NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
418072 |
2dt7   |
11365 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2dt7
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 2536
_Distance_constraint_stats_list.Viol_count 3833
_Distance_constraint_stats_list.Viol_total 3964.849
_Distance_constraint_stats_list.Viol_max 0.129
_Distance_constraint_stats_list.Viol_rms 0.0151
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0039
_Distance_constraint_stats_list.Viol_average_violations_only 0.0517
_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 GLU 0.159 0.080 15 0 "[ . 1 . 2]"
1 3 LEU 0.159 0.080 15 0 "[ . 1 . 2]"
1 4 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 ALA 0.634 0.085 12 0 "[ . 1 . 2]"
1 6 ILE 1.159 0.085 12 0 "[ . 1 . 2]"
1 7 SER 0.186 0.069 4 0 "[ . 1 . 2]"
1 8 GLY 0.386 0.072 8 0 "[ . 1 . 2]"
1 9 PRO 0.334 0.072 8 0 "[ . 1 . 2]"
1 10 ASN 1.581 0.097 16 0 "[ . 1 . 2]"
1 11 GLU 2.828 0.082 17 0 "[ . 1 . 2]"
1 12 PHE 4.456 0.089 14 0 "[ . 1 . 2]"
1 13 ALA 3.552 0.097 16 0 "[ . 1 . 2]"
1 14 GLU 3.278 0.091 6 0 "[ . 1 . 2]"
1 15 PHE 3.223 0.104 3 0 "[ . 1 . 2]"
1 16 TYR 6.487 0.105 5 0 "[ . 1 . 2]"
1 17 ASN 3.196 0.082 6 0 "[ . 1 . 2]"
1 18 ARG 3.757 0.085 12 0 "[ . 1 . 2]"
1 19 LEU 7.065 0.105 5 0 "[ . 1 . 2]"
1 20 LYS 1.907 0.076 20 0 "[ . 1 . 2]"
1 21 GLN 3.433 0.086 5 0 "[ . 1 . 2]"
1 22 ILE 4.205 0.112 3 0 "[ . 1 . 2]"
1 23 LYS 4.610 0.087 6 0 "[ . 1 . 2]"
1 24 GLU 6.838 0.086 8 0 "[ . 1 . 2]"
1 25 PHE 4.434 0.085 10 0 "[ . 1 . 2]"
1 26 HIS 1.388 0.081 4 0 "[ . 1 . 2]"
1 27 ARG 4.533 0.086 8 0 "[ . 1 . 2]"
1 28 LYS 0.341 0.087 11 0 "[ . 1 . 2]"
1 29 HIS 0.087 0.087 11 0 "[ . 1 . 2]"
1 30 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 GLU 0.208 0.083 5 0 "[ . 1 . 2]"
1 33 ILE 0.756 0.083 5 0 "[ . 1 . 2]"
1 34 CYS 1.045 0.083 11 0 "[ . 1 . 2]"
1 35 VAL 1.779 0.084 11 0 "[ . 1 . 2]"
1 36 PRO 0.890 0.084 11 0 "[ . 1 . 2]"
1 37 MET 0.126 0.058 1 0 "[ . 1 . 2]"
1 38 SER 0.320 0.076 10 0 "[ . 1 . 2]"
2 4 VAL 0.142 0.060 7 0 "[ . 1 . 2]"
2 5 ILE 0.313 0.060 7 0 "[ . 1 . 2]"
2 6 GLN 0.079 0.048 14 0 "[ . 1 . 2]"
2 7 GLU 0.203 0.057 17 0 "[ . 1 . 2]"
2 8 THR 0.380 0.068 15 0 "[ . 1 . 2]"
2 9 ILE 1.215 0.087 11 0 "[ . 1 . 2]"
2 10 VAL 0.830 0.081 19 0 "[ . 1 . 2]"
2 11 PRO 0.264 0.071 8 0 "[ . 1 . 2]"
2 12 LYS 0.488 0.078 10 0 "[ . 1 . 2]"
2 13 GLU 0.888 0.102 16 0 "[ . 1 . 2]"
2 14 PRO 0.273 0.102 16 0 "[ . 1 . 2]"
2 15 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 16 PRO 0.786 0.088 15 0 "[ . 1 . 2]"
2 17 GLU 1.741 0.088 15 0 "[ . 1 . 2]"
2 18 PHE 2.007 0.086 19 0 "[ . 1 . 2]"
2 19 GLU 1.942 0.085 3 0 "[ . 1 . 2]"
2 20 PHE 2.333 0.102 7 0 "[ . 1 . 2]"
2 21 ILE 4.477 0.113 8 0 "[ . 1 . 2]"
2 22 ALA 2.078 0.113 8 0 "[ . 1 . 2]"
2 23 ASP 0.982 0.083 10 0 "[ . 1 . 2]"
2 24 PRO 0.860 0.094 17 0 "[ . 1 . 2]"
2 25 PRO 0.641 0.081 3 0 "[ . 1 . 2]"
2 26 SER 1.054 0.081 3 0 "[ . 1 . 2]"
2 27 ILE 7.558 0.096 19 0 "[ . 1 . 2]"
2 28 SER 1.440 0.072 15 0 "[ . 1 . 2]"
2 29 ALA 1.736 0.077 11 0 "[ . 1 . 2]"
2 30 PHE 5.556 0.100 6 0 "[ . 1 . 2]"
2 31 ASP 4.447 0.093 14 0 "[ . 1 . 2]"
2 32 LEU 6.685 0.104 1 0 "[ . 1 . 2]"
2 33 ASP 4.524 0.092 15 0 "[ . 1 . 2]"
2 34 VAL 4.497 0.112 3 0 "[ . 1 . 2]"
2 35 VAL 7.026 0.104 1 0 "[ . 1 . 2]"
2 36 LYS 4.273 0.098 3 0 "[ . 1 . 2]"
2 37 LEU 6.831 0.096 2 0 "[ . 1 . 2]"
2 38 THR 4.424 0.104 3 0 "[ . 1 . 2]"
2 39 ALA 6.091 0.096 19 0 "[ . 1 . 2]"
2 40 GLN 3.542 0.077 9 0 "[ . 1 . 2]"
2 41 PHE 5.912 0.094 18 0 "[ . 1 . 2]"
2 42 VAL 12.512 0.108 16 0 "[ . 1 . 2]"
2 43 ALA 4.627 0.090 7 0 "[ . 1 . 2]"
2 44 ARG 3.217 0.088 6 0 "[ . 1 . 2]"
2 45 ASN 2.003 0.088 6 0 "[ . 1 . 2]"
2 46 GLY 2.935 0.083 17 0 "[ . 1 . 2]"
2 47 ARG 3.634 0.090 2 0 "[ . 1 . 2]"
2 48 GLN 1.512 0.080 11 0 "[ . 1 . 2]"
2 49 PHE 4.984 0.099 14 0 "[ . 1 . 2]"
2 50 LEU 12.645 0.115 4 0 "[ . 1 . 2]"
2 51 THR 10.501 0.129 14 0 "[ . 1 . 2]"
2 52 GLN 5.959 0.075 19 0 "[ . 1 . 2]"
2 53 LEU 8.732 0.115 4 0 "[ . 1 . 2]"
2 54 MET 8.903 0.111 15 0 "[ . 1 . 2]"
2 55 GLN 4.479 0.129 14 0 "[ . 1 . 2]"
2 56 LYS 3.486 0.089 17 0 "[ . 1 . 2]"
2 57 GLU 3.227 0.095 18 0 "[ . 1 . 2]"
2 58 GLN 1.300 0.077 19 0 "[ . 1 . 2]"
2 59 ARG 0.464 0.078 14 0 "[ . 1 . 2]"
2 60 ASN 2.140 0.087 19 0 "[ . 1 . 2]"
2 61 TYR 0.630 0.082 6 0 "[ . 1 . 2]"
2 62 GLN 4.759 0.105 4 0 "[ . 1 . 2]"
2 63 PHE 7.926 0.092 7 0 "[ . 1 . 2]"
2 64 ASP 1.842 0.079 17 0 "[ . 1 . 2]"
2 65 PHE 3.417 0.087 14 0 "[ . 1 . 2]"
2 66 LEU 4.692 0.089 2 0 "[ . 1 . 2]"
2 67 ARG 2.751 0.081 20 0 "[ . 1 . 2]"
2 68 PRO 4.419 0.111 15 0 "[ . 1 . 2]"
2 69 GLN 2.135 0.065 7 0 "[ . 1 . 2]"
2 70 HIS 5.225 0.082 7 0 "[ . 1 . 2]"
2 71 SER 0.675 0.082 7 0 "[ . 1 . 2]"
2 72 LEU 3.357 0.096 19 0 "[ . 1 . 2]"
2 73 PHE 3.147 0.080 15 0 "[ . 1 . 2]"
2 74 ASN 2.187 0.071 8 0 "[ . 1 . 2]"
2 75 TYR 5.944 0.100 3 0 "[ . 1 . 2]"
2 76 PHE 5.922 0.092 15 0 "[ . 1 . 2]"
2 77 THR 2.343 0.092 15 0 "[ . 1 . 2]"
2 78 LYS 2.627 0.085 13 0 "[ . 1 . 2]"
2 79 LEU 7.328 0.119 3 0 "[ . 1 . 2]"
2 80 VAL 8.354 0.108 16 0 "[ . 1 . 2]"
2 81 GLU 3.160 0.081 4 0 "[ . 1 . 2]"
2 82 GLN 5.132 0.119 3 0 "[ . 1 . 2]"
2 83 TYR 3.291 0.079 2 0 "[ . 1 . 2]"
2 84 THR 4.287 0.097 6 0 "[ . 1 . 2]"
2 85 LYS 2.228 0.097 6 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 GLU QG 1 3 LEU H . . 4.820 3.521 1.654 4.605 . 0 0 "[ . 1 . 2]" 1
2 1 2 GLU HG2 1 3 LEU H . . 5.500 4.253 2.187 5.580 0.080 15 0 "[ . 1 . 2]" 1
3 1 2 GLU HG3 1 3 LEU H . . 5.500 3.907 1.658 5.069 . 0 0 "[ . 1 . 2]" 1
4 1 3 LEU HA 1 3 LEU QD . . 3.790 2.376 1.934 3.435 . 0 0 "[ . 1 . 2]" 1
5 1 3 LEU QD 1 4 ASN H . . 5.040 3.520 2.009 4.510 . 0 0 "[ . 1 . 2]" 1
6 1 4 ASN HB2 1 5 ALA H . . 5.450 3.789 2.463 4.634 . 0 0 "[ . 1 . 2]" 1
7 1 4 ASN HB3 1 5 ALA H . . 5.450 3.194 1.969 4.518 . 0 0 "[ . 1 . 2]" 1
8 1 5 ALA HA 1 6 ILE H . . 3.130 2.623 2.148 3.189 0.059 18 0 "[ . 1 . 2]" 1
9 1 5 ALA HA 1 6 ILE MG . . 4.560 3.689 3.335 4.487 . 0 0 "[ . 1 . 2]" 1
10 1 5 ALA MB 1 6 ILE H . . 3.760 2.612 1.877 3.736 . 0 0 "[ . 1 . 2]" 1
11 1 5 ALA MB 1 6 ILE HA . . 4.650 4.200 3.916 4.419 . 0 0 "[ . 1 . 2]" 1
12 1 5 ALA MB 1 6 ILE HB . . 5.500 5.426 5.159 5.567 0.067 8 0 "[ . 1 . 2]" 1
13 1 5 ALA MB 1 6 ILE MG . . 4.360 3.945 3.027 4.445 0.085 12 0 "[ . 1 . 2]" 1
14 1 6 ILE H 1 6 ILE HB . . 3.960 3.768 3.569 3.946 . 0 0 "[ . 1 . 2]" 1
15 1 6 ILE H 1 6 ILE HG12 . . 3.870 2.783 2.076 3.917 0.047 20 0 "[ . 1 . 2]" 1
16 1 6 ILE H 1 6 ILE QG . . 3.310 2.260 1.896 2.658 . 0 0 "[ . 1 . 2]" 1
17 1 6 ILE H 1 6 ILE HG13 . . 3.870 2.738 1.906 3.503 . 0 0 "[ . 1 . 2]" 1
18 1 6 ILE H 1 6 ILE MG . . 3.700 2.805 2.073 3.298 . 0 0 "[ . 1 . 2]" 1
19 1 6 ILE H 1 7 SER H . . 4.670 4.179 2.140 4.669 . 0 0 "[ . 1 . 2]" 1
20 1 6 ILE HA 1 6 ILE MD . . 4.180 4.058 3.698 4.229 0.049 2 0 "[ . 1 . 2]" 1
21 1 6 ILE HA 1 6 ILE QG . . 3.560 3.419 3.352 3.540 . 0 0 "[ . 1 . 2]" 1
22 1 6 ILE HA 1 6 ILE MG . . 3.290 2.324 2.194 2.444 . 0 0 "[ . 1 . 2]" 1
23 1 6 ILE HA 1 7 SER H . . 3.410 2.536 2.310 3.253 . 0 0 "[ . 1 . 2]" 1
24 1 6 ILE HB 1 6 ILE MD . . 3.390 2.335 2.243 2.467 . 0 0 "[ . 1 . 2]" 1
25 1 6 ILE MD 1 7 SER H . . 4.990 3.937 3.134 5.059 0.069 4 0 "[ . 1 . 2]" 1
26 1 6 ILE HG12 1 6 ILE MG . . 3.540 2.328 2.183 2.576 . 0 0 "[ . 1 . 2]" 1
27 1 6 ILE HG13 1 6 ILE MG . . 3.540 3.066 2.468 3.273 . 0 0 "[ . 1 . 2]" 1
28 1 6 ILE MG 1 7 SER H . . 5.250 3.841 3.537 4.422 . 0 0 "[ . 1 . 2]" 1
29 1 7 SER H 1 7 SER QB . . 3.680 2.858 2.309 3.519 . 0 0 "[ . 1 . 2]" 1
30 1 7 SER HA 1 8 GLY H . . 3.510 2.705 2.188 3.562 0.052 14 0 "[ . 1 . 2]" 1
31 1 7 SER HB2 1 8 GLY H . . 5.370 3.576 1.914 4.623 . 0 0 "[ . 1 . 2]" 1
32 1 7 SER HB3 1 8 GLY H . . 5.370 3.473 2.302 4.732 . 0 0 "[ . 1 . 2]" 1
33 1 8 GLY H 1 9 PRO HD2 . . 5.500 4.747 4.303 4.955 . 0 0 "[ . 1 . 2]" 1
34 1 8 GLY H 1 9 PRO QD . . 4.750 4.291 3.725 4.435 . 0 0 "[ . 1 . 2]" 1
35 1 8 GLY H 1 9 PRO HD3 . . 5.500 4.935 3.912 5.234 . 0 0 "[ . 1 . 2]" 1
36 1 8 GLY QA 1 9 PRO QD . . 2.600 2.076 1.994 2.125 . 0 0 "[ . 1 . 2]" 1
37 1 8 GLY QA 1 9 PRO QG . . 4.220 3.789 3.696 3.859 . 0 0 "[ . 1 . 2]" 1
38 1 8 GLY HA2 1 9 PRO HD2 . . 3.500 2.761 2.425 3.481 . 0 0 "[ . 1 . 2]" 1
39 1 8 GLY HA2 1 9 PRO HD3 . . 3.500 2.510 2.197 2.924 . 0 0 "[ . 1 . 2]" 1
40 1 8 GLY HA3 1 9 PRO HD2 . . 3.500 2.502 2.197 3.012 . 0 0 "[ . 1 . 2]" 1
41 1 8 GLY HA3 1 9 PRO HD3 . . 3.500 3.297 2.649 3.572 0.072 8 0 "[ . 1 . 2]" 1
42 1 9 PRO QB 1 10 ASN H . . 4.110 3.413 2.042 4.086 . 0 0 "[ . 1 . 2]" 1
43 1 10 ASN H 1 10 ASN QD . . 4.810 4.088 2.396 4.807 . 0 0 "[ . 1 . 2]" 1
44 1 10 ASN H 1 11 GLU H . . 4.880 3.974 2.677 4.640 . 0 0 "[ . 1 . 2]" 1
45 1 10 ASN HA 1 11 GLU H . . 3.540 2.278 2.068 2.621 . 0 0 "[ . 1 . 2]" 1
46 1 10 ASN HA 1 12 PHE H . . 4.960 3.997 3.350 4.665 . 0 0 "[ . 1 . 2]" 1
47 1 10 ASN HA 1 13 ALA H . . 4.680 4.275 3.467 4.703 0.023 10 0 "[ . 1 . 2]" 1
48 1 10 ASN HA 1 13 ALA MB . . 4.240 4.243 3.656 4.337 0.097 16 0 "[ . 1 . 2]" 1
49 1 10 ASN QB 1 11 GLU H . . 3.830 3.404 2.488 3.904 0.074 2 0 "[ . 1 . 2]" 1
50 1 10 ASN QB 1 13 ALA H . . 4.720 2.586 2.163 3.340 . 0 0 "[ . 1 . 2]" 1
51 1 10 ASN QB 1 13 ALA HA . . 5.340 4.383 4.052 5.041 . 0 0 "[ . 1 . 2]" 1
52 1 10 ASN QB 1 13 ALA MB . . 3.490 2.277 2.003 3.511 0.021 16 0 "[ . 1 . 2]" 1
53 1 10 ASN HB2 1 11 GLU H . . 4.520 4.261 3.702 4.577 0.057 3 0 "[ . 1 . 2]" 1
54 1 10 ASN HB2 1 13 ALA MB . . 4.150 2.774 2.027 4.243 0.093 16 0 "[ . 1 . 2]" 1
55 1 10 ASN HB3 1 11 GLU H . . 4.520 3.625 2.524 4.384 . 0 0 "[ . 1 . 2]" 1
56 1 10 ASN HB3 1 13 ALA MB . . 4.150 2.709 2.040 3.745 . 0 0 "[ . 1 . 2]" 1
57 1 11 GLU H 1 11 GLU HB2 . . 3.600 2.730 2.272 3.616 0.016 18 0 "[ . 1 . 2]" 1
58 1 11 GLU H 1 11 GLU HG2 . . 4.150 3.138 1.968 3.811 . 0 0 "[ . 1 . 2]" 1
59 1 11 GLU H 1 11 GLU QG . . 3.580 2.218 1.833 2.650 . 0 0 "[ . 1 . 2]" 1
60 1 11 GLU H 1 11 GLU HG3 . . 4.150 2.667 1.855 3.770 . 0 0 "[ . 1 . 2]" 1
61 1 11 GLU H 1 12 PHE H . . 3.880 2.759 2.334 3.035 . 0 0 "[ . 1 . 2]" 1
62 1 11 GLU HA 1 11 GLU HG2 . . 3.930 3.235 2.556 3.750 . 0 0 "[ . 1 . 2]" 1
63 1 11 GLU HA 1 11 GLU QG . . 3.300 2.777 2.466 3.375 0.075 12 0 "[ . 1 . 2]" 1
64 1 11 GLU HA 1 11 GLU HG3 . . 3.930 3.165 2.594 3.961 0.031 12 0 "[ . 1 . 2]" 1
65 1 11 GLU HA 1 14 GLU H . . 3.950 3.726 3.398 3.944 . 0 0 "[ . 1 . 2]" 1
66 1 11 GLU HA 1 14 GLU HB2 . . 4.560 4.124 3.679 4.620 0.060 14 0 "[ . 1 . 2]" 1
67 1 11 GLU HA 1 14 GLU HB3 . . 3.960 3.119 2.778 3.398 . 0 0 "[ . 1 . 2]" 1
68 1 11 GLU HA 1 14 GLU HG2 . . 5.410 4.859 4.493 5.317 . 0 0 "[ . 1 . 2]" 1
69 1 11 GLU HA 1 14 GLU QG . . 4.720 4.513 4.216 4.793 0.073 12 0 "[ . 1 . 2]" 1
70 1 11 GLU HA 1 14 GLU HG3 . . 5.410 5.378 4.880 5.478 0.068 6 0 "[ . 1 . 2]" 1
71 1 11 GLU HA 1 15 PHE H . . 4.880 4.069 3.736 4.360 . 0 0 "[ . 1 . 2]" 1
72 1 11 GLU HA 2 41 PHE QD . . 4.740 4.246 3.440 4.816 0.076 8 0 "[ . 1 . 2]" 1
73 1 11 GLU HA 2 41 PHE QE . . 4.390 3.692 2.600 4.388 . 0 0 "[ . 1 . 2]" 1
74 1 11 GLU HB2 1 12 PHE H . . 3.580 2.694 2.256 3.629 0.049 12 0 "[ . 1 . 2]" 1
75 1 11 GLU HB2 1 12 PHE HA . . 4.880 4.242 3.990 4.642 . 0 0 "[ . 1 . 2]" 1
76 1 11 GLU HB2 1 12 PHE QD . . 5.360 4.160 2.481 5.231 . 0 0 "[ . 1 . 2]" 1
77 1 11 GLU HB2 2 49 PHE QD . . 5.330 3.319 2.588 4.054 . 0 0 "[ . 1 . 2]" 1
78 1 11 GLU HB2 2 49 PHE QE . . 5.260 2.988 2.229 3.976 . 0 0 "[ . 1 . 2]" 1
79 1 11 GLU HB3 2 41 PHE QD . . 4.980 3.498 2.696 4.323 . 0 0 "[ . 1 . 2]" 1
80 1 11 GLU HB3 2 41 PHE QE . . 4.700 4.332 3.351 4.782 0.082 17 0 "[ . 1 . 2]" 1
81 1 11 GLU HB3 2 45 ASN HD21 . . 4.740 3.299 2.642 4.549 . 0 0 "[ . 1 . 2]" 1
82 1 11 GLU HB3 2 45 ASN HD22 . . 4.740 2.747 1.985 3.994 . 0 0 "[ . 1 . 2]" 1
83 1 11 GLU HB3 2 49 PHE QD . . 5.500 3.748 2.496 4.707 . 0 0 "[ . 1 . 2]" 1
84 1 11 GLU HB3 2 49 PHE QE . . 4.680 3.282 2.287 4.740 0.060 18 0 "[ . 1 . 2]" 1
85 1 11 GLU QG 1 12 PHE H . . 4.150 3.883 1.945 4.226 0.076 4 0 "[ . 1 . 2]" 1
86 1 11 GLU QG 2 45 ASN QD . . 4.480 2.978 2.312 4.221 . 0 0 "[ . 1 . 2]" 1
87 1 12 PHE H 1 12 PHE HA . . 2.840 2.854 2.817 2.883 0.043 10 0 "[ . 1 . 2]" 1
88 1 12 PHE H 1 12 PHE HB2 . . 3.640 2.371 2.221 2.498 . 0 0 "[ . 1 . 2]" 1
89 1 12 PHE H 1 12 PHE QB . . 3.040 2.340 2.199 2.458 . 0 0 "[ . 1 . 2]" 1
90 1 12 PHE H 1 12 PHE HB3 . . 3.640 3.588 3.527 3.657 0.017 15 0 "[ . 1 . 2]" 1
91 1 12 PHE H 1 12 PHE QD . . 3.740 2.951 2.089 3.466 . 0 0 "[ . 1 . 2]" 1
92 1 12 PHE H 1 12 PHE QE . . 5.070 4.718 4.234 5.084 0.014 12 0 "[ . 1 . 2]" 1
93 1 12 PHE H 1 13 ALA H . . 3.350 2.732 2.611 2.816 . 0 0 "[ . 1 . 2]" 1
94 1 12 PHE H 1 13 ALA MB . . 4.460 4.391 4.307 4.485 0.025 18 0 "[ . 1 . 2]" 1
95 1 12 PHE H 2 49 PHE QE . . 4.890 3.689 3.218 4.309 . 0 0 "[ . 1 . 2]" 1
96 1 12 PHE HA 1 12 PHE QD . . 3.890 2.452 2.077 3.038 . 0 0 "[ . 1 . 2]" 1
97 1 12 PHE HA 1 12 PHE QE . . 4.980 4.350 4.150 4.507 . 0 0 "[ . 1 . 2]" 1
98 1 12 PHE HA 1 15 PHE H . . 3.680 3.330 2.996 3.512 . 0 0 "[ . 1 . 2]" 1
99 1 12 PHE HA 1 15 PHE HA . . 5.470 5.081 4.713 5.453 . 0 0 "[ . 1 . 2]" 1
100 1 12 PHE HA 1 15 PHE HB2 . . 4.150 3.164 2.560 3.521 . 0 0 "[ . 1 . 2]" 1
101 1 12 PHE HA 1 15 PHE QB . . 3.630 2.240 2.048 2.650 . 0 0 "[ . 1 . 2]" 1
102 1 12 PHE HA 1 15 PHE HB3 . . 4.150 2.295 2.123 2.740 . 0 0 "[ . 1 . 2]" 1
103 1 12 PHE HA 1 15 PHE QD . . 4.650 3.585 3.029 4.112 . 0 0 "[ . 1 . 2]" 1
104 1 12 PHE HA 1 16 TYR H . . 4.190 3.756 3.532 4.217 0.027 19 0 "[ . 1 . 2]" 1
105 1 12 PHE HA 1 16 TYR QD . . 4.630 4.143 3.714 4.704 0.074 5 0 "[ . 1 . 2]" 1
106 1 12 PHE HA 1 16 TYR QE . . 4.710 4.559 4.122 4.793 0.083 1 0 "[ . 1 . 2]" 1
107 1 12 PHE HA 2 49 PHE QD . . 5.500 5.271 4.884 5.578 0.078 20 0 "[ . 1 . 2]" 1
108 1 12 PHE HA 2 49 PHE QE . . 4.390 3.084 2.597 3.429 . 0 0 "[ . 1 . 2]" 1
109 1 12 PHE HA 2 49 PHE HZ . . 5.000 3.809 3.171 4.763 . 0 0 "[ . 1 . 2]" 1
110 1 12 PHE QB 1 13 ALA MB . . 4.420 4.038 3.908 4.177 . 0 0 "[ . 1 . 2]" 1
111 1 12 PHE QB 1 16 TYR QD . . 3.880 3.005 2.572 3.552 . 0 0 "[ . 1 . 2]" 1
112 1 12 PHE QB 1 16 TYR QE . . 3.910 2.889 2.177 3.600 . 0 0 "[ . 1 . 2]" 1
113 1 12 PHE HB2 1 13 ALA H . . 3.950 2.945 2.708 3.151 . 0 0 "[ . 1 . 2]" 1
114 1 12 PHE HB3 1 13 ALA H . . 3.950 3.675 3.364 3.901 . 0 0 "[ . 1 . 2]" 1
115 1 12 PHE QD 1 15 PHE QB . . 4.560 3.443 2.947 4.401 . 0 0 "[ . 1 . 2]" 1
116 1 12 PHE QD 1 15 PHE QD . . 4.330 3.185 2.600 4.408 0.078 19 0 "[ . 1 . 2]" 1
117 1 12 PHE QD 1 16 TYR QD . . 4.580 4.184 3.260 4.658 0.078 5 0 "[ . 1 . 2]" 1
118 1 12 PHE QD 1 16 TYR QE . . 4.010 3.357 2.462 4.083 0.073 12 0 "[ . 1 . 2]" 1
119 1 12 PHE QD 2 49 PHE QE . . 4.440 3.338 2.699 4.506 0.066 19 0 "[ . 1 . 2]" 1
120 1 12 PHE QD 2 53 LEU MD1 . . 4.870 4.618 4.038 4.959 0.089 14 0 "[ . 1 . 2]" 1
121 1 12 PHE QD 2 53 LEU MD2 . . 4.100 3.227 2.806 3.816 . 0 0 "[ . 1 . 2]" 1
122 1 12 PHE QD 2 56 LYS HE2 . . 5.500 4.001 2.383 5.327 . 0 0 "[ . 1 . 2]" 1
123 1 12 PHE QD 2 56 LYS HE3 . . 5.500 4.093 3.171 5.565 0.065 6 0 "[ . 1 . 2]" 1
124 1 12 PHE QE 2 49 PHE HA . . 5.240 4.458 3.587 5.169 . 0 0 "[ . 1 . 2]" 1
125 1 12 PHE QE 2 52 GLN HB2 . . 4.800 3.635 3.317 3.880 . 0 0 "[ . 1 . 2]" 1
126 1 12 PHE QE 2 52 GLN HB3 . . 4.590 3.452 3.186 3.868 . 0 0 "[ . 1 . 2]" 1
127 1 12 PHE QE 2 53 LEU H . . 4.520 4.174 3.837 4.499 . 0 0 "[ . 1 . 2]" 1
128 1 12 PHE QE 2 53 LEU HA . . 4.220 3.458 2.834 3.915 . 0 0 "[ . 1 . 2]" 1
129 1 12 PHE QE 2 53 LEU HB2 . . 4.960 4.736 4.547 5.020 0.060 6 0 "[ . 1 . 2]" 1
130 1 12 PHE QE 2 53 LEU MD1 . . 5.020 3.684 2.993 4.293 . 0 0 "[ . 1 . 2]" 1
131 1 12 PHE QE 2 53 LEU MD2 . . 3.500 2.342 2.100 2.942 . 0 0 "[ . 1 . 2]" 1
132 1 12 PHE QE 2 53 LEU HG . . 4.470 2.438 2.162 2.813 . 0 0 "[ . 1 . 2]" 1
133 1 12 PHE QE 2 56 LYS QD . . 4.990 2.792 2.169 3.848 . 0 0 "[ . 1 . 2]" 1
134 1 12 PHE QE 2 56 LYS HE2 . . 5.500 3.609 2.649 5.157 . 0 0 "[ . 1 . 2]" 1
135 1 12 PHE QE 2 56 LYS QE . . 4.740 3.220 2.517 4.744 0.004 19 0 "[ . 1 . 2]" 1
136 1 12 PHE QE 2 56 LYS HE3 . . 5.500 3.811 2.686 5.541 0.041 19 0 "[ . 1 . 2]" 1
137 1 12 PHE HZ 2 49 PHE HA . . 4.550 3.989 3.116 4.610 0.060 11 0 "[ . 1 . 2]" 1
138 1 12 PHE HZ 2 52 GLN H . . 5.040 4.835 4.332 5.100 0.060 4 0 "[ . 1 . 2]" 1
139 1 12 PHE HZ 2 52 GLN HA . . 4.810 4.632 4.433 4.872 0.062 14 0 "[ . 1 . 2]" 1
140 1 12 PHE HZ 2 52 GLN HB2 . . 4.020 2.390 2.063 2.667 . 0 0 "[ . 1 . 2]" 1
141 1 12 PHE HZ 2 52 GLN HB3 . . 3.880 2.413 2.203 2.773 . 0 0 "[ . 1 . 2]" 1
142 1 12 PHE HZ 2 52 GLN HG3 . . 4.850 4.270 3.661 4.890 0.040 4 0 "[ . 1 . 2]" 1
143 1 12 PHE HZ 2 53 LEU H . . 4.320 3.839 3.344 4.156 . 0 0 "[ . 1 . 2]" 1
144 1 12 PHE HZ 2 53 LEU HA . . 4.770 4.179 3.619 4.811 0.041 1 0 "[ . 1 . 2]" 1
145 1 12 PHE HZ 2 53 LEU HB2 . . 5.500 5.393 4.933 5.565 0.065 17 0 "[ . 1 . 2]" 1
146 1 12 PHE HZ 2 53 LEU MD2 . . 4.350 4.049 3.600 4.426 0.076 17 0 "[ . 1 . 2]" 1
147 1 12 PHE HZ 2 53 LEU HG . . 4.710 3.588 2.875 4.029 . 0 0 "[ . 1 . 2]" 1
148 1 12 PHE HZ 2 56 LYS HD2 . . 5.330 4.121 2.959 5.149 . 0 0 "[ . 1 . 2]" 1
149 1 12 PHE HZ 2 56 LYS QD . . 4.640 3.740 2.631 4.536 . 0 0 "[ . 1 . 2]" 1
150 1 12 PHE HZ 2 56 LYS HD3 . . 5.330 4.658 2.947 5.406 0.076 20 0 "[ . 1 . 2]" 1
151 1 13 ALA H 1 13 ALA MB . . 2.770 2.225 2.078 2.294 . 0 0 "[ . 1 . 2]" 1
152 1 13 ALA H 1 14 GLU HB2 . . 5.500 5.051 4.687 5.282 . 0 0 "[ . 1 . 2]" 1
153 1 13 ALA HA 1 16 TYR H . . 4.580 3.828 3.704 3.971 . 0 0 "[ . 1 . 2]" 1
154 1 13 ALA HA 1 16 TYR HB2 . . 5.050 3.314 3.180 3.464 . 0 0 "[ . 1 . 2]" 1
155 1 13 ALA HA 1 16 TYR QB . . 4.200 3.267 3.137 3.410 . 0 0 "[ . 1 . 2]" 1
156 1 13 ALA HA 1 16 TYR HB3 . . 5.050 4.954 4.760 5.095 0.045 7 0 "[ . 1 . 2]" 1
157 1 13 ALA HA 1 16 TYR QD . . 4.220 3.483 2.884 4.018 . 0 0 "[ . 1 . 2]" 1
158 1 13 ALA HA 1 17 ASN H . . 4.420 4.385 4.146 4.482 0.062 19 0 "[ . 1 . 2]" 1
159 1 13 ALA MB 1 14 GLU H . . 3.140 2.283 2.158 2.484 . 0 0 "[ . 1 . 2]" 1
160 1 13 ALA MB 1 14 GLU HA . . 4.400 3.809 3.695 3.893 . 0 0 "[ . 1 . 2]" 1
161 1 13 ALA MB 1 14 GLU HB2 . . 4.270 3.744 3.484 3.951 . 0 0 "[ . 1 . 2]" 1
162 1 13 ALA MB 1 14 GLU HB3 . . 4.260 4.327 4.284 4.351 0.091 6 0 "[ . 1 . 2]" 1
163 1 13 ALA MB 1 17 ASN H . . 4.900 4.835 4.564 4.971 0.071 10 0 "[ . 1 . 2]" 1
164 1 13 ALA MB 1 17 ASN HD21 . . 4.660 3.913 3.233 4.555 . 0 0 "[ . 1 . 2]" 1
165 1 13 ALA MB 1 17 ASN HD22 . . 4.660 3.842 3.079 4.727 0.067 1 0 "[ . 1 . 2]" 1
166 1 14 GLU H 1 14 GLU HB2 . . 3.240 2.440 2.231 2.701 . 0 0 "[ . 1 . 2]" 1
167 1 14 GLU H 1 14 GLU HB3 . . 3.640 2.432 2.275 2.571 . 0 0 "[ . 1 . 2]" 1
168 1 14 GLU H 1 14 GLU HG2 . . 4.770 4.535 4.440 4.627 . 0 0 "[ . 1 . 2]" 1
169 1 14 GLU H 1 14 GLU QG . . 4.120 3.983 3.915 4.049 . 0 0 "[ . 1 . 2]" 1
170 1 14 GLU H 1 14 GLU HG3 . . 4.770 4.414 4.280 4.494 . 0 0 "[ . 1 . 2]" 1
171 1 14 GLU H 1 15 PHE QB . . 4.990 4.398 4.154 4.621 . 0 0 "[ . 1 . 2]" 1
172 1 14 GLU HA 1 14 GLU HG2 . . 3.990 3.790 3.687 3.880 . 0 0 "[ . 1 . 2]" 1
173 1 14 GLU HA 1 14 GLU HG3 . . 3.990 3.102 2.775 3.348 . 0 0 "[ . 1 . 2]" 1
174 1 14 GLU HA 1 17 ASN H . . 3.930 3.302 3.047 3.503 . 0 0 "[ . 1 . 2]" 1
175 1 14 GLU HA 1 17 ASN HB2 . . 3.840 2.324 2.140 2.485 . 0 0 "[ . 1 . 2]" 1
176 1 14 GLU HA 1 17 ASN QB . . 3.250 2.304 2.118 2.459 . 0 0 "[ . 1 . 2]" 1
177 1 14 GLU HA 1 17 ASN HB3 . . 3.840 3.796 3.372 3.905 0.065 3 0 "[ . 1 . 2]" 1
178 1 14 GLU HA 1 17 ASN HD21 . . 4.630 2.691 2.009 3.350 . 0 0 "[ . 1 . 2]" 1
179 1 14 GLU HA 1 17 ASN QD . . 3.950 2.652 1.973 3.280 . 0 0 "[ . 1 . 2]" 1
180 1 14 GLU HA 1 17 ASN HD22 . . 4.630 4.043 2.882 4.676 0.046 2 0 "[ . 1 . 2]" 1
181 1 14 GLU HA 1 18 ARG H . . 4.860 3.995 3.766 4.299 . 0 0 "[ . 1 . 2]" 1
182 1 14 GLU HB2 2 41 PHE QE . . 4.610 4.152 3.817 4.496 . 0 0 "[ . 1 . 2]" 1
183 1 14 GLU HB2 2 41 PHE HZ . . 4.980 4.818 4.487 5.043 0.063 17 0 "[ . 1 . 2]" 1
184 1 14 GLU HB3 1 15 PHE H . . 3.860 2.658 2.350 2.982 . 0 0 "[ . 1 . 2]" 1
185 1 14 GLU HB3 2 41 PHE QE . . 4.110 2.603 2.266 2.950 . 0 0 "[ . 1 . 2]" 1
186 1 14 GLU HB3 2 41 PHE HZ . . 4.260 3.778 3.059 4.246 . 0 0 "[ . 1 . 2]" 1
187 1 14 GLU QG 1 15 PHE H . . 3.980 3.683 3.363 4.035 0.055 15 0 "[ . 1 . 2]" 1
188 1 14 GLU QG 1 18 ARG HG2 . . 5.340 3.081 2.444 3.784 . 0 0 "[ . 1 . 2]" 1
189 1 14 GLU QG 1 18 ARG HG3 . . 4.690 3.312 2.599 4.027 . 0 0 "[ . 1 . 2]" 1
190 1 14 GLU HG2 1 18 ARG HG3 . . 5.500 4.819 3.968 5.562 0.062 10 0 "[ . 1 . 2]" 1
191 1 14 GLU HG2 2 41 PHE QE . . 4.470 3.271 2.213 4.215 . 0 0 "[ . 1 . 2]" 1
192 1 14 GLU HG2 2 41 PHE HZ . . 3.990 3.047 2.198 3.729 . 0 0 "[ . 1 . 2]" 1
193 1 14 GLU HG3 1 18 ARG HG3 . . 5.500 3.376 2.635 4.132 . 0 0 "[ . 1 . 2]" 1
194 1 14 GLU HG3 2 41 PHE QE . . 4.470 2.935 2.253 3.591 . 0 0 "[ . 1 . 2]" 1
195 1 14 GLU HG3 2 41 PHE HZ . . 3.990 2.170 2.042 2.579 . 0 0 "[ . 1 . 2]" 1
196 1 15 PHE H 1 15 PHE HB2 . . 3.470 2.482 2.336 2.615 . 0 0 "[ . 1 . 2]" 1
197 1 15 PHE H 1 15 PHE HB3 . . 3.470 2.469 2.374 2.564 . 0 0 "[ . 1 . 2]" 1
198 1 15 PHE H 1 15 PHE QD . . 4.190 4.177 4.103 4.245 0.055 20 0 "[ . 1 . 2]" 1
199 1 15 PHE H 1 16 TYR H . . 3.730 2.899 2.749 3.036 . 0 0 "[ . 1 . 2]" 1
200 1 15 PHE H 2 41 PHE QD . . 5.490 4.459 3.980 5.257 . 0 0 "[ . 1 . 2]" 1
201 1 15 PHE H 2 41 PHE QE . . 4.110 3.106 2.517 4.181 0.071 17 0 "[ . 1 . 2]" 1
202 1 15 PHE H 2 41 PHE HZ . . 5.500 4.535 3.894 5.236 . 0 0 "[ . 1 . 2]" 1
203 1 15 PHE HA 1 15 PHE QD . . 3.800 2.502 2.222 2.718 . 0 0 "[ . 1 . 2]" 1
204 1 15 PHE HA 1 15 PHE QE . . 4.800 4.561 4.405 4.683 . 0 0 "[ . 1 . 2]" 1
205 1 15 PHE HA 1 18 ARG H . . 4.970 3.669 3.410 3.824 . 0 0 "[ . 1 . 2]" 1
206 1 15 PHE HA 1 18 ARG HB2 . . 4.890 3.035 2.693 3.375 . 0 0 "[ . 1 . 2]" 1
207 1 15 PHE HA 1 18 ARG HG3 . . 5.200 3.824 3.264 4.172 . 0 0 "[ . 1 . 2]" 1
208 1 15 PHE HA 2 37 LEU MD1 . . 4.540 3.668 3.078 4.016 . 0 0 "[ . 1 . 2]" 1
209 1 15 PHE HA 2 37 LEU MD2 . . 4.430 2.825 2.587 3.127 . 0 0 "[ . 1 . 2]" 1
210 1 15 PHE HA 2 41 PHE QD . . 4.780 4.193 3.694 4.858 0.078 17 0 "[ . 1 . 2]" 1
211 1 15 PHE HA 2 41 PHE QE . . 4.460 3.278 2.499 4.218 . 0 0 "[ . 1 . 2]" 1
212 1 15 PHE HA 2 41 PHE HZ . . 4.410 3.553 2.788 4.468 0.058 4 0 "[ . 1 . 2]" 1
213 1 15 PHE QB 1 16 TYR H . . 3.140 2.411 2.270 2.658 . 0 0 "[ . 1 . 2]" 1
214 1 15 PHE QB 1 19 LEU MD1 . . 5.080 4.109 3.626 4.431 . 0 0 "[ . 1 . 2]" 1
215 1 15 PHE QB 2 41 PHE QD . . 4.720 3.111 2.523 4.645 . 0 0 "[ . 1 . 2]" 1
216 1 15 PHE QB 2 49 PHE QE . . 5.020 3.357 2.975 3.812 . 0 0 "[ . 1 . 2]" 1
217 1 15 PHE QB 2 49 PHE HZ . . 4.440 2.507 2.237 2.884 . 0 0 "[ . 1 . 2]" 1
218 1 15 PHE QD 1 16 TYR H . . 4.290 3.445 3.130 3.857 . 0 0 "[ . 1 . 2]" 1
219 1 15 PHE QD 1 16 TYR HA . . 5.110 3.889 3.456 4.306 . 0 0 "[ . 1 . 2]" 1
220 1 15 PHE QD 1 16 TYR QD . . 4.440 3.688 3.074 4.251 . 0 0 "[ . 1 . 2]" 1
221 1 15 PHE QD 1 16 TYR QE . . 4.680 3.737 2.622 4.298 . 0 0 "[ . 1 . 2]" 1
222 1 15 PHE QD 1 18 ARG HB2 . . 5.500 4.320 3.633 4.702 . 0 0 "[ . 1 . 2]" 1
223 1 15 PHE QD 1 19 LEU HB2 . . 5.500 4.968 4.769 5.171 . 0 0 "[ . 1 . 2]" 1
224 1 15 PHE QD 1 19 LEU MD2 . . 5.010 4.930 4.657 5.098 0.088 15 0 "[ . 1 . 2]" 1
225 1 15 PHE QD 1 19 LEU HG . . 5.310 4.217 3.708 4.516 . 0 0 "[ . 1 . 2]" 1
226 1 15 PHE QD 2 37 LEU MD1 . . 4.230 3.456 2.557 4.121 . 0 0 "[ . 1 . 2]" 1
227 1 15 PHE QD 2 37 LEU MD2 . . 4.270 2.204 2.007 2.439 . 0 0 "[ . 1 . 2]" 1
228 1 15 PHE QD 2 37 LEU HG . . 5.190 4.841 4.313 5.158 . 0 0 "[ . 1 . 2]" 1
229 1 15 PHE QD 2 38 THR HA . . 4.220 3.792 3.549 4.070 . 0 0 "[ . 1 . 2]" 1
230 1 15 PHE QD 2 38 THR MG . . 5.170 4.489 4.269 4.906 . 0 0 "[ . 1 . 2]" 1
231 1 15 PHE QD 2 41 PHE H . . 5.290 5.127 4.841 5.374 0.084 20 0 "[ . 1 . 2]" 1
232 1 15 PHE QD 2 41 PHE QB . . 4.490 3.421 2.977 4.110 . 0 0 "[ . 1 . 2]" 1
233 1 15 PHE QD 2 41 PHE QD . . 4.810 3.483 2.698 4.272 . 0 0 "[ . 1 . 2]" 1
234 1 15 PHE QD 2 41 PHE QE . . 4.480 3.917 3.335 4.505 0.025 17 0 "[ . 1 . 2]" 1
235 1 15 PHE QD 2 53 LEU MD1 . . 4.720 3.772 3.330 3.955 . 0 0 "[ . 1 . 2]" 1
236 1 15 PHE QD 2 53 LEU MD2 . . 4.190 3.093 2.519 3.615 . 0 0 "[ . 1 . 2]" 1
237 1 15 PHE QE 1 19 LEU HB2 . . 5.500 5.270 5.088 5.553 0.053 16 0 "[ . 1 . 2]" 1
238 1 15 PHE QE 1 19 LEU MD1 . . 4.130 2.460 2.294 2.660 . 0 0 "[ . 1 . 2]" 1
239 1 15 PHE QE 1 19 LEU MD2 . . 4.230 3.938 3.489 4.120 . 0 0 "[ . 1 . 2]" 1
240 1 15 PHE QE 1 19 LEU HG . . 5.120 3.842 3.175 4.281 . 0 0 "[ . 1 . 2]" 1
241 1 15 PHE QE 2 37 LEU HB3 . . 5.130 3.780 3.102 4.356 . 0 0 "[ . 1 . 2]" 1
242 1 15 PHE QE 2 37 LEU MD1 . . 4.010 3.117 2.171 4.040 0.030 9 0 "[ . 1 . 2]" 1
243 1 15 PHE QE 2 37 LEU MD2 . . 4.450 2.351 2.164 2.727 . 0 0 "[ . 1 . 2]" 1
244 1 15 PHE QE 2 37 LEU HG . . 5.120 5.028 4.462 5.201 0.081 14 0 "[ . 1 . 2]" 1
245 1 15 PHE QE 2 38 THR H . . 4.210 3.503 3.083 3.876 . 0 0 "[ . 1 . 2]" 1
246 1 15 PHE QE 2 38 THR HA . . 3.560 2.351 2.016 3.002 . 0 0 "[ . 1 . 2]" 1
247 1 15 PHE QE 2 38 THR MG . . 3.430 2.972 2.561 3.534 0.104 3 0 "[ . 1 . 2]" 1
248 1 15 PHE QE 2 41 PHE QB . . 4.720 3.941 3.130 4.807 0.087 3 0 "[ . 1 . 2]" 1
249 1 15 PHE QE 2 53 LEU MD1 . . 4.050 3.039 2.726 3.303 . 0 0 "[ . 1 . 2]" 1
250 1 15 PHE QE 2 53 LEU MD2 . . 3.530 2.335 2.155 2.626 . 0 0 "[ . 1 . 2]" 1
251 1 15 PHE QE 2 63 PHE HZ . . 4.360 2.787 2.193 3.466 . 0 0 "[ . 1 . 2]" 1
252 1 15 PHE HZ 1 19 LEU MD1 . . 3.840 2.944 2.502 3.536 . 0 0 "[ . 1 . 2]" 1
253 1 15 PHE HZ 1 19 LEU MD2 . . 4.050 3.791 3.168 4.126 0.076 16 0 "[ . 1 . 2]" 1
254 1 15 PHE HZ 2 34 VAL MG1 . . 4.750 4.153 3.399 4.641 . 0 0 "[ . 1 . 2]" 1
255 1 15 PHE HZ 2 38 THR HA . . 4.550 4.115 3.574 4.473 . 0 0 "[ . 1 . 2]" 1
256 1 15 PHE HZ 2 38 THR MG . . 3.620 3.044 2.626 3.516 . 0 0 "[ . 1 . 2]" 1
257 1 15 PHE HZ 2 53 LEU MD1 . . 4.120 2.956 2.425 3.623 . 0 0 "[ . 1 . 2]" 1
258 1 15 PHE HZ 2 53 LEU MD2 . . 4.620 3.428 3.018 4.088 . 0 0 "[ . 1 . 2]" 1
259 1 15 PHE HZ 2 63 PHE HZ . . 3.820 3.419 3.006 3.839 0.019 16 0 "[ . 1 . 2]" 1
260 1 16 TYR H 1 16 TYR HB2 . . 3.880 2.368 2.284 2.544 . 0 0 "[ . 1 . 2]" 1
261 1 16 TYR H 1 16 TYR QB . . 3.360 2.337 2.258 2.494 . 0 0 "[ . 1 . 2]" 1
262 1 16 TYR H 1 16 TYR HB3 . . 3.880 3.580 3.549 3.617 . 0 0 "[ . 1 . 2]" 1
263 1 16 TYR H 1 16 TYR QD . . 3.750 3.143 3.033 3.330 . 0 0 "[ . 1 . 2]" 1
264 1 16 TYR H 1 16 TYR QE . . 4.840 4.794 4.421 4.910 0.070 14 0 "[ . 1 . 2]" 1
