MET H 1 42 MET HB3 . . 3.240 2.355 2.341 2.373 . 0 0 "[ . 1 . 2]" 1
1091 1 42 MET H 1 42 MET ME . . 5.500 4.386 4.266 4.547 . 0 0 "[ . 1 . 2]" 1
1092 1 42 MET H 1 42 MET HG2 . . 4.600 4.371 4.334 4.397 . 0 0 "[ . 1 . 2]" 1
1093 1 42 MET H 1 42 MET HG3 . . 4.550 4.428 4.422 4.460 . 0 0 "[ . 1 . 2]" 1
1094 1 42 MET H 1 43 MET H . . 2.880 2.496 2.455 2.548 . 0 0 "[ . 1 . 2]" 1
1095 1 42 MET H 1 43 MET HA . . 5.500 5.147 5.113 5.192 . 0 0 "[ . 1 . 2]" 1
1096 1 42 MET H 1 43 MET HG3 . . 5.150 3.792 3.739 3.860 . 0 0 "[ . 1 . 2]" 1
1097 1 42 MET H 1 44 ALA H . . 3.930 3.690 3.626 3.766 . 0 0 "[ . 1 . 2]" 1
1098 1 42 MET H 1 44 ALA MB . . 4.860 4.282 4.244 4.336 . 0 0 "[ . 1 . 2]" 1
1099 1 42 MET HA 1 42 MET ME . . 4.320 2.929 2.842 3.196 . 0 0 "[ . 1 . 2]" 1
1100 1 42 MET HA 1 42 MET HG2 . . 3.620 3.648 3.570 3.663 0.043 14 0 "[ . 1 . 2]" 1
1101 1 42 MET HA 1 42 MET HG3 . . 3.500 2.556 2.540 2.570 . 0 0 "[ . 1 . 2]" 1
1102 1 42 MET HA 1 45 GLU H . . 4.170 3.980 3.898 4.110 . 0 0 "[ . 1 . 2]" 1
1103 1 42 MET HA 1 45 GLU HG2 . . 3.660 2.831 2.736 2.999 . 0 0 "[ . 1 . 2]" 1
1104 1 42 MET HA 1 62 PHE HE2 . . 5.500 5.555 5.528 5.581 0.081 4 0 "[ . 1 . 2]" 1
1105 1 42 MET QB 1 42 MET HG2 . . 2.630 2.173 2.166 2.204 . 0 0 "[ . 1 . 2]" 1
1106 1 42 MET QB 1 42 MET HG3 . . 2.490 2.500 2.473 2.506 0.016 14 0 "[ . 1 . 2]" 1
1107 1 42 MET QB 1 43 MET H . . 4.080 2.595 2.554 2.653 . 0 0 "[ . 1 . 2]" 1
1108 1 42 MET QB 1 46 ILE MD . . 5.340 3.827 3.760 4.002 . 0 0 "[ . 1 . 2]" 1
1109 1 42 MET ME 1 46 ILE MD . . 4.670 3.909 3.832 4.015 . 0 0 "[ . 1 . 2]" 1
1110 1 42 MET HG2 1 43 MET HA . . 4.420 3.854 3.701 3.944 . 0 0 "[ . 1 . 2]" 1
1111 1 42 MET HG2 1 46 ILE H . . 5.500 5.542 5.516 5.558 0.058 17 0 "[ . 1 . 2]" 1
1112 1 42 MET HG2 1 46 ILE HB . . 5.490 5.021 4.924 5.116 . 0 0 "[ . 1 . 2]" 1
1113 1 42 MET HG2 1 46 ILE MD . . 3.470 2.469 2.400 2.655 . 0 0 "[ . 1 . 2]" 1
1114 1 42 MET HG2 1 46 ILE HG12 . . 5.500 5.140 5.077 5.259 . 0 0 "[ . 1 . 2]" 1
1115 1 42 MET HG3 1 43 MET HA . . 4.690 4.167 4.123 4.322 . 0 0 "[ . 1 . 2]" 1
1116 1 42 MET HG3 1 46 ILE HB . . 5.270 4.989 4.919 5.198 . 0 0 "[ . 1 . 2]" 1
1117 1 42 MET HG3 1 46 ILE MD . . 2.920 2.482 2.384 2.638 . 0 0 "[ . 1 . 2]" 1
1118 1 42 MET HG3 1 46 ILE HG12 . . 5.500 4.434 4.352 4.594 . 0 0 "[ . 1 . 2]" 1
1119 1 42 MET HG3 1 62 PHE HE2 . . 5.500 5.450 5.380 5.521 0.021 3 0 "[ . 1 . 2]" 1
1120 1 43 MET H 1 43 MET HB2 . . 3.670 3.592 3.588 3.598 . 0 0 "[ . 1 . 2]" 1
1121 1 43 MET H 1 43 MET HB3 . . 2.890 2.773 2.756 2.802 . 0 0 "[ . 1 . 2]" 1
1122 1 43 MET H 1 43 MET ME . . 5.500 4.521 4.505 4.532 . 0 0 "[ . 1 . 2]" 1
1123 1 43 MET H 1 43 MET HG2 . . 4.420 2.764 2.733 2.784 . 0 0 "[ . 1 . 2]" 1
1124 1 43 MET H 1 43 MET HG3 . . 3.800 1.989 1.945 2.012 . 0 0 "[ . 1 . 2]" 1
1125 1 43 MET H 1 44 ALA H . . 3.260 2.431 2.391 2.463 . 0 0 "[ . 1 . 2]" 1
1126 1 43 MET H 1 44 ALA HA . . 5.390 5.012 4.987 5.037 . 0 0 "[ . 1 . 2]" 1
1127 1 43 MET H 1 44 ALA MB . . 4.680 4.040 3.990 4.107 . 0 0 "[ . 1 . 2]" 1
1128 1 43 MET H 1 45 GLU H . . 4.630 4.219 4.143 4.266 . 0 0 "[ . 1 . 2]" 1
1129 1 43 MET H 1 46 ILE H . . 5.050 4.777 4.758 4.823 . 0 0 "[ . 1 . 2]" 1
1130 1 43 MET H 1 46 ILE MD . . 5.120 4.070 3.961 4.360 . 0 0 "[ . 1 . 2]" 1
1131 1 43 MET HA 1 43 MET HB3 . . 2.990 2.388 2.383 2.395 . 0 0 "[ . 1 . 2]" 1
1132 1 43 MET HA 1 43 MET ME . . 4.560 4.205 4.184 4.228 . 0 0 "[ . 1 . 2]" 1
1133 1 43 MET HA 1 43 MET HG3 . . 3.730 3.554 3.553 3.557 . 0 0 "[ . 1 . 2]" 1
1134 1 43 MET HA 1 46 ILE H . . 3.320 2.931 2.921 2.955 . 0 0 "[ . 1 . 2]" 1
1135 1 43 MET HA 1 46 ILE HB . . 3.420 2.184 2.146 2.290 . 0 0 "[ . 1 . 2]" 1
1136 1 43 MET HA 1 46 ILE MD . . 3.500 2.418 2.289 2.639 . 0 0 "[ . 1 . 2]" 1
1137 1 43 MET HA 1 46 ILE HG13 . . 4.140 3.239 3.160 3.302 . 0 0 "[ . 1 . 2]" 1
1138 1 43 MET HA 1 47 ASP H . . 4.160 3.567 3.531 3.631 . 0 0 "[ . 1 . 2]" 1
1139 1 43 MET HA 1 47 ASP HA . . 5.500 5.537 5.505 5.579 0.079 2 0 "[ . 1 . 2]" 1
1140 1 43 MET HA 1 54 ILE MD . . 3.650 2.531 2.457 2.700 . 0 0 "[ . 1 . 2]" 1
1141 1 43 MET HA 1 54 ILE HG13 . . 3.410 2.948 2.864 3.098 . 0 0 "[ . 1 . 2]" 1
1142 1 43 MET HA 1 54 ILE MG . . 5.500 4.297 4.255 4.423 . 0 0 "[ . 1 . 2]" 1
1143 1 43 MET HB2 1 43 MET ME . . 2.990 1.998 1.957 2.033 . 0 0 "[ . 1 . 2]" 1
1144 1 43 MET HB2 1 44 ALA H . . 4.110 3.884 3.831 3.938 . 0 0 "[ . 1 . 2]" 1
1145 1 43 MET HB2 1 44 ALA HA . . 4.930 4.499 4.476 4.521 . 0 0 "[ . 1 . 2]" 1
1146 1 43 MET HB2 1 46 ILE HB . . 4.750 3.891 3.832 3.985 . 0 0 "[ . 1 . 2]" 1
1147 1 43 MET HB2 1 54 ILE HG13 . . 3.060 2.601 2.544 2.662 . 0 0 "[ . 1 . 2]" 1
1148 1 43 MET HB3 1 43 MET HG2 . . 2.890 2.206 2.205 2.206 . 0 0 "[ . 1 . 2]" 1
1149 1 43 MET HB3 1 44 ALA H . . 4.330 4.167 4.117 4.204 . 0 0 "[ . 1 . 2]" 1
1150 1 43 MET HB3 1 46 ILE H . . 5.500 5.265 5.249 5.296 . 0 0 "[ . 1 . 2]" 1
1151 1 43 MET HB3 1 46 ILE HB . . 5.500 4.192 4.142 4.289 . 0 0 "[ . 1 . 2]" 1
1152 1 43 MET HB3 1 47 ASP H . . 5.500 5.330 5.285 5.384 . 0 0 "[ . 1 . 2]" 1
1153 1 43 MET ME 1 43 MET HG2 . . 3.580 2.510 2.491 2.531 . 0 0 "[ . 1 . 2]" 1
1154 1 43 MET ME 1 44 ALA H . . 5.500 4.820 4.744 4.880 . 0 0 "[ . 1 . 2]" 1
1155 1 43 MET ME 1 47 ASP H . . 5.500 5.150 5.141 5.155 . 0 0 "[ . 1 . 2]" 1
1156 1 43 MET ME 1 47 ASP QB . . 5.120 4.178 4.013 4.260 . 0 0 "[ . 1 . 2]" 1
1157 1 43 MET ME 1 52 GLY H . . 4.910 4.236 4.145 4.353 . 0 0 "[ . 1 . 2]" 1
1158 1 43 MET ME 1 52 GLY QA . . 3.840 3.042 2.916 3.178 . 0 0 "[ . 1 . 2]" 1
1159 1 43 MET ME 1 53 PHE H . . 3.930 3.533 3.432 3.638 . 0 0 "[ . 1 . 2]" 1
1160 1 43 MET ME 1 53 PHE HA . . 5.500 2.520 2.480 2.563 . 0 0 "[ . 1 . 2]" 1
1161 1 43 MET ME 1 53 PHE HB3 . . 5.500 4.587 4.530 4.638 . 0 0 "[ . 1 . 2]" 1
1162 1 43 MET ME 1 53 PHE QD . . 5.500 4.315 4.273 4.389 . 0 0 "[ . 1 . 2]" 1
1163 1 43 MET ME 1 54 ILE H . . 3.950 3.225 3.087 3.320 . 0 0 "[ . 1 . 2]" 1
1164 1 43 MET HG2 1 44 ALA H . . 4.280 3.927 3.829 4.013 . 0 0 "[ . 1 . 2]" 1
1165 1 43 MET HG2 1 54 ILE HG13 . . 5.500 4.738 4.689 4.846 . 0 0 "[ . 1 . 2]" 1
1166 1 43 MET HG3 1 44 ALA H . . 4.100 2.214 2.107 2.308 . 0 0 "[ . 1 . 2]" 1
1167 1 43 MET HG3 1 44 ALA HA . . 4.880 3.996 3.926 4.038 . 0 0 "[ . 1 . 2]" 1
1168 1 43 MET HG3 1 44 ALA MB . . 4.520 3.593 3.569 3.622 . 0 0 "[ . 1 . 2]" 1
1169 1 43 MET HG3 1 46 ILE H . . 5.500 5.438 5.371 5.536 0.036 6 0 "[ . 1 . 2]" 1
1170 1 44 ALA H 1 44 ALA HA . . 2.850 2.788 2.755 2.811 . 0 0 "[ . 1 . 2]" 1
1171 1 44 ALA H 1 44 ALA MB . . 2.770 2.096 2.074 2.150 . 0 0 "[ . 1 . 2]" 1
1172 1 44 ALA H 1 45 GLU HG2 . . 4.590 3.895 3.836 3.956 . 0 0 "[ . 1 . 2]" 1
1173 1 44 ALA H 1 47 ASP H . . 5.270 4.754 4.711 4.790 . 0 0 "[ . 1 . 2]" 1
1174 1 44 ALA HA 1 47 ASP H . . 4.190 3.965 3.834 4.059 . 0 0 "[ . 1 . 2]" 1
1175 1 44 ALA HA 1 47 ASP QB . . 3.850 3.168 3.069 3.238 . 0 0 "[ . 1 . 2]" 1
1176 1 44 ALA HA 1 54 ILE MD . . 5.500 4.527 4.495 4.647 . 0 0 "[ . 1 . 2]" 1
1177 1 44 ALA MB 1 45 GLU H . . 3.440 2.857 2.810 2.890 . 0 0 "[ . 1 . 2]" 1
1178 1 44 ALA MB 1 45 GLU HA . . 4.440 3.898 3.887 3.927 . 0 0 "[ . 1 . 2]" 1
1179 1 44 ALA MB 1 45 GLU HG2 . . 4.480 3.885 3.831 3.952 . 0 0 "[ . 1 . 2]" 1
1180 1 45 GLU H 1 45 GLU HB3 . . 3.040 2.933 2.918 2.957 . 0 0 "[ . 1 . 2]" 1
1181 1 45 GLU H 1 45 GLU HG2 . . 2.590 1.878 1.838 1.895 . 0 0 "[ . 1 . 2]" 1
1182 1 45 GLU H 1 45 GLU HG3 . . 5.500 2.853 2.833 2.879 . 0 0 "[ . 1 . 2]" 1
1183 1 45 GLU H 1 46 ILE H . . 2.730 2.219 2.203 2.261 . 0 0 "[ . 1 . 2]" 1
1184 1 45 GLU H 1 46 ILE MD . . 5.500 4.740 4.610 4.927 . 0 0 "[ . 1 . 2]" 1
1185 1 45 GLU H 1 46 ILE HG12 . . 5.500 5.495 5.417 5.526 0.026 20 0 "[ . 1 . 2]" 1
1186 1 45 GLU H 1 46 ILE HG13 . . 4.150 3.872 3.798 3.937 . 0 0 "[ . 1 . 2]" 1
1187 1 45 GLU H 1 47 ASP H . . 4.110 3.841 3.703 3.912 . 0 0 "[ . 1 . 2]" 1
1188 1 45 GLU H 1 47 ASP QB . . 5.340 4.712 4.598 4.799 . 0 0 "[ . 1 . 2]" 1
1189 1 45 GLU H 1 54 ILE MD . . 5.500 4.744 4.696 4.827 . 0 0 "[ . 1 . 2]" 1
1190 1 45 GLU HA 1 45 GLU HG2 . . 3.810 3.692 3.670 3.703 . 0 0 "[ . 1 . 2]" 1
1191 1 45 GLU HA 1 45 GLU HG3 . . 3.980 3.787 3.778 3.809 . 0 0 "[ . 1 . 2]" 1
1192 1 45 GLU HA 1 47 ASP QB . . 5.340 4.914 4.767 5.041 . 0 0 "[ . 1 . 2]" 1
1193 1 45 GLU HA 1 62 PHE HE2 . . 5.250 5.184 4.687 5.278 0.028 8 0 "[ . 1 . 2]" 1
