NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
594141 |
2ms8   |
25109 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ms8
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 1050
_Distance_constraint_stats_list.Viol_count 84
_Distance_constraint_stats_list.Viol_total 43.251
_Distance_constraint_stats_list.Viol_max 0.111
_Distance_constraint_stats_list.Viol_rms 0.0022
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0001
_Distance_constraint_stats_list.Viol_average_violations_only 0.0257
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 MET 0.087 0.046 14 0 "[ . 1 . 2]"
1 4 PRO 0.087 0.046 14 0 "[ . 1 . 2]"
1 5 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 6 ALA 0.145 0.056 5 0 "[ . 1 . 2]"
1 7 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 ARG 0.111 0.111 14 0 "[ . 1 . 2]"
1 17 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 CYS 0.020 0.020 7 0 "[ . 1 . 2]"
1 23 ASN 0.015 0.015 12 0 "[ . 1 . 2]"
1 24 VAL 0.289 0.061 12 0 "[ . 1 . 2]"
1 25 ASP 0.060 0.024 16 0 "[ . 1 . 2]"
1 26 VAL 0.088 0.044 10 0 "[ . 1 . 2]"
1 27 VAL 0.081 0.044 10 0 "[ . 1 . 2]"
1 28 GLU 0.031 0.029 10 0 "[ . 1 . 2]"
1 29 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 LEU 0.075 0.044 1 0 "[ . 1 . 2]"
1 34 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 LEU 0.426 0.107 18 0 "[ . 1 . 2]"
1 37 THR 0.013 0.007 18 0 "[ . 1 . 2]"
1 38 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 ARG 0.024 0.024 11 0 "[ . 1 . 2]"
1 40 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 CYS 0.047 0.047 15 0 "[ . 1 . 2]"
1 49 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ASN 0.198 0.079 8 0 "[ . 1 . 2]"
1 54 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ASP 0.010 0.010 20 0 "[ . 1 . 2]"
1 56 THR 0.007 0.007 4 0 "[ . 1 . 2]"
1 57 LEU 0.254 0.061 12 0 "[ . 1 . 2]"
1 58 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 ASN 0.029 0.029 17 0 "[ . 1 . 2]"
1 63 THR 0.001 0.001 13 0 "[ . 1 . 2]"
1 64 LEU 0.014 0.009 3 0 "[ . 1 . 2]"
1 65 GLN 0.029 0.029 17 0 "[ . 1 . 2]"
1 66 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 GLY 0.004 0.004 10 0 "[ . 1 . 2]"
1 70 TRP 0.004 0.004 10 0 "[ . 1 . 2]"
1 71 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 ALA 0.075 0.044 1 0 "[ . 1 . 2]"
1 78 LEU 0.497 0.050 19 0 "[ . 1 . 2]"
1 79 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 GLU 0.034 0.017 17 0 "[ . 1 . 2]"
1 83 LEU 0.034 0.017 17 0 "[ . 1 . 2]"
