NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
491740 |
2jvo   |
15485 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2jvo
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 1540
_Distance_constraint_stats_list.Viol_count 119
_Distance_constraint_stats_list.Viol_total 195.756
_Distance_constraint_stats_list.Viol_max 0.448
_Distance_constraint_stats_list.Viol_rms 0.0075
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0003
_Distance_constraint_stats_list.Viol_average_violations_only 0.0823
_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 29 LEU 1.005 0.206 1 0 "[ . 1 . 2]"
1 30 SER 1.005 0.206 1 0 "[ . 1 . 2]"
1 31 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 LEU 0.957 0.136 11 0 "[ . 1 . 2]"
1 35 PHE 1.580 0.350 17 0 "[ . 1 . 2]"
1 36 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 PRO 0.110 0.110 2 0 "[ . 1 . 2]"
1 39 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 GLU 0.009 0.009 14 0 "[ . 1 . 2]"
1 46 SER 0.023 0.023 7 0 "[ . 1 . 2]"
1 47 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 LEU 0.569 0.067 3 0 "[ . 1 . 2]"
1 49 ASN 0.032 0.023 7 0 "[ . 1 . 2]"
1 50 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 PHE 0.569 0.067 3 0 "[ . 1 . 2]"
1 53 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 LYS 0.027 0.024 18 0 "[ . 1 . 2]"
1 63 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 LEU 0.437 0.204 19 0 "[ . 1 . 2]"
1 65 ASN 0.377 0.204 19 0 "[ . 1 . 2]"
1 66 GLY 0.007 0.007 4 0 "[ . 1 . 2]"
1 67 PHE 0.067 0.026 12 0 "[ . 1 . 2]"
1 68 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 PHE 0.027 0.024 18 0 "[ . 1 . 2]"
1 70 VAL 0.020 0.016 16 0 "[ . 1 . 2]"
1 71 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 SER 0.256 0.061 5 0 "[ . 1 . 2]"
1 78 ALA 0.010 0.006 12 0 "[ . 1 . 2]"
1 79 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 LYS 0.172 0.061 5 0 "[ . 1 . 2]"
1 81 ALA 0.083 0.026 9 0 "[ . 1 . 2]"
1 82 ILE 0.010 0.006 12 0 "[ . 1 . 2]"
1 83 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 ASN 1.147 0.448 18 0 "[ . 1 . 2]"
1 93 GLN 1.037 0.448 18 0 "[ . 1 . 2]"
1 94 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 VAL 4.697 0.261 17 0 "[ . 1 . 2]"
1 99 TYR 3.760 0.261 17 0 "[ . 1 . 2]"
1 100 SER 1.580 0.350 17 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 29 LEU H 1 29 LEU HB3 3.970 . 4.470 3.309 2.580 4.020 . 0 0 "[ . 1 . 2]" 1
2 1 29 LEU HA 1 29 LEU MD1 4.180 . 4.680 2.453 2.111 2.819 . 0 0 "[ . 1 . 2]" 1
3 1 29 LEU HA 1 29 LEU HG 3.920 . 4.420 3.752 3.223 3.904 . 0 0 "[ . 1 . 2]" 1
4 1 29 LEU HA 1 30 SER HA 4.840 . 5.340 4.627 4.192 4.908 . 0 0 "[ . 1 . 2]" 1
5 1 29 LEU HA 1 30 SER HB2 5.300 . 5.800 5.215 4.962 5.402 . 0 0 "[ . 1 . 2]" 1
6 1 29 LEU HA 1 99 TYR HB3 5.180 . 5.680 4.765 4.278 5.226 . 0 0 "[ . 1 . 2]" 1
7 1 29 LEU HB2 1 29 LEU HG 2.930 . 3.430 2.502 2.382 2.946 . 0 0 "[ . 1 . 2]" 1
8 1 29 LEU HB2 1 30 SER H 4.920 . 5.420 3.718 3.258 4.106 . 0 0 "[ . 1 . 2]" 1
9 1 29 LEU HB2 1 31 ASN H 4.560 . 5.060 4.186 3.665 4.641 . 0 0 "[ . 1 . 2]" 1
10 1 29 LEU HB2 1 99 TYR HB2 4.700 . 5.200 4.157 3.700 4.704 . 0 0 "[ . 1 . 2]" 1
11 1 29 LEU HB2 1 99 TYR HB3 4.160 . 4.660 3.970 3.753 4.336 . 0 0 "[ . 1 . 2]" 1
12 1 29 LEU HB3 1 30 SER HA 5.000 . 5.500 4.743 4.543 5.059 . 0 0 "[ . 1 . 2]" 1
13 1 29 LEU HB3 1 30 SER HB2 5.500 . 6.000 4.281 3.862 5.121 . 0 0 "[ . 1 . 2]" 1
14 1 29 LEU HB3 1 31 ASN H 4.410 . 4.910 2.572 1.984 3.034 . 0 0 "[ . 1 . 2]" 1
15 1 29 LEU HB3 1 99 TYR HB2 5.080 . 5.580 3.104 2.619 3.645 . 0 0 "[ . 1 . 2]" 1
16 1 29 LEU HB3 1 99 TYR HB3 4.750 . 5.250 2.392 2.109 2.816 . 0 0 "[ . 1 . 2]" 1
17 1 29 LEU HB3 1 99 TYR QD 6.170 . 6.670 2.800 2.334 3.595 . 0 0 "[ . 1 . 2]" 1
18 1 29 LEU HB3 1 99 TYR QE 6.170 . 6.670 4.560 4.158 5.345 . 0 0 "[ . 1 . 2]" 1
19 1 29 LEU MD1 1 30 SER H 6.610 . 7.110 2.398 1.594 3.387 0.206 1 0 "[ . 1 . 2]" 1
20 1 29 LEU MD1 1 30 SER HA 5.040 . 5.540 4.096 3.900 4.314 . 0 0 "[ . 1 . 2]" 1
21 1 29 LEU MD1 1 99 TYR H 5.910 . 6.410 4.468 3.866 4.958 . 0 0 "[ . 1 . 2]" 1
22 1 29 LEU MD1 1 99 TYR HA 6.410 . 6.910 4.020 3.716 4.898 . 0 0 "[ . 1 . 2]" 1
23 1 29 LEU MD1 1 99 TYR HB2 5.730 . 6.230 2.800 2.202 3.635 . 0 0 "[ . 1 . 2]" 1
24 1 29 LEU MD1 1 99 TYR HB3 5.740 . 6.240 2.496 2.093 3.667 . 0 0 "[ . 1 . 2]" 1
25 1 29 LEU MD1 1 99 TYR QD 6.130 . 6.630 3.929 3.469 4.613 . 0 0 "[ . 1 . 2]" 1
26 1 29 LEU MD1 1 100 SER H 6.610 . 7.110 4.604 4.335 5.022 . 0 0 "[ . 1 . 2]" 1
27 1 29 LEU MD1 1 100 SER HA 5.400 . 5.900 4.595 4.417 4.736 . 0 0 "[ . 1 . 2]" 1
28 1 29 LEU MD2 1 30 SER H 6.610 . 7.110 4.070 3.504 4.645 . 0 0 "[ . 1 . 2]" 1
29 1 29 LEU MD2 1 30 SER HB2 6.610 . 7.110 5.422 5.071 5.584 . 0 0 "[ . 1 . 2]" 1
30 1 29 LEU MD2 1 99 TYR HB2 4.710 . 5.210 3.848 2.181 4.011 . 0 0 "[ . 1 . 2]" 1
31 1 29 LEU MD2 1 99 TYR HB3 5.160 . 5.660 4.280 3.157 4.400 . 0 0 "[ . 1 . 2]" 1
32 1 29 LEU MD2 1 99 TYR QD 6.340 . 6.840 3.805 2.487 4.347 . 0 0 "[ . 1 . 2]" 1
33 1 29 LEU HG 1 31 ASN H 4.620 . 5.120 4.376 3.306 4.814 . 0 0 "[ . 1 . 2]" 1
34 1 29 LEU HG 1 99 TYR HB2 5.500 . 6.000 2.353 2.179 2.478 . 0 0 "[ . 1 . 2]" 1
35 1 30 SER HA 1 31 ASN HD21 5.160 . 5.660 4.368 3.286 5.602 . 0 0 "[ . 1 . 2]" 1
36 1 30 SER HA 1 32 THR H 5.500 . 6.000 4.217 4.011 4.397 . 0 0 "[ . 1 . 2]" 1
37 1 30 SER HA 1 32 THR MG 6.610 . 7.110 5.041 4.712 5.554 . 0 0 "[ . 1 . 2]" 1
38 1 30 SER HA 1 33 ARG QD 5.260 . 5.760 4.317 4.018 4.621 . 0 0 "[ . 1 . 2]" 1
39 1 30 SER HB2 1 31 ASN H 5.410 . 5.910 3.160 2.743 3.490 . 0 0 "[ . 1 . 2]" 1
40 1 30 SER HB2 1 31 ASN HA 5.500 . 6.000 4.811 4.514 5.090 . 0 0 "[ . 1 . 2]" 1
41 1 30 SER HB2 1 33 ARG H 5.230 . 5.730 4.216 3.549 4.862 . 0 0 "[ . 1 . 2]" 1
42 1 30 SER HB2 1 33 ARG HB3 4.920 . 5.420 4.931 4.592 5.161 . 0 0 "[ . 1 . 2]" 1
43 1 30 SER HB2 1 33 ARG QG 6.170 . 6.670 4.162 3.386 4.923 . 0 0 "[ . 1 . 2]" 1
44 1 30 SER HB3 1 32 THR H 5.500 . 6.000 3.203 2.471 3.979 . 0 0 "[ . 1 . 2]" 1
45 1 30 SER HB3 1 32 THR MG 6.610 . 7.110 4.805 4.128 5.534 . 0 0 "[ . 1 . 2]" 1
46 1 31 ASN H 1 33 ARG H 5.500 . 6.000 5.049 4.840 5.324 . 0 0 "[ . 1 . 2]" 1
47 1 31 ASN HA 1 31 ASN HD22 4.950 . 5.450 4.857 4.109 5.152 . 0 0 "[ . 1 . 2]" 1
48 1 31 ASN HA 1 33 ARG H 5.380 . 5.880 4.813 4.488 5.008 . 0 0 "[ . 1 . 2]" 1
49 1 31 ASN HA 1 75 ALA MB 6.080 . 6.580 4.281 3.868 4.979 . 0 0 "[ . 1 . 2]" 1
50 1 31 ASN HA 1 99 TYR QD 4.060 . 4.560 2.692 2.464 2.867 . 0 0 "[ . 1 . 2]" 1
51 1 31 ASN HA 1 99 TYR QE 4.340 . 4.840 3.080 2.663 3.734 . 0 0 "[ . 1 . 2]" 1
52 1 31 ASN HB2 1 32 THR H 5.500 . 6.000 3.797 3.126 4.403 . 0 0 "[ . 1 . 2]" 1
53 1 31 ASN HB2 1 75 ALA HA 5.130 . 5.630 4.300 3.838 5.024 . 0 0 "[ . 1 . 2]" 1
54 1 31 ASN HB2 1 75 ALA MB 5.020 . 5.520 2.992 2.423 3.590 . 0 0 "[ . 1 . 2]" 1
55 1 31 ASN HB2 1 99 TYR QE 5.600 . 6.100 4.896 4.030 5.127 . 0 0 "[ . 1 . 2]" 1
56 1 31 ASN HB3 1 32 THR H 5.500 . 6.000 4.500 4.190 4.702 . 0 0 "[ . 1 . 2]" 1
57 1 31 ASN HB3 1 32 THR MG 6.610 . 7.110 3.676 2.996 4.365 . 0 0 "[ . 1 . 2]" 1
58 1 31 ASN HB3 1 75 ALA HA 5.500 . 6.000 4.548 3.837 5.645 . 0 0 "[ . 1 . 2]" 1
59 1 31 ASN HB3 1 75 ALA MB 5.060 . 5.560 2.995 2.253 4.228 . 0 0 "[ . 1 . 2]" 1
60 1 31 ASN HB3 1 99 TYR QE 5.940 . 6.440 4.095 3.831 5.070 . 0 0 "[ . 1 . 2]" 1
61 1 31 ASN HD21 1 75 ALA MB 6.320 . 6.820 4.511 3.785 5.264 . 0 0 "[ . 1 . 2]" 1
62 1 31 ASN HD22 1 32 THR MG 5.850 . 6.350 4.781 3.249 5.771 . 0 0 "[ . 1 . 2]" 1
63 1 31 ASN HD22 1 75 ALA MB 6.340 . 6.840 5.242 4.895 5.370 . 0 0 "[ . 1 . 2]" 1
64 1 32 THR H 1 33 ARG H 3.990 . 4.490 2.881 2.686 3.249 . 0 0 "[ . 1 . 2]" 1
65 1 32 THR H 1 33 ARG HB2 5.500 . 6.000 4.011 3.532 4.684 . 0 0 "[ . 1 . 2]" 1
66 1 32 THR H 1 99 TYR QD 6.170 . 6.670 3.512 2.997 3.907 . 0 0 "[ . 1 . 2]" 1
67 1 32 THR HA 1 34 LEU MD1 6.610 . 7.110 3.955 3.516 4.188 . 0 0 "[ . 1 . 2]" 1
68 1 32 THR HA 1 72 PHE H 4.760 . 5.260 4.039 3.727 4.240 . 0 0 "[ . 1 . 2]" 1
69 1 32 THR HA 1 72 PHE HB2 4.600 . 5.100 3.596 3.011 4.030 . 0 0 "[ . 1 . 2]" 1
70 1 32 THR HA 1 78 ALA H 4.920 . 5.420 4.066 3.708 4.514 . 0 0 "[ . 1 . 2]" 1
71 1 32 THR HA 1 78 ALA HA 4.550 . 5.050 4.271 4.009 4.445 . 0 0 "[ . 1 . 2]" 1
72 1 32 THR HA 1 78 ALA MB 4.180 . 4.680 1.964 1.861 2.045 . 0 0 "[ . 1 . 2]" 1
73 1 32 THR HA 1 99 TYR QD 5.320 . 5.820 3.880 3.510 4.171 . 0 0 "[ . 1 . 2]" 1
74 1 32 THR HA 1 99 TYR QE 5.700 . 6.200 4.589 4.189 4.903 . 0 0 "[ . 1 . 2]" 1
75 1 32 THR HB 1 33 ARG HA 5.230 . 5.730 4.728 4.488 4.896 . 0 0 "[ . 1 . 2]" 1
76 1 32 THR HB 1 71 GLU HA 4.920 . 5.420 4.192 3.711 4.397 . 0 0 "[ . 1 . 2]" 1
77 1 32 THR HB 1 71 GLU QG 4.950 . 5.450 3.653 2.831 4.098 . 0 0 "[ . 1 . 2]" 1
78 1 32 THR HB 1 72 PHE H 4.260 . 4.760 2.414 2.100 2.612 . 0 0 "[ . 1 . 2]" 1
79 1 32 THR HB 1 72 PHE HB2 4.820 . 5.320 2.432 2.135 3.147 . 0 0 "[ . 1 . 2]" 1
80 1 32 THR HB 1 75 ALA HA 5.500 . 6.000 4.403 3.936 5.007 . 0 0 "[ . 1 . 2]" 1
81 1 32 THR HB 1 75 ALA MB 6.610 . 7.110 5.201 4.770 5.555 . 0 0 "[ . 1 . 2]" 1
82 1 32 THR HB 1 78 ALA MB 5.790 . 6.290 3.554 2.854 4.090 . 0 0 "[ . 1 . 2]" 1
83 1 32 THR MG 1 33 ARG H 6.610 . 7.110 4.619 4.545 4.714 . 0 0 "[ . 1 . 2]" 1
84 1 32 THR MG 1 33 ARG QD 7.410 . 7.910 5.161 3.731 5.577 . 0 0 "[ . 1 . 2]" 1
85 1 32 THR MG 1 71 GLU HA 6.610 . 7.110 5.442 5.137 5.571 . 0 0 "[ . 1 . 2]" 1
86 1 32 THR MG 1 71 GLU QG 7.410 . 7.910 4.358 3.753 4.861 . 0 0 "[ . 1 . 2]" 1
87 1 32 THR MG 1 72 PHE H 5.720 . 6.220 3.981 3.702 4.142 . 0 0 "[ . 1 . 2]" 1
88 1 32 THR MG 1 72 PHE HB2 5.930 . 6.430 3.345 2.880 3.713 . 0 0 "[ . 1 . 2]" 1
89 1 32 THR MG 1 72 PHE QD 6.920 . 7.420 4.248 3.820 4.595 . 0 0 "[ . 1 . 2]" 1
90 1 32 THR MG 1 74 GLU H 6.610 . 7.110 3.306 2.904 4.066 . 0 0 "[ . 1 . 2]" 1
91 1 32 THR MG 1 75 ALA H 5.870 . 6.370 3.509 3.141 3.836 . 0 0 "[ . 1 . 2]" 1
92 1 32 THR MG 1 75 ALA HA 4.110 . 4.610 2.460 2.121 2.849 . 0 0 "[ . 1 . 2]" 1
93 1 32 THR MG 1 75 ALA MB 5.030 . 5.530 2.876 2.555 3.157 . 0 0 "[ . 1 . 2]" 1
94 1 32 THR MG 1 77 SER H 6.610 . 7.110 5.281 4.920 5.596 . 0 0 "[ . 1 . 2]" 1
95 1 32 THR MG 1 78 ALA H 6.610 . 7.110 4.328 3.570 4.610 . 0 0 "[ . 1 . 2]" 1
96 1 32 THR MG 1 78 ALA MB 5.910 . 6.410 3.200 2.333 3.567 . 0 0 "[ . 1 . 2]" 1
97 1 32 THR MG 1 99 TYR QE 7.410 . 7.910 5.064 4.666 5.384 . 0 0 "[ . 1 . 2]" 1
98 1 33 ARG H 1 34 LEU H 5.340 . 5.840 4.317 4.179 4.449 . 0 0 "[ . 1 . 2]" 1
99 1 33 ARG H 1 72 PHE H 5.110 . 5.610 5.097 5.042 5.144 . 0 0 "[ . 1 . 2]" 1
100 1 33 ARG H 1 98 VAL O 2.000 . 2.300 2.157 2.070 2.225 . 0 0 "[ . 1 . 2]" 1
101 1 33 ARG H 1 99 TYR HA 5.500 . 6.000 2.122 1.815 2.452 . 0 0 "[ . 1 . 2]" 1
102 1 33 ARG H 1 99 TYR QD 6.170 . 6.670 2.977 2.743 3.167 . 0 0 "[ . 1 . 2]" 1
103 1 33 ARG HA 1 34 LEU MD2 6.360 . 6.860 2.687 2.435 2.929 . 0 0 "[ . 1 . 2]" 1
104 1 33 ARG HA 1 71 GLU H 5.500 . 6.000 4.707 4.602 4.785 . 0 0 "[ . 1 . 2]" 1
105 1 33 ARG HA 1 71 GLU HA 3.880 . 4.380 2.295 2.169 2.417 . 0 0 "[ . 1 . 2]" 1
106 1 33 ARG HA 1 71 GLU QG 6.170 . 6.670 3.507 3.118 3.750 . 0 0 "[ . 1 . 2]" 1
107 1 33 ARG HA 1 72 PHE H 4.080 . 4.580 3.732 3.612 3.877 . 0 0 "[ . 1 . 2]" 1
108 1 33 ARG HB2 1 34 LEU H 4.470 . 4.970 4.183 4.037 4.349 . 0 0 "[ . 1 . 2]" 1
109 1 33 ARG HB2 1 34 LEU MD2 6.610 . 7.110 5.109 4.890 5.331 . 0 0 "[ . 1 . 2]" 1
110 1 33 ARG HB2 1 71 GLU HA 4.620 . 5.120 4.861 4.783 4.933 . 0 0 "[ . 1 . 2]" 1
111 1 33 ARG HB2 1 99 TYR H 5.500 . 6.000 4.996 4.735 5.355 . 0 0 "[ . 1 . 2]" 1
112 1 33 ARG HB2 1 99 TYR QD 5.650 . 6.150 5.021 4.708 5.115 . 0 0 "[ . 1 . 2]" 1
113 1 33 ARG HB2 1 100 SER H 5.460 . 5.960 2.781 2.206 3.180 . 0 0 "[ . 1 . 2]" 1
114 1 33 ARG HB2 1 100 SER HA 4.000 . 4.500 4.181 4.094 4.295 . 0 0 "[ . 1 . 2]" 1
115 1 33 ARG HB2 1 100 SER HB2 4.220 . 4.720 3.199 2.583 4.132 . 0 0 "[ . 1 . 2]" 1
116 1 33 ARG HB3 1 71 GLU HA 5.500 . 6.000 4.241 4.049 4.447 . 0 0 "[ . 1 . 2]" 1
117 1 33 ARG HB3 1 100 SER HB2 4.740 . 5.240 2.405 1.870 3.234 . 0 0 "[ . 1 . 2]" 1
118 1 33 ARG QD 1 71 GLU HA 6.170 . 6.670 4.680 4.019 5.045 . 0 0 "[ . 1 . 2]" 1
119 1 33 ARG QD 1 100 SER HB2 5.720 . 6.220 4.159 3.402 5.171 . 0 0 "[ . 1 . 2]" 1
120 1 33 ARG QG 1 34 LEU H 5.750 . 6.250 3.611 3.377 3.872 . 0 0 "[ . 1 . 2]" 1
121 1 33 ARG QG 1 34 LEU MD1 7.410 . 7.910 4.726 4.522 5.011 . 0 0 "[ . 1 . 2]" 1
122 1 33 ARG QG 1 34 LEU MD2 6.250 . 6.750 4.167 3.966 4.407 . 0 0 "[ . 1 . 2]" 1
123 1 33 ARG QG 1 69 PHE QD 6.930 . 7.430 5.561 5.320 5.673 . 0 0 "[ . 1 . 2]" 1
124 1 33 ARG QG 1 71 GLU HA 5.960 . 6.460 2.715 2.413 2.895 . 0 0 "[ . 1 . 2]" 1
125 1 33 ARG QG 1 72 PHE H 6.080 . 6.580 3.752 3.392 4.002 . 0 0 "[ . 1 . 2]" 1
126 1 33 ARG QG 1 100 SER H 6.170 . 6.670 4.745 4.196 5.142 . 0 0 "[ . 1 . 2]" 1
127 1 33 ARG QG 1 100 SER HA 6.170 . 6.670 5.725 5.559 5.847 . 0 0 "[ . 1 . 2]" 1
128 1 33 ARG QG 1 100 SER HB2 5.280 . 5.780 4.158 3.381 4.768 . 0 0 "[ . 1 . 2]" 1
129 1 33 ARG QG 1 100 SER HB3 6.110 . 6.610 3.730 2.982 5.122 . 0 0 "[ . 1 . 2]" 1
130 1 33 ARG N 1 98 VAL O 3.000 . 3.200 2.995 2.917 3.075 . 0 0 "[ . 1 . 2]" 1
131 1 33 ARG O 1 98 VAL H 2.000 . 2.300 2.144 2.094 2.272 . 0 0 "[ . 1 . 2]" 1
132 1 33 ARG O 1 98 VAL N 3.000 . 3.200 2.966 2.914 3.029 . 0 0 "[ . 1 . 2]" 1
133 1 34 LEU H 1 34 LEU HG 4.150 . 4.650 3.997 3.917 4.151 . 0 0 "[ . 1 . 2]" 1
134 1 34 LEU H 1 35 PHE H 4.800 . 5.300 4.356 4.168 4.613 . 0 0 "[ . 1 . 2]" 1
135 1 34 LEU H 1 69 PHE HA 5.100 . 5.600 4.200 3.899 4.479 . 0 0 "[ . 1 . 2]" 1
136 1 34 LEU H 1 69 PHE HB3 5.500 . 6.000 4.952 4.688 5.205 . 0 0 "[ . 1 . 2]" 1
137 1 34 LEU H 1 70 VAL H 4.180 . 4.680 3.286 3.017 3.523 . 0 0 "[ . 1 . 2]" 1
138 1 34 LEU H 1 70 VAL HB 4.740 . 5.240 3.423 3.307 3.678 . 0 0 "[ . 1 . 2]" 1
139 1 34 LEU H 1 70 VAL MG1 6.610 . 7.110 4.562 4.440 4.732 . 0 0 "[ . 1 . 2]" 1
140 1 34 LEU H 1 70 VAL MG2 6.610 . 7.110 4.415 4.321 4.620 . 0 0 "[ . 1 . 2]" 1
141 1 34 LEU H 1 70 VAL O 2.000 . 2.300 1.856 1.784 1.916 0.016 16 0 "[ . 1 . 2]" 1
142 1 34 LEU H 1 71 GLU HA 4.120 . 4.620 3.372 3.094 3.525 . 0 0 "[ . 1 . 2]" 1
143 1 34 LEU H 1 71 GLU HB2 5.500 . 6.000 4.688 4.355 5.091 . 0 0 "[ . 1 . 2]" 1
144 1 34 LEU H 1 71 GLU QG 6.170 . 6.670 4.970 4.626 5.173 . 0 0 "[ . 1 . 2]" 1
145 1 34 LEU H 1 72 PHE H 5.170 . 5.670 5.163 4.985 5.269 . 0 0 "[ . 1 . 2]" 1
146 1 34 LEU H 1 78 ALA MB 6.610 . 7.110 5.556 5.455 5.634 . 0 0 "[ . 1 . 2]" 1
147 1 34 LEU H 1 100 SER HB2 5.460 . 5.960 4.005 3.561 4.325 . 0 0 "[ . 1 . 2]" 1
148 1 34 LEU H 1 100 SER HB3 5.500 . 6.000 4.701 3.223 5.212 . 0 0 "[ . 1 . 2]" 1
149 1 34 LEU HA 1 34 LEU MD1 4.370 . 4.870 2.407 2.279 2.515 . 0 0 "[ . 1 . 2]" 1
150 1 34 LEU HA 1 35 PHE H 3.370 . 3.870 2.098 2.029 2.234 . 0 0 "[ . 1 . 2]" 1
151 1 34 LEU HA 1 35 PHE HB3 4.960 . 5.460 4.236 3.980 4.445 . 0 0 "[ . 1 . 2]" 1
152 1 34 LEU HA 1 70 VAL MG2 6.340 . 6.840 5.370 5.319 5.449 . 0 0 "[ . 1 . 2]" 1
153 1 34 LEU HA 1 97 VAL HA 3.830 . 4.330 2.030 1.973 2.140 . 0 0 "[ . 1 . 2]" 1
154 1 34 LEU HA 1 97 VAL HB 5.500 . 6.000 4.856 4.719 4.932 . 0 0 "[ . 1 . 2]" 1
155 1 34 LEU HA 1 97 VAL MG1 5.440 . 5.940 3.394 3.053 3.534 . 0 0 "[ . 1 . 2]" 1
156 1 34 LEU HA 1 97 VAL MG2 5.520 . 6.020 3.827 3.541 3.939 . 0 0 "[ . 1 . 2]" 1
157 1 34 LEU HA 1 98 VAL H 4.170 . 4.670 1.756 1.664 1.863 0.136 11 0 "[ . 1 . 2]" 1
158 1 34 LEU HA 1 98 VAL MG1 5.440 . 5.940 4.027 3.860 4.319 . 0 0 "[ . 1 . 2]" 1
159 1 34 LEU HA 1 100 SER H 3.920 . 4.420 3.999 3.710 4.116 . 0 0 "[ . 1 . 2]" 1
160 1 34 LEU HA 1 100 SER HB2 4.560 . 5.060 3.929 3.669 4.272 . 0 0 "[ . 1 . 2]" 1
161 1 34 LEU HB2 1 35 PHE H 4.220 . 4.720 4.177 4.051 4.293 . 0 0 "[ . 1 . 2]" 1
162 1 34 LEU HB2 1 36 VAL MG2 5.630 . 6.130 3.080 2.647 3.653 . 0 0 "[ . 1 . 2]" 1
163 1 34 LEU HB2 1 70 VAL H 5.300 . 5.800 3.018 2.827 3.105 . 0 0 "[ . 1 . 2]" 1
164 1 34 LEU HB2 1 70 VAL HA 5.500 . 6.000 4.739 4.366 4.984 . 0 0 "[ . 1 . 2]" 1
165 1 34 LEU HB2 1 70 VAL HB 3.890 . 4.390 2.171 2.026 2.394 . 0 0 "[ . 1 . 2]" 1
166 1 34 LEU HB2 1 81 ALA MB 5.660 . 6.160 4.717 4.620 4.819 . 0 0 "[ . 1 . 2]" 1
167 1 34 LEU HB2 1 97 VAL MG2 4.490 . 4.990 3.747 3.576 3.787 . 0 0 "[ . 1 . 2]" 1
168 1 34 LEU HB2 1 98 VAL H 5.390 . 5.890 4.624 4.552 4.721 . 0 0 "[ . 1 . 2]" 1
169 1 34 LEU HB2 1 100 SER HB2 5.500 . 6.000 5.665 5.587 5.741 . 0 0 "[ . 1 . 2]" 1
170 1 34 LEU HB3 1 35 PHE H 4.670 . 5.170 3.569 3.322 3.809 . 0 0 "[ . 1 . 2]" 1