1194 1 45 GLU HB2 1 46 ILE H . . 4.180 3.767 3.569 3.936 . 0 0 "[ . 1 . 2]" 1
1195 1 45 GLU HB2 1 46 ILE HA . . 4.740 4.408 4.318 4.482 . 0 0 "[ . 1 . 2]" 1
1196 1 45 GLU HB2 1 46 ILE HG13 . . 4.820 4.460 4.368 4.490 . 0 0 "[ . 1 . 2]" 1
1197 1 45 GLU HB2 1 62 PHE HE2 . . 3.690 2.795 2.334 2.880 . 0 0 "[ . 1 . 2]" 1
1198 1 45 GLU HB3 1 45 GLU HG2 . . 2.520 2.444 2.437 2.466 . 0 0 "[ . 1 . 2]" 1
1199 1 45 GLU HB3 1 46 ILE H . . 4.640 4.100 3.986 4.218 . 0 0 "[ . 1 . 2]" 1
1200 1 45 GLU HG2 1 62 PHE HE2 . . 5.500 3.912 3.703 3.994 . 0 0 "[ . 1 . 2]" 1
1201 1 45 GLU HG3 1 46 ILE H . . 4.440 2.404 2.141 2.699 . 0 0 "[ . 1 . 2]" 1
1202 1 45 GLU HG3 1 46 ILE HA . . 5.500 3.631 3.569 3.758 . 0 0 "[ . 1 . 2]" 1
1203 1 45 GLU HG3 1 46 ILE HG12 . . 3.740 3.533 3.436 3.579 . 0 0 "[ . 1 . 2]" 1
1204 1 45 GLU HG3 1 62 PHE HE2 . . 5.300 2.601 2.341 2.724 . 0 0 "[ . 1 . 2]" 1
1205 1 46 ILE H 1 46 ILE HB . . 2.670 2.471 2.454 2.504 . 0 0 "[ . 1 . 2]" 1
1206 1 46 ILE H 1 46 ILE MD . . 4.070 3.526 3.399 3.620 . 0 0 "[ . 1 . 2]" 1
1207 1 46 ILE H 1 46 ILE HG12 . . 3.820 3.596 3.436 3.697 . 0 0 "[ . 1 . 2]" 1
1208 1 46 ILE H 1 46 ILE HG13 . . 3.130 2.268 2.158 2.406 . 0 0 "[ . 1 . 2]" 1
1209 1 46 ILE H 1 47 ASP H . . 2.730 2.529 2.369 2.641 . 0 0 "[ . 1 . 2]" 1
1210 1 46 ILE H 1 47 ASP HA . . 5.410 5.140 5.003 5.234 . 0 0 "[ . 1 . 2]" 1
1211 1 46 ILE H 1 47 ASP QB . . 5.050 4.184 4.023 4.322 . 0 0 "[ . 1 . 2]" 1
1212 1 46 ILE H 1 54 ILE MD . . 3.960 3.462 3.360 3.597 . 0 0 "[ . 1 . 2]" 1
1213 1 46 ILE HA 1 46 ILE HG12 . . 3.530 2.566 2.504 2.645 . 0 0 "[ . 1 . 2]" 1
1214 1 46 ILE HA 1 46 ILE HG13 . . 3.390 2.891 2.858 2.967 . 0 0 "[ . 1 . 2]" 1
1215 1 46 ILE HA 1 46 ILE MG . . 3.300 2.413 2.323 2.423 . 0 0 "[ . 1 . 2]" 1
1216 1 46 ILE HA 1 47 ASP HA . . 5.500 4.838 4.813 4.855 . 0 0 "[ . 1 . 2]" 1
1217 1 46 ILE HA 1 62 PHE HB2 . . 4.200 2.622 2.595 2.659 . 0 0 "[ . 1 . 2]" 1
1218 1 46 ILE HA 1 62 PHE HB3 . . 3.960 3.594 3.548 3.647 . 0 0 "[ . 1 . 2]" 1
1219 1 46 ILE HA 1 63 CYS H . . 5.500 5.613 5.591 5.634 0.134 12 0 "[ . 1 . 2]" 1
1220 1 46 ILE HB 1 46 ILE MD . . 3.020 2.397 2.359 2.412 . 0 0 "[ . 1 . 2]" 1
1221 1 46 ILE HB 1 47 ASP H . . 3.170 2.741 2.686 2.838 . 0 0 "[ . 1 . 2]" 1
1222 1 46 ILE HB 1 47 ASP QB . . 5.340 4.272 4.245 4.320 . 0 0 "[ . 1 . 2]" 1
1223 1 46 ILE HB 1 54 ILE HB . . 5.500 5.300 5.229 5.350 . 0 0 "[ . 1 . 2]" 1
1224 1 46 ILE HB 1 54 ILE MD . . 2.820 2.019 1.959 2.058 . 0 0 "[ . 1 . 2]" 1
1225 1 46 ILE HB 1 59 PHE HA . . 5.170 5.113 5.013 5.147 . 0 0 "[ . 1 . 2]" 1
1226 1 46 ILE HB 1 59 PHE HD1 . . 5.500 5.162 5.093 5.203 . 0 0 "[ . 1 . 2]" 1
1227 1 46 ILE HB 1 62 PHE HB3 . . 5.270 5.015 4.910 5.080 . 0 0 "[ . 1 . 2]" 1
1228 1 46 ILE MD 1 46 ILE MG . . 2.400 1.942 1.917 2.061 . 0 0 "[ . 1 . 2]" 1
1229 1 46 ILE MD 1 47 ASP H . . 5.420 4.630 4.545 4.750 . 0 0 "[ . 1 . 2]" 1
1230 1 46 ILE MD 1 54 ILE HG13 . . 4.720 3.408 3.314 3.566 . 0 0 "[ . 1 . 2]" 1
1231 1 46 ILE MD 1 59 PHE HA . . 4.090 3.941 3.928 3.948 . 0 0 "[ . 1 . 2]" 1
1232 1 46 ILE MD 1 62 PHE HB2 . . 4.390 3.906 3.776 3.960 . 0 0 "[ . 1 . 2]" 1
1233 1 46 ILE MD 1 62 PHE HB3 . . 4.850 3.384 3.240 3.441 . 0 0 "[ . 1 . 2]" 1
1234 1 46 ILE MD 1 63 CYS H . . 5.500 4.512 4.333 4.575 . 0 0 "[ . 1 . 2]" 1
1235 1 46 ILE HG12 1 47 ASP H . . 5.500 5.075 5.057 5.102 . 0 0 "[ . 1 . 2]" 1
1236 1 46 ILE HG12 1 62 PHE H . . 5.500 4.593 4.534 4.685 . 0 0 "[ . 1 . 2]" 1
1237 1 46 ILE HG12 1 62 PHE HB2 . . 3.630 2.601 2.542 2.692 . 0 0 "[ . 1 . 2]" 1
1238 1 46 ILE HG13 1 47 ASP H . . 4.420 4.317 4.271 4.339 . 0 0 "[ . 1 . 2]" 1
1239 1 46 ILE HG13 1 54 ILE MD . . 4.640 4.180 4.134 4.201 . 0 0 "[ . 1 . 2]" 1
1240 1 46 ILE HG13 1 54 ILE MG . . 5.500 5.164 5.138 5.203 . 0 0 "[ . 1 . 2]" 1
1241 1 46 ILE HG13 1 62 PHE HB2 . . 4.590 4.130 4.061 4.246 . 0 0 "[ . 1 . 2]" 1
1242 1 46 ILE HG13 1 62 PHE HB3 . . 4.050 3.839 3.747 3.906 . 0 0 "[ . 1 . 2]" 1
1243 1 46 ILE HG13 1 62 PHE HE2 . . 4.730 3.965 3.829 4.049 . 0 0 "[ . 1 . 2]" 1
1244 1 46 ILE MG 1 47 ASP H . . 4.170 3.462 3.404 3.580 . 0 0 "[ . 1 . 2]" 1
1245 1 46 ILE MG 1 54 ILE MG . . 3.830 2.037 1.922 2.092 . 0 0 "[ . 1 . 2]" 1
1246 1 46 ILE MG 1 55 ASP H . . 5.500 5.020 4.978 5.104 . 0 0 "[ . 1 . 2]" 1
1247 1 46 ILE MG 1 58 GLU HB2 . . 3.570 2.763 2.716 2.915 . 0 0 "[ . 1 . 2]" 1
1248 1 46 ILE MG 1 58 GLU HB3 . . 5.270 4.251 4.207 4.388 . 0 0 "[ . 1 . 2]" 1
1249 1 46 ILE MG 1 58 GLU QG . . 4.980 2.775 2.735 2.845 . 0 0 "[ . 1 . 2]" 1
1250 1 46 ILE MG 1 59 PHE H . . 4.450 3.930 3.910 3.966 . 0 0 "[ . 1 . 2]" 1
1251 1 46 ILE MG 1 59 PHE HA . . 4.230 2.490 2.461 2.523 . 0 0 "[ . 1 . 2]" 1
1252 1 46 ILE MG 1 59 PHE HD1 . . 3.720 2.967 2.877 3.176 . 0 0 "[ . 1 . 2]" 1
1253 1 46 ILE MG 1 62 PHE H . . 4.140 3.198 3.147 3.239 . 0 0 "[ . 1 . 2]" 1
1254 1 46 ILE MG 1 62 PHE HA . . 5.230 4.644 4.612 4.689 . 0 0 "[ . 1 . 2]" 1
1255 1 46 ILE MG 1 62 PHE HB2 . . 3.870 2.071 1.997 2.229 . 0 0 "[ . 1 . 2]" 1
1256 1 46 ILE MG 1 62 PHE HB3 . . 4.320 2.998 2.920 3.076 . 0 0 "[ . 1 . 2]" 1
1257 1 46 ILE MG 1 63 CYS H . . 5.170 3.740 3.661 3.779 . 0 0 "[ . 1 . 2]" 1
1258 1 47 ASP H 1 47 ASP HB2 . . 3.620 2.081 2.068 2.126 . 0 0 "[ . 1 . 2]" 1
1259 1 47 ASP H 1 47 ASP QB . . 2.870 2.054 2.045 2.088 . 0 0 "[ . 1 . 2]" 1
1260 1 47 ASP H 1 47 ASP HB3 . . 3.620 3.175 3.054 3.232 . 0 0 "[ . 1 . 2]" 1
1261 1 47 ASP H 1 54 ILE MD . . 3.790 2.231 2.176 2.325 . 0 0 "[ . 1 . 2]" 1
1262 1 47 ASP H 1 54 ILE HG12 . . 4.900 4.734 4.679 4.804 . 0 0 "[ . 1 . 2]" 1
1263 1 47 ASP H 1 58 GLU HB2 . . 5.070 4.945 4.864 5.079 0.009 6 0 "[ . 1 . 2]" 1
1264 1 47 ASP HA 1 48 THR H . . 3.020 2.153 2.146 2.184 . 0 0 "[ . 1 . 2]" 1
1265 1 47 ASP HA 1 50 GLY H . . 5.500 3.581 3.541 3.631 . 0 0 "[ . 1 . 2]" 1
1266 1 47 ASP HA 1 50 GLY HA2 . . 5.500 4.461 4.346 4.666 . 0 0 "[ . 1 . 2]" 1
1267 1 47 ASP HA 1 54 ILE MD . . 3.640 2.180 2.072 2.229 . 0 0 "[ . 1 . 2]" 1
1268 1 47 ASP HA 1 54 ILE MG . . 5.500 4.018 3.916 4.081 . 0 0 "[ . 1 . 2]" 1
1269 1 47 ASP HA 1 58 GLU HB2 . . 4.110 3.278 3.198 3.384 . 0 0 "[ . 1 . 2]" 1
1270 1 47 ASP QB 1 49 ASP H . . 3.730 3.624 3.571 3.760 0.030 6 0 "[ . 1 . 2]" 1
1271 1 47 ASP QB 1 49 ASP QB . . 5.180 5.350 5.273 5.382 0.202 17 0 "[ . 1 . 2]" 1
1272 1 47 ASP QB 1 50 GLY H . . 4.220 2.282 2.215 2.574 . 0 0 "[ . 1 . 2]" 1
1273 1 47 ASP QB 1 50 GLY HA2 . . 3.770 2.013 1.955 2.326 . 0 0 "[ . 1 . 2]" 1
1274 1 47 ASP QB 1 51 ASP H . . 5.340 3.640 3.567 3.816 . 0 0 "[ . 1 . 2]" 1
1275 1 47 ASP QB 1 54 ILE HG12 . . 4.480 4.305 4.106 4.404 . 0 0 "[ . 1 . 2]" 1
1276 1 47 ASP HB2 1 50 GLY HA2 . . 4.480 3.177 3.083 3.574 . 0 0 "[ . 1 . 2]" 1
1277 1 47 ASP HB2 1 54 ILE MD . . 3.980 2.509 2.277 2.632 . 0 0 "[ . 1 . 2]" 1
1278 1 47 ASP HB3 1 50 GLY HA2 . . 4.480 2.036 1.976 2.357 . 0 0 "[ . 1 . 2]" 1
1279 1 47 ASP HB3 1 54 ILE MD . . 3.980 3.593 3.464 3.647 . 0 0 "[ . 1 . 2]" 1
1280 1 48 THR H 1 48 THR HB . . 3.220 2.517 2.497 2.564 . 0 0 "[ . 1 . 2]" 1
1281 1 48 THR H 1 50 GLY H . . 5.270 3.627 3.586 3.749 . 0 0 "[ . 1 . 2]" 1
1282 1 48 THR H 1 54 ILE MD . . 4.380 3.778 3.614 3.848 . 0 0 "[ . 1 . 2]" 1
1283 1 48 THR H 1 55 ASP H . . 5.090 5.007 4.964 5.080 . 0 0 "[ . 1 . 2]" 1
1284 1 48 THR H 1 58 GLU HA . . 4.680 4.427 4.346 4.541 . 0 0 "[ . 1 . 2]" 1
1285 1 48 THR H 1 58 GLU HB2 . . 3.420 2.524 2.340 2.611 . 0 0 "[ . 1 . 2]" 1
1286 1 48 THR H 1 58 GLU HB3 . . 3.890 2.433 2.345 2.555 . 0 0 "[ . 1 . 2]" 1
1287 1 48 THR H 1 58 GLU QG . . 4.270 3.473 3.361 3.557 . 0 0 "[ . 1 . 2]" 1
1288 1 48 THR HA 1 48 THR MG . . 3.700 2.324 2.261 2.418 . 0 0 "[ . 1 . 2]" 1
1289 1 48 THR HA 1 58 GLU HB2 . . 4.650 4.474 4.421 4.529 . 0 0 "[ . 1 . 2]" 1
1290 1 48 THR HB 1 49 ASP QB . . 4.730 4.294 3.843 4.396 . 0 0 "[ . 1 . 2]" 1
1291 1 48 THR HB 1 50 GLY H . . 5.110 4.835 4.744 5.034 . 0 0 "[ . 1 . 2]" 1
1292 1 48 THR HB 1 58 GLU HB2 . . 3.990 3.734 3.360 3.860 . 0 0 "[ . 1 . 2]" 1
1293 1 48 THR HB 1 58 GLU HB3 . . 5.260 2.416 2.116 2.548 . 0 0 "[ . 1 . 2]" 1
1294 1 48 THR HB 1 58 GLU QG . . 4.830 4.373 4.198 4.478 . 0 0 "[ . 1 . 2]" 1
1295 1 48 THR MG 1 49 ASP H . . 5.390 3.758 3.648 3.946 . 0 0 "[ . 1 . 2]" 1
1296 1 48 THR MG 1 49 ASP QB . . 5.340 4.002 3.888 4.140 . 0 0 "[ . 1 . 2]" 1
1297 1 48 THR MG 1 58 GLU HB3 . . 5.500 3.752 3.641 3.811 . 0 0 "[ . 1 . 2]" 1
1298 1 49 ASP H 1 49 ASP HB2 . . 3.290 3.513 3.483 3.543 0.253 8 0 "[ . 1 . 2]" 1