1 84 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 TYR 0.145 0.056 5 0 "[ . 1 . 2]"
1 98 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 SER 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 SER H 1 2 SER QB 3.190 . 3.670 2.553 2.302 3.453 . 0 0 "[ . 1 . 2]" 1
2 1 2 SER HA 1 3 MET H 3.020 . 3.470 2.675 2.125 3.457 . 0 0 "[ . 1 . 2]" 1
3 1 2 SER QB 1 3 MET QB 3.830 . 4.400 4.085 3.643 4.339 . 0 0 "[ . 1 . 2]" 1
4 1 3 MET H 1 3 MET QB 3.350 . 3.850 3.145 2.354 3.463 . 0 0 "[ . 1 . 2]" 1
5 1 3 MET H 1 3 MET HG2 3.730 . 4.290 3.599 2.772 4.177 . 0 0 "[ . 1 . 2]" 1
6 1 3 MET H 1 3 MET HG3 3.820 . 4.390 3.383 2.984 4.315 . 0 0 "[ . 1 . 2]" 1
7 1 3 MET H 1 4 PRO HB3 4.680 . 5.380 5.161 4.733 5.243 . 0 0 "[ . 1 . 2]" 1
8 1 3 MET H 1 4 PRO HD2 3.300 . 3.800 3.701 3.531 3.846 0.046 14 0 "[ . 1 . 2]" 1
9 1 3 MET H 1 4 PRO HD3 3.830 . 4.400 2.909 2.314 3.547 . 0 0 "[ . 1 . 2]" 1
10 1 3 MET HA 1 3 MET HG3 3.490 . 4.010 3.329 2.960 3.838 . 0 0 "[ . 1 . 2]" 1
11 1 3 MET HA 1 4 PRO HD2 3.250 . 3.740 2.007 1.782 2.388 0.018 14 0 "[ . 1 . 2]" 1
12 1 3 MET HA 1 4 PRO HD3 3.210 . 3.690 2.606 2.302 3.184 . 0 0 "[ . 1 . 2]" 1
13 1 3 MET QB 1 4 PRO HD3 3.890 . 4.470 4.325 4.212 4.415 . 0 0 "[ . 1 . 2]" 1
14 1 4 PRO HA 1 5 PHE H 3.110 . 3.580 2.102 1.982 2.251 . 0 0 "[ . 1 . 2]" 1
15 1 4 PRO HB2 1 5 PHE H 4.240 . 4.880 3.782 3.219 4.081 . 0 0 "[ . 1 . 2]" 1
16 1 4 PRO HB3 1 5 PHE H 3.820 . 4.390 4.087 3.803 4.272 . 0 0 "[ . 1 . 2]" 1
17 1 4 PRO HG2 1 5 PHE H 4.660 . 5.360 5.013 4.685 5.141 . 0 0 "[ . 1 . 2]" 1
18 1 5 PHE H 1 5 PHE HB2 3.040 . 3.500 3.088 2.822 3.372 . 0 0 "[ . 1 . 2]" 1
19 1 5 PHE H 1 5 PHE HB3 3.120 . 3.590 2.681 2.546 2.859 . 0 0 "[ . 1 . 2]" 1
20 1 5 PHE H 1 5 PHE QD 4.220 . 4.850 4.314 4.199 4.408 . 0 0 "[ . 1 . 2]" 1
21 1 5 PHE H 1 6 ALA H 3.220 . 3.700 2.235 1.900 2.567 . 0 0 "[ . 1 . 2]" 1
22 1 5 PHE HA 1 8 ASP H 3.920 . 4.510 3.715 3.300 4.267 . 0 0 "[ . 1 . 2]" 1
23 1 5 PHE HA 1 8 ASP HB3 3.640 . 4.190 2.955 2.340 3.497 . 0 0 "[ . 1 . 2]" 1
24 1 5 PHE HB2 1 6 ALA H 3.460 . 3.980 3.560 3.367 3.723 . 0 0 "[ . 1 . 2]" 1
25 1 5 PHE HB3 1 6 ALA H 3.520 . 4.050 2.106 1.876 2.435 . 0 0 "[ . 1 . 2]" 1
26 1 5 PHE HB3 1 6 ALA HA 3.890 . 4.470 4.270 4.191 4.308 . 0 0 "[ . 1 . 2]" 1
27 1 5 PHE QD 1 6 ALA H 3.730 . 4.290 2.985 2.598 3.573 . 0 0 "[ . 1 . 2]" 1
28 1 6 ALA H 1 6 ALA MB 2.920 . 3.360 2.211 2.170 2.267 . 0 0 "[ . 1 . 2]" 1
29 1 6 ALA HA 1 9 LYS H 4.230 . 4.860 3.315 3.057 3.974 . 0 0 "[ . 1 . 2]" 1