265 1 16 TYR H 1 17 ASN H . . 3.510 2.759 2.705 2.818 . 0 0 "[ . 1 . 2]" 1
266 1 16 TYR H 1 19 LEU MD1 . . 4.880 4.108 3.921 4.363 . 0 0 "[ . 1 . 2]" 1
267 1 16 TYR HA 1 16 TYR QD . . 3.390 2.257 2.139 2.493 . 0 0 "[ . 1 . 2]" 1
268 1 16 TYR HA 1 16 TYR QE . . 4.390 4.313 4.211 4.427 0.037 5 0 "[ . 1 . 2]" 1
269 1 16 TYR HA 1 19 LEU H . . 3.760 3.179 3.005 3.289 . 0 0 "[ . 1 . 2]" 1
270 1 16 TYR HA 1 19 LEU HB2 . . 3.590 2.140 2.050 2.273 . 0 0 "[ . 1 . 2]" 1
271 1 16 TYR HA 1 19 LEU HB3 . . 4.370 3.688 3.557 3.802 . 0 0 "[ . 1 . 2]" 1
272 1 16 TYR HA 1 19 LEU MD1 . . 3.590 2.352 2.214 2.524 . 0 0 "[ . 1 . 2]" 1
273 1 16 TYR HA 1 19 LEU MD2 . . 4.550 4.600 4.554 4.633 0.083 17 0 "[ . 1 . 2]" 1
274 1 16 TYR HA 1 19 LEU HG . . 4.910 3.850 3.588 4.245 . 0 0 "[ . 1 . 2]" 1
275 1 16 TYR HA 1 20 LYS H . . 4.770 3.883 3.594 4.370 . 0 0 "[ . 1 . 2]" 1
276 1 16 TYR QB 1 17 ASN H . . 3.570 3.011 2.864 3.194 . 0 0 "[ . 1 . 2]" 1
277 1 16 TYR QB 1 19 LEU H . . 5.340 4.796 4.656 4.923 . 0 0 "[ . 1 . 2]" 1
278 1 16 TYR QB 1 19 LEU MD1 . . 5.310 3.962 3.882 4.086 . 0 0 "[ . 1 . 2]" 1
279 1 16 TYR QD 1 17 ASN H . . 4.840 4.767 4.550 4.904 0.064 6 0 "[ . 1 . 2]" 1
280 1 16 TYR QD 1 19 LEU H . . 4.970 4.981 4.797 5.037 0.067 11 0 "[ . 1 . 2]" 1
281 1 16 TYR QD 1 19 LEU HB2 . . 4.440 3.177 2.869 3.368 . 0 0 "[ . 1 . 2]" 1
282 1 16 TYR QD 1 19 LEU HB3 . . 4.880 3.851 3.523 4.337 . 0 0 "[ . 1 . 2]" 1
283 1 16 TYR QD 1 19 LEU MD1 . . 3.420 2.356 2.129 2.665 . 0 0 "[ . 1 . 2]" 1
284 1 16 TYR QD 1 19 LEU MD2 . . 4.470 4.524 4.420 4.564 0.094 1 0 "[ . 1 . 2]" 1
285 1 16 TYR QD 1 19 LEU HG . . 4.970 4.731 4.516 5.022 0.052 19 0 "[ . 1 . 2]" 1
286 1 16 TYR QE 1 19 LEU MD1 . . 3.770 2.951 2.510 3.240 . 0 0 "[ . 1 . 2]" 1
287 1 16 TYR QE 1 19 LEU MD2 . . 5.130 4.997 4.301 5.235 0.105 5 0 "[ . 1 . 2]" 1
288 1 16 TYR QE 2 53 LEU MD2 . . 4.270 4.048 3.498 4.373 0.103 8 0 "[ . 1 . 2]" 1
289 1 16 TYR QE 2 56 LYS HD2 . . 4.920 4.505 3.122 5.009 0.089 17 0 "[ . 1 . 2]" 1
290 1 16 TYR QE 2 56 LYS HD3 . . 4.920 4.333 3.467 4.884 . 0 0 "[ . 1 . 2]" 1
291 1 16 TYR QE 2 56 LYS HE2 . . 5.500 4.177 2.554 5.555 0.055 9 0 "[ . 1 . 2]" 1
292 1 16 TYR QE 2 56 LYS HE3 . . 5.500 4.001 2.287 5.517 0.017 12 0 "[ . 1 . 2]" 1
293 1 16 TYR QE 2 63 PHE HZ . . 4.460 3.956 2.918 4.519 0.059 19 0 "[ . 1 . 2]" 1
294 1 17 ASN H 1 17 ASN HB2 . . 3.410 2.252 2.115 2.407 . 0 0 "[ . 1 . 2]" 1
295 1 17 ASN H 1 17 ASN QB . . 2.930 2.224 2.094 2.366 . 0 0 "[ . 1 . 2]" 1
296 1 17 ASN H 1 17 ASN HB3 . . 3.410 3.460 3.321 3.492 0.082 6 0 "[ . 1 . 2]" 1
297 1 17 ASN H 1 17 ASN HD21 . . 4.980 3.745 2.456 4.296 . 0 0 "[ . 1 . 2]" 1
298 1 17 ASN H 1 17 ASN QD . . 4.350 3.558 2.436 4.070 . 0 0 "[ . 1 . 2]" 1
299 1 17 ASN H 1 17 ASN HD22 . . 4.980 4.594 4.068 5.042 0.062 13 0 "[ . 1 . 2]" 1
300 1 17 ASN H 1 18 ARG HB2 . . 5.090 4.701 4.581 5.013 . 0 0 "[ . 1 . 2]" 1
301 1 17 ASN HA 1 20 LYS H . . 4.550 3.628 3.274 4.113 . 0 0 "[ . 1 . 2]" 1
302 1 17 ASN HA 1 20 LYS QB . . 3.950 2.854 2.535 3.345 . 0 0 "[ . 1 . 2]" 1
303 1 17 ASN HA 1 20 LYS QD . . 4.100 3.762 3.214 4.147 0.047 5 0 "[ . 1 . 2]" 1
304 1 17 ASN QB 1 18 ARG H . . 3.490 2.494 2.221 2.776 . 0 0 "[ . 1 . 2]" 1
305 1 17 ASN QB 1 18 ARG HA . . 4.610 3.900 3.731 4.024 . 0 0 "[ . 1 . 2]" 1
306 1 17 ASN QB 1 18 ARG HB2 . . 5.340 4.556 4.296 4.797 . 0 0 "[ . 1 . 2]" 1
307 1 17 ASN QB 1 18 ARG HG2 . . 4.810 3.383 2.927 3.729 . 0 0 "[ . 1 . 2]" 1
308 1 17 ASN QB 1 18 ARG HG3 . . 5.340 4.836 4.163 5.207 . 0 0 "[ . 1 . 2]" 1
309 1 17 ASN QB 1 19 LEU H . . 5.340 4.657 4.458 4.832 . 0 0 "[ . 1 . 2]" 1
310 1 17 ASN HB2 1 17 ASN HD22 . . 4.060 3.576 3.478 3.651 . 0 0 "[ . 1 . 2]" 1
311 1 17 ASN HB2 1 18 ARG H . . 4.030 2.647 2.261 2.948 . 0 0 "[ . 1 . 2]" 1
312 1 17 ASN HB3 1 17 ASN HD22 . . 4.060 3.846 3.643 4.121 0.061 2 0 "[ . 1 . 2]" 1
313 1 17 ASN HB3 1 18 ARG H . . 4.030 3.172 2.683 3.497 . 0 0 "[ . 1 . 2]" 1
314 1 18 ARG H 1 18 ARG HB2 . . 3.510 2.425 2.303 2.585 . 0 0 "[ . 1 . 2]" 1
315 1 18 ARG H 1 18 ARG HB3 . . 3.860 3.597 3.564 3.634 . 0 0 "[ . 1 . 2]" 1
316 1 18 ARG H 1 18 ARG HD2 . . 5.310 4.473 3.916 5.044 . 0 0 "[ . 1 . 2]" 1
317 1 18 ARG H 1 18 ARG QD . . 4.620 3.826 3.359 4.411 . 0 0 "[ . 1 . 2]" 1
318 1 18 ARG H 1 18 ARG HD3 . . 5.310 4.325 3.463 4.896 . 0 0 "[ . 1 . 2]" 1
319 1 18 ARG H 1 18 ARG HG2 . . 3.980 2.374 2.043 2.830 . 0 0 "[ . 1 . 2]" 1
320 1 18 ARG H 1 18 ARG HG3 . . 3.800 3.558 3.067 3.751 . 0 0 "[ . 1 . 2]" 1
321 1 18 ARG H 1 19 LEU H . . 3.600 2.749 2.618 2.888 . 0 0 "[ . 1 . 2]" 1
322 1 18 ARG H 2 37 LEU MD1 . . 4.590 4.118 3.809 4.307 . 0 0 "[ . 1 . 2]" 1
323 1 18 ARG H 2 37 LEU MD2 . . 4.760 4.539 4.311 4.809 0.049 11 0 "[ . 1 . 2]" 1
324 1 18 ARG HA 1 18 ARG QD . . 3.420 2.353 2.023 3.471 0.051 12 0 "[ . 1 . 2]" 1
325 1 18 ARG HA 1 18 ARG HG2 . . 3.350 2.983 2.459 3.205 . 0 0 "[ . 1 . 2]" 1
326 1 18 ARG HA 1 20 LYS H . . 4.830 4.461 3.831 4.764 . 0 0 "[ . 1 . 2]" 1
327 1 18 ARG HA 1 20 LYS QB . . 5.020 4.915 4.528 5.073 0.053 3 0 "[ . 1 . 2]" 1
328 1 18 ARG HA 1 21 GLN H . . 4.150 3.391 3.072 3.796 . 0 0 "[ . 1 . 2]" 1
329 1 18 ARG HA 1 21 GLN HB2 . . 3.970 2.939 2.425 4.053 0.083 15 0 "[ . 1 . 2]" 1
330 1 18 ARG HA 1 21 GLN QB . . 3.420 2.577 2.406 2.859 . 0 0 "[ . 1 . 2]" 1
331 1 18 ARG HA 1 21 GLN HB3 . . 3.970 3.493 2.460 4.035 0.065 19 0 "[ . 1 . 2]" 1
332 1 18 ARG HA 1 21 GLN QE . . 5.340 4.634 3.101 5.413 0.073 8 0 "[ . 1 . 2]" 1
333 1 18 ARG HA 1 21 GLN QG . . 4.000 3.374 2.171 4.080 0.080 9 0 "[ . 1 . 2]" 1
334 1 18 ARG HA 1 22 ILE H . . 4.730 4.319 3.707 4.540 . 0 0 "[ . 1 . 2]" 1
335 1 18 ARG HA 1 22 ILE MD . . 5.050 4.794 4.010 5.112 0.062 11 0 "[ . 1 . 2]" 1
336 1 18 ARG HA 2 37 LEU MD1 . . 4.520 4.060 3.596 4.348 . 0 0 "[ . 1 . 2]" 1
337 1 18 ARG HA 2 37 LEU MD2 . . 5.190 5.076 4.830 5.261 0.071 9 0 "[ . 1 . 2]" 1
338 1 18 ARG HB2 1 19 LEU H . . 3.880 2.669 2.506 2.941 . 0 0 "[ . 1 . 2]" 1
339 1 18 ARG HB2 2 37 LEU MD1 . . 3.390 2.216 2.073 2.361 . 0 0 "[ . 1 . 2]" 1
340 1 18 ARG HB2 2 37 LEU MD2 . . 3.500 2.555 2.258 2.805 . 0 0 "[ . 1 . 2]" 1
341 1 18 ARG HB3 1 18 ARG QD . . 3.670 2.580 2.177 3.159 . 0 0 "[ . 1 . 2]" 1
342 1 18 ARG HB3 1 19 LEU H . . 4.560 3.619 3.416 3.939 . 0 0 "[ . 1 . 2]" 1
343 1 18 ARG HB3 2 37 LEU MD1 . . 4.230 2.402 2.090 3.034 . 0 0 "[ . 1 . 2]" 1
344 1 18 ARG HB3 2 37 LEU MD2 . . 3.920 3.095 2.682 3.399 . 0 0 "[ . 1 . 2]" 1
345 1 18 ARG QD 1 19 LEU H . . 5.340 5.102 4.866 5.325 . 0 0 "[ . 1 . 2]" 1
346 1 18 ARG QD 1 21 GLN QB . . 4.780 3.871 3.395 4.865 0.085 12 0 "[ . 1 . 2]" 1
347 1 18 ARG QD 2 37 LEU MD2 . . 4.740 4.201 2.908 4.822 0.082 8 0 "[ . 1 . 2]" 1
348 1 18 ARG QD 2 41 PHE QE . . 4.450 4.093 3.034 4.520 0.070 8 0 "[ . 1 . 2]" 1
349 1 18 ARG QD 2 41 PHE HZ . . 4.220 4.181 3.839 4.303 0.083 10 0 "[ . 1 . 2]" 1
350 1 18 ARG HD2 2 37 LEU MD1 . . 5.500 4.708 3.981 5.333 . 0 0 "[ . 1 . 2]" 1
351 1 18 ARG HD2 2 37 LEU MD2 . . 5.500 4.649 2.972 5.521 0.021 8 0 "[ . 1 . 2]" 1
352 1 18 ARG HD3 2 37 LEU MD1 . . 5.500 5.014 4.051 5.569 0.069 4 0 "[ . 1 . 2]" 1
353 1 18 ARG HD3 2 37 LEU MD2 . . 5.500 4.920 3.118 5.549 0.049 9 0 "[ . 1 . 2]" 1
354 1 18 ARG HG2 1 19 LEU H . . 5.500 4.509 4.319 4.788 . 0 0 "[ . 1 . 2]" 1
355 1 18 ARG HG2 2 37 LEU MD2 . . 4.220 4.124 3.840 4.304 0.084 18 0 "[ . 1 . 2]" 1
356 1 18 ARG HG2 2 41 PHE HZ . . 4.720 3.460 2.624 4.764 0.044 18 0 "[ . 1 . 2]" 1
357 1 18 ARG HG3 1 19 LEU H . . 5.260 4.935 4.647 5.170 . 0 0 "[ . 1 . 2]" 1
358 1 18 ARG HG3 2 37 LEU MD1 . . 4.510 3.832 3.592 4.300 . 0 0 "[ . 1 . 2]" 1
359 1 18 ARG HG3 2 37 LEU MD2 . . 4.060 2.980 2.519 3.425 . 0 0 "[ . 1 . 2]" 1
360 1 18 ARG HG3 2 41 PHE QE . . 4.980 2.903 2.407 3.519 . 0 0 "[ . 1 . 2]" 1
361 1 18 ARG HG3 2 41 PHE HZ . . 4.630 2.652 2.192 3.288 . 0 0 "[ . 1 . 2]" 1
362 1 19 LEU H 1 19 LEU HB2 . . 3.410 2.280 2.193 2.355 . 0 0 "[ . 1 . 2]" 1
363 1 19 LEU H 1 19 LEU HB3 . . 3.680 3.572 3.507 3.614 . 0 0 "[ . 1 . 2]" 1
364 1 19 LEU H 1 19 LEU MD1 . . 4.200 3.583 3.309 3.763 . 0 0 "[ . 1 . 2]" 1
365 1 19 LEU H 1 19 LEU MD2 . . 4.260 4.055 3.909 4.198 . 0 0 "[ . 1 . 2]" 1
366 1 19 LEU H 1 19 LEU HG . . 4.230 2.934 2.701 3.106 . 0 0 "[ . 1 . 2]" 1
367 1 19 LEU H 1 20 LYS H . . 3.610 2.820 2.687 2.975 . 0 0 "[ . 1 . 2]" 1
368 1 19 LEU H 1 20 LYS HB2 . . 5.500 5.171 4.773 5.482 . 0 0 "[ . 1 . 2]" 1
369 1 19 LEU H 1 20 LYS HB3 . . 5.500 4.950 4.719 5.248 . 0 0 "[ . 1 . 2]" 1
370 1 19 LEU H 1 21 GLN H . . 4.690 4.343 4.095 4.498 . 0 0 "[ . 1 . 2]" 1
371 1 19 LEU H 1 22 ILE MD . . 4.810 4.463 4.226 4.761 . 0 0 "[ . 1 . 2]" 1
372 1 19 LEU H 2 37 LEU MD1 . . 3.930 2.805 2.610 3.120 . 0 0 "[ . 1 . 2]" 1
373 1 19 LEU H 2 37 LEU MD2 . . 4.540 4.252 3.822 4.597 0.057 11 0 "[ . 1 . 2]" 1
374 1 19 LEU HA 1 19 LEU MD1 . . 4.400 3.836 3.770 3.878 . 0 0 "[ . 1 . 2]" 1
375 1 19 LEU HA 1 19 LEU MD2 . . 3.120 2.195 2.095 2.483 . 0 0 "[ . 1 . 2]" 1
376 1 19 LEU HA 1 19 LEU HG . . 4.250 2.637 2.420 2.770 . 0 0 "[ . 1 . 2]" 1
377 1 19 LEU HA 1 22 ILE H . . 4.350 3.616 3.392 3.873 . 0 0 "[ . 1 . 2]" 1
378 1 19 LEU HA 1 22 ILE HB . . 3.800 3.228 3.003 3.599 . 0 0 "[ . 1 . 2]" 1
379 1 19 LEU HA 1 22 ILE MD . . 3.480 2.504 2.234 2.892 . 0 0 "[ . 1 . 2]" 1
380 1 19 LEU HA 1 22 ILE HG12 . . 5.500 5.015 4.641 5.556 0.056 15 0 "[ . 1 . 2]" 1
381 1 19 LEU HA 1 22 ILE HG13 . . 4.650 3.702 3.125 4.565 . 0 0 "[ . 1 . 2]" 1
382 1 19 LEU HA 1 22 ILE MG . . 4.910 4.540 4.263 4.864 . 0 0 "[ . 1 . 2]" 1
383 1 19 LEU HA 2 34 VAL MG2 . . 4.970 3.887 3.497 4.295 . 0 0 "[ . 1 . 2]" 1
384 1 19 LEU HA 2 37 LEU MD1 . . 3.760 2.692 2.444 2.962 . 0 0 "[ . 1 . 2]" 1
385 1 19 LEU HB2 1 19 LEU MD1 . . 3.500 2.284 2.236 2.318 . 0 0 "[ . 1 . 2]" 1
386 1 19 LEU HB2 1 19 LEU MD2 . . 3.560 3.194 3.154 3.225 . 0 0 "[ . 1 . 2]" 1
387 1 19 LEU HB2 1 20 LYS H . . 3.600 2.704 2.416 3.290 . 0 0 "[ . 1 . 2]" 1
388 1 19 LEU HB2 2 37 LEU MD1 . . 4.490 3.946 3.767 4.320 . 0 0 "[ . 1 . 2]" 1
389 1 19 LEU HB3 1 19 LEU MD2 . . 2.830 2.254 2.188 2.325 . 0 0 "[ . 1 . 2]" 1
390 1 19 LEU HB3 1 20 LYS H . . 3.920 3.188 2.876 3.712 . 0 0 "[ . 1 . 2]" 1
391 1 19 LEU HB3 1 20 LYS HA . . 4.780 4.020 3.717 4.257 . 0 0 "[ . 1 . 2]" 1
392 1 19 LEU HB3 2 37 LEU MD1 . . 4.920 4.391 4.130 4.755 . 0 0 "[ . 1 . 2]" 1
393 1 19 LEU MD1 2 34 VAL MG1 . . 4.070 3.970 3.598 4.148 0.078 14 0 "[ . 1 . 2]" 1
394 1 19 LEU MD1 2 53 LEU MD2 . . 4.460 4.022 3.852 4.200 . 0 0 "[ . 1 . 2]" 1
395 1 19 LEU MD1 2 63 PHE QE . . 4.270 3.359 3.029 3.860 . 0 0 "[ . 1 . 2]" 1
396 1 19 LEU MD1 2 63 PHE HZ . . 3.520 2.368 2.099 2.885 . 0 0 "[ . 1 . 2]" 1
397 1 19 LEU MD2 1 20 LYS H . . 4.950 4.649 4.478 4.877 . 0 0 "[ . 1 . 2]" 1
398 1 19 LEU MD2 1 22 ILE HB . . 4.310 3.736 3.322 4.098 . 0 0 "[ . 1 . 2]" 1
399 1 19 LEU MD2 1 22 ILE MG . . 4.690 4.206 3.744 4.741 0.051 5 0 "[ . 1 . 2]" 1
400 1 19 LEU MD2 1 23 LYS QE . . 4.650 2.959 1.964 4.721 0.071 10 0 "[ . 1 . 2]" 1
401 1 19 LEU MD2 2 30 PHE HE1 . . 4.300 3.817 3.337 4.070 . 0 0 "[ . 1 . 2]" 1
402 1 19 LEU MD2 2 30 PHE HZ . . 4.770 4.831 4.404 4.870 0.100 6 0 "[ . 1 . 2]" 1
403 1 19 LEU MD2 2 34 VAL HA . . 3.880 3.486 3.064 3.843 . 0 0 "[ . 1 . 2]" 1
404 1 19 LEU MD2 2 34 VAL MG1 . . 3.150 2.413 2.155 2.689 . 0 0 "[ . 1 . 2]" 1
405 1 19 LEU MD2 2 34 VAL MG2 . . 3.080 2.253 1.999 2.473 . 0 0 "[ . 1 . 2]" 1
406 1 19 LEU MD2 2 37 LEU HB3 . . 4.810 4.402 3.794 4.767 . 0 0 "[ . 1 . 2]" 1
407 1 19 LEU MD2 2 37 LEU MD1 . . 3.370 2.838 2.322 3.364 . 0 0 "[ . 1 . 2]" 1
408 1 19 LEU MD2 2 38 THR H . . 5.500 5.331 4.698 5.561 0.061 19 0 "[ . 1 . 2]" 1
409 1 19 LEU MD2 2 63 PHE QE . . 4.450 3.852 3.395 4.220 . 0 0 "[ . 1 . 2]" 1
410 1 19 LEU MD2 2 63 PHE HZ . . 3.580 3.393 2.636 3.664 0.084 3 0 "[ . 1 . 2]" 1
411 1 19 LEU HG 1 20 LYS H . . 5.020 4.784 4.653 5.059 0.039 15 0 "[ . 1 . 2]" 1
412 1 19 LEU HG 2 34 VAL MG1 . . 5.080 4.363 3.790 4.892 . 0 0 "[ . 1 . 2]" 1
413 1 19 LEU HG 2 37 LEU MD1 . . 4.650 2.326 2.109 2.864 . 0 0 "[ . 1 . 2]" 1
414 1 19 LEU HG 2 63 PHE HZ . . 5.500 4.846 4.263 5.429 . 0 0 "[ . 1 . 2]" 1
415 1 20 LYS H 1 20 LYS HB2 . . 3.620 2.509 2.274 2.690 . 0 0 "[ . 1 . 2]" 1
416 1 20 LYS H 1 20 LYS QB . . 2.960 2.217 2.094 2.310 . 0 0 "[ . 1 . 2]" 1
417 1 20 LYS H 1 20 LYS HB3 . . 3.620 2.514 2.185 2.814 . 0 0 "[ . 1 . 2]" 1
418 1 20 LYS H 1 20 LYS QD . . 4.690 4.490 4.197 4.749 0.059 6 0 "[ . 1 . 2]" 1
419 1 20 LYS H 1 20 LYS HG2 . . 4.590 4.462 4.234 4.597 0.007 20 0 "[ . 1 . 2]" 1
420 1 20 LYS H 1 20 LYS HG3 . . 4.590 4.463 4.225 4.613 0.023 4 0 "[ . 1 . 2]" 1
421 1 20 LYS H 1 21 GLN H . . 3.580 2.827 2.298 3.050 . 0 0 "[ . 1 . 2]" 1
422 1 20 LYS H 1 21 GLN QB . . 4.550 4.392 3.794 4.619 0.069 6 0 "[ . 1 . 2]" 1
423 1 20 LYS H 1 22 ILE MD . . 5.410 5.404 5.113 5.486 0.076 20 0 "[ . 1 . 2]" 1
424 1 20 LYS HA 1 20 LYS HD2 . . 5.420 4.541 4.221 5.034 . 0 0 "[ . 1 . 2]" 1
425 1 20 LYS HA 1 20 LYS QD . . 4.570 4.118 3.912 4.366 . 0 0 "[ . 1 . 2]" 1
426 1 20 LYS HA 1 20 LYS HD3 . . 5.420 4.739 4.249 5.056 . 0 0 "[ . 1 . 2]" 1
427 1 20 LYS HA 1 20 LYS HE2 . . 5.500 4.950 4.102 5.500 . 0 0 "[ . 1 . 2]" 1
428 1 20 LYS HA 1 20 LYS HE3 . . 5.500 4.880 3.650 5.567 0.067 1 0 "[ . 1 . 2]" 1
429 1 20 LYS HA 1 20 LYS HG2 . . 3.820 3.141 2.859 3.579 . 0 0 "[ . 1 . 2]" 1
430 1 20 LYS HA 1 20 LYS HG3 . . 3.820 2.615 2.390 3.077 . 0 0 "[ . 1 . 2]" 1
431 1 20 LYS HA 1 22 ILE H . . 4.780 4.654 4.423 4.835 0.055 1 0 "[ . 1 . 2]" 1
432 1 20 LYS HA 1 23 LYS H . . 4.120 3.579 3.364 3.775 . 0 0 "[ . 1 . 2]" 1
433 1 20 LYS HA 1 23 LYS QB . . 3.710 2.948 2.316 3.762 0.052 18 0 "[ . 1 . 2]" 1
434 1 20 LYS HA 1 23 LYS QD . . 3.690 3.289 2.437 3.761 0.071 9 0 "[ . 1 . 2]" 1
435 1 20 LYS HA 1 24 GLU H . . 5.290 4.048 3.523 4.808 . 0 0 "[ . 1 . 2]" 1
436 1 20 LYS QB 1 20 LYS QD . . 3.180 2.221 2.050 2.384 . 0 0 "[ . 1 . 2]" 1
437 1 20 LYS QB 1 20 LYS QE . . 4.550 2.815 1.985 3.567 . 0 0 "[ . 1 . 2]" 1
438 1 20 LYS QB 1 21 GLN H . . 3.430 2.570 2.300 3.003 . 0 0 "[ . 1 . 2]" 1
439 1 20 LYS QE 1 20 LYS QG . . 3.190 2.227 2.045 2.681 . 0 0 "[ . 1 . 2]" 1
440 1 20 LYS QG 1 21 GLN H . . 4.880 3.592 3.301 3.965 . 0 0 "[ . 1 . 2]" 1
441 1 20 LYS QG 1 24 GLU HG2 . . 4.630 3.163 2.517 4.283 . 0 0 "[ . 1 . 2]" 1
442 1 20 LYS HG2 1 24 GLU HG3 . . 4.830 2.740 2.169 4.470 . 0 0 "[ . 1 . 2]" 1
443 1 20 LYS HG3 1 24 GLU HG3 . . 4.830 3.643 2.790 4.880 0.050 13 0 "[ . 1 . 2]" 1
444 1 21 GLN H 1 21 GLN HB2 . . 3.660 2.304 1.879 3.376 . 0 0 "[ . 1 . 2]" 1
445 1 21 GLN H 1 21 GLN HB3 . . 3.660 2.962 1.868 3.562 . 0 0 "[ . 1 . 2]" 1
446 1 21 GLN H 1 21 GLN HG2 . . 3.950 3.396 2.259 4.010 0.060 5 0 "[ . 1 . 2]" 1
447 1 21 GLN H 1 21 GLN QG . . 3.460 3.108 2.219 3.546 0.086 5 0 "[ . 1 . 2]" 1
448 1 21 GLN H 1 21 GLN HG3 . . 3.950 3.792 3.089 4.032 0.082 3 0 "[ . 1 . 2]" 1
449 1 21 GLN H 1 22 ILE H . . 3.650 2.948 2.620 3.085 . 0 0 "[ . 1 . 2]" 1
450 1 21 GLN H 1 23 LYS H . . 5.040 4.386 4.229 4.637 . 0 0 "[ . 1 . 2]" 1
451 1 21 GLN HA 1 21 GLN HG2 . . 3.830 2.675 2.176 3.896 0.066 13 0 "[ . 1 . 2]" 1
452 1 21 GLN HA 1 21 GLN QG . . 3.230 2.507 2.134 3.263 0.033 15 0 "[ . 1 . 2]" 1
453 1 21 GLN HA 1 21 GLN HG3 . . 3.830 3.463 2.688 3.772 . 0 0 "[ . 1 . 2]" 1
454 1 21 GLN HA 1 22 ILE HG13 . . 5.500 5.368 5.097 5.510 0.010 16 0 "[ . 1 . 2]" 1
455 1 21 GLN HA 1 23 LYS H . . 4.910 4.629 4.367 4.965 0.055 5 0 "[ . 1 . 2]" 1
456 1 21 GLN HA 1 24 GLU H . . 4.440 3.808 3.379 4.161 . 0 0 "[ . 1 . 2]" 1
457 1 21 GLN HA 1 24 GLU HB2 . . 3.690 2.970 2.435 3.598 . 0 0 "[ . 1 . 2]" 1
458 1 21 GLN HA 1 24 GLU HG2 . . 4.670 4.525 4.021 4.737 0.067 8 0 "[ . 1 . 2]" 1
459 1 21 GLN HA 1 24 GLU HG3 . . 4.440 3.543 3.059 4.316 . 0 0 "[ . 1 . 2]" 1
460 1 21 GLN HA 1 25 PHE H . . 5.110 4.147 3.777 4.854 . 0 0 "[ . 1 . 2]" 1
461 1 21 GLN HB2 1 22 ILE H . . 4.400 3.316 2.541 4.243 . 0 0 "[ . 1 . 2]" 1
462 1 21 GLN HB3 1 22 ILE H . . 4.400 2.957 2.244 3.660 . 0 0 "[ . 1 . 2]" 1
463 1 21 GLN QG 1 22 ILE H . . 4.680 3.976 2.264 4.513 . 0 0 "[ . 1 . 2]" 1
464 1 21 GLN HG2 1 22 ILE H . . 5.500 4.392 2.320 5.055 . 0 0 "[ . 1 . 2]" 1
465 1 21 GLN HG3 1 22 ILE H . . 5.500 4.593 3.046 5.132 . 0 0 "[ . 1 . 2]" 1
466 1 22 ILE H 1 22 ILE HB . . 3.500 2.566 2.295 2.801 . 0 0 "[ . 1 . 2]" 1
467 1 22 ILE H 1 22 ILE MD . . 3.910 3.383 3.029 3.511 . 0 0 "[ . 1 . 2]" 1
468 1 22 ILE H 1 22 ILE HG12 . . 4.140 3.433 3.051 3.790 . 0 0 "[ . 1 . 2]" 1
469 1 22 ILE H 1 22 ILE HG13 . . 3.710 2.073 1.872 2.416 . 0 0 "[ . 1 . 2]" 1
470 1 22 ILE H 1 22 ILE MG . . 4.020 3.801 3.745 3.843 . 0 0 "[ . 1 . 2]" 1
471 1 22 ILE H 1 23 LYS H . . 3.630 2.822 2.662 2.977 . 0 0 "[ . 1 . 2]" 1
472 1 22 ILE H 1 23 LYS QG . . 5.340 4.405 4.052 5.396 0.056 10 0 "[ . 1 . 2]" 1
473 1 22 ILE H 1 25 PHE HB2 . . 5.500 5.062 4.548 5.553 0.053 15 0 "[ . 1 . 2]" 1
474 1 22 ILE HA 1 22 ILE MD . . 3.990 3.936 3.803 4.042 0.052 5 0 "[ . 1 . 2]" 1
475 1 22 ILE HA 1 22 ILE HG12 . . 3.810 2.704 2.541 2.980 . 0 0 "[ . 1 . 2]" 1
476 1 22 ILE HA 1 22 ILE HG13 . . 3.760 2.968 2.587 3.275 . 0 0 "[ . 1 . 2]" 1
477 1 22 ILE HA 1 22 ILE MG . . 3.390 2.445 2.295 2.604 . 0 0 "[ . 1 . 2]" 1
478 1 22 ILE HA 1 25 PHE H . . 4.200 3.565 3.316 4.061 . 0 0 "[ . 1 . 2]" 1
479 1 22 ILE HA 1 25 PHE HB2 . . 4.120 3.018 2.360 3.844 . 0 0 "[ . 1 . 2]" 1
480 1 22 ILE HA 1 25 PHE HB3 . . 4.060 2.986 2.435 3.750 . 0 0 "[ . 1 . 2]" 1
481 1 22 ILE HA 1 25 PHE QD . . 4.900 4.017 3.131 4.657 . 0 0 "[ . 1 . 2]" 1
482 1 22 ILE HA 1 26 HIS HD2 . . 5.050 4.047 3.531 4.510 . 0 0 "[ . 1 . 2]" 1
483 1 22 ILE HB 1 22 ILE MD . . 3.370 2.329 2.257 2.441 . 0 0 "[ . 1 . 2]" 1
484 1 22 ILE HB 1 23 LYS H . . 3.700 2.574 2.353 2.842 . 0 0 "[ . 1 . 2]" 1
485 1 22 ILE HB 2 30 PHE QD . . 5.500 5.013 4.438 5.551 0.051 2 0 "[ . 1 . 2]" 1
486 1 22 ILE HB 2 30 PHE HE1 . . 5.500 4.619 3.324 5.512 0.012 2 0 "[ . 1 . 2]" 1
487 1 22 ILE HB 2 37 LEU MD1 . . 4.950 4.279 3.811 4.530 . 0 0 "[ . 1 . 2]" 1
488 1 22 ILE MD 1 22 ILE MG . . 2.930 2.093 2.048 2.177 . 0 0 "[ . 1 . 2]" 1
489 1 22 ILE MD 1 23 LYS H . . 4.610 4.407 4.070 4.680 0.070 15 0 "[ . 1 . 2]" 1
490 1 22 ILE MD 2 33 ASP H . . 5.330 4.583 4.252 5.077 . 0 0 "[ . 1 . 2]" 1
491 1 22 ILE MD 2 33 ASP HA . . 4.800 4.126 3.940 4.356 . 0 0 "[ . 1 . 2]" 1
492 1 22 ILE MD 2 33 ASP HB2 . . 3.990 3.941 3.787 4.066 0.076 18 0 "[ . 1 . 2]" 1
493 1 22 ILE MD 2 33 ASP HB3 . . 4.230 2.534 2.313 2.944 . 0 0 "[ . 1 . 2]" 1
494 1 22 ILE MD 2 34 VAL H . . 5.100 3.355 2.849 4.226 . 0 0 "[ . 1 . 2]" 1
495 1 22 ILE MD 2 34 VAL HA . . 3.790 2.727 2.411 3.691 . 0 0 "[ . 1 . 2]" 1
496 1 22 ILE MD 2 34 VAL MG2 . . 3.470 2.565 2.154 3.582 0.112 3 0 "[ . 1 . 2]" 1
497 1 22 ILE MD 2 37 LEU H . . 4.450 4.065 3.880 4.516 0.066 2 0 "[ . 1 . 2]" 1
498 1 22 ILE MD 2 37 LEU HA . . 4.790 4.704 4.383 4.878 0.088 8 0 "[ . 1 . 2]" 1
499 1 22 ILE MD 2 37 LEU HB2 . . 3.750 2.621 2.373 3.078 . 0 0 "[ . 1 . 2]" 1
500 1 22 ILE MD 2 37 LEU HB3 . . 5.020 3.387 3.152 3.957 . 0 0 "[ . 1 . 2]" 1
501 1 22 ILE MD 2 37 LEU MD1 . . 2.990 2.015 1.873 2.253 . 0 0 "[ . 1 . 2]" 1
502 1 22 ILE MD 2 37 LEU MD2 . . 4.150 4.105 3.902 4.246 0.096 2 0 "[ . 1 . 2]" 1
503 1 22 ILE MD 2 37 LEU HG . . 4.800 3.253 2.678 3.755 . 0 0 "[ . 1 . 2]" 1
504 1 22 ILE HG12 1 23 LYS H . . 5.180 5.060 4.920 5.237 0.057 15 0 "[ . 1 . 2]" 1
505 1 22 ILE HG13 1 22 ILE MG . . 3.750 3.227 3.206 3.248 . 0 0 "[ . 1 . 2]" 1
506 1 22 ILE HG13 1 23 LYS H . . 4.760 4.287 4.009 4.583 . 0 0 "[ . 1 . 2]" 1
507 1 22 ILE MG 1 23 LYS H . . 4.070 3.459 3.158 3.775 . 0 0 "[ . 1 . 2]" 1
508 1 22 ILE MG 1 23 LYS HA . . 4.490 3.517 3.277 3.908 . 0 0 "[ . 1 . 2]" 1
509 1 22 ILE MG 1 26 HIS HD2 . . 3.340 2.473 2.104 3.020 . 0 0 "[ . 1 . 2]" 1
510 1 22 ILE MG 2 30 PHE HA . . 4.420 2.692 2.199 3.052 . 0 0 "[ . 1 . 2]" 1
511 1 22 ILE MG 2 30 PHE QD . . 3.980 3.182 2.547 4.025 0.045 5 0 "[ . 1 . 2]" 1
512 1 22 ILE MG 2 30 PHE HE1 . . 4.820 3.761 2.924 4.893 0.073 12 0 "[ . 1 . 2]" 1
513 1 22 ILE MG 2 33 ASP H . . 4.380 4.084 3.821 4.393 0.013 2 0 "[ . 1 . 2]" 1
514 1 22 ILE MG 2 33 ASP HA . . 4.830 4.826 4.494 4.913 0.083 7 0 "[ . 1 . 2]" 1
515 1 22 ILE MG 2 33 ASP HB2 . . 3.710 3.498 3.074 3.751 0.041 3 0 "[ . 1 . 2]" 1
516 1 22 ILE MG 2 33 ASP HB3 . . 3.830 2.333 2.034 2.488 . 0 0 "[ . 1 . 2]" 1
517 1 22 ILE MG 2 34 VAL HA . . 4.890 4.128 3.752 4.566 . 0 0 "[ . 1 . 2]" 1
518 1 22 ILE MG 2 34 VAL MG1 . . 5.490 4.790 4.516 5.402 . 0 0 "[ . 1 . 2]" 1
519 1 22 ILE MG 2 34 VAL MG2 . . 3.530 2.440 2.114 3.211 . 0 0 "[ . 1 . 2]" 1
520 1 23 LYS H 1 23 LYS QB . . 3.260 2.637 2.164 2.868 . 0 0 "[ . 1 . 2]" 1
521 1 23 LYS H 1 23 LYS QD . . 4.440 4.030 3.488 4.373 . 0 0 "[ . 1 . 2]" 1
522 1 23 LYS H 1 23 LYS HG2 . . 4.300 2.902 2.366 3.963 . 0 0 "[ . 1 . 2]" 1
523 1 23 LYS H 1 23 LYS QG . . 3.750 2.252 1.943 3.065 . 0 0 "[ . 1 . 2]" 1
524 1 23 LYS H 1 23 LYS HG3 . . 4.300 2.386 2.009 3.191 . 0 0 "[ . 1 . 2]" 1
525 1 23 LYS H 1 24 GLU H . . 3.690 2.891 2.742 3.107 . 0 0 "[ . 1 . 2]" 1
526 1 23 LYS H 2 30 PHE HE1 . . 5.500 5.260 4.514 5.570 0.070 5 0 "[ . 1 . 2]" 1
527 1 23 LYS H 2 30 PHE HE2 . . 5.500 5.147 4.667 5.560 0.060 2 0 "[ . 1 . 2]" 1
528 1 23 LYS HA 1 23 LYS HD2 . . 5.360 4.728 4.562 5.009 . 0 0 "[ . 1 . 2]" 1
529 1 23 LYS HA 1 23 LYS QD . . 4.600 3.809 3.546 4.074 . 0 0 "[ . 1 . 2]" 1
530 1 23 LYS HA 1 23 LYS HD3 . . 5.360 4.039 3.679 4.535 . 0 0 "[ . 1 . 2]" 1
531 1 23 LYS HA 1 23 LYS QE . . 5.340 4.396 4.123 4.709 . 0 0 "[ . 1 . 2]" 1
532 1 23 LYS HA 1 23 LYS HG2 . . 4.190 2.554 2.231 2.726 . 0 0 "[ . 1 . 2]" 1
533 1 23 LYS HA 1 23 LYS QG . . 3.540 2.466 2.167 2.654 . 0 0 "[ . 1 . 2]" 1
534 1 23 LYS HA 1 23 LYS HG3 . . 4.190 3.373 2.612 3.657 . 0 0 "[ . 1 . 2]" 1
535 1 23 LYS HA 1 26 HIS H . . 4.600 3.826 3.573 4.048 . 0 0 "[ . 1 . 2]" 1
536 1 23 LYS HA 1 26 HIS HB2 . . 5.500 3.578 3.250 3.855 . 0 0 "[ . 1 . 2]" 1
537 1 23 LYS HA 1 26 HIS QB . . 4.680 3.524 3.209 3.787 . 0 0 "[ . 1 . 2]" 1
538 1 23 LYS HA 1 26 HIS HB3 . . 5.500 5.294 4.950 5.547 0.047 20 0 "[ . 1 . 2]" 1
539 1 23 LYS HA 1 26 HIS HD2 . . 4.390 3.694 2.638 4.300 . 0 0 "[ . 1 . 2]" 1
540 1 23 LYS HA 2 30 PHE QD . . 4.710 3.859 3.521 4.464 . 0 0 "[ . 1 . 2]" 1
541 1 23 LYS HA 2 30 PHE HE1 . . 4.910 4.642 4.225 4.948 0.038 4 0 "[ . 1 . 2]" 1
542 1 23 LYS HA 2 30 PHE HE2 . . 4.860 2.528 2.068 2.936 . 0 0 "[ . 1 . 2]" 1
543 1 23 LYS HA 2 30 PHE HZ . . 5.170 3.106 2.428 3.538 . 0 0 "[ . 1 . 2]" 1
544 1 23 LYS QB 1 23 LYS QD . . 3.200 2.140 2.073 2.221 . 0 0 "[ . 1 . 2]" 1
545 1 23 LYS QB 1 23 LYS QE . . 4.090 3.552 3.386 3.651 . 0 0 "[ . 1 . 2]" 1
546 1 23 LYS QB 1 24 GLU H . . 3.370 2.410 2.217 2.639 . 0 0 "[ . 1 . 2]" 1
547 1 23 LYS QB 2 30 PHE HE1 . . 5.150 5.201 5.051 5.237 0.087 6 0 "[ . 1 . 2]" 1
548 1 23 LYS QB 2 30 PHE HE2 . . 4.860 3.446 2.867 4.547 . 0 0 "[ . 1 . 2]" 1
549 1 23 LYS QB 2 30 PHE HZ . . 4.600 3.355 3.069 3.909 . 0 0 "[ . 1 . 2]" 1
550 1 23 LYS HB2 1 23 LYS HE2 . . 5.500 4.777 4.396 5.134 . 0 0 "[ . 1 . 2]" 1
551 1 23 LYS HB2 1 23 LYS HE3 . . 5.500 4.574 4.282 4.818 . 0 0 "[ . 1 . 2]" 1
552 1 23 LYS HB2 1 24 GLU H . . 4.120 2.469 2.247 2.953 . 0 0 "[ . 1 . 2]" 1
553 1 23 LYS HB2 2 30 PHE HZ . . 5.350 4.515 3.601 4.838 . 0 0 "[ . 1 . 2]" 1
554 1 23 LYS HB3 1 23 LYS HE2 . . 5.500 4.310 4.107 4.646 . 0 0 "[ . 1 . 2]" 1
555 1 23 LYS HB3 1 23 LYS HE3 . . 5.500 4.473 3.726 4.941 . 0 0 "[ . 1 . 2]" 1
556 1 23 LYS HB3 1 24 GLU H . . 4.120 3.522 2.971 3.797 . 0 0 "[ . 1 . 2]" 1
557 1 23 LYS HB3 2 30 PHE HZ . . 5.350 3.501 3.144 4.332 . 0 0 "[ . 1 . 2]" 1
558 1 23 LYS QD 2 30 PHE HZ . . 4.380 2.918 2.218 4.051 . 0 0 "[ . 1 . 2]" 1
559 1 23 LYS HD2 1 24 GLU H . . 5.500 5.263 4.850 5.502 0.002 3 0 "[ . 1 . 2]" 1
560 1 23 LYS HD2 2 30 PHE HZ . . 5.030 4.159 3.747 5.014 . 0 0 "[ . 1 . 2]" 1
561 1 23 LYS HD3 1 24 GLU H . . 5.500 5.490 5.188 5.577 0.077 14 0 "[ . 1 . 2]" 1
562 1 23 LYS HD3 2 30 PHE HZ . . 5.030 3.041 2.234 4.606 . 0 0 "[ . 1 . 2]" 1
563 1 23 LYS QE 1 23 LYS QG . . 3.170 2.120 1.976 2.434 . 0 0 "[ . 1 . 2]" 1
564 1 23 LYS QE 2 30 PHE QD . . 5.340 5.006 4.518 5.422 0.082 16 0 "[ . 1 . 2]" 1
565 1 23 LYS QE 2 30 PHE HZ . . 3.990 2.481 2.063 3.368 . 0 0 "[ . 1 . 2]" 1
566 1 23 LYS HE2 2 30 PHE HZ . . 4.550 2.962 2.112 4.164 . 0 0 "[ . 1 . 2]" 1
567 1 23 LYS HE3 2 30 PHE HZ . . 4.550 3.410 2.074 4.613 0.063 1 0 "[ . 1 . 2]" 1
568 1 23 LYS QG 1 24 GLU H . . 4.770 3.868 3.555 4.406 . 0 0 "[ . 1 . 2]" 1
569 1 23 LYS QG 2 30 PHE HE1 . . 4.320 3.356 3.117 3.773 . 0 0 "[ . 1 . 2]" 1
570 1 23 LYS QG 2 30 PHE HZ . . 3.890 2.147 1.914 2.531 . 0 0 "[ . 1 . 2]" 1
571 1 23 LYS HG2 1 24 GLU H . . 5.500 4.663 4.379 5.063 . 0 0 "[ . 1 . 2]" 1
572 1 23 LYS HG2 2 30 PHE HE1 . . 4.980 3.571 3.355 4.712 . 0 0 "[ . 1 . 2]" 1
573 1 23 LYS HG2 2 30 PHE HE2 . . 5.080 3.579 2.522 3.943 . 0 0 "[ . 1 . 2]" 1
574 1 23 LYS HG2 2 30 PHE HZ . . 4.700 2.197 2.004 2.558 . 0 0 "[ . 1 . 2]" 1
575 1 23 LYS HG3 1 24 GLU H . . 5.500 4.141 3.732 4.957 . 0 0 "[ . 1 . 2]" 1
576 1 23 LYS HG3 2 30 PHE HE1 . . 4.980 4.605 3.326 5.025 0.045 15 0 "[ . 1 . 2]" 1
577 1 23 LYS HG3 2 30 PHE HE2 . . 5.080 4.935 3.719 5.151 0.071 7 0 "[ . 1 . 2]" 1
578 1 23 LYS HG3 2 30 PHE HZ . . 4.700 3.523 2.023 4.021 . 0 0 "[ . 1 . 2]" 1
579 1 24 GLU H 1 24 GLU HB2 . . 3.330 2.453 2.325 2.697 . 0 0 "[ . 1 . 2]" 1
580 1 24 GLU H 1 24 GLU HB3 . . 3.770 3.570 3.499 3.671 . 0 0 "[ . 1 . 2]" 1
581 1 24 GLU H 1 24 GLU HG2 . . 3.640 2.359 1.946 3.136 . 0 0 "[ . 1 . 2]" 1
582 1 24 GLU H 1 24 GLU HG3 . . 3.840 3.029 2.216 3.570 . 0 0 "[ . 1 . 2]" 1
583 1 24 GLU H 1 25 PHE H . . 3.640 2.739 2.632 2.824 . 0 0 "[ . 1 . 2]" 1
584 1 24 GLU H 1 25 PHE HA . . 5.280 5.339 5.319 5.356 0.076 7 0 "[ . 1 . 2]" 1
585 1 24 GLU H 1 25 PHE HB2 . . 5.500 4.900 4.553 5.169 . 0 0 "[ . 1 . 2]" 1
586 1 24 GLU H 1 25 PHE HB3 . . 5.500 5.164 4.642 5.535 0.035 12 0 "[ . 1 . 2]" 1
587 1 24 GLU H 1 26 HIS H . . 4.840 4.538 4.265 4.810 . 0 0 "[ . 1 . 2]" 1
588 1 24 GLU H 1 27 ARG QG . . 5.340 5.364 5.128 5.426 0.086 8 0 "[ . 1 . 2]" 1
589 1 24 GLU HA 1 24 GLU HG2 . . 3.690 2.636 2.277 2.841 . 0 0 "[ . 1 . 2]" 1
590 1 24 GLU HA 1 24 GLU HG3 . . 3.810 3.654 3.181 3.851 0.041 15 0 "[ . 1 . 2]" 1
591 1 24 GLU HA 1 27 ARG H . . 3.710 3.128 2.964 3.304 . 0 0 "[ . 1 . 2]" 1