171 1 34 LEU HB3 1 52 PHE HZ 5.500 . 6.000 3.384 3.140 3.622 . 0 0 "[ . 1 . 2]" 1
172 1 34 LEU HB3 1 70 VAL H 5.020 . 5.520 4.500 4.235 4.594 . 0 0 "[ . 1 . 2]" 1
173 1 34 LEU MD1 1 35 PHE H 5.340 . 5.840 4.123 4.015 4.255 . 0 0 "[ . 1 . 2]" 1
174 1 34 LEU MD1 1 55 PHE QD 7.410 . 7.910 5.065 4.858 5.256 . 0 0 "[ . 1 . 2]" 1
175 1 34 LEU MD1 1 70 VAL HB 6.610 . 7.110 4.434 4.355 4.556 . 0 0 "[ . 1 . 2]" 1
176 1 34 LEU MD1 1 72 PHE HB2 6.210 . 6.710 4.981 4.676 5.200 . 0 0 "[ . 1 . 2]" 1
177 1 34 LEU MD1 1 72 PHE QD 5.190 . 5.690 3.283 3.099 3.492 . 0 0 "[ . 1 . 2]" 1
178 1 34 LEU MD1 1 78 ALA H 6.610 . 7.110 4.613 4.441 4.869 . 0 0 "[ . 1 . 2]" 1
179 1 34 LEU MD1 1 78 ALA MB 5.910 . 6.410 2.782 2.576 2.973 . 0 0 "[ . 1 . 2]" 1
180 1 34 LEU MD1 1 79 ALA H 6.610 . 7.110 5.367 5.245 5.452 . 0 0 "[ . 1 . 2]" 1
181 1 34 LEU MD1 1 81 ALA HA 5.990 . 6.490 4.901 4.762 5.010 . 0 0 "[ . 1 . 2]" 1
182 1 34 LEU MD1 1 81 ALA MB 7.230 . 7.730 2.268 2.165 2.357 . 0 0 "[ . 1 . 2]" 1
183 1 34 LEU MD1 1 82 ILE H 5.870 . 6.370 3.957 3.701 4.155 . 0 0 "[ . 1 . 2]" 1
184 1 34 LEU MD1 1 82 ILE HA 6.440 . 6.940 4.608 4.326 4.857 . 0 0 "[ . 1 . 2]" 1
185 1 34 LEU MD1 1 98 VAL H 5.570 . 6.070 2.537 2.325 2.743 . 0 0 "[ . 1 . 2]" 1
186 1 34 LEU MD1 1 99 TYR H 6.060 . 6.560 4.978 4.784 5.101 . 0 0 "[ . 1 . 2]" 1
187 1 34 LEU MD1 1 99 TYR QE 7.160 . 7.660 5.307 4.984 5.390 . 0 0 "[ . 1 . 2]" 1
188 1 34 LEU MD1 1 100 SER H 5.480 . 5.980 4.346 4.063 4.574 . 0 0 "[ . 1 . 2]" 1
189 1 34 LEU MD1 1 100 SER HB2 6.610 . 7.110 5.049 4.856 5.596 . 0 0 "[ . 1 . 2]" 1
190 1 34 LEU MD2 1 35 PHE H 6.490 . 6.990 5.116 5.033 5.190 . 0 0 "[ . 1 . 2]" 1
191 1 34 LEU MD2 1 52 PHE HB3 6.610 . 7.110 4.616 3.643 4.977 . 0 0 "[ . 1 . 2]" 1
192 1 34 LEU MD2 1 52 PHE QD 7.410 . 7.910 2.967 2.762 3.159 . 0 0 "[ . 1 . 2]" 1
193 1 34 LEU MD2 1 52 PHE HZ 6.610 . 7.110 4.258 3.859 4.700 . 0 0 "[ . 1 . 2]" 1
194 1 34 LEU MD2 1 55 PHE QD 5.730 . 6.230 4.291 4.210 4.347 . 0 0 "[ . 1 . 2]" 1
195 1 34 LEU MD2 1 70 VAL H 6.470 . 6.970 3.571 3.400 3.860 . 0 0 "[ . 1 . 2]" 1
196 1 34 LEU MD2 1 70 VAL HA 4.420 . 4.920 3.804 3.767 3.842 . 0 0 "[ . 1 . 2]" 1
197 1 34 LEU MD2 1 70 VAL HB 4.530 . 5.030 2.082 2.027 2.179 . 0 0 "[ . 1 . 2]" 1
198 1 34 LEU MD2 1 72 PHE H 6.610 . 7.110 3.673 3.470 3.936 . 0 0 "[ . 1 . 2]" 1
199 1 34 LEU MD2 1 72 PHE HB2 6.610 . 7.110 4.277 3.994 4.444 . 0 0 "[ . 1 . 2]" 1
200 1 34 LEU MD2 1 72 PHE QD 5.760 . 6.260 2.955 2.623 3.050 . 0 0 "[ . 1 . 2]" 1
201 1 34 LEU MD2 1 81 ALA MB 5.030 . 5.530 3.384 3.268 3.521 . 0 0 "[ . 1 . 2]" 1
202 1 34 LEU MD2 1 100 SER HB2 6.610 . 7.110 5.410 5.135 5.629 . 0 0 "[ . 1 . 2]" 1
203 1 34 LEU HG 1 35 PHE H 5.500 . 6.000 5.545 5.452 5.610 . 0 0 "[ . 1 . 2]" 1
204 1 34 LEU HG 1 70 VAL H 5.500 . 6.000 5.500 5.428 5.557 . 0 0 "[ . 1 . 2]" 1
205 1 34 LEU HG 1 81 ALA HA 5.500 . 6.000 5.228 5.050 5.455 . 0 0 "[ . 1 . 2]" 1
206 1 34 LEU N 1 70 VAL O 3.000 . 3.200 2.796 2.716 2.837 . 0 0 "[ . 1 . 2]" 1
207 1 34 LEU O 1 70 VAL H 2.000 . 2.300 2.011 1.887 2.086 . 0 0 "[ . 1 . 2]" 1
208 1 34 LEU O 1 70 VAL N 3.000 . 3.200 2.957 2.848 3.013 . 0 0 "[ . 1 . 2]" 1
209 1 35 PHE H 1 35 PHE HB2 3.760 . 4.260 2.983 2.829 3.227 . 0 0 "[ . 1 . 2]" 1
210 1 35 PHE H 1 35 PHE HB3 4.040 . 4.540 2.408 2.187 2.661 . 0 0 "[ . 1 . 2]" 1
211 1 35 PHE H 1 36 VAL MG1 5.870 . 6.370 4.863 3.264 5.554 . 0 0 "[ . 1 . 2]" 1
212 1 35 PHE H 1 36 VAL MG2 6.200 . 6.700 3.374 2.908 4.441 . 0 0 "[ . 1 . 2]" 1
213 1 35 PHE H 1 70 VAL H 5.500 . 6.000 5.087 4.983 5.178 . 0 0 "[ . 1 . 2]" 1
214 1 35 PHE H 1 96 GLU H 4.740 . 5.240 4.344 4.021 4.767 . 0 0 "[ . 1 . 2]" 1
215 1 35 PHE H 1 96 GLU O 2.000 . 2.300 2.091 2.016 2.215 . 0 0 "[ . 1 . 2]" 1
216 1 35 PHE H 1 97 VAL HA 5.500 . 6.000 2.408 2.111 2.618 . 0 0 "[ . 1 . 2]" 1
217 1 35 PHE H 1 97 VAL MG1 6.260 . 6.760 4.565 4.438 4.758 . 0 0 "[ . 1 . 2]" 1
218 1 35 PHE H 1 98 VAL H 4.370 . 4.870 2.621 2.155 2.892 . 0 0 "[ . 1 . 2]" 1
219 1 35 PHE H 1 98 VAL MG1 5.190 . 5.690 3.448 3.190 3.884 . 0 0 "[ . 1 . 2]" 1
220 1 35 PHE H 1 100 SER H 4.710 . 5.210 4.195 3.697 4.724 . 0 0 "[ . 1 . 2]" 1
221 1 35 PHE H 1 100 SER HB2 4.670 . 5.170 3.504 3.176 4.619 . 0 0 "[ . 1 . 2]" 1
222 1 35 PHE H 1 100 SER HB3 4.860 . 5.360 4.754 3.539 5.019 . 0 0 "[ . 1 . 2]" 1
223 1 35 PHE HA 1 36 VAL H 3.320 . 3.820 2.004 1.921 2.120 . 0 0 "[ . 1 . 2]" 1
224 1 35 PHE HA 1 69 PHE HA 5.500 . 6.000 2.799 2.637 2.976 . 0 0 "[ . 1 . 2]" 1
225 1 35 PHE HA 1 69 PHE QD 6.170 . 6.670 3.533 2.444 4.012 . 0 0 "[ . 1 . 2]" 1
226 1 35 PHE HA 1 70 VAL H 5.500 . 6.000 4.063 3.856 4.206 . 0 0 "[ . 1 . 2]" 1
227 1 35 PHE HB2 1 36 VAL H 4.570 . 5.070 4.166 4.008 4.384 . 0 0 "[ . 1 . 2]" 1
228 1 35 PHE HB2 1 97 VAL HA 5.240 . 5.740 5.377 5.298 5.451 . 0 0 "[ . 1 . 2]" 1
229 1 35 PHE HB2 1 98 VAL H 5.490 . 5.990 4.835 4.672 5.111 . 0 0 "[ . 1 . 2]" 1
230 1 35 PHE HB2 1 98 VAL MG1 4.480 . 4.980 3.922 3.856 3.994 . 0 0 "[ . 1 . 2]" 1
231 1 35 PHE HB2 1 100 SER HA 4.190 . 4.690 2.896 1.981 3.570 . 0 0 "[ . 1 . 2]" 1
232 1 35 PHE HB2 1 100 SER HB2 5.120 . 5.620 2.306 1.948 3.388 . 0 0 "[ . 1 . 2]" 1
233 1 35 PHE HB2 1 100 SER HB3 4.280 . 4.780 3.125 1.956 3.554 . 0 0 "[ . 1 . 2]" 1
234 1 35 PHE HB3 1 36 VAL H 4.760 . 5.260 4.585 4.405 4.696 . 0 0 "[ . 1 . 2]" 1
235 1 35 PHE HB3 1 69 PHE HA 5.500 . 6.000 5.402 5.103 5.597 . 0 0 "[ . 1 . 2]" 1
236 1 35 PHE HB3 1 69 PHE QD 5.600 . 6.100 4.779 4.223 5.095 . 0 0 "[ . 1 . 2]" 1
237 1 35 PHE HB3 1 98 VAL H 5.500 . 6.000 4.146 3.638 4.421 . 0 0 "[ . 1 . 2]" 1
238 1 35 PHE HB3 1 98 VAL MG1 5.070 . 5.570 2.953 2.621 3.509 . 0 0 "[ . 1 . 2]" 1
239 1 35 PHE HB3 1 100 SER H 5.400 . 5.900 4.112 3.459 4.792 . 0 0 "[ . 1 . 2]" 1
240 1 35 PHE HB3 1 100 SER HA 2.830 . 3.330 2.855 2.143 3.678 0.348 3 0 "[ . 1 . 2]" 1
241 1 35 PHE HB3 1 100 SER HB2 4.510 . 5.010 3.161 2.625 4.416 . 0 0 "[ . 1 . 2]" 1
242 1 35 PHE HB3 1 100 SER HB3 3.900 . 4.400 4.120 3.020 4.750 0.350 17 0 "[ . 1 . 2]" 1
243 1 35 PHE QD 1 36 VAL H 4.980 . 5.480 3.002 2.515 4.214 . 0 0 "[ . 1 . 2]" 1
244 1 35 PHE QD 1 36 VAL HA 6.010 . 6.510 4.524 3.909 5.153 . 0 0 "[ . 1 . 2]" 1
245 1 35 PHE QD 1 37 ARG H 6.170 . 6.670 4.667 4.089 5.502 . 0 0 "[ . 1 . 2]" 1
246 1 35 PHE QD 1 37 ARG HG2 5.840 . 6.340 3.486 3.084 4.236 . 0 0 "[ . 1 . 2]" 1
247 1 35 PHE QD 1 37 ARG HG3 5.490 . 5.990 4.784 4.051 4.993 . 0 0 "[ . 1 . 2]" 1
248 1 35 PHE QD 1 69 PHE HA 5.800 . 6.300 4.366 3.794 5.136 . 0 0 "[ . 1 . 2]" 1
249 1 35 PHE QD 1 98 VAL MG1 6.360 . 6.860 3.802 3.017 4.718 . 0 0 "[ . 1 . 2]" 1
250 1 35 PHE QD 1 100 SER HA 5.870 . 6.370 3.476 2.812 4.877 . 0 0 "[ . 1 . 2]" 1
251 1 35 PHE QD 1 100 SER HB2 6.080 . 6.580 4.251 3.684 5.229 . 0 0 "[ . 1 . 2]" 1
252 1 35 PHE QD 1 100 SER HB3 5.960 . 6.460 4.693 3.434 5.310 . 0 0 "[ . 1 . 2]" 1
253 1 35 PHE N 1 96 GLU O 3.000 . 3.200 2.982 2.938 3.021 . 0 0 "[ . 1 . 2]" 1
254 1 35 PHE O 1 96 GLU H 2.000 . 2.300 2.100 1.997 2.257 . 0 0 "[ . 1 . 2]" 1
255 1 35 PHE O 1 96 GLU N 3.000 . 3.200 2.910 2.866 3.002 . 0 0 "[ . 1 . 2]" 1
256 1 36 VAL H 1 36 VAL HB 4.000 . 4.500 2.686 2.087 3.830 . 0 0 "[ . 1 . 2]" 1
257 1 36 VAL H 1 68 ALA H 4.140 . 4.640 3.308 3.119 3.479 . 0 0 "[ . 1 . 2]" 1
258 1 36 VAL H 1 68 ALA MB 6.030 . 6.530 3.498 3.289 3.702 . 0 0 "[ . 1 . 2]" 1
259 1 36 VAL H 1 68 ALA O 2.000 . 2.300 1.888 1.827 1.957 . 0 0 "[ . 1 . 2]" 1
260 1 36 VAL H 1 69 PHE HA 4.790 . 5.290 3.445 3.200 3.775 . 0 0 "[ . 1 . 2]" 1
261 1 36 VAL HA 1 37 ARG H 3.140 . 3.640 2.054 1.949 2.130 . 0 0 "[ . 1 . 2]" 1
262 1 36 VAL HA 1 37 ARG HG2 5.290 . 5.790 4.001 3.114 5.325 . 0 0 "[ . 1 . 2]" 1
263 1 36 VAL HA 1 37 ARG HG3 5.400 . 5.900 4.119 3.096 4.791 . 0 0 "[ . 1 . 2]" 1
264 1 36 VAL HA 1 39 PHE QE 6.170 . 6.670 4.013 3.229 4.771 . 0 0 "[ . 1 . 2]" 1
265 1 36 VAL HA 1 52 PHE HZ 5.500 . 6.000 5.420 5.092 5.735 . 0 0 "[ . 1 . 2]" 1
266 1 36 VAL HA 1 95 LEU MD1 6.610 . 7.110 2.656 2.199 3.618 . 0 0 "[ . 1 . 2]" 1
267 1 36 VAL HA 1 96 GLU H 4.900 . 5.400 2.878 2.511 3.081 . 0 0 "[ . 1 . 2]" 1
268 1 36 VAL HB 1 39 PHE QD 6.170 . 6.670 5.590 5.036 5.816 . 0 0 "[ . 1 . 2]" 1
269 1 36 VAL HB 1 39 PHE QE 4.310 . 4.810 3.684 3.236 3.913 . 0 0 "[ . 1 . 2]" 1
270 1 36 VAL HB 1 52 PHE HZ 5.500 . 6.000 3.558 3.082 4.264 . 0 0 "[ . 1 . 2]" 1
271 1 36 VAL HB 1 68 ALA H 5.230 . 5.730 4.183 3.617 5.299 . 0 0 "[ . 1 . 2]" 1
272 1 36 VAL MG1 1 37 ARG H 5.300 . 5.800 3.774 3.595 4.018 . 0 0 "[ . 1 . 2]" 1
273 1 36 VAL MG1 1 39 PHE QE 7.410 . 7.910 2.718 1.932 4.575 . 0 0 "[ . 1 . 2]" 1
274 1 36 VAL MG1 1 52 PHE HZ 6.150 . 6.650 2.488 2.113 2.929 . 0 0 "[ . 1 . 2]" 1
275 1 36 VAL MG1 1 68 ALA H 6.400 . 6.900 4.297 3.666 5.429 . 0 0 "[ . 1 . 2]" 1
276 1 36 VAL MG1 1 69 PHE HA 6.150 . 6.650 5.277 5.154 5.362 . 0 0 "[ . 1 . 2]" 1
277 1 36 VAL MG1 1 70 VAL H 5.880 . 6.380 4.770 4.576 4.927 . 0 0 "[ . 1 . 2]" 1
278 1 36 VAL MG2 1 37 ARG H 4.740 . 5.240 4.023 3.941 4.093 . 0 0 "[ . 1 . 2]" 1
279 1 36 VAL MG2 1 39 PHE QE 7.410 . 7.910 3.743 2.668 4.383 . 0 0 "[ . 1 . 2]" 1
280 1 36 VAL MG2 1 52 PHE HZ 6.610 . 7.110 1.986 1.925 2.036 . 0 0 "[ . 1 . 2]" 1
281 1 36 VAL MG2 1 70 VAL HB 5.100 . 5.600 4.148 3.952 4.287 . 0 0 "[ . 1 . 2]" 1
282 1 36 VAL MG2 1 70 VAL MG1 6.780 . 7.280 4.798 4.715 4.868 . 0 0 "[ . 1 . 2]" 1
283 1 36 VAL MG2 1 70 VAL MG2 7.930 . 8.430 3.166 2.765 3.432 . 0 0 "[ . 1 . 2]" 1
284 1 36 VAL MG2 1 95 LEU HA 5.760 . 6.260 4.080 3.523 4.862 . 0 0 "[ . 1 . 2]" 1
285 1 36 VAL MG2 1 95 LEU MD1 5.650 . 6.150 2.835 2.165 4.037 . 0 0 "[ . 1 . 2]" 1
286 1 36 VAL MG2 1 95 LEU MD2 5.780 . 6.280 4.093 3.993 4.164 . 0 0 "[ . 1 . 2]" 1
287 1 36 VAL MG2 1 96 GLU H 6.170 . 6.670 3.598 2.998 4.677 . 0 0 "[ . 1 . 2]" 1
288 1 36 VAL MG2 1 97 VAL HA 5.400 . 5.900 3.266 2.635 4.371 . 0 0 "[ . 1 . 2]" 1
289 1 36 VAL MG2 1 98 VAL H 6.270 . 6.770 4.978 4.492 5.820 . 0 0 "[ . 1 . 2]" 1
290 1 36 VAL N 1 68 ALA O 3.000 . 3.200 2.885 2.806 2.953 . 0 0 "[ . 1 . 2]" 1
291 1 36 VAL O 1 68 ALA H 2.000 . 2.300 1.914 1.843 2.006 . 0 0 "[ . 1 . 2]" 1
292 1 36 VAL O 1 68 ALA N 3.000 . 3.200 2.807 2.765 2.858 . 0 0 "[ . 1 . 2]" 1
293 1 37 ARG H 1 37 ARG HD2 5.360 . 5.860 4.562 3.565 5.183 . 0 0 "[ . 1 . 2]" 1
294 1 37 ARG H 1 37 ARG HD3 5.290 . 5.790 4.774 4.607 4.983 . 0 0 "[ . 1 . 2]" 1
295 1 37 ARG H 1 37 ARG HG2 4.700 . 5.200 2.812 2.341 3.952 . 0 0 "[ . 1 . 2]" 1
296 1 37 ARG H 1 37 ARG HG3 4.440 . 4.940 2.441 1.989 2.804 . 0 0 "[ . 1 . 2]" 1
297 1 37 ARG H 1 38 PRO HA 5.500 . 6.000 4.806 4.585 4.957 . 0 0 "[ . 1 . 2]" 1
298 1 37 ARG H 1 95 LEU MD1 6.080 . 6.580 3.184 2.932 3.579 . 0 0 "[ . 1 . 2]" 1
299 1 37 ARG H 1 96 GLU H 4.120 . 4.620 3.892 3.661 4.108 . 0 0 "[ . 1 . 2]" 1
300 1 37 ARG H 1 96 GLU HB2 5.500 . 6.000 5.428 5.230 5.592 . 0 0 "[ . 1 . 2]" 1
301 1 37 ARG HA 1 37 ARG HD3 5.500 . 6.000 4.912 4.422 5.462 . 0 0 "[ . 1 . 2]" 1
302 1 37 ARG HA 1 39 PHE H 3.990 . 4.490 3.661 3.202 3.914 . 0 0 "[ . 1 . 2]" 1
303 1 37 ARG HA 1 39 PHE QD 5.490 . 5.990 3.047 2.768 3.270 . 0 0 "[ . 1 . 2]" 1
304 1 37 ARG HA 1 39 PHE QE 6.020 . 6.520 3.436 2.589 3.985 . 0 0 "[ . 1 . 2]" 1
305 1 37 ARG HA 1 67 PHE HA 3.750 . 4.250 2.394 2.122 2.595 . 0 0 "[ . 1 . 2]" 1
306 1 37 ARG HA 1 67 PHE HB3 5.370 . 5.870 4.080 3.487 4.713 . 0 0 "[ . 1 . 2]" 1
307 1 37 ARG HA 1 67 PHE QD 6.170 . 6.670 3.391 2.314 4.187 . 0 0 "[ . 1 . 2]" 1
308 1 37 ARG HA 1 68 ALA H 4.920 . 5.420 3.380 3.130 3.611 . 0 0 "[ . 1 . 2]" 1
309 1 37 ARG HB2 1 37 ARG HD2 3.370 . 3.870 2.472 2.341 2.860 . 0 0 "[ . 1 . 2]" 1
310 1 37 ARG HB2 1 67 PHE HA 4.690 . 5.190 3.611 3.092 3.926 . 0 0 "[ . 1 . 2]" 1
311 1 37 ARG HB2 1 67 PHE QD 6.050 . 6.550 2.312 2.067 2.926 . 0 0 "[ . 1 . 2]" 1
312 1 37 ARG HB2 1 67 PHE QE 6.170 . 6.670 3.108 2.566 3.378 . 0 0 "[ . 1 . 2]" 1
313 1 37 ARG HB2 1 68 ALA H 4.850 . 5.350 4.883 4.654 4.995 . 0 0 "[ . 1 . 2]" 1
314 1 37 ARG HB3 1 37 ARG HD2 3.530 . 4.030 3.457 3.257 3.744 . 0 0 "[ . 1 . 2]" 1
315 1 37 ARG HB3 1 39 PHE QD 6.170 . 6.670 5.342 5.044 5.571 . 0 0 "[ . 1 . 2]" 1
316 1 37 ARG HB3 1 67 PHE HA 4.000 . 4.500 3.084 2.589 3.538 . 0 0 "[ . 1 . 2]" 1
317 1 37 ARG HB3 1 67 PHE QD 5.010 . 5.510 2.449 2.191 3.056 . 0 0 "[ . 1 . 2]" 1
318 1 37 ARG HD2 1 67 PHE QD 5.140 . 5.640 3.992 3.144 4.599 . 0 0 "[ . 1 . 2]" 1
319 1 37 ARG HD2 1 67 PHE QE 5.850 . 6.350 3.652 2.226 4.833 . 0 0 "[ . 1 . 2]" 1
320 1 37 ARG HD3 1 67 PHE QE 4.330 . 4.830 3.807 2.683 3.977 . 0 0 "[ . 1 . 2]" 1
321 1 37 ARG HG2 1 38 PRO QD 5.850 . 6.350 4.111 3.094 5.255 . 0 0 "[ . 1 . 2]" 1
322 1 37 ARG HG3 1 38 PRO HA 5.500 . 6.000 4.380 3.860 5.615 . 0 0 "[ . 1 . 2]" 1
323 1 37 ARG HG3 1 38 PRO QD 5.930 . 6.430 3.156 2.333 3.975 . 0 0 "[ . 1 . 2]" 1
324 1 38 PRO HA 1 39 PHE H 3.500 . 4.000 3.494 3.417 3.532 . 0 0 "[ . 1 . 2]" 1
325 1 38 PRO HA 1 39 PHE QD 6.170 . 6.670 5.207 5.017 5.363 . 0 0 "[ . 1 . 2]" 1
326 1 38 PRO HA 1 92 ASN H 5.500 . 6.000 5.063 4.419 5.371 . 0 0 "[ . 1 . 2]" 1
327 1 38 PRO HA 1 92 ASN HD21 5.150 . 5.650 4.839 3.187 5.576 . 0 0 "[ . 1 . 2]" 1
328 1 38 PRO HA 1 92 ASN HD22 5.500 . 6.000 3.805 2.860 4.585 . 0 0 "[ . 1 . 2]" 1
329 1 38 PRO HA 1 93 GLN HE21 5.230 . 5.730 3.022 2.157 4.913 . 0 0 "[ . 1 . 2]" 1
330 1 38 PRO HA 1 93 GLN HE22 5.080 . 5.580 3.675 3.081 5.227 . 0 0 "[ . 1 . 2]" 1
331 1 38 PRO HB2 1 39 PHE H 4.240 . 4.740 3.063 2.292 3.909 . 0 0 "[ . 1 . 2]" 1
332 1 38 PRO HB2 1 95 LEU MD1 6.440 . 6.940 3.769 2.920 4.274 . 0 0 "[ . 1 . 2]" 1
333 1 38 PRO HB3 1 39 PHE H 4.570 . 5.070 4.016 3.693 4.366 . 0 0 "[ . 1 . 2]" 1
334 1 38 PRO HB3 1 39 PHE QD 6.170 . 6.670 5.232 4.792 5.450 . 0 0 "[ . 1 . 2]" 1
335 1 38 PRO HB3 1 39 PHE QE 6.170 . 6.670 5.563 5.492 5.637 . 0 0 "[ . 1 . 2]" 1
336 1 38 PRO HB3 1 90 PHE QD 6.170 . 6.670 4.774 4.231 5.342 . 0 0 "[ . 1 . 2]" 1
337 1 38 PRO HB3 1 91 ALA MB 5.260 . 5.760 3.652 2.513 4.419 . 0 0 "[ . 1 . 2]" 1
338 1 38 PRO HB3 1 92 ASN HD21 5.360 . 5.860 4.890 3.321 5.970 0.110 2 0 "[ . 1 . 2]" 1
339 1 38 PRO HB3 1 93 GLN HA 5.500 . 6.000 4.805 4.315 5.139 . 0 0 "[ . 1 . 2]" 1
340 1 38 PRO QD 1 39 PHE H 6.170 . 6.670 2.750 2.388 3.239 . 0 0 "[ . 1 . 2]" 1
341 1 38 PRO QD 1 91 ALA MB 7.410 . 7.910 4.884 4.462 5.340 . 0 0 "[ . 1 . 2]" 1
342 1 38 PRO QD 1 95 LEU HB2 6.130 . 6.630 5.249 5.003 5.410 . 0 0 "[ . 1 . 2]" 1
343 1 38 PRO QD 1 95 LEU MD1 5.270 . 5.770 2.053 1.999 2.192 . 0 0 "[ . 1 . 2]" 1
344 1 38 PRO QD 1 95 LEU MD2 7.410 . 7.910 3.995 3.769 4.255 . 0 0 "[ . 1 . 2]" 1
345 1 38 PRO QD 1 95 LEU HG 6.010 . 6.510 4.295 3.592 4.723 . 0 0 "[ . 1 . 2]" 1
346 1 38 PRO QD 1 96 GLU H 4.910 . 5.410 4.311 3.738 4.546 . 0 0 "[ . 1 . 2]" 1
347 1 38 PRO QG 1 39 PHE H 6.170 . 6.670 3.106 2.111 4.309 . 0 0 "[ . 1 . 2]" 1
348 1 38 PRO QG 1 93 GLN HG3 5.530 . 6.030 3.234 2.067 4.346 . 0 0 "[ . 1 . 2]" 1
349 1 38 PRO QG 1 95 LEU HA 5.920 . 6.420 3.737 2.582 4.353 . 0 0 "[ . 1 . 2]" 1
350 1 38 PRO QG 1 95 LEU MD1 7.130 . 7.630 1.966 1.881 2.073 . 0 0 "[ . 1 . 2]" 1
351 1 38 PRO QG 1 95 LEU MD2 4.740 . 5.240 3.181 2.707 3.708 . 0 0 "[ . 1 . 2]" 1
352 1 39 PHE H 1 39 PHE HB2 3.970 . 4.470 3.059 2.820 3.263 . 0 0 "[ . 1 . 2]" 1
353 1 39 PHE H 1 39 PHE HB3 4.090 . 4.590 3.416 3.100 3.561 . 0 0 "[ . 1 . 2]" 1
354 1 39 PHE H 1 43 VAL HB 4.940 . 5.440 4.835 4.669 4.943 . 0 0 "[ . 1 . 2]" 1
355 1 39 PHE H 1 43 VAL MG1 5.930 . 6.430 4.204 4.029 4.476 . 0 0 "[ . 1 . 2]" 1
356 1 39 PHE HA 1 40 PRO HB3 5.500 . 6.000 5.159 4.896 5.615 . 0 0 "[ . 1 . 2]" 1
357 1 39 PHE HA 1 43 VAL MG1 5.870 . 6.370 4.913 4.777 4.973 . 0 0 "[ . 1 . 2]" 1
358 1 39 PHE HA 1 90 PHE QD 6.170 . 6.670 4.677 3.945 5.475 . 0 0 "[ . 1 . 2]" 1
359 1 39 PHE HA 1 91 ALA MB 5.880 . 6.380 2.903 2.346 3.276 . 0 0 "[ . 1 . 2]" 1
360 1 39 PHE HB2 1 43 VAL HA 4.840 . 5.340 4.702 4.451 4.902 . 0 0 "[ . 1 . 2]" 1
361 1 39 PHE HB2 1 43 VAL HB 3.340 . 3.840 2.492 2.261 2.808 . 0 0 "[ . 1 . 2]" 1
362 1 39 PHE HB2 1 43 VAL MG1 5.060 . 5.560 2.452 2.255 2.594 . 0 0 "[ . 1 . 2]" 1
363 1 39 PHE HB2 1 43 VAL MG2 5.860 . 6.360 3.814 3.532 4.103 . 0 0 "[ . 1 . 2]" 1
364 1 39 PHE HB2 1 66 GLY HA3 4.980 . 5.480 4.969 4.480 5.134 . 0 0 "[ . 1 . 2]" 1
365 1 39 PHE HB3 1 43 VAL HA 5.500 . 6.000 4.717 4.446 5.012 . 0 0 "[ . 1 . 2]" 1
366 1 39 PHE HB3 1 43 VAL MG1 6.050 . 6.550 3.636 3.252 3.900 . 0 0 "[ . 1 . 2]" 1