30 1 6 ALA HA 1 9 LYS HB2 3.850 . 4.430 2.916 2.338 3.872 . 0 0 "[ . 1 . 2]" 1
31 1 6 ALA HA 1 97 TYR HB2 3.350 . 3.850 3.689 3.464 3.737 . 0 0 "[ . 1 . 2]" 1
32 1 6 ALA HA 1 97 TYR HB3 3.570 . 4.110 2.372 1.988 2.680 . 0 0 "[ . 1 . 2]" 1
33 1 6 ALA MB 1 7 GLU H 3.740 . 4.300 2.612 2.283 2.843 . 0 0 "[ . 1 . 2]" 1
34 1 6 ALA MB 1 8 ASP H 4.860 . 5.590 4.370 4.169 4.531 . 0 0 "[ . 1 . 2]" 1
35 1 6 ALA MB 1 94 TYR QD 4.310 . 4.960 3.385 2.706 3.900 . 0 0 "[ . 1 . 2]" 1
36 1 6 ALA MB 1 94 TYR QE 3.410 . 3.920 2.675 2.143 3.452 . 0 0 "[ . 1 . 2]" 1
37 1 6 ALA MB 1 97 TYR H 4.740 . 5.450 4.307 4.092 4.561 . 0 0 "[ . 1 . 2]" 1
38 1 6 ALA MB 1 97 TYR HA 2.870 . 3.300 3.283 3.235 3.356 0.056 5 0 "[ . 1 . 2]" 1
39 1 6 ALA MB 1 97 TYR HB2 3.850 . 4.430 2.608 2.221 2.939 . 0 0 "[ . 1 . 2]" 1
40 1 6 ALA MB 1 97 TYR HB3 3.790 . 4.360 1.966 1.871 2.147 . 0 0 "[ . 1 . 2]" 1
41 1 6 ALA MB 1 98 GLN H 4.780 . 5.500 3.660 3.270 3.915 . 0 0 "[ . 1 . 2]" 1
42 1 6 ALA MB 1 98 GLN QG 3.610 . 4.150 2.941 2.102 4.093 . 0 0 "[ . 1 . 2]" 1
43 1 7 GLU H 1 7 GLU HB2 3.330 . 3.830 2.675 2.493 3.467 . 0 0 "[ . 1 . 2]" 1
44 1 7 GLU H 1 7 GLU HG2 3.450 . 3.970 3.642 3.218 3.774 . 0 0 "[ . 1 . 2]" 1
45 1 7 GLU H 1 7 GLU HG3 3.900 . 4.490 2.781 2.157 3.298 . 0 0 "[ . 1 . 2]" 1
46 1 7 GLU H 1 8 ASP H 3.070 . 3.530 2.480 2.381 2.618 . 0 0 "[ . 1 . 2]" 1
47 1 7 GLU H 1 9 LYS H 4.050 . 4.660 4.086 3.947 4.406 . 0 0 "[ . 1 . 2]" 1
48 1 7 GLU H 1 94 TYR QE 4.390 . 5.050 3.488 2.851 4.720 . 0 0 "[ . 1 . 2]" 1
49 1 7 GLU HA 1 7 GLU HG2 3.920 . 4.510 3.708 2.550 4.206 . 0 0 "[ . 1 . 2]" 1
50 1 7 GLU HA 1 7 GLU HG3 3.550 . 4.080 2.734 2.588 3.569 . 0 0 "[ . 1 . 2]" 1
51 1 7 GLU HA 1 71 VAL MG2 3.940 . 4.530 2.313 1.965 2.845 . 0 0 "[ . 1 . 2]" 1
52 1 7 GLU HB2 1 8 ASP H 3.500 . 4.030 2.734 2.410 3.566 . 0 0 "[ . 1 . 2]" 1
53 1 7 GLU HB3 1 70 TRP HE1 3.320 . 3.820 2.479 1.955 3.549 . 0 0 "[ . 1 . 2]" 1
54 1 7 GLU HB3 1 71 VAL MG2 4.320 . 4.970 2.563 2.043 3.519 . 0 0 "[ . 1 . 2]" 1
55 1 7 GLU HG2 1 71 VAL MG2 4.160 . 4.780 3.237 2.115 4.227 . 0 0 "[ . 1 . 2]" 1
56 1 7 GLU HG2 1 94 TYR QE 3.660 . 4.210 3.988 3.082 4.077 . 0 0 "[ . 1 . 2]" 1
57 1 7 GLU HG3 1 71 VAL H 4.380 . 5.040 4.156 3.338 4.957 . 0 0 "[ . 1 . 2]" 1
58 1 7 GLU HG3 1 71 VAL MG2 3.790 . 4.360 2.806 2.115 4.177 . 0 0 "[ . 1 . 2]" 1
59 1 7 GLU HG3 1 94 TYR QE 3.390 . 3.900 2.533 2.251 3.452 . 0 0 "[ . 1 . 2]" 1
60 1 8 ASP H 1 8 ASP HB2 3.190 . 3.670 2.637 2.449 2.787 . 0 0 "[ . 1 . 2]" 1
61 1 8 ASP H 1 8 ASP HB3 3.100 . 3.570 2.455 2.256 2.596 . 0 0 "[ . 1 . 2]" 1