1299 1 49 ASP H 1 49 ASP QB . . 2.820 2.982 2.328 3.102 0.282 17 0 "[ . 1 . 2]" 1
1300 1 49 ASP H 1 49 ASP HB3 . . 3.290 3.285 2.362 3.473 0.183 14 0 "[ . 1 . 2]" 1
1301 1 49 ASP H 1 50 GLY H . . 2.520 1.948 1.934 1.971 . 0 0 "[ . 1 . 2]" 1
1302 1 49 ASP H 1 50 GLY HA2 . . 4.540 4.207 4.196 4.230 . 0 0 "[ . 1 . 2]" 1
1303 1 49 ASP H 1 50 GLY HA3 . . 4.580 4.620 4.612 4.626 0.046 2 0 "[ . 1 . 2]" 1
1304 1 49 ASP H 1 54 ILE MD . . 5.500 4.925 4.633 4.984 . 0 0 "[ . 1 . 2]" 1
1305 1 49 ASP HB2 1 50 GLY H . . 4.290 3.879 3.747 4.452 0.162 4 0 "[ . 1 . 2]" 1
1306 1 49 ASP HB3 1 50 GLY H . . 4.290 4.306 3.538 4.446 0.156 14 0 "[ . 1 . 2]" 1
1307 1 50 GLY H 1 51 ASP H . . 3.390 3.270 3.240 3.338 . 0 0 "[ . 1 . 2]" 1
1308 1 50 GLY H 1 52 GLY H . . 5.380 5.007 4.968 5.051 . 0 0 "[ . 1 . 2]" 1
1309 1 50 GLY H 1 53 PHE H . . 5.500 5.576 5.530 5.595 0.095 9 0 "[ . 1 . 2]" 1
1310 1 50 GLY HA2 1 51 ASP H . . 2.550 2.367 2.352 2.372 . 0 0 "[ . 1 . 2]" 1
1311 1 50 GLY HA2 1 51 ASP HA . . 5.500 4.383 4.357 4.392 . 0 0 "[ . 1 . 2]" 1
1312 1 50 GLY HA2 1 51 ASP HB2 . . 5.500 5.900 5.891 5.917 0.417 6 0 "[ . 1 . 2]" 1
1313 1 50 GLY HA2 1 51 ASP QB . . 4.640 4.581 4.565 4.623 . 0 0 "[ . 1 . 2]" 1
1314 1 50 GLY HA2 1 51 ASP HB3 . . 5.500 4.773 4.755 4.827 . 0 0 "[ . 1 . 2]" 1
1315 1 50 GLY HA2 1 52 GLY H . . 3.490 3.207 3.171 3.252 . 0 0 "[ . 1 . 2]" 1
1316 1 50 GLY HA3 1 51 ASP QB . . 5.340 4.906 4.836 4.939 . 0 0 "[ . 1 . 2]" 1
1317 1 50 GLY HA3 1 52 GLY H . . 5.500 4.341 4.283 4.497 . 0 0 "[ . 1 . 2]" 1
1318 1 51 ASP H 1 51 ASP HB2 . . 3.790 3.847 3.829 3.896 0.106 4 0 "[ . 1 . 2]" 1
1319 1 51 ASP H 1 51 ASP QB . . 3.080 2.829 2.777 3.001 . 0 0 "[ . 1 . 2]" 1
1320 1 51 ASP H 1 51 ASP HB3 . . 3.790 2.912 2.851 3.120 . 0 0 "[ . 1 . 2]" 1
1321 1 51 ASP H 1 52 GLY H . . 3.080 2.140 1.949 2.228 . 0 0 "[ . 1 . 2]" 1
1322 1 51 ASP H 1 52 GLY QA . . 4.600 4.032 3.901 4.077 . 0 0 "[ . 1 . 2]" 1
1323 1 51 ASP H 1 53 PHE H . . 4.320 2.756 2.723 2.788 . 0 0 "[ . 1 . 2]" 1
1324 1 51 ASP H 1 53 PHE HB2 . . 5.500 4.918 4.850 4.986 . 0 0 "[ . 1 . 2]" 1
1325 1 51 ASP H 1 53 PHE QD . . 5.500 5.181 5.008 5.287 . 0 0 "[ . 1 . 2]" 1
1326 1 51 ASP HA 1 52 GLY H . . 3.370 3.096 3.048 3.136 . 0 0 "[ . 1 . 2]" 1
1327 1 51 ASP HA 1 52 GLY QA . . 4.590 4.098 4.088 4.108 . 0 0 "[ . 1 . 2]" 1
1328 1 51 ASP HA 1 53 PHE H . . 5.500 4.411 4.344 4.469 . 0 0 "[ . 1 . 2]" 1
1329 1 51 ASP QB 1 52 GLY H . . 3.920 3.972 3.947 3.997 0.077 3 0 "[ . 1 . 2]" 1
1330 1 51 ASP QB 1 52 GLY QA . . 5.180 4.611 4.557 4.633 . 0 0 "[ . 1 . 2]" 1
1331 1 51 ASP QB 1 53 PHE H . . 4.290 4.062 4.032 4.087 . 0 0 "[ . 1 . 2]" 1
1332 1 51 ASP QB 1 53 PHE HB2 . . 5.340 4.600 4.529 4.701 . 0 0 "[ . 1 . 2]" 1
1333 1 51 ASP QB 1 53 PHE QD . . 5.340 4.257 3.974 4.373 . 0 0 "[ . 1 . 2]" 1
1334 1 51 ASP HB2 1 52 GLY H . . 4.480 4.544 4.487 4.560 0.080 3 0 "[ . 1 . 2]" 1
1335 1 51 ASP HB3 1 52 GLY H . . 4.480 4.384 4.339 4.433 . 0 0 "[ . 1 . 2]" 1
1336 1 52 GLY H 1 53 PHE H . . 2.890 2.450 2.391 2.515 . 0 0 "[ . 1 . 2]" 1
1337 1 52 GLY H 1 53 PHE HA . . 5.500 4.971 4.917 5.037 . 0 0 "[ . 1 . 2]" 1
1338 1 52 GLY H 1 53 PHE HB2 . . 5.440 5.098 5.057 5.171 . 0 0 "[ . 1 . 2]" 1
1339 1 52 GLY H 1 53 PHE QD . . 5.500 4.621 4.513 4.719 . 0 0 "[ . 1 . 2]" 1
1340 1 52 GLY QA 1 53 PHE H . . 2.950 2.916 2.913 2.918 . 0 0 "[ . 1 . 2]" 1
1341 1 52 GLY QA 1 53 PHE QD . . 4.390 3.211 3.101 3.333 . 0 0 "[ . 1 . 2]" 1
1342 1 52 GLY HA2 1 53 PHE H . . 3.420 3.227 3.211 3.250 . 0 0 "[ . 1 . 2]" 1
1343 1 52 GLY HA3 1 53 PHE H . . 3.420 3.323 3.302 3.338 . 0 0 "[ . 1 . 2]" 1
1344 1 53 PHE H 1 53 PHE HB2 . . 2.870 2.806 2.786 2.840 . 0 0 "[ . 1 . 2]" 1
1345 1 53 PHE H 1 53 PHE HB3 . . 3.980 3.867 3.854 3.887 . 0 0 "[ . 1 . 2]" 1
1346 1 53 PHE H 1 53 PHE QD . . 3.890 3.202 3.083 3.314 . 0 0 "[ . 1 . 2]" 1
1347 1 53 PHE H 1 54 ILE H . . 4.430 4.356 4.306 4.387 . 0 0 "[ . 1 . 2]" 1
1348 1 53 PHE H 1 54 ILE MD . . 5.500 4.462 4.421 4.509 . 0 0 "[ . 1 . 2]" 1
1349 1 53 PHE H 1 54 ILE HG12 . . 5.500 4.950 4.898 4.981 . 0 0 "[ . 1 . 2]" 1
1350 1 53 PHE HA 1 54 ILE H . . 3.050 2.265 2.220 2.299 . 0 0 "[ . 1 . 2]" 1
1351 1 53 PHE HB2 1 53 PHE QD . . 3.050 2.402 2.382 2.432 . 0 0 "[ . 1 . 2]" 1
1352 1 53 PHE HB2 1 53 PHE QE . . 4.830 4.407 4.402 4.415 . 0 0 "[ . 1 . 2]" 1
1353 1 53 PHE HB2 1 54 ILE H . . 4.060 3.963 3.865 4.051 . 0 0 "[ . 1 . 2]" 1
1354 1 53 PHE HB3 1 53 PHE QD . . 3.090 2.367 2.342 2.385 . 0 0 "[ . 1 . 2]" 1
1355 1 53 PHE HB3 1 53 PHE QE . . 4.870 4.399 4.392 4.404 . 0 0 "[ . 1 . 2]" 1
1356 1 53 PHE HB3 1 54 ILE H . . 3.140 2.802 2.694 2.949 . 0 0 "[ . 1 . 2]" 1
1357 1 53 PHE HB3 1 54 ILE HB . . 5.500 5.150 5.078 5.226 . 0 0 "[ . 1 . 2]" 1
1358 1 53 PHE QD 1 54 ILE H . . 5.150 3.747 3.671 3.875 . 0 0 "[ . 1 . 2]" 1
1359 1 54 ILE H 1 54 ILE HB . . 2.930 2.468 2.443 2.495 . 0 0 "[ . 1 . 2]" 1
1360 1 54 ILE H 1 54 ILE HG12 . . 3.360 2.836 2.752 2.922 . 0 0 "[ . 1 . 2]" 1
1361 1 54 ILE H 1 54 ILE HG13 . . 5.120 4.084 4.016 4.152 . 0 0 "[ . 1 . 2]" 1
1362 1 54 ILE HA 1 54 ILE HG12 . . 3.810 2.936 2.923 2.953 . 0 0 "[ . 1 . 2]" 1
1363 1 54 ILE HA 1 54 ILE MG . . 3.120 2.414 2.407 2.421 . 0 0 "[ . 1 . 2]" 1
1364 1 54 ILE HA 1 55 ASP H . . 2.680 2.166 2.165 2.168 . 0 0 "[ . 1 . 2]" 1
1365 1 54 ILE HA 1 58 GLU HG2 . . 5.500 4.071 3.985 4.139 . 0 0 "[ . 1 . 2]" 1
1366 1 54 ILE HA 1 58 GLU HG3 . . 5.500 3.040 2.961 3.094 . 0 0 "[ . 1 . 2]" 1
1367 1 54 ILE HA 1 59 PHE H . . 5.500 5.463 5.430 5.507 0.007 17 0 "[ . 1 . 2]" 1
1368 1 54 ILE HB 1 54 ILE MD . . 3.690 3.226 3.218 3.227 . 0 0 "[ . 1 . 2]" 1
1369 1 54 ILE HB 1 54 ILE HG12 . . 2.860 2.460 2.456 2.464 . 0 0 "[ . 1 . 2]" 1
1370 1 54 ILE HB 1 54 ILE MG . . 2.480 2.087 2.085 2.088 . 0 0 "[ . 1 . 2]" 1
1371 1 54 ILE HB 1 59 PHE HD1 . . 4.240 3.949 3.920 3.988 . 0 0 "[ . 1 . 2]" 1
1372 1 54 ILE MD 1 54 ILE MG . . 2.980 2.012 1.990 2.072 . 0 0 "[ . 1 . 2]" 1
1373 1 54 ILE MD 1 55 ASP H . . 4.290 3.671 3.613 3.694 . 0 0 "[ . 1 . 2]" 1
1374 1 54 ILE MD 1 58 GLU HB2 . . 5.290 3.529 3.455 3.575 . 0 0 "[ . 1 . 2]" 1
1375 1 54 ILE MD 1 58 GLU HB3 . . 5.500 4.576 4.499 4.628 . 0 0 "[ . 1 . 2]" 1
1376 1 54 ILE MD 1 58 GLU QG . . 4.270 2.656 2.564 2.744 . 0 0 "[ . 1 . 2]" 1
1377 1 54 ILE MD 1 59 PHE HA . . 5.500 4.313 4.270 4.420 . 0 0 "[ . 1 . 2]" 1
1378 1 54 ILE MD 1 59 PHE HB2 . . 5.500 5.162 5.136 5.187 . 0 0 "[ . 1 . 2]" 1
1379 1 54 ILE HG12 1 54 ILE MG . . 3.620 3.186 3.186 3.187 . 0 0 "[ . 1 . 2]" 1
1380 1 54 ILE HG12 1 55 ASP H . . 5.260 5.059 5.048 5.072 . 0 0 "[ . 1 . 2]" 1
1381 1 54 ILE HG12 1 59 PHE HD1 . . 5.500 5.555 5.536 5.593 0.093 3 0 "[ . 1 . 2]" 1
1382 1 54 ILE HG13 1 54 ILE MG . . 2.670 2.293 2.284 2.299 . 0 0 "[ . 1 . 2]" 1
1383 1 54 ILE HG13 1 59 PHE HA . . 5.500 5.358 5.322 5.432 . 0 0 "[ . 1 . 2]" 1
1384 1 54 ILE MG 1 55 ASP H . . 3.360 2.966 2.958 2.979 . 0 0 "[ . 1 . 2]" 1
1385 1 54 ILE MG 1 56 PHE H . . 5.500 5.052 5.043 5.059 . 0 0 "[ . 1 . 2]" 1
1386 1 54 ILE MG 1 58 GLU H . . 5.220 4.647 4.589 4.700 . 0 0 "[ . 1 . 2]" 1
1387 1 54 ILE MG 1 58 GLU QG . . 3.270 1.963 1.940 1.996 . 0 0 "[ . 1 . 2]" 1
1388 1 54 ILE MG 1 59 PHE H . . 3.520 3.210 3.166 3.244 . 0 0 "[ . 1 . 2]" 1
1389 1 54 ILE MG 1 59 PHE HA . . 3.570 2.733 2.708 2.784 . 0 0 "[ . 1 . 2]" 1
1390 1 54 ILE MG 1 59 PHE HB2 . . 3.640 2.726 2.689 2.791 . 0 0 "[ . 1 . 2]" 1
1391 1 54 ILE MG 1 59 PHE HD1 . . 3.570 1.882 1.880 1.888 . 0 0 "[ . 1 . 2]" 1
1392 1 55 ASP H 1 55 ASP HB2 . . 3.160 2.694 2.619 2.733 . 0 0 "[ . 1 . 2]" 1
1393 1 55 ASP H 1 55 ASP HB3 . . 3.640 3.583 3.578 3.593 . 0 0 "[ . 1 . 2]" 1
1394 1 55 ASP H 1 56 PHE H . . 4.510 4.501 4.485 4.511 0.001 4 0 "[ . 1 . 2]" 1
1395 1 55 ASP H 1 58 GLU HB3 . . 4.930 4.679 4.664 4.692 . 0 0 "[ . 1 . 2]" 1
1396 1 55 ASP H 1 58 GLU HG2 . . 3.510 2.856 2.819 2.885 . 0 0 "[ . 1 . 2]" 1
1397 1 55 ASP H 1 58 GLU QG . . 3.050 2.567 2.546 2.602 . 0 0 "[ . 1 . 2]" 1
1398 1 55 ASP H 1 58 GLU HG3 . . 3.510 2.908 2.876 2.972 . 0 0 "[ . 1 . 2]" 1
1399 1 55 ASP H 1 59 PHE H . . 4.860 4.723 4.691 4.765 . 0 0 "[ . 1 . 2]" 1
1400 1 55 ASP HA 1 55 ASP HB3 . . 2.720 2.381 2.362 2.413 . 0 0 "[ . 1 . 2]" 1
1401 1 55 ASP HA 1 56 PHE H . . 2.880 2.696 2.685 2.715 . 0 0 "[ . 1 . 2]" 1
1402 1 55 ASP HA 1 56 PHE HA . . 4.880 4.337 4.336 4.339 . 0 0 "[ . 1 . 2]" 1