367 1 39 PHE HB3 1 43 VAL MG2 5.400 . 5.900 4.125 3.714 4.527 . 0 0 "[ . 1 . 2]" 1
368 1 39 PHE HB3 1 91 ALA MB 6.510 . 7.010 3.633 3.034 3.974 . 0 0 "[ . 1 . 2]" 1
369 1 39 PHE QD 1 40 PRO HA 6.170 . 6.670 5.664 5.421 5.836 . 0 0 "[ . 1 . 2]" 1
370 1 39 PHE QD 1 43 VAL HB 5.780 . 6.280 3.194 2.875 3.380 . 0 0 "[ . 1 . 2]" 1
371 1 39 PHE QD 1 43 VAL MG1 6.230 . 6.730 2.324 2.194 2.749 . 0 0 "[ . 1 . 2]" 1
372 1 39 PHE QD 1 43 VAL MG2 5.700 . 6.200 3.241 3.004 3.433 . 0 0 "[ . 1 . 2]" 1
373 1 39 PHE QD 1 51 ILE MD 6.030 . 6.530 4.300 3.784 4.502 . 0 0 "[ . 1 . 2]" 1
374 1 39 PHE QD 1 66 GLY HA3 6.170 . 6.670 5.052 4.297 5.544 . 0 0 "[ . 1 . 2]" 1
375 1 39 PHE QD 1 67 PHE HA 6.170 . 6.670 3.845 3.608 4.095 . 0 0 "[ . 1 . 2]" 1
376 1 39 PHE QD 1 68 ALA MB 5.800 . 6.300 4.203 3.882 4.344 . 0 0 "[ . 1 . 2]" 1
377 1 39 PHE QD 1 90 PHE HB2 6.170 . 6.670 5.604 5.524 5.666 . 0 0 "[ . 1 . 2]" 1
378 1 39 PHE QD 1 90 PHE QD 6.390 . 6.890 2.459 2.184 2.786 . 0 0 "[ . 1 . 2]" 1
379 1 39 PHE QD 1 91 ALA HA 6.170 . 6.670 5.392 5.060 5.546 . 0 0 "[ . 1 . 2]" 1
380 1 39 PHE QD 1 91 ALA MB 7.410 . 7.910 2.986 2.711 3.231 . 0 0 "[ . 1 . 2]" 1
381 1 39 PHE QD 1 95 LEU MD1 6.200 . 6.700 4.353 4.161 4.504 . 0 0 "[ . 1 . 2]" 1
382 1 39 PHE QE 1 43 VAL MG1 7.410 . 7.910 3.305 2.897 3.973 . 0 0 "[ . 1 . 2]" 1
383 1 39 PHE QE 1 48 LEU MD2 6.340 . 6.840 3.597 3.132 3.983 . 0 0 "[ . 1 . 2]" 1
384 1 39 PHE QE 1 48 LEU HG 6.170 . 6.670 5.164 4.559 5.537 . 0 0 "[ . 1 . 2]" 1
385 1 39 PHE QE 1 51 ILE MD 5.940 . 6.440 2.677 2.317 3.206 . 0 0 "[ . 1 . 2]" 1
386 1 39 PHE QE 1 51 ILE MG 7.180 . 7.680 4.633 4.304 4.859 . 0 0 "[ . 1 . 2]" 1
387 1 39 PHE QE 1 67 PHE HA 5.230 . 5.730 4.286 3.157 4.730 . 0 0 "[ . 1 . 2]" 1
388 1 39 PHE QE 1 68 ALA H 5.350 . 5.850 3.839 2.930 4.376 . 0 0 "[ . 1 . 2]" 1
389 1 39 PHE QE 1 68 ALA MB 5.570 . 6.070 3.005 2.291 3.743 . 0 0 "[ . 1 . 2]" 1
390 1 39 PHE QE 1 90 PHE HB2 6.170 . 6.670 4.337 4.168 4.501 . 0 0 "[ . 1 . 2]" 1
391 1 39 PHE QE 1 90 PHE QD 6.690 . 7.190 2.846 2.588 3.035 . 0 0 "[ . 1 . 2]" 1
392 1 39 PHE QE 1 91 ALA MB 7.410 . 7.910 4.404 4.209 4.560 . 0 0 "[ . 1 . 2]" 1
393 1 39 PHE QE 1 95 LEU MD1 6.030 . 6.530 3.091 2.671 3.463 . 0 0 "[ . 1 . 2]" 1
394 1 40 PRO HB3 1 41 LEU HB2 5.500 . 6.000 5.238 4.328 5.588 . 0 0 "[ . 1 . 2]" 1
395 1 40 PRO HB3 1 41 LEU MD1 6.350 . 6.850 4.557 3.458 5.318 . 0 0 "[ . 1 . 2]" 1
396 1 40 PRO HB3 1 42 ASP H 4.460 . 4.960 4.452 4.304 4.530 . 0 0 "[ . 1 . 2]" 1
397 1 41 LEU H 1 41 LEU HG 4.400 . 4.900 3.693 3.512 3.824 . 0 0 "[ . 1 . 2]" 1
398 1 41 LEU H 1 42 ASP H 5.300 . 5.800 2.914 2.703 3.318 . 0 0 "[ . 1 . 2]" 1
399 1 41 LEU HA 1 41 LEU MD1 3.750 . 4.250 2.586 2.183 2.970 . 0 0 "[ . 1 . 2]" 1
400 1 41 LEU HA 1 41 LEU HG 3.990 . 4.490 3.097 2.390 3.917 . 0 0 "[ . 1 . 2]" 1
401 1 41 LEU HA 1 43 VAL H 4.900 . 5.400 3.845 3.522 4.320 . 0 0 "[ . 1 . 2]" 1
402 1 41 LEU HA 1 43 VAL MG1 6.610 . 7.110 3.777 3.355 4.178 . 0 0 "[ . 1 . 2]" 1
403 1 41 LEU HB2 1 42 ASP H 4.810 . 5.310 3.305 2.819 4.322 . 0 0 "[ . 1 . 2]" 1
404 1 41 LEU HB3 1 42 ASP H 4.580 . 5.080 4.020 3.751 4.507 . 0 0 "[ . 1 . 2]" 1
405 1 41 LEU HB3 1 66 GLY H 5.500 . 6.000 5.220 4.355 5.602 . 0 0 "[ . 1 . 2]" 1
406 1 41 LEU MD1 1 42 ASP H 6.270 . 6.770 4.471 4.190 4.767 . 0 0 "[ . 1 . 2]" 1
407 1 41 LEU MD1 1 65 ASN H 6.610 . 7.110 4.864 4.270 5.525 . 0 0 "[ . 1 . 2]" 1
408 1 41 LEU MD1 1 65 ASN HB2 5.090 . 5.590 3.605 2.577 4.199 . 0 0 "[ . 1 . 2]" 1
409 1 41 LEU MD1 1 65 ASN HB3 5.080 . 5.580 2.727 2.094 3.439 . 0 0 "[ . 1 . 2]" 1
410 1 41 LEU MD1 1 66 GLY H 4.860 . 5.360 3.282 2.526 4.052 . 0 0 "[ . 1 . 2]" 1
411 1 41 LEU MD1 1 66 GLY HA2 5.690 . 6.190 3.479 2.951 3.907 . 0 0 "[ . 1 . 2]" 1
412 1 41 LEU MD1 1 66 GLY HA3 4.430 . 4.930 3.327 2.579 3.714 . 0 0 "[ . 1 . 2]" 1
413 1 41 LEU MD2 1 42 ASP H 6.610 . 7.110 4.643 3.687 5.613 . 0 0 "[ . 1 . 2]" 1
414 1 41 LEU MD2 1 65 ASN HB3 6.260 . 6.760 3.890 2.702 5.226 . 0 0 "[ . 1 . 2]" 1
415 1 42 ASP H 1 42 ASP HB2 3.770 . 4.270 2.677 2.442 3.807 . 0 0 "[ . 1 . 2]" 1
416 1 42 ASP H 1 42 ASP HB3 4.160 . 4.660 3.470 2.728 3.561 . 0 0 "[ . 1 . 2]" 1
417 1 42 ASP H 1 43 VAL H 3.700 . 4.200 2.907 2.090 3.444 . 0 0 "[ . 1 . 2]" 1
418 1 42 ASP H 1 43 VAL MG1 6.280 . 6.780 4.309 3.242 4.599 . 0 0 "[ . 1 . 2]" 1
419 1 42 ASP HA 1 44 GLN HE21 5.000 . 5.500 3.648 2.483 5.029 . 0 0 "[ . 1 . 2]" 1
420 1 42 ASP HA 1 44 GLN HE22 4.840 . 5.340 3.986 2.924 5.133 . 0 0 "[ . 1 . 2]" 1
421 1 42 ASP HB2 1 43 VAL H 4.350 . 4.850 3.450 2.914 4.321 . 0 0 "[ . 1 . 2]" 1
422 1 42 ASP HB2 1 43 VAL HA 5.430 . 5.930 4.654 4.382 5.191 . 0 0 "[ . 1 . 2]" 1
423 1 42 ASP HB2 1 43 VAL MG1 6.610 . 7.110 5.061 4.583 5.640 . 0 0 "[ . 1 . 2]" 1
424 1 42 ASP HB3 1 43 VAL H 4.430 . 4.930 4.184 3.887 4.500 . 0 0 "[ . 1 . 2]" 1
425 1 43 VAL H 1 43 VAL HB 3.100 . 3.600 2.730 2.592 3.206 . 0 0 "[ . 1 . 2]" 1
426 1 43 VAL H 1 43 VAL MG1 4.040 . 4.540 2.197 1.994 2.495 . 0 0 "[ . 1 . 2]" 1
427 1 43 VAL H 1 44 GLN H 4.740 . 5.240 4.635 4.394 4.719 . 0 0 "[ . 1 . 2]" 1
428 1 43 VAL HA 1 44 GLN H 2.810 . 3.310 2.231 2.149 2.342 . 0 0 "[ . 1 . 2]" 1
429 1 43 VAL HA 1 44 GLN HE21 5.500 . 6.000 3.980 3.374 4.925 . 0 0 "[ . 1 . 2]" 1
430 1 43 VAL HA 1 44 GLN QG 5.290 . 5.790 3.827 3.366 4.766 . 0 0 "[ . 1 . 2]" 1
431 1 43 VAL HA 1 47 GLU HB3 4.400 . 4.900 3.652 3.314 3.879 . 0 0 "[ . 1 . 2]" 1
432 1 43 VAL HB 1 48 LEU MD2 6.610 . 7.110 5.113 4.756 5.538 . 0 0 "[ . 1 . 2]" 1
433 1 43 VAL MG1 1 44 GLN H 5.580 . 6.080 3.729 3.358 3.942 . 0 0 "[ . 1 . 2]" 1
434 1 43 VAL MG1 1 44 GLN HE22 6.610 . 7.110 5.441 4.588 7.034 . 0 0 "[ . 1 . 2]" 1
435 1 43 VAL MG1 1 44 GLN QG 7.410 . 7.910 4.882 4.329 5.498 . 0 0 "[ . 1 . 2]" 1
436 1 43 VAL MG1 1 47 GLU HB3 6.460 . 6.960 5.205 4.607 5.439 . 0 0 "[ . 1 . 2]" 1
437 1 43 VAL MG1 1 47 GLU HG2 6.610 . 7.110 5.405 5.095 6.436 . 0 0 "[ . 1 . 2]" 1
438 1 43 VAL MG1 1 48 LEU MD2 6.420 . 6.920 3.881 3.722 4.139 . 0 0 "[ . 1 . 2]" 1
439 1 43 VAL MG1 1 48 LEU HG 6.610 . 7.110 4.393 4.202 4.604 . 0 0 "[ . 1 . 2]" 1
440 1 43 VAL MG1 1 66 GLY H 6.610 . 7.110 4.103 3.391 5.300 . 0 0 "[ . 1 . 2]" 1
441 1 43 VAL MG1 1 66 GLY HA3 6.570 . 7.070 4.352 3.749 4.775 . 0 0 "[ . 1 . 2]" 1
442 1 43 VAL MG2 1 44 GLN H 4.320 . 4.820 2.272 2.035 2.474 . 0 0 "[ . 1 . 2]" 1
443 1 43 VAL MG2 1 44 GLN QG 7.410 . 7.910 4.577 4.119 4.916 . 0 0 "[ . 1 . 2]" 1
444 1 43 VAL MG2 1 47 GLU H 6.140 . 6.640 3.946 3.878 4.025 . 0 0 "[ . 1 . 2]" 1
445 1 43 VAL MG2 1 47 GLU HB2 5.190 . 5.690 2.399 2.213 2.988 . 0 0 "[ . 1 . 2]" 1
446 1 43 VAL MG2 1 47 GLU HB3 4.820 . 5.320 2.431 2.054 2.685 . 0 0 "[ . 1 . 2]" 1
447 1 43 VAL MG2 1 47 GLU HG2 5.990 . 6.490 3.367 2.931 4.063 . 0 0 "[ . 1 . 2]" 1
448 1 43 VAL MG2 1 48 LEU H 5.880 . 6.380 3.431 3.390 3.493 . 0 0 "[ . 1 . 2]" 1
449 1 43 VAL MG2 1 48 LEU HA 5.510 . 6.010 4.284 4.164 4.418 . 0 0 "[ . 1 . 2]" 1
450 1 43 VAL MG2 1 48 LEU MD2 5.250 . 5.750 2.703 2.460 3.024 . 0 0 "[ . 1 . 2]" 1
451 1 43 VAL MG2 1 49 ASN H 6.610 . 7.110 5.608 5.564 5.654 . 0 0 "[ . 1 . 2]" 1
452 1 44 GLN H 1 44 GLN QG 4.400 . 4.900 3.158 2.600 3.930 . 0 0 "[ . 1 . 2]" 1
453 1 44 GLN H 1 45 GLU H 5.500 . 6.000 4.389 4.318 4.425 . 0 0 "[ . 1 . 2]" 1
454 1 44 GLN H 1 47 GLU H 4.110 . 4.610 3.031 2.921 3.258 . 0 0 "[ . 1 . 2]" 1
455 1 44 GLN H 1 47 GLU HB2 4.600 . 5.100 1.963 1.876 2.107 . 0 0 "[ . 1 . 2]" 1
456 1 44 GLN H 1 47 GLU HB3 3.360 . 3.860 3.392 2.463 3.521 . 0 0 "[ . 1 . 2]" 1
457 1 44 GLN H 1 47 GLU HG2 4.730 . 5.230 3.255 2.276 4.713 . 0 0 "[ . 1 . 2]" 1
458 1 44 GLN H 1 47 GLU HG3 4.750 . 5.250 4.153 2.432 4.747 . 0 0 "[ . 1 . 2]" 1
459 1 44 GLN H 1 48 LEU MD1 6.610 . 7.110 3.877 3.192 4.893 . 0 0 "[ . 1 . 2]" 1
460 1 44 GLN H 1 48 LEU MD2 5.820 . 6.320 4.907 4.847 4.961 . 0 0 "[ . 1 . 2]" 1
461 1 44 GLN H 1 48 LEU HG 5.230 . 5.730 3.735 3.642 3.957 . 0 0 "[ . 1 . 2]" 1
462 1 44 GLN HA 1 48 LEU MD2 6.610 . 7.110 5.388 4.625 5.639 . 0 0 "[ . 1 . 2]" 1
463 1 44 GLN HA 1 48 LEU HG 5.220 . 5.720 4.749 4.072 5.216 . 0 0 "[ . 1 . 2]" 1
464 1 44 GLN HA 1 63 ILE MD 5.010 . 5.510 2.462 2.102 2.715 . 0 0 "[ . 1 . 2]" 1
465 1 44 GLN QG 1 46 SER QB 6.930 . 7.430 4.544 2.762 5.548 . 0 0 "[ . 1 . 2]" 1
466 1 44 GLN QG 1 47 GLU H 5.920 . 6.420 4.433 3.063 5.348 . 0 0 "[ . 1 . 2]" 1
467 1 44 GLN O 1 48 LEU H 2.000 . 2.300 2.045 2.003 2.101 . 0 0 "[ . 1 . 2]" 1
468 1 44 GLN O 1 48 LEU N 3.000 . 3.200 3.049 3.007 3.109 . 0 0 "[ . 1 . 2]" 1
469 1 45 GLU H 1 63 ILE MD 6.610 . 7.110 2.643 2.215 2.866 . 0 0 "[ . 1 . 2]" 1
470 1 45 GLU HA 1 47 GLU H 4.920 . 5.420 4.039 3.904 4.206 . 0 0 "[ . 1 . 2]" 1
471 1 45 GLU HA 1 48 LEU H 4.110 . 4.610 3.407 3.219 3.577 . 0 0 "[ . 1 . 2]" 1
472 1 45 GLU HA 1 48 LEU HB2 3.800 . 4.300 2.316 2.182 2.401 . 0 0 "[ . 1 . 2]" 1
473 1 45 GLU HA 1 48 LEU HB3 4.800 . 5.300 3.841 3.717 3.892 . 0 0 "[ . 1 . 2]" 1
474 1 45 GLU HA 1 48 LEU MD1 6.220 . 6.720 2.112 2.003 2.367 . 0 0 "[ . 1 . 2]" 1
475 1 45 GLU HA 1 48 LEU MD2 5.310 . 5.810 4.475 4.382 4.529 . 0 0 "[ . 1 . 2]" 1
476 1 45 GLU HA 1 48 LEU HG 4.770 . 5.270 3.905 3.206 4.406 . 0 0 "[ . 1 . 2]" 1
477 1 45 GLU HA 1 49 ASN H 4.710 . 5.210 3.701 3.556 3.796 . 0 0 "[ . 1 . 2]" 1
478 1 45 GLU HA 1 49 ASN HD22 4.920 . 5.420 4.944 4.546 5.281 . 0 0 "[ . 1 . 2]" 1
479 1 45 GLU HA 1 61 VAL HB 5.500 . 6.000 4.614 4.016 5.196 . 0 0 "[ . 1 . 2]" 1
480 1 45 GLU HA 1 61 VAL MG2 6.610 . 7.110 4.070 3.454 4.428 . 0 0 "[ . 1 . 2]" 1
481 1 45 GLU HA 1 63 ILE MD 4.130 . 4.630 2.661 2.537 2.870 . 0 0 "[ . 1 . 2]" 1
482 1 45 GLU HA 1 63 ILE QG 6.170 . 6.670 4.389 4.000 4.736 . 0 0 "[ . 1 . 2]" 1
483 1 45 GLU HA 1 63 ILE MG 6.570 . 7.070 5.230 5.043 5.499 . 0 0 "[ . 1 . 2]" 1
484 1 45 GLU HB2 1 49 ASN HD22 5.500 . 6.000 4.707 3.678 5.594 . 0 0 "[ . 1 . 2]" 1
485 1 45 GLU HB2 1 61 VAL MG1 6.290 . 6.790 3.209 2.423 4.512 . 0 0 "[ . 1 . 2]" 1
486 1 45 GLU HB2 1 63 ILE MD 5.750 . 6.250 3.278 2.573 3.989 . 0 0 "[ . 1 . 2]" 1
487 1 45 GLU HB3 1 63 ILE MD 5.300 . 5.800 3.484 2.378 4.440 . 0 0 "[ . 1 . 2]" 1
488 1 45 GLU QG 1 48 LEU H 6.170 . 6.670 5.339 4.806 5.603 . 0 0 "[ . 1 . 2]" 1
489 1 45 GLU QG 1 49 ASN H 5.840 . 6.340 4.590 3.909 5.251 . 0 0 "[ . 1 . 2]" 1
490 1 45 GLU QG 1 49 ASN HD21 5.510 . 6.010 3.016 2.203 4.075 . 0 0 "[ . 1 . 2]" 1
491 1 45 GLU QG 1 49 ASN HD22 5.520 . 6.020 3.463 2.515 4.653 . 0 0 "[ . 1 . 2]" 1
492 1 45 GLU QG 1 61 VAL MG1 5.370 . 5.870 3.297 2.194 4.087 . 0 0 "[ . 1 . 2]" 1
493 1 45 GLU QG 1 61 VAL MG2 7.130 . 7.630 3.622 2.224 5.108 . 0 0 "[ . 1 . 2]" 1
494 1 45 GLU QG 1 63 ILE MD 6.430 . 6.930 3.686 2.315 4.548 . 0 0 "[ . 1 . 2]" 1
495 1 45 GLU O 1 49 ASN H 2.000 . 2.300 1.887 1.791 2.000 0.009 14 0 "[ . 1 . 2]" 1
496 1 45 GLU O 1 49 ASN N 3.000 . 3.200 2.742 2.693 2.817 . 0 0 "[ . 1 . 2]" 1
497 1 46 SER HA 1 49 ASN HB2 3.680 . 4.180 2.165 2.054 2.280 . 0 0 "[ . 1 . 2]" 1
498 1 46 SER HA 1 49 ASN HB3 3.770 . 4.270 3.650 3.503 3.766 . 0 0 "[ . 1 . 2]" 1
499 1 46 SER HA 1 49 ASN HD21 4.550 . 5.050 3.353 3.182 3.558 . 0 0 "[ . 1 . 2]" 1
500 1 46 SER HA 1 49 ASN HD22 4.150 . 4.650 4.597 4.502 4.673 0.023 7 0 "[ . 1 . 2]" 1
501 1 46 SER QB 1 47 GLU H 5.190 . 5.690 3.421 2.924 3.681 . 0 0 "[ . 1 . 2]" 1
502 1 46 SER QB 1 49 ASN HB2 5.100 . 5.600 3.958 3.870 4.148 . 0 0 "[ . 1 . 2]" 1
503 1 46 SER QB 1 49 ASN HB3 5.860 . 6.360 5.015 4.845 5.248 . 0 0 "[ . 1 . 2]" 1
504 1 46 SER QB 1 49 ASN HD22 6.040 . 6.540 6.065 5.892 6.429 . 0 0 "[ . 1 . 2]" 1
505 1 46 SER O 1 50 GLU H 2.000 . 2.300 2.100 2.064 2.123 . 0 0 "[ . 1 . 2]" 1
506 1 46 SER O 1 50 GLU N 3.000 . 3.200 3.038 3.021 3.058 . 0 0 "[ . 1 . 2]" 1
507 1 47 GLU H 1 47 GLU HB2 3.740 . 4.240 2.096 1.941 2.278 . 0 0 "[ . 1 . 2]" 1
508 1 47 GLU H 1 47 GLU HB3 3.200 . 3.700 3.339 2.700 3.466 . 0 0 "[ . 1 . 2]" 1
509 1 47 GLU H 1 47 GLU HG2 3.890 . 4.390 3.844 2.469 4.103 . 0 0 "[ . 1 . 2]" 1
510 1 47 GLU H 1 47 GLU HG3 3.940 . 4.440 3.938 3.418 4.213 . 0 0 "[ . 1 . 2]" 1
511 1 47 GLU H 1 48 LEU H 3.450 . 3.950 2.108 2.063 2.165 . 0 0 "[ . 1 . 2]" 1
512 1 47 GLU H 1 48 LEU HB2 5.190 . 5.690 4.115 4.038 4.226 . 0 0 "[ . 1 . 2]" 1
513 1 47 GLU H 1 48 LEU MD2 6.610 . 7.110 5.247 5.020 5.436 . 0 0 "[ . 1 . 2]" 1
514 1 47 GLU H 1 49 ASN H 4.310 . 4.810 3.401 3.313 3.454 . 0 0 "[ . 1 . 2]" 1
515 1 47 GLU H 1 49 ASN HB2 5.500 . 6.000 4.533 4.399 4.588 . 0 0 "[ . 1 . 2]" 1
516 1 47 GLU HA 1 47 GLU HG2 3.760 . 4.260 3.502 2.189 3.708 . 0 0 "[ . 1 . 2]" 1
517 1 47 GLU HA 1 47 GLU HG3 3.710 . 4.210 2.682 2.310 3.798 . 0 0 "[ . 1 . 2]" 1
518 1 47 GLU HA 1 48 LEU HG 5.500 . 6.000 5.271 5.094 5.534 . 0 0 "[ . 1 . 2]" 1
519 1 47 GLU HA 1 50 GLU H 3.990 . 4.490 3.202 3.035 3.497 . 0 0 "[ . 1 . 2]" 1
520 1 47 GLU HA 1 51 ILE H 5.110 . 5.610 4.308 4.195 4.540 . 0 0 "[ . 1 . 2]" 1
521 1 47 GLU HA 1 51 ILE MD 6.610 . 7.110 4.283 4.075 4.624 . 0 0 "[ . 1 . 2]" 1
522 1 47 GLU HB2 1 48 LEU H 4.500 . 5.000 2.586 2.331 3.026 . 0 0 "[ . 1 . 2]" 1
523 1 47 GLU HB2 1 48 LEU MD1 5.900 . 6.400 4.276 3.835 4.951 . 0 0 "[ . 1 . 2]" 1
524 1 47 GLU HB2 1 48 LEU MD2 6.610 . 7.110 4.671 4.172 5.231 . 0 0 "[ . 1 . 2]" 1
525 1 47 GLU HB2 1 48 LEU HG 4.740 . 5.240 3.389 2.806 3.960 . 0 0 "[ . 1 . 2]" 1
526 1 47 GLU HB3 1 48 LEU H 4.210 . 4.710 3.247 2.299 3.446 . 0 0 "[ . 1 . 2]" 1
527 1 47 GLU HB3 1 48 LEU MD2 5.600 . 6.100 4.608 3.933 4.757 . 0 0 "[ . 1 . 2]" 1
528 1 47 GLU HB3 1 48 LEU HG 5.500 . 6.000 3.811 2.649 4.385 . 0 0 "[ . 1 . 2]" 1
529 1 47 GLU HB3 1 49 ASN H 5.390 . 5.890 5.323 4.748 5.441 . 0 0 "[ . 1 . 2]" 1
530 1 47 GLU HB3 1 51 ILE MD 6.610 . 7.110 3.296 3.035 4.032 . 0 0 "[ . 1 . 2]" 1
531 1 47 GLU O 1 51 ILE H 2.000 . 2.300 2.085 2.052 2.133 . 0 0 "[ . 1 . 2]" 1
532 1 47 GLU O 1 51 ILE N 3.000 . 3.200 3.028 2.973 3.091 . 0 0 "[ . 1 . 2]" 1
533 1 48 LEU H 1 48 LEU HB2 3.400 . 3.900 2.409 2.345 2.487 . 0 0 "[ . 1 . 2]" 1
534 1 48 LEU H 1 48 LEU HB3 3.680 . 4.180 3.481 3.457 3.515 . 0 0 "[ . 1 . 2]" 1
535 1 48 LEU H 1 48 LEU MD2 4.840 . 5.340 3.635 3.423 3.824 . 0 0 "[ . 1 . 2]" 1
536 1 48 LEU H 1 48 LEU HG 3.930 . 4.430 2.238 2.133 2.409 . 0 0 "[ . 1 . 2]" 1
537 1 48 LEU H 1 49 ASN H 3.310 . 3.810 2.619 2.567 2.672 . 0 0 "[ . 1 . 2]" 1
538 1 48 LEU H 1 49 ASN HA 5.260 . 5.760 5.288 5.265 5.308 . 0 0 "[ . 1 . 2]" 1
539 1 48 LEU H 1 49 ASN HB2 4.730 . 5.230 4.653 4.560 4.731 . 0 0 "[ . 1 . 2]" 1
540 1 48 LEU H 1 50 GLU H 4.840 . 5.340 4.224 4.143 4.303 . 0 0 "[ . 1 . 2]" 1
541 1 48 LEU H 1 63 ILE MD 6.200 . 6.700 4.528 4.231 4.689 . 0 0 "[ . 1 . 2]" 1
542 1 48 LEU HA 1 48 LEU HG 3.760 . 4.260 2.909 2.640 3.217 . 0 0 "[ . 1 . 2]" 1
543 1 48 LEU HA 1 51 ILE HB 3.930 . 4.430 2.488 2.180 2.666 . 0 0 "[ . 1 . 2]" 1
544 1 48 LEU HA 1 51 ILE MD 4.680 . 5.180 2.838 2.424 3.099 . 0 0 "[ . 1 . 2]" 1
545 1 48 LEU HA 1 51 ILE MG 5.780 . 6.280 3.827 3.621 3.974 . 0 0 "[ . 1 . 2]" 1
546 1 48 LEU HA 1 52 PHE H 4.560 . 5.060 3.568 3.446 3.779 . 0 0 "[ . 1 . 2]" 1
547 1 48 LEU HA 1 52 PHE HB2 5.500 . 6.000 4.238 4.132 4.630 . 0 0 "[ . 1 . 2]" 1
548 1 48 LEU HA 1 52 PHE QD 4.820 . 5.320 2.418 2.199 3.023 . 0 0 "[ . 1 . 2]" 1
549 1 48 LEU HA 1 52 PHE QE 5.420 . 5.920 2.976 2.781 3.233 . 0 0 "[ . 1 . 2]" 1
550 1 48 LEU HA 1 58 MET ME 6.510 . 7.010 3.991 3.686 4.318 . 0 0 "[ . 1 . 2]" 1
551 1 48 LEU HB2 1 49 ASN H 3.770 . 4.270 2.743 2.619 2.859 . 0 0 "[ . 1 . 2]" 1
552 1 48 LEU HB2 1 49 ASN HA 5.500 . 6.000 4.587 4.428 4.733 . 0 0 "[ . 1 . 2]" 1
553 1 48 LEU HB2 1 49 ASN HD22 5.250 . 5.750 5.312 5.005 5.618 . 0 0 "[ . 1 . 2]" 1
554 1 48 LEU HB2 1 52 PHE QD 5.650 . 6.150 4.372 3.533 4.734 . 0 0 "[ . 1 . 2]" 1
555 1 48 LEU HB2 1 63 ILE MD 6.320 . 6.820 3.723 3.474 3.901 . 0 0 "[ . 1 . 2]" 1
556 1 48 LEU HB2 1 70 VAL MG1 5.270 . 5.770 4.480 4.143 4.900 . 0 0 "[ . 1 . 2]" 1
557 1 48 LEU HB3 1 49 ASN H 4.030 . 4.530 3.748 3.658 3.847 . 0 0 "[ . 1 . 2]" 1
558 1 48 LEU HB3 1 51 ILE MD 6.610 . 7.110 4.899 4.353 5.189 . 0 0 "[ . 1 . 2]" 1
559 1 48 LEU HB3 1 52 PHE QD 5.300 . 5.800 3.104 2.142 3.549 . 0 0 "[ . 1 . 2]" 1
560 1 48 LEU HB3 1 52 PHE HZ 5.500 . 6.000 4.814 4.604 5.201 . 0 0 "[ . 1 . 2]" 1
561 1 48 LEU HB3 1 63 ILE MD 6.610 . 7.110 4.420 4.140 4.644 . 0 0 "[ . 1 . 2]" 1
562 1 48 LEU HB3 1 70 VAL MG1 6.080 . 6.580 3.427 3.237 3.711 . 0 0 "[ . 1 . 2]" 1