62 1 8 ASP H 1 9 LYS H 3.190 . 3.670 2.547 2.338 2.824 . 0 0 "[ . 1 . 2]" 1
63 1 8 ASP HA 1 11 TYR HB2 3.660 . 4.210 3.548 2.982 3.873 . 0 0 "[ . 1 . 2]" 1
64 1 8 ASP HA 1 11 TYR HB3 3.690 . 4.240 2.825 2.421 3.528 . 0 0 "[ . 1 . 2]" 1
65 1 8 ASP HB2 1 9 LYS H 3.650 . 4.200 3.822 3.651 4.038 . 0 0 "[ . 1 . 2]" 1
66 1 8 ASP HB3 1 9 LYS H 3.760 . 4.320 2.503 2.219 2.784 . 0 0 "[ . 1 . 2]" 1
67 1 9 LYS H 1 9 LYS HB2 3.190 . 3.670 2.554 2.363 2.733 . 0 0 "[ . 1 . 2]" 1
68 1 9 LYS H 1 9 LYS HG2 3.310 . 3.810 2.656 1.914 3.595 . 0 0 "[ . 1 . 2]" 1
69 1 9 LYS H 1 9 LYS HG3 3.930 . 4.520 3.109 2.242 3.679 . 0 0 "[ . 1 . 2]" 1
70 1 9 LYS H 1 10 THR H 3.440 . 3.960 2.601 2.367 2.800 . 0 0 "[ . 1 . 2]" 1
71 1 9 LYS HA 1 9 LYS QD 3.510 . 4.040 2.842 2.000 4.028 . 0 0 "[ . 1 . 2]" 1
72 1 9 LYS HA 1 9 LYS HG2 3.170 . 3.650 2.889 2.349 3.419 . 0 0 "[ . 1 . 2]" 1
73 1 9 LYS HA 1 9 LYS HG3 3.830 . 4.400 3.518 2.786 3.855 . 0 0 "[ . 1 . 2]" 1
74 1 9 LYS HA 1 12 LYS H 3.840 . 4.420 3.389 2.675 3.812 . 0 0 "[ . 1 . 2]" 1
75 1 9 LYS HA 1 12 LYS QB 3.330 . 3.830 2.827 2.139 3.432 . 0 0 "[ . 1 . 2]" 1
76 1 9 LYS HB2 1 9 LYS HE2 5.040 . 5.800 4.210 2.826 5.182 . 0 0 "[ . 1 . 2]" 1
77 1 9 LYS HB2 1 10 THR H 3.580 . 4.120 2.714 2.305 3.256 . 0 0 "[ . 1 . 2]" 1
78 1 9 LYS HB3 1 9 LYS QD 3.370 . 3.880 2.539 2.291 2.915 . 0 0 "[ . 1 . 2]" 1
79 1 9 LYS HB3 1 10 THR H 3.900 . 4.490 3.756 3.428 4.038 . 0 0 "[ . 1 . 2]" 1
80 1 9 LYS HE2 1 9 LYS HG2 3.960 . 4.550 3.090 2.290 4.218 . 0 0 "[ . 1 . 2]" 1
81 1 9 LYS HE2 1 9 LYS HG3 3.860 . 4.440 2.830 2.471 3.750 . 0 0 "[ . 1 . 2]" 1
82 1 9 LYS HE3 1 97 TYR QD 3.590 . 4.130 3.788 2.448 4.065 . 0 0 "[ . 1 . 2]" 1
83 1 10 THR H 1 10 THR HB 3.620 . 4.160 2.543 2.448 2.635 . 0 0 "[ . 1 . 2]" 1
84 1 10 THR H 1 11 TYR H 3.330 . 3.830 2.698 2.581 2.852 . 0 0 "[ . 1 . 2]" 1
85 1 10 THR HA 1 10 THR MG 3.230 . 3.710 2.453 2.295 3.234 . 0 0 "[ . 1 . 2]" 1
86 1 10 THR HA 1 93 VAL MG1 3.480 . 4.000 2.302 1.828 3.538 . 0 0 "[ . 1 . 2]" 1
87 1 10 THR MG 1 11 TYR H 4.320 . 4.970 3.410 2.503 3.626 . 0 0 "[ . 1 . 2]" 1
88 1 10 THR MG 1 70 TRP HH2 3.860 . 4.440 2.659 2.248 3.122 . 0 0 "[ . 1 . 2]" 1
89 1 10 THR MG 1 70 TRP HZ3 3.670 . 4.220 3.936 3.576 4.088 . 0 0 "[ . 1 . 2]" 1
90 1 10 THR MG 1 71 VAL MG1 3.490 . 4.010 2.370 2.081 2.750 . 0 0 "[ . 1 . 2]" 1
91 1 10 THR MG 1 71 VAL MG2 3.570 . 4.110 2.424 1.947 2.992 . 0 0 "[ . 1 . 2]" 1
92 1 10 THR MG 1 93 VAL MG1 3.700 . 4.260 2.547 1.973 4.005 . 0 0 "[ . 1 . 2]" 1