1403 1 55 ASP HA 1 56 PHE HB2 . . 4.600 4.518 4.510 4.534 . 0 0 "[ . 1 . 2]" 1
1404 1 55 ASP HA 1 57 ASN H . . 4.920 4.672 4.597 4.770 . 0 0 "[ . 1 . 2]" 1
1405 1 55 ASP HA 1 58 GLU QG . . 5.340 4.106 4.085 4.137 . 0 0 "[ . 1 . 2]" 1
1406 1 55 ASP HB2 1 56 PHE H . . 2.860 2.835 2.763 2.903 0.043 14 0 "[ . 1 . 2]" 1
1407 1 55 ASP HB2 1 56 PHE HA . . 5.500 4.757 4.715 4.820 . 0 0 "[ . 1 . 2]" 1
1408 1 55 ASP HB2 1 57 ASN H . . 3.590 2.995 2.935 3.092 . 0 0 "[ . 1 . 2]" 1
1409 1 55 ASP HB2 1 58 GLU H . . 5.500 2.909 2.888 2.950 . 0 0 "[ . 1 . 2]" 1
1410 1 55 ASP HB3 1 56 PHE H . . 2.820 2.054 1.985 2.085 . 0 0 "[ . 1 . 2]" 1
1411 1 55 ASP HB3 1 56 PHE HB2 . . 4.420 4.452 4.422 4.481 0.061 4 0 "[ . 1 . 2]" 1
1412 1 55 ASP HB3 1 56 PHE HB3 . . 5.500 4.442 4.341 4.514 . 0 0 "[ . 1 . 2]" 1
1413 1 55 ASP HB3 1 57 ASN H . . 3.620 3.232 3.080 3.357 . 0 0 "[ . 1 . 2]" 1
1414 1 55 ASP HB3 1 58 GLU H . . 5.500 4.417 4.365 4.505 . 0 0 "[ . 1 . 2]" 1
1415 1 56 PHE H 1 56 PHE HB2 . . 2.940 2.506 2.474 2.531 . 0 0 "[ . 1 . 2]" 1
1416 1 56 PHE H 1 56 PHE HB3 . . 2.830 2.667 2.642 2.699 . 0 0 "[ . 1 . 2]" 1
1417 1 56 PHE H 1 56 PHE HD1 . . 5.500 4.735 4.718 4.756 . 0 0 "[ . 1 . 2]" 1
1418 1 56 PHE H 1 56 PHE HD2 . . 5.500 4.724 4.692 4.748 . 0 0 "[ . 1 . 2]" 1
1419 1 56 PHE H 1 57 ASN H . . 3.350 2.388 2.360 2.413 . 0 0 "[ . 1 . 2]" 1
1420 1 56 PHE H 1 57 ASN HA . . 5.500 5.032 5.009 5.051 . 0 0 "[ . 1 . 2]" 1
1421 1 56 PHE H 1 57 ASN HB2 . . 4.350 4.186 4.163 4.212 . 0 0 "[ . 1 . 2]" 1
1422 1 56 PHE H 1 57 ASN HD21 . . 4.410 4.310 4.145 4.413 0.003 7 0 "[ . 1 . 2]" 1
1423 1 56 PHE HA 1 56 PHE HB2 . . 3.000 2.556 2.543 2.572 . 0 0 "[ . 1 . 2]" 1
1424 1 56 PHE HA 1 57 ASN H . . 3.560 3.526 3.510 3.540 . 0 0 "[ . 1 . 2]" 1
1425 1 56 PHE HA 1 58 GLU QG . . 5.030 4.520 4.486 4.554 . 0 0 "[ . 1 . 2]" 1
1426 1 56 PHE HA 1 59 PHE H . . 4.000 3.640 3.599 3.673 . 0 0 "[ . 1 . 2]" 1
1427 1 56 PHE HA 1 60 ILE H . . 4.850 4.752 4.694 4.793 . 0 0 "[ . 1 . 2]" 1
1428 1 56 PHE HB2 1 56 PHE HD2 . . 3.550 2.290 2.286 2.297 . 0 0 "[ . 1 . 2]" 1
1429 1 56 PHE HB2 1 57 ASN H . . 4.080 3.770 3.702 3.839 . 0 0 "[ . 1 . 2]" 1
1430 1 56 PHE HB2 1 57 ASN HA . . 5.500 5.554 5.528 5.578 0.078 14 0 "[ . 1 . 2]" 1
1431 1 56 PHE HB2 1 57 ASN HD21 . . 4.920 4.891 4.810 4.927 0.007 5 0 "[ . 1 . 2]" 1
1432 1 56 PHE HB3 1 56 PHE HD1 . . 3.140 2.657 2.630 2.684 . 0 0 "[ . 1 . 2]" 1
1433 1 56 PHE HB3 1 56 PHE HE1 . . 4.930 4.792 4.777 4.808 . 0 0 "[ . 1 . 2]" 1
1434 1 56 PHE HB3 1 57 ASN H . . 3.770 2.653 2.556 2.746 . 0 0 "[ . 1 . 2]" 1
1435 1 56 PHE HB3 1 57 ASN HD21 . . 4.860 3.236 3.096 3.323 . 0 0 "[ . 1 . 2]" 1
1436 1 56 PHE HD1 1 57 ASN H . . 4.790 3.762 3.706 3.797 . 0 0 "[ . 1 . 2]" 1
1437 1 56 PHE HD1 1 57 ASN HA . . 3.710 3.162 3.131 3.223 . 0 0 "[ . 1 . 2]" 1
1438 1 56 PHE HD1 1 60 ILE H . . 5.500 4.447 4.268 4.581 . 0 0 "[ . 1 . 2]" 1
1439 1 56 PHE HD1 1 60 ILE MD . . 3.370 2.470 2.411 2.504 . 0 0 "[ . 1 . 2]" 1
1440 1 56 PHE HE1 1 60 ILE MD . . 2.690 1.989 1.939 2.039 . 0 0 "[ . 1 . 2]" 1
1441 1 56 PHE HE1 1 60 ILE HG12 . . 4.770 3.478 3.300 3.604 . 0 0 "[ . 1 . 2]" 1
1442 1 56 PHE HE1 1 60 ILE HG13 . . 4.650 3.583 3.452 3.674 . 0 0 "[ . 1 . 2]" 1
1443 1 57 ASN H 1 57 ASN HB2 . . 2.970 2.122 2.102 2.149 . 0 0 "[ . 1 . 2]" 1
1444 1 57 ASN H 1 57 ASN HB3 . . 3.480 3.433 3.402 3.464 . 0 0 "[ . 1 . 2]" 1
1445 1 57 ASN H 1 57 ASN HD21 . . 4.700 2.523 2.400 2.624 . 0 0 "[ . 1 . 2]" 1
1446 1 57 ASN H 1 57 ASN HD22 . . 5.380 4.182 4.056 4.292 . 0 0 "[ . 1 . 2]" 1
1447 1 57 ASN H 1 58 GLU H . . 3.130 2.968 2.927 3.018 . 0 0 "[ . 1 . 2]" 1
1448 1 57 ASN H 1 59 PHE H . . 3.980 3.857 3.808 3.908 . 0 0 "[ . 1 . 2]" 1
1449 1 57 ASN H 1 60 ILE H . . 5.500 5.122 5.110 5.141 . 0 0 "[ . 1 . 2]" 1
1450 1 57 ASN H 1 60 ILE MD . . 5.500 5.197 5.185 5.212 . 0 0 "[ . 1 . 2]" 1
1451 1 57 ASN H 1 60 ILE HG13 . . 5.500 5.084 5.058 5.109 . 0 0 "[ . 1 . 2]" 1
1452 1 57 ASN HA 1 57 ASN HB3 . . 2.990 2.746 2.716 2.765 . 0 0 "[ . 1 . 2]" 1
1453 1 57 ASN HA 1 57 ASN HD22 . . 4.170 3.644 3.467 3.792 . 0 0 "[ . 1 . 2]" 1
1454 1 57 ASN HA 1 59 PHE H . . 4.590 4.174 4.126 4.226 . 0 0 "[ . 1 . 2]" 1
1455 1 57 ASN HA 1 59 PHE HB2 . . 5.500 5.533 5.521 5.555 0.055 6 0 "[ . 1 . 2]" 1
1456 1 57 ASN HA 1 59 PHE HB3 . . 5.500 4.933 4.878 4.975 . 0 0 "[ . 1 . 2]" 1
1457 1 57 ASN HA 1 60 ILE H . . 4.020 3.752 3.728 3.773 . 0 0 "[ . 1 . 2]" 1
1458 1 57 ASN HA 1 60 ILE HB . . 4.130 4.165 4.156 4.180 0.050 14 0 "[ . 1 . 2]" 1
1459 1 57 ASN HA 1 60 ILE MD . . 3.760 3.397 3.361 3.468 . 0 0 "[ . 1 . 2]" 1
1460 1 57 ASN HA 1 60 ILE HG13 . . 3.800 3.349 3.315 3.416 . 0 0 "[ . 1 . 2]" 1
1461 1 57 ASN HA 1 61 SER H . . 4.620 4.635 4.585 4.655 0.035 8 0 "[ . 1 . 2]" 1
1462 1 57 ASN HB2 1 57 ASN HD21 . . 3.190 2.463 2.363 2.633 . 0 0 "[ . 1 . 2]" 1
1463 1 57 ASN HB2 1 58 GLU H . . 3.370 2.577 2.508 2.622 . 0 0 "[ . 1 . 2]" 1
1464 1 57 ASN HB2 1 58 GLU HA . . 4.960 4.855 4.784 4.900 . 0 0 "[ . 1 . 2]" 1
1465 1 57 ASN HB2 1 58 GLU HB3 . . 5.110 4.842 4.762 4.894 . 0 0 "[ . 1 . 2]" 1
1466 1 57 ASN HB3 1 58 GLU H . . 2.920 2.552 2.504 2.621 . 0 0 "[ . 1 . 2]" 1
1467 1 57 ASN HB3 1 59 PHE H . . 5.060 4.785 4.748 4.818 . 0 0 "[ . 1 . 2]" 1
1468 1 57 ASN HB3 1 60 ILE H . . 5.500 5.302 5.277 5.332 . 0 0 "[ . 1 . 2]" 1
1469 1 57 ASN HB3 1 61 SER H . . 5.500 5.170 5.123 5.195 . 0 0 "[ . 1 . 2]" 1
1470 1 57 ASN HB3 1 61 SER HB2 . . 4.850 4.784 4.632 4.852 0.002 9 0 "[ . 1 . 2]" 1
1471 1 57 ASN HB3 1 61 SER HB3 . . 5.500 5.517 5.508 5.526 0.026 6 0 "[ . 1 . 2]" 1
1472 1 57 ASN HD21 1 58 GLU H . . 4.800 4.685 4.604 4.733 . 0 0 "[ . 1 . 2]" 1
1473 1 58 GLU H 1 58 GLU HB2 . . 3.710 3.587 3.586 3.588 . 0 0 "[ . 1 . 2]" 1
1474 1 58 GLU H 1 58 GLU HB3 . . 3.710 2.658 2.650 2.665 . 0 0 "[ . 1 . 2]" 1
1475 1 58 GLU H 1 58 GLU HG2 . . 3.660 1.906 1.900 1.917 . 0 0 "[ . 1 . 2]" 1
1476 1 58 GLU H 1 58 GLU QG . . 3.100 1.897 1.891 1.907 . 0 0 "[ . 1 . 2]" 1
1477 1 58 GLU H 1 58 GLU HG3 . . 3.660 3.436 3.417 3.449 . 0 0 "[ . 1 . 2]" 1
1478 1 58 GLU H 1 59 PHE HA . . 5.500 5.312 5.301 5.325 . 0 0 "[ . 1 . 2]" 1
1479 1 58 GLU H 1 60 ILE H . . 5.500 4.496 4.481 4.501 . 0 0 "[ . 1 . 2]" 1
1480 1 58 GLU H 1 61 SER HB2 . . 5.120 5.002 4.867 5.053 . 0 0 "[ . 1 . 2]" 1
1481 1 58 GLU HA 1 58 GLU HB3 . . 2.990 2.370 2.368 2.373 . 0 0 "[ . 1 . 2]" 1
1482 1 58 GLU HA 1 60 ILE H . . 5.500 4.141 4.111 4.166 . 0 0 "[ . 1 . 2]" 1
1483 1 58 GLU HA 1 61 SER H . . 3.170 3.009 2.991 3.019 . 0 0 "[ . 1 . 2]" 1
1484 1 58 GLU HA 1 61 SER HB2 . . 3.170 2.649 2.560 2.687 . 0 0 "[ . 1 . 2]" 1
1485 1 58 GLU HB2 1 59 PHE H . . 3.870 3.741 3.714 3.770 . 0 0 "[ . 1 . 2]" 1
1486 1 58 GLU HB2 1 59 PHE HB2 . . 5.500 5.512 5.499 5.528 0.028 17 0 "[ . 1 . 2]" 1
1487 1 58 GLU HB2 1 60 ILE H . . 5.500 5.498 5.476 5.511 0.011 17 0 "[ . 1 . 2]" 1
1488 1 58 GLU HB2 1 61 SER H . . 5.500 4.865 4.837 4.890 . 0 0 "[ . 1 . 2]" 1
1489 1 58 GLU HB2 1 61 SER HB2 . . 5.500 4.861 4.822 4.891 . 0 0 "[ . 1 . 2]" 1
1490 1 58 GLU HB3 1 59 PHE H . . 4.240 4.112 4.089 4.129 . 0 0 "[ . 1 . 2]" 1
1491 1 58 GLU QG 1 59 PHE H . . 2.660 2.314 2.277 2.356 . 0 0 "[ . 1 . 2]" 1
1492 1 58 GLU QG 1 59 PHE HA . . 4.470 3.573 3.543 3.598 . 0 0 "[ . 1 . 2]" 1
1493 1 58 GLU QG 1 60 ILE H . . 5.340 4.659 4.638 4.675 . 0 0 "[ . 1 . 2]" 1
1494 1 58 GLU QG 1 61 SER H . . 5.340 5.047 5.026 5.066 . 0 0 "[ . 1 . 2]" 1
1495 1 58 GLU HG2 1 59 PHE H . . 3.290 2.445 2.408 2.506 . 0 0 "[ . 1 . 2]" 1
1496 1 58 GLU HG3 1 59 PHE H . . 3.290 2.861 2.802 2.927 . 0 0 "[ . 1 . 2]" 1
1497 1 59 PHE H 1 59 PHE HB2 . . 2.410 2.278 2.262 2.304 . 0 0 "[ . 1 . 2]" 1
1498 1 59 PHE H 1 60 ILE H . . 2.910 2.808 2.787 2.836 . 0 0 "[ . 1 . 2]" 1
1499 1 59 PHE H 1 60 ILE HA . . 5.500 5.400 5.384 5.419 . 0 0 "[ . 1 . 2]" 1
1500 1 59 PHE H 1 60 ILE HG13 . . 4.660 4.116 4.082 4.152 . 0 0 "[ . 1 . 2]" 1
1501 1 59 PHE H 1 61 SER H . . 4.200 3.961 3.938 3.989 . 0 0 "[ . 1 . 2]" 1
1502 1 59 PHE H 1 62 PHE H . . 5.500 5.197 5.176 5.224 . 0 0 "[ . 1 . 2]" 1
1503 1 59 PHE HA 1 59 PHE HB2 . . 2.870 2.579 2.565 2.587 . 0 0 "[ . 1 . 2]" 1
1504 1 59 PHE HA 1 59 PHE HD1 . . 3.010 2.264 2.235 2.322 . 0 0 "[ . 1 . 2]" 1
1505 1 59 PHE HA 1 60 ILE HG12 . . 5.500 5.535 5.524 5.552 0.052 14 0 "[ . 1 . 2]" 1
1506 1 59 PHE HA 1 60 ILE HG13 . . 5.370 5.109 5.095 5.136 . 0 0 "[ . 1 . 2]" 1