563 1 48 LEU MD1 1 49 ASN H 6.530 . 7.030 4.358 4.226 4.488 . 0 0 "[ . 1 . 2]" 1
564 1 48 LEU MD1 1 52 PHE QD 7.410 . 7.910 4.879 4.328 5.280 . 0 0 "[ . 1 . 2]" 1
565 1 48 LEU MD1 1 58 MET ME 6.680 . 7.180 4.155 3.509 4.534 . 0 0 "[ . 1 . 2]" 1
566 1 48 LEU MD1 1 68 ALA MB 6.300 . 6.800 2.190 1.987 2.619 . 0 0 "[ . 1 . 2]" 1
567 1 48 LEU MD2 1 49 ASN H 6.570 . 7.070 4.918 4.823 5.054 . 0 0 "[ . 1 . 2]" 1
568 1 48 LEU MD2 1 52 PHE QD 7.310 . 7.810 3.280 3.129 3.406 . 0 0 "[ . 1 . 2]" 1
569 1 48 LEU MD2 1 52 PHE QE 7.410 . 7.910 2.021 1.857 2.107 . 0 0 "[ . 1 . 2]" 1
570 1 48 LEU MD2 1 63 ILE HA 6.610 . 7.110 5.502 5.003 5.659 . 0 0 "[ . 1 . 2]" 1
571 1 48 LEU MD2 1 63 ILE MD 4.960 . 5.460 3.572 3.451 3.622 . 0 0 "[ . 1 . 2]" 1
572 1 48 LEU MD2 1 63 ILE MG 7.250 . 7.750 4.696 3.894 5.035 . 0 0 "[ . 1 . 2]" 1
573 1 48 LEU MD2 1 68 ALA H 6.610 . 7.110 4.683 4.522 4.791 . 0 0 "[ . 1 . 2]" 1
574 1 48 LEU MD2 1 68 ALA HA 6.610 . 7.110 4.183 4.023 4.315 . 0 0 "[ . 1 . 2]" 1
575 1 48 LEU MD2 1 68 ALA MB 5.450 . 5.950 1.965 1.865 2.048 . 0 0 "[ . 1 . 2]" 1
576 1 48 LEU MD2 1 69 PHE H 6.520 . 7.020 4.900 4.502 5.135 . 0 0 "[ . 1 . 2]" 1
577 1 48 LEU MD2 1 70 VAL MG1 4.620 . 5.120 3.445 3.338 3.523 . 0 0 "[ . 1 . 2]" 1
578 1 48 LEU HG 1 49 ASN H 5.500 . 6.000 4.458 4.362 4.607 . 0 0 "[ . 1 . 2]" 1
579 1 48 LEU HG 1 52 PHE QD 6.020 . 6.520 4.902 4.715 5.055 . 0 0 "[ . 1 . 2]" 1
580 1 48 LEU HG 1 63 ILE MD 5.820 . 6.320 3.749 2.956 4.309 . 0 0 "[ . 1 . 2]" 1
581 1 48 LEU O 1 52 PHE H 2.000 . 2.300 1.777 1.733 1.849 0.067 3 0 "[ . 1 . 2]" 1
582 1 48 LEU O 1 52 PHE N 3.000 . 3.200 2.757 2.713 2.826 . 0 0 "[ . 1 . 2]" 1
583 1 49 ASN H 1 49 ASN HB2 3.160 . 3.660 2.306 2.271 2.358 . 0 0 "[ . 1 . 2]" 1
584 1 49 ASN H 1 49 ASN HB3 3.640 . 4.140 3.579 3.538 3.622 . 0 0 "[ . 1 . 2]" 1
585 1 49 ASN H 1 49 ASN HD21 5.450 . 5.950 2.691 2.463 2.942 . 0 0 "[ . 1 . 2]" 1
586 1 49 ASN H 1 49 ASN HD22 5.210 . 5.710 4.347 4.116 4.555 . 0 0 "[ . 1 . 2]" 1
587 1 49 ASN H 1 50 GLU H 3.520 . 4.020 2.877 2.811 2.938 . 0 0 "[ . 1 . 2]" 1
588 1 49 ASN H 1 50 GLU HB2 4.660 . 5.160 4.724 4.697 4.752 . 0 0 "[ . 1 . 2]" 1
589 1 49 ASN H 1 51 ILE H 5.150 . 5.650 4.224 4.036 4.351 . 0 0 "[ . 1 . 2]" 1
590 1 49 ASN H 1 58 MET ME 6.170 . 6.670 3.295 3.116 3.611 . 0 0 "[ . 1 . 2]" 1
591 1 49 ASN H 1 63 ILE MD 6.610 . 7.110 5.613 5.542 5.675 . 0 0 "[ . 1 . 2]" 1
592 1 49 ASN HA 1 51 ILE H 4.460 . 4.960 4.362 4.178 4.465 . 0 0 "[ . 1 . 2]" 1
593 1 49 ASN HA 1 52 PHE H 4.420 . 4.920 3.609 3.423 3.712 . 0 0 "[ . 1 . 2]" 1
594 1 49 ASN HA 1 58 MET ME 3.930 . 4.430 2.312 1.930 2.828 . 0 0 "[ . 1 . 2]" 1
595 1 49 ASN HA 1 58 MET QG 6.170 . 6.670 4.560 4.133 4.857 . 0 0 "[ . 1 . 2]" 1
596 1 49 ASN HB2 1 49 ASN HD22 3.950 . 4.450 3.583 3.543 3.618 . 0 0 "[ . 1 . 2]" 1
597 1 49 ASN HB2 1 50 GLU H 3.590 . 4.090 3.048 2.911 3.164 . 0 0 "[ . 1 . 2]" 1
598 1 49 ASN HB2 1 58 MET ME 6.270 . 6.770 4.223 3.869 4.774 . 0 0 "[ . 1 . 2]" 1
599 1 49 ASN HB3 1 50 GLU H 4.050 . 4.550 3.245 3.083 3.322 . 0 0 "[ . 1 . 2]" 1
600 1 49 ASN HB3 1 58 MET ME 6.260 . 6.760 4.513 4.099 5.035 . 0 0 "[ . 1 . 2]" 1
601 1 49 ASN HD21 1 58 MET ME 6.610 . 7.110 3.131 2.843 3.664 . 0 0 "[ . 1 . 2]" 1
602 1 49 ASN HD21 1 61 VAL MG2 6.610 . 7.110 4.364 3.894 4.743 . 0 0 "[ . 1 . 2]" 1
603 1 49 ASN HD22 1 58 MET ME 6.610 . 7.110 3.442 3.091 3.959 . 0 0 "[ . 1 . 2]" 1
604 1 50 GLU H 1 50 GLU HB2 3.470 . 3.970 2.188 2.007 2.269 . 0 0 "[ . 1 . 2]" 1
605 1 50 GLU H 1 50 GLU HB3 3.560 . 4.060 3.468 2.912 3.562 . 0 0 "[ . 1 . 2]" 1
606 1 50 GLU H 1 50 GLU HG2 4.050 . 4.550 3.337 2.675 4.287 . 0 0 "[ . 1 . 2]" 1
607 1 50 GLU H 1 50 GLU HG3 3.750 . 4.250 3.390 2.577 3.817 . 0 0 "[ . 1 . 2]" 1
608 1 50 GLU H 1 51 ILE H 3.580 . 4.080 2.821 2.780 2.888 . 0 0 "[ . 1 . 2]" 1
609 1 50 GLU H 1 51 ILE HB 4.780 . 5.280 4.826 4.808 4.852 . 0 0 "[ . 1 . 2]" 1
610 1 50 GLU H 1 51 ILE MD 6.610 . 7.110 5.092 4.950 5.266 . 0 0 "[ . 1 . 2]" 1
611 1 50 GLU H 1 51 ILE HG13 5.030 . 5.530 4.600 4.513 4.791 . 0 0 "[ . 1 . 2]" 1
612 1 50 GLU H 1 52 PHE H 4.790 . 5.290 4.449 4.384 4.533 . 0 0 "[ . 1 . 2]" 1
613 1 50 GLU H 1 58 MET ME 6.610 . 7.110 4.944 4.672 5.220 . 0 0 "[ . 1 . 2]" 1
614 1 50 GLU HA 1 50 GLU HB2 2.940 . 3.440 2.969 2.734 3.007 . 0 0 "[ . 1 . 2]" 1
615 1 50 GLU HA 1 50 GLU HG2 3.850 . 4.350 2.517 2.203 2.768 . 0 0 "[ . 1 . 2]" 1
616 1 50 GLU HA 1 50 GLU HG3 3.670 . 4.170 3.205 2.415 3.677 . 0 0 "[ . 1 . 2]" 1
617 1 50 GLU HA 1 53 GLY H 4.610 . 5.110 4.446 4.307 4.588 . 0 0 "[ . 1 . 2]" 1
618 1 50 GLU HA 1 54 PRO HD3 5.500 . 6.000 4.208 3.761 4.600 . 0 0 "[ . 1 . 2]" 1
619 1 50 GLU HB2 1 51 ILE H 4.290 . 4.790 2.935 2.719 3.544 . 0 0 "[ . 1 . 2]" 1
620 1 50 GLU HB3 1 51 ILE H 4.070 . 4.570 3.285 2.620 3.448 . 0 0 "[ . 1 . 2]" 1
621 1 50 GLU HB3 1 51 ILE MD 6.610 . 7.110 4.639 4.037 4.818 . 0 0 "[ . 1 . 2]" 1
622 1 50 GLU HB3 1 51 ILE HG12 5.500 . 6.000 4.595 4.330 4.743 . 0 0 "[ . 1 . 2]" 1
623 1 50 GLU HB3 1 51 ILE MG 6.610 . 7.110 5.555 5.279 5.617 . 0 0 "[ . 1 . 2]" 1
624 1 50 GLU HG2 1 51 ILE H 5.500 . 6.000 4.864 4.374 5.110 . 0 0 "[ . 1 . 2]" 1
625 1 51 ILE H 1 51 ILE HB 3.430 . 3.930 2.222 2.177 2.259 . 0 0 "[ . 1 . 2]" 1
626 1 51 ILE H 1 51 ILE MD 4.670 . 5.170 3.417 3.347 3.490 . 0 0 "[ . 1 . 2]" 1
627 1 51 ILE H 1 51 ILE HG12 4.090 . 4.590 3.795 3.748 3.832 . 0 0 "[ . 1 . 2]" 1
628 1 51 ILE H 1 51 ILE HG13 3.690 . 4.190 2.460 2.400 2.502 . 0 0 "[ . 1 . 2]" 1
629 1 51 ILE H 1 52 PHE H 3.540 . 4.040 2.580 2.498 2.630 . 0 0 "[ . 1 . 2]" 1
630 1 51 ILE H 1 52 PHE HA 5.320 . 5.820 5.289 5.218 5.339 . 0 0 "[ . 1 . 2]" 1
631 1 51 ILE H 1 52 PHE HB2 4.690 . 5.190 4.719 4.662 4.811 . 0 0 "[ . 1 . 2]" 1
632 1 51 ILE H 1 52 PHE QD 5.760 . 6.260 3.618 3.354 4.569 . 0 0 "[ . 1 . 2]" 1
633 1 51 ILE H 1 53 GLY H 4.790 . 5.290 4.009 3.912 4.093 . 0 0 "[ . 1 . 2]" 1
634 1 51 ILE H 1 58 MET ME 6.120 . 6.620 4.880 4.486 5.058 . 0 0 "[ . 1 . 2]" 1
635 1 51 ILE HA 1 51 ILE HG12 3.610 . 4.110 2.634 2.568 2.739 . 0 0 "[ . 1 . 2]" 1
636 1 51 ILE HA 1 51 ILE HG13 3.640 . 4.140 2.801 2.759 2.837 . 0 0 "[ . 1 . 2]" 1
637 1 51 ILE HA 1 52 PHE HA 5.500 . 6.000 4.739 4.677 4.804 . 0 0 "[ . 1 . 2]" 1
638 1 51 ILE HA 1 53 GLY H 5.500 . 6.000 4.809 4.675 4.989 . 0 0 "[ . 1 . 2]" 1
639 1 51 ILE HA 1 54 PRO HD2 4.990 . 5.490 4.225 4.087 4.383 . 0 0 "[ . 1 . 2]" 1
640 1 51 ILE HB 1 52 PHE H 3.650 . 4.150 2.700 2.543 2.870 . 0 0 "[ . 1 . 2]" 1
641 1 51 ILE HB 1 52 PHE HA 5.350 . 5.850 4.608 4.489 4.710 . 0 0 "[ . 1 . 2]" 1
642 1 51 ILE HB 1 52 PHE HB2 4.900 . 5.400 4.411 4.303 4.581 . 0 0 "[ . 1 . 2]" 1
643 1 51 ILE HB 1 52 PHE QD 4.750 . 5.250 2.319 2.064 3.561 . 0 0 "[ . 1 . 2]" 1
644 1 51 ILE HB 1 52 PHE QE 5.400 . 5.900 3.275 2.955 3.950 . 0 0 "[ . 1 . 2]" 1
645 1 51 ILE HB 1 53 GLY H 5.260 . 5.760 4.910 4.822 5.024 . 0 0 "[ . 1 . 2]" 1
646 1 51 ILE HB 1 54 PRO HD3 5.500 . 6.000 5.663 5.620 5.688 . 0 0 "[ . 1 . 2]" 1
647 1 51 ILE HB 1 90 PHE QE 6.170 . 6.670 5.528 5.501 5.563 . 0 0 "[ . 1 . 2]" 1
648 1 51 ILE MD 1 52 PHE H 6.210 . 6.710 4.606 4.462 4.768 . 0 0 "[ . 1 . 2]" 1
649 1 51 ILE MD 1 52 PHE QD 7.410 . 7.910 3.817 3.498 4.607 . 0 0 "[ . 1 . 2]" 1
650 1 51 ILE MD 1 52 PHE QE 7.270 . 7.770 3.354 2.842 4.065 . 0 0 "[ . 1 . 2]" 1
651 1 51 ILE MD 1 52 PHE HZ 6.610 . 7.110 5.107 4.233 5.518 . 0 0 "[ . 1 . 2]" 1
652 1 51 ILE MD 1 90 PHE HB2 6.450 . 6.950 4.380 3.971 4.705 . 0 0 "[ . 1 . 2]" 1
653 1 51 ILE MD 1 90 PHE QD 5.260 . 5.760 3.278 3.040 3.513 . 0 0 "[ . 1 . 2]" 1
654 1 51 ILE MD 1 95 LEU MD1 6.550 . 7.050 3.948 3.412 4.402 . 0 0 "[ . 1 . 2]" 1
655 1 51 ILE HG12 1 90 PHE QE 5.300 . 5.800 2.907 2.740 3.168 . 0 0 "[ . 1 . 2]" 1
656 1 51 ILE HG13 1 52 PHE H 4.520 . 5.020 4.523 4.481 4.560 . 0 0 "[ . 1 . 2]" 1
657 1 51 ILE MG 1 52 PHE H 5.210 . 5.710 3.308 3.081 3.486 . 0 0 "[ . 1 . 2]" 1
658 1 51 ILE MG 1 52 PHE HA 5.560 . 6.060 3.351 3.075 3.529 . 0 0 "[ . 1 . 2]" 1
659 1 51 ILE MG 1 52 PHE HB2 6.610 . 7.110 4.400 4.255 4.570 . 0 0 "[ . 1 . 2]" 1
660 1 51 ILE MG 1 52 PHE QD 6.080 . 6.580 2.711 2.566 3.382 . 0 0 "[ . 1 . 2]" 1
661 1 51 ILE MG 1 52 PHE QE 7.410 . 7.910 2.823 2.637 3.276 . 0 0 "[ . 1 . 2]" 1
662 1 51 ILE MG 1 53 GLY H 6.610 . 7.110 5.037 4.867 5.132 . 0 0 "[ . 1 . 2]" 1
663 1 51 ILE MG 1 55 PHE QD 6.580 . 7.080 4.933 4.732 5.009 . 0 0 "[ . 1 . 2]" 1
664 1 51 ILE MG 1 81 ALA MB 7.930 . 8.430 5.051 4.581 5.443 . 0 0 "[ . 1 . 2]" 1
665 1 51 ILE MG 1 85 VAL HB 6.320 . 6.820 3.696 3.230 4.416 . 0 0 "[ . 1 . 2]" 1
666 1 51 ILE MG 1 85 VAL MG1 5.210 . 5.710 2.647 2.371 2.952 . 0 0 "[ . 1 . 2]" 1
667 1 51 ILE MG 1 85 VAL MG2 7.820 . 8.320 2.419 2.149 2.922 . 0 0 "[ . 1 . 2]" 1
668 1 51 ILE MG 1 90 PHE QD 7.020 . 7.520 4.183 4.002 4.426 . 0 0 "[ . 1 . 2]" 1
669 1 52 PHE H 1 52 PHE HB2 3.650 . 4.150 2.390 2.318 2.506 . 0 0 "[ . 1 . 2]" 1
670 1 52 PHE H 1 52 PHE HB3 3.910 . 4.410 3.625 3.563 3.687 . 0 0 "[ . 1 . 2]" 1
671 1 52 PHE H 1 52 PHE QD 4.410 . 4.910 2.345 2.155 3.101 . 0 0 "[ . 1 . 2]" 1
672 1 52 PHE H 1 53 GLY H 3.690 . 4.190 2.300 2.244 2.384 . 0 0 "[ . 1 . 2]" 1
673 1 52 PHE H 1 53 GLY QA 5.280 . 5.780 4.205 4.159 4.270 . 0 0 "[ . 1 . 2]" 1
674 1 52 PHE H 1 54 PRO HD3 5.290 . 5.790 3.737 3.642 3.895 . 0 0 "[ . 1 . 2]" 1
675 1 52 PHE H 1 58 MET ME 5.790 . 6.290 3.502 3.030 3.686 . 0 0 "[ . 1 . 2]" 1
676 1 52 PHE H 1 70 VAL MG1 6.610 . 7.110 5.436 5.032 5.562 . 0 0 "[ . 1 . 2]" 1
677 1 52 PHE HA 1 52 PHE QD 3.640 . 4.140 3.003 2.368 3.191 . 0 0 "[ . 1 . 2]" 1
678 1 52 PHE HA 1 53 GLY QA 6.140 . 6.640 4.578 4.541 4.633 . 0 0 "[ . 1 . 2]" 1
679 1 52 PHE HA 1 54 PRO HD3 4.960 . 5.460 4.156 3.983 4.386 . 0 0 "[ . 1 . 2]" 1
680 1 52 PHE HA 1 54 PRO QG 6.170 . 6.670 4.703 4.524 4.949 . 0 0 "[ . 1 . 2]" 1
681 1 52 PHE HA 1 55 PHE H 4.730 . 5.230 3.500 3.235 3.762 . 0 0 "[ . 1 . 2]" 1
682 1 52 PHE HA 1 55 PHE HB2 5.500 . 6.000 4.004 3.786 4.335 . 0 0 "[ . 1 . 2]" 1
683 1 52 PHE HA 1 55 PHE QD 4.380 . 4.880 2.819 2.223 3.118 . 0 0 "[ . 1 . 2]" 1
684 1 52 PHE HA 1 55 PHE QE 6.170 . 6.670 2.656 2.173 2.915 . 0 0 "[ . 1 . 2]" 1
685 1 52 PHE HA 1 55 PHE HZ 5.500 . 6.000 3.481 3.135 4.018 . 0 0 "[ . 1 . 2]" 1
686 1 52 PHE HA 1 58 MET ME 6.610 . 7.110 4.370 4.075 4.543 . 0 0 "[ . 1 . 2]" 1
687 1 52 PHE HA 1 70 VAL MG2 6.610 . 7.110 5.983 5.886 6.090 . 0 0 "[ . 1 . 2]" 1
688 1 52 PHE HA 1 81 ALA MB 6.100 . 6.600 4.621 4.198 4.901 . 0 0 "[ . 1 . 2]" 1
689 1 52 PHE HA 1 85 VAL MG1 6.490 . 6.990 4.461 4.256 4.673 . 0 0 "[ . 1 . 2]" 1
690 1 52 PHE HB2 1 53 GLY H 4.320 . 4.820 3.034 2.740 3.246 . 0 0 "[ . 1 . 2]" 1
691 1 52 PHE HB2 1 53 GLY QA 5.460 . 5.960 4.225 3.983 4.385 . 0 0 "[ . 1 . 2]" 1
692 1 52 PHE HB2 1 58 MET ME 4.610 . 5.110 1.994 1.886 2.087 . 0 0 "[ . 1 . 2]" 1
693 1 52 PHE HB2 1 61 VAL MG2 6.610 . 7.110 5.214 4.852 5.523 . 0 0 "[ . 1 . 2]" 1
694 1 52 PHE HB2 1 70 VAL MG1 5.310 . 5.810 3.652 3.237 3.961 . 0 0 "[ . 1 . 2]" 1
695 1 52 PHE HB3 1 53 GLY H 4.920 . 5.420 3.891 3.720 4.054 . 0 0 "[ . 1 . 2]" 1
696 1 52 PHE HB3 1 55 PHE HB2 5.400 . 5.900 3.973 3.574 4.226 . 0 0 "[ . 1 . 2]" 1
697 1 52 PHE HB3 1 55 PHE QD 5.080 . 5.580 2.891 2.590 3.091 . 0 0 "[ . 1 . 2]" 1
698 1 52 PHE HB3 1 55 PHE QE 6.170 . 6.670 3.759 3.556 4.211 . 0 0 "[ . 1 . 2]" 1
699 1 52 PHE HB3 1 58 MET ME 4.970 . 5.470 2.690 2.454 2.917 . 0 0 "[ . 1 . 2]" 1
700 1 52 PHE HB3 1 70 VAL MG1 5.190 . 5.690 3.547 3.365 3.818 . 0 0 "[ . 1 . 2]" 1
701 1 52 PHE HB3 1 70 VAL MG2 6.430 . 6.930 4.781 4.548 5.098 . 0 0 "[ . 1 . 2]" 1
702 1 52 PHE HB3 1 81 ALA MB 6.470 . 6.970 4.930 4.686 5.196 . 0 0 "[ . 1 . 2]" 1
703 1 52 PHE QD 1 53 GLY H 5.490 . 5.990 4.311 4.210 4.501 . 0 0 "[ . 1 . 2]" 1
704 1 52 PHE QD 1 58 MET ME 6.270 . 6.770 3.235 2.111 3.574 . 0 0 "[ . 1 . 2]" 1
705 1 52 PHE QD 1 70 VAL HB 6.170 . 6.670 3.818 3.496 4.081 . 0 0 "[ . 1 . 2]" 1
706 1 52 PHE QD 1 70 VAL MG1 6.120 . 6.620 2.945 2.621 3.239 . 0 0 "[ . 1 . 2]" 1
707 1 52 PHE QD 1 70 VAL MG2 6.160 . 6.660 3.497 2.705 3.766 . 0 0 "[ . 1 . 2]" 1
708 1 52 PHE QD 1 81 ALA HA 5.830 . 6.330 5.266 4.812 5.395 . 0 0 "[ . 1 . 2]" 1
709 1 52 PHE QD 1 81 ALA MB 4.970 . 5.470 3.410 2.917 3.647 . 0 0 "[ . 1 . 2]" 1
710 1 52 PHE QD 1 97 VAL MG2 7.410 . 7.910 4.671 4.111 4.970 . 0 0 "[ . 1 . 2]" 1
711 1 52 PHE QE 1 55 PHE QD 6.070 . 6.570 4.502 4.242 4.783 . 0 0 "[ . 1 . 2]" 1
712 1 52 PHE QE 1 58 MET ME 7.410 . 7.910 4.506 3.875 4.876 . 0 0 "[ . 1 . 2]" 1
713 1 52 PHE QE 1 70 VAL HA 6.170 . 6.670 5.275 5.056 5.580 . 0 0 "[ . 1 . 2]" 1
714 1 52 PHE QE 1 70 VAL MG2 7.410 . 7.910 2.751 2.111 2.950 . 0 0 "[ . 1 . 2]" 1
715 1 52 PHE QE 1 81 ALA MB 7.410 . 7.910 3.691 3.319 3.829 . 0 0 "[ . 1 . 2]" 1
716 1 52 PHE HZ 1 70 VAL HB 5.500 . 6.000 3.389 2.843 3.923 . 0 0 "[ . 1 . 2]" 1
717 1 52 PHE HZ 1 70 VAL MG1 6.520 . 7.020 3.922 3.485 4.580 . 0 0 "[ . 1 . 2]" 1
718 1 52 PHE HZ 1 70 VAL MG2 5.540 . 6.040 2.533 2.256 3.186 . 0 0 "[ . 1 . 2]" 1
719 1 52 PHE HZ 1 81 ALA MB 6.610 . 7.110 5.465 5.206 5.581 . 0 0 "[ . 1 . 2]" 1
720 1 52 PHE HZ 1 97 VAL HA 5.020 . 5.520 5.086 4.758 5.251 . 0 0 "[ . 1 . 2]" 1
721 1 52 PHE HZ 1 97 VAL MG1 5.610 . 6.110 4.533 4.329 4.645 . 0 0 "[ . 1 . 2]" 1
722 1 52 PHE HZ 1 97 VAL MG2 6.610 . 7.110 3.427 3.042 3.702 . 0 0 "[ . 1 . 2]" 1
723 1 53 GLY H 1 54 PRO HD2 4.160 . 4.660 3.139 2.973 3.252 . 0 0 "[ . 1 . 2]" 1
724 1 53 GLY H 1 54 PRO HD3 3.930 . 4.430 2.552 2.487 2.625 . 0 0 "[ . 1 . 2]" 1
725 1 53 GLY H 1 54 PRO QG 5.160 . 5.660 4.430 4.365 4.508 . 0 0 "[ . 1 . 2]" 1
726 1 53 GLY H 1 58 MET ME 5.000 . 5.500 3.546 2.581 3.861 . 0 0 "[ . 1 . 2]" 1
727 1 53 GLY QA 1 54 PRO HD3 4.580 . 5.080 2.804 2.734 2.848 . 0 0 "[ . 1 . 2]" 1
728 1 53 GLY QA 1 54 PRO QG 6.410 . 6.910 4.180 4.129 4.214 . 0 0 "[ . 1 . 2]" 1
729 1 53 GLY QA 1 55 PHE H 5.760 . 6.260 3.745 3.703 3.795 . 0 0 "[ . 1 . 2]" 1
730 1 53 GLY QA 1 56 GLY H 6.090 . 6.590 3.416 3.213 3.780 . 0 0 "[ . 1 . 2]" 1
731 1 53 GLY QA 1 58 MET ME 5.610 . 6.110 3.947 3.126 4.234 . 0 0 "[ . 1 . 2]" 1
732 1 53 GLY QA 1 58 MET QG 6.590 . 7.090 3.411 2.897 3.955 . 0 0 "[ . 1 . 2]" 1
733 1 54 PRO HA 1 55 PHE QD 6.170 . 6.670 4.879 4.711 5.024 . 0 0 "[ . 1 . 2]" 1
734 1 54 PRO HA 1 56 GLY H 4.960 . 5.460 4.774 4.253 4.993 . 0 0 "[ . 1 . 2]" 1
735 1 54 PRO QB 1 55 PHE HA 4.570 . 5.070 3.991 3.853 4.071 . 0 0 "[ . 1 . 2]" 1
736 1 54 PRO QB 1 55 PHE QD 6.930 . 7.430 2.816 2.568 3.110 . 0 0 "[ . 1 . 2]" 1
737 1 54 PRO HD2 1 55 PHE H 4.490 . 4.990 2.643 2.530 2.714 . 0 0 "[ . 1 . 2]" 1
738 1 54 PRO HD2 1 55 PHE QD 6.140 . 6.640 3.890 3.712 4.123 . 0 0 "[ . 1 . 2]" 1
739 1 54 PRO HD3 1 55 PHE H 4.780 . 5.280 3.937 3.866 3.999 . 0 0 "[ . 1 . 2]" 1
740 1 54 PRO QG 1 55 PHE H 5.380 . 5.880 4.114 4.038 4.170 . 0 0 "[ . 1 . 2]" 1
741 1 54 PRO QG 1 55 PHE QD 6.640 . 7.140 4.537 4.296 4.824 . 0 0 "[ . 1 . 2]" 1
742 1 54 PRO QG 1 55 PHE QE 6.930 . 7.430 3.910 3.506 4.379 . 0 0 "[ . 1 . 2]" 1
743 1 55 PHE H 1 55 PHE HB2 3.640 . 4.140 2.703 2.626 2.780 . 0 0 "[ . 1 . 2]" 1
744 1 55 PHE H 1 55 PHE HB3 3.590 . 4.090 3.624 3.607 3.643 . 0 0 "[ . 1 . 2]" 1
745 1 55 PHE H 1 55 PHE QD 4.790 . 5.290 2.826 2.689 3.007 . 0 0 "[ . 1 . 2]" 1
746 1 55 PHE H 1 56 GLY H 3.490 . 3.990 2.418 2.329 2.635 . 0 0 "[ . 1 . 2]" 1
747 1 55 PHE H 1 56 GLY QA 5.460 . 5.960 4.192 4.034 4.591 . 0 0 "[ . 1 . 2]" 1
748 1 55 PHE H 1 80 LYS QD 6.170 . 6.670 4.847 4.612 5.309 . 0 0 "[ . 1 . 2]" 1
749 1 55 PHE HA 1 55 PHE QE 5.400 . 5.900 4.673 4.512 4.793 . 0 0 "[ . 1 . 2]" 1
750 1 55 PHE HA 1 80 LYS QB 5.040 . 5.540 4.520 4.344 4.637 . 0 0 "[ . 1 . 2]" 1
751 1 55 PHE HA 1 80 LYS QG 5.850 . 6.350 3.226 2.926 3.558 . 0 0 "[ . 1 . 2]" 1
752 1 55 PHE HA 1 81 ALA MB 6.610 . 7.110 5.283 4.883 5.522 . 0 0 "[ . 1 . 2]" 1
753 1 55 PHE HB2 1 56 GLY H 4.440 . 4.940 2.421 2.212 2.862 . 0 0 "[ . 1 . 2]" 1
754 1 55 PHE HB2 1 72 PHE QD 6.170 . 6.670 5.511 5.168 5.655 . 0 0 "[ . 1 . 2]" 1
755 1 55 PHE HB2 1 80 LYS QD 6.170 . 6.670 4.022 3.691 4.673 . 0 0 "[ . 1 . 2]" 1
756 1 55 PHE HB2 1 80 LYS QG 6.170 . 6.670 4.020 3.793 4.327 . 0 0 "[ . 1 . 2]" 1
757 1 55 PHE HB2 1 81 ALA MB 5.740 . 6.240 4.004 3.557 4.453 . 0 0 "[ . 1 . 2]" 1
758 1 55 PHE HB2 1 84 GLU HG3 5.500 . 6.000 5.663 5.568 5.772 . 0 0 "[ . 1 . 2]" 1
759 1 55 PHE HB3 1 56 GLY H 4.890 . 5.390 3.683 3.534 3.982 . 0 0 "[ . 1 . 2]" 1