592 1 24 GLU HA 1 27 ARG HB2 . . 3.700 2.327 2.067 3.728 0.028 8 0 "[ . 1 . 2]" 1
593 1 24 GLU HA 1 27 ARG QB . . 3.110 2.088 1.959 2.254 . 0 0 "[ . 1 . 2]" 1
594 1 24 GLU HA 1 27 ARG HB3 . . 3.700 2.607 2.074 3.577 . 0 0 "[ . 1 . 2]" 1
595 1 24 GLU HA 1 27 ARG HD2 . . 5.470 4.683 3.290 5.137 . 0 0 "[ . 1 . 2]" 1
596 1 24 GLU HA 1 27 ARG QD . . 4.650 4.223 3.200 4.731 0.081 14 0 "[ . 1 . 2]" 1
597 1 24 GLU HA 1 27 ARG HD3 . . 5.470 5.018 3.528 5.541 0.071 15 0 "[ . 1 . 2]" 1
598 1 24 GLU HA 1 27 ARG HG2 . . 4.860 4.297 3.216 4.904 0.044 4 0 "[ . 1 . 2]" 1
599 1 24 GLU HA 1 27 ARG QG . . 3.990 3.500 3.162 3.763 . 0 0 "[ . 1 . 2]" 1
600 1 24 GLU HA 1 27 ARG HG3 . . 4.860 3.923 3.295 4.907 0.047 9 0 "[ . 1 . 2]" 1
601 1 24 GLU HB2 1 25 PHE H . . 4.070 2.657 2.449 3.199 . 0 0 "[ . 1 . 2]" 1
602 1 24 GLU HB3 1 25 PHE H . . 4.100 3.635 3.332 4.076 . 0 0 "[ . 1 . 2]" 1
603 1 24 GLU HG2 1 25 PHE H . . 4.910 4.480 4.245 4.969 0.059 16 0 "[ . 1 . 2]" 1
604 1 24 GLU HG2 1 27 ARG H . . 5.500 5.549 5.240 5.578 0.078 6 0 "[ . 1 . 2]" 1
605 1 24 GLU HG3 1 25 PHE H . . 4.630 4.647 4.374 4.715 0.085 19 0 "[ . 1 . 2]" 1
606 1 25 PHE H 1 25 PHE HB2 . . 3.470 2.355 2.154 2.562 . 0 0 "[ . 1 . 2]" 1
607 1 25 PHE H 1 25 PHE HB3 . . 3.550 2.749 2.377 3.128 . 0 0 "[ . 1 . 2]" 1
608 1 25 PHE H 1 25 PHE QD . . 4.650 4.153 4.007 4.291 . 0 0 "[ . 1 . 2]" 1
609 1 25 PHE H 1 26 HIS H . . 4.000 2.893 2.771 3.077 . 0 0 "[ . 1 . 2]" 1
610 1 25 PHE HA 1 25 PHE QD . . 4.020 2.857 2.397 3.186 . 0 0 "[ . 1 . 2]" 1
611 1 25 PHE HA 1 25 PHE QE . . 4.540 4.590 4.478 4.625 0.085 10 0 "[ . 1 . 2]" 1
612 1 25 PHE HA 1 27 ARG H . . 5.130 4.273 4.026 4.540 . 0 0 "[ . 1 . 2]" 1
613 1 25 PHE HB2 1 26 HIS H . . 4.880 3.670 3.257 3.966 . 0 0 "[ . 1 . 2]" 1
614 1 25 PHE HB3 1 26 HIS H . . 4.190 2.443 2.165 2.867 . 0 0 "[ . 1 . 2]" 1
615 1 25 PHE HB3 1 26 HIS HD2 . . 5.320 3.423 2.208 4.398 . 0 0 "[ . 1 . 2]" 1
616 1 25 PHE HB3 1 26 HIS HE1 . . 5.500 5.271 4.150 5.566 0.066 8 0 "[ . 1 . 2]" 1
617 1 25 PHE HB3 1 27 ARG H . . 5.500 4.713 4.525 4.901 . 0 0 "[ . 1 . 2]" 1
618 1 25 PHE QD 1 26 HIS H . . 4.690 3.676 3.224 4.147 . 0 0 "[ . 1 . 2]" 1
619 1 25 PHE QD 1 26 HIS HA . . 4.600 3.680 2.916 4.415 . 0 0 "[ . 1 . 2]" 1
620 1 25 PHE QD 1 26 HIS HD2 . . 5.500 4.341 3.292 5.564 0.064 2 0 "[ . 1 . 2]" 1
621 1 25 PHE QD 1 27 ARG H . . 5.500 5.402 5.038 5.572 0.072 9 0 "[ . 1 . 2]" 1
622 1 26 HIS H 1 26 HIS HB2 . . 3.970 2.427 2.335 2.617 . 0 0 "[ . 1 . 2]" 1
623 1 26 HIS H 1 26 HIS HB3 . . 3.970 3.606 3.566 3.686 . 0 0 "[ . 1 . 2]" 1
624 1 26 HIS H 1 26 HIS HD2 . . 4.800 2.895 2.045 3.668 . 0 0 "[ . 1 . 2]" 1
625 1 26 HIS H 1 27 ARG H . . 3.850 2.547 2.233 2.730 . 0 0 "[ . 1 . 2]" 1
626 1 26 HIS H 1 27 ARG HB2 . . 5.500 4.408 4.004 4.683 . 0 0 "[ . 1 . 2]" 1
627 1 26 HIS H 1 27 ARG QB . . 4.810 4.194 3.878 4.355 . 0 0 "[ . 1 . 2]" 1
628 1 26 HIS H 1 27 ARG HB3 . . 5.500 5.360 4.257 5.581 0.081 4 0 "[ . 1 . 2]" 1
629 1 26 HIS H 1 28 LYS H . . 4.930 4.283 3.823 4.799 . 0 0 "[ . 1 . 2]" 1
630 1 26 HIS H 2 30 PHE QD . . 5.500 4.648 4.168 5.167 . 0 0 "[ . 1 . 2]" 1
631 1 26 HIS QB 1 27 ARG H . . 4.100 3.113 2.855 3.297 . 0 0 "[ . 1 . 2]" 1
632 1 26 HIS QB 2 30 PHE QD . . 4.650 2.502 2.227 2.883 . 0 0 "[ . 1 . 2]" 1
633 1 26 HIS HB2 1 27 ARG H . . 4.680 3.231 2.949 3.439 . 0 0 "[ . 1 . 2]" 1
634 1 26 HIS HB2 2 30 PHE QD . . 5.500 2.640 2.272 3.078 . 0 0 "[ . 1 . 2]" 1
635 1 26 HIS HB3 1 27 ARG H . . 4.680 4.078 3.813 4.241 . 0 0 "[ . 1 . 2]" 1
636 1 26 HIS HB3 2 30 PHE QD . . 5.500 3.180 2.656 3.688 . 0 0 "[ . 1 . 2]" 1
637 1 26 HIS HD2 2 30 PHE HA . . 5.050 3.152 2.629 3.970 . 0 0 "[ . 1 . 2]" 1
638 1 26 HIS HD2 2 30 PHE QD . . 4.010 3.095 2.473 4.052 0.042 12 0 "[ . 1 . 2]" 1
639 1 27 ARG H 1 27 ARG HB2 . . 3.720 2.194 2.023 2.674 . 0 0 "[ . 1 . 2]" 1
640 1 27 ARG H 1 27 ARG QB . . 3.060 2.113 1.998 2.222 . 0 0 "[ . 1 . 2]" 1
641 1 27 ARG H 1 27 ARG HB3 . . 3.720 2.946 2.220 3.386 . 0 0 "[ . 1 . 2]" 1
642 1 27 ARG H 1 27 ARG HD2 . . 5.500 4.862 3.125 5.561 0.061 19 0 "[ . 1 . 2]" 1
643 1 27 ARG H 1 27 ARG HD3 . . 5.500 4.751 3.305 5.555 0.055 12 0 "[ . 1 . 2]" 1
644 1 27 ARG H 1 27 ARG HG2 . . 4.530 4.140 3.674 4.465 . 0 0 "[ . 1 . 2]" 1
645 1 27 ARG H 1 27 ARG HG3 . . 4.530 4.355 3.072 4.551 0.021 7 0 "[ . 1 . 2]" 1
646 1 27 ARG H 1 28 LYS H . . 4.140 2.645 2.380 2.946 . 0 0 "[ . 1 . 2]" 1
647 1 27 ARG HA 1 27 ARG HD2 . . 5.370 3.618 2.125 4.669 . 0 0 "[ . 1 . 2]" 1
648 1 27 ARG HA 1 27 ARG QD . . 4.630 2.744 2.112 3.869 . 0 0 "[ . 1 . 2]" 1
649 1 27 ARG HA 1 27 ARG HD3 . . 5.370 3.095 2.166 4.544 . 0 0 "[ . 1 . 2]" 1
650 1 27 ARG HA 1 27 ARG HG2 . . 3.710 2.717 2.111 3.754 0.044 12 0 "[ . 1 . 2]" 1
651 1 27 ARG HA 1 27 ARG QG . . 3.210 2.425 2.083 2.888 . 0 0 "[ . 1 . 2]" 1
652 1 27 ARG HA 1 27 ARG HG3 . . 3.710 3.330 2.465 3.762 0.052 3 0 "[ . 1 . 2]" 1
653 1 27 ARG QB 1 27 ARG QD . . 3.080 2.330 2.073 2.560 . 0 0 "[ . 1 . 2]" 1
654 1 27 ARG QB 1 28 LYS H . . 4.310 3.087 2.283 3.583 . 0 0 "[ . 1 . 2]" 1
655 1 27 ARG QB 1 28 LYS QB . . 4.940 3.812 3.307 4.799 . 0 0 "[ . 1 . 2]" 1
656 1 27 ARG HB2 1 28 LYS H . . 4.950 3.830 3.379 4.438 . 0 0 "[ . 1 . 2]" 1
657 1 27 ARG HB3 1 28 LYS H . . 4.950 3.302 2.313 3.868 . 0 0 "[ . 1 . 2]" 1
658 1 28 LYS H 1 28 LYS QB . . 3.590 2.430 2.117 2.669 . 0 0 "[ . 1 . 2]" 1
659 1 28 LYS H 1 28 LYS HG2 . . 4.920 4.426 2.745 4.953 0.033 17 0 "[ . 1 . 2]" 1
660 1 28 LYS H 1 28 LYS QG . . 4.160 3.824 2.690 4.227 0.067 17 0 "[ . 1 . 2]" 1
661 1 28 LYS H 1 28 LYS HG3 . . 4.920 4.272 3.217 4.823 . 0 0 "[ . 1 . 2]" 1
662 1 28 LYS H 1 29 HIS H . . 4.660 3.524 1.891 4.574 . 0 0 "[ . 1 . 2]" 1
663 1 28 LYS HA 1 28 LYS HD2 . . 5.340 3.648 2.096 4.774 . 0 0 "[ . 1 . 2]" 1
664 1 28 LYS HA 1 28 LYS QD . . 4.550 3.249 2.080 4.211 . 0 0 "[ . 1 . 2]" 1
665 1 28 LYS HA 1 28 LYS HD3 . . 5.340 3.936 2.130 4.795 . 0 0 "[ . 1 . 2]" 1
666 1 28 LYS HA 1 28 LYS HE2 . . 5.500 4.744 3.700 5.568 0.068 4 0 "[ . 1 . 2]" 1
667 1 28 LYS HA 1 28 LYS HE3 . . 5.500 4.511 3.308 5.275 . 0 0 "[ . 1 . 2]" 1
668 1 28 LYS HA 1 28 LYS HG2 . . 4.010 3.081 2.192 3.839 . 0 0 "[ . 1 . 2]" 1
669 1 28 LYS HA 1 28 LYS QG . . 3.390 2.436 2.081 3.094 . 0 0 "[ . 1 . 2]" 1
670 1 28 LYS HA 1 28 LYS HG3 . . 4.010 2.749 2.197 3.750 . 0 0 "[ . 1 . 2]" 1
671 1 28 LYS QB 1 28 LYS QE . . 4.510 2.939 1.886 3.915 . 0 0 "[ . 1 . 2]" 1
672 1 28 LYS HB2 1 29 HIS H . . 5.330 3.859 2.533 4.645 . 0 0 "[ . 1 . 2]" 1
673 1 28 LYS HB3 1 29 HIS H . . 5.330 3.259 2.405 4.455 . 0 0 "[ . 1 . 2]" 1
674 1 28 LYS QD 1 29 HIS H . . 5.340 4.436 2.640 5.427 0.087 11 0 "[ . 1 . 2]" 1
675 1 28 LYS QE 1 28 LYS QG . . 3.230 2.275 2.055 2.845 . 0 0 "[ . 1 . 2]" 1
676 1 29 HIS H 1 30 PRO QD . . 4.960 4.159 3.417 4.507 . 0 0 "[ . 1 . 2]" 1
677 1 29 HIS HA 1 30 PRO HD2 . . 3.640 2.378 2.099 2.591 . 0 0 "[ . 1 . 2]" 1
678 1 29 HIS HA 1 30 PRO QD . . 3.000 2.144 1.995 2.221 . 0 0 "[ . 1 . 2]" 1
679 1 29 HIS HA 1 30 PRO HD3 . . 3.640 2.504 2.287 2.834 . 0 0 "[ . 1 . 2]" 1
680 1 29 HIS HA 1 30 PRO HG2 . . 5.210 4.546 4.315 4.697 . 0 0 "[ . 1 . 2]" 1
681 1 29 HIS HA 1 30 PRO QG . . 4.450 4.083 3.929 4.176 . 0 0 "[ . 1 . 2]" 1
682 1 29 HIS HA 1 30 PRO HG3 . . 5.210 4.631 4.523 4.745 . 0 0 "[ . 1 . 2]" 1
683 1 29 HIS QB 1 30 PRO QD . . 4.680 2.809 2.164 3.776 . 0 0 "[ . 1 . 2]" 1
684 1 32 GLU H 1 32 GLU QB . . 3.700 2.597 2.062 3.365 . 0 0 "[ . 1 . 2]" 1
685 1 32 GLU H 1 32 GLU HG2 . . 5.140 3.797 2.406 4.926 . 0 0 "[ . 1 . 2]" 1
686 1 32 GLU H 1 32 GLU QG . . 4.420 3.122 1.946 4.307 . 0 0 "[ . 1 . 2]" 1
687 1 32 GLU H 1 32 GLU HG3 . . 5.140 3.479 1.999 4.760 . 0 0 "[ . 1 . 2]" 1
688 1 32 GLU HA 1 32 GLU HG2 . . 4.050 2.813 2.323 3.728 . 0 0 "[ . 1 . 2]" 1
689 1 32 GLU HA 1 32 GLU QG . . 3.430 2.419 2.095 3.387 . 0 0 "[ . 1 . 2]" 1
690 1 32 GLU HA 1 32 GLU HG3 . . 4.050 3.014 2.148 3.887 . 0 0 "[ . 1 . 2]" 1
691 1 32 GLU HA 1 33 ILE H . . 3.180 2.510 2.187 3.227 0.047 17 0 "[ . 1 . 2]" 1
692 1 32 GLU QB 1 33 ILE H . . 3.750 2.836 1.884 3.833 0.083 5 0 "[ . 1 . 2]" 1
693 1 32 GLU HB2 1 33 ILE H . . 4.590 3.851 2.513 4.592 0.002 12 0 "[ . 1 . 2]" 1
694 1 32 GLU HB3 1 33 ILE H . . 4.590 3.020 1.897 4.186 . 0 0 "[ . 1 . 2]" 1
695 1 32 GLU QG 1 33 ILE H . . 4.650 3.752 2.282 4.509 . 0 0 "[ . 1 . 2]" 1
696 1 32 GLU HG2 1 33 ILE H . . 5.500 4.200 2.697 5.100 . 0 0 "[ . 1 . 2]" 1
697 1 32 GLU HG3 1 33 ILE H . . 5.500 4.420 2.463 5.424 . 0 0 "[ . 1 . 2]" 1
698 1 33 ILE H 1 33 ILE HB . . 3.430 2.794 2.420 3.504 0.074 17 0 "[ . 1 . 2]" 1
699 1 33 ILE H 1 33 ILE HG12 . . 3.910 3.447 2.014 3.973 0.063 11 0 "[ . 1 . 2]" 1
700 1 33 ILE H 1 33 ILE HG13 . . 3.910 2.615 1.919 3.524 . 0 0 "[ . 1 . 2]" 1
701 1 33 ILE H 1 33 ILE MG . . 4.220 3.771 2.418 4.020 . 0 0 "[ . 1 . 2]" 1
702 1 33 ILE H 1 34 CYS H . . 4.930 3.687 2.473 4.598 . 0 0 "[ . 1 . 2]" 1
703 1 33 ILE HA 1 33 ILE MD . . 4.110 3.771 2.383 4.172 0.062 4 0 "[ . 1 . 2]" 1
704 1 33 ILE HA 1 33 ILE HG12 . . 4.230 2.936 2.479 3.884 . 0 0 "[ . 1 . 2]" 1
705 1 33 ILE HA 1 33 ILE QG . . 3.690 2.574 2.352 3.387 . 0 0 "[ . 1 . 2]" 1
706 1 33 ILE HA 1 33 ILE HG13 . . 4.230 3.068 2.396 3.899 . 0 0 "[ . 1 . 2]" 1
707 1 33 ILE HA 1 33 ILE MG . . 3.370 2.376 2.274 2.449 . 0 0 "[ . 1 . 2]" 1
708 1 33 ILE HB 1 33 ILE MD . . 3.740 2.422 2.246 3.274 . 0 0 "[ . 1 . 2]" 1
709 1 33 ILE HB 1 34 CYS H . . 4.900 3.736 1.961 4.561 . 0 0 "[ . 1 . 2]" 1
710 1 33 ILE MG 1 34 CYS H . . 4.800 3.290 2.386 4.066 . 0 0 "[ . 1 . 2]" 1
711 1 34 CYS H 1 35 VAL H . . 4.500 3.953 1.723 4.566 0.066 16 0 "[ . 1 . 2]" 1
712 1 34 CYS HA 1 35 VAL H . . 3.400 2.607 2.196 3.477 0.077 17 0 "[ . 1 . 2]" 1
713 1 34 CYS HA 1 35 VAL MG1 . . 5.160 3.967 3.258 5.136 . 0 0 "[ . 1 . 2]" 1
714 1 34 CYS HA 1 35 VAL QG . . 4.340 3.432 3.072 4.312 . 0 0 "[ . 1 . 2]" 1
715 1 34 CYS HA 1 35 VAL MG2 . . 5.160 3.805 3.296 4.739 . 0 0 "[ . 1 . 2]" 1
716 1 34 CYS QB 1 35 VAL H . . 4.410 3.131 1.931 4.055 . 0 0 "[ . 1 . 2]" 1
717 1 34 CYS QB 1 35 VAL HA . . 4.390 4.331 4.061 4.473 0.083 11 0 "[ . 1 . 2]" 1
718 1 35 VAL H 1 35 VAL HB . . 3.850 3.778 3.541 3.900 0.050 17 0 "[ . 1 . 2]" 1
719 1 35 VAL H 1 35 VAL MG1 . . 3.940 3.052 2.251 3.456 . 0 0 "[ . 1 . 2]" 1
720 1 35 VAL H 1 35 VAL QG . . 3.300 2.191 1.837 2.449 . 0 0 "[ . 1 . 2]" 1
721 1 35 VAL H 1 35 VAL MG2 . . 3.940 2.250 1.863 2.513 . 0 0 "[ . 1 . 2]" 1
722 1 35 VAL HA 1 36 PRO HD2 . . 2.990 2.503 2.056 2.799 . 0 0 "[ . 1 . 2]" 1
723 1 35 VAL HA 1 36 PRO HD3 . . 2.990 2.424 2.181 2.746 . 0 0 "[ . 1 . 2]" 1
724 1 35 VAL HB 1 36 PRO QD . . 3.850 2.409 2.011 3.924 0.074 18 0 "[ . 1 . 2]" 1
725 1 35 VAL QG 1 36 PRO HA . . 4.740 4.463 4.326 4.612 . 0 0 "[ . 1 . 2]" 1
726 1 35 VAL QG 1 36 PRO QD . . 3.470 2.945 2.613 3.419 . 0 0 "[ . 1 . 2]" 1
727 1 35 VAL MG1 1 36 PRO HD2 . . 4.720 3.264 2.759 3.923 . 0 0 "[ . 1 . 2]" 1
728 1 35 VAL MG1 1 36 PRO HD3 . . 4.720 3.908 3.549 4.383 . 0 0 "[ . 1 . 2]" 1
729 1 35 VAL MG2 1 36 PRO HD2 . . 4.720 3.914 3.572 4.785 0.065 9 0 "[ . 1 . 2]" 1
730 1 35 VAL MG2 1 36 PRO HD3 . . 4.720 4.667 4.449 4.804 0.084 11 0 "[ . 1 . 2]" 1
731 1 36 PRO HA 1 37 MET H . . 3.120 2.401 2.197 2.661 . 0 0 "[ . 1 . 2]" 1
732 1 36 PRO QB 1 37 MET H . . 3.950 2.885 2.156 4.001 0.051 11 0 "[ . 1 . 2]" 1
733 1 36 PRO QB 1 38 SER H . . 4.480 3.650 2.223 4.556 0.076 10 0 "[ . 1 . 2]" 1
734 1 37 MET H 1 38 SER H . . 4.170 2.945 1.879 4.228 0.058 1 0 "[ . 1 . 2]" 1
735 2 4 VAL H 2 4 VAL HB . . 4.090 3.384 2.446 3.860 . 0 0 "[ . 1 . 2]" 1
736 2 4 VAL HA 2 5 ILE H . . 3.400 2.570 2.171 3.460 0.060 7 0 "[ . 1 . 2]" 1
737 2 4 VAL QG 2 5 ILE H . . 4.420 2.791 1.820 3.513 . 0 0 "[ . 1 . 2]" 1
738 2 5 ILE H 2 5 ILE HB . . 3.880 3.245 2.363 3.928 0.048 14 0 "[ . 1 . 2]" 1
739 2 5 ILE H 2 5 ILE QG . . 4.490 2.981 2.100 4.249 . 0 0 "[ . 1 . 2]" 1
740 2 5 ILE HA 2 5 ILE MD . . 4.760 3.498 2.182 4.215 . 0 0 "[ . 1 . 2]" 1
741 2 5 ILE HA 2 5 ILE QG . . 3.650 2.981 2.207 3.589 . 0 0 "[ . 1 . 2]" 1
742 2 5 ILE HA 2 5 ILE MG . . 3.310 2.627 2.217 3.286 . 0 0 "[ . 1 . 2]" 1
743 2 5 ILE HA 2 6 GLN H . . 3.260 2.458 2.198 3.308 0.048 14 0 "[ . 1 . 2]" 1
744 2 5 ILE HB 2 5 ILE MD . . 3.710 2.553 2.296 3.300 . 0 0 "[ . 1 . 2]" 1
745 2 5 ILE HB 2 6 GLN H . . 4.890 3.831 2.242 4.515 . 0 0 "[ . 1 . 2]" 1
746 2 5 ILE QG 2 5 ILE MG . . 3.150 2.269 2.077 2.383 . 0 0 "[ . 1 . 2]" 1
747 2 5 ILE HG12 2 5 ILE MG . . 3.620 2.531 2.234 3.242 . 0 0 "[ . 1 . 2]" 1
748 2 5 ILE HG13 2 5 ILE MG . . 3.620 2.908 2.283 3.267 . 0 0 "[ . 1 . 2]" 1
749 2 6 GLN H 2 6 GLN HG2 . . 5.500 3.781 2.379 5.310 . 0 0 "[ . 1 . 2]" 1
750 2 6 GLN H 2 6 GLN QG . . 4.790 3.095 2.331 4.556 . 0 0 "[ . 1 . 2]" 1
751 2 6 GLN H 2 6 GLN HG3 . . 5.500 3.500 2.358 4.959 . 0 0 "[ . 1 . 2]" 1
752 2 6 GLN QB 2 7 GLU H . . 4.180 3.192 2.083 4.102 . 0 0 "[ . 1 . 2]" 1
753 2 7 GLU H 2 7 GLU QG . . 5.070 3.281 2.097 4.376 . 0 0 "[ . 1 . 2]" 1
754 2 7 GLU HA 2 8 THR H . . 3.380 2.694 2.145 3.437 0.057 17 0 "[ . 1 . 2]" 1
755 2 8 THR H 2 8 THR MG . . 4.630 3.151 1.933 4.044 . 0 0 "[ . 1 . 2]" 1
756 2 8 THR HA 2 8 THR MG . . 3.340 2.605 2.185 3.291 . 0 0 "[ . 1 . 2]" 1
757 2 8 THR HA 2 9 ILE H . . 2.960 2.492 2.202 3.028 0.068 15 0 "[ . 1 . 2]" 1
758 2 8 THR HB 2 9 ILE H . . 4.620 3.913 2.414 4.570 . 0 0 "[ . 1 . 2]" 1
759 2 8 THR MG 2 9 ILE H . . 4.540 3.469 1.898 4.359 . 0 0 "[ . 1 . 2]" 1
760 2 9 ILE H 2 9 ILE HB . . 3.800 3.174 2.267 3.845 0.045 1 0 "[ . 1 . 2]" 1
761 2 9 ILE H 2 9 ILE MD . . 4.250 3.188 2.032 4.193 . 0 0 "[ . 1 . 2]" 1
762 2 9 ILE H 2 9 ILE HG12 . . 4.470 3.170 2.059 4.368 . 0 0 "[ . 1 . 2]" 1
763 2 9 ILE H 2 9 ILE QG . . 3.710 2.550 2.047 3.797 0.087 11 0 "[ . 1 . 2]" 1
764 2 9 ILE H 2 9 ILE HG13 . . 4.470 3.316 2.167 4.530 0.060 2 0 "[ . 1 . 2]" 1
765 2 9 ILE H 2 9 ILE MG . . 4.290 3.231 1.939 4.128 . 0 0 "[ . 1 . 2]" 1
766 2 9 ILE HA 2 9 ILE MD . . 3.780 2.957 2.086 3.781 0.001 20 0 "[ . 1 . 2]" 1
767 2 9 ILE HA 2 10 VAL H . . 2.700 2.385 2.175 2.731 0.031 9 0 "[ . 1 . 2]" 1
768 2 9 ILE HB 2 10 VAL H . . 4.160 3.322 2.139 4.231 0.071 10 0 "[ . 1 . 2]" 1
769 2 9 ILE MD 2 10 VAL H . . 3.850 3.623 2.789 3.931 0.081 19 0 "[ . 1 . 2]" 1
770 2 9 ILE QG 2 10 VAL H . . 4.860 4.241 2.038 4.750 . 0 0 "[ . 1 . 2]" 1
771 2 9 ILE MG 2 10 VAL H . . 4.390 3.017 1.737 4.123 . 0 0 "[ . 1 . 2]" 1
772 2 10 VAL H 2 10 VAL HB . . 3.820 3.737 3.533 3.880 0.060 15 0 "[ . 1 . 2]" 1
773 2 10 VAL H 2 10 VAL QG . . 3.510 2.150 1.814 2.343 . 0 0 "[ . 1 . 2]" 1
774 2 10 VAL HA 2 10 VAL QG . . 3.100 2.260 2.179 2.320 . 0 0 "[ . 1 . 2]" 1
775 2 10 VAL HA 2 11 PRO HA . . 4.580 4.417 4.382 4.458 . 0 0 "[ . 1 . 2]" 1
776 2 10 VAL HA 2 11 PRO HD2 . . 2.950 2.554 2.248 2.767 . 0 0 "[ . 1 . 2]" 1
777 2 10 VAL HA 2 11 PRO HD3 . . 2.950 2.464 2.359 2.635 . 0 0 "[ . 1 . 2]" 1
778 2 10 VAL HB 2 11 PRO QD . . 3.390 2.209 2.026 2.686 . 0 0 "[ . 1 . 2]" 1
779 2 10 VAL QG 2 11 PRO QD . . 3.410 2.896 2.499 3.141 . 0 0 "[ . 1 . 2]" 1
780 2 11 PRO HB2 2 12 LYS H . . 4.240 2.982 1.894 3.820 . 0 0 "[ . 1 . 2]" 1
781 2 11 PRO HB3 2 12 LYS H . . 4.240 3.804 3.369 4.311 0.071 8 0 "[ . 1 . 2]" 1
782 2 12 LYS H 2 12 LYS HB2 . . 3.920 2.999 2.340 3.885 . 0 0 "[ . 1 . 2]" 1
783 2 12 LYS H 2 12 LYS QB . . 3.310 2.746 2.310 3.321 0.011 14 0 "[ . 1 . 2]" 1
784 2 12 LYS H 2 12 LYS HB3 . . 3.920 3.464 2.598 3.891 . 0 0 "[ . 1 . 2]" 1
785 2 12 LYS H 2 12 LYS HG2 . . 5.500 4.155 2.581 4.983 . 0 0 "[ . 1 . 2]" 1
786 2 12 LYS H 2 12 LYS QG . . 4.630 3.500 2.229 4.175 . 0 0 "[ . 1 . 2]" 1
787 2 12 LYS H 2 12 LYS HG3 . . 5.500 3.846 2.305 4.787 . 0 0 "[ . 1 . 2]" 1
788 2 12 LYS HA 2 13 GLU H . . 2.790 2.466 2.169 2.868 0.078 10 0 "[ . 1 . 2]" 1
789 2 12 LYS QB 2 13 GLU H . . 4.260 3.469 2.238 4.096 . 0 0 "[ . 1 . 2]" 1
790 2 12 LYS QG 2 13 GLU H . . 5.340 3.862 1.723 4.634 . 0 0 "[ . 1 . 2]" 1
791 2 13 GLU H 2 13 GLU HB2 . . 3.740 2.913 1.973 3.800 0.060 20 0 "[ . 1 . 2]" 1
792 2 13 GLU H 2 13 GLU QB . . 3.030 2.578 1.958 3.117 0.087 6 0 "[ . 1 . 2]" 1
793 2 13 GLU H 2 13 GLU HB3 . . 3.740 3.260 2.500 3.805 0.065 14 0 "[ . 1 . 2]" 1
794 2 13 GLU H 2 13 GLU HG2 . . 5.480 3.770 2.019 4.974 . 0 0 "[ . 1 . 2]" 1
795 2 13 GLU H 2 13 GLU QG . . 4.730 3.195 2.005 4.177 . 0 0 "[ . 1 . 2]" 1
796 2 13 GLU H 2 13 GLU HG3 . . 5.480 3.650 2.337 4.761 . 0 0 "[ . 1 . 2]" 1
797 2 13 GLU H 2 14 PRO QD . . 5.080 3.718 2.784 4.496 . 0 0 "[ . 1 . 2]" 1
798 2 13 GLU HA 2 13 GLU QG . . 3.730 2.570 2.120 3.391 . 0 0 "[ . 1 . 2]" 1
799 2 13 GLU HA 2 14 PRO HD2 . . 3.220 2.370 2.112 2.739 . 0 0 "[ . 1 . 2]" 1
800 2 13 GLU HA 2 14 PRO QD . . 2.800 2.169 2.036 2.326 . 0 0 "[ . 1 . 2]" 1
801 2 13 GLU HA 2 14 PRO HD3 . . 3.220 2.698 2.287 3.283 0.063 13 0 "[ . 1 . 2]" 1
802 2 13 GLU QG 2 14 PRO QD . . 4.180 3.500 2.127 4.282 0.102 16 0 "[ . 1 . 2]" 1
803 2 14 PRO QB 2 15 PRO QD . . 3.670 2.165 2.025 2.360 . 0 0 "[ . 1 . 2]" 1
804 2 15 PRO QB 2 16 PRO QD . . 3.980 2.237 2.040 3.023 . 0 0 "[ . 1 . 2]" 1
805 2 16 PRO HA 2 17 GLU H . . 2.830 2.352 2.123 2.660 . 0 0 "[ . 1 . 2]" 1
806 2 16 PRO HA 2 17 GLU QG . . 5.290 4.008 3.375 4.547 . 0 0 "[ . 1 . 2]" 1
807 2 16 PRO HA 2 18 PHE H . . 4.820 3.851 3.069 4.818 . 0 0 "[ . 1 . 2]" 1
808 2 16 PRO QB 2 17 GLU H . . 3.780 2.954 2.247 3.868 0.088 15 0 "[ . 1 . 2]" 1
809 2 16 PRO QB 2 18 PHE H . . 4.450 3.575 2.379 4.527 0.077 12 0 "[ . 1 . 2]" 1
810 2 16 PRO HB2 2 17 GLU H . . 4.480 3.118 2.279 4.248 . 0 0 "[ . 1 . 2]" 1
811 2 16 PRO HB3 2 17 GLU H . . 4.480 3.817 3.318 4.452 . 0 0 "[ . 1 . 2]" 1
812 2 16 PRO HD2 2 17 GLU H . . 5.500 5.376 4.641 5.562 0.062 2 0 "[ . 1 . 2]" 1
813 2 16 PRO HD3 2 17 GLU H . . 5.500 5.378 4.921 5.553 0.053 8 0 "[ . 1 . 2]" 1
814 2 17 GLU H 2 17 GLU HB2 . . 3.940 3.184 2.317 3.871 . 0 0 "[ . 1 . 2]" 1
815 2 17 GLU H 2 17 GLU QB . . 3.400 2.826 2.291 3.474 0.074 12 0 "[ . 1 . 2]" 1
816 2 17 GLU H 2 17 GLU HB3 . . 3.940 3.557 2.560 4.006 0.066 18 0 "[ . 1 . 2]" 1
817 2 17 GLU H 2 17 GLU QG . . 3.730 2.665 1.975 3.203 . 0 0 "[ . 1 . 2]" 1
818 2 17 GLU H 2 18 PHE H . . 3.580 2.793 2.123 3.641 0.061 10 0 "[ . 1 . 2]" 1
819 2 17 GLU HA 2 17 GLU QG . . 3.580 2.798 2.258 3.526 . 0 0 "[ . 1 . 2]" 1
820 2 17 GLU HA 2 18 PHE H . . 2.930 2.827 2.240 3.016 0.086 19 0 "[ . 1 . 2]" 1
821 2 17 GLU QB 2 18 PHE H . . 4.320 3.876 3.471 4.108 . 0 0 "[ . 1 . 2]" 1
822 2 18 PHE H 2 18 PHE HB2 . . 3.600 2.604 2.138 3.674 0.074 13 0 "[ . 1 . 2]" 1
823 2 18 PHE H 2 18 PHE QB . . 2.960 2.396 2.101 3.022 0.062 13 0 "[ . 1 . 2]" 1
824 2 18 PHE H 2 18 PHE HB3 . . 3.600 3.147 2.351 3.668 0.068 6 0 "[ . 1 . 2]" 1
825 2 18 PHE H 2 18 PHE QD . . 4.180 3.652 2.635 4.246 0.066 9 0 "[ . 1 . 2]" 1
826 2 18 PHE HA 2 18 PHE QD . . 3.880 2.886 2.082 3.817 . 0 0 "[ . 1 . 2]" 1
827 2 18 PHE HA 2 19 GLU H . . 3.030 2.557 2.136 3.102 0.072 7 0 "[ . 1 . 2]" 1
828 2 18 PHE QB 2 19 GLU H . . 3.850 3.137 2.466 3.933 0.083 13 0 "[ . 1 . 2]" 1
829 2 18 PHE HB2 2 19 GLU H . . 4.440 3.970 2.640 4.365 . 0 0 "[ . 1 . 2]" 1
830 2 18 PHE HB3 2 19 GLU H . . 4.440 3.411 2.495 4.496 0.056 13 0 "[ . 1 . 2]" 1
831 2 19 GLU H 2 19 GLU HB2 . . 3.970 3.116 2.079 3.916 . 0 0 "[ . 1 . 2]" 1
832 2 19 GLU H 2 19 GLU QB . . 3.220 2.688 2.035 3.189 . 0 0 "[ . 1 . 2]" 1
833 2 19 GLU H 2 19 GLU HB3 . . 3.970 3.264 2.384 3.901 . 0 0 "[ . 1 . 2]" 1
834 2 19 GLU H 2 19 GLU HG2 . . 4.490 3.549 1.877 4.565 0.075 7 0 "[ . 1 . 2]" 1
835 2 19 GLU H 2 19 GLU QG . . 3.920 3.055 1.864 4.005 0.085 3 0 "[ . 1 . 2]" 1
836 2 19 GLU H 2 19 GLU HG3 . . 4.490 3.631 2.570 4.541 0.051 3 0 "[ . 1 . 2]" 1
837 2 19 GLU HA 2 19 GLU QG . . 3.720 2.723 2.125 3.403 . 0 0 "[ . 1 . 2]" 1
838 2 19 GLU HA 2 20 PHE H . . 2.830 2.530 2.082 2.913 0.083 7 0 "[ . 1 . 2]" 1
839 2 19 GLU QB 2 20 PHE H . . 3.640 2.545 1.861 3.596 . 0 0 "[ . 1 . 2]" 1
840 2 19 GLU HB2 2 20 PHE H . . 4.320 3.223 2.089 4.385 0.065 12 0 "[ . 1 . 2]" 1
841 2 19 GLU HB3 2 20 PHE H . . 4.320 3.145 1.871 4.064 . 0 0 "[ . 1 . 2]" 1
842 2 19 GLU HG2 2 20 PHE H . . 4.650 3.629 1.667 4.709 0.059 19 0 "[ . 1 . 2]" 1
843 2 19 GLU HG3 2 20 PHE H . . 4.650 3.671 1.913 4.719 0.069 9 0 "[ . 1 . 2]" 1
844 2 20 PHE H 2 20 PHE HB2 . . 3.800 3.339 2.373 3.871 0.071 14 0 "[ . 1 . 2]" 1
845 2 20 PHE H 2 20 PHE QB . . 3.060 2.737 2.225 3.117 0.057 14 0 "[ . 1 . 2]" 1
846 2 20 PHE H 2 20 PHE HB3 . . 3.800 2.972 2.563 3.632 . 0 0 "[ . 1 . 2]" 1
847 2 20 PHE H 2 20 PHE QD . . 4.330 3.366 2.026 4.408 0.078 12 0 "[ . 1 . 2]" 1
848 2 20 PHE HA 2 20 PHE QD . . 4.010 3.224 2.309 3.802 . 0 0 "[ . 1 . 2]" 1
849 2 20 PHE HA 2 21 ILE H . . 2.950 2.408 2.118 2.722 . 0 0 "[ . 1 . 2]" 1
850 2 20 PHE HA 2 21 ILE HB . . 4.830 4.655 4.315 4.889 0.059 7 0 "[ . 1 . 2]" 1
851 2 20 PHE HB2 2 21 ILE H . . 4.140 3.316 2.365 4.228 0.088 12 0 "[ . 1 . 2]" 1
852 2 20 PHE HB3 2 21 ILE H . . 4.140 3.796 3.212 4.170 0.030 12 0 "[ . 1 . 2]" 1
853 2 20 PHE QD 2 21 ILE H . . 4.680 3.281 2.713 4.099 . 0 0 "[ . 1 . 2]" 1
854 2 20 PHE QD 2 22 ALA HA . . 4.750 4.150 3.323 4.785 0.035 3 0 "[ . 1 . 2]" 1
855 2 20 PHE QD 2 22 ALA MB . . 4.400 3.752 2.522 4.502 0.102 7 0 "[ . 1 . 2]" 1
856 2 21 ILE H 2 21 ILE HB . . 3.320 2.611 2.413 2.969 . 0 0 "[ . 1 . 2]" 1
857 2 21 ILE H 2 21 ILE MD . . 4.210 3.630 2.015 4.282 0.072 3 0 "[ . 1 . 2]" 1
858 2 21 ILE H 2 21 ILE HG12 . . 4.100 3.529 2.251 4.172 0.072 7 0 "[ . 1 . 2]" 1
859 2 21 ILE H 2 21 ILE QG . . 3.530 2.784 2.051 3.175 . 0 0 "[ . 1 . 2]" 1
860 2 21 ILE H 2 21 ILE HG13 . . 4.100 3.299 2.073 4.176 0.076 8 0 "[ . 1 . 2]" 1
861 2 21 ILE H 2 21 ILE MG . . 3.980 3.846 3.744 4.000 0.020 3 0 "[ . 1 . 2]" 1
862 2 21 ILE H 2 22 ALA H . . 4.640 4.355 4.018 4.672 0.032 4 0 "[ . 1 . 2]" 1
863 2 21 ILE HA 2 21 ILE MD . . 3.850 3.256 2.152 3.931 0.081 3 0 "[ . 1 . 2]" 1
864 2 21 ILE HA 2 21 ILE HG12 . . 3.780 2.916 2.391 3.635 . 0 0 "[ . 1 . 2]" 1
865 2 21 ILE HA 2 21 ILE QG . . 3.280 2.639 2.289 3.144 . 0 0 "[ . 1 . 2]" 1
866 2 21 ILE HA 2 21 ILE HG13 . . 3.780 3.242 2.473 3.849 0.069 1 0 "[ . 1 . 2]" 1
867 2 21 ILE HA 2 21 ILE MG . . 3.080 2.402 2.242 2.576 . 0 0 "[ . 1 . 2]" 1
868 2 21 ILE HA 2 22 ALA H . . 2.770 2.175 2.004 2.481 . 0 0 "[ . 1 . 2]" 1
869 2 21 ILE HA 2 22 ALA MB . . 4.000 3.940 3.839 4.007 0.007 14 0 "[ . 1 . 2]" 1
870 2 21 ILE HB 2 21 ILE MD . . 3.270 2.707 2.238 3.291 0.021 1 0 "[ . 1 . 2]" 1
871 2 21 ILE HB 2 22 ALA H . . 4.130 4.078 3.338 4.204 0.074 14 0 "[ . 1 . 2]" 1
872 2 21 ILE MD 2 22 ALA H . . 5.220 4.641 3.684 5.287 0.067 2 0 "[ . 1 . 2]" 1
873 2 21 ILE MD 2 24 PRO QB . . 4.080 3.688 2.413 4.174 0.094 17 0 "[ . 1 . 2]" 1
874 2 21 ILE QG 2 21 ILE MG . . 2.820 2.310 2.057 2.510 . 0 0 "[ . 1 . 2]" 1
875 2 21 ILE QG 2 22 ALA H . . 4.640 4.315 3.876 4.712 0.072 8 0 "[ . 1 . 2]" 1
876 2 21 ILE HG12 2 21 ILE MG . . 3.260 2.681 2.115 3.269 0.009 8 0 "[ . 1 . 2]" 1
877 2 21 ILE HG13 2 21 ILE MG . . 3.260 2.866 2.255 3.282 0.022 5 0 "[ . 1 . 2]" 1
878 2 21 ILE MG 2 22 ALA H . . 3.580 2.571 1.927 2.921 . 0 0 "[ . 1 . 2]" 1
879 2 21 ILE MG 2 22 ALA HA . . 4.920 3.925 3.483 4.260 . 0 0 "[ . 1 . 2]" 1
880 2 21 ILE MG 2 22 ALA MB . . 4.160 3.929 3.435 4.273 0.113 8 0 "[ . 1 . 2]" 1
881 2 21 ILE MG 2 23 ASP H . . 4.400 3.811 1.836 4.478 0.078 5 0 "[ . 1 . 2]" 1
882 2 21 ILE MG 2 24 PRO HA . . 4.130 2.876 2.190 4.210 0.080 8 0 "[ . 1 . 2]" 1
883 2 21 ILE MG 2 24 PRO HB2 . . 4.530 3.748 3.472 4.339 . 0 0 "[ . 1 . 2]" 1
884 2 21 ILE MG 2 24 PRO QB . . 3.820 2.368 2.097 2.980 . 0 0 "[ . 1 . 2]" 1
885 2 21 ILE MG 2 24 PRO HB3 . . 4.530 2.396 2.112 3.053 . 0 0 "[ . 1 . 2]" 1
886 2 21 ILE MG 2 24 PRO HD2 . . 4.690 4.111 3.212 4.717 0.027 5 0 "[ . 1 . 2]" 1
887 2 21 ILE MG 2 24 PRO QD . . 4.020 2.693 1.975 3.248 . 0 0 "[ . 1 . 2]" 1
888 2 21 ILE MG 2 24 PRO HD3 . . 4.690 2.734 1.991 3.310 . 0 0 "[ . 1 . 2]" 1
889 2 21 ILE MG 2 24 PRO QG . . 4.240 3.431 2.383 4.240 . 5 0 "[ . 1 . 2]" 1
890 2 22 ALA H 2 22 ALA MB . . 2.870 2.392 2.182 2.715 . 0 0 "[ . 1 . 2]" 1
891 2 22 ALA HA 2 23 ASP H . . 3.060 2.317 2.072 3.143 0.083 10 0 "[ . 1 . 2]" 1
892 2 22 ALA HA 2 23 ASP QB . . 4.950 4.382 4.018 4.806 . 0 0 "[ . 1 . 2]" 1
893 2 22 ALA MB 2 23 ASP H . . 3.640 3.288 2.881 3.689 0.049 4 0 "[ . 1 . 2]" 1
894 2 23 ASP H 2 23 ASP QB . . 3.430 2.959 2.543 3.305 . 0 0 "[ . 1 . 2]" 1
895 2 23 ASP H 2 24 PRO QD . . 4.370 2.790 2.438 3.365 . 0 0 "[ . 1 . 2]" 1
896 2 23 ASP HA 2 24 PRO HD2 . . 3.430 2.202 2.069 2.367 . 0 0 "[ . 1 . 2]" 1
897 2 23 ASP HA 2 24 PRO QD . . 3.000 2.147 2.034 2.308 . 0 0 "[ . 1 . 2]" 1
898 2 23 ASP HA 2 24 PRO HD3 . . 3.430 3.002 2.644 3.244 . 0 0 "[ . 1 . 2]" 1
899 2 23 ASP QB 2 24 PRO QD . . 3.900 3.871 3.736 3.944 0.044 9 0 "[ . 1 . 2]" 1
900 2 23 ASP HB2 2 24 PRO HD2 . . 5.260 4.794 4.515 5.016 . 0 0 "[ . 1 . 2]" 1
901 2 23 ASP HB2 2 24 PRO HD3 . . 5.260 5.088 4.986 5.251 . 0 0 "[ . 1 . 2]" 1
902 2 23 ASP HB3 2 24 PRO HD2 . . 5.260 4.711 4.249 5.052 . 0 0 "[ . 1 . 2]" 1
903 2 23 ASP HB3 2 24 PRO HD3 . . 5.260 5.107 4.910 5.216 . 0 0 "[ . 1 . 2]" 1
904 2 24 PRO HA 2 25 PRO HD2 . . 3.200 2.553 2.327 2.800 . 0 0 "[ . 1 . 2]" 1
905 2 24 PRO HA 2 25 PRO QD . . 2.740 2.211 2.081 2.331 . 0 0 "[ . 1 . 2]" 1
906 2 24 PRO HA 2 25 PRO HD3 . . 3.200 2.433 2.221 2.580 . 0 0 "[ . 1 . 2]" 1
907 2 24 PRO HA 2 25 PRO HG2 . . 5.430 4.685 4.496 4.885 . 0 0 "[ . 1 . 2]" 1
908 2 24 PRO HA 2 25 PRO QG . . 4.660 4.159 4.011 4.309 . 0 0 "[ . 1 . 2]" 1
909 2 24 PRO HA 2 25 PRO HG3 . . 5.430 4.655 4.464 4.791 . 0 0 "[ . 1 . 2]" 1
910 2 24 PRO QB 2 25 PRO QD . . 3.520 2.331 2.080 2.790 . 0 0 "[ . 1 . 2]" 1
911 2 25 PRO HA 2 26 SER QB . . 5.020 4.715 4.334 5.101 0.081 3 0 "[ . 1 . 2]" 1
912 2 25 PRO QB 2 26 SER H . . 3.880 3.197 2.003 3.855 . 0 0 "[ . 1 . 2]" 1
913 2 25 PRO QB 2 26 SER QB . . 4.390 3.670 3.068 4.450 0.060 14 0 "[ . 1 . 2]" 1
914 2 25 PRO HB2 2 26 SER H . . 4.460 3.365 2.018 4.180 . 0 0 "[ . 1 . 2]" 1
915 2 25 PRO HB3 2 26 SER H . . 4.460 4.065 3.364 4.528 0.068 11 0 "[ . 1 . 2]" 1
916 2 25 PRO QG 2 26 SER H . . 4.510 3.484 2.274 4.584 0.074 2 0 "[ . 1 . 2]" 1
917 2 25 PRO QG 2 26 SER QB . . 4.840 3.743 3.122 4.609 . 0 0 "[ . 1 . 2]" 1
918 2 26 SER H 2 26 SER QB . . 3.510 2.933 2.224 3.487 . 0 0 "[ . 1 . 2]" 1
919 2 26 SER H 2 27 ILE H . . 4.490 4.389 4.125 4.563 0.073 17 0 "[ . 1 . 2]" 1
920 2 26 SER HA 2 27 ILE H . . 3.420 2.521 2.050 3.040 . 0 0 "[ . 1 . 2]" 1