1507 1 59 PHE HA 1 62 PHE HB2 . . 4.940 4.478 4.416 4.534 . 0 0 "[ . 1 . 2]" 1
1508 1 59 PHE HA 1 63 CYS H . . 4.360 4.155 4.122 4.190 . 0 0 "[ . 1 . 2]" 1
1509 1 59 PHE HA 1 63 CYS HB2 . . 4.930 4.542 4.501 4.566 . 0 0 "[ . 1 . 2]" 1
1510 1 59 PHE HB2 1 59 PHE HD1 . . 3.020 2.745 2.715 2.761 . 0 0 "[ . 1 . 2]" 1
1511 1 59 PHE HB3 1 59 PHE HD2 . . 3.120 2.285 2.284 2.286 . 0 0 "[ . 1 . 2]" 1
1512 1 59 PHE HB3 1 60 ILE H . . 2.720 2.589 2.563 2.617 . 0 0 "[ . 1 . 2]" 1
1513 1 59 PHE HB3 1 60 ILE HB . . 5.190 4.974 4.950 4.987 . 0 0 "[ . 1 . 2]" 1
1514 1 59 PHE HB3 1 60 ILE MD . . 5.500 4.259 4.234 4.282 . 0 0 "[ . 1 . 2]" 1
1515 1 59 PHE HB3 1 60 ILE HG12 . . 4.930 3.373 3.358 3.389 . 0 0 "[ . 1 . 2]" 1
1516 1 59 PHE HB3 1 60 ILE HG13 . . 5.500 2.974 2.936 3.000 . 0 0 "[ . 1 . 2]" 1
1517 1 59 PHE HB3 1 60 ILE MG . . 5.500 4.992 4.981 5.000 . 0 0 "[ . 1 . 2]" 1
1518 1 59 PHE HB3 1 61 SER H . . 4.790 4.794 4.778 4.805 0.015 14 0 "[ . 1 . 2]" 1
1519 1 59 PHE HD2 1 60 ILE H . . 4.580 4.334 4.267 4.375 . 0 0 "[ . 1 . 2]" 1
1520 1 59 PHE HD2 1 60 ILE HG12 . . 5.180 3.482 3.373 3.526 . 0 0 "[ . 1 . 2]" 1
1521 1 59 PHE HD2 1 60 ILE HG13 . . 4.560 4.142 4.065 4.197 . 0 0 "[ . 1 . 2]" 1
1522 1 59 PHE HD2 1 60 ILE MG . . 5.500 5.054 4.945 5.088 . 0 0 "[ . 1 . 2]" 1
1523 1 59 PHE HE2 1 63 CYS HB2 . . 5.310 5.139 5.053 5.259 . 0 0 "[ . 1 . 2]" 1
1524 1 60 ILE H 1 60 ILE HB . . 2.900 2.763 2.758 2.769 . 0 0 "[ . 1 . 2]" 1
1525 1 60 ILE H 1 60 ILE MD . . 4.760 3.600 3.596 3.606 . 0 0 "[ . 1 . 2]" 1
1526 1 60 ILE H 1 60 ILE HG12 . . 3.130 2.986 2.955 3.009 . 0 0 "[ . 1 . 2]" 1
1527 1 60 ILE H 1 60 ILE HG13 . . 2.920 1.925 1.918 1.935 . 0 0 "[ . 1 . 2]" 1
1528 1 60 ILE H 1 61 SER H . . 2.660 2.349 2.332 2.378 . 0 0 "[ . 1 . 2]" 1
1529 1 60 ILE H 1 61 SER HB2 . . 5.300 4.782 4.685 4.833 . 0 0 "[ . 1 . 2]" 1
1530 1 60 ILE H 1 62 PHE H . . 5.500 4.348 4.327 4.371 . 0 0 "[ . 1 . 2]" 1
1531 1 60 ILE H 1 63 CYS HB2 . . 5.500 5.481 5.452 5.506 0.006 7 0 "[ . 1 . 2]" 1
1532 1 60 ILE HA 1 60 ILE HG12 . . 3.300 2.703 2.692 2.711 . 0 0 "[ . 1 . 2]" 1
1533 1 60 ILE HA 1 60 ILE HG13 . . 3.380 3.339 3.331 3.346 . 0 0 "[ . 1 . 2]" 1
1534 1 60 ILE HA 1 60 ILE MG . . 3.550 2.284 2.278 2.288 . 0 0 "[ . 1 . 2]" 1
1535 1 60 ILE HA 1 62 PHE H . . 4.500 4.288 4.275 4.308 . 0 0 "[ . 1 . 2]" 1
1536 1 60 ILE HA 1 63 CYS HB3 . . 2.840 2.096 2.074 2.111 . 0 0 "[ . 1 . 2]" 1
1537 1 60 ILE HA 1 64 ASN H . . 3.870 3.244 3.234 3.258 . 0 0 "[ . 1 . 2]" 1
1538 1 60 ILE HA 1 64 ASN HA . . 5.290 4.916 4.901 4.930 . 0 0 "[ . 1 . 2]" 1
1539 1 60 ILE HB 1 60 ILE MD . . 3.280 2.422 2.413 2.431 . 0 0 "[ . 1 . 2]" 1
1540 1 60 ILE HB 1 61 SER H . . 3.190 2.900 2.870 2.931 . 0 0 "[ . 1 . 2]" 1
1541 1 60 ILE HB 1 61 SER HA . . 5.340 4.000 3.993 4.009 . 0 0 "[ . 1 . 2]" 1
1542 1 60 ILE HB 1 61 SER HB2 . . 5.450 4.699 4.649 4.738 . 0 0 "[ . 1 . 2]" 1
1543 1 60 ILE HB 1 62 PHE H . . 5.500 5.303 5.274 5.331 . 0 0 "[ . 1 . 2]" 1
1544 1 60 ILE HB 1 63 CYS HB3 . . 5.060 5.046 5.022 5.061 0.001 17 0 "[ . 1 . 2]" 1
1545 1 60 ILE HB 1 64 ASN H . . 5.190 5.018 5.009 5.038 . 0 0 "[ . 1 . 2]" 1
1546 1 60 ILE HB 1 64 ASN QB . . 5.220 4.316 4.291 4.384 . 0 0 "[ . 1 . 2]" 1
1547 1 60 ILE MD 1 61 SER H . . 5.490 4.691 4.678 4.706 . 0 0 "[ . 1 . 2]" 1
1548 1 60 ILE HG12 1 60 ILE MG . . 2.590 2.385 2.372 2.395 . 0 0 "[ . 1 . 2]" 1
1549 1 60 ILE HG12 1 61 SER H . . 5.110 4.756 4.744 4.765 . 0 0 "[ . 1 . 2]" 1
1550 1 60 ILE HG13 1 61 SER H . . 4.110 3.823 3.811 3.831 . 0 0 "[ . 1 . 2]" 1
1551 1 60 ILE MG 1 61 SER H . . 4.480 3.963 3.945 3.982 . 0 0 "[ . 1 . 2]" 1
1552 1 60 ILE MG 1 63 CYS H . . 5.500 4.826 4.809 4.839 . 0 0 "[ . 1 . 2]" 1
1553 1 60 ILE MG 1 63 CYS HB3 . . 5.470 3.527 3.495 3.548 . 0 0 "[ . 1 . 2]" 1
1554 1 60 ILE MG 1 64 ASN H . . 4.070 3.387 3.375 3.396 . 0 0 "[ . 1 . 2]" 1
1555 1 60 ILE MG 1 64 ASN HA . . 4.050 3.781 3.751 3.798 . 0 0 "[ . 1 . 2]" 1
1556 1 60 ILE MG 1 64 ASN QB . . 4.340 2.384 2.355 2.453 . 0 0 "[ . 1 . 2]" 1
1557 1 61 SER H 1 61 SER HB2 . . 2.780 2.639 2.564 2.674 . 0 0 "[ . 1 . 2]" 1
1558 1 61 SER H 1 61 SER HB3 . . 4.080 2.442 2.410 2.513 . 0 0 "[ . 1 . 2]" 1
1559 1 61 SER H 1 62 PHE HB2 . . 5.500 4.854 4.824 4.868 . 0 0 "[ . 1 . 2]" 1
1560 1 61 SER H 1 63 CYS H . . 4.320 4.264 4.241 4.284 . 0 0 "[ . 1 . 2]" 1
1561 1 61 SER H 1 63 CYS HB3 . . 5.500 4.882 4.860 4.902 . 0 0 "[ . 1 . 2]" 1
1562 1 61 SER H 1 64 ASN H . . 5.500 4.652 4.644 4.659 . 0 0 "[ . 1 . 2]" 1
1563 1 61 SER H 1 64 ASN QB . . 5.340 4.761 4.754 4.774 . 0 0 "[ . 1 . 2]" 1
1564 1 61 SER HA 1 61 SER HB2 . . 2.550 2.391 2.376 2.424 . 0 0 "[ . 1 . 2]" 1
1565 1 61 SER HA 1 64 ASN H . . 4.940 4.280 4.267 4.289 . 0 0 "[ . 1 . 2]" 1
1566 1 61 SER HA 1 65 ALA H . . 5.500 5.441 5.413 5.481 . 0 0 "[ . 1 . 2]" 1
1567 1 61 SER HB2 1 62 PHE HB2 . . 5.500 5.548 5.514 5.566 0.066 8 0 "[ . 1 . 2]" 1
1568 1 61 SER HB3 1 62 PHE H . . 3.410 2.538 2.509 2.557 . 0 0 "[ . 1 . 2]" 1
1569 1 61 SER HB3 1 62 PHE HB2 . . 5.500 3.879 3.824 3.907 . 0 0 "[ . 1 . 2]" 1
1570 1 61 SER HB3 1 63 CYS H . . 5.030 4.897 4.870 4.920 . 0 0 "[ . 1 . 2]" 1
1571 1 62 PHE H 1 62 PHE HB2 . . 3.110 2.178 2.166 2.187 . 0 0 "[ . 1 . 2]" 1
1572 1 62 PHE H 1 62 PHE HB3 . . 3.270 3.191 3.165 3.237 . 0 0 "[ . 1 . 2]" 1
1573 1 62 PHE H 1 63 CYS H . . 2.480 2.427 2.419 2.432 . 0 0 "[ . 1 . 2]" 1
1574 1 62 PHE H 1 63 CYS HB2 . . 5.320 4.893 4.860 4.909 . 0 0 "[ . 1 . 2]" 1
1575 1 62 PHE H 1 63 CYS HB3 . . 5.500 4.390 4.374 4.414 . 0 0 "[ . 1 . 2]" 1
1576 1 62 PHE H 1 64 ASN H . . 3.950 3.859 3.850 3.868 . 0 0 "[ . 1 . 2]" 1
1577 1 62 PHE H 1 64 ASN QB . . 5.340 4.709 4.659 4.733 . 0 0 "[ . 1 . 2]" 1
1578 1 62 PHE H 1 65 ALA H . . 5.120 5.042 5.033 5.050 . 0 0 "[ . 1 . 2]" 1
1579 1 62 PHE H 1 65 ALA MB . . 5.500 5.256 5.246 5.266 . 0 0 "[ . 1 . 2]" 1
1580 1 62 PHE HA 1 63 CYS HA . . 5.500 4.862 4.860 4.864 . 0 0 "[ . 1 . 2]" 1
1581 1 62 PHE HA 1 64 ASN H . . 4.640 4.142 4.128 4.152 . 0 0 "[ . 1 . 2]" 1
1582 1 62 PHE HA 1 64 ASN QB . . 5.340 4.503 4.491 4.515 . 0 0 "[ . 1 . 2]" 1
1583 1 62 PHE HA 1 65 ALA H . . 3.620 3.466 3.456 3.477 . 0 0 "[ . 1 . 2]" 1
1584 1 62 PHE HA 1 65 ALA MB . . 3.130 2.952 2.938 2.963 . 0 0 "[ . 1 . 2]" 1
1585 1 62 PHE HB2 1 62 PHE HD1 . . 3.190 2.722 2.672 2.810 . 0 0 "[ . 1 . 2]" 1
1586 1 62 PHE HB2 1 63 CYS H . . 3.570 3.101 3.044 3.127 . 0 0 "[ . 1 . 2]" 1
1587 1 62 PHE HB2 1 63 CYS HB2 . . 5.500 5.317 5.223 5.354 . 0 0 "[ . 1 . 2]" 1
1588 1 62 PHE HB2 1 63 CYS HB3 . . 5.460 5.508 5.478 5.538 0.078 15 0 "[ . 1 . 2]" 1
1589 1 62 PHE HB3 1 63 CYS H . . 3.070 2.695 2.656 2.744 . 0 0 "[ . 1 . 2]" 1
1590 1 62 PHE HB3 1 64 ASN H . . 5.400 4.940 4.925 4.959 . 0 0 "[ . 1 . 2]" 1
1591 1 63 CYS H 1 63 CYS HB2 . . 3.370 2.608 2.581 2.622 . 0 0 "[ . 1 . 2]" 1
1592 1 63 CYS H 1 63 CYS HB3 . . 3.570 2.458 2.445 2.485 . 0 0 "[ . 1 . 2]" 1
1593 1 63 CYS H 1 64 ASN H . . 2.910 2.816 2.808 2.823 . 0 0 "[ . 1 . 2]" 1
1594 1 63 CYS H 1 64 ASN HA . . 5.500 5.380 5.372 5.385 . 0 0 "[ . 1 . 2]" 1
1595 1 63 CYS H 1 64 ASN QB . . 5.340 4.544 4.517 4.554 . 0 0 "[ . 1 . 2]" 1
1596 1 63 CYS H 1 65 ALA H . . 4.350 4.290 4.261 4.320 . 0 0 "[ . 1 . 2]" 1
1597 1 63 CYS H 1 65 ALA MB . . 5.500 4.980 4.959 5.009 . 0 0 "[ . 1 . 2]" 1
1598 1 63 CYS HA 1 64 ASN HA . . 5.500 4.846 4.842 4.849 . 0 0 "[ . 1 . 2]" 1
1599 1 63 CYS HA 1 65 ALA H . . 4.180 4.041 3.995 4.088 . 0 0 "[ . 1 . 2]" 1
1600 1 63 CYS HA 1 65 ALA MB . . 5.450 4.687 4.643 4.747 . 0 0 "[ . 1 . 2]" 1
1601 1 63 CYS HA 1 66 ASN H . . 3.450 3.360 3.342 3.378 . 0 0 "[ . 1 . 2]" 1
1602 1 63 CYS HA 1 66 ASN HB2 . . 4.030 2.821 2.693 2.910 . 0 0 "[ . 1 . 2]" 1
1603 1 63 CYS HA 1 66 ASN HB3 . . 4.710 4.495 4.343 4.598 . 0 0 "[ . 1 . 2]" 1
1604 1 63 CYS HA 1 66 ASN HD21 . . 5.500 3.964 3.943 4.007 . 0 0 "[ . 1 . 2]" 1
1605 1 63 CYS HA 1 70 MET H . . 5.500 5.551 5.524 5.585 0.085 8 0 "[ . 1 . 2]" 1
1606 1 63 CYS HA 1 70 MET ME . . 5.500 4.258 4.030 4.490 . 0 0 "[ . 1 . 2]" 1
1607 1 63 CYS HB2 1 64 ASN H . . 4.280 4.022 4.008 4.029 . 0 0 "[ . 1 . 2]" 1
1608 1 63 CYS HB2 1 66 ASN H . . 5.500 5.512 5.501 5.527 0.027 4 0 "[ . 1 . 2]" 1
1609 1 63 CYS HB3 1 64 ASN H . . 3.630 2.740 2.731 2.748 . 0 0 "[ . 1 . 2]" 1
1610 1 63 CYS HB3 1 64 ASN HA . . 4.870 4.376 4.345 4.392 . 0 0 "[ . 1 . 2]" 1