93 1 10 THR MG 1 94 TYR HB2 4.110 . 4.730 3.086 2.191 3.967 . 0 0 "[ . 1 . 2]" 1
94 1 10 THR MG 1 94 TYR QD 4.320 . 4.970 3.460 2.745 4.347 . 0 0 "[ . 1 . 2]" 1
95 1 11 TYR H 1 11 TYR HB2 3.330 . 3.830 2.631 2.423 2.784 . 0 0 "[ . 1 . 2]" 1
96 1 11 TYR H 1 11 TYR HB3 3.230 . 3.710 2.494 2.361 2.646 . 0 0 "[ . 1 . 2]" 1
97 1 11 TYR H 1 11 TYR QD 4.090 . 4.700 4.215 4.152 4.246 . 0 0 "[ . 1 . 2]" 1
98 1 11 TYR H 1 12 LYS H 3.420 . 3.930 2.791 2.598 2.971 . 0 0 "[ . 1 . 2]" 1
99 1 11 TYR H 1 70 TRP HZ2 3.180 . 3.660 2.745 2.319 3.449 . 0 0 "[ . 1 . 2]" 1
100 1 11 TYR HA 1 11 TYR QD 3.030 . 3.480 2.814 2.594 2.975 . 0 0 "[ . 1 . 2]" 1
101 1 11 TYR HA 1 14 ILE H 4.270 . 4.910 3.567 3.159 3.832 . 0 0 "[ . 1 . 2]" 1
102 1 11 TYR HA 1 14 ILE HB 3.650 . 4.200 2.882 2.231 3.215 . 0 0 "[ . 1 . 2]" 1
103 1 11 TYR HA 1 15 CYS H 4.410 . 5.070 4.157 3.703 4.540 . 0 0 "[ . 1 . 2]" 1
104 1 11 TYR HA 1 70 TRP HH2 3.740 . 4.300 2.895 2.572 3.190 . 0 0 "[ . 1 . 2]" 1
105 1 11 TYR HA 1 70 TRP HZ2 3.370 . 3.880 2.986 2.295 3.734 . 0 0 "[ . 1 . 2]" 1
106 1 11 TYR HB2 1 12 LYS H 3.970 . 4.570 3.875 3.631 4.026 . 0 0 "[ . 1 . 2]" 1
107 1 11 TYR HB2 1 65 GLN HB3 3.990 . 4.590 3.425 2.331 4.422 . 0 0 "[ . 1 . 2]" 1
108 1 11 TYR HB2 1 70 TRP HZ2 3.940 . 4.530 2.182 1.974 2.744 . 0 0 "[ . 1 . 2]" 1
109 1 11 TYR HB3 1 12 LYS H 3.640 . 4.190 2.528 2.316 2.730 . 0 0 "[ . 1 . 2]" 1
110 1 11 TYR HB3 1 70 TRP HZ2 3.900 . 4.490 3.563 3.244 3.935 . 0 0 "[ . 1 . 2]" 1
111 1 11 TYR QD 1 65 GLN HE21 4.590 . 5.280 4.317 2.889 5.099 . 0 0 "[ . 1 . 2]" 1
112 1 11 TYR QD 1 65 GLN HE22 4.580 . 5.270 4.290 3.623 5.058 . 0 0 "[ . 1 . 2]" 1
113 1 11 TYR QE 1 61 PHE HB2 3.930 . 4.520 3.114 2.395 3.621 . 0 0 "[ . 1 . 2]" 1
114 1 11 TYR QE 1 61 PHE HB3 3.490 . 4.010 2.018 1.868 2.293 . 0 0 "[ . 1 . 2]" 1
115 1 11 TYR QE 1 62 ASN H 4.390 . 5.050 4.300 3.135 4.890 . 0 0 "[ . 1 . 2]" 1
116 1 11 TYR QE 1 65 GLN HE21 3.800 . 4.370 3.462 2.495 4.017 . 0 0 "[ . 1 . 2]" 1
117 1 11 TYR QE 1 65 GLN HE22 4.440 . 5.110 3.194 2.715 4.152 . 0 0 "[ . 1 . 2]" 1
118 1 12 LYS H 1 12 LYS QB 3.020 . 3.470 2.447 1.985 2.641 . 0 0 "[ . 1 . 2]" 1
119 1 12 LYS H 1 12 LYS HG2 3.470 . 3.990 2.903 2.053 3.916 . 0 0 "[ . 1 . 2]" 1
120 1 12 LYS H 1 12 LYS HG3 4.030 . 4.630 3.010 1.958 4.363 . 0 0 "[ . 1 . 2]" 1
121 1 12 LYS H 1 13 TYR H 3.310 . 3.810 2.635 2.544 2.737 . 0 0 "[ . 1 . 2]" 1
122 1 12 LYS HA 1 12 LYS HD3 3.950 . 4.540 3.503 2.015 4.473 . 0 0 "[ . 1 . 2]" 1