921 2 26 SER HA 2 27 ILE MG . . 5.060 4.095 3.479 4.349 . 0 0 "[ . 1 . 2]" 1
922 2 26 SER QB 2 27 ILE H . . 3.950 2.667 1.940 3.669 . 0 0 "[ . 1 . 2]" 1
923 2 26 SER QB 2 27 ILE HA . . 5.340 4.576 4.265 4.934 . 0 0 "[ . 1 . 2]" 1
924 2 27 ILE H 2 27 ILE HB . . 3.720 2.602 2.271 3.212 . 0 0 "[ . 1 . 2]" 1
925 2 27 ILE H 2 27 ILE MD . . 4.850 4.403 4.169 4.810 . 0 0 "[ . 1 . 2]" 1
926 2 27 ILE H 2 27 ILE HG12 . . 4.700 4.490 4.377 4.615 . 0 0 "[ . 1 . 2]" 1
927 2 27 ILE H 2 27 ILE QG . . 4.110 3.985 3.849 4.164 0.054 17 0 "[ . 1 . 2]" 1
928 2 27 ILE H 2 27 ILE HG13 . . 4.700 4.461 4.269 4.739 0.039 17 0 "[ . 1 . 2]" 1
929 2 27 ILE H 2 27 ILE MG . . 3.730 2.077 1.925 2.404 . 0 0 "[ . 1 . 2]" 1
930 2 27 ILE H 2 28 SER H . . 4.780 4.592 4.391 4.696 . 0 0 "[ . 1 . 2]" 1
931 2 27 ILE H 2 72 LEU MD2 . . 5.170 4.675 4.037 5.266 0.096 19 0 "[ . 1 . 2]" 1
932 2 27 ILE HA 2 27 ILE MD . . 3.760 3.796 3.733 3.826 0.066 16 0 "[ . 1 . 2]" 1
933 2 27 ILE HA 2 27 ILE HG12 . . 4.120 3.051 2.728 3.212 . 0 0 "[ . 1 . 2]" 1
934 2 27 ILE HA 2 27 ILE HG13 . . 4.120 2.431 2.378 2.475 . 0 0 "[ . 1 . 2]" 1
935 2 27 ILE HA 2 27 ILE MG . . 3.220 3.258 3.230 3.277 0.057 3 0 "[ . 1 . 2]" 1
936 2 27 ILE HA 2 28 SER H . . 3.160 2.340 2.233 2.445 . 0 0 "[ . 1 . 2]" 1
937 2 27 ILE HB 2 27 ILE MD . . 3.580 2.359 2.271 2.515 . 0 0 "[ . 1 . 2]" 1
938 2 27 ILE HB 2 28 SER H . . 4.080 4.129 4.101 4.152 0.072 15 0 "[ . 1 . 2]" 1
939 2 27 ILE HB 2 31 ASP HB2 . . 4.880 4.902 4.764 4.950 0.070 13 0 "[ . 1 . 2]" 1
940 2 27 ILE HB 2 72 LEU MD2 . . 4.330 2.714 2.317 3.110 . 0 0 "[ . 1 . 2]" 1
941 2 27 ILE MD 2 27 ILE MG . . 3.000 2.075 2.036 2.104 . 0 0 "[ . 1 . 2]" 1
942 2 27 ILE MD 2 28 SER H . . 4.490 4.035 3.916 4.198 . 0 0 "[ . 1 . 2]" 1
943 2 27 ILE MD 2 31 ASP HB2 . . 4.490 2.893 2.435 3.255 . 0 0 "[ . 1 . 2]" 1
944 2 27 ILE MD 2 31 ASP HB3 . . 4.150 2.199 2.050 2.474 . 0 0 "[ . 1 . 2]" 1
945 2 27 ILE MD 2 32 LEU H . . 4.700 3.210 3.027 3.426 . 0 0 "[ . 1 . 2]" 1
946 2 27 ILE MD 2 32 LEU HA . . 3.550 2.230 2.074 2.493 . 0 0 "[ . 1 . 2]" 1
947 2 27 ILE MD 2 32 LEU HB2 . . 4.000 3.168 2.639 3.546 . 0 0 "[ . 1 . 2]" 1
948 2 27 ILE MD 2 35 VAL H . . 4.840 4.280 4.039 4.603 . 0 0 "[ . 1 . 2]" 1
949 2 27 ILE MD 2 35 VAL MG2 . . 3.990 2.510 2.119 2.822 . 0 0 "[ . 1 . 2]" 1
950 2 27 ILE MD 2 70 HIS HE1 . . 5.460 4.985 4.463 5.536 0.076 1 0 "[ . 1 . 2]" 1
951 2 27 ILE MD 2 72 LEU HB3 . . 4.500 3.818 3.463 4.117 . 0 0 "[ . 1 . 2]" 1
952 2 27 ILE MD 2 72 LEU MD1 . . 3.320 2.027 1.907 2.256 . 0 0 "[ . 1 . 2]" 1
953 2 27 ILE MD 2 72 LEU HG . . 4.320 3.938 3.760 4.166 . 0 0 "[ . 1 . 2]" 1
954 2 27 ILE MD 2 75 TYR QD . . 4.570 4.032 2.981 4.629 0.059 17 0 "[ . 1 . 2]" 1
955 2 27 ILE MD 2 75 TYR QE . . 4.560 3.967 2.942 4.637 0.077 17 0 "[ . 1 . 2]" 1
956 2 27 ILE QG 2 28 SER H . . 3.620 2.307 2.151 2.463 . 0 0 "[ . 1 . 2]" 1
957 2 27 ILE QG 2 31 ASP HB2 . . 4.350 2.067 2.018 2.146 . 0 0 "[ . 1 . 2]" 1
958 2 27 ILE QG 2 72 LEU MD1 . . 4.100 2.842 2.458 3.199 . 0 0 "[ . 1 . 2]" 1
959 2 27 ILE HG12 2 27 ILE MG . . 3.400 2.361 2.274 2.622 . 0 0 "[ . 1 . 2]" 1
960 2 27 ILE HG12 2 31 ASP HB2 . . 4.980 2.134 2.053 2.202 . 0 0 "[ . 1 . 2]" 1
961 2 27 ILE HG13 2 27 ILE MG . . 3.400 3.223 3.202 3.252 . 0 0 "[ . 1 . 2]" 1
962 2 27 ILE HG13 2 31 ASP HB2 . . 4.980 2.808 2.496 3.333 . 0 0 "[ . 1 . 2]" 1
963 2 27 ILE MG 2 28 SER H . . 3.690 3.620 3.447 3.731 0.041 9 0 "[ . 1 . 2]" 1
964 2 27 ILE MG 2 28 SER HA . . 4.920 4.323 4.140 4.441 . 0 0 "[ . 1 . 2]" 1
965 2 27 ILE MG 2 31 ASP H . . 5.190 5.218 4.957 5.282 0.092 9 0 "[ . 1 . 2]" 1
966 2 27 ILE MG 2 31 ASP HB2 . . 4.000 4.047 3.818 4.093 0.093 14 0 "[ . 1 . 2]" 1
967 2 27 ILE MG 2 31 ASP HB3 . . 4.610 4.610 4.247 4.687 0.077 7 0 "[ . 1 . 2]" 1
968 2 27 ILE MG 2 32 LEU H . . 4.190 3.440 3.158 3.571 . 0 0 "[ . 1 . 2]" 1
969 2 27 ILE MG 2 32 LEU HA . . 4.040 3.142 2.672 3.475 . 0 0 "[ . 1 . 2]" 1
970 2 28 SER H 2 28 SER HB2 . . 4.100 3.045 2.355 3.713 . 0 0 "[ . 1 . 2]" 1
971 2 28 SER H 2 28 SER QB . . 3.510 2.542 2.324 2.752 . 0 0 "[ . 1 . 2]" 1
972 2 28 SER H 2 28 SER HB3 . . 4.100 3.134 2.489 3.623 . 0 0 "[ . 1 . 2]" 1
973 2 28 SER H 2 31 ASP HB2 . . 4.460 2.829 2.381 3.590 . 0 0 "[ . 1 . 2]" 1
974 2 28 SER H 2 31 ASP HB3 . . 5.360 4.294 3.731 5.221 . 0 0 "[ . 1 . 2]" 1
975 2 28 SER HA 2 29 ALA H . . 3.460 2.382 2.263 2.489 . 0 0 "[ . 1 . 2]" 1
976 2 28 SER HA 2 29 ALA MB . . 4.160 4.142 4.048 4.226 0.066 8 0 "[ . 1 . 2]" 1
977 2 28 SER HA 2 30 PHE H . . 4.930 4.151 3.918 4.478 . 0 0 "[ . 1 . 2]" 1
978 2 28 SER QB 2 29 ALA H . . 3.530 2.723 2.518 2.947 . 0 0 "[ . 1 . 2]" 1
979 2 28 SER QB 2 29 ALA MB . . 4.220 4.029 3.756 4.255 0.035 10 0 "[ . 1 . 2]" 1
980 2 28 SER QB 2 30 PHE QB . . 4.460 3.089 2.565 3.305 . 0 0 "[ . 1 . 2]" 1
981 2 28 SER QB 2 31 ASP H . . 4.670 3.015 2.104 3.886 . 0 0 "[ . 1 . 2]" 1
982 2 28 SER QB 2 31 ASP HB2 . . 5.110 3.505 2.492 4.629 . 0 0 "[ . 1 . 2]" 1
983 2 28 SER HB2 2 29 ALA H . . 4.120 3.262 2.560 4.060 . 0 0 "[ . 1 . 2]" 1
984 2 28 SER HB2 2 30 PHE H . . 4.430 3.004 2.518 3.687 . 0 0 "[ . 1 . 2]" 1
985 2 28 SER HB3 2 29 ALA H . . 4.120 3.410 2.633 4.134 0.014 10 0 "[ . 1 . 2]" 1
986 2 28 SER HB3 2 30 PHE H . . 4.430 3.646 2.857 4.439 0.009 4 0 "[ . 1 . 2]" 1
987 2 29 ALA H 2 29 ALA MB . . 3.240 2.218 2.162 2.283 . 0 0 "[ . 1 . 2]" 1
988 2 29 ALA H 2 30 PHE H . . 4.100 2.724 2.469 2.988 . 0 0 "[ . 1 . 2]" 1
989 2 29 ALA HA 2 32 LEU H . . 4.460 3.564 3.376 3.735 . 0 0 "[ . 1 . 2]" 1
990 2 29 ALA HA 2 32 LEU HB3 . . 3.640 2.434 2.318 2.630 . 0 0 "[ . 1 . 2]" 1
991 2 29 ALA HA 2 32 LEU MD1 . . 4.690 4.666 4.225 4.767 0.077 11 0 "[ . 1 . 2]" 1
992 2 29 ALA HA 2 32 LEU MD2 . . 3.690 2.750 2.523 2.926 . 0 0 "[ . 1 . 2]" 1
993 2 29 ALA HA 2 32 LEU HG . . 4.530 4.556 4.415 4.602 0.072 5 0 "[ . 1 . 2]" 1
994 2 29 ALA HA 2 33 ASP H . . 4.860 4.138 3.891 4.399 . 0 0 "[ . 1 . 2]" 1
995 2 29 ALA MB 2 30 PHE H . . 3.530 2.803 2.458 3.075 . 0 0 "[ . 1 . 2]" 1
996 2 29 ALA MB 2 30 PHE HA . . 4.780 3.969 3.849 4.099 . 0 0 "[ . 1 . 2]" 1
997 2 29 ALA MB 2 30 PHE QB . . 4.330 3.923 3.675 4.116 . 0 0 "[ . 1 . 2]" 1
998 2 29 ALA MB 2 32 LEU MD2 . . 4.060 3.519 3.198 3.740 . 0 0 "[ . 1 . 2]" 1
999 2 30 PHE H 2 30 PHE HB2 . . 3.630 2.399 2.318 2.503 . 0 0 "[ . 1 . 2]" 1
1000 2 30 PHE H 2 30 PHE QB . . 3.110 2.179 2.128 2.226 . 0 0 "[ . 1 . 2]" 1
1001 2 30 PHE H 2 30 PHE HB3 . . 3.630 2.507 2.381 2.677 . 0 0 "[ . 1 . 2]" 1
1002 2 30 PHE H 2 30 PHE QD . . 4.530 4.229 4.180 4.281 . 0 0 "[ . 1 . 2]" 1
1003 2 30 PHE H 2 31 ASP H . . 3.820 2.761 2.517 2.945 . 0 0 "[ . 1 . 2]" 1
1004 2 30 PHE HA 2 30 PHE QD . . 3.860 3.168 2.934 3.273 . 0 0 "[ . 1 . 2]" 1
1005 2 30 PHE HA 2 33 ASP H . . 4.490 3.801 3.583 3.944 . 0 0 "[ . 1 . 2]" 1
1006 2 30 PHE HA 2 33 ASP HB2 . . 4.780 4.232 3.397 4.578 . 0 0 "[ . 1 . 2]" 1
1007 2 30 PHE HA 2 33 ASP HB3 . . 4.490 3.670 3.310 3.937 . 0 0 "[ . 1 . 2]" 1
1008 2 30 PHE QB 2 31 ASP H . . 3.480 2.167 1.989 2.293 . 0 0 "[ . 1 . 2]" 1
1009 2 30 PHE QD 2 31 ASP H . . 4.540 3.351 3.041 3.797 . 0 0 "[ . 1 . 2]" 1
1010 2 30 PHE QD 2 31 ASP HA . . 4.660 2.960 2.670 3.518 . 0 0 "[ . 1 . 2]" 1
1011 2 30 PHE QD 2 33 ASP HB3 . . 5.150 4.973 3.968 5.229 0.079 6 0 "[ . 1 . 2]" 1
1012 2 30 PHE QD 2 34 VAL H . . 5.260 3.960 3.725 4.192 . 0 0 "[ . 1 . 2]" 1
1013 2 30 PHE QD 2 34 VAL MG2 . . 3.880 2.255 2.108 2.501 . 0 0 "[ . 1 . 2]" 1
1014 2 30 PHE HE1 2 34 VAL MG1 . . 4.210 4.038 3.664 4.273 0.063 16 0 "[ . 1 . 2]" 1
1015 2 30 PHE HE1 2 34 VAL MG2 . . 4.290 2.266 2.103 2.418 . 0 0 "[ . 1 . 2]" 1
1016 2 30 PHE HZ 2 34 VAL MG2 . . 4.400 4.248 4.094 4.425 0.025 11 0 "[ . 1 . 2]" 1
1017 2 31 ASP H 2 31 ASP HB2 . . 3.800 2.380 2.287 2.530 . 0 0 "[ . 1 . 2]" 1
1018 2 31 ASP H 2 31 ASP HB3 . . 4.040 3.560 3.493 3.610 . 0 0 "[ . 1 . 2]" 1
1019 2 31 ASP H 2 32 LEU H . . 3.920 2.759 2.658 2.876 . 0 0 "[ . 1 . 2]" 1
1020 2 31 ASP H 2 34 VAL MG2 . . 4.900 4.520 4.178 4.762 . 0 0 "[ . 1 . 2]" 1
1021 2 31 ASP HA 2 34 VAL H . . 4.260 3.341 2.958 3.610 . 0 0 "[ . 1 . 2]" 1
1022 2 31 ASP HA 2 34 VAL HB . . 3.920 2.411 2.142 2.725 . 0 0 "[ . 1 . 2]" 1
1023 2 31 ASP HA 2 34 VAL MG1 . . 4.290 3.722 3.475 4.050 . 0 0 "[ . 1 . 2]" 1
1024 2 31 ASP HA 2 34 VAL MG2 . . 3.920 3.046 2.457 3.359 . 0 0 "[ . 1 . 2]" 1
1025 2 31 ASP HA 2 35 VAL H . . 4.670 4.031 3.731 4.720 0.050 19 0 "[ . 1 . 2]" 1
1026 2 31 ASP HA 2 62 GLN HE21 . . 4.990 4.338 3.472 5.045 0.055 16 0 "[ . 1 . 2]" 1
1027 2 31 ASP HA 2 62 GLN QE . . 4.260 3.600 2.873 4.191 . 0 0 "[ . 1 . 2]" 1
1028 2 31 ASP HA 2 62 GLN HE22 . . 4.990 4.073 3.029 5.061 0.071 13 0 "[ . 1 . 2]" 1
1029 2 31 ASP HA 2 72 LEU MD1 . . 5.500 5.336 4.725 5.584 0.084 17 0 "[ . 1 . 2]" 1
1030 2 31 ASP HB2 2 32 LEU H . . 4.100 2.760 2.558 3.144 . 0 0 "[ . 1 . 2]" 1
1031 2 31 ASP HB2 2 72 LEU MD1 . . 4.790 4.422 3.997 4.832 0.042 3 0 "[ . 1 . 2]" 1
1032 2 31 ASP HB3 2 32 LEU H . . 4.400 3.571 3.327 3.919 . 0 0 "[ . 1 . 2]" 1
1033 2 31 ASP HB3 2 35 VAL MG2 . . 4.450 3.415 3.006 3.842 . 0 0 "[ . 1 . 2]" 1
1034 2 31 ASP HB3 2 72 LEU MD1 . . 4.110 3.473 2.895 3.777 . 0 0 "[ . 1 . 2]" 1
1035 2 32 LEU H 2 32 LEU HB2 . . 3.660 2.498 2.364 2.618 . 0 0 "[ . 1 . 2]" 1
1036 2 32 LEU H 2 32 LEU HB3 . . 3.800 2.398 2.225 2.543 . 0 0 "[ . 1 . 2]" 1
1037 2 32 LEU H 2 32 LEU MD1 . . 4.220 4.127 4.008 4.211 . 0 0 "[ . 1 . 2]" 1
1038 2 32 LEU H 2 32 LEU MD2 . . 4.220 4.153 4.009 4.275 0.055 12 0 "[ . 1 . 2]" 1
1039 2 32 LEU H 2 32 LEU HG . . 4.450 4.425 4.334 4.483 0.033 12 0 "[ . 1 . 2]" 1
1040 2 32 LEU H 2 33 ASP H . . 3.650 2.858 2.731 2.974 . 0 0 "[ . 1 . 2]" 1
1041 2 32 LEU HA 2 32 LEU MD1 . . 3.280 2.229 2.147 2.364 . 0 0 "[ . 1 . 2]" 1
1042 2 32 LEU HA 2 32 LEU MD2 . . 3.950 3.932 3.880 4.002 0.052 16 0 "[ . 1 . 2]" 1
1043 2 32 LEU HA 2 32 LEU HG . . 4.030 3.211 3.138 3.304 . 0 0 "[ . 1 . 2]" 1
1044 2 32 LEU HA 2 35 VAL H . . 4.300 3.758 3.548 3.982 . 0 0 "[ . 1 . 2]" 1
1045 2 32 LEU HA 2 35 VAL HB . . 3.790 3.091 2.782 3.524 . 0 0 "[ . 1 . 2]" 1
1046 2 32 LEU HA 2 35 VAL MG1 . . 5.120 4.330 3.904 4.919 . 0 0 "[ . 1 . 2]" 1
1047 2 32 LEU HA 2 35 VAL MG2 . . 3.470 3.476 3.148 3.548 0.078 6 0 "[ . 1 . 2]" 1
1048 2 32 LEU HA 2 72 LEU MD1 . . 5.500 4.907 4.562 5.453 . 0 0 "[ . 1 . 2]" 1
1049 2 32 LEU HA 2 75 TYR QE . . 4.850 3.764 2.929 4.391 . 0 0 "[ . 1 . 2]" 1
1050 2 32 LEU HB2 2 32 LEU MD1 . . 3.280 2.358 2.256 2.450 . 0 0 "[ . 1 . 2]" 1
1051 2 32 LEU HB2 2 32 LEU MD2 . . 3.370 2.406 2.330 2.467 . 0 0 "[ . 1 . 2]" 1
1052 2 32 LEU HB2 2 75 TYR QE . . 5.500 5.342 4.851 5.577 0.077 8 0 "[ . 1 . 2]" 1
1053 2 32 LEU HB3 2 33 ASP H . . 3.610 2.422 2.325 2.516 . 0 0 "[ . 1 . 2]" 1
1054 2 32 LEU MD1 2 33 ASP H . . 4.700 4.392 4.233 4.519 . 0 0 "[ . 1 . 2]" 1
1055 2 32 LEU MD1 2 33 ASP HA . . 5.500 4.555 4.243 4.978 . 0 0 "[ . 1 . 2]" 1
1056 2 32 LEU MD1 2 33 ASP HB2 . . 5.480 5.504 5.332 5.572 0.092 15 0 "[ . 1 . 2]" 1
1057 2 32 LEU MD1 2 35 VAL HB . . 4.670 3.707 3.388 4.097 . 0 0 "[ . 1 . 2]" 1
1058 2 32 LEU MD1 2 35 VAL MG2 . . 4.320 4.358 4.164 4.424 0.104 1 0 "[ . 1 . 2]" 1
1059 2 32 LEU MD1 2 36 LYS QD . . 4.070 3.096 2.065 4.125 0.055 2 0 "[ . 1 . 2]" 1
1060 2 32 LEU MD1 2 36 LYS QE . . 3.920 2.716 1.958 4.004 0.084 12 0 "[ . 1 . 2]" 1
1061 2 32 LEU MD1 2 36 LYS HG3 . . 5.180 3.274 2.683 4.395 . 0 0 "[ . 1 . 2]" 1
1062 2 32 LEU MD1 2 75 TYR QD . . 4.920 4.218 3.694 4.482 . 0 0 "[ . 1 . 2]" 1
1063 2 32 LEU MD1 2 75 TYR QE . . 3.820 2.562 2.263 2.851 . 0 0 "[ . 1 . 2]" 1
1064 2 32 LEU MD2 2 33 ASP H . . 4.600 3.912 3.759 4.084 . 0 0 "[ . 1 . 2]" 1
1065 2 32 LEU MD2 2 33 ASP HA . . 4.900 4.567 4.392 4.784 . 0 0 "[ . 1 . 2]" 1
1066 2 32 LEU MD2 2 33 ASP HB2 . . 4.420 4.279 4.188 4.491 0.071 20 0 "[ . 1 . 2]" 1
1067 2 32 LEU MD2 2 33 ASP HB3 . . 5.500 5.576 5.559 5.587 0.087 14 0 "[ . 1 . 2]" 1
1068 2 32 LEU MD2 2 36 LYS QE . . 4.180 3.381 2.289 4.245 0.065 12 0 "[ . 1 . 2]" 1
1069 2 32 LEU HG 2 33 ASP H . . 4.870 3.436 3.184 3.701 . 0 0 "[ . 1 . 2]" 1
1070 2 32 LEU HG 2 36 LYS QE . . 4.490 3.316 2.177 4.227 . 0 0 "[ . 1 . 2]" 1
1071 2 32 LEU HG 2 75 TYR QE . . 5.500 4.744 4.035 5.123 . 0 0 "[ . 1 . 2]" 1
1072 2 33 ASP H 2 33 ASP HB2 . . 3.690 2.392 2.243 2.555 . 0 0 "[ . 1 . 2]" 1
1073 2 33 ASP H 2 33 ASP HB3 . . 3.410 2.674 2.471 2.863 . 0 0 "[ . 1 . 2]" 1
1074 2 33 ASP H 2 34 VAL MG2 . . 4.410 4.259 4.053 4.423 0.013 6 0 "[ . 1 . 2]" 1
1075 2 33 ASP HA 2 36 LYS H . . 4.620 3.257 2.997 3.564 . 0 0 "[ . 1 . 2]" 1
1076 2 33 ASP HA 2 36 LYS HB2 . . 4.280 2.377 2.068 2.704 . 0 0 "[ . 1 . 2]" 1
1077 2 33 ASP HA 2 36 LYS HD2 . . 4.700 3.193 2.326 4.742 0.042 8 0 "[ . 1 . 2]" 1
1078 2 33 ASP HA 2 36 LYS QD . . 4.020 2.835 2.291 3.589 . 0 0 "[ . 1 . 2]" 1
1079 2 33 ASP HA 2 36 LYS HD3 . . 4.700 3.704 2.447 4.744 0.044 11 0 "[ . 1 . 2]" 1
1080 2 33 ASP HB2 2 34 VAL H . . 4.540 3.931 3.711 4.112 . 0 0 "[ . 1 . 2]" 1
1081 2 33 ASP HB3 2 34 VAL H . . 4.370 2.879 2.575 3.128 . 0 0 "[ . 1 . 2]" 1
1082 2 33 ASP HB3 2 34 VAL HA . . 5.190 4.327 4.166 4.542 . 0 0 "[ . 1 . 2]" 1
1083 2 34 VAL H 2 34 VAL HB . . 3.390 2.384 2.223 2.626 . 0 0 "[ . 1 . 2]" 1
1084 2 34 VAL H 2 34 VAL MG1 . . 3.830 3.768 3.700 3.840 0.010 15 0 "[ . 1 . 2]" 1
1085 2 34 VAL H 2 34 VAL MG2 . . 3.140 2.305 2.111 2.480 . 0 0 "[ . 1 . 2]" 1
1086 2 34 VAL H 2 35 VAL H . . 3.800 2.759 2.648 2.856 . 0 0 "[ . 1 . 2]" 1
1087 2 34 VAL H 2 35 VAL MG2 . . 4.290 4.339 4.233 4.377 0.087 9 0 "[ . 1 . 2]" 1
1088 2 34 VAL H 2 36 LYS H . . 5.150 4.269 4.160 4.423 . 0 0 "[ . 1 . 2]" 1
1089 2 34 VAL HA 2 34 VAL MG1 . . 3.230 2.561 2.205 2.702 . 0 0 "[ . 1 . 2]" 1
1090 2 34 VAL HA 2 34 VAL MG2 . . 3.180 2.327 2.244 2.443 . 0 0 "[ . 1 . 2]" 1
1091 2 34 VAL HA 2 37 LEU H . . 4.450 3.619 3.327 3.903 . 0 0 "[ . 1 . 2]" 1
1092 2 34 VAL HA 2 37 LEU HB2 . . 4.230 3.374 2.975 3.903 . 0 0 "[ . 1 . 2]" 1
1093 2 34 VAL HA 2 37 LEU HB3 . . 3.950 2.811 2.443 3.997 0.047 19 0 "[ . 1 . 2]" 1
1094 2 34 VAL HA 2 37 LEU MD1 . . 4.350 3.128 2.675 3.896 . 0 0 "[ . 1 . 2]" 1
1095 2 34 VAL HA 2 37 LEU MD2 . . 5.500 4.884 4.369 5.571 0.071 19 0 "[ . 1 . 2]" 1
1096 2 34 VAL HA 2 38 THR H . . 4.470 3.882 3.636 4.226 . 0 0 "[ . 1 . 2]" 1
1097 2 34 VAL HB 2 35 VAL H . . 3.950 2.747 2.588 3.754 . 0 0 "[ . 1 . 2]" 1
1098 2 34 VAL HB 2 35 VAL MG2 . . 4.210 3.438 3.239 3.851 . 0 0 "[ . 1 . 2]" 1
1099 2 34 VAL MG1 2 35 VAL H . . 3.970 3.331 3.074 4.059 0.089 19 0 "[ . 1 . 2]" 1
1100 2 34 VAL MG1 2 35 VAL HA . . 4.160 3.505 3.307 4.046 . 0 0 "[ . 1 . 2]" 1
1101 2 34 VAL MG1 2 35 VAL MG2 . . 3.940 3.343 3.081 3.843 . 0 0 "[ . 1 . 2]" 1
1102 2 34 VAL MG1 2 37 LEU HB3 . . 4.720 4.100 3.521 4.776 0.056 19 0 "[ . 1 . 2]" 1
1103 2 34 VAL MG1 2 38 THR H . . 4.530 4.138 3.701 4.619 0.089 19 0 "[ . 1 . 2]" 1
1104 2 34 VAL MG1 2 38 THR HG1 . . 3.680 3.017 2.645 3.730 0.050 19 0 "[ . 1 . 2]" 1
1105 2 34 VAL MG1 2 38 THR MG . . 5.500 4.410 4.050 4.982 . 0 0 "[ . 1 . 2]" 1
1106 2 34 VAL MG1 2 62 GLN HB3 . . 4.830 4.700 3.750 4.917 0.087 15 0 "[ . 1 . 2]" 1
1107 2 34 VAL MG1 2 62 GLN QE . . 3.560 2.842 1.694 3.665 0.105 4 0 "[ . 1 . 2]" 1
1108 2 34 VAL MG1 2 62 GLN QG . . 5.080 4.444 3.728 5.107 0.027 2 0 "[ . 1 . 2]" 1
1109 2 34 VAL MG1 2 63 PHE HA . . 4.810 4.690 4.363 4.899 0.089 19 0 "[ . 1 . 2]" 1
1110 2 34 VAL MG1 2 63 PHE QE . . 4.530 4.009 3.077 4.574 0.044 20 0 "[ . 1 . 2]" 1
1111 2 34 VAL MG1 2 63 PHE HZ . . 4.850 4.411 3.701 4.795 . 0 0 "[ . 1 . 2]" 1
1112 2 34 VAL MG1 2 65 PHE QE . . 3.360 2.517 2.129 3.104 . 0 0 "[ . 1 . 2]" 1
1113 2 34 VAL MG1 2 65 PHE HZ . . 3.560 2.799 2.290 3.647 0.087 14 0 "[ . 1 . 2]" 1
1114 2 34 VAL MG2 2 35 VAL H . . 4.290 4.038 3.930 4.328 0.038 19 0 "[ . 1 . 2]" 1
1115 2 34 VAL MG2 2 62 GLN HE21 . . 4.900 3.976 2.623 4.981 0.081 16 0 "[ . 1 . 2]" 1
1116 2 34 VAL MG2 2 62 GLN QE . . 4.210 3.044 2.134 3.626 . 0 0 "[ . 1 . 2]" 1
1117 2 34 VAL MG2 2 62 GLN HE22 . . 4.900 3.210 2.260 3.737 . 0 0 "[ . 1 . 2]" 1
1118 2 34 VAL MG2 2 62 GLN QG . . 5.240 4.835 4.265 5.325 0.085 4 0 "[ . 1 . 2]" 1
1119 2 34 VAL MG2 2 65 PHE QE . . 5.340 4.831 4.513 5.420 0.080 14 0 "[ . 1 . 2]" 1
1120 2 35 VAL H 2 35 VAL HB . . 3.550 2.407 2.178 2.706 . 0 0 "[ . 1 . 2]" 1
1121 2 35 VAL H 2 35 VAL MG1 . . 3.890 3.757 3.649 3.938 0.048 19 0 "[ . 1 . 2]" 1
1122 2 35 VAL H 2 35 VAL MG2 . . 3.150 2.250 2.154 2.645 . 0 0 "[ . 1 . 2]" 1
1123 2 35 VAL H 2 36 LYS H . . 3.790 2.761 2.089 2.897 . 0 0 "[ . 1 . 2]" 1
1124 2 35 VAL HA 2 35 VAL MG1 . . 3.220 2.484 2.349 2.630 . 0 0 "[ . 1 . 2]" 1
1125 2 35 VAL HA 2 35 VAL MG2 . . 3.130 2.389 2.325 2.448 . 0 0 "[ . 1 . 2]" 1
1126 2 35 VAL HA 2 38 THR H . . 4.080 3.843 3.671 4.105 0.025 19 0 "[ . 1 . 2]" 1
1127 2 35 VAL HA 2 38 THR HB . . 4.100 3.113 2.812 3.540 . 0 0 "[ . 1 . 2]" 1
1128 2 35 VAL HA 2 38 THR HG1 . . 4.380 3.716 3.132 4.421 0.041 6 0 "[ . 1 . 2]" 1
1129 2 35 VAL HA 2 38 THR MG . . 4.900 4.472 3.989 4.915 0.015 6 0 "[ . 1 . 2]" 1
1130 2 35 VAL HA 2 39 ALA H . . 4.630 3.900 3.845 3.980 . 0 0 "[ . 1 . 2]" 1
1131 2 35 VAL HA 2 39 ALA MB . . 4.270 4.336 4.301 4.355 0.085 9 0 "[ . 1 . 2]" 1
1132 2 35 VAL HA 2 65 PHE QD . . 4.920 4.257 3.613 4.681 . 0 0 "[ . 1 . 2]" 1
1133 2 35 VAL HA 2 65 PHE QE . . 4.270 2.970 2.580 3.458 . 0 0 "[ . 1 . 2]" 1
1134 2 35 VAL HA 2 65 PHE HZ . . 4.150 3.244 2.698 3.885 . 0 0 "[ . 1 . 2]" 1
1135 2 35 VAL HA 2 76 PHE QD . . 4.620 3.253 2.736 3.965 . 0 0 "[ . 1 . 2]" 1
1136 2 35 VAL HB 2 36 LYS H . . 3.670 2.629 2.514 2.783 . 0 0 "[ . 1 . 2]" 1
1137 2 35 VAL HB 2 75 TYR QD . . 4.770 4.058 3.730 4.439 . 0 0 "[ . 1 . 2]" 1
1138 2 35 VAL HB 2 75 TYR QE . . 4.520 3.120 2.376 3.857 . 0 0 "[ . 1 . 2]" 1
1139 2 35 VAL HB 2 79 LEU MD1 . . 4.650 4.166 3.620 4.697 0.047 12 0 "[ . 1 . 2]" 1
1140 2 35 VAL MG1 2 36 LYS H . . 3.940 3.329 2.993 3.727 . 0 0 "[ . 1 . 2]" 1
1141 2 35 VAL MG1 2 36 LYS HA . . 4.100 3.534 3.342 3.915 . 0 0 "[ . 1 . 2]" 1
1142 2 35 VAL MG1 2 38 THR H . . 5.500 5.204 5.001 5.470 . 0 0 "[ . 1 . 2]" 1
1143 2 35 VAL MG1 2 38 THR HB . . 4.770 4.392 4.082 4.823 0.053 9 0 "[ . 1 . 2]" 1
1144 2 35 VAL MG1 2 39 ALA H . . 4.830 4.113 3.932 4.468 . 0 0 "[ . 1 . 2]" 1
1145 2 35 VAL MG1 2 39 ALA MB . . 3.610 3.184 2.959 3.565 . 0 0 "[ . 1 . 2]" 1
1146 2 35 VAL MG1 2 65 PHE QD . . 4.130 3.371 2.686 3.709 . 0 0 "[ . 1 . 2]" 1
1147 2 35 VAL MG1 2 65 PHE QE . . 4.440 3.292 2.673 3.932 . 0 0 "[ . 1 . 2]" 1
1148 2 35 VAL MG1 2 75 TYR QD . . 3.150 2.250 2.056 2.554 . 0 0 "[ . 1 . 2]" 1
1149 2 35 VAL MG1 2 75 TYR QE . . 3.310 2.680 2.281 3.338 0.028 19 0 "[ . 1 . 2]" 1
1150 2 35 VAL MG1 2 76 PHE H . . 4.080 3.641 3.269 3.964 . 0 0 "[ . 1 . 2]" 1
1151 2 35 VAL MG1 2 76 PHE HA . . 3.380 2.658 2.449 2.931 . 0 0 "[ . 1 . 2]" 1
1152 2 35 VAL MG1 2 76 PHE HB2 . . 4.060 2.223 2.041 2.535 . 0 0 "[ . 1 . 2]" 1
1153 2 35 VAL MG1 2 76 PHE HB3 . . 4.020 3.709 3.454 4.041 0.021 9 0 "[ . 1 . 2]" 1
1154 2 35 VAL MG1 2 76 PHE QD . . 3.040 2.171 2.071 2.329 . 0 0 "[ . 1 . 2]" 1
1155 2 35 VAL MG1 2 76 PHE QE . . 4.630 4.140 3.902 4.318 . 0 0 "[ . 1 . 2]" 1
1156 2 35 VAL MG1 2 79 LEU MD1 . . 3.040 2.507 2.174 3.118 0.078 13 0 "[ . 1 . 2]" 1
1157 2 35 VAL MG2 2 36 LYS H . . 4.100 3.981 3.837 4.097 . 0 0 "[ . 1 . 2]" 1
1158 2 35 VAL MG2 2 38 THR HB . . 5.240 4.815 4.613 5.117 . 0 0 "[ . 1 . 2]" 1
1159 2 35 VAL MG2 2 39 ALA H . . 5.500 5.536 5.468 5.596 0.096 19 0 "[ . 1 . 2]" 1
1160 2 35 VAL MG2 2 65 PHE H . . 5.500 5.364 5.044 5.574 0.074 6 0 "[ . 1 . 2]" 1
1161 2 35 VAL MG2 2 65 PHE HB2 . . 4.920 3.413 2.987 3.781 . 0 0 "[ . 1 . 2]" 1
1162 2 35 VAL MG2 2 65 PHE QB . . 4.290 3.184 2.853 3.497 . 0 0 "[ . 1 . 2]" 1
1163 2 35 VAL MG2 2 65 PHE HB3 . . 4.920 3.819 3.500 4.119 . 0 0 "[ . 1 . 2]" 1
1164 2 35 VAL MG2 2 65 PHE QD . . 3.860 2.959 2.561 3.267 . 0 0 "[ . 1 . 2]" 1
1165 2 35 VAL MG2 2 65 PHE QE . . 4.400 3.168 2.888 3.653 . 0 0 "[ . 1 . 2]" 1
1166 2 35 VAL MG2 2 65 PHE HZ . . 4.310 3.800 3.361 4.371 0.061 8 0 "[ . 1 . 2]" 1
1167 2 35 VAL MG2 2 72 LEU HB2 . . 4.700 4.166 3.691 4.420 . 0 0 "[ . 1 . 2]" 1
1168 2 35 VAL MG2 2 72 LEU HB3 . . 4.140 3.223 2.794 3.581 . 0 0 "[ . 1 . 2]" 1
1169 2 35 VAL MG2 2 72 LEU MD1 . . 3.290 2.481 2.261 2.932 . 0 0 "[ . 1 . 2]" 1
1170 2 35 VAL MG2 2 75 TYR QD . . 3.890 3.637 3.075 3.987 0.097 3 0 "[ . 1 . 2]" 1
1171 2 35 VAL MG2 2 75 TYR QE . . 4.460 3.924 3.060 4.523 0.063 3 0 "[ . 1 . 2]" 1
1172 2 35 VAL MG2 2 76 PHE HA . . 4.970 4.869 4.468 5.035 0.065 19 0 "[ . 1 . 2]" 1
1173 2 35 VAL MG2 2 76 PHE QD . . 4.120 3.835 3.363 4.207 0.087 6 0 "[ . 1 . 2]" 1
1174 2 36 LYS H 2 36 LYS HB2 . . 3.570 2.305 2.112 2.416 . 0 0 "[ . 1 . 2]" 1
1175 2 36 LYS H 2 36 LYS HD2 . . 5.180 3.921 3.472 4.484 . 0 0 "[ . 1 . 2]" 1
1176 2 36 LYS H 2 36 LYS QD . . 4.320 3.647 3.329 4.030 . 0 0 "[ . 1 . 2]" 1
1177 2 36 LYS H 2 36 LYS HD3 . . 5.180 4.487 3.748 4.947 . 0 0 "[ . 1 . 2]" 1
1178 2 36 LYS H 2 36 LYS HG2 . . 4.140 3.870 3.704 4.211 0.071 3 0 "[ . 1 . 2]" 1
1179 2 36 LYS H 2 36 LYS HG3 . . 3.600 2.642 2.405 3.116 . 0 0 "[ . 1 . 2]" 1
1180 2 36 LYS H 2 37 LEU H . . 4.160 2.838 2.621 3.032 . 0 0 "[ . 1 . 2]" 1
1181 2 36 LYS H 2 38 THR H . . 4.730 4.550 4.345 4.782 0.052 14 0 "[ . 1 . 2]" 1
1182 2 36 LYS H 2 79 LEU MD1 . . 4.590 3.967 3.526 4.443 . 0 0 "[ . 1 . 2]" 1
1183 2 36 LYS HA 2 36 LYS HD2 . . 5.500 4.596 4.416 4.747 . 0 0 "[ . 1 . 2]" 1
1184 2 36 LYS HA 2 36 LYS HD3 . . 5.500 4.437 4.208 4.596 . 0 0 "[ . 1 . 2]" 1
1185 2 36 LYS HA 2 36 LYS HG2 . . 3.630 2.549 2.276 2.762 . 0 0 "[ . 1 . 2]" 1
1186 2 36 LYS HA 2 36 LYS HG3 . . 3.710 2.739 2.465 2.932 . 0 0 "[ . 1 . 2]" 1
1187 2 36 LYS HA 2 39 ALA H . . 4.460 3.581 3.417 3.773 . 0 0 "[ . 1 . 2]" 1
1188 2 36 LYS HA 2 39 ALA MB . . 3.370 2.524 2.367 2.877 . 0 0 "[ . 1 . 2]" 1
1189 2 36 LYS HA 2 40 GLN H . . 4.650 4.130 3.901 4.425 . 0 0 "[ . 1 . 2]" 1
1190 2 36 LYS HA 2 79 LEU MD1 . . 3.360 2.332 2.052 2.839 . 0 0 "[ . 1 . 2]" 1
1191 2 36 LYS HA 2 79 LEU MD2 . . 4.280 4.198 3.686 4.361 0.081 13 0 "[ . 1 . 2]" 1
1192 2 36 LYS HA 2 83 TYR QE . . 3.970 3.374 2.731 4.007 0.037 18 0 "[ . 1 . 2]" 1
1193 2 36 LYS HB2 2 36 LYS QD . . 3.470 2.335 2.206 2.557 . 0 0 "[ . 1 . 2]" 1
1194 2 36 LYS HB2 2 36 LYS QE . . 4.760 3.972 3.502 4.119 . 0 0 "[ . 1 . 2]" 1
1195 2 36 LYS HB2 2 37 LEU H . . 3.740 2.713 2.460 3.012 . 0 0 "[ . 1 . 2]" 1
1196 2 36 LYS HB2 2 79 LEU MD1 . . 5.080 4.331 4.060 4.757 . 0 0 "[ . 1 . 2]" 1
1197 2 36 LYS HB3 2 36 LYS QE . . 5.010 3.848 2.810 4.292 . 0 0 "[ . 1 . 2]" 1
1198 2 36 LYS HB3 2 79 LEU MD1 . . 5.320 3.902 3.402 4.579 . 0 0 "[ . 1 . 2]" 1
1199 2 36 LYS HB3 2 83 TYR QE . . 4.930 4.339 3.734 5.002 0.072 18 0 "[ . 1 . 2]" 1
1200 2 36 LYS QD 2 79 LEU MD1 . . 4.340 3.925 3.385 4.293 . 0 0 "[ . 1 . 2]" 1
1201 2 36 LYS HD2 2 79 LEU MD1 . . 5.170 4.368 3.505 4.884 . 0 0 "[ . 1 . 2]" 1
1202 2 36 LYS HD3 2 79 LEU MD1 . . 5.170 4.511 4.127 4.832 . 0 0 "[ . 1 . 2]" 1
1203 2 36 LYS QE 2 36 LYS HG2 . . 3.440 2.434 2.147 2.946 . 0 0 "[ . 1 . 2]" 1
1204 2 36 LYS QE 2 79 LEU MD1 . . 4.120 3.302 2.500 3.729 . 0 0 "[ . 1 . 2]" 1
1205 2 36 LYS QE 2 79 LEU MD2 . . 3.920 3.502 2.493 4.018 0.098 3 0 "[ . 1 . 2]" 1
1206 2 36 LYS HE2 2 75 TYR QE . . 5.500 4.391 3.795 5.578 0.078 13 0 "[ . 1 . 2]" 1
1207 2 36 LYS HE3 2 75 TYR QE . . 5.500 4.670 3.423 5.570 0.070 17 0 "[ . 1 . 2]" 1
1208 2 36 LYS HG2 2 79 LEU MD1 . . 3.520 2.373 2.010 2.787 . 0 0 "[ . 1 . 2]" 1
1209 2 36 LYS HG2 2 79 LEU MD2 . . 3.280 3.249 2.845 3.374 0.094 3 0 "[ . 1 . 2]" 1
1210 2 36 LYS HG3 2 37 LEU H . . 5.260 4.710 4.555 5.001 . 0 0 "[ . 1 . 2]" 1
1211 2 36 LYS HG3 2 75 TYR QD . . 5.500 5.366 4.903 5.586 0.086 2 0 "[ . 1 . 2]" 1
1212 2 36 LYS HG3 2 75 TYR QE . . 4.710 3.336 2.771 3.800 . 0 0 "[ . 1 . 2]" 1
1213 2 36 LYS HG3 2 79 LEU MD1 . . 3.620 2.672 2.365 3.096 . 0 0 "[ . 1 . 2]" 1
1214 2 36 LYS HG3 2 79 LEU MD2 . . 4.260 4.191 3.490 4.344 0.084 12 0 "[ . 1 . 2]" 1
1215 2 36 LYS HG3 2 83 TYR QE . . 5.500 5.258 4.106 5.554 0.054 18 0 "[ . 1 . 2]" 1
1216 2 37 LEU H 2 37 LEU HB2 . . 3.760 2.290 2.185 2.349 . 0 0 "[ . 1 . 2]" 1
1217 2 37 LEU H 2 37 LEU HB3 . . 3.970 2.550 2.393 2.899 . 0 0 "[ . 1 . 2]" 1
1218 2 37 LEU H 2 37 LEU MD1 . . 4.310 4.149 4.041 4.224 . 0 0 "[ . 1 . 2]" 1
1219 2 37 LEU H 2 37 LEU MD2 . . 4.340 4.271 4.230 4.333 . 0 0 "[ . 1 . 2]" 1
1220 2 37 LEU H 2 37 LEU HG . . 4.340 4.355 4.240 4.399 0.059 17 0 "[ . 1 . 2]" 1
1221 2 37 LEU H 2 38 THR H . . 3.920 2.891 2.643 3.065 . 0 0 "[ . 1 . 2]" 1
1222 2 37 LEU H 2 39 ALA H . . 4.990 4.238 4.044 4.365 . 0 0 "[ . 1 . 2]" 1
1223 2 37 LEU H 2 39 ALA MB . . 4.920 4.808 4.712 4.924 0.004 17 0 "[ . 1 . 2]" 1
1224 2 37 LEU H 2 40 GLN H . . 4.800 4.774 4.669 4.850 0.050 16 0 "[ . 1 . 2]" 1
1225 2 37 LEU HA 2 37 LEU MD1 . . 4.200 3.954 3.881 4.024 . 0 0 "[ . 1 . 2]" 1
1226 2 37 LEU HA 2 37 LEU MD2 . . 3.040 2.576 2.313 2.940 . 0 0 "[ . 1 . 2]" 1
1227 2 37 LEU HA 2 37 LEU HG . . 4.090 2.899 2.705 3.052 . 0 0 "[ . 1 . 2]" 1
1228 2 37 LEU HA 2 40 GLN H . . 4.160 3.681 3.565 3.790 . 0 0 "[ . 1 . 2]" 1
1229 2 37 LEU HA 2 40 GLN HB2 . . 4.080 2.934 2.767 3.228 . 0 0 "[ . 1 . 2]" 1
1230 2 37 LEU HA 2 40 GLN HB3 . . 4.420 4.455 4.260 4.488 0.068 14 0 "[ . 1 . 2]" 1
1231 2 37 LEU HA 2 41 PHE QD . . 4.730 3.839 3.530 4.232 . 0 0 "[ . 1 . 2]" 1
1232 2 37 LEU HB2 2 37 LEU MD1 . . 3.590 2.517 2.287 2.661 . 0 0 "[ . 1 . 2]" 1
1233 2 37 LEU HB2 2 37 LEU MD2 . . 3.360 3.236 3.192 3.286 . 0 0 "[ . 1 . 2]" 1
1234 2 37 LEU HB2 2 38 THR H . . 4.100 3.601 3.442 3.795 . 0 0 "[ . 1 . 2]" 1
1235 2 37 LEU HB3 2 38 THR H . . 3.820 2.198 2.099 2.390 . 0 0 "[ . 1 . 2]" 1
1236 2 37 LEU HB3 2 38 THR HA . . 4.930 4.169 3.923 4.258 . 0 0 "[ . 1 . 2]" 1
1237 2 37 LEU HB3 2 39 ALA H . . 4.870 4.889 4.783 4.939 0.069 19 0 "[ . 1 . 2]" 1
1238 2 37 LEU MD1 2 38 THR H . . 4.290 3.729 3.442 4.034 . 0 0 "[ . 1 . 2]" 1
1239 2 37 LEU MD1 2 41 PHE QD . . 5.200 4.918 4.555 5.263 0.063 17 0 "[ . 1 . 2]" 1
1240 2 37 LEU MD1 2 41 PHE QE . . 4.550 4.534 4.229 4.644 0.094 18 0 "[ . 1 . 2]" 1
1241 2 37 LEU MD2 2 38 THR H . . 4.560 3.315 2.945 3.708 . 0 0 "[ . 1 . 2]" 1
1242 2 37 LEU MD2 2 40 GLN HB2 . . 4.460 3.741 3.358 4.065 . 0 0 "[ . 1 . 2]" 1
1243 2 37 LEU MD2 2 40 GLN HB3 . . 4.940 4.639 4.128 5.017 0.077 9 0 "[ . 1 . 2]" 1