1611 1 63 CYS HB3 1 65 ALA H . . 5.500 5.058 5.026 5.085 . 0 0 "[ . 1 . 2]" 1
1612 1 63 CYS HB3 1 66 ASN H . . 5.500 5.326 5.300 5.345 . 0 0 "[ . 1 . 2]" 1
1613 1 64 ASN H 1 64 ASN HA . . 2.940 2.780 2.777 2.782 . 0 0 "[ . 1 . 2]" 1
1614 1 64 ASN H 1 64 ASN QB . . 2.370 2.248 2.213 2.255 . 0 0 "[ . 1 . 2]" 1
1615 1 64 ASN H 1 64 ASN QD . . 4.190 4.204 4.117 4.219 0.029 4 0 "[ . 1 . 2]" 1
1616 1 64 ASN H 1 65 ALA H . . 2.870 2.726 2.712 2.738 . 0 0 "[ . 1 . 2]" 1
1617 1 64 ASN H 1 65 ALA HA . . 5.500 5.326 5.315 5.336 . 0 0 "[ . 1 . 2]" 1
1618 1 64 ASN H 1 65 ALA MB . . 4.650 4.308 4.299 4.317 . 0 0 "[ . 1 . 2]" 1
1619 1 64 ASN H 1 66 ASN HD21 . . 5.500 5.534 5.521 5.544 0.044 4 0 "[ . 1 . 2]" 1
1620 1 64 ASN HA 1 64 ASN QB . . 2.310 2.340 2.271 2.353 0.043 16 0 "[ . 1 . 2]" 1
1621 1 64 ASN HA 1 64 ASN HD21 . . 4.770 2.286 1.944 4.246 . 0 0 "[ . 1 . 2]" 1
1622 1 64 ASN HA 1 64 ASN QD . . 4.140 2.236 1.935 3.954 . 0 0 "[ . 1 . 2]" 1
1623 1 64 ASN HA 1 64 ASN HD22 . . 4.770 3.692 3.515 4.715 . 0 0 "[ . 1 . 2]" 1
1624 1 64 ASN HA 1 65 ALA MB . . 5.500 4.994 4.990 4.998 . 0 0 "[ . 1 . 2]" 1
1625 1 64 ASN QB 1 64 ASN QD . . 2.980 2.504 2.112 2.573 . 0 0 "[ . 1 . 2]" 1
1626 1 64 ASN QB 1 65 ALA H . . 3.160 2.732 2.683 2.801 . 0 0 "[ . 1 . 2]" 1
1627 1 64 ASN QB 1 65 ALA MB . . 4.720 3.913 3.869 4.025 . 0 0 "[ . 1 . 2]" 1
1628 1 64 ASN QB 1 66 ASN H . . 5.340 4.534 4.499 4.590 . 0 0 "[ . 1 . 2]" 1
1629 1 65 ALA H 1 65 ALA HA . . 2.890 2.845 2.837 2.856 . 0 0 "[ . 1 . 2]" 1
1630 1 65 ALA H 1 65 ALA MB . . 2.750 2.040 2.035 2.048 . 0 0 "[ . 1 . 2]" 1
1631 1 65 ALA H 1 66 ASN HA . . 5.500 5.181 5.150 5.205 . 0 0 "[ . 1 . 2]" 1
1632 1 65 ALA H 1 66 ASN HB2 . . 4.820 4.601 4.520 4.653 . 0 0 "[ . 1 . 2]" 1
1633 1 65 ALA H 1 66 ASN HD21 . . 3.880 3.613 3.574 3.644 . 0 0 "[ . 1 . 2]" 1
1634 1 65 ALA HA 1 66 ASN H . . 3.550 3.404 3.378 3.416 . 0 0 "[ . 1 . 2]" 1
1635 1 65 ALA HA 1 66 ASN HD21 . . 4.750 4.191 4.159 4.260 . 0 0 "[ . 1 . 2]" 1
1636 1 65 ALA HA 1 67 PRO HD3 . . 3.550 3.439 3.393 3.468 . 0 0 "[ . 1 . 2]" 1
1637 1 65 ALA MB 1 66 ASN H . . 3.930 3.103 3.078 3.154 . 0 0 "[ . 1 . 2]" 1
1638 1 65 ALA MB 1 66 ASN HB2 . . 5.500 4.411 4.396 4.436 . 0 0 "[ . 1 . 2]" 1
1639 1 65 ALA MB 1 66 ASN HD21 . . 3.510 2.370 2.337 2.440 . 0 0 "[ . 1 . 2]" 1
1640 1 65 ALA MB 1 66 ASN HD22 . . 3.420 3.032 2.977 3.146 . 0 0 "[ . 1 . 2]" 1
1641 1 65 ALA MB 1 67 PRO HD2 . . 5.500 4.830 4.795 4.850 . 0 0 "[ . 1 . 2]" 1
1642 1 65 ALA MB 1 67 PRO HD3 . . 5.500 4.339 4.308 4.357 . 0 0 "[ . 1 . 2]" 1
1643 1 66 ASN H 1 66 ASN HB2 . . 2.550 2.440 2.427 2.446 . 0 0 "[ . 1 . 2]" 1
1644 1 66 ASN H 1 66 ASN HB3 . . 3.740 3.655 3.642 3.660 . 0 0 "[ . 1 . 2]" 1
1645 1 66 ASN H 1 66 ASN HD21 . . 2.560 2.419 2.382 2.495 . 0 0 "[ . 1 . 2]" 1
1646 1 66 ASN H 1 67 PRO HA . . 4.830 4.766 4.754 4.775 . 0 0 "[ . 1 . 2]" 1
1647 1 66 ASN H 1 67 PRO HD2 . . 4.300 4.217 4.198 4.232 . 0 0 "[ . 1 . 2]" 1
1648 1 66 ASN H 1 67 PRO HD3 . . 3.670 3.565 3.536 3.587 . 0 0 "[ . 1 . 2]" 1
1649 1 66 ASN H 1 70 MET HG2 . . 5.500 5.074 5.018 5.132 . 0 0 "[ . 1 . 2]" 1
1650 1 66 ASN HA 1 69 LEU H . . 4.700 4.009 4.004 4.021 . 0 0 "[ . 1 . 2]" 1
1651 1 66 ASN HA 1 69 LEU HB3 . . 4.700 4.702 4.644 4.721 0.021 15 0 "[ . 1 . 2]" 1
1652 1 66 ASN HB2 1 66 ASN HD21 . . 3.130 2.606 2.577 2.622 . 0 0 "[ . 1 . 2]" 1
1653 1 66 ASN HB2 1 66 ASN HD22 . . 3.980 3.635 3.623 3.642 . 0 0 "[ . 1 . 2]" 1
1654 1 66 ASN HB2 1 67 PRO HA . . 5.470 5.358 5.349 5.379 . 0 0 "[ . 1 . 2]" 1
1655 1 66 ASN HB2 1 69 LEU H . . 4.680 4.170 4.128 4.230 . 0 0 "[ . 1 . 2]" 1
1656 1 66 ASN HB2 1 69 LEU MD2 . . 5.500 4.157 4.108 4.221 . 0 0 "[ . 1 . 2]" 1
1657 1 66 ASN HB3 1 67 PRO HA . . 5.500 5.153 5.131 5.164 . 0 0 "[ . 1 . 2]" 1
1658 1 66 ASN HB3 1 67 PRO HD2 . . 5.000 4.245 4.226 4.276 . 0 0 "[ . 1 . 2]" 1
1659 1 66 ASN HB3 1 69 LEU H . . 3.560 2.843 2.817 2.914 . 0 0 "[ . 1 . 2]" 1
1660 1 66 ASN HB3 1 69 LEU HA . . 4.830 4.640 4.613 4.656 . 0 0 "[ . 1 . 2]" 1
1661 1 66 ASN HB3 1 69 LEU HB3 . . 3.340 2.341 2.312 2.356 . 0 0 "[ . 1 . 2]" 1
1662 1 66 ASN HB3 1 69 LEU MD1 . . 3.400 3.085 2.997 3.128 . 0 0 "[ . 1 . 2]" 1
1663 1 66 ASN HB3 1 69 LEU MD2 . . 5.500 4.051 4.004 4.072 . 0 0 "[ . 1 . 2]" 1
1664 1 66 ASN HB3 1 69 LEU HG . . 5.020 4.888 4.839 4.918 . 0 0 "[ . 1 . 2]" 1
1665 1 66 ASN HB3 1 70 MET H . . 5.280 3.791 3.764 3.830 . 0 0 "[ . 1 . 2]" 1
1666 1 66 ASN HB3 1 70 MET HB3 . . 5.500 5.493 5.440 5.527 0.027 20 0 "[ . 1 . 2]" 1
1667 1 66 ASN HD21 1 69 LEU MD1 . . 5.500 5.190 5.164 5.207 . 0 0 "[ . 1 . 2]" 1
1668 1 66 ASN HD22 1 67 PRO HD2 . . 5.500 5.573 5.533 5.596 0.096 4 0 "[ . 1 . 2]" 1
1669 1 67 PRO HA 1 69 LEU H . . 4.170 3.967 3.921 4.000 . 0 0 "[ . 1 . 2]" 1
1670 1 67 PRO HA 1 69 LEU HB3 . . 5.500 5.399 5.318 5.438 . 0 0 "[ . 1 . 2]" 1
1671 1 67 PRO HA 1 70 MET H . . 4.080 3.731 3.661 3.776 . 0 0 "[ . 1 . 2]" 1
1672 1 67 PRO HA 1 70 MET ME . . 4.480 2.851 2.751 2.910 . 0 0 "[ . 1 . 2]" 1
1673 1 67 PRO HA 1 70 MET HG2 . . 4.350 2.020 1.950 2.140 . 0 0 "[ . 1 . 2]" 1
1674 1 67 PRO HA 1 70 MET HG3 . . 3.720 3.003 2.982 3.044 . 0 0 "[ . 1 . 2]" 1
1675 1 67 PRO HA 1 71 LYS H . . 4.570 4.531 4.508 4.552 . 0 0 "[ . 1 . 2]" 1
1676 1 67 PRO HA 1 71 LYS HG3 . . 5.110 4.120 4.062 4.181 . 0 0 "[ . 1 . 2]" 1
1677 1 67 PRO QB 1 68 GLY H . . 3.670 3.344 3.250 3.383 . 0 0 "[ . 1 . 2]" 1
1678 1 67 PRO QB 1 71 LYS H . . 5.340 5.439 5.404 5.465 0.125 2 0 "[ . 1 . 2]" 1
1679 1 67 PRO HB2 1 68 GLY HA2 . . 5.500 4.151 4.106 4.172 . 0 0 "[ . 1 . 2]" 1
1680 1 67 PRO HB3 1 68 GLY HA2 . . 5.500 5.596 5.574 5.605 0.105 20 0 "[ . 1 . 2]" 1
1681 1 67 PRO HD2 1 68 GLY H . . 4.100 2.673 2.651 2.688 . 0 0 "[ . 1 . 2]" 1
1682 1 67 PRO HD2 1 68 GLY HA3 . . 4.820 4.744 4.742 4.747 . 0 0 "[ . 1 . 2]" 1
1683 1 67 PRO HD2 1 69 LEU H . . 5.240 4.503 4.447 4.528 . 0 0 "[ . 1 . 2]" 1
1684 1 67 PRO HD2 1 70 MET HG2 . . 5.500 5.432 5.396 5.498 . 0 0 "[ . 1 . 2]" 1
1685 1 67 PRO HD3 1 68 GLY H . . 5.500 3.857 3.842 3.866 . 0 0 "[ . 1 . 2]" 1
1686 1 67 PRO HD3 1 69 LEU H . . 5.500 5.376 5.332 5.387 . 0 0 "[ . 1 . 2]" 1
1687 1 67 PRO QG 1 68 GLY H . . 3.250 2.559 2.414 2.621 . 0 0 "[ . 1 . 2]" 1
1688 1 68 GLY H 1 69 LEU H . . 3.370 2.446 2.415 2.513 . 0 0 "[ . 1 . 2]" 1
1689 1 68 GLY H 1 69 LEU HB2 . . 5.500 4.689 4.637 4.749 . 0 0 "[ . 1 . 2]" 1
1690 1 68 GLY H 1 69 LEU HB3 . . 5.270 4.716 4.683 4.790 . 0 0 "[ . 1 . 2]" 1
1691 1 68 GLY H 1 70 MET H . . 5.110 4.328 4.300 4.397 . 0 0 "[ . 1 . 2]" 1
1692 1 68 GLY H 1 71 LYS H . . 5.180 5.067 5.050 5.118 . 0 0 "[ . 1 . 2]" 1
1693 1 68 GLY HA2 1 70 MET H . . 4.990 4.908 4.882 4.921 . 0 0 "[ . 1 . 2]" 1
1694 1 68 GLY HA2 1 71 LYS H . . 4.570 3.971 3.956 3.985 . 0 0 "[ . 1 . 2]" 1
1695 1 68 GLY HA2 1 71 LYS HB2 . . 4.320 3.225 3.154 3.313 . 0 0 "[ . 1 . 2]" 1
1696 1 68 GLY HA2 1 71 LYS HD2 . . 5.500 3.889 2.633 4.959 . 0 0 "[ . 1 . 2]" 1
1697 1 68 GLY HA2 1 71 LYS HD3 . . 5.500 4.914 4.391 5.217 . 0 0 "[ . 1 . 2]" 1
1698 1 68 GLY HA2 1 71 LYS QE . . 3.560 2.608 2.021 3.576 0.016 8 0 "[ . 1 . 2]" 1
1699 1 68 GLY HA2 1 71 LYS HG2 . . 5.500 5.331 5.194 5.424 . 0 0 "[ . 1 . 2]" 1
1700 1 68 GLY HA2 1 71 LYS HG3 . . 4.340 3.943 3.903 3.977 . 0 0 "[ . 1 . 2]" 1
1701 1 68 GLY HA3 1 69 LEU H . . 3.230 3.092 3.078 3.108 . 0 0 "[ . 1 . 2]" 1
1702 1 68 GLY HA3 1 70 MET H . . 5.500 5.227 5.207 5.256 . 0 0 "[ . 1 . 2]" 1
1703 1 69 LEU H 1 69 LEU HB2 . . 3.180 2.698 2.692 2.702 . 0 0 "[ . 1 . 2]" 1
1704 1 69 LEU H 1 69 LEU HB3 . . 2.810 2.503 2.495 2.511 . 0 0 "[ . 1 . 2]" 1
1705 1 69 LEU H 1 69 LEU MD1 . . 5.500 4.297 4.294 4.301 . 0 0 "[ . 1 . 2]" 1
1706 1 69 LEU H 1 69 LEU MD2 . . 5.480 3.970 3.961 3.980 . 0 0 "[ . 1 . 2]" 1
1707 1 69 LEU H 1 69 LEU HG . . 4.740 4.556 4.554 4.557 . 0 0 "[ . 1 . 2]" 1
1708 1 69 LEU H 1 70 MET H . . 2.600 2.386 2.379 2.392 . 0 0 "[ . 1 . 2]" 1
1709 1 69 LEU H 1 70 MET HA . . 5.280 5.012 5.008 5.016 . 0 0 "[ . 1 . 2]" 1
1710 1 69 LEU H 1 72 ASP HB2 . . 5.500 5.241 5.218 5.261 . 0 0 "[ . 1 . 2]" 1
1711 1 69 LEU H 1 73 VAL MG1 . . 5.500 5.268 5.262 5.283 . 0 0 "[ . 1 . 2]" 1
1712 1 69 LEU HA 1 69 LEU MD2 . . 3.850 3.194 3.183 3.205 . 0 0 "[ . 1 . 2]" 1
1713 1 69 LEU HA 1 71 LYS H . . 4.830 3.800 3.789 3.813 . 0 0 "[ . 1 . 2]" 1
1714 1 69 LEU HA 1 72 ASP H . . 4.000 3.152 3.134 3.179 . 0 0 "[ . 1 . 2]" 1