123 1 12 LYS HA 1 12 LYS HG2 3.730 . 4.290 2.852 2.217 3.719 . 0 0 "[ . 1 . 2]" 1
124 1 12 LYS HA 1 12 LYS HG3 3.540 . 4.070 3.354 2.785 3.836 . 0 0 "[ . 1 . 2]" 1
125 1 12 LYS HA 1 14 ILE H 4.710 . 5.420 4.517 4.180 4.908 . 0 0 "[ . 1 . 2]" 1
126 1 12 LYS HA 1 15 CYS H 4.290 . 4.930 3.509 2.935 3.970 . 0 0 "[ . 1 . 2]" 1
127 1 12 LYS HA 1 15 CYS HB2 3.690 . 4.240 3.136 2.457 3.768 . 0 0 "[ . 1 . 2]" 1
128 1 12 LYS QB 1 12 LYS HD2 3.120 . 3.590 2.527 2.215 3.249 . 0 0 "[ . 1 . 2]" 1
129 1 12 LYS QB 1 12 LYS HD3 3.310 . 3.810 2.771 2.320 3.535 . 0 0 "[ . 1 . 2]" 1
130 1 12 LYS QB 1 12 LYS HG2 2.600 . 2.990 2.337 2.145 2.412 . 0 0 "[ . 1 . 2]" 1
131 1 12 LYS QB 1 13 TYR H 3.340 . 3.840 2.813 2.308 3.350 . 0 0 "[ . 1 . 2]" 1
132 1 12 LYS HD2 1 12 LYS HG3 2.910 . 3.350 2.559 2.383 3.026 . 0 0 "[ . 1 . 2]" 1
133 1 12 LYS HG2 1 13 TYR H 5.500 . 6.330 4.656 4.076 5.217 . 0 0 "[ . 1 . 2]" 1
134 1 13 TYR H 1 13 TYR HB2 3.210 . 3.690 2.360 2.199 2.574 . 0 0 "[ . 1 . 2]" 1
135 1 13 TYR H 1 13 TYR HB3 3.170 . 3.650 2.670 2.506 2.923 . 0 0 "[ . 1 . 2]" 1
136 1 13 TYR H 1 14 ILE H 3.280 . 3.770 2.496 2.161 2.716 . 0 0 "[ . 1 . 2]" 1
137 1 13 TYR H 1 93 VAL MG1 4.830 . 5.550 4.312 3.626 5.336 . 0 0 "[ . 1 . 2]" 1
138 1 13 TYR HA 1 13 TYR QD 3.330 . 3.830 2.970 2.519 3.133 . 0 0 "[ . 1 . 2]" 1
139 1 13 TYR HB2 1 14 ILE H 3.540 . 4.070 3.473 3.341 3.749 . 0 0 "[ . 1 . 2]" 1
140 1 13 TYR HB2 1 14 ILE HG12 3.780 . 4.350 4.239 4.213 4.282 . 0 0 "[ . 1 . 2]" 1
141 1 13 TYR HB2 1 93 VAL MG1 3.860 . 4.440 2.857 2.238 3.431 . 0 0 "[ . 1 . 2]" 1
142 1 13 TYR HB2 1 93 VAL MG2 4.250 . 4.890 4.138 3.147 4.704 . 0 0 "[ . 1 . 2]" 1
143 1 13 TYR HB3 1 14 ILE H 3.940 . 4.530 2.283 2.096 2.547 . 0 0 "[ . 1 . 2]" 1
144 1 13 TYR HB3 1 93 VAL MG1 4.180 . 4.810 2.660 2.107 4.089 . 0 0 "[ . 1 . 2]" 1
145 1 13 TYR QD 1 14 ILE H 4.260 . 4.900 3.633 3.286 4.157 . 0 0 "[ . 1 . 2]" 1
146 1 13 TYR QD 1 14 ILE HA 3.840 . 4.420 3.289 2.983 3.912 . 0 0 "[ . 1 . 2]" 1
147 1 13 TYR QD 1 14 ILE HG12 4.070 . 4.680 3.444 2.599 4.439 . 0 0 "[ . 1 . 2]" 1
148 1 13 TYR QE 1 93 VAL MG2 3.780 . 4.350 2.871 2.535 3.771 . 0 0 "[ . 1 . 2]" 1
149 1 14 ILE H 1 14 ILE HB 3.040 . 3.500 2.473 2.411 2.518 . 0 0 "[ . 1 . 2]" 1
150 1 14 ILE H 1 14 ILE MD 4.140 . 4.760 3.282 3.178 3.469 . 0 0 "[ . 1 . 2]" 1
151 1 14 ILE H 1 14 ILE HG12 3.310 . 3.810 2.114 1.952 2.395 . 0 0 "[ . 1 . 2]" 1
152 1 14 ILE H 1 14 ILE HG13 3.850 . 4.430 3.567 3.425 3.777 . 0 0 "[ . 1 . 2]" 1