1244 2 37 LEU MD2 2 41 PHE H . . 4.180 3.588 3.445 3.825 . 0 0 "[ . 1 . 2]" 1
1245 2 37 LEU MD2 2 41 PHE QD . . 3.490 2.428 2.095 2.732 . 0 0 "[ . 1 . 2]" 1
1246 2 37 LEU MD2 2 41 PHE QE . . 3.190 2.495 2.279 2.842 . 0 0 "[ . 1 . 2]" 1
1247 2 37 LEU MD2 2 41 PHE HZ . . 4.090 3.553 3.127 3.979 . 0 0 "[ . 1 . 2]" 1
1248 2 37 LEU HG 2 38 THR H . . 4.970 4.788 4.612 4.997 0.027 6 0 "[ . 1 . 2]" 1
1249 2 37 LEU HG 2 41 PHE QD . . 4.730 4.639 4.119 4.806 0.076 3 0 "[ . 1 . 2]" 1
1250 2 37 LEU HG 2 41 PHE QE . . 4.790 3.903 3.174 4.421 . 0 0 "[ . 1 . 2]" 1
1251 2 38 THR H 2 38 THR HB . . 3.740 2.621 2.396 2.763 . 0 0 "[ . 1 . 2]" 1
1252 2 38 THR H 2 38 THR HG1 . . 3.440 2.537 1.885 3.320 . 0 0 "[ . 1 . 2]" 1
1253 2 38 THR H 2 38 THR MG . . 3.790 3.727 3.685 3.759 . 0 0 "[ . 1 . 2]" 1
1254 2 38 THR H 2 39 ALA H . . 3.760 2.895 2.750 2.960 . 0 0 "[ . 1 . 2]" 1
1255 2 38 THR H 2 65 PHE HZ . . 4.940 4.646 4.392 5.009 0.069 14 0 "[ . 1 . 2]" 1
1256 2 38 THR H 2 76 PHE QE . . 4.960 4.757 4.416 5.050 0.090 6 0 "[ . 1 . 2]" 1
1257 2 38 THR HA 2 38 THR MG . . 3.230 2.340 2.260 2.529 . 0 0 "[ . 1 . 2]" 1
1258 2 38 THR HA 2 40 GLN H . . 5.150 4.255 4.148 4.419 . 0 0 "[ . 1 . 2]" 1
1259 2 38 THR HA 2 41 PHE H . . 4.260 3.582 3.421 3.898 . 0 0 "[ . 1 . 2]" 1
1260 2 38 THR HA 2 41 PHE QB . . 4.310 2.912 2.491 4.083 . 0 0 "[ . 1 . 2]" 1
1261 2 38 THR HA 2 41 PHE QD . . 5.500 4.246 3.986 4.488 . 0 0 "[ . 1 . 2]" 1
1262 2 38 THR HA 2 42 VAL H . . 5.020 3.991 3.677 4.388 . 0 0 "[ . 1 . 2]" 1
1263 2 38 THR HA 2 42 VAL MG1 . . 4.350 3.658 3.357 3.995 . 0 0 "[ . 1 . 2]" 1
1264 2 38 THR HA 2 53 LEU MD1 . . 4.660 3.989 3.678 4.157 . 0 0 "[ . 1 . 2]" 1
1265 2 38 THR HB 2 39 ALA H . . 3.960 2.633 2.495 2.820 . 0 0 "[ . 1 . 2]" 1
1266 2 38 THR HB 2 65 PHE HZ . . 4.410 3.062 2.725 3.537 . 0 0 "[ . 1 . 2]" 1
1267 2 38 THR HB 2 66 LEU MD2 . . 4.880 3.554 3.142 3.909 . 0 0 "[ . 1 . 2]" 1
1268 2 38 THR HB 2 76 PHE QD . . 4.950 3.659 3.344 4.429 . 0 0 "[ . 1 . 2]" 1
1269 2 38 THR HG1 2 39 ALA H . . 4.770 4.343 3.874 4.834 0.064 10 0 "[ . 1 . 2]" 1
1270 2 38 THR HG1 2 63 PHE QE . . 4.710 4.203 3.389 4.789 0.079 3 0 "[ . 1 . 2]" 1
1271 2 38 THR HG1 2 65 PHE HZ . . 4.310 2.708 2.264 3.098 . 0 0 "[ . 1 . 2]" 1
1272 2 38 THR MG 2 39 ALA H . . 3.890 3.665 3.468 3.766 . 0 0 "[ . 1 . 2]" 1
1273 2 38 THR MG 2 40 GLN H . . 5.250 5.155 4.978 5.291 0.041 9 0 "[ . 1 . 2]" 1
1274 2 38 THR MG 2 41 PHE H . . 5.500 4.911 4.765 5.138 . 0 0 "[ . 1 . 2]" 1
1275 2 38 THR MG 2 42 VAL H . . 4.650 3.999 3.687 4.484 . 0 0 "[ . 1 . 2]" 1
1276 2 38 THR MG 2 42 VAL HB . . 5.190 4.834 4.464 5.290 0.100 20 0 "[ . 1 . 2]" 1
1277 2 38 THR MG 2 42 VAL MG2 . . 4.370 3.399 3.016 3.643 . 0 0 "[ . 1 . 2]" 1
1278 2 38 THR MG 2 49 PHE QE . . 4.240 3.254 2.678 4.206 . 0 0 "[ . 1 . 2]" 1
1279 2 38 THR MG 2 49 PHE HZ . . 5.500 4.737 4.091 5.574 0.074 20 0 "[ . 1 . 2]" 1
1280 2 38 THR MG 2 50 LEU HA . . 4.470 4.134 3.704 4.496 0.026 3 0 "[ . 1 . 2]" 1
1281 2 38 THR MG 2 50 LEU MD1 . . 4.570 4.618 4.462 4.671 0.101 17 0 "[ . 1 . 2]" 1
1282 2 38 THR MG 2 50 LEU MD2 . . 4.780 4.001 3.783 4.286 . 0 0 "[ . 1 . 2]" 1
1283 2 38 THR MG 2 53 LEU MD1 . . 2.950 2.210 1.958 2.477 . 0 0 "[ . 1 . 2]" 1
1284 2 38 THR MG 2 53 LEU MD2 . . 4.040 3.963 3.704 4.143 0.103 3 0 "[ . 1 . 2]" 1
1285 2 38 THR MG 2 63 PHE QE . . 4.390 3.604 3.212 4.231 . 0 0 "[ . 1 . 2]" 1
1286 2 38 THR MG 2 63 PHE HZ . . 5.500 5.440 5.172 5.592 0.092 7 0 "[ . 1 . 2]" 1
1287 2 38 THR MG 2 65 PHE HZ . . 3.370 2.930 2.457 3.448 0.078 19 0 "[ . 1 . 2]" 1
1288 2 38 THR MG 2 66 LEU MD1 . . 3.410 2.867 2.482 3.337 . 0 0 "[ . 1 . 2]" 1
1289 2 38 THR MG 2 66 LEU MD2 . . 3.030 2.139 2.036 2.299 . 0 0 "[ . 1 . 2]" 1
1290 2 38 THR MG 2 76 PHE QE . . 3.170 2.399 2.222 2.866 . 0 0 "[ . 1 . 2]" 1
1291 2 38 THR MG 2 76 PHE HZ . . 3.730 3.058 2.563 3.467 . 0 0 "[ . 1 . 2]" 1
1292 2 39 ALA H 2 39 ALA MB . . 3.010 2.225 2.187 2.263 . 0 0 "[ . 1 . 2]" 1
1293 2 39 ALA H 2 40 GLN H . . 3.610 2.846 2.785 2.928 . 0 0 "[ . 1 . 2]" 1
1294 2 39 ALA H 2 40 GLN HB2 . . 4.780 4.822 4.774 4.840 0.060 20 0 "[ . 1 . 2]" 1
1295 2 39 ALA H 2 65 PHE QE . . 4.830 4.730 4.426 4.907 0.077 6 0 "[ . 1 . 2]" 1
1296 2 39 ALA H 2 66 LEU MD2 . . 5.500 5.190 4.882 5.401 . 0 0 "[ . 1 . 2]" 1
1297 2 39 ALA H 2 76 PHE QD . . 5.000 3.588 3.281 3.892 . 0 0 "[ . 1 . 2]" 1
1298 2 39 ALA H 2 76 PHE QE . . 3.900 2.955 2.691 3.219 . 0 0 "[ . 1 . 2]" 1
1299 2 39 ALA H 2 79 LEU MD1 . . 5.020 4.452 4.067 4.947 . 0 0 "[ . 1 . 2]" 1
1300 2 39 ALA H 2 80 VAL MG2 . . 4.820 4.510 4.331 4.709 . 0 0 "[ . 1 . 2]" 1
1301 2 39 ALA HA 2 42 VAL H . . 4.210 3.676 3.522 3.906 . 0 0 "[ . 1 . 2]" 1
1302 2 39 ALA HA 2 42 VAL HB . . 4.600 4.672 4.664 4.676 0.076 14 0 "[ . 1 . 2]" 1
1303 2 39 ALA HA 2 42 VAL MG1 . . 4.070 3.594 3.492 3.682 . 0 0 "[ . 1 . 2]" 1
1304 2 39 ALA HA 2 42 VAL MG2 . . 3.910 1.942 1.894 1.991 . 0 0 "[ . 1 . 2]" 1
1305 2 39 ALA HA 2 43 ALA H . . 4.620 4.252 3.959 4.453 . 0 0 "[ . 1 . 2]" 1
1306 2 39 ALA HA 2 76 PHE QD . . 4.340 4.010 3.587 4.364 0.024 9 0 "[ . 1 . 2]" 1
1307 2 39 ALA HA 2 76 PHE QE . . 3.440 2.761 2.357 3.118 . 0 0 "[ . 1 . 2]" 1
1308 2 39 ALA HA 2 79 LEU QB . . 5.340 4.398 4.145 4.748 . 0 0 "[ . 1 . 2]" 1
1309 2 39 ALA HA 2 80 VAL HA . . 4.540 4.211 3.918 4.428 . 0 0 "[ . 1 . 2]" 1
1310 2 39 ALA HA 2 80 VAL MG1 . . 4.250 4.075 3.959 4.235 . 0 0 "[ . 1 . 2]" 1
1311 2 39 ALA HA 2 80 VAL MG2 . . 3.040 2.218 2.106 2.383 . 0 0 "[ . 1 . 2]" 1
1312 2 39 ALA MB 2 40 GLN H . . 3.270 2.799 2.625 2.964 . 0 0 "[ . 1 . 2]" 1
1313 2 39 ALA MB 2 40 GLN HB2 . . 4.800 4.520 4.323 4.686 . 0 0 "[ . 1 . 2]" 1
1314 2 39 ALA MB 2 40 GLN QG . . 5.010 3.685 3.310 4.402 . 0 0 "[ . 1 . 2]" 1
1315 2 39 ALA MB 2 42 VAL MG2 . . 4.060 3.274 3.199 3.335 . 0 0 "[ . 1 . 2]" 1
1316 2 39 ALA MB 2 76 PHE HA . . 4.300 3.237 2.941 3.362 . 0 0 "[ . 1 . 2]" 1
1317 2 39 ALA MB 2 76 PHE QD . . 3.350 2.630 2.282 2.985 . 0 0 "[ . 1 . 2]" 1
1318 2 39 ALA MB 2 76 PHE QE . . 3.740 3.024 2.803 3.330 . 0 0 "[ . 1 . 2]" 1
1319 2 39 ALA MB 2 79 LEU H . . 4.240 4.159 3.890 4.320 0.080 11 0 "[ . 1 . 2]" 1
1320 2 39 ALA MB 2 79 LEU HA . . 4.550 4.374 4.202 4.595 0.045 19 0 "[ . 1 . 2]" 1
1321 2 39 ALA MB 2 79 LEU HB2 . . 3.640 2.416 2.104 2.914 . 0 0 "[ . 1 . 2]" 1
1322 2 39 ALA MB 2 79 LEU QB . . 3.100 2.151 1.983 2.373 . 0 0 "[ . 1 . 2]" 1
1323 2 39 ALA MB 2 79 LEU HB3 . . 3.640 2.437 2.195 2.624 . 0 0 "[ . 1 . 2]" 1
1324 2 39 ALA MB 2 79 LEU MD1 . . 3.100 2.537 2.154 3.067 . 0 0 "[ . 1 . 2]" 1
1325 2 39 ALA MB 2 80 VAL H . . 3.640 3.132 2.889 3.505 . 0 0 "[ . 1 . 2]" 1
1326 2 39 ALA MB 2 80 VAL HB . . 4.890 4.585 4.288 4.871 . 0 0 "[ . 1 . 2]" 1
1327 2 39 ALA MB 2 80 VAL MG2 . . 2.870 2.388 2.167 2.574 . 0 0 "[ . 1 . 2]" 1
1328 2 39 ALA MB 2 83 TYR QD . . 3.660 2.818 2.297 3.308 . 0 0 "[ . 1 . 2]" 1
1329 2 39 ALA MB 2 83 TYR QE . . 3.270 2.430 2.128 2.868 . 0 0 "[ . 1 . 2]" 1
1330 2 40 GLN H 2 40 GLN HB2 . . 3.130 2.211 2.118 2.284 . 0 0 "[ . 1 . 2]" 1
1331 2 40 GLN H 2 40 GLN HB3 . . 3.520 3.493 3.324 3.556 0.036 20 0 "[ . 1 . 2]" 1
1332 2 40 GLN H 2 40 GLN HG2 . . 4.160 3.892 3.451 4.201 0.041 18 0 "[ . 1 . 2]" 1
1333 2 40 GLN H 2 40 GLN QG . . 3.560 2.819 2.518 3.468 . 0 0 "[ . 1 . 2]" 1
1334 2 40 GLN H 2 40 GLN HG3 . . 4.160 2.931 2.556 4.039 . 0 0 "[ . 1 . 2]" 1
1335 2 40 GLN H 2 42 VAL H . . 4.830 4.193 4.023 4.437 . 0 0 "[ . 1 . 2]" 1
1336 2 40 GLN H 2 43 ALA H . . 4.850 4.837 4.713 4.913 0.063 12 0 "[ . 1 . 2]" 1
1337 2 40 GLN H 2 79 LEU MD1 . . 5.380 5.053 4.380 5.453 0.073 12 0 "[ . 1 . 2]" 1
1338 2 40 GLN H 2 80 VAL MG2 . . 5.500 4.935 4.739 5.096 . 0 0 "[ . 1 . 2]" 1
1339 2 40 GLN H 2 83 TYR QD . . 4.530 4.041 3.614 4.410 . 0 0 "[ . 1 . 2]" 1
1340 2 40 GLN H 2 83 TYR QE . . 4.360 3.642 2.857 4.353 . 0 0 "[ . 1 . 2]" 1
1341 2 40 GLN HA 2 40 GLN HG2 . . 3.980 2.388 2.155 2.615 . 0 0 "[ . 1 . 2]" 1
1342 2 40 GLN HA 2 40 GLN QG . . 3.380 2.254 2.104 2.369 . 0 0 "[ . 1 . 2]" 1
1343 2 40 GLN HA 2 40 GLN HG3 . . 3.980 2.865 2.462 3.597 . 0 0 "[ . 1 . 2]" 1
1344 2 40 GLN HA 2 43 ALA H . . 4.250 3.688 3.556 3.951 . 0 0 "[ . 1 . 2]" 1
1345 2 40 GLN HA 2 43 ALA MB . . 3.350 2.896 2.636 3.153 . 0 0 "[ . 1 . 2]" 1
1346 2 40 GLN HA 2 83 TYR HB2 . . 4.580 3.722 3.080 4.332 . 0 0 "[ . 1 . 2]" 1
1347 2 40 GLN HA 2 83 TYR HB3 . . 4.150 3.354 2.580 4.123 . 0 0 "[ . 1 . 2]" 1
1348 2 40 GLN HA 2 83 TYR QD . . 3.920 2.731 2.328 3.190 . 0 0 "[ . 1 . 2]" 1
1349 2 40 GLN HA 2 83 TYR QE . . 4.360 3.690 3.197 4.412 0.052 2 0 "[ . 1 . 2]" 1
1350 2 40 GLN HB2 2 41 PHE H . . 3.870 2.669 2.410 3.098 . 0 0 "[ . 1 . 2]" 1
1351 2 40 GLN HB2 2 41 PHE HA . . 5.130 4.719 4.472 5.154 0.024 12 0 "[ . 1 . 2]" 1
1352 2 40 GLN HB2 2 41 PHE QD . . 4.460 2.934 2.462 3.777 . 0 0 "[ . 1 . 2]" 1
1353 2 40 GLN HB3 2 41 PHE H . . 3.390 3.169 2.880 3.430 0.040 20 0 "[ . 1 . 2]" 1
1354 2 40 GLN HB3 2 41 PHE QD . . 4.470 3.204 2.839 3.614 . 0 0 "[ . 1 . 2]" 1
1355 2 40 GLN HB3 2 83 TYR QD . . 5.500 4.966 4.600 5.304 . 0 0 "[ . 1 . 2]" 1
1356 2 40 GLN QG 2 79 LEU MD2 . . 5.340 4.867 4.489 5.391 0.051 10 0 "[ . 1 . 2]" 1
1357 2 40 GLN QG 2 83 TYR QD . . 4.130 3.162 2.752 3.613 . 0 0 "[ . 1 . 2]" 1
1358 2 40 GLN QG 2 83 TYR QE . . 3.390 2.586 2.172 2.904 . 0 0 "[ . 1 . 2]" 1
1359 2 40 GLN HG2 2 83 TYR QD . . 4.800 3.479 3.087 4.256 . 0 0 "[ . 1 . 2]" 1
1360 2 40 GLN HG2 2 83 TYR QE . . 3.920 3.347 2.851 3.865 . 0 0 "[ . 1 . 2]" 1
1361 2 40 GLN HG3 2 83 TYR QD . . 4.800 3.719 3.022 4.751 . 0 0 "[ . 1 . 2]" 1
1362 2 40 GLN HG3 2 83 TYR QE . . 3.920 2.763 2.214 3.985 0.065 19 0 "[ . 1 . 2]" 1
1363 2 41 PHE H 2 41 PHE HB2 . . 4.040 2.315 2.228 2.524 . 0 0 "[ . 1 . 2]" 1
1364 2 41 PHE H 2 41 PHE QB . . 3.280 2.286 2.205 2.478 . 0 0 "[ . 1 . 2]" 1
1365 2 41 PHE H 2 41 PHE HB3 . . 4.040 3.551 3.511 3.615 . 0 0 "[ . 1 . 2]" 1
1366 2 41 PHE H 2 41 PHE QD . . 3.360 2.185 1.937 2.445 . 0 0 "[ . 1 . 2]" 1
1367 2 41 PHE H 2 41 PHE QE . . 5.030 4.519 4.268 4.742 . 0 0 "[ . 1 . 2]" 1
1368 2 41 PHE H 2 42 VAL H . . 3.600 2.863 2.689 3.025 . 0 0 "[ . 1 . 2]" 1
1369 2 41 PHE H 2 42 VAL MG1 . . 4.450 4.369 4.212 4.491 0.041 18 0 "[ . 1 . 2]" 1
1370 2 41 PHE H 2 42 VAL MG2 . . 5.230 4.044 3.882 4.281 . 0 0 "[ . 1 . 2]" 1
1371 2 41 PHE H 2 43 ALA H . . 4.910 4.181 4.030 4.341 . 0 0 "[ . 1 . 2]" 1
1372 2 41 PHE HA 2 41 PHE QD . . 3.730 2.997 2.755 3.255 . 0 0 "[ . 1 . 2]" 1
1373 2 41 PHE HA 2 41 PHE QE . . 4.870 4.591 4.448 4.934 0.064 17 0 "[ . 1 . 2]" 1
1374 2 41 PHE HA 2 43 ALA H . . 4.520 4.169 3.891 4.540 0.020 11 0 "[ . 1 . 2]" 1
1375 2 41 PHE HA 2 44 ARG H . . 3.780 3.381 3.125 3.656 . 0 0 "[ . 1 . 2]" 1
1376 2 41 PHE HA 2 44 ARG HB2 . . 4.340 2.758 2.208 3.675 . 0 0 "[ . 1 . 2]" 1
1377 2 41 PHE HA 2 44 ARG QB . . 3.710 2.588 2.196 2.794 . 0 0 "[ . 1 . 2]" 1
1378 2 41 PHE HA 2 44 ARG HB3 . . 4.340 3.928 2.603 4.399 0.059 5 0 "[ . 1 . 2]" 1
1379 2 41 PHE HA 2 44 ARG HD2 . . 4.880 3.706 2.591 4.860 . 0 0 "[ . 1 . 2]" 1
1380 2 41 PHE HA 2 44 ARG QD . . 4.260 3.106 2.557 3.975 . 0 0 "[ . 1 . 2]" 1
1381 2 41 PHE HA 2 44 ARG HD3 . . 4.880 3.736 2.903 4.480 . 0 0 "[ . 1 . 2]" 1
1382 2 41 PHE HA 2 44 ARG QG . . 4.550 4.080 3.379 4.618 0.068 8 0 "[ . 1 . 2]" 1
1383 2 41 PHE HA 2 45 ASN H . . 4.170 3.665 3.264 4.218 0.048 1 0 "[ . 1 . 2]" 1
1384 2 41 PHE HA 2 45 ASN HD21 . . 4.510 4.035 2.713 4.576 0.066 12 0 "[ . 1 . 2]" 1
1385 2 41 PHE HA 2 45 ASN QD . . 3.900 3.519 2.613 3.975 0.075 18 0 "[ . 1 . 2]" 1
1386 2 41 PHE HA 2 45 ASN HD22 . . 4.510 3.987 3.407 4.550 0.040 4 0 "[ . 1 . 2]" 1
1387 2 41 PHE QB 2 42 VAL H . . 3.760 2.725 2.543 3.050 . 0 0 "[ . 1 . 2]" 1
1388 2 41 PHE QB 2 49 PHE HZ . . 5.340 3.435 2.760 4.048 . 0 0 "[ . 1 . 2]" 1
1389 2 41 PHE HB2 2 42 VAL H . . 4.320 2.856 2.643 3.231 . 0 0 "[ . 1 . 2]" 1
1390 2 41 PHE HB2 2 49 PHE QE . . 4.670 2.779 2.346 3.520 . 0 0 "[ . 1 . 2]" 1
1391 2 41 PHE HB3 2 42 VAL H . . 4.320 3.457 3.100 3.851 . 0 0 "[ . 1 . 2]" 1
1392 2 41 PHE HB3 2 49 PHE QE . . 4.670 2.761 2.325 3.874 . 0 0 "[ . 1 . 2]" 1
1393 2 41 PHE QD 2 42 VAL H . . 4.710 4.550 4.433 4.671 . 0 0 "[ . 1 . 2]" 1
1394 2 41 PHE QD 2 44 ARG HD2 . . 5.500 4.909 3.658 5.587 0.087 18 0 "[ . 1 . 2]" 1
1395 2 41 PHE QD 2 44 ARG HD3 . . 5.500 4.914 3.883 5.570 0.070 14 0 "[ . 1 . 2]" 1
1396 2 41 PHE QD 2 45 ASN HD21 . . 4.380 3.314 2.686 4.443 0.063 12 0 "[ . 1 . 2]" 1
1397 2 41 PHE QD 2 45 ASN HD22 . . 4.380 2.782 2.051 3.916 . 0 0 "[ . 1 . 2]" 1
1398 2 41 PHE QD 2 49 PHE QE . . 5.130 3.581 2.961 4.572 . 0 0 "[ . 1 . 2]" 1
1399 2 42 VAL H 2 42 VAL HB . . 3.700 3.627 3.591 3.664 . 0 0 "[ . 1 . 2]" 1
1400 2 42 VAL H 2 42 VAL MG1 . . 3.070 2.186 2.062 2.386 . 0 0 "[ . 1 . 2]" 1
1401 2 42 VAL H 2 42 VAL MG2 . . 3.760 2.057 1.950 2.199 . 0 0 "[ . 1 . 2]" 1
1402 2 42 VAL H 2 43 ALA H . . 3.370 2.721 2.537 2.907 . 0 0 "[ . 1 . 2]" 1
1403 2 42 VAL H 2 43 ALA MB . . 4.570 4.384 4.243 4.551 . 0 0 "[ . 1 . 2]" 1
1404 2 42 VAL H 2 44 ARG H . . 4.780 4.214 3.978 4.486 . 0 0 "[ . 1 . 2]" 1
1405 2 42 VAL H 2 80 VAL MG1 . . 5.210 4.796 4.581 4.946 . 0 0 "[ . 1 . 2]" 1
1406 2 42 VAL H 2 80 VAL MG2 . . 4.730 4.504 4.316 4.615 . 0 0 "[ . 1 . 2]" 1
1407 2 42 VAL HA 2 42 VAL MG1 . . 3.090 2.430 2.356 2.497 . 0 0 "[ . 1 . 2]" 1
1408 2 42 VAL HA 2 42 VAL MG2 . . 3.230 3.221 3.161 3.241 0.011 11 0 "[ . 1 . 2]" 1
1409 2 42 VAL HA 2 44 ARG H . . 5.040 4.215 3.758 4.821 . 0 0 "[ . 1 . 2]" 1
1410 2 42 VAL HA 2 45 ASN H . . 4.450 3.710 3.344 4.095 . 0 0 "[ . 1 . 2]" 1
1411 2 42 VAL HA 2 45 ASN HB2 . . 5.310 3.253 2.727 3.920 . 0 0 "[ . 1 . 2]" 1
1412 2 42 VAL HA 2 45 ASN QB . . 4.550 3.208 2.702 3.830 . 0 0 "[ . 1 . 2]" 1
1413 2 42 VAL HA 2 45 ASN HB3 . . 5.310 4.897 4.397 5.380 0.070 18 0 "[ . 1 . 2]" 1
1414 2 42 VAL HA 2 45 ASN QD . . 5.260 4.287 3.729 5.332 0.072 12 0 "[ . 1 . 2]" 1
1415 2 42 VAL HA 2 46 GLY H . . 3.760 3.104 2.717 3.532 . 0 0 "[ . 1 . 2]" 1
1416 2 42 VAL HA 2 46 GLY HA2 . . 5.200 4.676 4.387 5.029 . 0 0 "[ . 1 . 2]" 1
1417 2 42 VAL HA 2 47 ARG HA . . 5.500 4.848 4.464 5.199 . 0 0 "[ . 1 . 2]" 1
1418 2 42 VAL HA 2 49 PHE H . . 5.500 4.847 4.565 5.199 . 0 0 "[ . 1 . 2]" 1
1419 2 42 VAL HA 2 49 PHE HB2 . . 4.540 4.476 3.979 4.606 0.066 10 0 "[ . 1 . 2]" 1
1420 2 42 VAL HA 2 49 PHE HB3 . . 4.780 2.951 2.533 3.324 . 0 0 "[ . 1 . 2]" 1
1421 2 42 VAL HA 2 49 PHE QD . . 3.810 2.531 2.099 3.034 . 0 0 "[ . 1 . 2]" 1
1422 2 42 VAL HA 2 49 PHE QE . . 5.110 4.349 3.501 4.877 . 0 0 "[ . 1 . 2]" 1
1423 2 42 VAL HA 2 50 LEU H . . 5.500 3.968 3.763 4.209 . 0 0 "[ . 1 . 2]" 1
1424 2 42 VAL HA 2 80 VAL MG2 . . 5.500 5.338 5.264 5.409 . 0 0 "[ . 1 . 2]" 1
1425 2 42 VAL HB 2 43 ALA H . . 3.950 3.980 3.822 4.019 0.069 13 0 "[ . 1 . 2]" 1
1426 2 42 VAL HB 2 43 ALA MB . . 4.910 4.964 4.888 5.000 0.090 7 0 "[ . 1 . 2]" 1
1427 2 42 VAL HB 2 50 LEU MD1 . . 3.570 2.882 2.674 3.165 . 0 0 "[ . 1 . 2]" 1
1428 2 42 VAL HB 2 76 PHE QE . . 4.770 4.785 4.609 4.850 0.080 6 0 "[ . 1 . 2]" 1
1429 2 42 VAL HB 2 76 PHE HZ . . 4.740 3.964 3.751 4.129 . 0 0 "[ . 1 . 2]" 1
1430 2 42 VAL HB 2 80 VAL MG1 . . 4.140 3.443 3.211 3.560 . 0 0 "[ . 1 . 2]" 1
1431 2 42 VAL HB 2 80 VAL MG2 . . 3.650 3.702 3.612 3.740 0.090 9 0 "[ . 1 . 2]" 1
1432 2 42 VAL MG1 2 43 ALA H . . 4.130 4.105 4.029 4.187 0.057 14 0 "[ . 1 . 2]" 1
1433 2 42 VAL MG1 2 46 GLY H . . 5.260 4.949 4.558 5.304 0.044 1 0 "[ . 1 . 2]" 1
1434 2 42 VAL MG1 2 47 ARG HA . . 4.640 4.403 4.140 4.698 0.058 16 0 "[ . 1 . 2]" 1
1435 2 42 VAL MG1 2 49 PHE HB2 . . 5.190 4.823 4.392 5.143 . 0 0 "[ . 1 . 2]" 1
1436 2 42 VAL MG1 2 49 PHE QD . . 3.200 2.089 1.950 2.271 . 0 0 "[ . 1 . 2]" 1
1437 2 42 VAL MG1 2 49 PHE QE . . 3.680 2.807 2.363 3.165 . 0 0 "[ . 1 . 2]" 1
1438 2 42 VAL MG1 2 49 PHE HZ . . 5.110 4.894 4.517 5.175 0.065 12 0 "[ . 1 . 2]" 1
1439 2 42 VAL MG1 2 50 LEU H . . 4.000 3.020 2.752 3.335 . 0 0 "[ . 1 . 2]" 1
1440 2 42 VAL MG1 2 50 LEU HA . . 3.680 2.357 2.216 2.481 . 0 0 "[ . 1 . 2]" 1
1441 2 42 VAL MG1 2 50 LEU HB2 . . 3.490 2.376 2.202 2.787 . 0 0 "[ . 1 . 2]" 1
1442 2 42 VAL MG1 2 50 LEU MD1 . . 3.040 3.043 2.913 3.121 0.081 3 0 "[ . 1 . 2]" 1
1443 2 42 VAL MG1 2 50 LEU HG . . 4.080 2.074 2.007 2.181 . 0 0 "[ . 1 . 2]" 1
1444 2 42 VAL MG1 2 53 LEU MD1 . . 3.730 3.001 2.754 3.403 . 0 0 "[ . 1 . 2]" 1
1445 2 42 VAL MG1 2 66 LEU MD2 . . 3.920 3.473 3.063 3.840 . 0 0 "[ . 1 . 2]" 1
1446 2 42 VAL MG1 2 76 PHE QE . . 3.470 3.356 3.110 3.542 0.072 9 0 "[ . 1 . 2]" 1
1447 2 42 VAL MG1 2 76 PHE HZ . . 3.370 2.400 2.209 2.699 . 0 0 "[ . 1 . 2]" 1
1448 2 42 VAL MG1 2 80 VAL MG1 . . 4.280 4.322 4.194 4.388 0.108 16 0 "[ . 1 . 2]" 1
1449 2 42 VAL MG1 2 80 VAL MG2 . . 3.700 3.764 3.709 3.798 0.098 8 0 "[ . 1 . 2]" 1
1450 2 42 VAL MG2 2 43 ALA H . . 3.750 2.431 2.183 2.568 . 0 0 "[ . 1 . 2]" 1
1451 2 42 VAL MG2 2 43 ALA HA . . 3.740 3.510 3.372 3.614 . 0 0 "[ . 1 . 2]" 1
1452 2 42 VAL MG2 2 43 ALA MB . . 3.750 3.124 3.017 3.243 . 0 0 "[ . 1 . 2]" 1
1453 2 42 VAL MG2 2 46 GLY H . . 4.940 4.972 4.888 5.021 0.081 10 0 "[ . 1 . 2]" 1
1454 2 42 VAL MG2 2 46 GLY HA2 . . 5.500 5.480 5.305 5.583 0.083 17 0 "[ . 1 . 2]" 1
1455 2 42 VAL MG2 2 47 ARG HA . . 5.000 4.893 4.633 5.072 0.072 16 0 "[ . 1 . 2]" 1
1456 2 42 VAL MG2 2 49 PHE QD . . 4.520 4.365 4.105 4.596 0.076 11 0 "[ . 1 . 2]" 1
1457 2 42 VAL MG2 2 50 LEU HB2 . . 4.200 3.784 3.531 4.002 . 0 0 "[ . 1 . 2]" 1
1458 2 42 VAL MG2 2 50 LEU HG . . 3.810 3.290 3.121 3.450 . 0 0 "[ . 1 . 2]" 1
1459 2 42 VAL MG2 2 76 PHE QE . . 3.880 2.966 2.639 3.104 . 0 0 "[ . 1 . 2]" 1
1460 2 42 VAL MG2 2 76 PHE HZ . . 4.450 2.273 2.137 2.372 . 0 0 "[ . 1 . 2]" 1
1461 2 42 VAL MG2 2 80 VAL H . . 4.630 4.631 4.537 4.704 0.074 9 0 "[ . 1 . 2]" 1
1462 2 42 VAL MG2 2 80 VAL HA . . 4.670 3.536 3.384 3.687 . 0 0 "[ . 1 . 2]" 1
1463 2 42 VAL MG2 2 80 VAL HB . . 4.210 3.922 3.849 3.988 . 0 0 "[ . 1 . 2]" 1
1464 2 42 VAL MG2 2 80 VAL MG1 . . 2.920 2.066 1.984 2.130 . 0 0 "[ . 1 . 2]" 1
1465 2 42 VAL MG2 2 80 VAL MG2 . . 3.050 1.923 1.877 1.968 . 0 0 "[ . 1 . 2]" 1
1466 2 43 ALA H 2 43 ALA MB . . 2.830 2.221 2.165 2.264 . 0 0 "[ . 1 . 2]" 1
1467 2 43 ALA H 2 44 ARG H . . 3.450 2.520 2.361 2.705 . 0 0 "[ . 1 . 2]" 1
1468 2 43 ALA H 2 44 ARG HA . . 5.380 5.207 5.091 5.343 . 0 0 "[ . 1 . 2]" 1
1469 2 43 ALA H 2 45 ASN H . . 4.640 4.289 3.769 4.642 0.002 11 0 "[ . 1 . 2]" 1
1470 2 43 ALA H 2 46 GLY H . . 4.910 4.571 4.380 4.812 . 0 0 "[ . 1 . 2]" 1
1471 2 43 ALA H 2 80 VAL HA . . 4.410 4.379 4.119 4.472 0.062 12 0 "[ . 1 . 2]" 1
1472 2 43 ALA H 2 80 VAL MG1 . . 3.810 3.236 3.057 3.455 . 0 0 "[ . 1 . 2]" 1
1473 2 43 ALA H 2 80 VAL MG2 . . 4.070 3.992 3.614 4.144 0.074 4 0 "[ . 1 . 2]" 1
1474 2 43 ALA H 2 83 TYR HB2 . . 4.760 4.590 4.332 4.801 0.041 18 0 "[ . 1 . 2]" 1
1475 2 43 ALA H 2 84 THR MG . . 5.500 4.446 4.268 4.738 . 0 0 "[ . 1 . 2]" 1
1476 2 43 ALA HA 2 45 ASN H . . 5.160 4.956 4.477 5.226 0.066 18 0 "[ . 1 . 2]" 1
1477 2 43 ALA HA 2 46 GLY H . . 4.480 4.121 3.637 4.540 0.060 15 0 "[ . 1 . 2]" 1
1478 2 43 ALA HA 2 80 VAL HA . . 4.680 4.458 4.049 4.690 0.010 12 0 "[ . 1 . 2]" 1
1479 2 43 ALA HA 2 80 VAL MG1 . . 3.140 2.541 2.397 2.839 . 0 0 "[ . 1 . 2]" 1
1480 2 43 ALA HA 2 80 VAL MG2 . . 4.700 4.593 4.382 4.752 0.052 12 0 "[ . 1 . 2]" 1
1481 2 43 ALA HA 2 83 TYR HB2 . . 5.180 4.639 4.424 4.884 . 0 0 "[ . 1 . 2]" 1
1482 2 43 ALA HA 2 84 THR H . . 5.270 4.766 4.518 4.979 . 0 0 "[ . 1 . 2]" 1
1483 2 43 ALA HA 2 84 THR HA . . 4.740 4.182 3.479 4.522 . 0 0 "[ . 1 . 2]" 1
1484 2 43 ALA HA 2 84 THR MG . . 3.380 2.273 2.071 2.547 . 0 0 "[ . 1 . 2]" 1
1485 2 43 ALA MB 2 44 ARG H . . 2.890 2.726 2.309 2.973 0.083 10 0 "[ . 1 . 2]" 1
1486 2 43 ALA MB 2 46 GLY H . . 5.500 5.023 4.667 5.429 . 0 0 "[ . 1 . 2]" 1
1487 2 43 ALA MB 2 80 VAL HA . . 3.090 2.441 2.086 2.593 . 0 0 "[ . 1 . 2]" 1
1488 2 43 ALA MB 2 80 VAL HB . . 5.170 4.505 4.332 4.629 . 0 0 "[ . 1 . 2]" 1
1489 2 43 ALA MB 2 80 VAL MG1 . . 2.990 2.208 2.148 2.281 . 0 0 "[ . 1 . 2]" 1
1490 2 43 ALA MB 2 83 TYR H . . 3.850 3.737 3.501 3.914 0.064 6 0 "[ . 1 . 2]" 1
1491 2 43 ALA MB 2 83 TYR HA . . 4.320 4.019 3.822 4.163 . 0 0 "[ . 1 . 2]" 1
1492 2 43 ALA MB 2 83 TYR HB2 . . 3.170 2.147 2.026 2.275 . 0 0 "[ . 1 . 2]" 1
1493 2 43 ALA MB 2 83 TYR HB3 . . 3.350 2.389 2.217 2.773 . 0 0 "[ . 1 . 2]" 1
1494 2 43 ALA MB 2 83 TYR QD . . 3.880 3.052 2.589 3.553 . 0 0 "[ . 1 . 2]" 1
1495 2 43 ALA MB 2 84 THR H . . 3.850 2.953 2.790 3.176 . 0 0 "[ . 1 . 2]" 1
1496 2 43 ALA MB 2 84 THR HA . . 3.320 2.736 2.332 3.253 . 0 0 "[ . 1 . 2]" 1
1497 2 43 ALA MB 2 84 THR HB . . 4.710 4.362 4.127 4.598 . 0 0 "[ . 1 . 2]" 1
1498 2 43 ALA MB 2 84 THR MG . . 3.040 2.224 2.077 2.389 . 0 0 "[ . 1 . 2]" 1
1499 2 44 ARG H 2 44 ARG HB2 . . 3.540 2.360 2.210 2.544 . 0 0 "[ . 1 . 2]" 1
1500 2 44 ARG H 2 44 ARG QB . . 3.010 2.292 2.164 2.422 . 0 0 "[ . 1 . 2]" 1
1501 2 44 ARG H 2 44 ARG HB3 . . 3.540 3.370 2.438 3.598 0.058 3 0 "[ . 1 . 2]" 1
1502 2 44 ARG H 2 44 ARG HD2 . . 5.500 4.298 2.632 5.032 . 0 0 "[ . 1 . 2]" 1
1503 2 44 ARG H 2 44 ARG HD3 . . 5.500 4.545 3.480 5.298 . 0 0 "[ . 1 . 2]" 1
1504 2 44 ARG H 2 44 ARG HG2 . . 4.730 4.052 3.440 4.618 . 0 0 "[ . 1 . 2]" 1
1505 2 44 ARG H 2 44 ARG QG . . 3.970 3.005 2.300 4.030 0.060 17 0 "[ . 1 . 2]" 1
1506 2 44 ARG H 2 44 ARG HG3 . . 4.730 3.147 2.336 4.457 . 0 0 "[ . 1 . 2]" 1
1507 2 44 ARG H 2 45 ASN H . . 3.310 2.531 2.137 2.967 . 0 0 "[ . 1 . 2]" 1
1508 2 44 ARG H 2 46 GLY H . . 4.370 3.802 3.270 4.425 0.055 8 0 "[ . 1 . 2]" 1
1509 2 44 ARG H 2 80 VAL MG1 . . 5.220 4.945 4.771 5.133 . 0 0 "[ . 1 . 2]" 1
1510 2 44 ARG HA 2 44 ARG HD2 . . 4.700 4.543 3.323 4.767 0.067 7 0 "[ . 1 . 2]" 1
1511 2 44 ARG HA 2 44 ARG HD3 . . 4.700 4.495 4.272 4.735 0.035 12 0 "[ . 1 . 2]" 1
1512 2 44 ARG HA 2 44 ARG HG2 . . 3.830 2.662 2.335 3.587 . 0 0 "[ . 1 . 2]" 1
1513 2 44 ARG HA 2 44 ARG QG . . 3.280 2.353 2.246 2.532 . 0 0 "[ . 1 . 2]" 1
1514 2 44 ARG HA 2 44 ARG HG3 . . 3.830 2.765 2.317 3.105 . 0 0 "[ . 1 . 2]" 1
1515 2 44 ARG QB 2 44 ARG QD . . 2.970 2.147 1.992 2.419 . 0 0 "[ . 1 . 2]" 1
1516 2 44 ARG QB 2 45 ASN H . . 3.230 2.370 2.041 2.818 . 0 0 "[ . 1 . 2]" 1
1517 2 44 ARG QB 2 45 ASN QD . . 4.160 3.674 2.668 4.248 0.088 6 0 "[ . 1 . 2]" 1
1518 2 44 ARG QB 2 46 GLY H . . 5.340 4.533 4.268 4.977 . 0 0 "[ . 1 . 2]" 1
1519 2 44 ARG HB2 2 45 ASN H . . 3.930 2.661 2.091 3.849 . 0 0 "[ . 1 . 2]" 1
1520 2 44 ARG HB3 2 45 ASN H . . 3.930 3.041 2.409 3.548 . 0 0 "[ . 1 . 2]" 1
1521 2 44 ARG HG2 2 45 ASN H . . 5.030 4.744 3.704 5.091 0.061 4 0 "[ . 1 . 2]" 1
1522 2 44 ARG HG3 2 45 ASN H . . 5.030 4.572 4.268 5.089 0.059 1 0 "[ . 1 . 2]" 1
1523 2 45 ASN H 2 45 ASN HB2 . . 3.730 2.519 2.365 2.599 . 0 0 "[ . 1 . 2]" 1
1524 2 45 ASN H 2 45 ASN HB3 . . 3.730 3.627 3.560 3.755 0.025 1 0 "[ . 1 . 2]" 1
1525 2 45 ASN H 2 45 ASN QD . . 4.070 3.324 2.092 3.796 . 0 0 "[ . 1 . 2]" 1
1526 2 45 ASN H 2 46 GLY H . . 3.140 2.581 2.163 2.808 . 0 0 "[ . 1 . 2]" 1
1527 2 45 ASN H 2 49 PHE HB2 . . 5.500 5.247 4.880 5.552 0.052 3 0 "[ . 1 . 2]" 1
1528 2 45 ASN QB 2 46 GLY H . . 3.880 2.787 1.968 3.295 . 0 0 "[ . 1 . 2]" 1
1529 2 45 ASN QB 2 49 PHE HB2 . . 3.830 2.398 2.090 2.911 . 0 0 "[ . 1 . 2]" 1
1530 2 45 ASN QB 2 49 PHE HB3 . . 3.680 2.598 2.259 3.433 . 0 0 "[ . 1 . 2]" 1
1531 2 45 ASN QB 2 49 PHE QD . . 4.040 3.291 2.931 3.914 . 0 0 "[ . 1 . 2]" 1
1532 2 45 ASN HB2 2 46 GLY H . . 4.680 2.868 1.987 3.432 . 0 0 "[ . 1 . 2]" 1
1533 2 45 ASN HB2 2 49 PHE H . . 4.550 4.193 3.833 4.615 0.065 18 0 "[ . 1 . 2]" 1
1534 2 45 ASN HB2 2 49 PHE HB2 . . 4.420 2.783 2.433 3.210 . 0 0 "[ . 1 . 2]" 1
1535 2 45 ASN HB2 2 49 PHE HB3 . . 4.240 2.685 2.317 3.608 . 0 0 "[ . 1 . 2]" 1
1536 2 45 ASN HB2 2 49 PHE QD . . 4.760 3.513 3.063 4.143 . 0 0 "[ . 1 . 2]" 1
1537 2 45 ASN HB3 2 46 GLY H . . 4.680 3.837 2.976 4.250 . 0 0 "[ . 1 . 2]" 1
1538 2 45 ASN HB3 2 49 PHE H . . 4.550 4.134 3.697 4.607 0.057 17 0 "[ . 1 . 2]" 1
1539 2 45 ASN HB3 2 49 PHE HB2 . . 4.420 2.647 2.208 3.333 . 0 0 "[ . 1 . 2]" 1
1540 2 45 ASN HB3 2 49 PHE HB3 . . 4.240 3.479 2.996 4.303 0.063 18 0 "[ . 1 . 2]" 1
1541 2 45 ASN HB3 2 49 PHE QD . . 4.760 4.013 3.453 4.811 0.051 3 0 "[ . 1 . 2]" 1
1542 2 46 GLY H 2 47 ARG H . . 4.650 4.336 4.216 4.454 . 0 0 "[ . 1 . 2]" 1
1543 2 46 GLY H 2 49 PHE H . . 4.990 4.706 3.994 5.055 0.065 18 0 "[ . 1 . 2]" 1
1544 2 46 GLY H 2 49 PHE HB2 . . 5.160 4.751 3.875 5.134 . 0 0 "[ . 1 . 2]" 1
1545 2 46 GLY H 2 49 PHE QD . . 4.950 4.935 4.427 5.027 0.077 18 0 "[ . 1 . 2]" 1
1546 2 46 GLY HA2 2 47 ARG H . . 3.440 2.454 2.376 2.588 . 0 0 "[ . 1 . 2]" 1
1547 2 46 GLY HA2 2 47 ARG HB2 . . 5.240 4.611 4.481 4.779 . 0 0 "[ . 1 . 2]" 1
1548 2 46 GLY HA2 2 47 ARG HB3 . . 5.500 4.934 4.794 5.151 . 0 0 "[ . 1 . 2]" 1
1549 2 46 GLY HA3 2 47 ARG H . . 3.360 2.568 2.400 2.739 . 0 0 "[ . 1 . 2]" 1
1550 2 46 GLY HA3 2 47 ARG HB2 . . 5.500 5.008 4.808 5.236 . 0 0 "[ . 1 . 2]" 1
1551 2 46 GLY HA3 2 47 ARG HB3 . . 5.500 4.688 4.541 4.899 . 0 0 "[ . 1 . 2]" 1
1552 2 47 ARG H 2 47 ARG HB2 . . 3.210 2.448 2.309 2.655 . 0 0 "[ . 1 . 2]" 1
1553 2 47 ARG H 2 47 ARG HB3 . . 3.620 2.488 2.336 2.666 . 0 0 "[ . 1 . 2]" 1
1554 2 47 ARG H 2 47 ARG HG2 . . 5.150 4.506 4.324 4.600 . 0 0 "[ . 1 . 2]" 1
1555 2 47 ARG H 2 47 ARG QG . . 4.410 4.008 3.903 4.057 . 0 0 "[ . 1 . 2]" 1
1556 2 47 ARG H 2 47 ARG HG3 . . 5.150 4.494 4.383 4.611 . 0 0 "[ . 1 . 2]" 1
1557 2 47 ARG H 2 49 PHE H . . 5.400 4.798 4.653 5.124 . 0 0 "[ . 1 . 2]" 1
1558 2 47 ARG H 2 50 LEU H . . 5.500 5.106 4.943 5.264 . 0 0 "[ . 1 . 2]" 1
1559 2 47 ARG HA 2 47 ARG HD2 . . 4.840 3.474 2.476 4.029 . 0 0 "[ . 1 . 2]" 1
1560 2 47 ARG HA 2 47 ARG QD . . 4.200 2.657 2.121 3.703 . 0 0 "[ . 1 . 2]" 1
1561 2 47 ARG HA 2 47 ARG HD3 . . 4.840 3.011 2.167 4.628 . 0 0 "[ . 1 . 2]" 1
1562 2 47 ARG HA 2 47 ARG HG2 . . 3.880 3.430 2.388 3.931 0.051 7 0 "[ . 1 . 2]" 1
1563 2 47 ARG HA 2 47 ARG QG . . 3.360 2.920 2.356 3.217 . 0 0 "[ . 1 . 2]" 1
1564 2 47 ARG HA 2 47 ARG HG3 . . 3.880 3.399 3.158 3.660 . 0 0 "[ . 1 . 2]" 1
1565 2 47 ARG HA 2 50 LEU H . . 3.730 3.229 3.038 3.387 . 0 0 "[ . 1 . 2]" 1
1566 2 47 ARG HA 2 50 LEU HB2 . . 3.590 2.728 2.290 3.064 . 0 0 "[ . 1 . 2]" 1
1567 2 47 ARG HA 2 50 LEU HB3 . . 4.080 2.961 2.611 3.238 . 0 0 "[ . 1 . 2]" 1