760 1 55 PHE HB3 1 56 GLY QA 5.110 . 5.610 4.621 4.079 4.708 . 0 0 "[ . 1 . 2]" 1
761 1 55 PHE HB3 1 80 LYS QG 6.160 . 6.660 2.507 2.345 2.735 . 0 0 "[ . 1 . 2]" 1
762 1 55 PHE HB3 1 81 ALA MB 5.750 . 6.250 3.511 2.959 3.865 . 0 0 "[ . 1 . 2]" 1
763 1 55 PHE QD 1 56 GLY H 5.350 . 5.850 4.031 3.834 4.294 . 0 0 "[ . 1 . 2]" 1
764 1 55 PHE QD 1 56 GLY QA 6.440 . 6.940 5.303 5.200 5.387 . 0 0 "[ . 1 . 2]" 1
765 1 55 PHE QD 1 58 MET ME 6.650 . 7.150 5.058 4.990 5.194 . 0 0 "[ . 1 . 2]" 1
766 1 55 PHE QD 1 58 MET QG 6.600 . 7.100 5.038 4.135 5.306 . 0 0 "[ . 1 . 2]" 1
767 1 55 PHE QD 1 77 SER HB2 6.170 . 6.670 5.638 5.377 5.812 . 0 0 "[ . 1 . 2]" 1
768 1 55 PHE QD 1 80 LYS QD 6.700 . 7.200 3.562 3.040 3.986 . 0 0 "[ . 1 . 2]" 1
769 1 55 PHE QD 1 80 LYS QG 6.310 . 6.810 3.271 2.443 3.833 . 0 0 "[ . 1 . 2]" 1
770 1 55 PHE QD 1 81 ALA HA 4.580 . 5.080 3.575 3.369 3.696 . 0 0 "[ . 1 . 2]" 1
771 1 55 PHE QD 1 81 ALA MB 5.410 . 5.910 2.748 2.514 2.965 . 0 0 "[ . 1 . 2]" 1
772 1 55 PHE QD 1 84 GLU HB2 5.890 . 6.390 4.085 3.981 4.207 . 0 0 "[ . 1 . 2]" 1
773 1 55 PHE QD 1 84 GLU HB3 4.870 . 5.370 4.156 4.052 4.265 . 0 0 "[ . 1 . 2]" 1
774 1 55 PHE QD 1 84 GLU HG2 5.780 . 6.280 4.181 4.041 4.314 . 0 0 "[ . 1 . 2]" 1
775 1 55 PHE QD 1 84 GLU HG3 4.890 . 5.390 2.515 2.396 2.666 . 0 0 "[ . 1 . 2]" 1
776 1 55 PHE QD 1 85 VAL MG1 6.040 . 6.540 4.444 4.114 4.606 . 0 0 "[ . 1 . 2]" 1
777 1 55 PHE QE 1 80 LYS QG 6.930 . 7.430 4.624 4.050 5.177 . 0 0 "[ . 1 . 2]" 1
778 1 55 PHE QE 1 81 ALA HA 6.170 . 6.670 3.290 3.115 3.545 . 0 0 "[ . 1 . 2]" 1
779 1 55 PHE QE 1 81 ALA MB 7.410 . 7.910 2.674 2.375 3.087 . 0 0 "[ . 1 . 2]" 1
780 1 55 PHE QE 1 84 GLU HA 6.170 . 6.670 4.666 4.579 4.803 . 0 0 "[ . 1 . 2]" 1
781 1 55 PHE QE 1 84 GLU HB2 5.840 . 6.340 2.889 2.738 2.972 . 0 0 "[ . 1 . 2]" 1
782 1 55 PHE QE 1 84 GLU HB3 6.170 . 6.670 2.265 2.208 2.340 . 0 0 "[ . 1 . 2]" 1
783 1 55 PHE QE 1 84 GLU HG2 6.170 . 6.670 3.978 3.791 4.096 . 0 0 "[ . 1 . 2]" 1
784 1 55 PHE QE 1 84 GLU HG3 6.170 . 6.670 2.566 2.363 2.691 . 0 0 "[ . 1 . 2]" 1
785 1 55 PHE QE 1 85 VAL MG1 7.310 . 7.810 2.777 2.393 2.980 . 0 0 "[ . 1 . 2]" 1
786 1 55 PHE HZ 1 81 ALA MB 6.610 . 7.110 3.905 3.350 4.339 . 0 0 "[ . 1 . 2]" 1
787 1 55 PHE HZ 1 84 GLU HB2 3.850 . 4.350 3.292 3.225 3.409 . 0 0 "[ . 1 . 2]" 1
788 1 55 PHE HZ 1 84 GLU HB3 3.940 . 4.440 3.270 3.025 3.762 . 0 0 "[ . 1 . 2]" 1
789 1 55 PHE HZ 1 84 GLU HG2 5.480 . 5.980 5.530 5.473 5.597 . 0 0 "[ . 1 . 2]" 1
790 1 55 PHE HZ 1 84 GLU HG3 4.330 . 4.830 4.301 4.237 4.376 . 0 0 "[ . 1 . 2]" 1
791 1 55 PHE HZ 1 85 VAL H 4.900 . 5.400 4.469 4.364 4.535 . 0 0 "[ . 1 . 2]" 1
792 1 55 PHE HZ 1 85 VAL MG1 6.470 . 6.970 2.013 1.910 2.132 . 0 0 "[ . 1 . 2]" 1
793 1 55 PHE HZ 1 85 VAL MG2 5.000 . 5.500 3.744 3.529 4.018 . 0 0 "[ . 1 . 2]" 1
794 1 56 GLY H 1 57 PRO HD2 4.920 . 5.420 3.683 3.265 4.306 . 0 0 "[ . 1 . 2]" 1
795 1 56 GLY QA 1 57 PRO QB 6.340 . 6.840 4.364 4.083 4.631 . 0 0 "[ . 1 . 2]" 1
796 1 56 GLY QA 1 57 PRO HD2 4.360 . 4.860 2.973 2.530 3.257 . 0 0 "[ . 1 . 2]" 1
797 1 56 GLY QA 1 57 PRO HG2 5.600 . 6.100 4.628 4.435 4.787 . 0 0 "[ . 1 . 2]" 1
798 1 56 GLY QA 1 57 PRO HG3 5.290 . 5.790 4.278 3.770 4.611 . 0 0 "[ . 1 . 2]" 1
799 1 57 PRO HA 1 58 MET H 3.360 . 3.860 2.913 2.194 3.523 . 0 0 "[ . 1 . 2]" 1
800 1 57 PRO HA 1 58 MET QG 5.950 . 6.450 4.063 3.631 4.456 . 0 0 "[ . 1 . 2]" 1
801 1 57 PRO QB 1 58 MET H 5.020 . 5.520 3.480 2.442 4.128 . 0 0 "[ . 1 . 2]" 1
802 1 57 PRO QB 1 58 MET HA 6.070 . 6.570 4.550 3.872 5.070 . 0 0 "[ . 1 . 2]" 1
803 1 57 PRO QB 1 72 PHE QE 6.930 . 7.430 4.623 3.500 5.526 . 0 0 "[ . 1 . 2]" 1
804 1 57 PRO QB 1 73 GLU H 5.770 . 6.270 3.644 2.857 4.308 . 0 0 "[ . 1 . 2]" 1
805 1 57 PRO QB 1 77 SER HB2 6.130 . 6.630 3.754 2.450 4.980 . 0 0 "[ . 1 . 2]" 1
806 1 57 PRO HD2 1 72 PHE QE 6.170 . 6.670 4.316 2.864 5.415 . 0 0 "[ . 1 . 2]" 1
807 1 57 PRO HD3 1 80 LYS QE 4.610 . 5.110 4.032 3.473 4.255 . 0 0 "[ . 1 . 2]" 1
808 1 57 PRO HG2 1 73 GLU H 5.500 . 6.000 4.839 3.752 5.558 . 0 0 "[ . 1 . 2]" 1
809 1 57 PRO HG3 1 58 MET H 5.500 . 6.000 4.980 4.048 5.494 . 0 0 "[ . 1 . 2]" 1
810 1 58 MET H 1 58 MET HB3 4.030 . 4.530 3.265 2.648 4.053 . 0 0 "[ . 1 . 2]" 1
811 1 58 MET H 1 58 MET ME 6.610 . 7.110 4.670 4.229 5.239 . 0 0 "[ . 1 . 2]" 1
812 1 58 MET H 1 59 LYS H 5.290 . 5.790 3.542 2.452 4.365 . 0 0 "[ . 1 . 2]" 1
813 1 58 MET HA 1 58 MET ME 5.140 . 5.640 3.870 3.483 4.136 . 0 0 "[ . 1 . 2]" 1
814 1 58 MET HA 1 59 LYS H 3.400 . 3.900 2.248 2.065 2.490 . 0 0 "[ . 1 . 2]" 1
815 1 58 MET HA 1 59 LYS HA 4.440 . 4.940 4.526 4.436 4.635 . 0 0 "[ . 1 . 2]" 1
816 1 58 MET HA 1 59 LYS QB 5.480 . 5.980 3.895 3.672 4.178 . 0 0 "[ . 1 . 2]" 1
817 1 58 MET HA 1 60 GLU H 4.400 . 4.900 3.532 3.255 3.913 . 0 0 "[ . 1 . 2]" 1
818 1 58 MET HA 1 70 VAL MG1 6.610 . 7.110 3.069 2.978 3.196 . 0 0 "[ . 1 . 2]" 1
819 1 58 MET HA 1 70 VAL MG2 6.400 . 6.900 5.494 5.387 5.583 . 0 0 "[ . 1 . 2]" 1
820 1 58 MET HA 1 72 PHE QD 5.210 . 5.710 2.358 1.990 3.050 . 0 0 "[ . 1 . 2]" 1
821 1 58 MET HA 1 72 PHE QE 6.170 . 6.670 2.291 2.028 2.763 . 0 0 "[ . 1 . 2]" 1
822 1 58 MET HB2 1 59 LYS H 4.080 . 4.580 4.020 3.606 4.231 . 0 0 "[ . 1 . 2]" 1
823 1 58 MET HB2 1 59 LYS HA 5.240 . 5.740 5.084 4.809 5.352 . 0 0 "[ . 1 . 2]" 1
824 1 58 MET HB2 1 60 GLU H 4.490 . 4.990 4.508 4.078 4.810 . 0 0 "[ . 1 . 2]" 1
825 1 58 MET HB2 1 61 VAL MG2 4.560 . 5.060 3.053 2.463 3.753 . 0 0 "[ . 1 . 2]" 1
826 1 58 MET HB2 1 70 VAL MG1 6.610 . 7.110 3.310 2.645 4.557 . 0 0 "[ . 1 . 2]" 1
827 1 58 MET HB3 1 59 LYS H 5.020 . 5.520 4.300 3.840 4.447 . 0 0 "[ . 1 . 2]" 1
828 1 58 MET ME 1 59 LYS H 6.610 . 7.110 5.488 5.005 5.662 . 0 0 "[ . 1 . 2]" 1
829 1 58 MET ME 1 61 VAL MG2 5.060 . 5.560 2.643 2.166 3.437 . 0 0 "[ . 1 . 2]" 1
830 1 58 MET ME 1 70 VAL MG1 5.410 . 5.910 2.601 2.173 3.070 . 0 0 "[ . 1 . 2]" 1
831 1 58 MET ME 1 70 VAL MG2 7.930 . 8.430 3.605 3.138 4.183 . 0 0 "[ . 1 . 2]" 1
832 1 58 MET QG 1 59 LYS H 5.530 . 6.030 4.464 4.286 4.651 . 0 0 "[ . 1 . 2]" 1
833 1 58 MET QG 1 61 VAL MG2 7.410 . 7.910 4.143 3.549 4.612 . 0 0 "[ . 1 . 2]" 1
834 1 58 MET QG 1 70 VAL MG1 7.010 . 7.510 4.133 3.503 4.542 . 0 0 "[ . 1 . 2]" 1
835 1 58 MET QG 1 72 PHE QD 6.070 . 6.570 4.703 4.201 4.905 . 0 0 "[ . 1 . 2]" 1
836 1 59 LYS H 1 59 LYS HD3 5.430 . 5.930 5.406 4.760 5.707 . 0 0 "[ . 1 . 2]" 1
837 1 59 LYS H 1 59 LYS HG2 4.870 . 5.370 4.366 4.107 4.595 . 0 0 "[ . 1 . 2]" 1
838 1 59 LYS H 1 59 LYS HG3 4.770 . 5.270 4.275 4.075 4.488 . 0 0 "[ . 1 . 2]" 1
839 1 59 LYS H 1 60 GLU H 3.320 . 3.820 2.569 2.057 2.954 . 0 0 "[ . 1 . 2]" 1
840 1 59 LYS H 1 72 PHE H 5.370 . 5.870 5.026 4.654 5.437 . 0 0 "[ . 1 . 2]" 1
841 1 59 LYS H 1 72 PHE HB3 5.500 . 6.000 4.388 3.959 5.095 . 0 0 "[ . 1 . 2]" 1
842 1 59 LYS H 1 72 PHE QD 6.090 . 6.590 2.388 2.154 2.709 . 0 0 "[ . 1 . 2]" 1
843 1 59 LYS H 1 73 GLU H 4.520 . 5.020 4.376 3.667 4.661 . 0 0 "[ . 1 . 2]" 1
844 1 59 LYS HA 1 59 LYS HD2 5.290 . 5.790 3.855 3.462 4.639 . 0 0 "[ . 1 . 2]" 1
845 1 59 LYS HA 1 59 LYS QE 5.420 . 5.920 4.426 3.991 5.051 . 0 0 "[ . 1 . 2]" 1
846 1 59 LYS HA 1 59 LYS HG2 4.120 . 4.620 2.694 2.435 3.017 . 0 0 "[ . 1 . 2]" 1
847 1 59 LYS HA 1 59 LYS HG3 4.030 . 4.530 3.647 2.454 3.918 . 0 0 "[ . 1 . 2]" 1
848 1 59 LYS HA 1 72 PHE QD 6.170 . 6.670 5.028 4.770 5.348 . 0 0 "[ . 1 . 2]" 1
849 1 59 LYS QB 1 59 LYS HD3 3.670 . 4.170 3.256 2.381 3.382 . 0 0 "[ . 1 . 2]" 1
850 1 59 LYS QB 1 60 GLU H 3.820 . 4.320 2.834 2.347 3.145 . 0 0 "[ . 1 . 2]" 1
851 1 59 LYS QB 1 60 GLU HA 5.740 . 6.240 4.852 4.523 5.089 . 0 0 "[ . 1 . 2]" 1
852 1 59 LYS QB 1 71 GLU H 5.410 . 5.910 4.653 4.289 4.910 . 0 0 "[ . 1 . 2]" 1
853 1 59 LYS QB 1 72 PHE H 5.880 . 6.380 4.161 3.872 4.557 . 0 0 "[ . 1 . 2]" 1
854 1 59 LYS QB 1 72 PHE HA 5.190 . 5.690 1.953 1.878 2.219 . 0 0 "[ . 1 . 2]" 1
855 1 59 LYS QB 1 72 PHE QD 6.250 . 6.750 3.216 2.901 3.406 . 0 0 "[ . 1 . 2]" 1
856 1 59 LYS QB 1 73 GLU H 5.810 . 6.310 2.774 2.492 3.202 . 0 0 "[ . 1 . 2]" 1
857 1 59 LYS QB 1 73 GLU HA 5.070 . 5.570 4.450 3.882 4.582 . 0 0 "[ . 1 . 2]" 1
858 1 59 LYS QB 1 73 GLU HB3 4.660 . 5.160 3.584 2.589 4.134 . 0 0 "[ . 1 . 2]" 1
859 1 59 LYS QB 1 73 GLU HG2 4.430 . 4.930 3.254 2.455 4.294 . 0 0 "[ . 1 . 2]" 1
860 1 59 LYS HD2 1 60 GLU H 5.480 . 5.980 4.046 2.699 5.766 . 0 0 "[ . 1 . 2]" 1
861 1 59 LYS HD2 1 73 GLU HA 5.500 . 6.000 5.392 4.135 5.664 . 0 0 "[ . 1 . 2]" 1
862 1 59 LYS HD3 1 72 PHE HA 4.620 . 5.120 4.788 3.500 4.946 . 0 0 "[ . 1 . 2]" 1
863 1 59 LYS QE 1 60 GLU H 6.170 . 6.670 3.642 3.075 4.906 . 0 0 "[ . 1 . 2]" 1
864 1 59 LYS QE 1 71 GLU HA 6.170 . 6.670 4.579 4.169 4.937 . 0 0 "[ . 1 . 2]" 1
865 1 59 LYS QE 1 71 GLU HB2 5.160 . 5.660 4.387 4.010 4.724 . 0 0 "[ . 1 . 2]" 1
866 1 59 LYS QE 1 71 GLU HB3 5.140 . 5.640 3.013 2.461 3.693 . 0 0 "[ . 1 . 2]" 1
867 1 59 LYS QE 1 71 GLU QG 6.160 . 6.660 2.285 1.953 2.627 . 0 0 "[ . 1 . 2]" 1
868 1 59 LYS QE 1 72 PHE HB3 6.140 . 6.640 4.850 4.158 5.505 . 0 0 "[ . 1 . 2]" 1
869 1 59 LYS QE 1 72 PHE QD 6.820 . 7.320 4.929 4.136 5.492 . 0 0 "[ . 1 . 2]" 1
870 1 59 LYS QE 1 73 GLU HB3 3.040 . 3.540 2.746 2.401 2.812 . 0 0 "[ . 1 . 2]" 1
871 1 59 LYS QE 1 74 GLU H 6.170 . 6.670 4.931 4.443 5.519 . 0 0 "[ . 1 . 2]" 1
872 1 59 LYS HG2 1 60 GLU H 5.030 . 5.530 4.758 3.936 5.025 . 0 0 "[ . 1 . 2]" 1
873 1 59 LYS HG2 1 73 GLU HA 5.500 . 6.000 5.538 5.133 5.809 . 0 0 "[ . 1 . 2]" 1
874 1 59 LYS HG2 1 73 GLU HB3 5.160 . 5.660 3.741 3.521 4.701 . 0 0 "[ . 1 . 2]" 1
875 1 59 LYS HG3 1 60 GLU H 5.020 . 5.520 5.060 4.755 5.189 . 0 0 "[ . 1 . 2]" 1
876 1 59 LYS HG3 1 72 PHE QD 6.170 . 6.670 5.391 4.931 5.724 . 0 0 "[ . 1 . 2]" 1
877 1 59 LYS HG3 1 73 GLU HB3 5.190 . 5.690 2.291 2.081 4.032 . 0 0 "[ . 1 . 2]" 1
878 1 59 LYS HG3 1 73 GLU HG2 5.500 . 6.000 2.995 2.271 4.989 . 0 0 "[ . 1 . 2]" 1
879 1 60 GLU H 1 60 GLU HG2 5.500 . 6.000 4.744 4.334 5.019 . 0 0 "[ . 1 . 2]" 1
880 1 60 GLU H 1 60 GLU HG3 5.090 . 5.590 4.664 4.236 5.099 . 0 0 "[ . 1 . 2]" 1
881 1 60 GLU H 1 61 VAL H 4.610 . 5.110 4.343 4.289 4.418 . 0 0 "[ . 1 . 2]" 1
882 1 60 GLU H 1 61 VAL MG2 6.510 . 7.010 3.531 3.365 3.752 . 0 0 "[ . 1 . 2]" 1
883 1 60 GLU H 1 70 VAL MG1 6.570 . 7.070 3.597 3.475 3.715 . 0 0 "[ . 1 . 2]" 1
884 1 60 GLU H 1 70 VAL MG2 6.610 . 7.110 5.652 5.607 5.712 . 0 0 "[ . 1 . 2]" 1
885 1 60 GLU H 1 71 GLU H 4.100 . 4.600 2.763 2.557 2.926 . 0 0 "[ . 1 . 2]" 1
886 1 60 GLU H 1 71 GLU HA 5.360 . 5.860 4.732 4.491 5.055 . 0 0 "[ . 1 . 2]" 1
887 1 60 GLU H 1 71 GLU HB2 4.990 . 5.490 4.378 3.898 4.846 . 0 0 "[ . 1 . 2]" 1
888 1 60 GLU H 1 71 GLU HB3 3.750 . 4.250 2.917 2.444 3.466 . 0 0 "[ . 1 . 2]" 1
889 1 60 GLU H 1 71 GLU O 2.000 . 2.300 2.082 1.987 2.181 . 0 0 "[ . 1 . 2]" 1
890 1 60 GLU H 1 72 PHE HA 5.500 . 6.000 3.956 3.755 4.135 . 0 0 "[ . 1 . 2]" 1
891 1 60 GLU HA 1 60 GLU HG2 2.990 . 3.490 2.535 2.228 2.773 . 0 0 "[ . 1 . 2]" 1
892 1 60 GLU HA 1 60 GLU HG3 3.470 . 3.970 2.817 2.313 3.580 . 0 0 "[ . 1 . 2]" 1
893 1 60 GLU HA 1 61 VAL H 2.900 . 3.400 2.193 2.134 2.284 . 0 0 "[ . 1 . 2]" 1
894 1 60 GLU HA 1 61 VAL MG1 6.550 . 7.050 5.033 4.895 5.142 . 0 0 "[ . 1 . 2]" 1
895 1 60 GLU HA 1 70 VAL MG2 6.610 . 7.110 6.116 6.061 6.187 . 0 0 "[ . 1 . 2]" 1
896 1 60 GLU HG3 1 61 VAL H 4.010 . 4.510 3.724 3.159 4.159 . 0 0 "[ . 1 . 2]" 1
897 1 60 GLU N 1 71 GLU O 3.000 . 3.200 2.971 2.879 3.059 . 0 0 "[ . 1 . 2]" 1
898 1 60 GLU O 1 71 GLU H 2.000 . 2.300 1.899 1.824 1.986 . 0 0 "[ . 1 . 2]" 1
899 1 60 GLU O 1 71 GLU N 3.000 . 3.200 2.792 2.750 2.851 . 0 0 "[ . 1 . 2]" 1
900 1 61 VAL H 1 61 VAL HB 3.160 . 3.660 3.031 2.690 3.180 . 0 0 "[ . 1 . 2]" 1
901 1 61 VAL H 1 62 LYS H 5.060 . 5.560 3.285 3.046 3.955 . 0 0 "[ . 1 . 2]" 1
902 1 61 VAL HA 1 62 LYS H 3.040 . 3.540 2.295 2.093 2.408 . 0 0 "[ . 1 . 2]" 1
903 1 61 VAL HA 1 62 LYS HB2 5.160 . 5.660 4.776 4.508 4.990 . 0 0 "[ . 1 . 2]" 1
904 1 61 VAL HA 1 63 ILE H 5.500 . 6.000 5.644 5.518 5.762 . 0 0 "[ . 1 . 2]" 1
905 1 61 VAL HA 1 69 PHE H 4.790 . 5.290 4.290 4.129 4.573 . 0 0 "[ . 1 . 2]" 1
906 1 61 VAL HA 1 69 PHE HA 5.500 . 6.000 5.599 5.517 5.662 . 0 0 "[ . 1 . 2]" 1
907 1 61 VAL HA 1 69 PHE HB2 5.500 . 6.000 5.516 5.317 5.590 . 0 0 "[ . 1 . 2]" 1
908 1 61 VAL HA 1 70 VAL HA 3.210 . 3.710 2.143 2.018 2.294 . 0 0 "[ . 1 . 2]" 1
909 1 61 VAL HA 1 70 VAL HB 5.410 . 5.910 4.711 4.529 4.909 . 0 0 "[ . 1 . 2]" 1
910 1 61 VAL HA 1 70 VAL MG1 5.380 . 5.880 2.686 2.553 3.018 . 0 0 "[ . 1 . 2]" 1
911 1 61 VAL HA 1 70 VAL MG2 5.280 . 5.780 2.613 2.477 2.900 . 0 0 "[ . 1 . 2]" 1
912 1 61 VAL HA 1 71 GLU H 4.250 . 4.750 3.840 3.646 3.987 . 0 0 "[ . 1 . 2]" 1
913 1 61 VAL HA 1 71 GLU HB2 5.010 . 5.510 5.136 5.067 5.209 . 0 0 "[ . 1 . 2]" 1
914 1 61 VAL HB 1 63 ILE MD 6.440 . 6.940 3.461 2.650 4.340 . 0 0 "[ . 1 . 2]" 1
915 1 61 VAL HB 1 70 VAL MG1 6.140 . 6.640 4.253 4.096 4.541 . 0 0 "[ . 1 . 2]" 1
916 1 61 VAL HB 1 70 VAL MG2 5.720 . 6.220 4.582 4.333 4.864 . 0 0 "[ . 1 . 2]" 1
917 1 61 VAL MG1 1 62 LYS H 4.700 . 5.200 3.744 3.057 3.925 . 0 0 "[ . 1 . 2]" 1
918 1 61 VAL MG1 1 63 ILE H 5.810 . 6.310 4.756 3.889 4.936 . 0 0 "[ . 1 . 2]" 1
919 1 61 VAL MG1 1 63 ILE MD 4.470 . 4.970 1.959 1.907 2.021 . 0 0 "[ . 1 . 2]" 1
920 1 61 VAL MG1 1 68 ALA HA 6.610 . 7.110 4.502 4.130 4.754 . 0 0 "[ . 1 . 2]" 1
921 1 61 VAL MG1 1 69 PHE H 6.610 . 7.110 4.454 4.049 4.944 . 0 0 "[ . 1 . 2]" 1
922 1 61 VAL MG1 1 70 VAL HA 5.340 . 5.840 3.577 3.370 4.177 . 0 0 "[ . 1 . 2]" 1
923 1 61 VAL MG1 1 70 VAL MG1 6.970 . 7.470 2.328 2.075 3.493 . 0 0 "[ . 1 . 2]" 1
924 1 61 VAL MG1 1 71 GLU H 6.610 . 7.110 4.863 4.654 5.585 . 0 0 "[ . 1 . 2]" 1
925 1 61 VAL MG2 1 62 LYS H 5.490 . 5.990 4.524 4.226 4.600 . 0 0 "[ . 1 . 2]" 1
926 1 61 VAL MG2 1 70 VAL HA 4.920 . 5.420 3.658 3.421 3.747 . 0 0 "[ . 1 . 2]" 1
927 1 61 VAL MG2 1 70 VAL MG1 5.120 . 5.620 2.132 1.992 2.273 . 0 0 "[ . 1 . 2]" 1
928 1 61 VAL MG2 1 70 VAL MG2 5.080 . 5.580 3.366 2.737 3.521 . 0 0 "[ . 1 . 2]" 1
929 1 61 VAL MG2 1 71 GLU H 6.080 . 6.580 3.853 3.652 3.992 . 0 0 "[ . 1 . 2]" 1
930 1 62 LYS H 1 62 LYS HB2 3.880 . 4.380 2.604 2.455 2.759 . 0 0 "[ . 1 . 2]" 1
931 1 62 LYS H 1 62 LYS HB3 3.640 . 4.140 3.635 3.591 3.696 . 0 0 "[ . 1 . 2]" 1
932 1 62 LYS H 1 62 LYS HE3 5.450 . 5.950 4.931 4.493 5.297 . 0 0 "[ . 1 . 2]" 1
933 1 62 LYS H 1 62 LYS HG2 4.650 . 5.150 2.876 2.229 3.198 . 0 0 "[ . 1 . 2]" 1
934 1 62 LYS H 1 62 LYS HG3 5.240 . 5.740 2.478 2.021 3.485 . 0 0 "[ . 1 . 2]" 1
935 1 62 LYS H 1 63 ILE HA 5.310 . 5.810 5.267 4.753 5.376 . 0 0 "[ . 1 . 2]" 1
936 1 62 LYS H 1 63 ILE MD 6.610 . 7.110 4.854 3.742 5.500 . 0 0 "[ . 1 . 2]" 1
937 1 62 LYS H 1 68 ALA HA 5.130 . 5.630 4.801 4.160 5.068 . 0 0 "[ . 1 . 2]" 1
938 1 62 LYS H 1 69 PHE H 4.150 . 4.650 3.242 2.729 3.418 . 0 0 "[ . 1 . 2]" 1
939 1 62 LYS H 1 69 PHE HB2 4.810 . 5.310 3.708 3.476 3.817 . 0 0 "[ . 1 . 2]" 1
940 1 62 LYS H 1 69 PHE HB3 5.250 . 5.750 5.031 4.733 5.185 . 0 0 "[ . 1 . 2]" 1
941 1 62 LYS H 1 69 PHE O 2.000 . 2.300 2.048 1.979 2.085 . 0 0 "[ . 1 . 2]" 1
942 1 62 LYS H 1 70 VAL H 5.500 . 6.000 4.642 4.510 4.806 . 0 0 "[ . 1 . 2]" 1
943 1 62 LYS H 1 70 VAL HA 4.460 . 4.960 3.126 2.970 3.319 . 0 0 "[ . 1 . 2]" 1
944 1 62 LYS H 1 70 VAL MG1 6.610 . 7.110 4.515 4.372 4.775 . 0 0 "[ . 1 . 2]" 1
945 1 62 LYS H 1 70 VAL MG2 6.440 . 6.940 3.965 3.557 4.174 . 0 0 "[ . 1 . 2]" 1
946 1 62 LYS HB2 1 62 LYS HE3 4.640 . 5.140 3.553 2.262 3.993 . 0 0 "[ . 1 . 2]" 1
947 1 62 LYS HB2 1 64 LEU MD1 5.920 . 6.420 3.432 2.864 4.983 . 0 0 "[ . 1 . 2]" 1
948 1 62 LYS HB2 1 68 ALA HA 4.850 . 5.350 4.469 4.046 4.642 . 0 0 "[ . 1 . 2]" 1
949 1 62 LYS HB2 1 69 PHE H 4.200 . 4.700 2.858 2.598 3.034 . 0 0 "[ . 1 . 2]" 1
950 1 62 LYS HB2 1 69 PHE HA 5.100 . 5.600 4.548 4.410 4.739 . 0 0 "[ . 1 . 2]" 1
951 1 62 LYS HB2 1 69 PHE HB2 4.320 . 4.820 2.167 2.082 2.301 . 0 0 "[ . 1 . 2]" 1
952 1 62 LYS HB2 1 69 PHE QD 5.380 . 5.880 2.478 2.194 2.817 . 0 0 "[ . 1 . 2]" 1
953 1 62 LYS HB3 1 63 ILE H 4.310 . 4.810 3.530 2.921 3.781 . 0 0 "[ . 1 . 2]" 1
954 1 62 LYS HB3 1 68 ALA HA 5.500 . 6.000 5.471 5.111 5.597 . 0 0 "[ . 1 . 2]" 1
955 1 62 LYS HB3 1 69 PHE H 4.390 . 4.890 4.303 4.146 4.442 . 0 0 "[ . 1 . 2]" 1
956 1 62 LYS HB3 1 69 PHE HB2 4.200 . 4.700 3.675 3.475 3.846 . 0 0 "[ . 1 . 2]" 1