153 1 14 ILE H 1 14 ILE MG 3.770 . 4.340 3.759 3.724 3.776 . 0 0 "[ . 1 . 2]" 1
154 1 14 ILE H 1 15 CYS H 3.440 . 3.960 2.597 2.388 2.712 . 0 0 "[ . 1 . 2]" 1
155 1 14 ILE HA 1 14 ILE MD 3.390 . 3.900 2.091 2.014 2.135 . 0 0 "[ . 1 . 2]" 1
156 1 14 ILE HA 1 14 ILE HG12 3.920 . 4.510 3.030 2.911 3.096 . 0 0 "[ . 1 . 2]" 1
157 1 14 ILE HA 1 14 ILE HG13 3.980 . 4.580 3.771 3.731 3.799 . 0 0 "[ . 1 . 2]" 1
158 1 14 ILE HA 1 14 ILE MG 3.440 . 3.960 2.466 2.436 2.513 . 0 0 "[ . 1 . 2]" 1
159 1 14 ILE HA 1 17 ASN H 3.910 . 4.500 3.134 2.850 3.569 . 0 0 "[ . 1 . 2]" 1
160 1 14 ILE HA 1 17 ASN HB3 3.940 . 4.530 4.417 4.381 4.452 . 0 0 "[ . 1 . 2]" 1
161 1 14 ILE HB 1 14 ILE MD 3.240 . 3.730 3.259 3.252 3.264 . 0 0 "[ . 1 . 2]" 1
162 1 14 ILE HB 1 15 CYS H 3.530 . 4.060 3.034 2.759 3.230 . 0 0 "[ . 1 . 2]" 1
163 1 14 ILE MD 1 14 ILE MG 3.400 . 3.910 2.033 1.986 2.142 . 0 0 "[ . 1 . 2]" 1
164 1 14 ILE HG12 1 14 ILE MG 3.160 . 3.630 3.213 3.207 3.222 . 0 0 "[ . 1 . 2]" 1
165 1 14 ILE HG12 1 15 CYS H 4.540 . 5.220 4.361 4.263 4.456 . 0 0 "[ . 1 . 2]" 1
166 1 14 ILE HG13 1 90 VAL MG1 3.890 . 4.470 3.203 2.602 3.853 . 0 0 "[ . 1 . 2]" 1
167 1 14 ILE MG 1 70 TRP HH2 3.870 . 4.450 4.014 3.429 4.295 . 0 0 "[ . 1 . 2]" 1
168 1 14 ILE MG 1 90 VAL MG1 4.370 . 5.030 4.290 3.652 4.827 . 0 0 "[ . 1 . 2]" 1
169 1 14 ILE MG 1 90 VAL MG2 4.280 . 4.920 3.417 2.609 4.101 . 0 0 "[ . 1 . 2]" 1
170 1 15 CYS H 1 15 CYS HB2 3.330 . 3.830 2.455 2.301 2.589 . 0 0 "[ . 1 . 2]" 1
171 1 15 CYS H 1 15 CYS HB3 3.500 . 4.030 3.044 2.530 3.633 . 0 0 "[ . 1 . 2]" 1
172 1 15 CYS H 1 16 ARG H 3.480 . 4.000 2.650 2.523 2.903 . 0 0 "[ . 1 . 2]" 1
173 1 15 CYS HB2 1 16 ARG H 3.580 . 4.120 3.527 2.858 4.009 . 0 0 "[ . 1 . 2]" 1
174 1 15 CYS HB3 1 16 ARG H 3.550 . 4.080 3.373 2.805 3.960 . 0 0 "[ . 1 . 2]" 1
175 1 16 ARG H 1 16 ARG HB2 3.220 . 3.700 2.796 2.442 3.628 . 0 0 "[ . 1 . 2]" 1
176 1 16 ARG H 1 16 ARG QD 4.500 . 5.180 3.960 3.573 4.511 . 0 0 "[ . 1 . 2]" 1
177 1 16 ARG H 1 17 ASN H 3.220 . 3.700 2.467 2.333 2.620 . 0 0 "[ . 1 . 2]" 1
178 1 16 ARG HA 1 18 PHE H 4.350 . 5.000 3.852 3.647 4.112 . 0 0 "[ . 1 . 2]" 1
179 1 16 ARG HB2 1 16 ARG QD 2.800 . 3.220 2.493 2.268 2.977 . 0 0 "[ . 1 . 2]" 1
180 1 16 ARG HB2 1 16 ARG HG3 2.400 . 2.760 2.421 2.297 2.871 0.111 14 0 "[ . 1 . 2]" 1
181 1 16 ARG HB2 1 17 ASN HD21 4.450 . 5.120 3.568 2.701 5.006 . 0 0 "[ . 1 . 2]" 1
182 1 16 ARG HB3 1 17 ASN H 3.910 . 4.500 3.659 2.537 4.314 . 0 0 "[ . 1 . 2]" 1