1568 2 47 ARG HA 2 50 LEU MD1 . . 3.650 3.286 2.972 3.607 . 0 0 "[ . 1 . 2]" 1
1569 2 47 ARG HA 2 50 LEU MD2 . . 5.110 4.896 4.624 5.159 0.049 12 0 "[ . 1 . 2]" 1
1570 2 47 ARG HA 2 51 THR H . . 4.140 4.080 3.826 4.211 0.071 19 0 "[ . 1 . 2]" 1
1571 2 47 ARG HB2 2 47 ARG QD . . 3.710 3.026 2.400 3.624 . 0 0 "[ . 1 . 2]" 1
1572 2 47 ARG HB2 2 50 LEU MD1 . . 4.850 4.441 3.896 4.865 0.015 12 0 "[ . 1 . 2]" 1
1573 2 47 ARG HB3 2 47 ARG QD . . 3.540 3.248 2.593 3.548 0.008 18 0 "[ . 1 . 2]" 1
1574 2 47 ARG HB3 2 48 GLN H . . 5.250 2.886 2.656 3.067 . 0 0 "[ . 1 . 2]" 1
1575 2 47 ARG HB3 2 48 GLN HA . . 4.840 4.323 3.966 4.640 . 0 0 "[ . 1 . 2]" 1
1576 2 47 ARG HB3 2 50 LEU H . . 5.500 5.486 5.252 5.568 0.068 18 0 "[ . 1 . 2]" 1
1577 2 47 ARG HB3 2 51 THR H . . 5.420 5.454 5.305 5.485 0.065 3 0 "[ . 1 . 2]" 1
1578 2 47 ARG QD 2 50 LEU MD1 . . 4.470 2.846 2.078 4.460 . 0 0 "[ . 1 . 2]" 1
1579 2 47 ARG QD 2 51 THR H . . 4.300 3.255 2.997 3.783 . 0 0 "[ . 1 . 2]" 1
1580 2 47 ARG QD 2 51 THR MG . . 4.710 4.345 3.663 4.800 0.090 2 0 "[ . 1 . 2]" 1
1581 2 47 ARG HD2 2 50 LEU HB2 . . 5.500 4.530 3.420 5.296 . 0 0 "[ . 1 . 2]" 1
1582 2 47 ARG HD2 2 50 LEU MD1 . . 5.180 3.486 2.342 5.233 0.053 4 0 "[ . 1 . 2]" 1
1583 2 47 ARG HD2 2 51 THR H . . 4.890 3.689 3.082 4.465 . 0 0 "[ . 1 . 2]" 1
1584 2 47 ARG HD3 2 50 LEU HB2 . . 5.500 4.167 2.951 5.570 0.070 4 0 "[ . 1 . 2]" 1
1585 2 47 ARG HD3 2 50 LEU MD1 . . 5.180 3.074 2.192 4.834 . 0 0 "[ . 1 . 2]" 1
1586 2 47 ARG HD3 2 51 THR H . . 4.890 4.081 3.106 4.944 0.054 13 0 "[ . 1 . 2]" 1
1587 2 47 ARG QG 2 50 LEU MD1 . . 4.730 3.772 2.703 4.492 . 0 0 "[ . 1 . 2]" 1
1588 2 47 ARG QG 2 51 THR H . . 5.340 3.858 3.634 4.327 . 0 0 "[ . 1 . 2]" 1
1589 2 47 ARG HG2 2 48 GLN HA . . 5.500 5.251 4.677 5.536 0.036 15 0 "[ . 1 . 2]" 1
1590 2 47 ARG HG3 2 48 GLN HA . . 5.500 4.319 3.563 5.580 0.080 11 0 "[ . 1 . 2]" 1
1591 2 48 GLN H 2 48 GLN HG2 . . 5.500 4.506 4.381 4.737 . 0 0 "[ . 1 . 2]" 1
1592 2 48 GLN H 2 48 GLN HG3 . . 5.500 4.489 4.381 4.620 . 0 0 "[ . 1 . 2]" 1
1593 2 48 GLN H 2 49 PHE H . . 4.690 2.935 2.752 3.060 . 0 0 "[ . 1 . 2]" 1
1594 2 48 GLN HA 2 48 GLN QG . . 3.400 2.606 2.273 3.110 . 0 0 "[ . 1 . 2]" 1
1595 2 48 GLN HA 2 50 LEU H . . 4.530 4.351 4.187 4.563 0.033 11 0 "[ . 1 . 2]" 1
1596 2 48 GLN HA 2 51 THR H . . 3.890 3.529 3.221 3.744 . 0 0 "[ . 1 . 2]" 1
1597 2 48 GLN HA 2 51 THR MG . . 4.630 4.361 3.938 4.614 . 0 0 "[ . 1 . 2]" 1
1598 2 48 GLN HA 2 52 GLN HG3 . . 4.840 4.260 3.798 4.654 . 0 0 "[ . 1 . 2]" 1
1599 2 48 GLN HB2 2 49 PHE H . . 3.990 3.884 3.688 4.042 0.052 17 0 "[ . 1 . 2]" 1
1600 2 48 GLN HB2 2 51 THR HB . . 5.500 5.336 4.926 5.568 0.068 18 0 "[ . 1 . 2]" 1
1601 2 48 GLN HB3 2 49 PHE H . . 4.020 2.533 2.358 2.773 . 0 0 "[ . 1 . 2]" 1
1602 2 48 GLN HB3 2 49 PHE HA . . 4.830 4.440 4.176 4.754 . 0 0 "[ . 1 . 2]" 1
1603 2 48 GLN QG 2 49 PHE H . . 4.660 3.514 3.004 4.052 . 0 0 "[ . 1 . 2]" 1
1604 2 48 GLN QG 2 52 GLN QE . . 4.300 2.981 2.580 3.572 . 0 0 "[ . 1 . 2]" 1
1605 2 48 GLN HG2 2 49 PHE H . . 5.500 3.819 3.081 4.909 . 0 0 "[ . 1 . 2]" 1
1606 2 48 GLN HG2 2 52 GLN HE21 . . 5.500 3.355 2.651 4.621 . 0 0 "[ . 1 . 2]" 1
1607 2 48 GLN HG2 2 52 GLN HE22 . . 5.500 4.507 3.761 5.558 0.058 2 0 "[ . 1 . 2]" 1
1608 2 48 GLN HG3 2 49 PHE H . . 5.500 4.421 3.200 4.859 . 0 0 "[ . 1 . 2]" 1
1609 2 48 GLN HG3 2 52 GLN HE21 . . 5.500 4.159 2.864 5.210 . 0 0 "[ . 1 . 2]" 1
1610 2 48 GLN HG3 2 52 GLN HE22 . . 5.500 5.194 3.924 5.561 0.061 19 0 "[ . 1 . 2]" 1
1611 2 49 PHE H 2 49 PHE HB2 . . 3.430 2.466 2.320 2.581 . 0 0 "[ . 1 . 2]" 1
1612 2 49 PHE H 2 49 PHE HB3 . . 3.410 2.406 2.269 2.576 . 0 0 "[ . 1 . 2]" 1
1613 2 49 PHE H 2 49 PHE QD . . 4.400 4.151 4.093 4.200 . 0 0 "[ . 1 . 2]" 1
1614 2 49 PHE H 2 50 LEU HA . . 5.500 5.419 5.264 5.500 0.000 12 0 "[ . 1 . 2]" 1
1615 2 49 PHE H 2 51 THR H . . 5.500 4.487 4.249 4.682 . 0 0 "[ . 1 . 2]" 1
1616 2 49 PHE HA 2 49 PHE QD . . 3.650 2.823 2.488 3.262 . 0 0 "[ . 1 . 2]" 1
1617 2 49 PHE HA 2 52 GLN H . . 4.130 3.509 3.251 3.743 . 0 0 "[ . 1 . 2]" 1
1618 2 49 PHE HA 2 52 GLN HB2 . . 4.180 2.766 2.602 3.024 . 0 0 "[ . 1 . 2]" 1
1619 2 49 PHE HA 2 52 GLN HB3 . . 4.750 4.380 4.165 4.611 . 0 0 "[ . 1 . 2]" 1
1620 2 49 PHE HA 2 52 GLN QE . . 4.730 3.242 2.599 4.025 . 0 0 "[ . 1 . 2]" 1
1621 2 49 PHE HA 2 52 GLN HG2 . . 4.940 4.606 4.282 4.971 0.031 18 0 "[ . 1 . 2]" 1
1622 2 49 PHE HA 2 53 LEU H . . 4.630 4.238 4.062 4.536 . 0 0 "[ . 1 . 2]" 1
1623 2 49 PHE HB2 2 50 LEU H . . 4.670 3.959 3.703 4.087 . 0 0 "[ . 1 . 2]" 1
1624 2 49 PHE HB3 2 50 LEU H . . 4.170 2.674 2.284 2.873 . 0 0 "[ . 1 . 2]" 1
1625 2 49 PHE HB3 2 50 LEU HA . . 4.860 4.454 4.011 4.604 . 0 0 "[ . 1 . 2]" 1
1626 2 49 PHE QD 2 50 LEU H . . 4.020 3.492 3.035 3.719 . 0 0 "[ . 1 . 2]" 1
1627 2 49 PHE QD 2 50 LEU HA . . 4.210 3.574 3.073 3.934 . 0 0 "[ . 1 . 2]" 1
1628 2 49 PHE QD 2 50 LEU MD1 . . 5.500 5.496 5.212 5.598 0.098 14 0 "[ . 1 . 2]" 1
1629 2 49 PHE QD 2 50 LEU MD2 . . 5.500 5.437 5.042 5.599 0.099 14 0 "[ . 1 . 2]" 1
1630 2 49 PHE QE 2 53 LEU MD1 . . 3.940 2.557 2.151 3.384 . 0 0 "[ . 1 . 2]" 1
1631 2 49 PHE QE 2 53 LEU MD2 . . 4.460 4.036 3.491 4.536 0.076 17 0 "[ . 1 . 2]" 1
1632 2 49 PHE HZ 2 53 LEU MD1 . . 4.580 3.004 2.471 3.711 . 0 0 "[ . 1 . 2]" 1
1633 2 49 PHE HZ 2 53 LEU MD2 . . 4.840 3.845 3.289 4.408 . 0 0 "[ . 1 . 2]" 1
1634 2 50 LEU H 2 50 LEU HB2 . . 3.380 2.267 2.191 2.347 . 0 0 "[ . 1 . 2]" 1
1635 2 50 LEU H 2 50 LEU HB3 . . 3.270 2.786 2.706 2.903 . 0 0 "[ . 1 . 2]" 1
1636 2 50 LEU H 2 50 LEU MD1 . . 4.210 4.207 4.138 4.255 0.045 4 0 "[ . 1 . 2]" 1
1637 2 50 LEU H 2 50 LEU MD2 . . 4.510 4.323 4.279 4.373 . 0 0 "[ . 1 . 2]" 1
1638 2 50 LEU H 2 50 LEU HG . . 4.420 4.300 4.155 4.403 . 0 0 "[ . 1 . 2]" 1
1639 2 50 LEU H 2 51 THR H . . 3.460 2.784 2.701 2.852 . 0 0 "[ . 1 . 2]" 1
1640 2 50 LEU H 2 51 THR HB . . 5.080 4.944 4.765 5.099 0.019 18 0 "[ . 1 . 2]" 1
1641 2 50 LEU H 2 52 GLN H . . 4.360 4.151 4.003 4.372 0.012 14 0 "[ . 1 . 2]" 1
1642 2 50 LEU HA 2 50 LEU MD1 . . 3.930 3.847 3.803 3.908 . 0 0 "[ . 1 . 2]" 1
1643 2 50 LEU HA 2 50 LEU MD2 . . 2.960 2.578 2.455 2.721 . 0 0 "[ . 1 . 2]" 1
1644 2 50 LEU HA 2 50 LEU HG . . 3.510 2.603 2.495 2.726 . 0 0 "[ . 1 . 2]" 1
1645 2 50 LEU HA 2 52 GLN H . . 4.900 4.597 4.373 4.891 . 0 0 "[ . 1 . 2]" 1
1646 2 50 LEU HA 2 53 LEU H . . 4.050 3.656 3.537 3.816 . 0 0 "[ . 1 . 2]" 1
1647 2 50 LEU HA 2 53 LEU HB2 . . 3.390 2.957 2.709 3.090 . 0 0 "[ . 1 . 2]" 1
1648 2 50 LEU HA 2 53 LEU HB3 . . 4.620 4.542 4.128 4.677 0.057 1 0 "[ . 1 . 2]" 1
1649 2 50 LEU HA 2 53 LEU MD1 . . 4.360 2.857 2.631 3.509 . 0 0 "[ . 1 . 2]" 1
1650 2 50 LEU HA 2 54 MET H . . 4.820 4.367 4.152 4.620 . 0 0 "[ . 1 . 2]" 1
1651 2 50 LEU HB2 2 50 LEU MD1 . . 3.320 2.355 2.313 2.405 . 0 0 "[ . 1 . 2]" 1
1652 2 50 LEU HB2 2 51 THR H . . 3.480 3.519 3.432 3.541 0.061 15 0 "[ . 1 . 2]" 1
1653 2 50 LEU HB3 2 50 LEU MD1 . . 3.000 2.294 2.206 2.346 . 0 0 "[ . 1 . 2]" 1
1654 2 50 LEU HB3 2 50 LEU MD2 . . 3.130 2.494 2.365 2.572 . 0 0 "[ . 1 . 2]" 1
1655 2 50 LEU HB3 2 51 THR H . . 3.420 2.321 2.205 2.407 . 0 0 "[ . 1 . 2]" 1
1656 2 50 LEU HB3 2 51 THR HA . . 4.070 3.991 3.913 4.044 . 0 0 "[ . 1 . 2]" 1
1657 2 50 LEU HB3 2 54 MET QG . . 5.340 4.617 4.283 4.839 . 0 0 "[ . 1 . 2]" 1
1658 2 50 LEU MD1 2 51 THR H . . 4.440 4.194 4.010 4.333 . 0 0 "[ . 1 . 2]" 1
1659 2 50 LEU MD1 2 54 MET ME . . 4.720 4.810 4.778 4.827 0.107 7 0 "[ . 1 . 2]" 1
1660 2 50 LEU MD1 2 66 LEU MD2 . . 3.840 3.336 2.959 3.592 . 0 0 "[ . 1 . 2]" 1
1661 2 50 LEU MD1 2 76 PHE QD . . 5.040 4.138 3.847 4.338 . 0 0 "[ . 1 . 2]" 1
1662 2 50 LEU MD1 2 76 PHE QE . . 3.890 2.135 2.061 2.246 . 0 0 "[ . 1 . 2]" 1
1663 2 50 LEU MD1 2 76 PHE HZ . . 4.120 2.744 2.434 3.089 . 0 0 "[ . 1 . 2]" 1
1664 2 50 LEU MD2 2 51 THR H . . 3.690 3.504 3.321 3.687 . 0 0 "[ . 1 . 2]" 1
1665 2 50 LEU MD2 2 53 LEU H . . 4.640 4.446 4.291 4.563 . 0 0 "[ . 1 . 2]" 1
1666 2 50 LEU MD2 2 53 LEU HB2 . . 4.500 3.391 3.291 3.498 . 0 0 "[ . 1 . 2]" 1
1667 2 50 LEU MD2 2 53 LEU HB3 . . 4.340 4.283 3.821 4.411 0.071 14 0 "[ . 1 . 2]" 1
1668 2 50 LEU MD2 2 53 LEU MD1 . . 3.770 3.864 3.852 3.885 0.115 4 0 "[ . 1 . 2]" 1
1669 2 50 LEU MD2 2 54 MET H . . 4.210 3.473 3.360 3.676 . 0 0 "[ . 1 . 2]" 1
1670 2 50 LEU MD2 2 54 MET HA . . 4.800 4.611 4.387 4.835 0.035 17 0 "[ . 1 . 2]" 1
1671 2 50 LEU MD2 2 54 MET HB2 . . 4.650 3.908 3.777 4.112 . 0 0 "[ . 1 . 2]" 1
1672 2 50 LEU MD2 2 54 MET HB3 . . 4.760 4.476 4.314 4.653 . 0 0 "[ . 1 . 2]" 1
1673 2 50 LEU MD2 2 54 MET ME . . 3.380 3.445 3.341 3.479 0.099 14 0 "[ . 1 . 2]" 1
1674 2 50 LEU MD2 2 54 MET HG2 . . 4.040 3.067 2.723 3.220 . 0 0 "[ . 1 . 2]" 1
1675 2 50 LEU MD2 2 54 MET QG . . 3.440 2.132 1.950 2.305 . 0 0 "[ . 1 . 2]" 1
1676 2 50 LEU MD2 2 54 MET HG3 . . 4.040 2.175 1.997 2.361 . 0 0 "[ . 1 . 2]" 1
1677 2 50 LEU MD2 2 66 LEU HA . . 4.480 3.866 3.539 4.239 . 0 0 "[ . 1 . 2]" 1
1678 2 50 LEU MD2 2 66 LEU HB3 . . 4.300 2.591 2.358 2.840 . 0 0 "[ . 1 . 2]" 1
1679 2 50 LEU MD2 2 66 LEU MD1 . . 3.310 2.488 2.245 2.640 . 0 0 "[ . 1 . 2]" 1
1680 2 50 LEU MD2 2 66 LEU MD2 . . 2.900 2.176 2.027 2.385 . 0 0 "[ . 1 . 2]" 1
1681 2 50 LEU MD2 2 76 PHE QE . . 3.550 3.410 2.708 3.633 0.083 8 0 "[ . 1 . 2]" 1
1682 2 50 LEU MD2 2 76 PHE HZ . . 3.570 3.440 2.917 3.636 0.066 2 0 "[ . 1 . 2]" 1
1683 2 50 LEU HG 2 51 THR H . . 4.900 4.915 4.829 4.956 0.056 3 0 "[ . 1 . 2]" 1
1684 2 50 LEU HG 2 54 MET QG . . 5.340 4.495 4.331 4.707 . 0 0 "[ . 1 . 2]" 1
1685 2 50 LEU HG 2 66 LEU MD2 . . 4.480 2.927 2.449 3.355 . 0 0 "[ . 1 . 2]" 1
1686 2 50 LEU HG 2 76 PHE HZ . . 5.040 2.478 2.263 2.730 . 0 0 "[ . 1 . 2]" 1
1687 2 51 THR H 2 51 THR HB . . 3.060 2.559 2.442 2.697 . 0 0 "[ . 1 . 2]" 1
1688 2 51 THR H 2 51 THR MG . . 3.770 3.740 3.705 3.799 0.029 14 0 "[ . 1 . 2]" 1
1689 2 51 THR H 2 52 GLN H . . 3.370 2.869 2.804 2.989 . 0 0 "[ . 1 . 2]" 1
1690 2 51 THR H 2 52 GLN HG2 . . 5.500 5.516 5.055 5.575 0.075 19 0 "[ . 1 . 2]" 1
1691 2 51 THR H 2 52 GLN HG3 . . 4.920 4.885 4.659 4.994 0.074 2 0 "[ . 1 . 2]" 1
1692 2 51 THR H 2 53 LEU H . . 4.740 4.394 4.272 4.542 . 0 0 "[ . 1 . 2]" 1
1693 2 51 THR HA 2 51 THR MG . . 2.870 2.356 2.205 2.447 . 0 0 "[ . 1 . 2]" 1
1694 2 51 THR HA 2 53 LEU H . . 4.950 4.411 4.226 4.575 . 0 0 "[ . 1 . 2]" 1
1695 2 51 THR HA 2 54 MET H . . 3.910 3.278 3.189 3.383 . 0 0 "[ . 1 . 2]" 1
1696 2 51 THR HA 2 54 MET HB2 . . 3.940 2.602 2.405 2.808 . 0 0 "[ . 1 . 2]" 1
1697 2 51 THR HA 2 54 MET HB3 . . 4.710 4.216 3.971 4.401 . 0 0 "[ . 1 . 2]" 1
1698 2 51 THR HA 2 54 MET HG2 . . 4.540 4.579 4.422 4.610 0.070 7 0 "[ . 1 . 2]" 1
1699 2 51 THR HA 2 54 MET HG3 . . 4.540 3.108 2.951 3.310 . 0 0 "[ . 1 . 2]" 1
1700 2 51 THR HA 2 55 GLN H . . 4.700 4.486 3.858 4.753 0.053 8 0 "[ . 1 . 2]" 1
1701 2 51 THR HA 2 55 GLN QE . . 5.320 4.519 2.690 5.332 0.012 6 0 "[ . 1 . 2]" 1
1702 2 51 THR HB 2 52 GLN H . . 3.250 2.682 2.540 2.824 . 0 0 "[ . 1 . 2]" 1
1703 2 51 THR HB 2 52 GLN HA . . 4.380 4.338 4.179 4.427 0.047 1 0 "[ . 1 . 2]" 1
1704 2 51 THR HB 2 52 GLN HB2 . . 5.090 5.104 4.944 5.151 0.061 3 0 "[ . 1 . 2]" 1
1705 2 51 THR HB 2 52 GLN HG2 . . 4.530 4.091 3.461 4.296 . 0 0 "[ . 1 . 2]" 1
1706 2 51 THR HB 2 52 GLN HG3 . . 4.340 4.135 3.645 4.388 0.048 7 0 "[ . 1 . 2]" 1
1707 2 51 THR MG 2 52 GLN H . . 3.640 3.610 3.458 3.702 0.062 2 0 "[ . 1 . 2]" 1
1708 2 51 THR MG 2 52 GLN HA . . 4.100 3.695 3.468 3.839 . 0 0 "[ . 1 . 2]" 1
1709 2 51 THR MG 2 52 GLN HG2 . . 4.710 4.186 3.626 4.433 . 0 0 "[ . 1 . 2]" 1
1710 2 51 THR MG 2 52 GLN HG3 . . 5.010 4.888 4.427 5.084 0.074 5 0 "[ . 1 . 2]" 1
1711 2 51 THR MG 2 54 MET H . . 4.520 4.583 4.484 4.602 0.082 18 0 "[ . 1 . 2]" 1
1712 2 51 THR MG 2 54 MET HB2 . . 4.020 3.416 3.312 3.632 . 0 0 "[ . 1 . 2]" 1
1713 2 51 THR MG 2 55 GLN H . . 4.860 4.352 3.819 4.683 . 0 0 "[ . 1 . 2]" 1
1714 2 51 THR MG 2 55 GLN HB2 . . 4.990 4.469 3.611 5.040 0.050 1 0 "[ . 1 . 2]" 1
1715 2 51 THR MG 2 55 GLN HB3 . . 5.500 5.180 4.396 5.570 0.070 14 0 "[ . 1 . 2]" 1
1716 2 51 THR MG 2 55 GLN HE21 . . 4.670 3.551 2.297 4.708 0.038 8 0 "[ . 1 . 2]" 1
1717 2 51 THR MG 2 55 GLN QE . . 4.070 3.318 1.981 4.118 0.048 8 0 "[ . 1 . 2]" 1
1718 2 51 THR MG 2 55 GLN HE22 . . 4.670 4.281 2.002 4.762 0.092 12 0 "[ . 1 . 2]" 1
1719 2 51 THR MG 2 55 GLN HG2 . . 4.130 2.819 2.414 4.025 . 0 0 "[ . 1 . 2]" 1
1720 2 51 THR MG 2 55 GLN QG . . 3.520 2.666 2.125 3.649 0.129 14 0 "[ . 1 . 2]" 1
1721 2 51 THR MG 2 55 GLN HG3 . . 4.130 3.345 2.358 4.177 0.047 14 0 "[ . 1 . 2]" 1
1722 2 52 GLN H 2 52 GLN HB2 . . 3.150 2.520 2.422 2.599 . 0 0 "[ . 1 . 2]" 1
1723 2 52 GLN H 2 52 GLN HB3 . . 3.630 3.614 3.587 3.647 0.017 11 0 "[ . 1 . 2]" 1
1724 2 52 GLN H 2 52 GLN HG2 . . 3.620 2.922 2.580 3.044 . 0 0 "[ . 1 . 2]" 1
1725 2 52 GLN H 2 52 GLN HG3 . . 3.360 2.537 2.208 2.704 . 0 0 "[ . 1 . 2]" 1
1726 2 52 GLN H 2 53 LEU H . . 3.370 2.835 2.749 2.984 . 0 0 "[ . 1 . 2]" 1
1727 2 52 GLN H 2 53 LEU HA . . 5.500 5.446 5.383 5.557 0.057 14 0 "[ . 1 . 2]" 1
1728 2 52 GLN H 2 53 LEU HB2 . . 4.860 4.812 4.567 4.919 0.059 14 0 "[ . 1 . 2]" 1
1729 2 52 GLN H 2 53 LEU HG . . 5.500 5.300 5.024 5.559 0.059 17 0 "[ . 1 . 2]" 1
1730 2 52 GLN H 2 54 MET H . . 4.800 4.298 4.152 4.442 . 0 0 "[ . 1 . 2]" 1
1731 2 52 GLN HA 2 52 GLN HG2 . . 3.280 2.337 2.264 2.439 . 0 0 "[ . 1 . 2]" 1
1732 2 52 GLN HA 2 52 GLN HG3 . . 3.600 3.433 3.262 3.584 . 0 0 "[ . 1 . 2]" 1
1733 2 52 GLN HA 2 54 MET H . . 4.850 4.528 4.358 4.679 . 0 0 "[ . 1 . 2]" 1
1734 2 52 GLN HA 2 55 GLN H . . 3.900 3.486 3.286 3.643 . 0 0 "[ . 1 . 2]" 1
1735 2 52 GLN HA 2 55 GLN HB2 . . 3.250 2.923 2.540 3.299 0.049 14 0 "[ . 1 . 2]" 1
1736 2 52 GLN HA 2 55 GLN QG . . 4.180 3.234 2.606 4.252 0.072 14 0 "[ . 1 . 2]" 1
1737 2 52 GLN HB2 2 53 LEU H . . 3.760 2.690 2.417 3.001 . 0 0 "[ . 1 . 2]" 1
1738 2 52 GLN HB3 2 53 LEU H . . 3.910 3.634 3.374 3.956 0.046 4 0 "[ . 1 . 2]" 1
1739 2 52 GLN HB3 2 55 GLN H . . 5.500 5.161 4.977 5.474 . 0 0 "[ . 1 . 2]" 1
1740 2 52 GLN HG2 2 53 LEU H . . 4.840 4.831 4.689 4.883 0.043 12 0 "[ . 1 . 2]" 1
1741 2 52 GLN HG3 2 53 LEU H . . 4.530 4.503 4.270 4.592 0.062 7 0 "[ . 1 . 2]" 1
1742 2 53 LEU H 2 53 LEU HB2 . . 3.450 2.298 2.159 2.380 . 0 0 "[ . 1 . 2]" 1
1743 2 53 LEU H 2 53 LEU HB3 . . 4.040 3.573 3.466 3.612 . 0 0 "[ . 1 . 2]" 1
1744 2 53 LEU H 2 53 LEU MD1 . . 4.120 3.655 3.449 4.025 . 0 0 "[ . 1 . 2]" 1
1745 2 53 LEU H 2 53 LEU MD2 . . 4.100 3.898 3.696 4.062 . 0 0 "[ . 1 . 2]" 1
1746 2 53 LEU H 2 53 LEU HG . . 3.380 2.795 2.462 3.070 . 0 0 "[ . 1 . 2]" 1
1747 2 53 LEU H 2 54 MET H . . 3.610 2.761 2.660 2.872 . 0 0 "[ . 1 . 2]" 1
1748 2 53 LEU H 2 55 GLN H . . 4.740 4.070 3.908 4.183 . 0 0 "[ . 1 . 2]" 1
1749 2 53 LEU HA 2 53 LEU MD1 . . 4.280 3.838 3.776 3.873 . 0 0 "[ . 1 . 2]" 1
1750 2 53 LEU HA 2 53 LEU MD2 . . 3.060 2.081 2.021 2.142 . 0 0 "[ . 1 . 2]" 1
1751 2 53 LEU HA 2 53 LEU HG . . 4.120 2.801 2.648 3.002 . 0 0 "[ . 1 . 2]" 1
1752 2 53 LEU HA 2 55 GLN H . . 4.810 3.961 3.729 4.351 . 0 0 "[ . 1 . 2]" 1
1753 2 53 LEU HA 2 56 LYS H . . 4.270 3.574 3.385 3.882 . 0 0 "[ . 1 . 2]" 1
1754 2 53 LEU HA 2 56 LYS QB . . 4.440 4.083 2.329 4.498 0.058 13 0 "[ . 1 . 2]" 1
1755 2 53 LEU HA 2 56 LYS HD2 . . 4.830 3.591 2.903 4.573 . 0 0 "[ . 1 . 2]" 1
1756 2 53 LEU HA 2 56 LYS QD . . 4.130 3.009 2.143 3.548 . 0 0 "[ . 1 . 2]" 1
1757 2 53 LEU HA 2 56 LYS HD3 . . 4.830 3.797 2.161 4.876 0.046 11 0 "[ . 1 . 2]" 1
1758 2 53 LEU HA 2 56 LYS QG . . 4.400 2.356 2.013 4.073 . 0 0 "[ . 1 . 2]" 1
1759 2 53 LEU HA 2 57 GLU H . . 4.600 3.723 3.527 3.882 . 0 0 "[ . 1 . 2]" 1
1760 2 53 LEU HA 2 57 GLU QG . . 4.780 3.836 3.170 4.394 . 0 0 "[ . 1 . 2]" 1
1761 2 53 LEU HB2 2 53 LEU MD1 . . 3.500 2.264 2.224 2.299 . 0 0 "[ . 1 . 2]" 1
1762 2 53 LEU HB2 2 54 MET H . . 3.810 2.693 2.593 2.890 . 0 0 "[ . 1 . 2]" 1
1763 2 53 LEU HB2 2 66 LEU MD1 . . 4.130 3.069 2.484 3.631 . 0 0 "[ . 1 . 2]" 1
1764 2 53 LEU HB3 2 53 LEU MD2 . . 3.350 2.358 2.271 2.492 . 0 0 "[ . 1 . 2]" 1
1765 2 53 LEU HB3 2 54 MET H . . 3.930 3.299 3.129 3.472 . 0 0 "[ . 1 . 2]" 1
1766 2 53 LEU HB3 2 54 MET HA . . 4.980 4.095 3.903 4.266 . 0 0 "[ . 1 . 2]" 1
1767 2 53 LEU HB3 2 63 PHE QD . . 5.330 3.482 2.971 4.623 . 0 0 "[ . 1 . 2]" 1
1768 2 53 LEU HB3 2 66 LEU MD1 . . 4.080 2.639 2.168 3.092 . 0 0 "[ . 1 . 2]" 1
1769 2 53 LEU MD1 2 54 MET H . . 4.710 4.517 4.431 4.680 . 0 0 "[ . 1 . 2]" 1
1770 2 53 LEU MD1 2 63 PHE QD . . 4.680 3.639 2.711 4.174 . 0 0 "[ . 1 . 2]" 1
1771 2 53 LEU MD1 2 63 PHE QE . . 4.270 2.987 2.041 3.825 . 0 0 "[ . 1 . 2]" 1
1772 2 53 LEU MD1 2 63 PHE HZ . . 4.790 4.723 4.131 4.867 0.077 3 0 "[ . 1 . 2]" 1
1773 2 53 LEU MD1 2 66 LEU MD1 . . 3.600 2.908 2.429 3.486 . 0 0 "[ . 1 . 2]" 1
1774 2 53 LEU MD1 2 66 LEU MD2 . . 3.880 3.615 3.020 3.956 0.076 20 0 "[ . 1 . 2]" 1
1775 2 53 LEU MD2 2 54 MET H . . 4.820 4.734 4.645 4.810 . 0 0 "[ . 1 . 2]" 1
1776 2 53 LEU MD2 2 56 LYS HD2 . . 4.610 3.139 2.208 4.237 . 0 0 "[ . 1 . 2]" 1
1777 2 53 LEU MD2 2 56 LYS HD3 . . 4.610 3.267 2.286 4.223 . 0 0 "[ . 1 . 2]" 1
1778 2 53 LEU MD2 2 56 LYS HE2 . . 5.500 3.913 2.675 5.025 . 0 0 "[ . 1 . 2]" 1
1779 2 53 LEU MD2 2 56 LYS HE3 . . 5.500 3.835 2.175 5.564 0.064 14 0 "[ . 1 . 2]" 1
1780 2 53 LEU MD2 2 56 LYS QG . . 5.170 3.025 2.678 4.719 . 0 0 "[ . 1 . 2]" 1
1781 2 53 LEU MD2 2 57 GLU H . . 4.410 4.467 4.387 4.493 0.083 9 0 "[ . 1 . 2]" 1
1782 2 53 LEU MD2 2 57 GLU HB2 . . 5.240 3.935 3.576 4.336 . 0 0 "[ . 1 . 2]" 1
1783 2 53 LEU MD2 2 57 GLU QB . . 4.410 3.784 3.460 4.153 . 0 0 "[ . 1 . 2]" 1
1784 2 53 LEU MD2 2 57 GLU HB3 . . 5.240 4.927 4.574 5.335 0.095 18 0 "[ . 1 . 2]" 1
1785 2 53 LEU MD2 2 57 GLU HG2 . . 4.000 3.458 2.678 4.058 0.058 16 0 "[ . 1 . 2]" 1
1786 2 53 LEU MD2 2 57 GLU QG . . 3.430 2.976 2.310 3.523 0.093 18 0 "[ . 1 . 2]" 1
1787 2 53 LEU MD2 2 57 GLU HG3 . . 4.000 3.282 2.523 3.873 . 0 0 "[ . 1 . 2]" 1
1788 2 53 LEU MD2 2 63 PHE QE . . 3.800 2.690 2.145 3.807 0.007 12 0 "[ . 1 . 2]" 1
1789 2 53 LEU MD2 2 63 PHE HZ . . 4.670 3.680 3.293 4.334 . 0 0 "[ . 1 . 2]" 1
1790 2 53 LEU MD2 2 66 LEU MD2 . . 5.500 5.194 4.567 5.539 0.039 19 0 "[ . 1 . 2]" 1
1791 2 54 MET H 2 54 MET HB2 . . 3.630 2.528 2.424 2.595 . 0 0 "[ . 1 . 2]" 1
1792 2 54 MET H 2 54 MET HB3 . . 3.660 3.616 3.568 3.653 . 0 0 "[ . 1 . 2]" 1
1793 2 54 MET H 2 54 MET ME . . 4.860 4.802 4.699 4.903 0.043 3 0 "[ . 1 . 2]" 1
1794 2 54 MET H 2 54 MET HG2 . . 3.730 3.303 3.078 3.490 . 0 0 "[ . 1 . 2]" 1
1795 2 54 MET H 2 54 MET QG . . 3.210 2.173 2.048 2.310 . 0 0 "[ . 1 . 2]" 1
1796 2 54 MET H 2 54 MET HG3 . . 3.730 2.205 2.069 2.360 . 0 0 "[ . 1 . 2]" 1
1797 2 54 MET H 2 55 GLN H . . 3.390 2.774 2.669 2.853 . 0 0 "[ . 1 . 2]" 1
1798 2 54 MET H 2 55 GLN HB2 . . 5.210 5.043 4.779 5.265 0.055 8 0 "[ . 1 . 2]" 1
1799 2 54 MET H 2 56 LYS H . . 5.120 4.656 4.321 4.828 . 0 0 "[ . 1 . 2]" 1
1800 2 54 MET H 2 57 GLU H . . 5.500 4.962 4.854 5.102 . 0 0 "[ . 1 . 2]" 1
1801 2 54 MET H 2 66 LEU MD1 . . 4.480 3.453 3.124 3.867 . 0 0 "[ . 1 . 2]" 1
1802 2 54 MET HA 2 54 MET ME . . 3.870 3.792 3.388 3.951 0.081 18 0 "[ . 1 . 2]" 1
1803 2 54 MET HA 2 54 MET HG2 . . 3.650 2.445 2.363 2.537 . 0 0 "[ . 1 . 2]" 1
1804 2 54 MET HA 2 54 MET QG . . 3.200 2.358 2.303 2.426 . 0 0 "[ . 1 . 2]" 1
1805 2 54 MET HA 2 54 MET HG3 . . 3.650 3.108 2.938 3.318 . 0 0 "[ . 1 . 2]" 1
1806 2 54 MET HA 2 57 GLU H . . 4.480 4.021 3.784 4.289 . 0 0 "[ . 1 . 2]" 1
1807 2 54 MET HA 2 66 LEU MD1 . . 3.810 3.111 2.745 3.491 . 0 0 "[ . 1 . 2]" 1
1808 2 54 MET HB2 2 55 GLN H . . 3.170 3.108 2.691 3.241 0.071 20 0 "[ . 1 . 2]" 1
1809 2 54 MET HB2 2 55 GLN QE . . 4.810 3.179 2.110 3.638 . 0 0 "[ . 1 . 2]" 1
1810 2 54 MET HB2 2 66 LEU MD1 . . 5.000 4.515 4.235 4.767 . 0 0 "[ . 1 . 2]" 1
1811 2 54 MET HB3 2 55 GLN H . . 4.630 3.991 3.637 4.144 . 0 0 "[ . 1 . 2]" 1
1812 2 54 MET HB3 2 55 GLN HE21 . . 4.910 3.596 3.187 4.192 . 0 0 "[ . 1 . 2]" 1
1813 2 54 MET HB3 2 55 GLN QE . . 4.180 3.423 2.751 3.963 . 0 0 "[ . 1 . 2]" 1
1814 2 54 MET HB3 2 55 GLN HE22 . . 4.910 4.484 2.977 4.969 0.059 7 0 "[ . 1 . 2]" 1
1815 2 54 MET HB3 2 66 LEU MD1 . . 4.460 4.371 4.141 4.523 0.063 20 0 "[ . 1 . 2]" 1
1816 2 54 MET ME 2 54 MET HG2 . . 3.470 2.311 2.238 2.387 . 0 0 "[ . 1 . 2]" 1
1817 2 54 MET ME 2 54 MET HG3 . . 3.470 3.351 3.304 3.389 . 0 0 "[ . 1 . 2]" 1
1818 2 54 MET ME 2 55 GLN QE . . 4.970 4.547 3.933 5.068 0.098 15 0 "[ . 1 . 2]" 1
1819 2 54 MET ME 2 66 LEU HA . . 4.080 4.086 3.983 4.150 0.070 8 0 "[ . 1 . 2]" 1
1820 2 54 MET ME 2 66 LEU HB2 . . 3.560 2.700 2.264 2.986 . 0 0 "[ . 1 . 2]" 1
1821 2 54 MET ME 2 66 LEU HB3 . . 3.790 2.584 2.282 2.784 . 0 0 "[ . 1 . 2]" 1
1822 2 54 MET ME 2 66 LEU MD1 . . 3.840 3.678 3.176 3.918 0.078 8 0 "[ . 1 . 2]" 1
1823 2 54 MET ME 2 66 LEU MD2 . . 4.380 4.275 3.998 4.448 0.068 18 0 "[ . 1 . 2]" 1
1824 2 54 MET ME 2 67 ARG H . . 4.410 3.614 3.300 3.928 . 0 0 "[ . 1 . 2]" 1
1825 2 54 MET ME 2 67 ARG HA . . 3.620 2.474 2.014 2.832 . 0 0 "[ . 1 . 2]" 1
1826 2 54 MET ME 2 67 ARG HD2 . . 4.660 4.026 3.422 4.605 . 0 0 "[ . 1 . 2]" 1
1827 2 54 MET ME 2 67 ARG QD . . 3.910 3.691 3.305 3.991 0.081 20 0 "[ . 1 . 2]" 1
1828 2 54 MET ME 2 67 ARG HD3 . . 4.660 4.388 3.845 4.699 0.039 3 0 "[ . 1 . 2]" 1
1829 2 54 MET ME 2 67 ARG HG2 . . 4.170 2.249 2.041 2.433 . 0 0 "[ . 1 . 2]" 1
1830 2 54 MET ME 2 67 ARG HG3 . . 3.810 2.720 2.219 3.380 . 0 0 "[ . 1 . 2]" 1
1831 2 54 MET ME 2 68 PRO HD2 . . 4.100 3.740 3.135 4.107 0.007 14 0 "[ . 1 . 2]" 1
1832 2 54 MET ME 2 68 PRO QD . . 3.490 3.299 2.537 3.601 0.111 15 0 "[ . 1 . 2]" 1
1833 2 54 MET ME 2 68 PRO HD3 . . 4.100 3.678 2.680 4.063 . 0 0 "[ . 1 . 2]" 1
1834 2 54 MET QG 2 55 GLN H . . 4.570 4.250 4.073 4.377 . 0 0 "[ . 1 . 2]" 1
1835 2 54 MET QG 2 55 GLN QE . . 5.180 4.839 3.897 5.260 0.080 3 0 "[ . 1 . 2]" 1
1836 2 54 MET QG 2 66 LEU HB2 . . 4.440 2.721 2.265 3.272 . 0 0 "[ . 1 . 2]" 1
1837 2 54 MET QG 2 66 LEU HB3 . . 4.640 2.477 2.201 2.894 . 0 0 "[ . 1 . 2]" 1
1838 2 54 MET QG 2 66 LEU MD2 . . 4.230 3.560 3.395 3.829 . 0 0 "[ . 1 . 2]" 1
1839 2 54 MET HG2 2 55 GLN H . . 5.440 5.117 4.928 5.224 . 0 0 "[ . 1 . 2]" 1
1840 2 54 MET HG2 2 66 LEU HB2 . . 5.210 2.757 2.286 3.323 . 0 0 "[ . 1 . 2]" 1
1841 2 54 MET HG2 2 66 LEU HB3 . . 5.390 2.548 2.254 2.998 . 0 0 "[ . 1 . 2]" 1
1842 2 54 MET HG2 2 66 LEU MD1 . . 3.770 2.425 2.201 2.606 . 0 0 "[ . 1 . 2]" 1
1843 2 54 MET HG2 2 66 LEU MD2 . . 4.870 3.988 3.767 4.236 . 0 0 "[ . 1 . 2]" 1
1844 2 54 MET HG3 2 55 GLN H . . 5.440 4.543 4.342 4.710 . 0 0 "[ . 1 . 2]" 1
1845 2 54 MET HG3 2 66 LEU HB2 . . 5.210 4.191 3.669 4.907 . 0 0 "[ . 1 . 2]" 1
1846 2 54 MET HG3 2 66 LEU HB3 . . 5.390 3.382 2.983 3.984 . 0 0 "[ . 1 . 2]" 1
1847 2 54 MET HG3 2 66 LEU MD1 . . 3.770 2.658 2.274 3.243 . 0 0 "[ . 1 . 2]" 1
1848 2 54 MET HG3 2 66 LEU MD2 . . 4.870 4.013 3.794 4.391 . 0 0 "[ . 1 . 2]" 1
1849 2 55 GLN H 2 55 GLN HB2 . . 2.920 2.486 2.291 2.662 . 0 0 "[ . 1 . 2]" 1
1850 2 55 GLN H 2 55 GLN HG2 . . 4.200 2.776 2.394 4.240 0.040 14 0 "[ . 1 . 2]" 1
1851 2 55 GLN H 2 55 GLN QG . . 3.520 2.702 2.368 3.566 0.046 14 0 "[ . 1 . 2]" 1
1852 2 55 GLN H 2 55 GLN HG3 . . 4.200 3.958 3.679 4.221 0.021 1 0 "[ . 1 . 2]" 1
1853 2 55 GLN H 2 56 LYS H . . 3.120 2.517 2.290 2.817 . 0 0 "[ . 1 . 2]" 1
1854 2 55 GLN H 2 56 LYS QB . . 4.890 4.774 4.016 4.957 0.067 19 0 "[ . 1 . 2]" 1
1855 2 55 GLN H 2 57 GLU H . . 4.530 3.788 3.583 4.194 . 0 0 "[ . 1 . 2]" 1
1856 2 55 GLN HA 2 55 GLN HB3 . . 2.890 2.473 2.374 2.610 . 0 0 "[ . 1 . 2]" 1
1857 2 55 GLN HA 2 55 GLN QE . . 3.830 2.715 1.771 3.553 . 0 0 "[ . 1 . 2]" 1
1858 2 55 GLN HA 2 55 GLN HG2 . . 3.810 3.231 2.934 3.730 . 0 0 "[ . 1 . 2]" 1
1859 2 55 GLN HA 2 55 GLN QG . . 3.230 2.997 2.522 3.268 0.038 1 0 "[ . 1 . 2]" 1
1860 2 55 GLN HA 2 55 GLN HG3 . . 3.810 3.687 2.565 3.853 0.043 6 0 "[ . 1 . 2]" 1
1861 2 55 GLN HA 2 57 GLU H . . 4.960 4.421 4.018 4.679 . 0 0 "[ . 1 . 2]" 1
1862 2 55 GLN HA 2 58 GLN H . . 4.800 3.646 3.424 4.036 . 0 0 "[ . 1 . 2]" 1
1863 2 55 GLN HA 2 58 GLN QB . . 3.610 2.463 2.123 2.812 . 0 0 "[ . 1 . 2]" 1
1864 2 55 GLN HA 2 58 GLN HE21 . . 4.410 3.070 2.229 4.269 . 0 0 "[ . 1 . 2]" 1
1865 2 55 GLN HA 2 58 GLN QE . . 3.750 2.917 2.200 3.817 0.067 4 0 "[ . 1 . 2]" 1
1866 2 55 GLN HA 2 58 GLN HE22 . . 4.410 3.804 3.109 4.467 0.057 5 0 "[ . 1 . 2]" 1
1867 2 55 GLN HB2 2 56 LYS H . . 3.200 2.492 2.195 2.847 . 0 0 "[ . 1 . 2]" 1
1868 2 55 GLN HB2 2 56 LYS QG . . 4.840 4.301 3.674 4.882 0.042 7 0 "[ . 1 . 2]" 1
1869 2 55 GLN HB2 2 57 GLU H . . 5.500 4.965 4.818 5.122 . 0 0 "[ . 1 . 2]" 1
1870 2 55 GLN HB3 2 57 GLU H . . 5.500 5.513 5.325 5.574 0.074 18 0 "[ . 1 . 2]" 1
1871 2 56 LYS H 2 56 LYS QB . . 2.990 2.540 2.319 2.761 . 0 0 "[ . 1 . 2]" 1
1872 2 56 LYS H 2 56 LYS HD2 . . 5.500 4.513 3.845 4.891 . 0 0 "[ . 1 . 2]" 1
1873 2 56 LYS H 2 56 LYS QD . . 4.750 4.086 3.542 4.391 . 0 0 "[ . 1 . 2]" 1
1874 2 56 LYS H 2 56 LYS HD3 . . 5.500 4.681 4.103 4.969 . 0 0 "[ . 1 . 2]" 1
1875 2 56 LYS H 2 56 LYS QG . . 3.490 2.332 2.103 2.651 . 0 0 "[ . 1 . 2]" 1
1876 2 56 LYS HA 2 56 LYS QD . . 4.390 4.388 4.006 4.467 0.077 17 0 "[ . 1 . 2]" 1
1877 2 56 LYS HA 2 56 LYS HG2 . . 3.850 3.688 2.373 3.918 0.068 2 0 "[ . 1 . 2]" 1
1878 2 56 LYS HA 2 56 LYS QG . . 3.350 3.264 2.281 3.387 0.037 5 0 "[ . 1 . 2]" 1
1879 2 56 LYS HA 2 56 LYS HG3 . . 3.850 3.661 2.903 3.828 . 0 0 "[ . 1 . 2]" 1
1880 2 56 LYS QB 2 56 LYS QD . . 3.310 2.257 2.042 2.382 . 0 0 "[ . 1 . 2]" 1
1881 2 56 LYS QB 2 56 LYS QE . . 4.580 2.927 1.983 3.538 . 0 0 "[ . 1 . 2]" 1
1882 2 56 LYS QB 2 57 GLU H . . 3.910 3.548 2.338 3.862 . 0 0 "[ . 1 . 2]" 1
1883 2 56 LYS HB2 2 57 GLU H . . 4.570 3.901 2.430 4.274 . 0 0 "[ . 1 . 2]" 1
1884 2 56 LYS HB3 2 57 GLU H . . 4.570 4.104 3.043 4.401 . 0 0 "[ . 1 . 2]" 1
1885 2 56 LYS HD2 2 57 GLU H . . 5.500 5.061 4.583 5.563 0.063 14 0 "[ . 1 . 2]" 1
1886 2 56 LYS HD3 2 57 GLU H . . 5.500 4.949 4.485 5.552 0.052 11 0 "[ . 1 . 2]" 1
1887 2 56 LYS QE 2 56 LYS QG . . 3.280 2.392 2.250 2.855 . 0 0 "[ . 1 . 2]" 1
1888 2 56 LYS QG 2 57 GLU H . . 4.470 2.672 2.254 4.299 . 0 0 "[ . 1 . 2]" 1
1889 2 57 GLU H 2 57 GLU HB2 . . 4.000 2.478 2.323 2.628 . 0 0 "[ . 1 . 2]" 1