957 1 62 LYS HB3 1 69 PHE QD 5.430 . 5.930 3.367 2.789 3.785 . 0 0 "[ . 1 . 2]" 1
958 1 62 LYS HB3 1 69 PHE QE 6.170 . 6.670 4.941 4.219 5.380 . 0 0 "[ . 1 . 2]" 1
959 1 62 LYS HD2 1 69 PHE HB2 5.500 . 6.000 4.371 3.205 5.425 . 0 0 "[ . 1 . 2]" 1
960 1 62 LYS HE3 1 63 ILE H 5.500 . 6.000 4.933 3.667 5.626 . 0 0 "[ . 1 . 2]" 1
961 1 62 LYS HE3 1 64 LEU MD1 5.090 . 5.590 4.006 2.961 4.288 . 0 0 "[ . 1 . 2]" 1
962 1 62 LYS HG3 1 69 PHE HA 5.500 . 6.000 5.450 5.018 5.576 . 0 0 "[ . 1 . 2]" 1
963 1 62 LYS HG3 1 69 PHE HB2 5.500 . 6.000 3.094 2.298 3.504 . 0 0 "[ . 1 . 2]" 1
964 1 62 LYS HG3 1 69 PHE QD 6.130 . 6.630 4.544 4.086 4.926 . 0 0 "[ . 1 . 2]" 1
965 1 62 LYS HG3 1 70 VAL HA 4.940 . 5.440 4.642 4.130 5.110 . 0 0 "[ . 1 . 2]" 1
966 1 62 LYS N 1 69 PHE O 3.000 . 3.200 3.010 2.971 3.034 . 0 0 "[ . 1 . 2]" 1
967 1 62 LYS O 1 69 PHE H 2.000 . 2.300 1.850 1.776 2.011 0.024 18 0 "[ . 1 . 2]" 1
968 1 62 LYS O 1 69 PHE N 3.000 . 3.200 2.837 2.765 3.000 . 0 0 "[ . 1 . 2]" 1
969 1 63 ILE H 1 63 ILE HB 3.230 . 3.730 2.767 2.517 2.941 . 0 0 "[ . 1 . 2]" 1
970 1 63 ILE H 1 63 ILE MD 5.130 . 5.630 3.912 3.472 4.320 . 0 0 "[ . 1 . 2]" 1
971 1 63 ILE H 1 63 ILE QG 4.200 . 4.700 2.798 2.521 3.092 . 0 0 "[ . 1 . 2]" 1
972 1 63 ILE H 1 64 LEU H 4.600 . 5.100 4.321 4.188 4.402 . 0 0 "[ . 1 . 2]" 1
973 1 63 ILE H 1 64 LEU MD2 6.610 . 7.110 5.216 2.621 5.697 . 0 0 "[ . 1 . 2]" 1
974 1 63 ILE H 1 64 LEU HG 5.480 . 5.980 5.160 4.962 5.630 . 0 0 "[ . 1 . 2]" 1
975 1 63 ILE HA 1 64 LEU H 3.230 . 3.730 2.036 1.958 2.141 . 0 0 "[ . 1 . 2]" 1
976 1 63 ILE HA 1 64 LEU HA 5.500 . 6.000 4.456 4.399 4.515 . 0 0 "[ . 1 . 2]" 1
977 1 63 ILE HA 1 64 LEU HB2 5.030 . 5.530 4.382 4.097 4.827 . 0 0 "[ . 1 . 2]" 1
978 1 63 ILE HA 1 64 LEU HG 5.020 . 5.520 5.056 3.595 5.226 . 0 0 "[ . 1 . 2]" 1
979 1 63 ILE HA 1 68 ALA H 5.500 . 6.000 4.976 4.814 5.172 . 0 0 "[ . 1 . 2]" 1
980 1 63 ILE HA 1 68 ALA HA 3.490 . 3.990 2.561 2.366 2.702 . 0 0 "[ . 1 . 2]" 1
981 1 63 ILE HA 1 68 ALA MB 4.440 . 4.940 3.533 3.301 3.679 . 0 0 "[ . 1 . 2]" 1
982 1 63 ILE HA 1 69 PHE H 4.570 . 5.070 3.777 3.588 3.927 . 0 0 "[ . 1 . 2]" 1
983 1 63 ILE HA 1 69 PHE QD 6.170 . 6.670 4.148 3.711 5.503 . 0 0 "[ . 1 . 2]" 1
984 1 63 ILE HA 1 69 PHE QE 6.170 . 6.670 4.692 4.104 5.567 . 0 0 "[ . 1 . 2]" 1
985 1 63 ILE HB 1 64 LEU H 4.880 . 5.380 4.133 4.004 4.300 . 0 0 "[ . 1 . 2]" 1
986 1 63 ILE HB 1 68 ALA HA 5.500 . 6.000 5.314 5.006 5.634 . 0 0 "[ . 1 . 2]" 1
987 1 63 ILE MD 1 64 LEU H 6.610 . 7.110 4.740 4.106 5.184 . 0 0 "[ . 1 . 2]" 1
988 1 63 ILE MD 1 68 ALA HA 6.610 . 7.110 3.942 2.978 4.926 . 0 0 "[ . 1 . 2]" 1
989 1 63 ILE MD 1 68 ALA MB 7.930 . 8.430 3.148 2.688 3.762 . 0 0 "[ . 1 . 2]" 1
990 1 63 ILE MD 1 70 VAL MG1 6.880 . 7.380 4.849 4.775 4.944 . 0 0 "[ . 1 . 2]" 1
991 1 63 ILE QG 1 64 LEU H 5.980 . 6.480 4.334 3.785 4.899 . 0 0 "[ . 1 . 2]" 1
992 1 63 ILE QG 1 68 ALA HA 6.170 . 6.670 3.677 2.630 4.917 . 0 0 "[ . 1 . 2]" 1
993 1 63 ILE MG 1 64 LEU H 4.620 . 5.120 2.686 2.473 2.800 . 0 0 "[ . 1 . 2]" 1
994 1 63 ILE MG 1 64 LEU HB2 6.610 . 7.110 4.803 4.459 4.961 . 0 0 "[ . 1 . 2]" 1
995 1 63 ILE MG 1 66 GLY H 6.610 . 7.110 4.521 3.239 5.516 . 0 0 "[ . 1 . 2]" 1
996 1 63 ILE MG 1 67 PHE H 6.400 . 6.900 4.132 3.580 4.658 . 0 0 "[ . 1 . 2]" 1
997 1 63 ILE MG 1 68 ALA HA 5.640 . 6.140 3.783 3.164 4.087 . 0 0 "[ . 1 . 2]" 1
998 1 63 ILE MG 1 69 PHE H 6.610 . 7.110 5.269 4.771 5.512 . 0 0 "[ . 1 . 2]" 1
999 1 64 LEU H 1 64 LEU HB2 4.070 . 4.570 2.630 2.461 2.929 . 0 0 "[ . 1 . 2]" 1
1000 1 64 LEU H 1 64 LEU MD1 5.250 . 5.750 2.704 2.380 4.026 . 0 0 "[ . 1 . 2]" 1
1001 1 64 LEU H 1 64 LEU MD2 4.910 . 5.410 3.947 2.444 4.217 . 0 0 "[ . 1 . 2]" 1
1002 1 64 LEU H 1 64 LEU HG 4.470 . 4.970 4.015 2.546 4.242 . 0 0 "[ . 1 . 2]" 1
1003 1 64 LEU H 1 65 ASN H 5.280 . 5.780 4.244 3.846 4.401 . 0 0 "[ . 1 . 2]" 1
1004 1 64 LEU H 1 67 PHE H 4.300 . 4.800 3.191 3.006 3.432 . 0 0 "[ . 1 . 2]" 1
1005 1 64 LEU H 1 67 PHE O 2.000 . 2.300 1.823 1.774 1.871 0.026 12 0 "[ . 1 . 2]" 1
1006 1 64 LEU H 1 68 ALA H 4.840 . 5.340 4.852 4.764 4.900 . 0 0 "[ . 1 . 2]" 1
1007 1 64 LEU H 1 68 ALA HA 3.780 . 4.280 3.577 3.468 3.663 . 0 0 "[ . 1 . 2]" 1
1008 1 64 LEU H 1 68 ALA MB 5.360 . 5.860 4.367 4.113 4.514 . 0 0 "[ . 1 . 2]" 1
1009 1 64 LEU H 1 69 PHE H 5.000 . 5.500 4.984 4.848 5.068 . 0 0 "[ . 1 . 2]" 1
1010 1 64 LEU HA 1 64 LEU MD1 3.950 . 4.450 3.166 2.442 3.657 . 0 0 "[ . 1 . 2]" 1
1011 1 64 LEU HA 1 64 LEU HG 3.800 . 4.300 2.877 2.585 3.875 . 0 0 "[ . 1 . 2]" 1
1012 1 64 LEU HA 1 65 ASN HD21 4.970 . 5.470 4.723 4.017 4.999 . 0 0 "[ . 1 . 2]" 1
1013 1 64 LEU HA 1 65 ASN HD22 4.940 . 5.440 4.741 4.159 5.025 . 0 0 "[ . 1 . 2]" 1
1014 1 64 LEU HA 1 66 GLY H 5.500 . 6.000 4.957 4.537 5.549 . 0 0 "[ . 1 . 2]" 1
1015 1 64 LEU HA 1 69 PHE QE 6.170 . 6.670 5.254 5.004 5.650 . 0 0 "[ . 1 . 2]" 1
1016 1 64 LEU HB2 1 65 ASN H 4.410 . 4.910 3.419 2.785 4.448 . 0 0 "[ . 1 . 2]" 1
1017 1 64 LEU HB2 1 65 ASN HB2 5.350 . 5.850 4.942 4.265 5.528 . 0 0 "[ . 1 . 2]" 1
1018 1 64 LEU HB2 1 65 ASN HD21 4.990 . 5.490 4.672 3.389 5.694 0.204 19 0 "[ . 1 . 2]" 1
1019 1 64 LEU HB2 1 67 PHE H 4.570 . 5.070 3.281 2.824 3.529 . 0 0 "[ . 1 . 2]" 1
1020 1 64 LEU HB2 1 67 PHE QD 6.040 . 6.540 2.688 2.226 3.242 . 0 0 "[ . 1 . 2]" 1
1021 1 64 LEU HB2 1 69 PHE HZ 5.500 . 6.000 4.189 3.598 5.151 . 0 0 "[ . 1 . 2]" 1
1022 1 64 LEU HB3 1 65 ASN H 3.830 . 4.330 2.485 1.839 3.927 . 0 0 "[ . 1 . 2]" 1
1023 1 64 LEU HB3 1 65 ASN HB2 5.070 . 5.570 4.272 3.774 5.066 . 0 0 "[ . 1 . 2]" 1
1024 1 64 LEU HB3 1 67 PHE H 4.640 . 5.140 4.335 4.107 4.631 . 0 0 "[ . 1 . 2]" 1
1025 1 64 LEU HB3 1 67 PHE QD 6.170 . 6.670 3.184 2.837 3.721 . 0 0 "[ . 1 . 2]" 1
1026 1 64 LEU MD1 1 65 ASN H 5.900 . 6.400 4.599 3.709 4.933 . 0 0 "[ . 1 . 2]" 1
1027 1 64 LEU MD1 1 67 PHE HB3 6.610 . 7.110 4.481 3.427 5.662 . 0 0 "[ . 1 . 2]" 1
1028 1 64 LEU MD1 1 67 PHE QD 6.210 . 6.710 4.506 3.448 4.659 . 0 0 "[ . 1 . 2]" 1
1029 1 64 LEU MD1 1 68 ALA HA 6.610 . 7.110 3.913 3.468 5.579 . 0 0 "[ . 1 . 2]" 1
1030 1 64 LEU MD1 1 69 PHE QD 6.550 . 7.050 2.595 2.212 4.350 . 0 0 "[ . 1 . 2]" 1
1031 1 64 LEU MD1 1 69 PHE QE 5.450 . 5.950 2.253 1.999 4.049 . 0 0 "[ . 1 . 2]" 1
1032 1 64 LEU MD2 1 67 PHE H 5.990 . 6.490 4.971 4.386 5.128 . 0 0 "[ . 1 . 2]" 1
1033 1 64 LEU MD2 1 69 PHE QD 6.620 . 7.120 3.556 1.965 3.815 . 0 0 "[ . 1 . 2]" 1
1034 1 64 LEU MD2 1 69 PHE QE 6.430 . 6.930 2.162 1.957 3.272 . 0 0 "[ . 1 . 2]" 1
1035 1 64 LEU MD2 1 69 PHE HZ 5.300 . 5.800 2.892 2.553 4.584 . 0 0 "[ . 1 . 2]" 1
1036 1 64 LEU HG 1 65 ASN H 5.500 . 6.000 4.344 3.989 5.033 . 0 0 "[ . 1 . 2]" 1
1037 1 64 LEU HG 1 67 PHE QD 6.170 . 6.670 5.046 3.484 5.516 . 0 0 "[ . 1 . 2]" 1
1038 1 64 LEU HG 1 69 PHE QD 5.890 . 6.390 4.900 3.050 5.314 . 0 0 "[ . 1 . 2]" 1
1039 1 64 LEU HG 1 69 PHE HZ 5.340 . 5.840 5.401 4.164 5.631 . 0 0 "[ . 1 . 2]" 1
1040 1 64 LEU N 1 67 PHE O 3.000 . 3.200 2.832 2.785 2.876 . 0 0 "[ . 1 . 2]" 1
1041 1 64 LEU O 1 67 PHE H 2.000 . 2.300 2.029 1.824 2.126 . 0 0 "[ . 1 . 2]" 1
1042 1 64 LEU O 1 67 PHE N 3.000 . 3.200 3.009 2.833 3.101 . 0 0 "[ . 1 . 2]" 1
1043 1 65 ASN H 1 66 GLY H 5.440 . 5.940 3.885 3.355 4.399 . 0 0 "[ . 1 . 2]" 1
1044 1 65 ASN H 1 67 PHE QD 6.170 . 6.670 3.944 2.973 5.524 . 0 0 "[ . 1 . 2]" 1
1045 1 65 ASN HB2 1 66 GLY H 4.620 . 5.120 3.650 1.793 4.312 0.007 4 0 "[ . 1 . 2]" 1
1046 1 65 ASN HB2 1 66 GLY HA2 5.500 . 6.000 5.406 4.622 5.751 . 0 0 "[ . 1 . 2]" 1
1047 1 65 ASN HB2 1 67 PHE H 4.660 . 5.160 4.576 3.668 4.925 . 0 0 "[ . 1 . 2]" 1
1048 1 65 ASN HB3 1 66 GLY H 4.520 . 5.020 4.084 2.424 4.586 . 0 0 "[ . 1 . 2]" 1
1049 1 65 ASN HB3 1 66 GLY HA3 5.450 . 5.950 5.061 4.317 5.600 . 0 0 "[ . 1 . 2]" 1
1050 1 65 ASN HD21 1 67 PHE QD 5.350 . 5.850 4.047 2.583 5.347 . 0 0 "[ . 1 . 2]" 1
1051 1 66 GLY H 1 67 PHE H 3.380 . 3.880 2.298 1.875 2.874 . 0 0 "[ . 1 . 2]" 1
1052 1 66 GLY HA2 1 67 PHE QD 6.080 . 6.580 4.789 4.429 5.333 . 0 0 "[ . 1 . 2]" 1
1053 1 66 GLY HA2 1 67 PHE QE 6.170 . 6.670 5.526 5.328 5.620 . 0 0 "[ . 1 . 2]" 1
1054 1 67 PHE H 1 67 PHE QD 4.800 . 5.300 2.892 2.470 3.513 . 0 0 "[ . 1 . 2]" 1
1055 1 67 PHE H 1 68 ALA H 4.700 . 5.200 4.452 4.379 4.539 . 0 0 "[ . 1 . 2]" 1
1056 1 67 PHE HA 1 68 ALA H 3.460 . 3.960 2.159 2.094 2.279 . 0 0 "[ . 1 . 2]" 1
1057 1 67 PHE HA 1 68 ALA MB 6.080 . 6.580 3.891 3.804 3.991 . 0 0 "[ . 1 . 2]" 1
1058 1 67 PHE HA 1 69 PHE HZ 5.500 . 6.000 5.460 5.117 5.581 . 0 0 "[ . 1 . 2]" 1
1059 1 67 PHE HB2 1 68 ALA H 3.730 . 4.230 3.742 3.606 3.805 . 0 0 "[ . 1 . 2]" 1
1060 1 67 PHE HB2 1 68 ALA HA 5.500 . 6.000 4.547 4.334 4.662 . 0 0 "[ . 1 . 2]" 1
1061 1 67 PHE HB3 1 68 ALA H 3.910 . 4.410 2.862 2.712 3.013 . 0 0 "[ . 1 . 2]" 1
1062 1 68 ALA H 1 69 PHE H 5.030 . 5.530 4.251 4.033 4.328 . 0 0 "[ . 1 . 2]" 1
1063 1 68 ALA H 1 69 PHE HA 5.250 . 5.750 4.854 4.696 4.974 . 0 0 "[ . 1 . 2]" 1
1064 1 68 ALA HA 1 69 PHE H 3.220 . 3.720 2.081 2.023 2.137 . 0 0 "[ . 1 . 2]" 1
1065 1 68 ALA HA 1 69 PHE HA 5.400 . 5.900 4.397 4.350 4.426 . 0 0 "[ . 1 . 2]" 1
1066 1 68 ALA HA 1 69 PHE HB2 4.970 . 5.470 4.906 4.701 5.039 . 0 0 "[ . 1 . 2]" 1
1067 1 68 ALA HA 1 69 PHE QD 5.620 . 6.120 3.331 2.788 4.611 . 0 0 "[ . 1 . 2]" 1
1068 1 68 ALA HA 1 69 PHE QE 5.970 . 6.470 4.332 3.885 5.075 . 0 0 "[ . 1 . 2]" 1
1069 1 68 ALA HA 1 70 VAL H 5.100 . 5.600 4.895 4.717 5.096 . 0 0 "[ . 1 . 2]" 1
1070 1 68 ALA HA 1 70 VAL MG1 6.610 . 7.110 6.140 6.083 6.205 . 0 0 "[ . 1 . 2]" 1
1071 1 68 ALA MB 1 69 PHE H 4.440 . 4.940 3.025 2.880 3.297 . 0 0 "[ . 1 . 2]" 1
1072 1 68 ALA MB 1 69 PHE HA 6.260 . 6.760 4.078 3.978 4.264 . 0 0 "[ . 1 . 2]" 1
1073 1 68 ALA MB 1 70 VAL HB 6.210 . 6.710 4.856 4.725 5.001 . 0 0 "[ . 1 . 2]" 1
1074 1 68 ALA MB 1 70 VAL MG1 7.620 . 8.120 4.388 4.230 4.571 . 0 0 "[ . 1 . 2]" 1
1075 1 69 PHE H 1 69 PHE HB2 4.130 . 4.630 2.999 2.890 3.092 . 0 0 "[ . 1 . 2]" 1
1076 1 69 PHE H 1 70 VAL H 5.380 . 5.880 3.604 3.466 3.818 . 0 0 "[ . 1 . 2]" 1
1077 1 69 PHE H 1 70 VAL HA 5.350 . 5.850 4.396 4.276 4.609 . 0 0 "[ . 1 . 2]" 1
1078 1 69 PHE HA 1 69 PHE QE 5.610 . 6.110 5.007 4.809 5.074 . 0 0 "[ . 1 . 2]" 1
1079 1 69 PHE HA 1 70 VAL H 3.310 . 3.810 2.111 2.049 2.153 . 0 0 "[ . 1 . 2]" 1
1080 1 69 PHE HA 1 70 VAL HA 4.930 . 5.430 4.434 4.396 4.471 . 0 0 "[ . 1 . 2]" 1
1081 1 69 PHE HA 1 70 VAL HB 4.820 . 5.320 4.822 4.748 4.899 . 0 0 "[ . 1 . 2]" 1
1082 1 69 PHE HA 1 70 VAL MG1 6.610 . 7.110 5.455 5.410 5.506 . 0 0 "[ . 1 . 2]" 1
1083 1 69 PHE HA 1 70 VAL MG2 6.610 . 7.110 3.694 3.549 3.834 . 0 0 "[ . 1 . 2]" 1
1084 1 69 PHE HA 1 100 SER HB2 5.500 . 6.000 4.268 3.327 4.685 . 0 0 "[ . 1 . 2]" 1
1085 1 69 PHE HB2 1 70 VAL H 4.630 . 5.130 4.373 4.309 4.417 . 0 0 "[ . 1 . 2]" 1
1086 1 69 PHE HB3 1 70 VAL H 4.250 . 4.750 4.009 3.841 4.087 . 0 0 "[ . 1 . 2]" 1
1087 1 69 PHE QD 1 100 SER HA 6.120 . 6.620 5.084 4.457 5.541 . 0 0 "[ . 1 . 2]" 1
1088 1 69 PHE QD 1 100 SER HB2 5.130 . 5.630 3.864 2.652 4.189 . 0 0 "[ . 1 . 2]" 1
1089 1 69 PHE QD 1 100 SER HB3 4.970 . 5.470 3.893 2.655 4.490 . 0 0 "[ . 1 . 2]" 1
1090 1 70 VAL H 1 70 VAL HB 3.850 . 4.350 2.743 2.665 2.851 . 0 0 "[ . 1 . 2]" 1
1091 1 70 VAL H 1 71 GLU H 4.670 . 5.170 4.611 4.559 4.667 . 0 0 "[ . 1 . 2]" 1
1092 1 70 VAL HA 1 71 GLU H 3.130 . 3.630 2.357 2.281 2.427 . 0 0 "[ . 1 . 2]" 1
1093 1 70 VAL HA 1 71 GLU HA 5.500 . 6.000 4.497 4.439 4.530 . 0 0 "[ . 1 . 2]" 1
1094 1 70 VAL HA 1 71 GLU HB2 5.370 . 5.870 3.812 3.732 3.928 . 0 0 "[ . 1 . 2]" 1
1095 1 70 VAL HA 1 71 GLU QG 6.120 . 6.620 5.498 5.474 5.534 . 0 0 "[ . 1 . 2]" 1
1096 1 70 VAL HB 1 71 GLU H 4.950 . 5.450 3.554 3.398 3.717 . 0 0 "[ . 1 . 2]" 1
1097 1 70 VAL MG1 1 71 GLU H 5.040 . 5.540 2.170 2.071 2.319 . 0 0 "[ . 1 . 2]" 1
1098 1 70 VAL MG1 1 71 GLU HA 6.610 . 7.110 4.383 4.276 4.548 . 0 0 "[ . 1 . 2]" 1
1099 1 70 VAL MG1 1 72 PHE QE 7.410 . 7.910 3.366 2.517 4.113 . 0 0 "[ . 1 . 2]" 1
1100 1 70 VAL MG2 1 71 GLU H 5.520 . 6.020 3.966 3.886 4.063 . 0 0 "[ . 1 . 2]" 1
1101 1 71 GLU H 1 71 GLU HB3 3.730 . 4.230 2.791 2.696 2.917 . 0 0 "[ . 1 . 2]" 1
1102 1 71 GLU HA 1 72 PHE HB2 4.930 . 5.430 4.654 4.461 4.829 . 0 0 "[ . 1 . 2]" 1
1103 1 71 GLU HA 1 72 PHE HB3 5.500 . 6.000 5.621 5.537 5.668 . 0 0 "[ . 1 . 2]" 1
1104 1 71 GLU HA 1 72 PHE QD 5.570 . 6.070 4.369 4.045 4.482 . 0 0 "[ . 1 . 2]" 1
1105 1 71 GLU HB3 1 72 PHE H 4.600 . 5.100 3.827 3.613 3.984 . 0 0 "[ . 1 . 2]" 1
1106 1 71 GLU QG 1 72 PHE H 4.970 . 5.470 2.382 2.186 2.585 . 0 0 "[ . 1 . 2]" 1
1107 1 72 PHE H 1 72 PHE HB2 3.760 . 4.260 2.737 2.556 2.901 . 0 0 "[ . 1 . 2]" 1
1108 1 72 PHE H 1 72 PHE QD 4.870 . 5.370 3.510 3.220 3.677 . 0 0 "[ . 1 . 2]" 1
1109 1 72 PHE H 1 73 GLU H 5.330 . 5.830 4.491 4.451 4.542 . 0 0 "[ . 1 . 2]" 1
1110 1 72 PHE H 1 78 ALA MB 5.800 . 6.300 4.631 4.196 4.841 . 0 0 "[ . 1 . 2]" 1
1111 1 72 PHE HA 1 74 GLU H 5.500 . 6.000 3.924 3.583 4.440 . 0 0 "[ . 1 . 2]" 1
1112 1 72 PHE HB2 1 73 GLU H 4.530 . 5.030 3.503 3.335 3.721 . 0 0 "[ . 1 . 2]" 1
1113 1 72 PHE HB2 1 74 GLU H 4.780 . 5.280 2.834 2.259 3.274 . 0 0 "[ . 1 . 2]" 1
1114 1 72 PHE HB2 1 77 SER H 5.500 . 6.000 4.803 4.437 5.189 . 0 0 "[ . 1 . 2]" 1
1115 1 72 PHE HB2 1 77 SER HB2 5.220 . 5.720 4.457 3.170 5.180 . 0 0 "[ . 1 . 2]" 1
1116 1 72 PHE HB2 1 77 SER HB3 4.360 . 4.860 3.647 2.878 4.504 . 0 0 "[ . 1 . 2]" 1
1117 1 72 PHE HB2 1 78 ALA H 5.060 . 5.560 3.853 3.441 4.087 . 0 0 "[ . 1 . 2]" 1
1118 1 72 PHE HB2 1 78 ALA MB 4.980 . 5.480 3.527 3.037 4.070 . 0 0 "[ . 1 . 2]" 1
1119 1 72 PHE HB3 1 73 GLU H 4.300 . 4.800 2.492 2.221 2.657 . 0 0 "[ . 1 . 2]" 1
1120 1 72 PHE HB3 1 74 GLU H 4.220 . 4.720 2.552 2.030 2.997 . 0 0 "[ . 1 . 2]" 1
1121 1 72 PHE HB3 1 77 SER H 5.030 . 5.530 4.654 4.223 5.194 . 0 0 "[ . 1 . 2]" 1
1122 1 72 PHE QD 1 73 GLU H 5.240 . 5.740 4.053 3.806 4.258 . 0 0 "[ . 1 . 2]" 1
1123 1 72 PHE QD 1 74 GLU H 5.410 . 5.910 4.471 4.154 4.749 . 0 0 "[ . 1 . 2]" 1
1124 1 72 PHE QD 1 77 SER HB3 4.570 . 5.070 3.222 2.529 4.198 . 0 0 "[ . 1 . 2]" 1
1125 1 72 PHE QD 1 78 ALA HA 5.470 . 5.970 2.831 2.591 3.128 . 0 0 "[ . 1 . 2]" 1
1126 1 72 PHE QD 1 78 ALA MB 4.930 . 5.430 2.322 2.146 2.663 . 0 0 "[ . 1 . 2]" 1
1127 1 73 GLU H 1 73 GLU HB2 3.790 . 4.290 3.710 3.567 3.808 . 0 0 "[ . 1 . 2]" 1
1128 1 73 GLU H 1 73 GLU HB3 4.180 . 4.680 2.933 2.653 3.190 . 0 0 "[ . 1 . 2]" 1
1129 1 73 GLU H 1 73 GLU HG2 4.110 . 4.610 2.090 1.895 2.755 . 0 0 "[ . 1 . 2]" 1
1130 1 73 GLU H 1 73 GLU HG3 3.710 . 4.210 3.152 2.886 3.728 . 0 0 "[ . 1 . 2]" 1
1131 1 73 GLU H 1 74 GLU H 3.910 . 4.410 2.440 2.264 2.678 . 0 0 "[ . 1 . 2]" 1
1132 1 73 GLU H 1 77 SER HB3 5.500 . 6.000 5.168 4.725 5.536 . 0 0 "[ . 1 . 2]" 1
1133 1 73 GLU HA 1 73 GLU HB3 2.960 . 3.460 2.348 2.261 2.408 . 0 0 "[ . 1 . 2]" 1
1134 1 73 GLU HA 1 73 GLU HG2 3.730 . 4.230 3.725 3.602 3.761 . 0 0 "[ . 1 . 2]" 1
1135 1 73 GLU HA 1 73 GLU HG3 3.800 . 4.300 3.828 3.756 4.088 . 0 0 "[ . 1 . 2]" 1
1136 1 73 GLU HG3 1 74 GLU H 4.360 . 4.860 3.736 3.257 4.412 . 0 0 "[ . 1 . 2]" 1
1137 1 74 GLU H 1 77 SER H 4.980 . 5.480 4.660 4.085 5.006 . 0 0 "[ . 1 . 2]" 1
1138 1 74 GLU H 1 77 SER HB2 5.160 . 5.660 5.005 4.359 5.311 . 0 0 "[ . 1 . 2]" 1
1139 1 74 GLU H 1 77 SER HB3 4.990 . 5.490 4.345 3.691 5.064 . 0 0 "[ . 1 . 2]" 1
1140 1 74 GLU H 1 78 ALA H 5.370 . 5.870 5.068 4.711 5.292 . 0 0 "[ . 1 . 2]" 1
1141 1 74 GLU HG3 1 77 SER H 5.500 . 6.000 4.170 2.079 5.549 . 0 0 "[ . 1 . 2]" 1
1142 1 75 ALA H 1 76 GLU HB2 5.310 . 5.810 4.843 4.066 5.322 . 0 0 "[ . 1 . 2]" 1
1143 1 75 ALA H 1 76 GLU HG2 4.630 . 5.130 4.286 3.597 4.728 . 0 0 "[ . 1 . 2]" 1
1144 1 75 ALA H 1 77 SER H 5.500 . 6.000 4.480 4.170 5.026 . 0 0 "[ . 1 . 2]" 1
1145 1 75 ALA HA 1 76 GLU HG2 5.500 . 6.000 5.543 5.396 5.722 . 0 0 "[ . 1 . 2]" 1
1146 1 75 ALA MB 1 76 GLU H 6.610 . 7.110 3.139 2.769 3.563 . 0 0 "[ . 1 . 2]" 1
1147 1 75 ALA MB 1 76 GLU HG2 6.120 . 6.620 3.996 3.568 4.376 . 0 0 "[ . 1 . 2]" 1
1148 1 75 ALA MB 1 77 SER H 6.390 . 6.890 4.808 4.472 5.259 . 0 0 "[ . 1 . 2]" 1
1149 1 75 ALA MB 1 78 ALA H 5.800 . 6.300 4.474 4.286 4.792 . 0 0 "[ . 1 . 2]" 1
1150 1 75 ALA MB 1 79 ALA H 6.610 . 7.110 4.193 4.007 4.470 . 0 0 "[ . 1 . 2]" 1
1151 1 75 ALA O 1 79 ALA H 2.000 . 2.300 1.932 1.837 2.011 . 0 0 "[ . 1 . 2]" 1
1152 1 75 ALA O 1 79 ALA N 3.000 . 3.200 2.926 2.828 3.006 . 0 0 "[ . 1 . 2]" 1