1715 1 69 LEU HA 1 72 ASP HB2 . . 3.900 2.751 2.718 2.791 . 0 0 "[ . 1 . 2]" 1
1716 1 69 LEU HA 1 73 VAL MG1 . . 5.500 4.352 4.344 4.367 . 0 0 "[ . 1 . 2]" 1
1717 1 69 LEU HB2 1 69 LEU MD1 . . 3.410 2.207 2.185 2.219 . 0 0 "[ . 1 . 2]" 1
1718 1 69 LEU HB3 1 69 LEU MD1 . . 3.020 2.460 2.453 2.473 . 0 0 "[ . 1 . 2]" 1
1719 1 69 LEU HB3 1 70 MET H . . 2.730 2.378 2.359 2.393 . 0 0 "[ . 1 . 2]" 1
1720 1 69 LEU HB3 1 70 MET HA . . 5.320 4.140 4.133 4.147 . 0 0 "[ . 1 . 2]" 1
1721 1 69 LEU HB3 1 70 MET HG2 . . 4.400 4.196 4.076 4.255 . 0 0 "[ . 1 . 2]" 1
1722 1 69 LEU HB3 1 71 LYS H . . 5.500 4.639 4.625 4.656 . 0 0 "[ . 1 . 2]" 1
1723 1 69 LEU MD1 1 70 MET H . . 5.500 4.441 4.424 4.466 . 0 0 "[ . 1 . 2]" 1
1724 1 69 LEU MD2 1 70 MET H . . 5.340 2.762 2.749 2.785 . 0 0 "[ . 1 . 2]" 1
1725 1 69 LEU MD2 1 70 MET HA . . 5.500 2.604 2.592 2.621 . 0 0 "[ . 1 . 2]" 1
1726 1 69 LEU MD2 1 70 MET HB3 . . 5.500 3.613 3.595 3.633 . 0 0 "[ . 1 . 2]" 1
1727 1 69 LEU MD2 1 72 ASP H . . 5.500 4.081 4.065 4.108 . 0 0 "[ . 1 . 2]" 1
1728 1 69 LEU MD2 1 72 ASP HB2 . . 5.330 4.408 4.389 4.434 . 0 0 "[ . 1 . 2]" 1
1729 1 69 LEU MD2 1 72 ASP HB3 . . 4.350 4.378 4.370 4.393 0.043 15 0 "[ . 1 . 2]" 1
1730 1 69 LEU MD2 1 73 VAL H . . 4.120 2.943 2.917 2.968 . 0 0 "[ . 1 . 2]" 1
1731 1 69 LEU HG 1 70 MET H . . 5.500 4.555 4.546 4.561 . 0 0 "[ . 1 . 2]" 1
1732 1 69 LEU HG 1 70 MET HA . . 4.770 5.058 5.049 5.071 0.301 16 0 "[ . 1 . 2]" 1
1733 1 69 LEU HG 1 71 LYS H . . 5.500 5.631 5.616 5.646 0.146 20 0 "[ . 1 . 2]" 1
1734 1 69 LEU HG 1 72 ASP H . . 5.500 4.805 4.782 4.828 . 0 0 "[ . 1 . 2]" 1
1735 1 69 LEU HG 1 72 ASP HB2 . . 5.440 4.237 4.193 4.295 . 0 0 "[ . 1 . 2]" 1
1736 1 69 LEU HG 1 73 VAL H . . 4.800 4.207 4.168 4.264 . 0 0 "[ . 1 . 2]" 1
1737 1 70 MET H 1 70 MET HB3 . . 2.770 2.612 2.592 2.647 . 0 0 "[ . 1 . 2]" 1
1738 1 70 MET H 1 70 MET ME . . 5.500 3.615 3.398 3.719 . 0 0 "[ . 1 . 2]" 1
1739 1 70 MET H 1 70 MET HG2 . . 3.020 2.060 1.961 2.111 . 0 0 "[ . 1 . 2]" 1
1740 1 70 MET H 1 70 MET HG3 . . 3.190 3.054 3.005 3.115 . 0 0 "[ . 1 . 2]" 1
1741 1 70 MET H 1 71 LYS H . . 2.880 2.742 2.736 2.752 . 0 0 "[ . 1 . 2]" 1
1742 1 70 MET H 1 71 LYS HA . . 5.500 5.330 5.323 5.340 . 0 0 "[ . 1 . 2]" 1
1743 1 70 MET H 1 71 LYS QE . . 5.340 5.307 5.162 5.388 0.048 11 0 "[ . 1 . 2]" 1
1744 1 70 MET H 1 73 VAL MG1 . . 5.500 3.653 3.648 3.664 . 0 0 "[ . 1 . 2]" 1
1745 1 70 MET HA 1 70 MET HB2 . . 2.920 2.509 2.500 2.526 . 0 0 "[ . 1 . 2]" 1
1746 1 70 MET HA 1 70 MET ME . . 5.450 4.024 4.007 4.041 . 0 0 "[ . 1 . 2]" 1
1747 1 70 MET HA 1 70 MET HG3 . . 3.960 3.732 3.714 3.774 . 0 0 "[ . 1 . 2]" 1
1748 1 70 MET HA 1 72 ASP H . . 5.500 4.192 4.152 4.242 . 0 0 "[ . 1 . 2]" 1
1749 1 70 MET HA 1 72 ASP HB2 . . 5.500 5.796 5.784 5.805 0.305 10 0 "[ . 1 . 2]" 1
1750 1 70 MET HA 1 73 VAL H . . 4.100 3.505 3.478 3.528 . 0 0 "[ . 1 . 2]" 1
1751 1 70 MET HA 1 73 VAL HA . . 5.500 5.496 5.478 5.513 0.013 3 0 "[ . 1 . 2]" 1
1752 1 70 MET HA 1 73 VAL HB . . 3.500 3.990 3.982 3.998 0.498 14 0 "[ . 1 . 2]" 1
1753 1 70 MET HA 1 73 VAL MG1 . . 3.260 1.762 1.755 1.769 . 0 0 "[ . 1 . 2]" 1
1754 1 70 MET HA 1 74 ALA H . . 5.000 3.668 3.622 3.712 . 0 0 "[ . 1 . 2]" 1
1755 1 70 MET HB2 1 70 MET HG3 . . 2.550 2.497 2.453 2.517 . 0 0 "[ . 1 . 2]" 1
1756 1 70 MET HB2 1 71 LYS H . . 4.440 3.907 3.882 3.923 . 0 0 "[ . 1 . 2]" 1
1757 1 70 MET HB2 1 73 VAL MG1 . . 5.300 3.552 3.544 3.563 . 0 0 "[ . 1 . 2]" 1
1758 1 70 MET HB3 1 71 LYS H . . 4.900 4.176 4.163 4.194 . 0 0 "[ . 1 . 2]" 1
1759 1 70 MET HB3 1 73 VAL MG1 . . 5.500 3.595 3.565 3.614 . 0 0 "[ . 1 . 2]" 1
1760 1 70 MET HG2 1 71 LYS H . . 4.600 3.158 3.080 3.213 . 0 0 "[ . 1 . 2]" 1
1761 1 70 MET HG2 1 71 LYS HA . . 5.500 5.205 5.141 5.257 . 0 0 "[ . 1 . 2]" 1
1762 1 70 MET HG2 1 71 LYS HG2 . . 5.500 5.248 5.194 5.282 . 0 0 "[ . 1 . 2]" 1
1763 1 70 MET HG3 1 71 LYS H . . 3.410 2.504 2.430 2.588 . 0 0 "[ . 1 . 2]" 1
1764 1 70 MET HG3 1 71 LYS HA . . 4.100 3.676 3.640 3.741 . 0 0 "[ . 1 . 2]" 1
1765 1 70 MET HG3 1 71 LYS HD2 . . 5.500 5.217 4.577 5.522 0.022 2 0 "[ . 1 . 2]" 1
1766 1 70 MET HG3 1 71 LYS HD3 . . 5.500 5.121 4.792 5.320 . 0 0 "[ . 1 . 2]" 1
1767 1 70 MET HG3 1 71 LYS HG2 . . 4.020 3.655 3.607 3.706 . 0 0 "[ . 1 . 2]" 1
1768 1 70 MET HG3 1 71 LYS HG3 . . 4.570 2.458 2.258 2.612 . 0 0 "[ . 1 . 2]" 1
1769 1 70 MET HG3 1 72 ASP H . . 5.500 4.815 4.774 4.898 . 0 0 "[ . 1 . 2]" 1
1770 1 71 LYS H 1 71 LYS HA . . 2.840 2.882 2.879 2.884 0.044 16 0 "[ . 1 . 2]" 1
1771 1 71 LYS H 1 71 LYS HB2 . . 2.830 2.333 2.295 2.405 . 0 0 "[ . 1 . 2]" 1
1772 1 71 LYS H 1 71 LYS HD2 . . 5.500 4.540 3.902 5.048 . 0 0 "[ . 1 . 2]" 1
1773 1 71 LYS H 1 71 LYS HD3 . . 5.500 5.135 4.902 5.272 . 0 0 "[ . 1 . 2]" 1
1774 1 71 LYS H 1 71 LYS HG2 . . 3.750 3.756 3.720 3.787 0.037 9 0 "[ . 1 . 2]" 1
1775 1 71 LYS H 1 71 LYS HG3 . . 4.540 2.671 2.475 2.774 . 0 0 "[ . 1 . 2]" 1
1776 1 71 LYS H 1 72 ASP HA . . 5.400 5.060 5.054 5.074 . 0 0 "[ . 1 . 2]" 1
1777 1 71 LYS H 1 72 ASP HB2 . . 5.500 4.245 4.236 4.261 . 0 0 "[ . 1 . 2]" 1
1778 1 71 LYS H 1 73 VAL H . . 4.820 3.921 3.898 3.944 . 0 0 "[ . 1 . 2]" 1
1779 1 71 LYS H 1 73 VAL HB . . 5.500 5.966 5.958 5.977 0.477 15 0 "[ . 1 . 2]" 1
1780 1 71 LYS H 1 73 VAL MG1 . . 5.500 3.780 3.766 3.806 . 0 0 "[ . 1 . 2]" 1
1781 1 71 LYS H 1 74 ALA H . . 5.500 4.610 4.591 4.622 . 0 0 "[ . 1 . 2]" 1
1782 1 71 LYS HA 1 71 LYS HB3 . . 2.760 2.554 2.507 2.578 . 0 0 "[ . 1 . 2]" 1
1783 1 71 LYS HA 1 71 LYS QD . . 4.210 3.941 3.876 4.046 . 0 0 "[ . 1 . 2]" 1
1784 1 71 LYS HA 1 71 LYS QE . . 5.120 4.615 4.428 4.753 . 0 0 "[ . 1 . 2]" 1
1785 1 71 LYS HA 1 71 LYS HG3 . . 3.240 3.003 2.905 3.057 . 0 0 "[ . 1 . 2]" 1
1786 1 71 LYS HA 1 72 ASP HB2 . . 5.500 5.522 5.514 5.533 0.033 17 0 "[ . 1 . 2]" 1
1787 1 71 LYS HA 1 73 VAL H . . 4.740 4.614 4.569 4.653 . 0 0 "[ . 1 . 2]" 1
1788 1 71 LYS HA 1 74 ALA H . . 4.760 3.825 3.784 3.862 . 0 0 "[ . 1 . 2]" 1
1789 1 71 LYS HB2 1 71 LYS QE . . 3.820 2.902 1.990 3.742 . 0 0 "[ . 1 . 2]" 1
1790 1 71 LYS HB2 1 72 ASP H . . 3.740 2.919 2.845 2.963 . 0 0 "[ . 1 . 2]" 1
1791 1 71 LYS HB2 1 72 ASP HB2 . . 4.570 4.261 4.207 4.294 . 0 0 "[ . 1 . 2]" 1
1792 1 71 LYS HB2 1 73 VAL H . . 5.500 5.159 5.124 5.194 . 0 0 "[ . 1 . 2]" 1
1793 1 71 LYS HB3 1 71 LYS QE . . 4.350 3.626 2.975 4.189 . 0 0 "[ . 1 . 2]" 1
1794 1 71 LYS HB3 1 71 LYS HG2 . . 2.550 2.470 2.378 2.519 . 0 0 "[ . 1 . 2]" 1
1795 1 71 LYS HG3 1 72 ASP H . . 4.880 4.579 4.434 4.663 . 0 0 "[ . 1 . 2]" 1
1796 1 72 ASP H 1 72 ASP HB2 . . 3.300 2.156 2.138 2.168 . 0 0 "[ . 1 . 2]" 1
1797 1 72 ASP H 1 72 ASP HB3 . . 3.850 3.250 3.242 3.256 . 0 0 "[ . 1 . 2]" 1
1798 1 72 ASP H 1 73 VAL H . . 2.400 2.348 2.321 2.388 . 0 0 "[ . 1 . 2]" 1
1799 1 72 ASP H 1 73 VAL HB . . 5.070 4.840 4.813 4.878 . 0 0 "[ . 1 . 2]" 1
1800 1 72 ASP H 1 73 VAL MG1 . . 4.860 3.431 3.415 3.465 . 0 0 "[ . 1 . 2]" 1
1801 1 72 ASP H 1 74 ALA H . . 5.280 3.832 3.803 3.865 . 0 0 "[ . 1 . 2]" 1
1802 1 72 ASP H 1 75 LYS QD . . 5.340 4.735 4.655 4.825 . 0 0 "[ . 1 . 2]" 1
1803 1 72 ASP HA 1 74 ALA H . . 4.380 4.396 4.387 4.406 0.026 4 0 "[ . 1 . 2]" 1
1804 1 72 ASP HA 1 74 ALA MB . . 5.500 5.218 5.203 5.241 . 0 0 "[ . 1 . 2]" 1
1805 1 72 ASP HA 1 75 LYS H . . 4.220 3.816 3.794 3.838 . 0 0 "[ . 1 . 2]" 1
1806 1 72 ASP HA 1 75 LYS HB3 . . 3.760 2.692 2.657 2.735 . 0 0 "[ . 1 . 2]" 1
1807 1 72 ASP HA 1 75 LYS QD . . 5.340 2.033 1.986 2.356 . 0 0 "[ . 1 . 2]" 1
1808 1 72 ASP HA 1 75 LYS HE2 . . 5.500 4.384 3.221 5.114 . 0 0 "[ . 1 . 2]" 1
1809 1 72 ASP HA 1 75 LYS HE3 . . 5.500 4.231 3.457 5.025 . 0 0 "[ . 1 . 2]" 1
1810 1 72 ASP HA 1 75 LYS HG3 . . 5.500 4.759 4.708 4.814 . 0 0 "[ . 1 . 2]" 1
1811 1 72 ASP HB2 1 73 VAL H . . 3.810 3.185 3.164 3.210 . 0 0 "[ . 1 . 2]" 1
1812 1 72 ASP HB2 1 73 VAL MG1 . . 5.500 4.606 4.590 4.624 . 0 0 "[ . 1 . 2]" 1
1813 1 72 ASP HB2 1 74 ALA H . . 5.500 5.344 5.335 5.354 . 0 0 "[ . 1 . 2]" 1
1814 1 72 ASP HB2 1 75 LYS QD . . 4.820 4.321 4.263 4.409 . 0 0 "[ . 1 . 2]" 1
1815 1 72 ASP HB3 1 73 VAL H . . 3.880 3.012 2.985 3.047 . 0 0 "[ . 1 . 2]" 1
1816 1 72 ASP HB3 1 73 VAL HA . . 4.530 3.904 3.895 3.920 . 0 0 "[ . 1 . 2]" 1
1817 1 72 ASP HB3 1 73 VAL MG1 . . 5.500 4.562 4.551 4.579 . 0 0 "[ . 1 . 2]" 1
1818 1 72 ASP HB3 1 74 ALA H . . 5.440 5.182 5.164 5.205 . 0 0 "[ . 1 . 2]" 1