1890 2 57 GLU H 2 57 GLU QB . . 3.370 2.441 2.296 2.581 . 0 0 "[ . 1 . 2]" 1
1891 2 57 GLU H 2 57 GLU HB3 . . 4.000 3.671 3.602 3.767 . 0 0 "[ . 1 . 2]" 1
1892 2 57 GLU H 2 57 GLU HG2 . . 4.260 2.950 2.517 3.283 . 0 0 "[ . 1 . 2]" 1
1893 2 57 GLU H 2 57 GLU QG . . 3.670 2.880 2.487 3.178 . 0 0 "[ . 1 . 2]" 1
1894 2 57 GLU H 2 57 GLU HG3 . . 4.260 4.053 3.811 4.296 0.036 3 0 "[ . 1 . 2]" 1
1895 2 57 GLU H 2 58 GLN H . . 3.500 2.689 2.481 2.929 . 0 0 "[ . 1 . 2]" 1
1896 2 57 GLU H 2 58 GLN HA . . 4.730 4.551 4.278 4.776 0.046 13 0 "[ . 1 . 2]" 1
1897 2 57 GLU H 2 58 GLN HG2 . . 5.500 5.070 4.708 5.546 0.046 5 0 "[ . 1 . 2]" 1
1898 2 57 GLU HA 2 59 ARG H . . 4.610 3.331 3.019 3.571 . 0 0 "[ . 1 . 2]" 1
1899 2 57 GLU HA 2 60 ASN HB2 . . 5.060 3.383 2.721 3.965 . 0 0 "[ . 1 . 2]" 1
1900 2 57 GLU HA 2 60 ASN QB . . 4.340 3.038 2.573 3.564 . 0 0 "[ . 1 . 2]" 1
1901 2 57 GLU HA 2 60 ASN HB3 . . 5.060 3.492 2.995 4.038 . 0 0 "[ . 1 . 2]" 1
1902 2 57 GLU QB 2 60 ASN H . . 4.770 3.482 3.282 3.661 . 0 0 "[ . 1 . 2]" 1
1903 2 57 GLU QB 2 60 ASN QB . . 3.860 2.212 2.057 2.432 . 0 0 "[ . 1 . 2]" 1
1904 2 57 GLU QB 2 63 PHE QB . . 4.330 2.403 1.956 3.253 . 0 0 "[ . 1 . 2]" 1
1905 2 57 GLU QB 2 63 PHE QD . . 3.840 2.720 2.325 3.144 . 0 0 "[ . 1 . 2]" 1
1906 2 57 GLU QB 2 63 PHE QE . . 4.780 3.906 3.517 4.310 . 0 0 "[ . 1 . 2]" 1
1907 2 57 GLU HB2 2 60 ASN HB2 . . 5.140 4.999 4.347 5.205 0.065 8 0 "[ . 1 . 2]" 1
1908 2 57 GLU HB2 2 60 ASN HB3 . . 5.140 3.966 3.836 4.121 . 0 0 "[ . 1 . 2]" 1
1909 2 57 GLU HB2 2 63 PHE QD . . 4.540 3.491 2.863 3.888 . 0 0 "[ . 1 . 2]" 1
1910 2 57 GLU HB3 2 60 ASN HB2 . . 5.140 3.358 2.731 3.613 . 0 0 "[ . 1 . 2]" 1
1911 2 57 GLU HB3 2 60 ASN HB3 . . 5.140 2.264 2.143 2.523 . 0 0 "[ . 1 . 2]" 1
1912 2 57 GLU HB3 2 63 PHE QD . . 4.540 2.912 2.364 3.400 . 0 0 "[ . 1 . 2]" 1
1913 2 57 GLU QG 2 63 PHE QD . . 5.030 3.192 2.850 3.763 . 0 0 "[ . 1 . 2]" 1
1914 2 57 GLU QG 2 63 PHE QE . . 4.820 3.139 2.596 3.528 . 0 0 "[ . 1 . 2]" 1
1915 2 58 GLN H 2 58 GLN HB2 . . 3.730 3.573 3.457 3.605 . 0 0 "[ . 1 . 2]" 1
1916 2 58 GLN H 2 58 GLN QB . . 3.220 2.336 2.116 2.422 . 0 0 "[ . 1 . 2]" 1
1917 2 58 GLN H 2 58 GLN HB3 . . 3.730 2.368 2.135 2.462 . 0 0 "[ . 1 . 2]" 1
1918 2 58 GLN H 2 58 GLN HG2 . . 3.710 2.520 2.263 2.957 . 0 0 "[ . 1 . 2]" 1
1919 2 58 GLN H 2 58 GLN HG3 . . 4.170 3.766 3.471 4.082 . 0 0 "[ . 1 . 2]" 1
1920 2 58 GLN H 2 59 ARG H . . 4.140 3.033 2.815 3.228 . 0 0 "[ . 1 . 2]" 1
1921 2 58 GLN H 2 60 ASN H . . 4.990 4.373 4.251 4.629 . 0 0 "[ . 1 . 2]" 1
1922 2 58 GLN HA 2 58 GLN HG2 . . 3.790 3.790 3.669 3.842 0.052 1 0 "[ . 1 . 2]" 1
1923 2 58 GLN HA 2 58 GLN HG3 . . 3.940 3.788 3.704 3.888 . 0 0 "[ . 1 . 2]" 1
1924 2 58 GLN HA 2 59 ARG HA . . 4.860 4.602 4.472 4.720 . 0 0 "[ . 1 . 2]" 1
1925 2 58 GLN HA 2 60 ASN H . . 4.670 4.099 3.818 4.721 0.051 8 0 "[ . 1 . 2]" 1
1926 2 58 GLN QB 2 58 GLN QE . . 3.530 2.458 2.033 3.123 . 0 0 "[ . 1 . 2]" 1
1927 2 58 GLN QE 2 58 GLN HG2 . . 3.460 2.592 2.211 3.404 . 0 0 "[ . 1 . 2]" 1
1928 2 58 GLN HE22 2 58 GLN HG2 . . 4.000 3.705 3.530 4.077 0.077 19 0 "[ . 1 . 2]" 1
1929 2 58 GLN HG2 2 59 ARG H . . 4.230 3.087 2.371 3.759 . 0 0 "[ . 1 . 2]" 1
1930 2 58 GLN HG2 2 59 ARG HG2 . . 4.550 4.100 3.076 4.599 0.049 7 0 "[ . 1 . 2]" 1
1931 2 58 GLN HG2 2 59 ARG HG3 . . 4.550 3.058 2.286 4.599 0.049 14 0 "[ . 1 . 2]" 1
1932 2 58 GLN HG3 2 59 ARG H . . 3.960 3.356 2.757 3.986 0.026 8 0 "[ . 1 . 2]" 1
1933 2 58 GLN HG3 2 59 ARG HA . . 4.700 4.060 3.654 4.548 . 0 0 "[ . 1 . 2]" 1
1934 2 58 GLN HG3 2 59 ARG HD2 . . 5.500 4.357 3.416 5.126 . 0 0 "[ . 1 . 2]" 1
1935 2 58 GLN HG3 2 59 ARG HD3 . . 5.500 4.752 3.103 5.261 . 0 0 "[ . 1 . 2]" 1
1936 2 58 GLN HG3 2 59 ARG HG2 . . 4.000 2.931 2.213 3.592 . 0 0 "[ . 1 . 2]" 1
1937 2 58 GLN HG3 2 59 ARG HG3 . . 4.000 2.501 2.077 4.043 0.043 14 0 "[ . 1 . 2]" 1
1938 2 59 ARG H 2 59 ARG HB2 . . 4.080 2.642 2.328 2.957 . 0 0 "[ . 1 . 2]" 1
1939 2 59 ARG H 2 59 ARG QB . . 3.460 2.591 2.299 2.879 . 0 0 "[ . 1 . 2]" 1
1940 2 59 ARG H 2 59 ARG HB3 . . 4.080 3.754 3.561 3.953 . 0 0 "[ . 1 . 2]" 1
1941 2 59 ARG H 2 59 ARG HG2 . . 4.370 3.668 2.944 3.996 . 0 0 "[ . 1 . 2]" 1
1942 2 59 ARG H 2 59 ARG HG3 . . 4.370 3.006 2.268 4.315 . 0 0 "[ . 1 . 2]" 1
1943 2 59 ARG H 2 60 ASN H . . 3.500 2.238 1.854 2.759 . 0 0 "[ . 1 . 2]" 1
1944 2 59 ARG HA 2 59 ARG HD2 . . 5.420 4.565 2.323 5.041 . 0 0 "[ . 1 . 2]" 1
1945 2 59 ARG HA 2 59 ARG QD . . 4.670 3.928 2.169 4.341 . 0 0 "[ . 1 . 2]" 1
1946 2 59 ARG HA 2 59 ARG HD3 . . 5.420 4.332 2.600 4.780 . 0 0 "[ . 1 . 2]" 1
1947 2 59 ARG HA 2 59 ARG HG2 . . 3.560 2.531 2.217 3.019 . 0 0 "[ . 1 . 2]" 1
1948 2 59 ARG HA 2 59 ARG QG . . 3.100 2.451 2.185 2.880 . 0 0 "[ . 1 . 2]" 1
1949 2 59 ARG HA 2 59 ARG HG3 . . 3.560 3.337 3.030 3.638 0.078 14 0 "[ . 1 . 2]" 1
1950 2 59 ARG QB 2 59 ARG QD . . 3.240 2.266 2.074 2.444 . 0 0 "[ . 1 . 2]" 1
1951 2 59 ARG QB 2 60 ASN H . . 4.060 3.465 2.588 3.843 . 0 0 "[ . 1 . 2]" 1
1952 2 59 ARG HB2 2 60 ASN H . . 4.740 3.655 2.642 4.146 . 0 0 "[ . 1 . 2]" 1
1953 2 59 ARG HB3 2 60 ASN H . . 4.740 4.332 3.706 4.605 . 0 0 "[ . 1 . 2]" 1
1954 2 60 ASN H 2 60 ASN HB2 . . 3.770 2.717 2.299 3.099 . 0 0 "[ . 1 . 2]" 1
1955 2 60 ASN H 2 60 ASN HB3 . . 3.770 2.564 2.452 2.730 . 0 0 "[ . 1 . 2]" 1
1956 2 60 ASN H 2 61 TYR H . . 4.710 4.319 4.058 4.648 . 0 0 "[ . 1 . 2]" 1
1957 2 60 ASN HA 2 61 TYR H . . 3.270 2.201 2.100 2.403 . 0 0 "[ . 1 . 2]" 1
1958 2 60 ASN HA 2 61 TYR HA . . 4.970 4.462 4.402 4.568 . 0 0 "[ . 1 . 2]" 1
1959 2 60 ASN HA 2 61 TYR HB3 . . 4.860 4.608 4.422 4.758 . 0 0 "[ . 1 . 2]" 1
1960 2 60 ASN HA 2 61 TYR QD . . 4.580 3.895 3.284 4.615 0.035 12 0 "[ . 1 . 2]" 1
1961 2 60 ASN HA 2 62 GLN H . . 4.060 3.775 3.532 4.127 0.067 13 0 "[ . 1 . 2]" 1
1962 2 60 ASN QB 2 61 TYR H . . 4.100 3.934 3.560 4.047 . 0 0 "[ . 1 . 2]" 1
1963 2 60 ASN HB2 2 61 TYR H . . 4.780 4.491 4.248 4.681 . 0 0 "[ . 1 . 2]" 1
1964 2 60 ASN HB2 2 63 PHE QD . . 4.520 4.128 3.638 4.583 0.063 14 0 "[ . 1 . 2]" 1
1965 2 60 ASN HB3 2 61 TYR H . . 4.780 4.353 3.822 4.456 . 0 0 "[ . 1 . 2]" 1
1966 2 60 ASN HB3 2 63 PHE QD . . 4.520 2.794 2.464 3.341 . 0 0 "[ . 1 . 2]" 1
1967 2 60 ASN QD 2 62 GLN H . . 4.600 3.306 2.065 3.795 . 0 0 "[ . 1 . 2]" 1
1968 2 60 ASN QD 2 62 GLN HB2 . . 4.000 2.728 1.953 3.371 . 0 0 "[ . 1 . 2]" 1
1969 2 60 ASN QD 2 62 GLN HB3 . . 4.080 2.776 2.278 4.041 . 0 0 "[ . 1 . 2]" 1
1970 2 60 ASN QD 2 62 GLN QG . . 4.530 3.976 3.373 4.617 0.087 19 0 "[ . 1 . 2]" 1
1971 2 60 ASN QD 2 63 PHE H . . 4.000 3.740 2.476 4.081 0.081 7 0 "[ . 1 . 2]" 1
1972 2 60 ASN QD 2 63 PHE QD . . 3.730 2.271 1.823 2.501 . 0 0 "[ . 1 . 2]" 1
1973 2 60 ASN QD 2 63 PHE QE . . 4.330 2.741 2.236 3.671 . 0 0 "[ . 1 . 2]" 1
1974 2 60 ASN HD21 2 63 PHE H . . 4.660 4.099 2.497 4.651 . 0 0 "[ . 1 . 2]" 1
1975 2 60 ASN HD21 2 63 PHE QD . . 4.300 2.354 1.844 2.685 . 0 0 "[ . 1 . 2]" 1
1976 2 60 ASN HD21 2 63 PHE QE . . 4.990 2.969 2.374 4.140 . 0 0 "[ . 1 . 2]" 1
1977 2 60 ASN HD22 2 63 PHE H . . 4.660 4.527 4.106 4.723 0.063 4 0 "[ . 1 . 2]" 1
1978 2 60 ASN HD22 2 63 PHE QD . . 4.300 3.085 2.707 3.849 . 0 0 "[ . 1 . 2]" 1
1979 2 60 ASN HD22 2 63 PHE QE . . 4.990 3.278 2.729 4.148 . 0 0 "[ . 1 . 2]" 1
1980 2 61 TYR H 2 61 TYR HB2 . . 3.800 3.586 3.527 3.711 . 0 0 "[ . 1 . 2]" 1
1981 2 61 TYR H 2 61 TYR HB3 . . 4.070 2.496 2.329 2.844 . 0 0 "[ . 1 . 2]" 1
1982 2 61 TYR H 2 61 TYR QD . . 3.720 2.384 1.953 2.887 . 0 0 "[ . 1 . 2]" 1
1983 2 61 TYR H 2 61 TYR QE . . 4.970 4.225 3.898 4.714 . 0 0 "[ . 1 . 2]" 1
1984 2 61 TYR H 2 62 GLN H . . 3.680 2.881 2.212 3.128 . 0 0 "[ . 1 . 2]" 1
1985 2 61 TYR H 2 63 PHE H . . 5.500 4.443 4.314 4.556 . 0 0 "[ . 1 . 2]" 1
1986 2 61 TYR HA 2 61 TYR QD . . 4.090 3.768 3.734 3.804 . 0 0 "[ . 1 . 2]" 1
1987 2 61 TYR HA 2 63 PHE H . . 4.740 3.723 3.443 4.054 . 0 0 "[ . 1 . 2]" 1
1988 2 61 TYR HA 2 64 ASP H . . 4.230 3.438 3.025 3.977 . 0 0 "[ . 1 . 2]" 1
1989 2 61 TYR HA 2 64 ASP QB . . 4.630 2.539 2.106 3.116 . 0 0 "[ . 1 . 2]" 1
1990 2 61 TYR HB2 2 62 GLN H . . 5.110 4.053 3.717 4.210 . 0 0 "[ . 1 . 2]" 1
1991 2 61 TYR HB3 2 62 GLN H . . 4.440 4.193 3.942 4.345 . 0 0 "[ . 1 . 2]" 1
1992 2 61 TYR HB3 2 64 ASP QB . . 5.340 4.461 3.963 5.167 . 0 0 "[ . 1 . 2]" 1
1993 2 61 TYR QD 2 62 GLN H . . 4.190 3.260 2.701 3.526 . 0 0 "[ . 1 . 2]" 1
1994 2 61 TYR QD 2 62 GLN HA . . 4.320 3.143 2.768 4.151 . 0 0 "[ . 1 . 2]" 1
1995 2 61 TYR QD 2 62 GLN QG . . 4.290 3.828 3.012 4.372 0.082 6 0 "[ . 1 . 2]" 1
1996 2 61 TYR QE 2 62 GLN HA . . 4.720 4.056 3.543 4.792 0.072 4 0 "[ . 1 . 2]" 1
1997 2 61 TYR QE 2 62 GLN HG2 . . 4.750 3.840 2.592 4.822 0.072 8 0 "[ . 1 . 2]" 1
1998 2 61 TYR QE 2 62 GLN QG . . 4.180 3.260 2.540 4.071 . 0 0 "[ . 1 . 2]" 1
1999 2 61 TYR QE 2 62 GLN HG3 . . 4.750 3.992 3.040 4.795 0.045 17 0 "[ . 1 . 2]" 1
2000 2 62 GLN H 2 62 GLN HB2 . . 3.330 2.138 1.991 2.261 . 0 0 "[ . 1 . 2]" 1
2001 2 62 GLN H 2 62 GLN HB3 . . 3.450 3.097 2.896 3.511 0.061 4 0 "[ . 1 . 2]" 1
2002 2 62 GLN H 2 62 GLN HG2 . . 4.380 3.998 3.065 4.448 0.068 13 0 "[ . 1 . 2]" 1
2003 2 62 GLN H 2 62 GLN QG . . 3.750 3.566 2.865 3.800 0.050 20 0 "[ . 1 . 2]" 1
2004 2 62 GLN H 2 62 GLN HG3 . . 4.380 4.094 3.047 4.436 0.056 20 0 "[ . 1 . 2]" 1
2005 2 62 GLN H 2 63 PHE H . . 3.300 2.780 2.623 3.039 . 0 0 "[ . 1 . 2]" 1
2006 2 62 GLN H 2 63 PHE QD . . 4.390 4.089 3.687 4.448 0.058 5 0 "[ . 1 . 2]" 1
2007 2 62 GLN H 2 64 ASP H . . 4.420 4.259 4.065 4.488 0.068 13 0 "[ . 1 . 2]" 1
2008 2 62 GLN HA 2 62 GLN HG2 . . 3.850 2.308 2.103 2.631 . 0 0 "[ . 1 . 2]" 1
2009 2 62 GLN HA 2 62 GLN QG . . 3.370 2.238 2.051 2.571 . 0 0 "[ . 1 . 2]" 1
2010 2 62 GLN HA 2 62 GLN HG3 . . 3.850 3.228 2.397 3.617 . 0 0 "[ . 1 . 2]" 1
2011 2 62 GLN HA 2 64 ASP H . . 4.760 3.736 3.490 4.010 . 0 0 "[ . 1 . 2]" 1
2012 2 62 GLN HB2 2 63 PHE H . . 4.540 3.860 3.441 4.259 . 0 0 "[ . 1 . 2]" 1
2013 2 62 GLN HB2 2 63 PHE QD . . 4.580 4.013 2.724 4.624 0.044 12 0 "[ . 1 . 2]" 1
2014 2 62 GLN HB3 2 63 PHE H . . 4.290 3.446 3.110 3.852 . 0 0 "[ . 1 . 2]" 1
2015 2 62 GLN HB3 2 63 PHE QD . . 4.240 3.018 2.419 3.882 . 0 0 "[ . 1 . 2]" 1
2016 2 62 GLN HB3 2 63 PHE QE . . 5.230 3.634 3.176 4.282 . 0 0 "[ . 1 . 2]" 1
2017 2 62 GLN QG 2 63 PHE H . . 4.790 4.693 4.447 4.860 0.070 17 0 "[ . 1 . 2]" 1
2018 2 62 GLN QG 2 63 PHE QD . . 5.340 4.891 4.528 5.408 0.068 17 0 "[ . 1 . 2]" 1
2019 2 62 GLN QG 2 63 PHE QE . . 5.340 5.125 4.680 5.428 0.088 8 0 "[ . 1 . 2]" 1
2020 2 62 GLN HG2 2 63 PHE H . . 5.500 5.093 4.766 5.359 . 0 0 "[ . 1 . 2]" 1
2021 2 62 GLN HG3 2 63 PHE H . . 5.500 5.508 5.291 5.584 0.084 2 0 "[ . 1 . 2]" 1
2022 2 63 PHE H 2 63 PHE HB2 . . 3.910 2.413 2.237 2.694 . 0 0 "[ . 1 . 2]" 1
2023 2 63 PHE H 2 63 PHE QB . . 3.350 2.379 2.213 2.640 . 0 0 "[ . 1 . 2]" 1
2024 2 63 PHE H 2 63 PHE HB3 . . 3.910 3.626 3.504 3.788 . 0 0 "[ . 1 . 2]" 1
2025 2 63 PHE H 2 64 ASP QB . . 4.490 4.078 3.723 4.470 . 0 0 "[ . 1 . 2]" 1
2026 2 63 PHE H 2 66 LEU MD1 . . 5.310 5.378 5.272 5.399 0.089 2 0 "[ . 1 . 2]" 1
2027 2 63 PHE HA 2 63 PHE QD . . 4.040 2.892 2.592 3.138 . 0 0 "[ . 1 . 2]" 1
2028 2 63 PHE HA 2 65 PHE H . . 4.040 3.434 3.155 3.624 . 0 0 "[ . 1 . 2]" 1
2029 2 63 PHE HA 2 65 PHE QD . . 4.220 3.212 2.464 4.159 . 0 0 "[ . 1 . 2]" 1
2030 2 63 PHE HA 2 65 PHE QE . . 3.510 2.887 2.285 3.596 0.086 20 0 "[ . 1 . 2]" 1
2031 2 63 PHE HA 2 65 PHE HZ . . 4.580 4.350 3.887 4.636 0.056 7 0 "[ . 1 . 2]" 1
2032 2 63 PHE HA 2 66 LEU H . . 5.500 3.893 3.737 4.038 . 0 0 "[ . 1 . 2]" 1
2033 2 63 PHE HA 2 66 LEU MD1 . . 4.500 3.605 3.301 4.001 . 0 0 "[ . 1 . 2]" 1
2034 2 63 PHE HA 2 66 LEU MD2 . . 5.180 4.828 4.461 5.259 0.079 19 0 "[ . 1 . 2]" 1
2035 2 63 PHE HA 2 66 LEU HG . . 4.500 3.536 3.204 4.106 . 0 0 "[ . 1 . 2]" 1
2036 2 63 PHE QB 2 64 ASP H . . 3.920 3.675 3.511 3.831 . 0 0 "[ . 1 . 2]" 1
2037 2 63 PHE QB 2 66 LEU MD1 . . 3.500 2.339 2.135 2.608 . 0 0 "[ . 1 . 2]" 1
2038 2 63 PHE QB 2 66 LEU MD2 . . 5.160 4.652 3.883 5.215 0.055 19 0 "[ . 1 . 2]" 1
2039 2 63 PHE QB 2 66 LEU HG . . 4.860 3.633 2.627 4.584 . 0 0 "[ . 1 . 2]" 1
2040 2 63 PHE HB2 2 64 ASP H . . 4.490 3.944 3.770 4.157 . 0 0 "[ . 1 . 2]" 1
2041 2 63 PHE HB2 2 66 LEU MD1 . . 4.110 3.877 3.160 4.172 0.062 19 0 "[ . 1 . 2]" 1
2042 2 63 PHE HB3 2 64 ASP H . . 4.490 4.389 4.188 4.517 0.027 17 0 "[ . 1 . 2]" 1
2043 2 63 PHE HB3 2 66 LEU MD1 . . 4.110 2.359 2.171 2.635 . 0 0 "[ . 1 . 2]" 1
2044 2 63 PHE QD 2 64 ASP H . . 5.220 4.858 4.719 5.023 . 0 0 "[ . 1 . 2]" 1
2045 2 63 PHE QD 2 66 LEU MD1 . . 3.610 2.209 1.981 3.019 . 0 0 "[ . 1 . 2]" 1
2046 2 63 PHE QD 2 66 LEU MD2 . . 4.650 3.935 3.411 4.686 0.036 19 0 "[ . 1 . 2]" 1
2047 2 63 PHE QD 2 66 LEU HG . . 5.200 3.531 2.997 4.579 . 0 0 "[ . 1 . 2]" 1
2048 2 63 PHE QE 2 66 LEU MD1 . . 4.690 3.683 3.367 4.510 . 0 0 "[ . 1 . 2]" 1
2049 2 63 PHE QE 2 66 LEU MD2 . . 5.270 4.892 4.427 5.321 0.051 17 0 "[ . 1 . 2]" 1
2050 2 64 ASP H 2 64 ASP QB . . 2.990 2.349 2.117 2.625 . 0 0 "[ . 1 . 2]" 1
2051 2 64 ASP H 2 65 PHE H . . 3.610 2.680 2.545 2.862 . 0 0 "[ . 1 . 2]" 1
2052 2 64 ASP H 2 65 PHE HA . . 5.500 5.223 5.028 5.371 . 0 0 "[ . 1 . 2]" 1
2053 2 64 ASP H 2 65 PHE QB . . 5.340 4.775 4.635 4.978 . 0 0 "[ . 1 . 2]" 1
2054 2 64 ASP H 2 65 PHE QD . . 4.270 4.039 3.605 4.328 0.058 1 0 "[ . 1 . 2]" 1
2055 2 64 ASP H 2 65 PHE QE . . 5.500 5.270 4.993 5.520 0.020 1 0 "[ . 1 . 2]" 1
2056 2 64 ASP H 2 70 HIS HD2 . . 5.500 5.179 4.637 5.565 0.065 2 0 "[ . 1 . 2]" 1
2057 2 64 ASP HA 2 66 LEU H . . 4.360 3.591 3.460 3.767 . 0 0 "[ . 1 . 2]" 1
2058 2 64 ASP HA 2 67 ARG H . . 4.490 3.586 3.264 3.895 . 0 0 "[ . 1 . 2]" 1
2059 2 64 ASP HA 2 67 ARG QD . . 4.190 3.437 2.873 4.176 . 0 0 "[ . 1 . 2]" 1
2060 2 64 ASP HA 2 67 ARG HG2 . . 5.160 4.956 4.266 5.219 0.059 20 0 "[ . 1 . 2]" 1
2061 2 64 ASP HA 2 67 ARG HG3 . . 4.050 3.269 2.537 3.682 . 0 0 "[ . 1 . 2]" 1
2062 2 64 ASP HA 2 70 HIS HD2 . . 4.950 4.906 4.613 5.019 0.069 3 0 "[ . 1 . 2]" 1
2063 2 64 ASP QB 2 65 PHE H . . 4.070 3.400 2.996 3.782 . 0 0 "[ . 1 . 2]" 1
2064 2 64 ASP QB 2 67 ARG QD . . 5.180 4.216 3.523 5.074 . 0 0 "[ . 1 . 2]" 1
2065 2 64 ASP QB 2 70 HIS HD2 . . 3.260 2.943 2.373 3.339 0.079 17 0 "[ . 1 . 2]" 1
2066 2 64 ASP HB2 2 65 PHE H . . 4.780 4.106 3.311 4.296 . 0 0 "[ . 1 . 2]" 1
2067 2 64 ASP HB3 2 65 PHE H . . 4.780 3.706 3.089 4.287 . 0 0 "[ . 1 . 2]" 1
2068 2 65 PHE H 2 65 PHE HB2 . . 3.740 3.638 3.571 3.738 . 0 0 "[ . 1 . 2]" 1
2069 2 65 PHE H 2 65 PHE QB . . 3.280 2.488 2.377 2.676 . 0 0 "[ . 1 . 2]" 1
2070 2 65 PHE H 2 65 PHE HB3 . . 3.740 2.534 2.413 2.741 . 0 0 "[ . 1 . 2]" 1
2071 2 65 PHE H 2 65 PHE QD . . 3.250 2.506 2.187 2.837 . 0 0 "[ . 1 . 2]" 1
2072 2 65 PHE H 2 66 LEU H . . 3.730 2.717 2.567 2.817 . 0 0 "[ . 1 . 2]" 1
2073 2 65 PHE H 2 66 LEU HB2 . . 4.990 4.942 4.688 5.037 0.047 18 0 "[ . 1 . 2]" 1
2074 2 65 PHE H 2 66 LEU MD2 . . 5.500 5.379 5.114 5.573 0.073 19 0 "[ . 1 . 2]" 1
2075 2 65 PHE H 2 66 LEU HG . . 4.580 4.356 4.215 4.512 . 0 0 "[ . 1 . 2]" 1
2076 2 65 PHE H 2 70 HIS HB2 . . 5.080 4.614 4.064 4.942 . 0 0 "[ . 1 . 2]" 1
2077 2 65 PHE H 2 70 HIS HB3 . . 5.500 5.051 4.658 5.390 . 0 0 "[ . 1 . 2]" 1
2078 2 65 PHE HA 2 65 PHE QD . . 4.360 3.752 3.701 3.778 . 0 0 "[ . 1 . 2]" 1
2079 2 65 PHE HA 2 67 ARG H . . 4.580 3.595 3.392 3.867 . 0 0 "[ . 1 . 2]" 1
2080 2 65 PHE HA 2 67 ARG HB2 . . 5.500 4.942 4.677 5.203 . 0 0 "[ . 1 . 2]" 1
2081 2 65 PHE HA 2 70 HIS H . . 4.940 4.413 3.943 4.954 0.014 2 0 "[ . 1 . 2]" 1
2082 2 65 PHE HA 2 70 HIS HB2 . . 4.200 2.455 2.151 2.786 . 0 0 "[ . 1 . 2]" 1
2083 2 65 PHE HA 2 70 HIS HB3 . . 4.380 2.309 2.102 2.588 . 0 0 "[ . 1 . 2]" 1
2084 2 65 PHE HA 2 70 HIS HD2 . . 4.770 3.486 2.699 4.250 . 0 0 "[ . 1 . 2]" 1
2085 2 65 PHE HA 2 70 HIS HE1 . . 5.500 4.840 3.772 5.534 0.034 11 0 "[ . 1 . 2]" 1
2086 2 65 PHE HA 2 72 LEU HB3 . . 5.500 4.835 4.296 5.328 . 0 0 "[ . 1 . 2]" 1
2087 2 65 PHE QB 2 70 HIS HE1 . . 4.790 3.843 2.665 4.847 0.057 11 0 "[ . 1 . 2]" 1
2088 2 65 PHE QB 2 72 LEU HB2 . . 4.050 2.377 2.117 3.077 . 0 0 "[ . 1 . 2]" 1
2089 2 65 PHE QB 2 72 LEU HB3 . . 3.970 2.970 2.445 3.550 . 0 0 "[ . 1 . 2]" 1
2090 2 65 PHE QB 2 72 LEU MD1 . . 3.950 2.525 2.168 3.258 . 0 0 "[ . 1 . 2]" 1
2091 2 65 PHE HB2 2 72 LEU HB3 . . 4.660 3.040 2.511 3.669 . 0 0 "[ . 1 . 2]" 1
2092 2 65 PHE HB2 2 72 LEU MD1 . . 4.530 2.978 2.406 3.677 . 0 0 "[ . 1 . 2]" 1
2093 2 65 PHE HB3 2 72 LEU HB3 . . 4.660 4.188 3.363 4.726 0.066 8 0 "[ . 1 . 2]" 1
2094 2 65 PHE HB3 2 72 LEU MD1 . . 4.530 2.747 2.299 3.639 . 0 0 "[ . 1 . 2]" 1
2095 2 65 PHE QD 2 66 LEU H . . 4.410 3.563 3.430 3.639 . 0 0 "[ . 1 . 2]" 1
2096 2 65 PHE QD 2 66 LEU HA . . 4.810 3.371 3.156 3.693 . 0 0 "[ . 1 . 2]" 1
2097 2 65 PHE QD 2 66 LEU HB2 . . 5.500 5.133 4.994 5.329 . 0 0 "[ . 1 . 2]" 1
2098 2 65 PHE QD 2 66 LEU HG . . 4.960 3.667 3.471 4.035 . 0 0 "[ . 1 . 2]" 1
2099 2 65 PHE QD 2 72 LEU MD1 . . 4.630 3.889 3.431 4.619 . 0 0 "[ . 1 . 2]" 1
2100 2 65 PHE QD 2 73 PHE HA . . 4.910 4.116 3.533 4.811 . 0 0 "[ . 1 . 2]" 1
2101 2 65 PHE QD 2 76 PHE H . . 5.500 5.199 4.810 5.557 0.057 8 0 "[ . 1 . 2]" 1
2102 2 65 PHE QD 2 76 PHE HB2 . . 4.900 3.051 2.463 3.369 . 0 0 "[ . 1 . 2]" 1
2103 2 65 PHE QD 2 76 PHE HB3 . . 4.510 3.722 3.177 4.194 . 0 0 "[ . 1 . 2]" 1
2104 2 65 PHE QD 2 76 PHE QD . . 4.340 3.536 3.064 3.933 . 0 0 "[ . 1 . 2]" 1
2105 2 65 PHE QE 2 66 LEU HA . . 5.490 4.203 3.751 4.444 . 0 0 "[ . 1 . 2]" 1
2106 2 65 PHE QE 2 66 LEU MD2 . . 3.410 2.386 2.195 2.852 . 0 0 "[ . 1 . 2]" 1
2107 2 65 PHE QE 2 66 LEU HG . . 4.540 3.350 2.965 3.828 . 0 0 "[ . 1 . 2]" 1
2108 2 65 PHE QE 2 76 PHE QD . . 4.310 2.726 2.463 3.069 . 0 0 "[ . 1 . 2]" 1
2109 2 65 PHE HZ 2 66 LEU H . . 5.500 5.501 5.094 5.565 0.065 3 0 "[ . 1 . 2]" 1
2110 2 65 PHE HZ 2 66 LEU MD2 . . 4.130 3.294 2.670 4.047 . 0 0 "[ . 1 . 2]" 1
2111 2 66 LEU H 2 66 LEU HB2 . . 3.280 2.431 2.353 2.503 . 0 0 "[ . 1 . 2]" 1
2112 2 66 LEU H 2 66 LEU MD1 . . 3.760 3.588 3.406 3.746 . 0 0 "[ . 1 . 2]" 1
2113 2 66 LEU H 2 66 LEU MD2 . . 3.770 3.596 3.359 3.826 0.056 19 0 "[ . 1 . 2]" 1
2114 2 66 LEU H 2 66 LEU HG . . 3.170 2.456 2.241 2.701 . 0 0 "[ . 1 . 2]" 1
2115 2 66 LEU H 2 67 ARG H . . 3.400 2.592 2.489 2.698 . 0 0 "[ . 1 . 2]" 1
2116 2 66 LEU H 2 73 PHE QD . . 5.500 5.150 4.720 5.565 0.065 12 0 "[ . 1 . 2]" 1
2117 2 66 LEU HA 2 66 LEU MD1 . . 4.020 3.900 3.840 3.938 . 0 0 "[ . 1 . 2]" 1
2118 2 66 LEU HA 2 66 LEU MD2 . . 2.980 2.137 2.062 2.193 . 0 0 "[ . 1 . 2]" 1
2119 2 66 LEU HA 2 66 LEU HG . . 3.660 3.055 2.826 3.180 . 0 0 "[ . 1 . 2]" 1
2120 2 66 LEU HA 2 73 PHE QD . . 3.910 3.418 2.481 3.878 . 0 0 "[ . 1 . 2]" 1
2121 2 66 LEU HA 2 73 PHE QE . . 5.070 4.436 3.558 5.120 0.050 11 0 "[ . 1 . 2]" 1
2122 2 66 LEU HA 2 76 PHE QD . . 4.660 4.110 3.293 4.583 . 0 0 "[ . 1 . 2]" 1
2123 2 66 LEU HA 2 76 PHE QE . . 5.140 4.233 3.291 4.693 . 0 0 "[ . 1 . 2]" 1
2124 2 66 LEU HB2 2 66 LEU MD1 . . 3.360 2.301 2.240 2.347 . 0 0 "[ . 1 . 2]" 1
2125 2 66 LEU HB2 2 67 ARG H . . 3.940 3.276 3.134 3.533 . 0 0 "[ . 1 . 2]" 1
2126 2 66 LEU HB3 2 66 LEU MD1 . . 3.550 2.422 2.357 2.559 . 0 0 "[ . 1 . 2]" 1
2127 2 66 LEU HB3 2 66 LEU MD2 . . 3.300 2.382 2.349 2.436 . 0 0 "[ . 1 . 2]" 1
2128 2 66 LEU MD1 2 67 ARG H . . 5.410 5.010 4.875 5.210 . 0 0 "[ . 1 . 2]" 1
2129 2 66 LEU MD2 2 67 ARG H . . 5.040 4.903 4.800 5.019 . 0 0 "[ . 1 . 2]" 1
2130 2 66 LEU MD2 2 73 PHE QD . . 5.500 4.903 3.974 5.278 . 0 0 "[ . 1 . 2]" 1
2131 2 66 LEU MD2 2 76 PHE HB3 . . 4.920 4.669 4.204 4.992 0.072 8 0 "[ . 1 . 2]" 1
2132 2 66 LEU MD2 2 76 PHE QD . . 4.990 3.475 3.222 3.796 . 0 0 "[ . 1 . 2]" 1
2133 2 66 LEU MD2 2 76 PHE QE . . 3.490 2.788 2.603 3.057 . 0 0 "[ . 1 . 2]" 1
2134 2 66 LEU MD2 2 76 PHE HZ . . 3.710 2.741 2.537 2.985 . 0 0 "[ . 1 . 2]" 1
2135 2 66 LEU HG 2 67 ARG H . . 4.970 4.701 4.606 4.857 . 0 0 "[ . 1 . 2]" 1
2136 2 67 ARG H 2 67 ARG HB2 . . 3.380 2.428 2.320 2.570 . 0 0 "[ . 1 . 2]" 1
2137 2 67 ARG H 2 67 ARG HB3 . . 3.710 3.625 3.568 3.689 . 0 0 "[ . 1 . 2]" 1
2138 2 67 ARG H 2 67 ARG HD2 . . 5.500 4.640 4.057 5.036 . 0 0 "[ . 1 . 2]" 1
2139 2 67 ARG H 2 67 ARG QD . . 4.830 4.139 3.811 4.483 . 0 0 "[ . 1 . 2]" 1
2140 2 67 ARG H 2 67 ARG HD3 . . 5.500 4.750 4.311 5.188 . 0 0 "[ . 1 . 2]" 1
2141 2 67 ARG H 2 67 ARG HG2 . . 3.880 3.732 3.264 3.936 0.056 19 0 "[ . 1 . 2]" 1
2142 2 67 ARG H 2 67 ARG HG3 . . 3.490 2.756 2.499 2.967 . 0 0 "[ . 1 . 2]" 1
2143 2 67 ARG H 2 68 PRO HD2 . . 5.090 4.852 4.798 4.900 . 0 0 "[ . 1 . 2]" 1
2144 2 67 ARG H 2 68 PRO QD . . 4.450 4.428 4.376 4.457 0.007 9 0 "[ . 1 . 2]" 1
2145 2 67 ARG H 2 68 PRO HD3 . . 5.090 5.114 5.041 5.149 0.059 4 0 "[ . 1 . 2]" 1
2146 2 67 ARG H 2 70 HIS H . . 4.870 4.594 4.198 4.929 0.059 4 0 "[ . 1 . 2]" 1
2147 2 67 ARG H 2 70 HIS HB2 . . 4.090 3.931 3.607 4.138 0.048 11 0 "[ . 1 . 2]" 1
2148 2 67 ARG H 2 73 PHE QD . . 4.200 3.820 3.532 4.246 0.046 4 0 "[ . 1 . 2]" 1
2149 2 67 ARG HA 2 67 ARG HD2 . . 5.500 4.728 4.051 4.947 . 0 0 "[ . 1 . 2]" 1
2150 2 67 ARG HA 2 67 ARG QD . . 4.630 4.073 3.774 4.291 . 0 0 "[ . 1 . 2]" 1
2151 2 67 ARG HA 2 67 ARG HD3 . . 5.500 4.462 4.199 4.739 . 0 0 "[ . 1 . 2]" 1
2152 2 67 ARG HA 2 67 ARG HG2 . . 3.670 2.440 2.299 2.600 . 0 0 "[ . 1 . 2]" 1
2153 2 67 ARG HA 2 67 ARG HG3 . . 4.090 3.127 2.842 3.412 . 0 0 "[ . 1 . 2]" 1
2154 2 67 ARG HA 2 68 PRO HD2 . . 3.410 2.297 2.219 2.374 . 0 0 "[ . 1 . 2]" 1
2155 2 67 ARG HA 2 68 PRO QD . . 2.900 2.114 2.074 2.152 . 0 0 "[ . 1 . 2]" 1
2156 2 67 ARG HA 2 68 PRO HD3 . . 3.410 2.476 2.421 2.566 . 0 0 "[ . 1 . 2]" 1
2157 2 67 ARG HA 2 68 PRO HG2 . . 4.790 4.479 4.401 4.535 . 0 0 "[ . 1 . 2]" 1
2158 2 67 ARG HA 2 68 PRO HG3 . . 4.550 4.578 4.508 4.612 0.062 3 0 "[ . 1 . 2]" 1
2159 2 67 ARG HA 2 69 GLN H . . 4.450 3.990 3.770 4.284 . 0 0 "[ . 1 . 2]" 1
2160 2 67 ARG HB2 2 68 PRO QD . . 4.640 3.755 3.640 3.892 . 0 0 "[ . 1 . 2]" 1
2161 2 67 ARG HB2 2 69 GLN H . . 4.120 3.249 2.924 3.602 . 0 0 "[ . 1 . 2]" 1
2162 2 67 ARG HB2 2 70 HIS H . . 4.550 4.104 3.600 4.547 . 0 0 "[ . 1 . 2]" 1
2163 2 67 ARG HB2 2 70 HIS HB2 . . 4.900 4.009 3.470 4.316 . 0 0 "[ . 1 . 2]" 1
2164 2 67 ARG HB2 2 73 PHE QD . . 5.500 5.178 4.971 5.563 0.063 7 0 "[ . 1 . 2]" 1
2165 2 67 ARG HB3 2 68 PRO HD2 . . 4.350 2.395 2.258 2.570 . 0 0 "[ . 1 . 2]" 1
2166 2 67 ARG HB3 2 68 PRO HD3 . . 4.350 3.851 3.726 4.053 . 0 0 "[ . 1 . 2]" 1
2167 2 67 ARG HB3 2 69 GLN H . . 3.990 2.655 2.329 3.071 . 0 0 "[ . 1 . 2]" 1
2168 2 67 ARG HG2 2 68 PRO HD2 . . 5.070 3.435 3.029 3.913 . 0 0 "[ . 1 . 2]" 1
2169 2 67 ARG HG2 2 68 PRO QD . . 4.350 3.320 2.956 3.763 . 0 0 "[ . 1 . 2]" 1
2170 2 67 ARG HG2 2 68 PRO HD3 . . 5.070 4.420 4.115 4.882 . 0 0 "[ . 1 . 2]" 1
2171 2 68 PRO HA 2 69 GLN H . . 3.520 3.406 3.307 3.500 . 0 0 "[ . 1 . 2]" 1
2172 2 68 PRO HA 2 70 HIS H . . 4.450 3.508 3.154 3.994 . 0 0 "[ . 1 . 2]" 1
2173 2 68 PRO HA 2 73 PHE HB2 . . 4.460 2.792 2.331 3.117 . 0 0 "[ . 1 . 2]" 1
2174 2 68 PRO HA 2 73 PHE HB3 . . 4.450 2.878 2.481 3.311 . 0 0 "[ . 1 . 2]" 1
2175 2 68 PRO HA 2 73 PHE QD . . 3.750 2.864 2.481 3.080 . 0 0 "[ . 1 . 2]" 1
2176 2 68 PRO HA 2 73 PHE QE . . 4.250 3.750 3.407 4.053 . 0 0 "[ . 1 . 2]" 1
2177 2 68 PRO HB2 2 69 GLN H . . 3.740 3.770 3.603 3.805 0.065 7 0 "[ . 1 . 2]" 1
2178 2 68 PRO HB2 2 69 GLN HA . . 4.740 4.407 4.239 4.528 . 0 0 "[ . 1 . 2]" 1
2179 2 68 PRO HB2 2 73 PHE QD . . 4.950 4.739 4.288 5.006 0.056 19 0 "[ . 1 . 2]" 1
2180 2 68 PRO HB2 2 73 PHE QE . . 5.130 4.829 4.353 5.183 0.053 2 0 "[ . 1 . 2]" 1
2181 2 68 PRO HB3 2 69 GLN H . . 4.400 4.422 4.332 4.457 0.057 8 0 "[ . 1 . 2]" 1
2182 2 68 PRO HB3 2 73 PHE QD . . 4.890 3.778 3.219 4.037 . 0 0 "[ . 1 . 2]" 1
2183 2 68 PRO HB3 2 73 PHE QE . . 4.520 3.431 2.935 3.790 . 0 0 "[ . 1 . 2]" 1
2184 2 68 PRO HB3 2 73 PHE HZ . . 5.210 3.823 3.285 4.399 . 0 0 "[ . 1 . 2]" 1
2185 2 68 PRO QD 2 69 GLN H . . 3.770 3.022 2.789 3.168 . 0 0 "[ . 1 . 2]" 1
2186 2 68 PRO QD 2 73 PHE QE . . 4.530 2.857 2.404 3.596 . 0 0 "[ . 1 . 2]" 1
2187 2 68 PRO HD2 2 69 GLN H . . 4.360 3.113 2.855 3.269 . 0 0 "[ . 1 . 2]" 1
2188 2 68 PRO HD2 2 73 PHE QE . . 5.330 4.442 4.146 5.037 . 0 0 "[ . 1 . 2]" 1
2189 2 68 PRO HD3 2 69 GLN H . . 4.360 4.091 3.921 4.252 . 0 0 "[ . 1 . 2]" 1
2190 2 68 PRO HD3 2 73 PHE QE . . 5.330 2.894 2.419 3.682 . 0 0 "[ . 1 . 2]" 1
2191 2 68 PRO HG2 2 69 GLN H . . 4.040 3.001 2.783 3.120 . 0 0 "[ . 1 . 2]" 1
2192 2 68 PRO HG2 2 73 PHE QE . . 5.500 5.408 4.959 5.563 0.063 7 0 "[ . 1 . 2]" 1
2193 2 68 PRO HG3 2 69 GLN H . . 4.460 4.444 4.235 4.522 0.062 7 0 "[ . 1 . 2]" 1
2194 2 68 PRO HG3 2 73 PHE QE . . 4.680 4.544 3.800 4.749 0.069 18 0 "[ . 1 . 2]" 1
2195 2 68 PRO HG3 2 73 PHE HZ . . 5.340 4.902 4.350 5.395 0.055 2 0 "[ . 1 . 2]" 1
2196 2 69 GLN H 2 69 GLN HB2 . . 3.630 2.370 2.048 3.604 . 0 0 "[ . 1 . 2]" 1
2197 2 69 GLN H 2 69 GLN QB . . 3.090 2.225 1.996 2.441 . 0 0 "[ . 1 . 2]" 1
2198 2 69 GLN H 2 69 GLN HB3 . . 3.630 3.091 2.266 3.627 . 0 0 "[ . 1 . 2]" 1
2199 2 69 GLN H 2 69 GLN HG2 . . 5.150 3.644 2.166 4.555 . 0 0 "[ . 1 . 2]" 1
2200 2 69 GLN H 2 69 GLN QG . . 4.450 3.072 2.068 3.950 . 0 0 "[ . 1 . 2]" 1
2201 2 69 GLN H 2 69 GLN HG3 . . 5.150 3.577 2.092 4.506 . 0 0 "[ . 1 . 2]" 1
2202 2 69 GLN H 2 70 HIS H . . 3.250 2.784 2.658 2.977 . 0 0 "[ . 1 . 2]" 1
2203 2 69 GLN H 2 70 HIS HA . . 5.500 5.351 5.230 5.455 . 0 0 "[ . 1 . 2]" 1
2204 2 69 GLN H 2 70 HIS HB2 . . 4.750 4.505 4.225 4.667 . 0 0 "[ . 1 . 2]" 1
2205 2 69 GLN HA 2 69 GLN HG2 . . 3.960 3.034 2.330 3.831 . 0 0 "[ . 1 . 2]" 1
2206 2 69 GLN HA 2 69 GLN QG . . 3.410 2.530 2.234 3.394 . 0 0 "[ . 1 . 2]" 1
2207 2 69 GLN HA 2 69 GLN HG3 . . 3.960 2.965 2.258 3.877 . 0 0 "[ . 1 . 2]" 1
2208 2 69 GLN QB 2 70 HIS H . . 4.050 3.251 2.714 3.750 . 0 0 "[ . 1 . 2]" 1
2209 2 69 GLN HB2 2 70 HIS H . . 4.650 3.775 2.848 4.464 . 0 0 "[ . 1 . 2]" 1
2210 2 69 GLN HB3 2 70 HIS H . . 4.650 3.780 2.766 4.442 . 0 0 "[ . 1 . 2]" 1
2211 2 69 GLN HG2 2 70 HIS H . . 5.500 4.821 2.941 5.558 0.058 15 0 "[ . 1 . 2]" 1
2212 2 69 GLN HG3 2 70 HIS H . . 5.500 5.031 3.061 5.564 0.064 14 0 "[ . 1 . 2]" 1
2213 2 70 HIS H 2 70 HIS HB2 . . 3.140 2.405 2.067 2.694 . 0 0 "[ . 1 . 2]" 1