1153 1 76 GLU H 1 77 SER H 5.500 . 6.000 2.585 2.225 2.861 . 0 0 "[ . 1 . 2]" 1
1154 1 76 GLU HA 1 76 GLU HG2 3.340 . 3.840 3.004 2.277 3.373 . 0 0 "[ . 1 . 2]" 1
1155 1 76 GLU HA 1 76 GLU HG3 4.060 . 4.560 3.734 3.510 3.836 . 0 0 "[ . 1 . 2]" 1
1156 1 76 GLU HA 1 79 ALA H 4.010 . 4.510 3.264 2.999 3.724 . 0 0 "[ . 1 . 2]" 1
1157 1 76 GLU HA 1 79 ALA MB 4.160 . 4.660 2.364 2.103 2.694 . 0 0 "[ . 1 . 2]" 1
1158 1 76 GLU HA 1 80 LYS H 4.610 . 5.110 3.851 3.668 4.109 . 0 0 "[ . 1 . 2]" 1
1159 1 76 GLU HB2 1 77 SER H 3.720 . 4.220 2.835 2.350 3.219 . 0 0 "[ . 1 . 2]" 1
1160 1 76 GLU HB2 1 77 SER HB2 5.500 . 6.000 5.065 4.347 5.685 . 0 0 "[ . 1 . 2]" 1
1161 1 76 GLU HB2 1 78 ALA H 5.500 . 6.000 5.127 4.902 5.421 . 0 0 "[ . 1 . 2]" 1
1162 1 76 GLU HB3 1 77 SER H 4.180 . 4.680 3.665 2.955 4.191 . 0 0 "[ . 1 . 2]" 1
1163 1 76 GLU HB3 1 80 LYS H 4.920 . 5.420 4.817 4.478 4.981 . 0 0 "[ . 1 . 2]" 1
1164 1 76 GLU HB3 1 80 LYS QE 6.170 . 6.670 3.785 2.962 5.168 . 0 0 "[ . 1 . 2]" 1
1165 1 76 GLU HG2 1 79 ALA MB 6.610 . 7.110 4.793 3.764 5.385 . 0 0 "[ . 1 . 2]" 1
1166 1 76 GLU O 1 80 LYS H 2.000 . 2.300 1.963 1.851 2.026 . 0 0 "[ . 1 . 2]" 1
1167 1 76 GLU O 1 80 LYS N 3.000 . 3.200 2.967 2.855 3.033 . 0 0 "[ . 1 . 2]" 1
1168 1 77 SER H 1 77 SER HB2 3.920 . 4.420 2.930 2.486 3.621 . 0 0 "[ . 1 . 2]" 1
1169 1 77 SER H 1 77 SER HB3 3.770 . 4.270 2.640 2.198 2.958 . 0 0 "[ . 1 . 2]" 1
1170 1 77 SER H 1 78 ALA H 3.610 . 4.110 2.606 2.391 2.808 . 0 0 "[ . 1 . 2]" 1
1171 1 77 SER H 1 78 ALA MB 5.940 . 6.440 4.276 4.048 4.457 . 0 0 "[ . 1 . 2]" 1
1172 1 77 SER H 1 79 ALA H 4.580 . 5.080 4.219 3.791 4.556 . 0 0 "[ . 1 . 2]" 1
1173 1 77 SER H 1 80 LYS QE 6.170 . 6.670 3.823 3.440 4.448 . 0 0 "[ . 1 . 2]" 1
1174 1 77 SER HA 1 79 ALA H 5.040 . 5.540 4.684 4.482 4.918 . 0 0 "[ . 1 . 2]" 1
1175 1 77 SER HA 1 80 LYS QD 4.000 . 4.500 3.393 2.947 3.629 . 0 0 "[ . 1 . 2]" 1
1176 1 77 SER HA 1 80 LYS QE 5.080 . 5.580 1.956 1.739 2.273 0.061 5 0 "[ . 1 . 2]" 1
1177 1 77 SER HA 1 80 LYS QG 4.230 . 4.730 2.151 2.029 2.419 . 0 0 "[ . 1 . 2]" 1
1178 1 77 SER HB2 1 78 ALA H 4.450 . 4.950 3.804 2.870 4.101 . 0 0 "[ . 1 . 2]" 1
1179 1 77 SER HB2 1 78 ALA MB 6.350 . 6.850 5.135 3.975 5.469 . 0 0 "[ . 1 . 2]" 1
1180 1 77 SER HB2 1 80 LYS QG 5.870 . 6.370 4.226 3.897 4.508 . 0 0 "[ . 1 . 2]" 1
1181 1 77 SER HB3 1 78 ALA H 3.600 . 4.100 3.182 2.743 3.863 . 0 0 "[ . 1 . 2]" 1
1182 1 77 SER O 1 81 ALA H 2.000 . 2.300 1.863 1.774 2.022 0.026 9 0 "[ . 1 . 2]" 1
1183 1 77 SER O 1 81 ALA N 3.000 . 3.200 2.819 2.742 2.986 . 0 0 "[ . 1 . 2]" 1
1184 1 78 ALA H 1 79 ALA H 3.550 . 4.050 2.824 2.706 2.953 . 0 0 "[ . 1 . 2]" 1
1185 1 78 ALA H 1 79 ALA HA 5.500 . 6.000 5.431 5.338 5.534 . 0 0 "[ . 1 . 2]" 1
1186 1 78 ALA H 1 79 ALA MB 5.760 . 6.260 4.373 4.262 4.532 . 0 0 "[ . 1 . 2]" 1
1187 1 78 ALA H 1 80 LYS H 4.770 . 5.270 4.365 4.176 4.550 . 0 0 "[ . 1 . 2]" 1
1188 1 78 ALA H 1 82 ILE MD 6.610 . 7.110 5.212 5.092 5.366 . 0 0 "[ . 1 . 2]" 1
1189 1 78 ALA MB 1 79 ALA H 4.580 . 5.080 2.507 2.344 2.630 . 0 0 "[ . 1 . 2]" 1
1190 1 78 ALA MB 1 79 ALA HA 5.510 . 6.010 4.033 3.926 4.156 . 0 0 "[ . 1 . 2]" 1
1191 1 78 ALA MB 1 80 LYS H 6.610 . 7.110 4.759 4.645 4.880 . 0 0 "[ . 1 . 2]" 1
1192 1 78 ALA MB 1 99 TYR QE 5.220 . 5.720 2.829 2.233 3.863 . 0 0 "[ . 1 . 2]" 1
1193 1 78 ALA O 1 82 ILE H 2.000 . 2.300 1.826 1.794 1.866 0.006 12 0 "[ . 1 . 2]" 1
1194 1 78 ALA O 1 82 ILE N 3.000 . 3.200 2.830 2.796 2.873 . 0 0 "[ . 1 . 2]" 1
1195 1 79 ALA H 1 80 LYS H 3.550 . 4.050 3.030 2.911 3.125 . 0 0 "[ . 1 . 2]" 1
1196 1 79 ALA H 1 80 LYS QB 5.930 . 6.430 5.226 5.051 5.329 . 0 0 "[ . 1 . 2]" 1
1197 1 79 ALA H 1 81 ALA MB 6.610 . 7.110 4.884 4.767 5.091 . 0 0 "[ . 1 . 2]" 1
1198 1 79 ALA H 1 82 ILE MD 6.610 . 7.110 3.546 3.431 3.644 . 0 0 "[ . 1 . 2]" 1
1199 1 79 ALA HA 1 82 ILE HB 3.920 . 4.420 2.943 2.875 3.044 . 0 0 "[ . 1 . 2]" 1
1200 1 79 ALA HA 1 82 ILE MD 5.200 . 5.700 1.966 1.944 1.994 . 0 0 "[ . 1 . 2]" 1
1201 1 79 ALA HA 1 82 ILE HG12 4.770 . 5.270 4.866 4.821 4.914 . 0 0 "[ . 1 . 2]" 1
1202 1 79 ALA HA 1 82 ILE HG13 5.500 . 6.000 4.192 4.141 4.278 . 0 0 "[ . 1 . 2]" 1
1203 1 79 ALA HA 1 82 ILE MG 6.610 . 7.110 4.131 4.055 4.223 . 0 0 "[ . 1 . 2]" 1
1204 1 79 ALA HA 1 83 GLU H 4.560 . 5.060 4.177 4.120 4.254 . 0 0 "[ . 1 . 2]" 1
1205 1 79 ALA HA 1 99 TYR QE 6.160 . 6.660 4.757 4.132 5.468 . 0 0 "[ . 1 . 2]" 1
1206 1 79 ALA MB 1 80 LYS H 4.190 . 4.690 2.451 2.328 2.548 . 0 0 "[ . 1 . 2]" 1
1207 1 79 ALA MB 1 80 LYS QE 7.410 . 7.910 4.974 4.572 5.534 . 0 0 "[ . 1 . 2]" 1
1208 1 79 ALA MB 1 82 ILE MD 5.910 . 6.410 3.436 3.396 3.492 . 0 0 "[ . 1 . 2]" 1
1209 1 79 ALA MB 1 83 GLU H 6.340 . 6.840 4.761 4.713 4.804 . 0 0 "[ . 1 . 2]" 1
1210 1 79 ALA MB 1 83 GLU QB 7.090 . 7.590 4.938 4.867 5.005 . 0 0 "[ . 1 . 2]" 1
1211 1 79 ALA MB 1 99 TYR QE 7.230 . 7.730 4.703 4.163 5.358 . 0 0 "[ . 1 . 2]" 1
1212 1 79 ALA O 1 83 GLU H 2.000 . 2.300 2.069 2.041 2.085 . 0 0 "[ . 1 . 2]" 1
1213 1 79 ALA O 1 83 GLU N 3.000 . 3.200 3.086 3.057 3.102 . 0 0 "[ . 1 . 2]" 1
1214 1 80 LYS H 1 80 LYS QB 3.330 . 3.830 2.461 2.255 2.590 . 0 0 "[ . 1 . 2]" 1
1215 1 80 LYS H 1 80 LYS QD 4.830 . 5.330 4.256 4.052 4.404 . 0 0 "[ . 1 . 2]" 1
1216 1 80 LYS H 1 80 LYS QE 6.170 . 6.670 3.876 3.399 4.419 . 0 0 "[ . 1 . 2]" 1
1217 1 80 LYS H 1 80 LYS QG 4.130 . 4.630 2.541 2.266 3.023 . 0 0 "[ . 1 . 2]" 1
1218 1 80 LYS H 1 81 ALA HA 5.390 . 5.890 5.361 5.302 5.400 . 0 0 "[ . 1 . 2]" 1
1219 1 80 LYS H 1 81 ALA MB 6.180 . 6.680 4.441 4.376 4.516 . 0 0 "[ . 1 . 2]" 1
1220 1 80 LYS H 1 82 ILE MD 6.610 . 7.110 4.725 4.681 4.762 . 0 0 "[ . 1 . 2]" 1
1221 1 80 LYS HA 1 80 LYS QG 3.810 . 4.310 3.362 3.340 3.387 . 0 0 "[ . 1 . 2]" 1
1222 1 80 LYS HA 1 81 ALA MB 6.610 . 7.110 5.034 5.004 5.071 . 0 0 "[ . 1 . 2]" 1
1223 1 80 LYS HA 1 82 ILE H 4.500 . 5.000 4.379 4.305 4.467 . 0 0 "[ . 1 . 2]" 1
1224 1 80 LYS HA 1 82 ILE MD 6.340 . 6.840 5.422 5.386 5.459 . 0 0 "[ . 1 . 2]" 1
1225 1 80 LYS HA 1 83 GLU H 4.390 . 4.890 3.225 3.092 3.368 . 0 0 "[ . 1 . 2]" 1
1226 1 80 LYS HA 1 83 GLU QB 3.510 . 4.010 2.587 2.452 2.789 . 0 0 "[ . 1 . 2]" 1
1227 1 80 LYS HA 1 84 GLU H 4.640 . 5.140 3.945 3.848 4.103 . 0 0 "[ . 1 . 2]" 1
1228 1 80 LYS HA 1 84 GLU HG2 4.610 . 5.110 3.884 3.722 4.034 . 0 0 "[ . 1 . 2]" 1
1229 1 80 LYS QB 1 81 ALA H 3.850 . 4.350 3.533 3.508 3.566 . 0 0 "[ . 1 . 2]" 1
1230 1 80 LYS QE 1 81 ALA H 6.170 . 6.670 4.471 4.026 4.841 . 0 0 "[ . 1 . 2]" 1
1231 1 80 LYS QG 1 81 ALA H 5.490 . 5.990 2.302 2.252 2.372 . 0 0 "[ . 1 . 2]" 1
1232 1 80 LYS QG 1 81 ALA HA 3.540 . 4.040 3.310 3.254 3.358 . 0 0 "[ . 1 . 2]" 1
1233 1 80 LYS QG 1 84 GLU HG2 5.050 . 5.550 3.975 3.453 4.468 . 0 0 "[ . 1 . 2]" 1
1234 1 80 LYS QG 1 84 GLU HG3 5.330 . 5.830 3.238 2.696 3.790 . 0 0 "[ . 1 . 2]" 1
1235 1 80 LYS O 1 84 GLU H 2.000 . 2.300 1.935 1.882 2.030 . 0 0 "[ . 1 . 2]" 1
1236 1 80 LYS O 1 84 GLU N 3.000 . 3.200 2.792 2.744 2.837 . 0 0 "[ . 1 . 2]" 1
1237 1 81 ALA H 1 82 ILE MD 5.630 . 6.130 4.747 4.730 4.761 . 0 0 "[ . 1 . 2]" 1
1238 1 81 ALA HA 1 84 GLU HB2 5.500 . 6.000 2.469 2.316 2.649 . 0 0 "[ . 1 . 2]" 1
1239 1 81 ALA MB 1 82 ILE H 4.950 . 5.450 2.521 2.434 2.642 . 0 0 "[ . 1 . 2]" 1
1240 1 81 ALA MB 1 84 GLU H 6.610 . 7.110 4.600 4.527 4.729 . 0 0 "[ . 1 . 2]" 1
1241 1 81 ALA MB 1 84 GLU HB2 5.670 . 6.170 4.017 3.920 4.111 . 0 0 "[ . 1 . 2]" 1
1242 1 81 ALA MB 1 84 GLU HB3 6.610 . 7.110 5.231 5.120 5.352 . 0 0 "[ . 1 . 2]" 1
1243 1 81 ALA MB 1 85 VAL H 6.280 . 6.780 4.595 4.448 4.820 . 0 0 "[ . 1 . 2]" 1
1244 1 82 ILE H 1 82 ILE HB 3.350 . 3.850 2.506 2.460 2.543 . 0 0 "[ . 1 . 2]" 1
1245 1 82 ILE H 1 82 ILE MD 4.830 . 5.330 3.064 2.956 3.121 . 0 0 "[ . 1 . 2]" 1
1246 1 82 ILE H 1 82 ILE HG12 4.060 . 4.560 3.820 3.722 3.945 . 0 0 "[ . 1 . 2]" 1
1247 1 82 ILE H 1 82 ILE HG13 3.760 . 4.260 2.395 2.279 2.562 . 0 0 "[ . 1 . 2]" 1
1248 1 82 ILE H 1 83 GLU H 3.620 . 4.120 2.990 2.917 3.072 . 0 0 "[ . 1 . 2]" 1
1249 1 82 ILE H 1 83 GLU QB 6.010 . 6.510 4.916 4.793 5.015 . 0 0 "[ . 1 . 2]" 1
1250 1 82 ILE H 1 85 VAL H 5.500 . 6.000 4.889 4.805 5.060 . 0 0 "[ . 1 . 2]" 1
1251 1 82 ILE H 1 86 HIS HB2 5.480 . 5.980 4.703 4.621 4.799 . 0 0 "[ . 1 . 2]" 1
1252 1 82 ILE H 1 97 VAL MG1 5.560 . 6.060 2.962 2.938 2.995 . 0 0 "[ . 1 . 2]" 1
1253 1 82 ILE H 1 97 VAL MG2 6.560 . 7.060 5.460 5.243 5.516 . 0 0 "[ . 1 . 2]" 1
1254 1 82 ILE HA 1 82 ILE HG12 3.560 . 4.060 2.921 2.875 2.990 . 0 0 "[ . 1 . 2]" 1
1255 1 82 ILE HA 1 82 ILE HG13 3.810 . 4.310 2.677 2.600 2.723 . 0 0 "[ . 1 . 2]" 1
1256 1 82 ILE HA 1 83 GLU QB 6.170 . 6.670 5.509 5.473 5.522 . 0 0 "[ . 1 . 2]" 1
1257 1 82 ILE HA 1 84 GLU H 5.330 . 5.830 4.258 4.143 4.379 . 0 0 "[ . 1 . 2]" 1
1258 1 82 ILE HA 1 85 VAL H 4.600 . 5.100 3.786 3.683 3.927 . 0 0 "[ . 1 . 2]" 1
1259 1 82 ILE HA 1 86 HIS H 4.190 . 4.690 2.836 2.643 3.099 . 0 0 "[ . 1 . 2]" 1
1260 1 82 ILE HA 1 97 VAL HB 3.860 . 4.360 2.984 2.868 3.085 . 0 0 "[ . 1 . 2]" 1
1261 1 82 ILE HA 1 97 VAL MG1 4.370 . 4.870 2.516 2.377 2.673 . 0 0 "[ . 1 . 2]" 1
1262 1 82 ILE HA 1 97 VAL MG2 5.380 . 5.880 4.284 4.153 4.386 . 0 0 "[ . 1 . 2]" 1
1263 1 82 ILE HB 1 83 GLU H 3.500 . 4.000 2.324 2.270 2.367 . 0 0 "[ . 1 . 2]" 1
1264 1 82 ILE HB 1 83 GLU HA 4.570 . 5.070 4.392 4.325 4.425 . 0 0 "[ . 1 . 2]" 1
1265 1 82 ILE HB 1 84 GLU H 5.190 . 5.690 4.771 4.736 4.802 . 0 0 "[ . 1 . 2]" 1
1266 1 82 ILE MD 1 83 GLU H 4.850 . 5.350 4.039 3.997 4.054 . 0 0 "[ . 1 . 2]" 1
1267 1 82 ILE MD 1 83 GLU QB 7.410 . 7.910 5.510 5.499 5.520 . 0 0 "[ . 1 . 2]" 1
1268 1 82 ILE MD 1 83 GLU HG2 5.260 . 5.760 4.422 4.408 4.435 . 0 0 "[ . 1 . 2]" 1
1269 1 82 ILE MD 1 98 VAL HB 5.820 . 6.320 4.837 4.777 4.890 . 0 0 "[ . 1 . 2]" 1
1270 1 82 ILE MD 1 98 VAL MG2 5.700 . 6.200 3.068 2.963 3.222 . 0 0 "[ . 1 . 2]" 1
1271 1 82 ILE MD 1 99 TYR QE 6.690 . 7.190 2.876 2.521 3.257 . 0 0 "[ . 1 . 2]" 1
1272 1 82 ILE HG12 1 83 GLU H 5.500 . 6.000 5.028 4.986 5.065 . 0 0 "[ . 1 . 2]" 1
1273 1 82 ILE HG12 1 97 VAL HB 5.210 . 5.710 4.425 4.275 4.590 . 0 0 "[ . 1 . 2]" 1
1274 1 82 ILE HG12 1 97 VAL MG1 4.280 . 4.780 3.582 3.571 3.609 . 0 0 "[ . 1 . 2]" 1
1275 1 82 ILE HG13 1 83 GLU H 4.930 . 5.430 4.510 4.428 4.605 . 0 0 "[ . 1 . 2]" 1
1276 1 82 ILE HG13 1 97 VAL HB 5.030 . 5.530 4.296 4.066 4.468 . 0 0 "[ . 1 . 2]" 1
1277 1 82 ILE HG13 1 97 VAL MG1 5.210 . 5.710 2.611 2.460 2.746 . 0 0 "[ . 1 . 2]" 1
1278 1 82 ILE HG13 1 98 VAL MG2 4.410 . 4.910 3.716 3.676 3.777 . 0 0 "[ . 1 . 2]" 1
1279 1 82 ILE HG13 1 99 TYR QE 6.090 . 6.590 5.159 4.879 5.455 . 0 0 "[ . 1 . 2]" 1
1280 1 82 ILE MG 1 83 GLU H 6.610 . 7.110 3.016 2.915 3.073 . 0 0 "[ . 1 . 2]" 1
1281 1 82 ILE MG 1 83 GLU HG3 6.610 . 7.110 4.636 4.418 4.787 . 0 0 "[ . 1 . 2]" 1
1282 1 82 ILE MG 1 86 HIS HB2 6.470 . 6.970 2.632 2.528 2.713 . 0 0 "[ . 1 . 2]" 1
1283 1 82 ILE MG 1 86 HIS HE1 6.610 . 7.110 4.723 4.551 4.872 . 0 0 "[ . 1 . 2]" 1
1284 1 82 ILE MG 1 98 VAL MG2 5.020 . 5.520 3.249 2.992 3.489 . 0 0 "[ . 1 . 2]" 1
1285 1 83 GLU H 1 83 GLU QB 3.390 . 3.890 2.395 2.383 2.410 . 0 0 "[ . 1 . 2]" 1
1286 1 83 GLU H 1 83 GLU HG2 4.000 . 4.500 2.257 2.234 2.285 . 0 0 "[ . 1 . 2]" 1
1287 1 83 GLU H 1 83 GLU HG3 3.890 . 4.390 3.568 3.385 3.623 . 0 0 "[ . 1 . 2]" 1
1288 1 83 GLU H 1 84 GLU H 3.570 . 4.070 2.812 2.771 2.846 . 0 0 "[ . 1 . 2]" 1
1289 1 83 GLU H 1 84 GLU HB2 5.090 . 5.590 4.885 4.836 4.933 . 0 0 "[ . 1 . 2]" 1
1290 1 83 GLU H 1 85 VAL H 4.920 . 5.420 4.578 4.524 4.668 . 0 0 "[ . 1 . 2]" 1
1291 1 83 GLU HA 1 83 GLU HG2 3.810 . 4.310 2.969 2.804 3.041 . 0 0 "[ . 1 . 2]" 1
1292 1 83 GLU HA 1 83 GLU HG3 3.650 . 4.150 3.712 3.700 3.745 . 0 0 "[ . 1 . 2]" 1
1293 1 83 GLU HA 1 86 HIS HB3 5.500 . 6.000 4.510 4.332 4.782 . 0 0 "[ . 1 . 2]" 1
1294 1 83 GLU QB 1 84 GLU H 3.770 . 4.270 3.008 2.814 3.121 . 0 0 "[ . 1 . 2]" 1
1295 1 83 GLU QB 1 84 GLU HA 4.960 . 5.460 4.160 4.003 4.238 . 0 0 "[ . 1 . 2]" 1
1296 1 83 GLU HG2 1 84 GLU H 5.110 . 5.610 4.647 4.558 4.716 . 0 0 "[ . 1 . 2]" 1
1297 1 84 GLU H 1 84 GLU HB2 3.400 . 3.900 2.319 2.294 2.361 . 0 0 "[ . 1 . 2]" 1
1298 1 84 GLU H 1 84 GLU HB3 3.780 . 4.280 3.576 3.562 3.595 . 0 0 "[ . 1 . 2]" 1
1299 1 84 GLU H 1 84 GLU HG2 3.760 . 4.260 2.765 2.573 2.868 . 0 0 "[ . 1 . 2]" 1
1300 1 84 GLU H 1 85 VAL H 3.480 . 3.980 2.565 2.477 2.688 . 0 0 "[ . 1 . 2]" 1
1301 1 84 GLU H 1 85 VAL MG1 5.550 . 6.050 3.969 3.827 4.208 . 0 0 "[ . 1 . 2]" 1
1302 1 84 GLU H 1 86 HIS H 5.100 . 5.600 3.955 3.866 4.040 . 0 0 "[ . 1 . 2]" 1
1303 1 84 GLU H 1 86 HIS HB2 5.470 . 5.970 5.596 5.576 5.632 . 0 0 "[ . 1 . 2]" 1
1304 1 84 GLU HA 1 84 GLU HG2 3.480 . 3.980 2.763 2.700 2.945 . 0 0 "[ . 1 . 2]" 1
1305 1 84 GLU HA 1 84 GLU HG3 3.790 . 4.290 3.803 3.788 3.822 . 0 0 "[ . 1 . 2]" 1
1306 1 84 GLU HA 1 85 VAL MG1 5.930 . 6.430 4.648 4.502 4.808 . 0 0 "[ . 1 . 2]" 1
1307 1 84 GLU HA 1 86 HIS H 5.470 . 5.970 5.305 5.221 5.365 . 0 0 "[ . 1 . 2]" 1
1308 1 84 GLU HB2 1 84 GLU HG2 2.750 . 3.250 2.634 2.533 2.668 . 0 0 "[ . 1 . 2]" 1
1309 1 84 GLU HB2 1 85 VAL H 3.520 . 4.020 2.658 2.527 2.741 . 0 0 "[ . 1 . 2]" 1
1310 1 84 GLU HB2 1 85 VAL MG1 4.860 . 5.360 2.651 2.521 2.800 . 0 0 "[ . 1 . 2]" 1
1311 1 84 GLU HB3 1 85 VAL H 4.350 . 4.850 3.473 3.380 3.555 . 0 0 "[ . 1 . 2]" 1
1312 1 84 GLU HB3 1 85 VAL MG1 5.160 . 5.660 3.175 2.940 3.360 . 0 0 "[ . 1 . 2]" 1
1313 1 84 GLU HG2 1 85 VAL MG1 5.990 . 6.490 5.026 4.817 5.150 . 0 0 "[ . 1 . 2]" 1
1314 1 84 GLU HG3 1 85 VAL MG1 6.030 . 6.530 4.459 4.288 4.603 . 0 0 "[ . 1 . 2]" 1
1315 1 85 VAL H 1 85 VAL HB 3.960 . 4.460 3.195 3.079 3.276 . 0 0 "[ . 1 . 2]" 1
1316 1 85 VAL H 1 85 VAL MG1 4.280 . 4.780 2.389 2.352 2.464 . 0 0 "[ . 1 . 2]" 1
1317 1 85 VAL H 1 86 HIS H 3.310 . 3.810 2.087 2.050 2.164 . 0 0 "[ . 1 . 2]" 1
1318 1 85 VAL H 1 86 HIS HA 5.500 . 6.000 4.742 4.699 4.773 . 0 0 "[ . 1 . 2]" 1
1319 1 85 VAL H 1 86 HIS HB2 4.570 . 5.070 4.363 4.293 4.446 . 0 0 "[ . 1 . 2]" 1
1320 1 85 VAL H 1 86 HIS HB3 4.530 . 5.030 4.548 4.528 4.566 . 0 0 "[ . 1 . 2]" 1
1321 1 85 VAL HA 1 88 LYS H 4.450 . 4.950 3.921 3.769 4.076 . 0 0 "[ . 1 . 2]" 1
1322 1 85 VAL HA 1 88 LYS HB3 4.210 . 4.710 3.667 3.307 3.878 . 0 0 "[ . 1 . 2]" 1
1323 1 85 VAL HA 1 88 LYS QE 5.740 . 6.240 2.263 1.887 2.588 . 0 0 "[ . 1 . 2]" 1
1324 1 85 VAL HA 1 88 LYS HG2 4.200 . 4.700 2.622 2.231 3.044 . 0 0 "[ . 1 . 2]" 1
1325 1 85 VAL HA 1 95 LEU MD2 6.610 . 7.110 4.136 3.959 4.496 . 0 0 "[ . 1 . 2]" 1
1326 1 85 VAL HB 1 86 HIS H 4.440 . 4.940 4.521 4.478 4.543 . 0 0 "[ . 1 . 2]" 1
1327 1 85 VAL MG1 1 86 HIS H 5.080 . 5.580 3.177 2.944 3.413 . 0 0 "[ . 1 . 2]" 1
1328 1 85 VAL MG1 1 86 HIS HA 5.800 . 6.300 3.994 3.804 4.095 . 0 0 "[ . 1 . 2]" 1
1329 1 85 VAL MG1 1 88 LYS QE 7.280 . 7.780 4.512 4.105 4.765 . 0 0 "[ . 1 . 2]" 1
1330 1 85 VAL MG2 1 86 HIS H 5.380 . 5.880 4.265 4.100 4.433 . 0 0 "[ . 1 . 2]" 1
1331 1 85 VAL MG2 1 88 LYS H 6.610 . 7.110 4.066 3.875 4.317 . 0 0 "[ . 1 . 2]" 1
1332 1 86 HIS H 1 86 HIS HB2 3.090 . 3.590 2.567 2.522 2.630 . 0 0 "[ . 1 . 2]" 1
1333 1 86 HIS H 1 86 HIS HB3 3.670 . 4.170 2.628 2.554 2.688 . 0 0 "[ . 1 . 2]" 1
1334 1 86 HIS H 1 86 HIS HD2 5.440 . 5.940 5.083 4.993 5.123 . 0 0 "[ . 1 . 2]" 1
1335 1 86 HIS H 1 87 GLY H 4.710 . 5.210 4.499 4.458 4.544 . 0 0 "[ . 1 . 2]" 1
1336 1 86 HIS H 1 88 LYS H 5.460 . 5.960 4.578 4.330 4.795 . 0 0 "[ . 1 . 2]" 1
1337 1 86 HIS H 1 97 VAL H 5.500 . 6.000 5.057 4.812 5.258 . 0 0 "[ . 1 . 2]" 1
1338 1 86 HIS H 1 97 VAL HB 4.580 . 5.080 3.444 3.258 3.725 . 0 0 "[ . 1 . 2]" 1
1339 1 86 HIS H 1 97 VAL MG1 5.810 . 6.310 3.565 3.336 4.070 . 0 0 "[ . 1 . 2]" 1
1340 1 86 HIS HA 1 86 HIS HD2 4.450 . 4.950 3.866 3.732 3.965 . 0 0 "[ . 1 . 2]" 1
1341 1 86 HIS HA 1 86 HIS HE1 5.500 . 6.000 5.274 5.156 5.402 . 0 0 "[ . 1 . 2]" 1
1342 1 86 HIS HA 1 87 GLY H 3.060 . 3.560 2.177 2.113 2.205 . 0 0 "[ . 1 . 2]" 1
1343 1 86 HIS HA 1 88 LYS H 4.280 . 4.780 3.617 3.480 3.757 . 0 0 "[ . 1 . 2]" 1
1344 1 86 HIS HA 1 95 LEU MD1 6.610 . 7.110 5.451 5.258 5.573 . 0 0 "[ . 1 . 2]" 1
1345 1 86 HIS HA 1 95 LEU MD2 6.610 . 7.110 4.477 4.219 4.698 . 0 0 "[ . 1 . 2]" 1
1346 1 86 HIS HA 1 96 GLU HA 4.540 . 5.040 4.018 3.812 4.233 . 0 0 "[ . 1 . 2]" 1
1347 1 86 HIS HA 1 97 VAL H 4.260 . 4.760 2.773 2.636 2.881 . 0 0 "[ . 1 . 2]" 1