1819 1 72 ASP HB3 1 75 LYS H . . 5.500 5.191 5.165 5.227 . 0 0 "[ . 1 . 2]" 1
1820 1 72 ASP HB3 1 75 LYS QD . . 4.420 3.636 3.437 3.821 . 0 0 "[ . 1 . 2]" 1
1821 1 73 VAL H 1 73 VAL HB . . 3.130 2.653 2.639 2.666 . 0 0 "[ . 1 . 2]" 1
1822 1 73 VAL H 1 73 VAL MG1 . . 3.430 1.929 1.911 1.952 . 0 0 "[ . 1 . 2]" 1
1823 1 73 VAL H 1 74 ALA H . . 2.570 2.557 2.526 2.579 0.009 6 0 "[ . 1 . 2]" 1
1824 1 73 VAL H 1 74 ALA HA . . 5.500 5.200 5.174 5.217 . 0 0 "[ . 1 . 2]" 1
1825 1 73 VAL H 1 74 ALA MB . . 4.680 4.271 4.247 4.288 . 0 0 "[ . 1 . 2]" 1
1826 1 73 VAL H 1 75 LYS H . . 4.290 3.917 3.902 3.927 . 0 0 "[ . 1 . 2]" 1
1827 1 73 VAL H 1 75 LYS HB3 . . 5.500 4.860 4.838 4.876 . 0 0 "[ . 1 . 2]" 1
1828 1 73 VAL HA 1 73 VAL MG1 . . 3.180 3.189 3.188 3.190 0.010 16 0 "[ . 1 . 2]" 1
1829 1 73 VAL HA 1 73 VAL MG2 . . 3.690 2.398 2.393 2.402 . 0 0 "[ . 1 . 2]" 1
1830 1 73 VAL HA 1 74 ALA HA . . 5.500 4.720 4.715 4.724 . 0 0 "[ . 1 . 2]" 1
1831 1 73 VAL HA 1 74 ALA MB . . 5.500 5.011 5.009 5.012 . 0 0 "[ . 1 . 2]" 1
1832 1 73 VAL HA 1 75 LYS H . . 3.680 3.483 3.474 3.497 . 0 0 "[ . 1 . 2]" 1
1833 1 73 VAL HA 1 75 LYS HB3 . . 5.500 5.107 5.079 5.151 . 0 0 "[ . 1 . 2]" 1
1834 1 73 VAL HA 1 75 LYS QD . . 5.300 4.763 4.560 5.066 . 0 0 "[ . 1 . 2]" 1
1835 1 73 VAL HA 1 75 LYS HG2 . . 5.500 4.196 4.164 4.223 . 0 0 "[ . 1 . 2]" 1
1836 1 73 VAL HA 1 76 VAL H . . 4.340 3.681 3.671 3.701 . 0 0 "[ . 1 . 2]" 1
1837 1 73 VAL HA 1 76 VAL HB . . 5.500 5.597 5.573 5.609 0.109 8 0 "[ . 1 . 2]" 1
1838 1 73 VAL HA 1 76 VAL QG . . 3.430 3.031 3.001 3.064 . 0 0 "[ . 1 . 2]" 1
1839 1 73 VAL HA 1 77 PHE H . . 5.080 3.438 3.409 3.474 . 0 0 "[ . 1 . 2]" 1
1840 1 73 VAL HA 1 77 PHE HB2 . . 5.450 3.083 3.063 3.132 . 0 0 "[ . 1 . 2]" 1
1841 1 73 VAL HA 1 77 PHE HD1 . . 5.500 5.135 5.062 5.321 . 0 0 "[ . 1 . 2]" 1
1842 1 73 VAL HB 1 74 ALA H . . 3.310 3.976 3.970 3.984 0.674 10 20 [*********+*********-] 1
1843 1 73 VAL HB 1 74 ALA HA . . 5.490 5.627 5.625 5.629 0.139 10 0 "[ . 1 . 2]" 1
1844 1 73 VAL HB 1 74 ALA MB . . 5.500 5.267 5.258 5.273 . 0 0 "[ . 1 . 2]" 1
1845 1 73 VAL HB 1 75 LYS H . . 5.010 5.283 5.278 5.289 0.279 10 0 "[ . 1 . 2]" 1
1846 1 73 VAL HB 1 77 PHE HB3 . . 5.280 5.320 5.313 5.331 0.051 1 0 "[ . 1 . 2]" 1
1847 1 73 VAL MG1 1 74 ALA H . . 5.050 1.931 1.921 1.943 . 0 0 "[ . 1 . 2]" 1
1848 1 73 VAL MG1 1 77 PHE HB2 . . 5.500 4.247 4.224 4.282 . 0 0 "[ . 1 . 2]" 1
1849 1 73 VAL MG2 1 75 LYS H . . 5.500 4.358 4.347 4.373 . 0 0 "[ . 1 . 2]" 1
1850 1 73 VAL MG2 1 77 PHE HA . . 5.500 4.345 4.331 4.368 . 0 0 "[ . 1 . 2]" 1
1851 1 73 VAL MG2 1 77 PHE HB2 . . 4.230 2.012 1.988 2.055 . 0 0 "[ . 1 . 2]" 1
1852 1 73 VAL MG2 1 77 PHE HB3 . . 4.360 2.506 2.466 2.525 . 0 0 "[ . 1 . 2]" 1
1853 1 74 ALA H 1 74 ALA MB . . 3.390 2.231 2.226 2.240 . 0 0 "[ . 1 . 2]" 1
1854 1 74 ALA H 1 75 LYS H . . 2.690 2.641 2.632 2.647 . 0 0 "[ . 1 . 2]" 1
1855 1 74 ALA H 1 76 VAL H . . 4.630 4.474 4.458 4.481 . 0 0 "[ . 1 . 2]" 1
1856 1 74 ALA HA 1 75 LYS H . . 3.550 3.221 3.217 3.229 . 0 0 "[ . 1 . 2]" 1
1857 1 74 ALA HA 1 75 LYS HB3 . . 5.500 5.378 5.373 5.387 . 0 0 "[ . 1 . 2]" 1
1858 1 74 ALA HA 1 76 VAL H . . 4.860 4.033 4.008 4.044 . 0 0 "[ . 1 . 2]" 1
1859 1 74 ALA HA 1 77 PHE H . . 4.200 3.821 3.781 3.835 . 0 0 "[ . 1 . 2]" 1
1860 1 74 ALA HA 1 77 PHE HB2 . . 4.970 4.414 4.378 4.454 . 0 0 "[ . 1 . 2]" 1
1861 1 74 ALA HA 1 77 PHE HB3 . . 5.500 4.798 4.681 4.882 . 0 0 "[ . 1 . 2]" 1
1862 1 74 ALA MB 1 75 LYS H . . 3.920 3.359 3.348 3.365 . 0 0 "[ . 1 . 2]" 1
1863 1 74 ALA MB 1 75 LYS HB3 . . 4.830 4.380 4.364 4.388 . 0 0 "[ . 1 . 2]" 1
1864 1 74 ALA MB 1 76 VAL H . . 5.500 4.802 4.790 4.809 . 0 0 "[ . 1 . 2]" 1
1865 1 75 LYS H 1 75 LYS HB3 . . 2.980 2.382 2.369 2.405 . 0 0 "[ . 1 . 2]" 1
1866 1 75 LYS H 1 75 LYS QD . . 4.170 3.707 3.656 3.776 . 0 0 "[ . 1 . 2]" 1
1867 1 75 LYS H 1 75 LYS HG2 . . 3.250 2.768 2.741 2.786 . 0 0 "[ . 1 . 2]" 1
1868 1 75 LYS H 1 75 LYS HG3 . . 3.960 4.042 4.031 4.048 0.088 20 0 "[ . 1 . 2]" 1
1869 1 75 LYS H 1 76 VAL H . . 2.720 2.210 2.193 2.230 . 0 0 "[ . 1 . 2]" 1
1870 1 75 LYS H 1 76 VAL HA . . 4.910 4.928 4.915 4.945 0.035 2 0 "[ . 1 . 2]" 1
1871 1 75 LYS H 1 76 VAL QG . . 3.940 3.611 3.578 3.649 . 0 0 "[ . 1 . 2]" 1
1872 1 75 LYS H 1 77 PHE H . . 3.350 3.391 3.377 3.406 0.056 2 0 "[ . 1 . 2]" 1
1873 1 75 LYS H 1 77 PHE HB2 . . 5.110 4.786 4.775 4.808 . 0 0 "[ . 1 . 2]" 1
1874 1 75 LYS HA 1 75 LYS HB2 . . 2.840 2.271 2.269 2.275 . 0 0 "[ . 1 . 2]" 1
1875 1 75 LYS HA 1 75 LYS HD2 . . 5.500 4.759 4.579 4.985 . 0 0 "[ . 1 . 2]" 1
1876 1 75 LYS HA 1 75 LYS QD . . 4.830 4.336 4.279 4.446 . 0 0 "[ . 1 . 2]" 1
1877 1 75 LYS HA 1 75 LYS HD3 . . 5.500 5.094 4.659 5.469 . 0 0 "[ . 1 . 2]" 1
1878 1 75 LYS HA 1 75 LYS HG2 . . 3.740 3.678 3.667 3.684 . 0 0 "[ . 1 . 2]" 1
1879 1 75 LYS HA 1 75 LYS HG3 . . 3.870 3.607 3.592 3.632 . 0 0 "[ . 1 . 2]" 1
1880 1 75 LYS HA 1 76 VAL QG . . 5.500 4.809 4.793 4.829 . 0 0 "[ . 1 . 2]" 1
1881 1 75 LYS HB2 1 75 LYS HG3 . . 2.660 2.339 2.328 2.345 . 0 0 "[ . 1 . 2]" 1
1882 1 75 LYS HB3 1 75 LYS QD . . 2.390 2.163 2.102 2.269 . 0 0 "[ . 1 . 2]" 1
1883 1 75 LYS HB3 1 75 LYS HG2 . . 2.970 2.560 2.551 2.576 . 0 0 "[ . 1 . 2]" 1
1884 1 75 LYS QD 1 75 LYS HG3 . . 2.610 2.386 2.227 2.507 . 0 0 "[ . 1 . 2]" 1
1885 1 75 LYS HD2 1 76 VAL H . . 5.500 4.922 4.595 5.194 . 0 0 "[ . 1 . 2]" 1
1886 1 75 LYS HD3 1 76 VAL H . . 5.500 4.504 4.334 4.635 . 0 0 "[ . 1 . 2]" 1
1887 1 75 LYS QE 1 75 LYS HG3 . . 3.550 2.457 2.017 3.193 . 0 0 "[ . 1 . 2]" 1
1888 1 75 LYS QE 1 76 VAL HB . . 5.070 3.919 3.004 4.942 . 0 0 "[ . 1 . 2]" 1
1889 1 75 LYS HG2 1 76 VAL H . . 4.310 2.260 2.250 2.282 . 0 0 "[ . 1 . 2]" 1
1890 1 75 LYS HG2 1 76 VAL HA . . 5.310 3.971 3.960 3.982 . 0 0 "[ . 1 . 2]" 1
1891 1 75 LYS HG2 1 76 VAL HB . . 3.380 2.825 2.776 2.856 . 0 0 "[ . 1 . 2]" 1
1892 1 75 LYS HG2 1 76 VAL QG . . 5.500 2.684 2.651 2.718 . 0 0 "[ . 1 . 2]" 1
1893 1 75 LYS HG2 1 77 PHE H . . 4.500 3.896 3.884 3.908 . 0 0 "[ . 1 . 2]" 1
1894 1 75 LYS HG2 1 77 PHE HB2 . . 5.500 5.599 5.582 5.614 0.114 5 0 "[ . 1 . 2]" 1
1895 1 75 LYS HG3 1 76 VAL H . . 4.020 3.464 3.442 3.496 . 0 0 "[ . 1 . 2]" 1
1896 1 75 LYS HG3 1 76 VAL HA . . 5.500 3.962 3.939 4.004 . 0 0 "[ . 1 . 2]" 1
1897 1 75 LYS HG3 1 76 VAL QG . . 5.500 3.537 3.514 3.575 . 0 0 "[ . 1 . 2]" 1
1898 1 75 LYS HG3 1 77 PHE H . . 5.500 5.193 5.178 5.218 . 0 0 "[ . 1 . 2]" 1
1899 1 76 VAL H 1 76 VAL HB . . 3.200 3.110 3.078 3.134 . 0 0 "[ . 1 . 2]" 1
1900 1 76 VAL H 1 76 VAL QG . . 3.270 2.053 2.035 2.091 . 0 0 "[ . 1 . 2]" 1
1901 1 76 VAL H 1 77 PHE H . . 2.750 1.841 1.836 1.846 . 0 0 "[ . 1 . 2]" 1
1902 1 76 VAL H 1 77 PHE HB2 . . 4.000 3.897 3.880 3.918 . 0 0 "[ . 1 . 2]" 1
1903 1 76 VAL H 1 77 PHE HB3 . . 5.500 5.269 5.236 5.293 . 0 0 "[ . 1 . 2]" 1
1904 1 76 VAL H 1 77 PHE HD1 . . 4.550 4.420 4.345 4.554 0.004 15 0 "[ . 1 . 2]" 1
1905 1 76 VAL HA 1 76 VAL HB . . 2.980 2.476 2.465 2.498 . 0 0 "[ . 1 . 2]" 1
1906 1 76 VAL HA 1 76 VAL QG . . 2.600 2.246 2.230 2.261 . 0 0 "[ . 1 . 2]" 1
1907 1 76 VAL HA 1 77 PHE H . . 3.520 3.503 3.501 3.506 . 0 0 "[ . 1 . 2]" 1
1908 1 76 VAL HA 1 77 PHE HD1 . . 4.510 4.455 4.374 4.547 0.037 2 0 "[ . 1 . 2]" 1
1909 1 76 VAL HB 1 77 PHE H . . 4.120 3.961 3.927 3.975 . 0 0 "[ . 1 . 2]" 1
1910 1 76 VAL QG 1 77 PHE H . . 3.500 1.911 1.894 1.981 . 0 0 "[ . 1 . 2]" 1
1911 1 76 VAL QG 1 77 PHE HA . . 4.620 3.299 3.257 3.320 . 0 0 "[ . 1 . 2]" 1
1912 1 76 VAL QG 1 77 PHE HB2 . . 4.700 2.935 2.905 2.945 . 0 0 "[ . 1 . 2]" 1
1913 1 76 VAL QG 1 77 PHE HB3 . . 5.500 4.141 4.126 4.150 . 0 0 "[ . 1 . 2]" 1
1914 1 76 VAL QG 1 77 PHE HD1 . . 3.390 1.910 1.890 1.958 . 0 0 "[ . 1 . 2]" 1
1915 1 76 VAL QG 1 77 PHE HE1 . . 4.410 2.846 2.727 2.993 . 0 0 "[ . 1 . 2]" 1
1916 1 77 PHE H 1 77 PHE HB2 . . 3.090 2.256 2.240 2.273 . 0 0 "[ . 1 . 2]" 1
1917 1 77 PHE H 1 77 PHE HB3 . . 3.740 3.490 3.462 3.510 . 0 0 "[ . 1 . 2]" 1
1918 1 77 PHE H 1 77 PHE HD1 . . 4.100 3.044 2.987 3.138 . 0 0 "[ . 1 . 2]" 1
1919 1 77 PHE HA 1 77 PHE HD1 . . 3.520 2.338 2.196 2.385 . 0 0 "[ . 1 . 2]" 1
1920 1 77 PHE HB2 1 77 PHE HD2 . . 3.710 3.153 3.094 3.191 . 0 0 "[ . 1 . 2]" 1
1921 1 77 PHE HB3 1 77 PHE HD2 . . 3.510 2.360 2.341 2.394 . 0 0 "[ . 1 . 2]" 1
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