2214 2 70 HIS H 2 70 HIS HD2 . . 4.980 4.678 4.129 5.037 0.057 4 0 "[ . 1 . 2]" 1
2215 2 70 HIS H 2 71 SER H . . 4.920 4.519 4.300 4.683 . 0 0 "[ . 1 . 2]" 1
2216 2 70 HIS H 2 73 PHE HB2 . . 4.100 3.342 2.987 3.612 . 0 0 "[ . 1 . 2]" 1
2217 2 70 HIS H 2 73 PHE HB3 . . 4.690 4.083 3.431 4.550 . 0 0 "[ . 1 . 2]" 1
2218 2 70 HIS H 2 73 PHE QD . . 4.650 4.603 4.334 4.730 0.080 5 0 "[ . 1 . 2]" 1
2219 2 70 HIS HA 2 70 HIS HD2 . . 4.290 3.495 2.888 4.161 . 0 0 "[ . 1 . 2]" 1
2220 2 70 HIS HA 2 70 HIS HE1 . . 5.500 5.149 4.828 5.547 0.047 8 0 "[ . 1 . 2]" 1
2221 2 70 HIS HA 2 71 SER H . . 3.490 2.275 2.170 2.391 . 0 0 "[ . 1 . 2]" 1
2222 2 70 HIS HA 2 71 SER QB . . 4.470 4.346 4.061 4.552 0.082 7 0 "[ . 1 . 2]" 1
2223 2 70 HIS HB2 2 70 HIS HD2 . . 3.900 2.612 2.475 2.785 . 0 0 "[ . 1 . 2]" 1
2224 2 70 HIS HB3 2 71 SER H . . 4.790 3.804 3.370 3.948 . 0 0 "[ . 1 . 2]" 1
2225 2 70 HIS HB3 2 73 PHE H . . 3.770 2.723 2.320 3.028 . 0 0 "[ . 1 . 2]" 1
2226 2 70 HIS HB3 2 73 PHE HB2 . . 4.550 3.165 2.681 3.474 . 0 0 "[ . 1 . 2]" 1
2227 2 70 HIS HB3 2 73 PHE HB3 . . 4.790 4.227 3.819 4.586 . 0 0 "[ . 1 . 2]" 1
2228 2 70 HIS HB3 2 74 ASN H . . 5.500 5.465 4.981 5.568 0.068 8 0 "[ . 1 . 2]" 1
2229 2 70 HIS HD1 2 72 LEU HA . . 4.450 4.242 4.031 4.488 0.038 7 0 "[ . 1 . 2]" 1
2230 2 70 HIS HD1 2 72 LEU HB2 . . 4.250 2.230 1.781 3.033 . 0 0 "[ . 1 . 2]" 1
2231 2 70 HIS HD1 2 72 LEU HB3 . . 4.470 3.803 3.339 4.530 0.060 13 0 "[ . 1 . 2]" 1
2232 2 70 HIS HD1 2 72 LEU HG . . 4.180 2.329 1.975 3.755 . 0 0 "[ . 1 . 2]" 1
2233 2 70 HIS HD1 2 73 PHE H . . 4.000 3.940 3.399 4.068 0.068 7 0 "[ . 1 . 2]" 1
2234 2 70 HIS HE1 2 72 LEU HB2 . . 3.990 3.918 2.807 4.048 0.058 4 0 "[ . 1 . 2]" 1
2235 2 70 HIS HE1 2 72 LEU HB3 . . 5.500 5.098 4.172 5.257 . 0 0 "[ . 1 . 2]" 1
2236 2 70 HIS HE1 2 72 LEU MD1 . . 3.380 2.432 2.057 2.732 . 0 0 "[ . 1 . 2]" 1
2237 2 70 HIS HE1 2 72 LEU MD2 . . 5.090 4.329 3.936 4.702 . 0 0 "[ . 1 . 2]" 1
2238 2 70 HIS HE1 2 72 LEU HG . . 3.530 3.067 2.612 3.591 0.061 8 0 "[ . 1 . 2]" 1
2239 2 71 SER H 2 71 SER QB . . 3.510 2.336 2.084 2.558 . 0 0 "[ . 1 . 2]" 1
2240 2 71 SER HA 2 73 PHE H . . 4.620 3.797 3.623 3.972 . 0 0 "[ . 1 . 2]" 1
2241 2 71 SER QB 2 72 LEU MD1 . . 5.340 4.989 4.683 5.278 . 0 0 "[ . 1 . 2]" 1
2242 2 71 SER QB 2 72 LEU MD2 . . 4.280 3.810 3.412 4.244 . 0 0 "[ . 1 . 2]" 1
2243 2 71 SER QB 2 72 LEU HG . . 4.830 3.704 3.295 4.019 . 0 0 "[ . 1 . 2]" 1
2244 2 71 SER HB2 2 72 LEU HG . . 5.500 4.454 3.347 5.540 0.040 4 0 "[ . 1 . 2]" 1
2245 2 71 SER HB3 2 72 LEU HG . . 5.500 4.533 3.442 5.484 . 0 0 "[ . 1 . 2]" 1
2246 2 72 LEU HA 2 72 LEU MD1 . . 3.980 3.858 3.772 3.892 . 0 0 "[ . 1 . 2]" 1
2247 2 72 LEU HA 2 72 LEU MD2 . . 3.030 2.100 2.031 2.212 . 0 0 "[ . 1 . 2]" 1
2248 2 72 LEU HA 2 72 LEU HG . . 4.240 3.138 3.000 3.277 . 0 0 "[ . 1 . 2]" 1
2249 2 72 LEU HA 2 74 ASN H . . 4.580 4.004 3.763 4.248 . 0 0 "[ . 1 . 2]" 1
2250 2 72 LEU HA 2 75 TYR H . . 4.160 3.201 3.016 3.403 . 0 0 "[ . 1 . 2]" 1
2251 2 72 LEU HA 2 75 TYR HB2 . . 4.630 3.817 3.448 4.183 . 0 0 "[ . 1 . 2]" 1
2252 2 72 LEU HA 2 75 TYR QB . . 4.070 2.794 2.497 3.105 . 0 0 "[ . 1 . 2]" 1
2253 2 72 LEU HA 2 75 TYR HB3 . . 4.630 2.882 2.544 3.211 . 0 0 "[ . 1 . 2]" 1
2254 2 72 LEU HA 2 75 TYR QD . . 4.870 4.216 3.676 4.764 . 0 0 "[ . 1 . 2]" 1
2255 2 72 LEU HA 2 76 PHE H . . 5.380 4.178 3.986 4.405 . 0 0 "[ . 1 . 2]" 1
2256 2 72 LEU HB2 2 72 LEU MD1 . . 3.440 2.329 2.266 2.400 . 0 0 "[ . 1 . 2]" 1
2257 2 72 LEU HB2 2 73 PHE H . . 5.080 3.226 2.990 3.640 . 0 0 "[ . 1 . 2]" 1
2258 2 72 LEU HB3 2 72 LEU MD1 . . 3.430 2.339 2.235 2.427 . 0 0 "[ . 1 . 2]" 1
2259 2 72 LEU HB3 2 72 LEU MD2 . . 3.350 2.429 2.363 2.528 . 0 0 "[ . 1 . 2]" 1
2260 2 72 LEU HB3 2 73 PHE H . . 4.350 4.031 3.821 4.210 . 0 0 "[ . 1 . 2]" 1
2261 2 72 LEU HB3 2 75 TYR QB . . 4.630 3.667 3.205 4.068 . 0 0 "[ . 1 . 2]" 1
2262 2 72 LEU HB3 2 75 TYR QD . . 4.410 3.796 2.992 4.377 . 0 0 "[ . 1 . 2]" 1
2263 2 72 LEU HB3 2 76 PHE H . . 4.870 4.204 3.855 4.544 . 0 0 "[ . 1 . 2]" 1
2264 2 72 LEU MD1 2 75 TYR QD . . 4.930 4.470 3.714 5.017 0.087 7 0 "[ . 1 . 2]" 1
2265 2 72 LEU MD2 2 73 PHE H . . 4.840 4.832 4.685 4.916 0.076 8 0 "[ . 1 . 2]" 1
2266 2 72 LEU MD2 2 75 TYR H . . 4.470 4.487 4.205 4.558 0.088 19 0 "[ . 1 . 2]" 1
2267 2 72 LEU MD2 2 75 TYR HB2 . . 4.210 3.963 3.214 4.261 0.051 2 0 "[ . 1 . 2]" 1
2268 2 72 LEU MD2 2 75 TYR QB . . 3.700 3.133 2.643 3.295 . 0 0 "[ . 1 . 2]" 1
2269 2 72 LEU MD2 2 75 TYR HB3 . . 4.210 3.289 2.812 3.595 . 0 0 "[ . 1 . 2]" 1
2270 2 72 LEU MD2 2 75 TYR QD . . 3.920 3.235 2.513 4.008 0.088 14 0 "[ . 1 . 2]" 1
2271 2 73 PHE H 2 73 PHE HB2 . . 3.360 2.440 2.360 2.517 . 0 0 "[ . 1 . 2]" 1
2272 2 73 PHE H 2 73 PHE HB3 . . 3.210 2.481 2.305 2.615 . 0 0 "[ . 1 . 2]" 1
2273 2 73 PHE H 2 73 PHE QD . . 4.240 4.179 4.117 4.228 . 0 0 "[ . 1 . 2]" 1
2274 2 73 PHE H 2 74 ASN H . . 3.540 2.792 2.672 2.926 . 0 0 "[ . 1 . 2]" 1
2275 2 73 PHE HA 2 73 PHE QD . . 3.590 3.019 2.594 3.302 . 0 0 "[ . 1 . 2]" 1
2276 2 73 PHE HA 2 76 PHE H . . 3.960 3.461 3.239 3.742 . 0 0 "[ . 1 . 2]" 1
2277 2 73 PHE HA 2 76 PHE HB2 . . 4.000 3.657 3.440 3.952 . 0 0 "[ . 1 . 2]" 1
2278 2 73 PHE HA 2 76 PHE HB3 . . 4.240 2.412 2.197 2.778 . 0 0 "[ . 1 . 2]" 1
2279 2 73 PHE HA 2 76 PHE QD . . 4.290 3.641 3.028 4.318 0.028 8 0 "[ . 1 . 2]" 1
2280 2 73 PHE HA 2 77 THR H . . 4.560 3.720 3.533 4.089 . 0 0 "[ . 1 . 2]" 1
2281 2 73 PHE HB2 2 74 ASN H . . 3.960 3.921 3.817 4.006 0.046 11 0 "[ . 1 . 2]" 1
2282 2 73 PHE HB3 2 74 ASN H . . 3.300 2.640 2.453 2.810 . 0 0 "[ . 1 . 2]" 1
2283 2 73 PHE QD 2 74 ASN H . . 4.030 3.406 3.161 3.878 . 0 0 "[ . 1 . 2]" 1
2284 2 73 PHE QD 2 74 ASN HA . . 4.320 3.130 2.809 3.861 . 0 0 "[ . 1 . 2]" 1
2285 2 73 PHE QD 2 76 PHE QD . . 4.880 4.187 2.982 4.960 0.080 15 0 "[ . 1 . 2]" 1
2286 2 73 PHE QD 2 77 THR H . . 5.500 4.455 4.046 4.838 . 0 0 "[ . 1 . 2]" 1
2287 2 73 PHE QD 2 77 THR HB . . 4.950 3.956 3.219 4.627 . 0 0 "[ . 1 . 2]" 1
2288 2 73 PHE QD 2 77 THR MG . . 4.010 3.216 2.829 3.711 . 0 0 "[ . 1 . 2]" 1
2289 2 73 PHE QE 2 77 THR MG . . 3.750 3.037 2.380 3.611 . 0 0 "[ . 1 . 2]" 1
2290 2 73 PHE HZ 2 77 THR MG . . 4.720 4.546 3.829 4.787 0.067 4 0 "[ . 1 . 2]" 1
2291 2 74 ASN H 2 74 ASN HB2 . . 3.490 2.304 2.068 3.560 0.070 18 0 "[ . 1 . 2]" 1
2292 2 74 ASN H 2 74 ASN HB3 . . 3.490 3.423 2.469 3.559 0.069 9 0 "[ . 1 . 2]" 1
2293 2 74 ASN H 2 74 ASN HD21 . . 4.770 2.854 2.109 4.040 . 0 0 "[ . 1 . 2]" 1
2294 2 74 ASN H 2 74 ASN QD . . 4.180 2.798 2.088 3.666 . 0 0 "[ . 1 . 2]" 1
2295 2 74 ASN H 2 74 ASN HD22 . . 4.770 4.245 3.362 4.841 0.071 13 0 "[ . 1 . 2]" 1
2296 2 74 ASN H 2 75 TYR H . . 3.780 2.794 2.682 2.922 . 0 0 "[ . 1 . 2]" 1
2297 2 74 ASN H 2 75 TYR QB . . 5.340 4.464 4.357 4.579 . 0 0 "[ . 1 . 2]" 1
2298 2 74 ASN HA 2 77 THR H . . 4.020 3.831 3.640 4.074 0.054 4 0 "[ . 1 . 2]" 1
2299 2 74 ASN HA 2 77 THR HB . . 4.280 4.249 3.888 4.351 0.071 8 0 "[ . 1 . 2]" 1
2300 2 74 ASN HA 2 77 THR MG . . 3.780 2.188 2.051 2.515 . 0 0 "[ . 1 . 2]" 1
2301 2 74 ASN HA 2 78 LYS H . . 4.550 4.022 3.771 4.563 0.013 4 0 "[ . 1 . 2]" 1
2302 2 74 ASN HB2 2 75 TYR H . . 3.970 3.086 2.414 3.743 . 0 0 "[ . 1 . 2]" 1
2303 2 74 ASN HB3 2 75 TYR H . . 3.970 3.375 2.719 3.945 . 0 0 "[ . 1 . 2]" 1
2304 2 75 TYR H 2 75 TYR HB2 . . 3.350 2.714 2.477 2.978 . 0 0 "[ . 1 . 2]" 1
2305 2 75 TYR H 2 75 TYR HB3 . . 3.350 2.319 2.201 2.477 . 0 0 "[ . 1 . 2]" 1
2306 2 75 TYR H 2 75 TYR QD . . 4.250 4.152 4.074 4.222 . 0 0 "[ . 1 . 2]" 1
2307 2 75 TYR H 2 76 PHE H . . 3.580 2.527 2.168 2.874 . 0 0 "[ . 1 . 2]" 1
2308 2 75 TYR HA 2 75 TYR QD . . 3.460 2.692 2.438 3.037 . 0 0 "[ . 1 . 2]" 1
2309 2 75 TYR HA 2 75 TYR QE . . 4.970 4.734 4.617 4.910 . 0 0 "[ . 1 . 2]" 1
2310 2 75 TYR HA 2 78 LYS H . . 3.970 3.799 3.568 4.033 0.063 6 0 "[ . 1 . 2]" 1
2311 2 75 TYR HA 2 78 LYS HB2 . . 4.520 3.496 2.440 4.605 0.085 13 0 "[ . 1 . 2]" 1
2312 2 75 TYR HA 2 78 LYS QB . . 3.840 3.075 2.418 3.736 . 0 0 "[ . 1 . 2]" 1
2313 2 75 TYR HA 2 78 LYS HB3 . . 4.520 4.090 3.287 4.575 0.055 4 0 "[ . 1 . 2]" 1
2314 2 75 TYR HA 2 78 LYS HD2 . . 5.290 3.030 2.276 4.183 . 0 0 "[ . 1 . 2]" 1
2315 2 75 TYR HA 2 78 LYS QD . . 4.630 2.870 2.256 3.808 . 0 0 "[ . 1 . 2]" 1
2316 2 75 TYR HA 2 78 LYS HD3 . . 5.290 3.826 2.500 5.105 . 0 0 "[ . 1 . 2]" 1
2317 2 75 TYR QB 2 76 PHE H . . 3.480 2.667 2.419 3.049 . 0 0 "[ . 1 . 2]" 1
2318 2 75 TYR QD 2 76 PHE H . . 4.180 3.591 3.152 3.927 . 0 0 "[ . 1 . 2]" 1
2319 2 75 TYR QD 2 76 PHE HA . . 4.770 3.889 3.137 4.311 . 0 0 "[ . 1 . 2]" 1
2320 2 75 TYR QD 2 76 PHE HB2 . . 4.990 4.106 3.697 4.455 . 0 0 "[ . 1 . 2]" 1
2321 2 75 TYR QD 2 78 LYS QB . . 5.340 4.469 3.458 5.287 . 0 0 "[ . 1 . 2]" 1
2322 2 75 TYR QD 2 78 LYS QD . . 4.690 3.732 2.340 4.710 0.020 15 0 "[ . 1 . 2]" 1
2323 2 75 TYR QD 2 79 LEU MD1 . . 4.290 3.522 3.037 4.339 0.049 13 0 "[ . 1 . 2]" 1
2324 2 75 TYR QD 2 79 LEU MD2 . . 4.800 4.460 3.630 4.900 0.100 3 0 "[ . 1 . 2]" 1
2325 2 75 TYR QE 2 76 PHE HB2 . . 5.500 5.561 5.501 5.587 0.087 3 0 "[ . 1 . 2]" 1
2326 2 75 TYR QE 2 79 LEU MD1 . . 3.730 2.728 2.292 3.385 . 0 0 "[ . 1 . 2]" 1
2327 2 75 TYR QE 2 79 LEU MD2 . . 4.460 3.403 2.364 4.115 . 0 0 "[ . 1 . 2]" 1
2328 2 76 PHE H 2 76 PHE HB2 . . 3.350 2.657 2.538 2.846 . 0 0 "[ . 1 . 2]" 1
2329 2 76 PHE H 2 76 PHE HB3 . . 3.360 2.323 2.168 2.471 . 0 0 "[ . 1 . 2]" 1
2330 2 76 PHE H 2 76 PHE QD . . 4.190 4.131 3.924 4.223 0.033 15 0 "[ . 1 . 2]" 1
2331 2 76 PHE H 2 77 THR H . . 3.550 2.912 2.555 3.079 . 0 0 "[ . 1 . 2]" 1
2332 2 76 PHE H 2 78 LYS H . . 4.910 4.292 4.004 4.687 . 0 0 "[ . 1 . 2]" 1
2333 2 76 PHE HA 2 76 PHE QD . . 3.530 2.964 2.555 3.186 . 0 0 "[ . 1 . 2]" 1
2334 2 76 PHE HA 2 78 LYS H . . 4.940 4.664 4.537 4.888 . 0 0 "[ . 1 . 2]" 1
2335 2 76 PHE HA 2 79 LEU H . . 4.300 3.575 3.384 3.747 . 0 0 "[ . 1 . 2]" 1
2336 2 76 PHE HA 2 79 LEU QB . . 4.440 2.940 2.582 3.330 . 0 0 "[ . 1 . 2]" 1
2337 2 76 PHE HA 2 79 LEU MD1 . . 3.910 2.834 2.506 3.541 . 0 0 "[ . 1 . 2]" 1
2338 2 76 PHE HA 2 79 LEU MD2 . . 5.430 5.078 4.736 5.485 0.055 9 0 "[ . 1 . 2]" 1
2339 2 76 PHE HA 2 79 LEU HG . . 4.800 3.910 3.243 4.613 . 0 0 "[ . 1 . 2]" 1
2340 2 76 PHE HA 2 80 VAL H . . 5.020 4.444 4.185 4.793 . 0 0 "[ . 1 . 2]" 1
2341 2 76 PHE HB2 2 77 THR H . . 4.150 3.927 3.805 4.012 . 0 0 "[ . 1 . 2]" 1
2342 2 76 PHE HB3 2 77 THR H . . 4.130 2.515 2.371 2.668 . 0 0 "[ . 1 . 2]" 1
2343 2 76 PHE QD 2 77 THR H . . 3.890 2.686 2.565 2.820 . 0 0 "[ . 1 . 2]" 1
2344 2 76 PHE QD 2 77 THR HA . . 4.370 3.122 2.729 3.750 . 0 0 "[ . 1 . 2]" 1
2345 2 76 PHE QD 2 77 THR HB . . 5.060 3.048 2.793 3.301 . 0 0 "[ . 1 . 2]" 1
2346 2 76 PHE QD 2 77 THR MG . . 4.230 4.231 4.026 4.322 0.092 15 0 "[ . 1 . 2]" 1
2347 2 76 PHE QD 2 79 LEU H . . 5.500 5.322 5.231 5.534 0.034 5 0 "[ . 1 . 2]" 1
2348 2 76 PHE QD 2 79 LEU MD1 . . 5.230 4.158 3.871 4.793 . 0 0 "[ . 1 . 2]" 1
2349 2 76 PHE QD 2 80 VAL MG2 . . 3.780 3.430 3.183 3.592 . 0 0 "[ . 1 . 2]" 1
2350 2 76 PHE QE 2 77 THR HB . . 4.650 4.479 4.018 4.730 0.080 8 0 "[ . 1 . 2]" 1
2351 2 76 PHE QE 2 80 VAL MG1 . . 4.650 4.455 4.072 4.738 0.088 7 0 "[ . 1 . 2]" 1
2352 2 76 PHE QE 2 80 VAL MG2 . . 3.900 2.856 2.535 3.130 . 0 0 "[ . 1 . 2]" 1
2353 2 76 PHE HZ 2 80 VAL MG1 . . 4.880 4.736 4.452 4.940 0.060 2 0 "[ . 1 . 2]" 1
2354 2 76 PHE HZ 2 80 VAL MG2 . . 3.720 3.143 2.836 3.294 . 0 0 "[ . 1 . 2]" 1
2355 2 77 THR H 2 77 THR HB . . 3.490 2.343 2.081 2.561 . 0 0 "[ . 1 . 2]" 1
2356 2 77 THR H 2 77 THR MG . . 3.340 2.363 1.992 2.688 . 0 0 "[ . 1 . 2]" 1
2357 2 77 THR H 2 78 LYS H . . 3.480 2.916 2.799 3.050 . 0 0 "[ . 1 . 2]" 1
2358 2 77 THR H 2 79 LEU H . . 5.440 4.259 4.112 4.438 . 0 0 "[ . 1 . 2]" 1
2359 2 77 THR H 2 80 VAL MG2 . . 4.660 4.354 4.116 4.542 . 0 0 "[ . 1 . 2]" 1
2360 2 77 THR HA 2 77 THR MG . . 3.290 3.266 3.240 3.300 0.010 10 0 "[ . 1 . 2]" 1
2361 2 77 THR HA 2 79 LEU H . . 4.840 4.125 3.630 4.477 . 0 0 "[ . 1 . 2]" 1
2362 2 77 THR HA 2 80 VAL H . . 3.990 3.276 3.085 3.570 . 0 0 "[ . 1 . 2]" 1
2363 2 77 THR HA 2 80 VAL HB . . 3.550 3.039 2.578 3.500 . 0 0 "[ . 1 . 2]" 1
2364 2 77 THR HA 2 80 VAL MG1 . . 4.540 4.353 4.032 4.581 0.041 2 0 "[ . 1 . 2]" 1
2365 2 77 THR HA 2 80 VAL MG2 . . 3.530 2.630 2.299 2.970 . 0 0 "[ . 1 . 2]" 1
2366 2 77 THR HA 2 81 GLU H . . 4.520 4.086 3.579 4.547 0.027 2 0 "[ . 1 . 2]" 1
2367 2 77 THR HB 2 78 LYS H . . 4.040 3.953 3.817 4.056 0.016 9 0 "[ . 1 . 2]" 1
2368 2 77 THR MG 2 78 LYS H . . 3.610 2.232 2.061 2.415 . 0 0 "[ . 1 . 2]" 1
2369 2 77 THR MG 2 78 LYS HA . . 3.990 3.463 3.336 3.716 . 0 0 "[ . 1 . 2]" 1
2370 2 77 THR MG 2 78 LYS QB . . 4.150 3.555 3.085 3.905 . 0 0 "[ . 1 . 2]" 1
2371 2 77 THR MG 2 80 VAL MG2 . . 5.160 4.931 4.687 5.165 0.005 15 0 "[ . 1 . 2]" 1
2372 2 77 THR MG 2 81 GLU H . . 5.500 5.096 4.661 5.342 . 0 0 "[ . 1 . 2]" 1
2373 2 77 THR MG 2 81 GLU HG2 . . 5.110 4.442 3.805 4.857 . 0 0 "[ . 1 . 2]" 1
2374 2 77 THR MG 2 81 GLU HG3 . . 4.530 4.077 3.366 4.611 0.081 4 0 "[ . 1 . 2]" 1
2375 2 78 LYS H 2 78 LYS HB2 . . 3.570 2.768 2.119 3.610 0.040 12 0 "[ . 1 . 2]" 1
2376 2 78 LYS H 2 78 LYS QB . . 2.910 2.312 2.056 2.464 . 0 0 "[ . 1 . 2]" 1
2377 2 78 LYS H 2 78 LYS HB3 . . 3.570 3.102 2.224 3.587 0.017 7 0 "[ . 1 . 2]" 1
2378 2 78 LYS H 2 78 LYS HD2 . . 5.350 4.109 3.572 5.095 . 0 0 "[ . 1 . 2]" 1
2379 2 78 LYS H 2 78 LYS QD . . 4.590 3.842 3.428 4.548 . 0 0 "[ . 1 . 2]" 1
2380 2 78 LYS H 2 78 LYS HD3 . . 5.350 4.700 4.130 5.115 . 0 0 "[ . 1 . 2]" 1
2381 2 78 LYS H 2 78 LYS HG2 . . 4.470 3.393 2.309 4.390 . 0 0 "[ . 1 . 2]" 1
2382 2 78 LYS H 2 78 LYS QG . . 3.640 2.512 2.198 3.717 0.077 8 0 "[ . 1 . 2]" 1
2383 2 78 LYS H 2 78 LYS HG3 . . 4.470 2.892 2.223 4.012 . 0 0 "[ . 1 . 2]" 1
2384 2 78 LYS H 2 81 GLU H . . 5.400 5.032 4.846 5.244 . 0 0 "[ . 1 . 2]" 1
2385 2 78 LYS H 2 81 GLU HG3 . . 5.500 5.159 4.382 5.563 0.063 4 0 "[ . 1 . 2]" 1
2386 2 78 LYS HA 2 78 LYS HE2 . . 5.370 4.749 4.008 5.430 0.060 12 0 "[ . 1 . 2]" 1
2387 2 78 LYS HA 2 78 LYS QE . . 4.620 4.314 3.911 4.542 . 0 0 "[ . 1 . 2]" 1
2388 2 78 LYS HA 2 78 LYS HE3 . . 5.370 5.091 4.322 5.449 0.079 18 0 "[ . 1 . 2]" 1
2389 2 78 LYS HA 2 78 LYS HG2 . . 4.240 2.996 2.226 4.244 0.004 12 0 "[ . 1 . 2]" 1
2390 2 78 LYS HA 2 78 LYS QG . . 3.450 2.692 2.161 3.459 0.009 12 0 "[ . 1 . 2]" 1
2391 2 78 LYS HA 2 78 LYS HG3 . . 4.240 3.110 2.436 3.725 . 0 0 "[ . 1 . 2]" 1
2392 2 78 LYS HA 2 81 GLU HB2 . . 3.560 2.896 2.442 3.399 . 0 0 "[ . 1 . 2]" 1
2393 2 78 LYS HA 2 81 GLU HG2 . . 4.740 3.838 3.107 4.712 . 0 0 "[ . 1 . 2]" 1
2394 2 78 LYS HA 2 81 GLU HG3 . . 4.040 3.336 2.539 3.793 . 0 0 "[ . 1 . 2]" 1
2395 2 78 LYS QB 2 78 LYS QD . . 3.310 2.195 2.068 2.675 . 0 0 "[ . 1 . 2]" 1
2396 2 78 LYS QB 2 78 LYS QE . . 4.090 2.971 1.838 3.546 . 0 0 "[ . 1 . 2]" 1
2397 2 78 LYS QB 2 79 LEU H . . 4.030 3.110 2.620 3.878 . 0 0 "[ . 1 . 2]" 1
2398 2 78 LYS HB2 2 78 LYS HE2 . . 5.500 3.916 1.865 4.644 . 0 0 "[ . 1 . 2]" 1
2399 2 78 LYS HB2 2 78 LYS HE3 . . 5.500 3.914 2.016 4.572 . 0 0 "[ . 1 . 2]" 1
2400 2 78 LYS HB3 2 78 LYS HE2 . . 5.500 3.859 1.943 4.878 . 0 0 "[ . 1 . 2]" 1
2401 2 78 LYS HB3 2 78 LYS HE3 . . 5.500 4.233 2.931 4.775 . 0 0 "[ . 1 . 2]" 1
2402 2 78 LYS HD2 2 79 LEU H . . 5.500 5.304 3.860 5.567 0.067 8 0 "[ . 1 . 2]" 1
2403 2 78 LYS HD3 2 79 LEU H . . 5.500 5.298 2.885 5.575 0.075 11 0 "[ . 1 . 2]" 1
2404 2 78 LYS QE 2 78 LYS QG . . 3.340 2.187 2.023 2.632 . 0 0 "[ . 1 . 2]" 1
2405 2 78 LYS QG 2 79 LEU H . . 4.520 3.774 2.435 4.464 . 0 0 "[ . 1 . 2]" 1
2406 2 79 LEU H 2 79 LEU HB2 . . 3.740 2.391 2.215 2.569 . 0 0 "[ . 1 . 2]" 1
2407 2 79 LEU H 2 79 LEU QB . . 3.170 2.359 2.192 2.522 . 0 0 "[ . 1 . 2]" 1
2408 2 79 LEU H 2 79 LEU HB3 . . 3.740 3.612 3.499 3.709 . 0 0 "[ . 1 . 2]" 1
2409 2 79 LEU H 2 79 LEU MD1 . . 4.060 3.801 3.521 4.099 0.039 6 0 "[ . 1 . 2]" 1
2410 2 79 LEU H 2 79 LEU MD2 . . 4.000 3.863 3.363 4.079 0.079 19 0 "[ . 1 . 2]" 1
2411 2 79 LEU H 2 79 LEU HG . . 3.520 2.878 2.606 3.220 . 0 0 "[ . 1 . 2]" 1
2412 2 79 LEU H 2 80 VAL MG2 . . 4.440 3.979 3.608 4.342 . 0 0 "[ . 1 . 2]" 1
2413 2 79 LEU H 2 81 GLU H . . 4.680 4.265 3.757 4.515 . 0 0 "[ . 1 . 2]" 1
2414 2 79 LEU HA 2 79 LEU MD1 . . 4.020 3.856 3.782 3.887 . 0 0 "[ . 1 . 2]" 1
2415 2 79 LEU HA 2 79 LEU MD2 . . 2.960 2.128 2.012 2.219 . 0 0 "[ . 1 . 2]" 1
2416 2 79 LEU HA 2 79 LEU HG . . 4.200 2.981 2.742 3.246 . 0 0 "[ . 1 . 2]" 1
2417 2 79 LEU HA 2 82 GLN H . . 3.720 3.412 3.213 3.593 . 0 0 "[ . 1 . 2]" 1
2418 2 79 LEU HA 2 82 GLN HB2 . . 4.260 3.128 2.575 3.701 . 0 0 "[ . 1 . 2]" 1
2419 2 79 LEU HA 2 82 GLN QB . . 3.540 2.529 2.327 2.682 . 0 0 "[ . 1 . 2]" 1
2420 2 79 LEU HA 2 82 GLN HB3 . . 4.260 3.222 2.405 4.331 0.071 16 0 "[ . 1 . 2]" 1
2421 2 79 LEU HA 2 82 GLN QG . . 4.330 3.959 2.902 4.405 0.075 9 0 "[ . 1 . 2]" 1
2422 2 79 LEU HA 2 83 TYR H . . 4.490 4.166 3.938 4.437 . 0 0 "[ . 1 . 2]" 1
2423 2 79 LEU HA 2 83 TYR QD . . 5.120 4.479 4.143 4.729 . 0 0 "[ . 1 . 2]" 1
2424 2 79 LEU QB 2 79 LEU MD1 . . 3.220 2.064 2.013 2.150 . 0 0 "[ . 1 . 2]" 1
2425 2 79 LEU QB 2 79 LEU MD2 . . 2.970 2.334 2.218 2.420 . 0 0 "[ . 1 . 2]" 1
2426 2 79 LEU QB 2 80 VAL MG2 . . 5.260 3.363 3.222 3.516 . 0 0 "[ . 1 . 2]" 1
2427 2 79 LEU QB 2 83 TYR QD . . 5.340 3.113 2.738 3.736 . 0 0 "[ . 1 . 2]" 1
2428 2 79 LEU QB 2 83 TYR QE . . 3.850 2.487 2.148 3.006 . 0 0 "[ . 1 . 2]" 1
2429 2 79 LEU HB2 2 79 LEU MD2 . . 3.500 3.249 3.190 3.278 . 0 0 "[ . 1 . 2]" 1
2430 2 79 LEU HB2 2 80 VAL H . . 3.970 2.779 2.607 2.903 . 0 0 "[ . 1 . 2]" 1
2431 2 79 LEU HB3 2 79 LEU MD2 . . 3.500 2.393 2.263 2.495 . 0 0 "[ . 1 . 2]" 1
2432 2 79 LEU HB3 2 80 VAL H . . 3.970 3.518 3.239 3.680 . 0 0 "[ . 1 . 2]" 1
2433 2 79 LEU MD1 2 80 VAL H . . 4.730 4.615 4.460 4.730 0.000 13 0 "[ . 1 . 2]" 1
2434 2 79 LEU MD1 2 83 TYR QE . . 3.820 2.901 2.347 3.521 . 0 0 "[ . 1 . 2]" 1
2435 2 79 LEU MD2 2 80 VAL H . . 4.890 4.850 4.727 4.931 0.041 8 0 "[ . 1 . 2]" 1
2436 2 79 LEU MD2 2 82 GLN H . . 5.210 4.938 4.650 5.205 . 0 0 "[ . 1 . 2]" 1
2437 2 79 LEU MD2 2 82 GLN HB2 . . 4.520 4.017 3.395 4.593 0.073 14 0 "[ . 1 . 2]" 1
2438 2 79 LEU MD2 2 82 GLN QB . . 3.650 3.380 3.077 3.593 . 0 0 "[ . 1 . 2]" 1
2439 2 79 LEU MD2 2 82 GLN HB3 . . 4.520 3.882 3.173 4.608 0.088 3 0 "[ . 1 . 2]" 1
2440 2 79 LEU MD2 2 82 GLN HE21 . . 5.040 3.564 2.468 5.122 0.082 18 0 "[ . 1 . 2]" 1
2441 2 79 LEU MD2 2 82 GLN QE . . 4.360 3.264 2.228 4.405 0.045 2 0 "[ . 1 . 2]" 1
2442 2 79 LEU MD2 2 82 GLN HE22 . . 5.040 3.987 2.433 5.116 0.076 16 0 "[ . 1 . 2]" 1
2443 2 79 LEU MD2 2 82 GLN QG . . 4.300 4.206 3.446 4.419 0.119 3 0 "[ . 1 . 2]" 1
2444 2 79 LEU MD2 2 83 TYR QD . . 4.630 4.150 3.795 4.528 . 0 0 "[ . 1 . 2]" 1
2445 2 79 LEU MD2 2 83 TYR QE . . 3.600 2.963 2.388 3.600 . 0 0 "[ . 1 . 2]" 1
2446 2 79 LEU HG 2 80 VAL H . . 5.330 4.746 4.475 4.955 . 0 0 "[ . 1 . 2]" 1
2447 2 80 VAL H 2 80 VAL HB . . 3.230 2.633 2.552 2.723 . 0 0 "[ . 1 . 2]" 1
2448 2 80 VAL H 2 80 VAL MG1 . . 3.810 3.805 3.789 3.832 0.022 12 0 "[ . 1 . 2]" 1
2449 2 80 VAL H 2 80 VAL MG2 . . 2.970 2.091 2.012 2.152 . 0 0 "[ . 1 . 2]" 1
2450 2 80 VAL H 2 81 GLU H . . 3.310 2.772 2.645 2.858 . 0 0 "[ . 1 . 2]" 1
2451 2 80 VAL H 2 81 GLU HB2 . . 5.380 4.847 4.564 5.244 . 0 0 "[ . 1 . 2]" 1
2452 2 80 VAL H 2 81 GLU HG3 . . 5.500 5.476 4.560 5.574 0.074 8 0 "[ . 1 . 2]" 1
2453 2 80 VAL HA 2 80 VAL MG1 . . 3.020 2.364 2.248 2.490 . 0 0 "[ . 1 . 2]" 1
2454 2 80 VAL HA 2 80 VAL MG2 . . 3.030 2.430 2.362 2.496 . 0 0 "[ . 1 . 2]" 1
2455 2 80 VAL HA 2 82 GLN H . . 4.640 4.184 3.810 4.667 0.027 12 0 "[ . 1 . 2]" 1
2456 2 80 VAL HA 2 83 TYR H . . 3.950 3.381 3.289 3.525 . 0 0 "[ . 1 . 2]" 1
2457 2 80 VAL HA 2 83 TYR HB2 . . 4.370 2.703 2.456 2.951 . 0 0 "[ . 1 . 2]" 1
2458 2 80 VAL HA 2 83 TYR QD . . 4.000 2.799 2.400 3.343 . 0 0 "[ . 1 . 2]" 1
2459 2 80 VAL HA 2 83 TYR QE . . 5.240 4.796 4.330 5.218 . 0 0 "[ . 1 . 2]" 1
2460 2 80 VAL HA 2 84 THR H . . 4.560 4.065 3.937 4.283 . 0 0 "[ . 1 . 2]" 1
2461 2 80 VAL HA 2 84 THR MG . . 5.000 3.859 3.665 4.104 . 0 0 "[ . 1 . 2]" 1
2462 2 80 VAL HB 2 81 GLU H . . 3.230 2.405 2.213 2.563 . 0 0 "[ . 1 . 2]" 1
2463 2 80 VAL HB 2 84 THR H . . 5.500 5.563 5.546 5.576 0.076 2 0 "[ . 1 . 2]" 1
2464 2 80 VAL MG1 2 81 GLU H . . 3.590 3.424 3.298 3.554 . 0 0 "[ . 1 . 2]" 1
2465 2 80 VAL MG1 2 81 GLU HA . . 3.840 3.590 3.430 3.753 . 0 0 "[ . 1 . 2]" 1
2466 2 80 VAL MG1 2 81 GLU HG2 . . 4.510 3.935 3.570 4.467 . 0 0 "[ . 1 . 2]" 1
2467 2 80 VAL MG1 2 83 TYR QD . . 4.660 4.365 3.945 4.728 0.068 2 0 "[ . 1 . 2]" 1
2468 2 80 VAL MG1 2 84 THR MG . . 3.370 2.335 2.158 2.562 . 0 0 "[ . 1 . 2]" 1
2469 2 80 VAL MG2 2 81 GLU H . . 3.750 3.733 3.578 3.824 0.074 16 0 "[ . 1 . 2]" 1
2470 2 80 VAL MG2 2 83 TYR H . . 5.420 5.216 5.137 5.346 . 0 0 "[ . 1 . 2]" 1
2471 2 80 VAL MG2 2 83 TYR QD . . 4.530 3.885 3.470 4.338 . 0 0 "[ . 1 . 2]" 1
2472 2 81 GLU H 2 81 GLU HB2 . . 2.950 2.513 2.321 2.768 . 0 0 "[ . 1 . 2]" 1
2473 2 81 GLU H 2 81 GLU HG2 . . 3.810 2.043 1.782 2.430 . 0 0 "[ . 1 . 2]" 1
2474 2 81 GLU H 2 81 GLU HG3 . . 3.340 3.217 2.304 3.396 0.056 19 0 "[ . 1 . 2]" 1
2475 2 81 GLU H 2 82 GLN H . . 3.250 2.817 2.720 2.898 . 0 0 "[ . 1 . 2]" 1
2476 2 81 GLU H 2 83 TYR H . . 4.720 4.215 4.002 4.418 . 0 0 "[ . 1 . 2]" 1
2477 2 81 GLU HA 2 81 GLU HG2 . . 3.690 2.947 2.464 3.431 . 0 0 "[ . 1 . 2]" 1
2478 2 81 GLU HA 2 81 GLU HG3 . . 3.960 3.797 3.567 3.976 0.016 13 0 "[ . 1 . 2]" 1
2479 2 81 GLU HA 2 84 THR H . . 3.990 3.504 3.335 3.677 . 0 0 "[ . 1 . 2]" 1
2480 2 81 GLU HA 2 84 THR HB . . 4.460 4.471 4.351 4.525 0.065 6 0 "[ . 1 . 2]" 1
2481 2 81 GLU HA 2 84 THR MG . . 4.010 3.541 3.256 3.852 . 0 0 "[ . 1 . 2]" 1
2482 2 81 GLU HB2 2 82 GLN H . . 3.180 2.885 2.419 3.198 0.018 8 0 "[ . 1 . 2]" 1
2483 2 81 GLU HG2 2 82 GLN H . . 4.490 4.419 4.129 4.562 0.072 3 0 "[ . 1 . 2]" 1
2484 2 81 GLU HG3 2 82 GLN H . . 5.160 4.959 4.310 5.219 0.059 2 0 "[ . 1 . 2]" 1
2485 2 82 GLN H 2 82 GLN HB2 . . 3.590 2.513 2.283 2.987 . 0 0 "[ . 1 . 2]" 1
2486 2 82 GLN H 2 82 GLN QB . . 2.970 2.263 2.139 2.437 . 0 0 "[ . 1 . 2]" 1
2487 2 82 GLN H 2 82 GLN HB3 . . 3.590 2.888 2.289 3.626 0.036 3 0 "[ . 1 . 2]" 1
2488 2 82 GLN H 2 82 GLN HG2 . . 4.440 3.961 2.635 4.479 0.039 9 0 "[ . 1 . 2]" 1
2489 2 82 GLN H 2 82 GLN HG3 . . 4.440 3.827 2.433 4.498 0.058 2 0 "[ . 1 . 2]" 1
2490 2 82 GLN H 2 83 TYR H . . 3.330 2.414 2.080 2.752 . 0 0 "[ . 1 . 2]" 1
2491 2 82 GLN H 2 83 TYR HB2 . . 5.270 4.563 4.236 4.916 . 0 0 "[ . 1 . 2]" 1
2492 2 82 GLN H 2 84 THR H . . 4.370 3.927 3.541 4.241 . 0 0 "[ . 1 . 2]" 1
2493 2 82 GLN HA 2 82 GLN HG2 . . 3.780 2.841 2.113 3.435 . 0 0 "[ . 1 . 2]" 1
2494 2 82 GLN HA 2 82 GLN HG3 . . 3.780 2.874 2.302 3.714 . 0 0 "[ . 1 . 2]" 1
2495 2 82 GLN HA 2 84 THR H . . 5.270 4.411 4.165 4.589 . 0 0 "[ . 1 . 2]" 1
2496 2 82 GLN QB 2 83 TYR H . . 3.440 2.780 2.423 3.079 . 0 0 "[ . 1 . 2]" 1
2497 2 82 GLN QB 2 83 TYR HB2 . . 4.950 4.666 4.458 4.861 . 0 0 "[ . 1 . 2]" 1
2498 2 82 GLN QB 2 84 THR H . . 5.340 4.812 4.558 4.974 . 0 0 "[ . 1 . 2]" 1
2499 2 82 GLN HB2 2 83 TYR H . . 4.290 3.550 2.482 4.198 . 0 0 "[ . 1 . 2]" 1
2500 2 82 GLN HB2 2 83 TYR QD . . 5.500 5.109 4.412 5.577 0.077 9 0 "[ . 1 . 2]" 1
2501 2 82 GLN HB3 2 83 TYR H . . 4.290 3.176 2.482 3.926 . 0 0 "[ . 1 . 2]" 1
2502 2 82 GLN HB3 2 83 TYR QD . . 5.500 4.364 3.580 5.149 . 0 0 "[ . 1 . 2]" 1
2503 2 82 GLN HG2 2 83 TYR H . . 4.760 4.376 3.589 4.837 0.077 19 0 "[ . 1 . 2]" 1
2504 2 82 GLN HG3 2 83 TYR H . . 4.760 4.709 4.359 4.834 0.074 7 0 "[ . 1 . 2]" 1
2505 2 83 TYR H 2 83 TYR HB2 . . 3.240 2.403 2.339 2.539 . 0 0 "[ . 1 . 2]" 1
2506 2 83 TYR H 2 83 TYR HB3 . . 3.700 3.618 3.557 3.713 0.013 7 0 "[ . 1 . 2]" 1
2507 2 83 TYR H 2 83 TYR QD . . 3.840 3.407 3.141 3.589 . 0 0 "[ . 1 . 2]" 1
2508 2 83 TYR H 2 83 TYR QE . . 5.320 4.980 4.719 5.262 . 0 0 "[ . 1 . 2]" 1
2509 2 83 TYR H 2 84 THR H . . 3.210 2.524 2.278 2.715 . 0 0 "[ . 1 . 2]" 1
2510 2 83 TYR H 2 84 THR HA . . 5.330 5.135 4.916 5.350 0.020 19 0 "[ . 1 . 2]" 1
2511 2 83 TYR H 2 84 THR MG . . 5.010 4.390 4.101 4.637 . 0 0 "[ . 1 . 2]" 1
2512 2 83 TYR HA 2 83 TYR QD . . 3.440 2.183 2.035 2.382 . 0 0 "[ . 1 . 2]" 1
2513 2 83 TYR HA 2 83 TYR QE . . 4.450 4.446 4.307 4.523 0.073 10 0 "[ . 1 . 2]" 1
2514 2 83 TYR HB2 2 84 THR H . . 4.040 3.041 2.757 3.349 . 0 0 "[ . 1 . 2]" 1
2515 2 83 TYR HB2 2 84 THR MG . . 4.860 3.868 3.569 4.243 . 0 0 "[ . 1 . 2]" 1
2516 2 83 TYR HB3 2 84 THR H . . 4.740 3.909 3.677 4.161 . 0 0 "[ . 1 . 2]" 1
2517 2 83 TYR HB3 2 84 THR MG . . 5.500 4.586 4.323 5.007 . 0 0 "[ . 1 . 2]" 1
2518 2 83 TYR QD 2 84 THR H . . 4.740 4.735 4.577 4.819 0.079 2 0 "[ . 1 . 2]" 1
2519 2 84 THR H 2 84 THR HB . . 3.580 3.557 3.473 3.619 0.039 19 0 "[ . 1 . 2]" 1
2520 2 84 THR H 2 84 THR MG . . 3.360 2.607 2.479 2.820 . 0 0 "[ . 1 . 2]" 1
2521 2 84 THR HA 2 84 THR HB . . 2.910 2.601 2.552 2.662 . 0 0 "[ . 1 . 2]" 1
2522 2 84 THR HA 2 84 THR MG . . 2.840 2.228 2.133 2.317 . 0 0 "[ . 1 . 2]" 1
2523 2 84 THR HA 2 85 LYS H . . 3.120 2.390 2.152 2.668 . 0 0 "[ . 1 . 2]" 1
2524 2 84 THR HB 2 85 LYS H . . 3.870 2.554 1.954 3.302 . 0 0 "[ . 1 . 2]" 1
2525 2 84 THR MG 2 85 LYS H . . 3.550 3.391 3.000 3.631 0.081 1 0 "[ . 1 . 2]" 1
2526 2 84 THR MG 2 85 LYS HA . . 5.150 5.221 5.064 5.247 0.097 6 0 "[ . 1 . 2]" 1
2527 2 85 LYS H 2 85 LYS HB2 . . 3.760 3.317 2.974 3.837 0.077 2 0 "[ . 1 . 2]" 1
2528 2 85 LYS H 2 85 LYS QB . . 3.130 2.929 2.436 3.202 0.072 12 0 "[ . 1 . 2]" 1
2529 2 85 LYS H 2 85 LYS HB3 . . 3.760 3.347 2.484 3.833 0.073 9 0 "[ . 1 . 2]" 1
2530 2 85 LYS H 2 85 LYS HG2 . . 5.500 4.459 2.100 5.340 . 0 0 "[ . 1 . 2]" 1
2531 2 85 LYS H 2 85 LYS HG3 . . 5.500 4.552 3.096 5.206 . 0 0 "[ . 1 . 2]" 1
2532 2 85 LYS HA 2 85 LYS HD2 . . 5.240 4.008 2.102 4.903 . 0 0 "[ . 1 . 2]" 1
2533 2 85 LYS HA 2 85 LYS QD . . 4.500 3.496 2.081 4.304 . 0 0 "[ . 1 . 2]" 1
2534 2 85 LYS HA 2 85 LYS HD3 . . 5.240 4.080 2.108 5.068 . 0 0 "[ . 1 . 2]" 1
2535 2 85 LYS HA 2 85 LYS HG2 . . 4.140 3.022 2.135 3.841 . 0 0 "[ . 1 . 2]" 1
2536 2 85 LYS HA 2 85 LYS HG3 . . 4.140 2.964 2.226 4.214 0.074 2 0 "[ . 1 . 2]" 1
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