1348 1 86 HIS HA 1 97 VAL HB 4.120 . 4.620 2.620 2.390 2.915 . 0 0 "[ . 1 . 2]" 1
1349 1 86 HIS HA 1 97 VAL MG1 6.530 . 7.030 4.072 3.848 4.426 . 0 0 "[ . 1 . 2]" 1
1350 1 86 HIS HA 1 97 VAL MG2 4.400 . 4.900 3.028 2.832 3.355 . 0 0 "[ . 1 . 2]" 1
1351 1 86 HIS HB2 1 96 GLU HA 5.500 . 6.000 4.882 4.648 5.092 . 0 0 "[ . 1 . 2]" 1
1352 1 86 HIS HB2 1 97 VAL H 4.930 . 5.430 3.598 3.374 3.754 . 0 0 "[ . 1 . 2]" 1
1353 1 86 HIS HB2 1 97 VAL HB 3.510 . 4.010 2.288 2.193 2.419 . 0 0 "[ . 1 . 2]" 1
1354 1 86 HIS HB2 1 97 VAL MG2 4.800 . 5.300 3.851 3.718 4.009 . 0 0 "[ . 1 . 2]" 1
1355 1 86 HIS HD2 1 87 GLY HA3 5.500 . 6.000 2.849 2.755 2.981 . 0 0 "[ . 1 . 2]" 1
1356 1 86 HIS HD2 1 98 VAL MG2 6.610 . 7.110 5.100 4.862 5.292 . 0 0 "[ . 1 . 2]" 1
1357 1 86 HIS HE1 1 96 GLU HA 4.110 . 4.610 3.015 2.919 3.130 . 0 0 "[ . 1 . 2]" 1
1358 1 86 HIS HE1 1 96 GLU HB2 5.360 . 5.860 4.802 4.579 4.998 . 0 0 "[ . 1 . 2]" 1
1359 1 86 HIS HE1 1 96 GLU HB3 5.270 . 5.770 5.106 4.755 5.290 . 0 0 "[ . 1 . 2]" 1
1360 1 86 HIS HE1 1 96 GLU HG2 4.760 . 5.260 3.153 2.352 3.833 . 0 0 "[ . 1 . 2]" 1
1361 1 86 HIS HE1 1 96 GLU HG3 4.750 . 5.250 2.864 2.493 3.240 . 0 0 "[ . 1 . 2]" 1
1362 1 86 HIS HE1 1 98 VAL MG1 6.610 . 7.110 3.219 2.845 3.552 . 0 0 "[ . 1 . 2]" 1
1363 1 86 HIS HE1 1 98 VAL MG2 6.300 . 6.800 2.333 2.239 2.433 . 0 0 "[ . 1 . 2]" 1
1364 1 87 GLY H 1 88 LYS H 3.560 . 4.060 2.316 2.147 2.484 . 0 0 "[ . 1 . 2]" 1
1365 1 87 GLY H 1 88 LYS HB3 5.200 . 5.700 5.483 5.417 5.519 . 0 0 "[ . 1 . 2]" 1
1366 1 87 GLY H 1 88 LYS QD 5.030 . 5.530 4.047 3.550 4.580 . 0 0 "[ . 1 . 2]" 1
1367 1 87 GLY H 1 94 PRO HB2 5.330 . 5.830 3.480 2.994 4.100 . 0 0 "[ . 1 . 2]" 1
1368 1 87 GLY H 1 95 LEU HB2 4.910 . 5.410 2.683 2.297 3.089 . 0 0 "[ . 1 . 2]" 1
1369 1 87 GLY H 1 95 LEU HB3 4.610 . 5.110 3.773 3.361 4.216 . 0 0 "[ . 1 . 2]" 1
1370 1 87 GLY H 1 96 GLU HA 4.290 . 4.790 4.291 4.173 4.350 . 0 0 "[ . 1 . 2]" 1
1371 1 87 GLY H 1 97 VAL H 4.910 . 5.410 4.065 3.875 4.263 . 0 0 "[ . 1 . 2]" 1
1372 1 87 GLY H 1 97 VAL HB 4.870 . 5.370 4.705 4.454 4.943 . 0 0 "[ . 1 . 2]" 1
1373 1 87 GLY H 1 97 VAL MG2 5.580 . 6.080 4.335 4.071 4.655 . 0 0 "[ . 1 . 2]" 1
1374 1 87 GLY HA2 1 94 PRO HB2 4.420 . 4.920 2.319 2.154 2.894 . 0 0 "[ . 1 . 2]" 1
1375 1 87 GLY HA2 1 94 PRO HB3 4.310 . 4.810 3.065 2.352 3.222 . 0 0 "[ . 1 . 2]" 1
1376 1 87 GLY HA2 1 94 PRO HG2 5.500 . 6.000 4.309 4.035 4.457 . 0 0 "[ . 1 . 2]" 1
1377 1 87 GLY HA2 1 95 LEU H 5.500 . 6.000 3.913 3.246 4.416 . 0 0 "[ . 1 . 2]" 1
1378 1 87 GLY HA3 1 94 PRO HB2 4.590 . 5.090 4.022 3.853 4.624 . 0 0 "[ . 1 . 2]" 1
1379 1 87 GLY HA3 1 94 PRO HB3 4.410 . 4.910 4.373 3.841 4.479 . 0 0 "[ . 1 . 2]" 1
1380 1 87 GLY HA3 1 94 PRO HG3 5.500 . 6.000 5.490 5.305 5.566 . 0 0 "[ . 1 . 2]" 1
1381 1 88 LYS H 1 88 LYS HB2 3.460 . 3.960 2.110 1.970 2.183 . 0 0 "[ . 1 . 2]" 1
1382 1 88 LYS H 1 88 LYS HB3 3.310 . 3.810 3.373 3.268 3.424 . 0 0 "[ . 1 . 2]" 1
1383 1 88 LYS H 1 88 LYS HG2 4.020 . 4.520 4.020 3.894 4.135 . 0 0 "[ . 1 . 2]" 1
1384 1 88 LYS H 1 88 LYS HG3 4.110 . 4.610 3.984 3.814 4.122 . 0 0 "[ . 1 . 2]" 1
1385 1 88 LYS H 1 94 PRO HA 4.950 . 5.450 4.494 4.041 4.827 . 0 0 "[ . 1 . 2]" 1
1386 1 88 LYS H 1 95 LEU H 5.000 . 5.500 3.551 3.141 3.828 . 0 0 "[ . 1 . 2]" 1
1387 1 88 LYS H 1 95 LEU HB3 4.940 . 5.440 4.981 4.555 5.094 . 0 0 "[ . 1 . 2]" 1
1388 1 88 LYS H 1 95 LEU MD2 6.210 . 6.710 3.686 2.905 4.642 . 0 0 "[ . 1 . 2]" 1
1389 1 88 LYS HA 1 88 LYS QD 3.740 . 4.240 2.826 2.317 3.001 . 0 0 "[ . 1 . 2]" 1
1390 1 88 LYS HA 1 88 LYS QE 5.260 . 5.760 4.412 4.023 4.602 . 0 0 "[ . 1 . 2]" 1
1391 1 88 LYS HA 1 88 LYS HG2 4.000 . 4.500 3.701 3.592 3.771 . 0 0 "[ . 1 . 2]" 1
1392 1 88 LYS HA 1 88 LYS HG3 2.960 . 3.460 2.505 2.352 2.598 . 0 0 "[ . 1 . 2]" 1
1393 1 88 LYS HA 1 95 LEU MD2 6.610 . 7.110 4.882 4.533 5.569 . 0 0 "[ . 1 . 2]" 1
1394 1 88 LYS HB2 1 89 SER H 4.040 . 4.540 4.086 2.508 4.215 . 0 0 "[ . 1 . 2]" 1
1395 1 88 LYS HB2 1 95 LEU MD2 5.800 . 6.300 3.056 2.600 3.979 . 0 0 "[ . 1 . 2]" 1
1396 1 88 LYS HB3 1 89 SER H 4.420 . 4.920 3.059 2.357 3.176 . 0 0 "[ . 1 . 2]" 1
1397 1 88 LYS HB3 1 90 PHE QD 5.960 . 6.460 5.342 5.279 5.409 . 0 0 "[ . 1 . 2]" 1
1398 1 88 LYS HB3 1 95 LEU MD2 5.400 . 5.900 3.572 3.300 4.059 . 0 0 "[ . 1 . 2]" 1
1399 1 88 LYS QE 1 95 LEU MD2 7.410 . 7.910 5.350 4.699 5.602 . 0 0 "[ . 1 . 2]" 1
1400 1 88 LYS HG2 1 89 SER H 5.070 . 5.570 4.974 4.553 5.140 . 0 0 "[ . 1 . 2]" 1
1401 1 88 LYS HG3 1 89 SER H 4.410 . 4.910 3.970 3.638 4.503 . 0 0 "[ . 1 . 2]" 1
1402 1 89 SER H 1 90 PHE H 5.380 . 5.880 4.320 3.343 4.515 . 0 0 "[ . 1 . 2]" 1
1403 1 89 SER H 1 90 PHE HA 5.500 . 6.000 5.358 4.923 5.506 . 0 0 "[ . 1 . 2]" 1
1404 1 89 SER HA 1 94 PRO HA 5.500 . 6.000 2.071 1.898 2.168 . 0 0 "[ . 1 . 2]" 1
1405 1 89 SER HA 1 95 LEU H 5.500 . 6.000 3.848 3.491 4.090 . 0 0 "[ . 1 . 2]" 1
1406 1 89 SER HA 1 95 LEU MD2 6.610 . 7.110 3.945 3.039 4.837 . 0 0 "[ . 1 . 2]" 1
1407 1 89 SER HB2 1 90 PHE H 4.000 . 4.500 3.987 3.723 4.161 . 0 0 "[ . 1 . 2]" 1
1408 1 89 SER HB2 1 93 GLN H 4.820 . 5.320 4.206 3.725 4.876 . 0 0 "[ . 1 . 2]" 1
1409 1 89 SER HB2 1 93 GLN HA 5.400 . 5.900 3.860 3.354 4.804 . 0 0 "[ . 1 . 2]" 1
1410 1 90 PHE H 1 90 PHE HB2 4.170 . 4.670 2.684 2.581 2.938 . 0 0 "[ . 1 . 2]" 1
1411 1 90 PHE H 1 90 PHE HB3 4.000 . 4.500 2.594 2.528 2.654 . 0 0 "[ . 1 . 2]" 1
1412 1 90 PHE H 1 91 ALA MB 6.610 . 7.110 4.955 4.764 5.100 . 0 0 "[ . 1 . 2]" 1
1413 1 90 PHE H 1 92 ASN H 5.410 . 5.910 4.449 4.123 4.641 . 0 0 "[ . 1 . 2]" 1
1414 1 90 PHE H 1 93 GLN H 3.860 . 4.360 3.566 3.127 3.723 . 0 0 "[ . 1 . 2]" 1
1415 1 90 PHE H 1 93 GLN O 2.000 . 2.500 2.155 2.016 2.236 . 0 0 "[ . 1 . 2]" 1
1416 1 90 PHE H 1 94 PRO HA 4.070 . 4.570 2.738 2.647 2.899 . 0 0 "[ . 1 . 2]" 1
1417 1 90 PHE H 1 95 LEU H 4.600 . 5.100 3.739 3.364 4.434 . 0 0 "[ . 1 . 2]" 1
1418 1 90 PHE H 1 95 LEU MD1 6.050 . 6.550 3.304 2.297 3.860 . 0 0 "[ . 1 . 2]" 1
1419 1 90 PHE H 1 95 LEU MD2 6.430 . 6.930 2.723 2.318 3.608 . 0 0 "[ . 1 . 2]" 1
1420 1 90 PHE H 1 95 LEU HG 5.020 . 5.520 5.324 5.248 5.404 . 0 0 "[ . 1 . 2]" 1
1421 1 90 PHE HA 1 90 PHE HZ 5.500 . 6.000 5.591 5.540 5.637 . 0 0 "[ . 1 . 2]" 1
1422 1 90 PHE HA 1 91 ALA MB 6.440 . 6.940 4.241 4.191 4.331 . 0 0 "[ . 1 . 2]" 1
1423 1 90 PHE HA 1 92 ASN H 5.500 . 6.000 4.606 4.432 4.736 . 0 0 "[ . 1 . 2]" 1
1424 1 90 PHE HA 1 93 GLN H 5.500 . 6.000 4.816 4.595 4.931 . 0 0 "[ . 1 . 2]" 1
1425 1 90 PHE HA 1 95 LEU MD1 6.060 . 6.560 4.795 4.134 5.128 . 0 0 "[ . 1 . 2]" 1
1426 1 90 PHE HA 1 95 LEU MD2 5.570 . 6.070 3.986 3.798 4.273 . 0 0 "[ . 1 . 2]" 1
1427 1 90 PHE HB2 1 91 ALA MB 6.610 . 7.110 5.058 4.977 5.180 . 0 0 "[ . 1 . 2]" 1
1428 1 90 PHE HB2 1 95 LEU H 5.490 . 5.990 4.839 4.587 5.516 . 0 0 "[ . 1 . 2]" 1
1429 1 90 PHE HB2 1 95 LEU MD1 4.860 . 5.360 3.022 2.420 3.319 . 0 0 "[ . 1 . 2]" 1
1430 1 90 PHE HB2 1 95 LEU MD2 4.740 . 5.240 2.016 1.948 2.146 . 0 0 "[ . 1 . 2]" 1
1431 1 90 PHE HB2 1 95 LEU HG 4.490 . 4.990 4.256 4.087 4.400 . 0 0 "[ . 1 . 2]" 1
1432 1 90 PHE HB3 1 91 ALA MB 6.410 . 6.910 4.008 3.815 4.195 . 0 0 "[ . 1 . 2]" 1
1433 1 90 PHE HB3 1 94 PRO HA 4.610 . 5.110 4.806 4.744 4.880 . 0 0 "[ . 1 . 2]" 1
1434 1 90 PHE HB3 1 95 LEU HB2 5.500 . 6.000 5.431 5.006 5.655 . 0 0 "[ . 1 . 2]" 1
1435 1 90 PHE HB3 1 95 LEU MD1 4.610 . 5.110 2.432 1.961 2.726 . 0 0 "[ . 1 . 2]" 1
1436 1 90 PHE HB3 1 95 LEU MD2 4.900 . 5.400 2.529 2.352 2.821 . 0 0 "[ . 1 . 2]" 1
1437 1 90 PHE HB3 1 95 LEU HG 4.450 . 4.950 4.394 4.155 4.577 . 0 0 "[ . 1 . 2]" 1
1438 1 90 PHE QD 1 91 ALA HA 5.600 . 6.100 3.879 3.613 4.193 . 0 0 "[ . 1 . 2]" 1
1439 1 90 PHE QD 1 91 ALA MB 4.890 . 5.390 2.292 2.148 2.472 . 0 0 "[ . 1 . 2]" 1
1440 1 90 PHE QD 1 95 LEU MD1 6.130 . 6.630 3.815 3.464 4.040 . 0 0 "[ . 1 . 2]" 1
1441 1 90 PHE QD 1 95 LEU MD2 6.500 . 7.000 3.058 2.742 3.528 . 0 0 "[ . 1 . 2]" 1
1442 1 90 PHE QD 1 95 LEU HG 6.040 . 6.540 5.072 4.636 5.398 . 0 0 "[ . 1 . 2]" 1
1443 1 90 PHE QE 1 95 LEU MD1 7.410 . 7.910 5.280 5.023 5.499 . 0 0 "[ . 1 . 2]" 1
1444 1 90 PHE N 1 93 GLN O 3.000 . 3.500 2.930 2.884 2.980 . 0 0 "[ . 1 . 2]" 1
1445 1 90 PHE O 1 93 GLN H 2.000 . 2.500 2.033 2.009 2.052 . 0 0 "[ . 1 . 2]" 1
1446 1 90 PHE O 1 93 GLN N 3.000 . 3.500 3.042 3.019 3.062 . 0 0 "[ . 1 . 2]" 1
1447 1 91 ALA HA 1 92 ASN HA 4.890 . 5.390 4.726 4.639 4.824 . 0 0 "[ . 1 . 2]" 1
1448 1 91 ALA HA 1 92 ASN HB3 5.500 . 6.000 4.800 4.700 5.096 . 0 0 "[ . 1 . 2]" 1
1449 1 91 ALA MB 1 92 ASN H 5.730 . 6.230 2.362 2.125 2.477 . 0 0 "[ . 1 . 2]" 1
1450 1 91 ALA MB 1 92 ASN HA 6.360 . 6.860 4.387 4.319 4.463 . 0 0 "[ . 1 . 2]" 1
1451 1 91 ALA MB 1 92 ASN HB2 6.610 . 7.110 4.892 4.710 5.104 . 0 0 "[ . 1 . 2]" 1
1452 1 91 ALA MB 1 92 ASN HB3 5.370 . 5.870 3.764 3.485 4.029 . 0 0 "[ . 1 . 2]" 1
1453 1 91 ALA MB 1 92 ASN HD22 6.610 . 7.110 4.064 3.002 5.051 . 0 0 "[ . 1 . 2]" 1
1454 1 91 ALA MB 1 93 GLN H 6.240 . 6.740 3.678 3.351 3.814 . 0 0 "[ . 1 . 2]" 1
1455 1 91 ALA MB 1 93 GLN HG2 5.500 . 6.000 4.311 3.864 4.723 . 0 0 "[ . 1 . 2]" 1
1456 1 91 ALA MB 1 93 GLN HG3 6.610 . 7.110 5.319 3.688 5.557 . 0 0 "[ . 1 . 2]" 1
1457 1 91 ALA MB 1 95 LEU MD1 7.930 . 8.430 4.965 4.456 5.365 . 0 0 "[ . 1 . 2]" 1
1458 1 91 ALA MB 1 95 LEU MD2 7.930 . 8.430 5.485 5.396 5.571 . 0 0 "[ . 1 . 2]" 1
1459 1 92 ASN H 1 93 GLN H 4.200 . 4.700 1.779 1.745 1.821 0.055 19 0 "[ . 1 . 2]" 1
1460 1 92 ASN H 1 93 GLN HB2 5.500 . 6.000 5.518 4.892 5.646 . 0 0 "[ . 1 . 2]" 1
1461 1 92 ASN HA 1 93 GLN HA 5.500 . 6.000 4.638 4.515 4.707 . 0 0 "[ . 1 . 2]" 1
1462 1 92 ASN HA 1 93 GLN HG2 5.500 . 6.000 5.059 4.406 5.317 . 0 0 "[ . 1 . 2]" 1
1463 1 92 ASN HB2 1 93 GLN H 4.680 . 5.180 4.411 4.175 4.558 . 0 0 "[ . 1 . 2]" 1
1464 1 92 ASN HB3 1 93 GLN H 4.720 . 5.220 4.529 4.304 4.642 . 0 0 "[ . 1 . 2]" 1
1465 1 92 ASN HD21 1 93 GLN HE22 5.110 . 5.610 4.540 2.854 5.665 0.055 16 0 "[ . 1 . 2]" 1
1466 1 92 ASN HD21 1 93 GLN HG2 5.500 . 6.000 3.407 2.368 4.591 . 0 0 "[ . 1 . 2]" 1
1467 1 92 ASN HD22 1 93 GLN HE21 3.910 . 4.410 2.715 2.108 4.858 0.448 18 0 "[ . 1 . 2]" 1
1468 1 92 ASN HD22 1 93 GLN HE22 4.740 . 5.240 3.443 2.466 4.950 . 0 0 "[ . 1 . 2]" 1
1469 1 93 GLN H 1 93 GLN HG2 4.040 . 4.540 2.724 2.519 3.339 . 0 0 "[ . 1 . 2]" 1
1470 1 93 GLN H 1 93 GLN HG3 4.490 . 4.990 3.584 2.823 3.957 . 0 0 "[ . 1 . 2]" 1
1471 1 93 GLN H 1 94 PRO QD 5.800 . 6.300 4.392 4.351 4.442 . 0 0 "[ . 1 . 2]" 1
1472 1 93 GLN HA 1 93 GLN HG2 3.790 . 4.290 3.726 3.251 3.833 . 0 0 "[ . 1 . 2]" 1
1473 1 93 GLN HA 1 93 GLN HG3 4.150 . 4.650 3.839 3.717 4.105 . 0 0 "[ . 1 . 2]" 1
1474 1 93 GLN HA 1 94 PRO QD 3.730 . 4.230 2.204 2.048 2.275 . 0 0 "[ . 1 . 2]" 1
1475 1 93 GLN HA 1 94 PRO HG2 4.580 . 5.080 4.675 4.609 4.719 . 0 0 "[ . 1 . 2]" 1
1476 1 93 GLN HB2 1 93 GLN HE22 5.330 . 5.830 4.629 4.070 4.895 . 0 0 "[ . 1 . 2]" 1
1477 1 93 GLN HB2 1 94 PRO QD 3.570 . 4.070 2.152 2.049 2.755 . 0 0 "[ . 1 . 2]" 1
1478 1 93 GLN HB3 1 94 PRO QD 4.840 . 5.340 3.330 2.381 3.506 . 0 0 "[ . 1 . 2]" 1
1479 1 93 GLN HG2 1 94 PRO QD 5.340 . 5.840 4.555 4.477 4.645 . 0 0 "[ . 1 . 2]" 1
1480 1 93 GLN HG3 1 94 PRO QD 6.170 . 6.670 3.813 3.599 4.724 . 0 0 "[ . 1 . 2]" 1
1481 1 94 PRO HA 1 95 LEU H 3.200 . 3.700 2.107 2.019 2.201 . 0 0 "[ . 1 . 2]" 1
1482 1 94 PRO HA 1 95 LEU HA 5.170 . 5.670 4.358 4.298 4.415 . 0 0 "[ . 1 . 2]" 1
1483 1 94 PRO HA 1 95 LEU MD1 6.210 . 6.710 3.758 2.788 4.404 . 0 0 "[ . 1 . 2]" 1
1484 1 94 PRO HB2 1 95 LEU H 4.430 . 4.930 2.902 2.538 3.248 . 0 0 "[ . 1 . 2]" 1
1485 1 94 PRO QD 1 95 LEU H 5.390 . 5.890 4.841 4.783 4.896 . 0 0 "[ . 1 . 2]" 1
1486 1 95 LEU H 1 95 LEU HB2 3.920 . 4.420 2.148 1.947 2.296 . 0 0 "[ . 1 . 2]" 1
1487 1 95 LEU H 1 95 LEU HB3 3.370 . 3.870 3.410 3.289 3.495 . 0 0 "[ . 1 . 2]" 1
1488 1 95 LEU H 1 95 LEU MD1 5.270 . 5.770 3.025 2.513 3.321 . 0 0 "[ . 1 . 2]" 1
1489 1 95 LEU H 1 95 LEU MD2 5.330 . 5.830 2.581 2.162 3.508 . 0 0 "[ . 1 . 2]" 1
1490 1 95 LEU H 1 95 LEU HG 4.010 . 4.510 4.005 3.886 4.141 . 0 0 "[ . 1 . 2]" 1
1491 1 95 LEU H 1 96 GLU H 4.710 . 5.210 4.628 4.534 4.689 . 0 0 "[ . 1 . 2]" 1
1492 1 95 LEU H 1 97 VAL MG2 6.610 . 7.110 4.820 4.647 5.070 . 0 0 "[ . 1 . 2]" 1
1493 1 95 LEU HA 1 95 LEU MD1 4.080 . 4.580 2.091 2.001 2.241 . 0 0 "[ . 1 . 2]" 1
1494 1 95 LEU HA 1 95 LEU HG 4.270 . 4.770 3.420 2.700 3.755 . 0 0 "[ . 1 . 2]" 1
1495 1 95 LEU HA 1 96 GLU H 3.180 . 3.680 2.249 2.123 2.340 . 0 0 "[ . 1 . 2]" 1
1496 1 95 LEU HA 1 97 VAL MG2 6.610 . 7.110 4.017 3.830 4.263 . 0 0 "[ . 1 . 2]" 1
1497 1 95 LEU HB2 1 96 GLU H 4.250 . 4.750 4.069 3.869 4.395 . 0 0 "[ . 1 . 2]" 1
1498 1 95 LEU HB3 1 96 GLU H 4.630 . 5.130 2.909 2.649 3.414 . 0 0 "[ . 1 . 2]" 1
1499 1 95 LEU HB3 1 97 VAL MG2 6.210 . 6.710 2.034 1.967 2.078 . 0 0 "[ . 1 . 2]" 1
1500 1 95 LEU MD1 1 96 GLU H 4.880 . 5.380 3.537 3.254 3.973 . 0 0 "[ . 1 . 2]" 1
1501 1 95 LEU MD1 1 97 VAL MG2 7.140 . 7.640 3.614 2.985 4.311 . 0 0 "[ . 1 . 2]" 1
1502 1 95 LEU MD2 1 96 GLU H 6.040 . 6.540 4.967 4.863 5.069 . 0 0 "[ . 1 . 2]" 1
1503 1 95 LEU HG 1 96 GLU H 5.100 . 5.600 4.472 3.908 4.825 . 0 0 "[ . 1 . 2]" 1
1504 1 96 GLU H 1 96 GLU HB2 3.540 . 4.040 2.885 2.725 3.031 . 0 0 "[ . 1 . 2]" 1
1505 1 96 GLU H 1 96 GLU HG2 4.660 . 5.160 4.561 4.466 4.606 . 0 0 "[ . 1 . 2]" 1
1506 1 96 GLU H 1 97 VAL H 5.140 . 5.640 2.964 2.853 3.116 . 0 0 "[ . 1 . 2]" 1
1507 1 96 GLU H 1 97 VAL MG2 6.610 . 7.110 3.392 3.014 3.881 . 0 0 "[ . 1 . 2]" 1
1508 1 96 GLU HA 1 97 VAL H 3.130 . 3.630 2.475 2.413 2.523 . 0 0 "[ . 1 . 2]" 1
1509 1 96 GLU HA 1 97 VAL HB 5.000 . 5.500 4.456 4.380 4.542 . 0 0 "[ . 1 . 2]" 1
1510 1 96 GLU HA 1 97 VAL MG2 5.540 . 6.040 4.330 4.193 4.457 . 0 0 "[ . 1 . 2]" 1
1511 1 96 GLU HA 1 98 VAL MG2 6.970 . 7.470 4.404 4.251 4.600 . 0 0 "[ . 1 . 2]" 1
1512 1 96 GLU HB2 1 97 VAL H 4.420 . 4.920 4.479 4.426 4.516 . 0 0 "[ . 1 . 2]" 1
1513 1 96 GLU HG2 1 97 VAL H 5.160 . 5.660 4.568 4.267 4.835 . 0 0 "[ . 1 . 2]" 1
1514 1 96 GLU HG2 1 97 VAL HA 5.370 . 5.870 5.413 5.261 5.543 . 0 0 "[ . 1 . 2]" 1
1515 1 96 GLU HG2 1 98 VAL MG2 5.920 . 6.420 3.782 3.154 4.441 . 0 0 "[ . 1 . 2]" 1
1516 1 97 VAL H 1 97 VAL HB 4.060 . 4.560 2.239 2.119 2.323 . 0 0 "[ . 1 . 2]" 1
1517 1 97 VAL H 1 98 VAL H 5.020 . 5.520 4.464 4.345 4.581 . 0 0 "[ . 1 . 2]" 1
1518 1 97 VAL H 1 98 VAL MG2 5.600 . 6.100 4.729 4.713 4.749 . 0 0 "[ . 1 . 2]" 1
1519 1 97 VAL HA 1 98 VAL H 3.100 . 3.600 2.418 2.258 2.514 . 0 0 "[ . 1 . 2]" 1
1520 1 97 VAL HB 1 98 VAL H 4.910 . 5.410 4.543 4.457 4.591 . 0 0 "[ . 1 . 2]" 1
1521 1 97 VAL HB 1 98 VAL MG2 5.400 . 5.900 4.733 4.703 4.761 . 0 0 "[ . 1 . 2]" 1
1522 1 97 VAL MG1 1 98 VAL H 4.610 . 5.110 3.571 3.313 3.701 . 0 0 "[ . 1 . 2]" 1
1523 1 97 VAL MG2 1 98 VAL H 5.400 . 5.900 4.372 4.181 4.457 . 0 0 "[ . 1 . 2]" 1
1524 1 98 VAL H 1 98 VAL MG1 4.300 . 4.800 2.843 2.738 3.041 . 0 0 "[ . 1 . 2]" 1
1525 1 98 VAL HB 1 99 TYR H 3.310 . 3.810 3.379 3.329 3.403 . 0 0 "[ . 1 . 2]" 1
1526 1 98 VAL MG1 1 99 TYR H 4.080 . 4.580 1.612 1.539 1.732 0.261 17 0 "[ . 1 . 2]" 1
1527 1 98 VAL MG1 1 100 SER H 6.610 . 7.110 2.425 2.011 3.128 . 0 0 "[ . 1 . 2]" 1
1528 1 98 VAL MG1 1 100 SER HA 5.880 . 6.380 2.523 2.226 3.089 . 0 0 "[ . 1 . 2]" 1
1529 1 98 VAL MG1 1 100 SER HB3 6.590 . 7.090 4.372 3.769 4.943 . 0 0 "[ . 1 . 2]" 1
1530 1 98 VAL MG2 1 99 TYR H 4.400 . 4.900 2.503 2.215 3.114 . 0 0 "[ . 1 . 2]" 1
1531 1 98 VAL MG2 1 99 TYR QE 6.970 . 7.470 4.305 3.571 4.934 . 0 0 "[ . 1 . 2]" 1
1532 1 99 TYR H 1 99 TYR HB2 3.610 . 4.110 2.553 2.419 2.701 . 0 0 "[ . 1 . 2]" 1
1533 1 99 TYR H 1 99 TYR HB3 3.910 . 4.410 3.695 3.630 3.761 . 0 0 "[ . 1 . 2]" 1
1534 1 99 TYR H 1 99 TYR QD 4.370 . 4.870 3.427 3.266 3.498 . 0 0 "[ . 1 . 2]" 1
1535 1 99 TYR H 1 99 TYR QE 6.010 . 6.510 4.987 4.759 5.213 . 0 0 "[ . 1 . 2]" 1
1536 1 99 TYR H 1 100 SER H 4.740 . 5.240 2.720 2.246 3.389 . 0 0 "[ . 1 . 2]" 1
1537 1 99 TYR HB2 1 100 SER H 4.610 . 5.110 4.114 3.773 4.514 . 0 0 "[ . 1 . 2]" 1
1538 1 99 TYR HB3 1 100 SER H 4.440 . 4.940 4.467 4.411 4.541 . 0 0 "[ . 1 . 2]" 1
1539 1 100 SER H 1 100 SER HB2 3.860 . 4.360 2.744 2.491 3.540 . 0 0 "[ . 1 . 2]" 1
1540 1 100 SER H 1 100 SER HB3 3.900 . 4.400 3.120 2.458 3.651 . 0 0 "[ . 1 . 2]" 1
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