183 1 16 ARG HG3 1 17 ASN H 4.480 . 5.150 3.961 3.130 4.496 . 0 0 "[ . 1 . 2]" 1
184 1 16 ARG HG3 1 17 ASN HD21 4.250 . 4.890 4.329 2.645 4.741 . 0 0 "[ . 1 . 2]" 1
185 1 17 ASN H 1 17 ASN HB2 3.680 . 4.230 3.753 3.633 3.878 . 0 0 "[ . 1 . 2]" 1
186 1 17 ASN H 1 17 ASN HB3 3.400 . 3.910 2.950 2.725 3.309 . 0 0 "[ . 1 . 2]" 1
187 1 17 ASN H 1 17 ASN HD21 4.460 . 5.130 2.488 2.189 3.002 . 0 0 "[ . 1 . 2]" 1
188 1 17 ASN H 1 17 ASN HD22 3.910 . 4.500 3.285 3.021 3.581 . 0 0 "[ . 1 . 2]" 1
189 1 17 ASN H 1 18 PHE H 3.310 . 3.810 2.373 1.914 2.662 . 0 0 "[ . 1 . 2]" 1
190 1 17 ASN HB2 1 17 ASN HD22 3.670 . 4.220 3.977 3.914 4.012 . 0 0 "[ . 1 . 2]" 1
191 1 17 ASN HB2 1 20 ASN HB3 3.770 . 4.340 3.545 2.691 4.208 . 0 0 "[ . 1 . 2]" 1
192 1 17 ASN HB2 1 20 ASN HD21 4.110 . 4.730 3.373 1.860 3.959 . 0 0 "[ . 1 . 2]" 1
193 1 17 ASN HB2 1 20 ASN HD22 4.570 . 5.260 4.140 2.653 5.092 . 0 0 "[ . 1 . 2]" 1
194 1 17 ASN HB3 1 17 ASN HD22 3.620 . 4.160 3.403 3.367 3.456 . 0 0 "[ . 1 . 2]" 1
195 1 17 ASN HD22 1 18 PHE H 4.600 . 5.290 5.144 5.088 5.191 . 0 0 "[ . 1 . 2]" 1
196 1 18 PHE H 1 18 PHE HB2 3.100 . 3.570 2.491 2.320 2.623 . 0 0 "[ . 1 . 2]" 1
197 1 18 PHE H 1 18 PHE HB3 3.030 . 3.480 2.612 2.412 2.848 . 0 0 "[ . 1 . 2]" 1
198 1 18 PHE H 1 19 SER H 3.590 . 4.130 2.933 2.668 3.387 . 0 0 "[ . 1 . 2]" 1
199 1 18 PHE HA 1 18 PHE QD 3.200 . 3.680 2.824 2.630 3.156 . 0 0 "[ . 1 . 2]" 1
200 1 18 PHE HB2 1 19 SER H 4.100 . 4.720 3.990 3.719 4.128 . 0 0 "[ . 1 . 2]" 1
201 1 18 PHE HB3 1 19 SER H 3.530 . 4.060 2.764 2.552 2.934 . 0 0 "[ . 1 . 2]" 1
202 1 18 PHE QE 1 57 LEU HB2 3.740 . 4.300 3.598 2.120 4.172 . 0 0 "[ . 1 . 2]" 1
203 1 18 PHE QE 1 57 LEU HB3 3.770 . 4.340 2.764 2.233 4.154 . 0 0 "[ . 1 . 2]" 1
204 1 18 PHE QE 1 57 LEU MD1 4.430 . 5.090 4.085 2.886 4.731 . 0 0 "[ . 1 . 2]" 1
205 1 19 SER H 1 19 SER QB 3.070 . 3.530 2.473 2.242 2.744 . 0 0 "[ . 1 . 2]" 1
206 1 19 SER H 1 20 ASN H 3.310 . 3.810 2.678 2.540 2.810 . 0 0 "[ . 1 . 2]" 1
207 1 19 SER QB 1 20 ASN H 4.220 . 4.850 3.019 2.541 3.694 . 0 0 "[ . 1 . 2]" 1
208 1 20 ASN H 1 20 ASN HB2 3.100 . 3.570 2.556 2.267 2.937 . 0 0 "[ . 1 . 2]" 1
209 1 20 ASN H 1 20 ASN HB3 3.480 . 4.000 2.984 2.287 3.657 . 0 0 "[ . 1 . 2]" 1
210 1 20 ASN H 1 20 ASN HD21 4.360 . 5.010 4.496 3.859 4.820 . 0 0 "[ . 1 . 2]" 1
211 1 20 ASN H 1 21 PHE QD 4.390 . 5.050 3.788 3.041 4.547 . 0 0 "[ . 1 . 2]" 1
212 1 21 PHE H 1 21 PHE HB2 3.600 . 4.140 2.560 2.281 3.776 . 0 0 "[ . 1 . 2]" 1
213 1 21 PHE H 1 21 PHE HB3 3.240 . 3.730 3.514 2.938 3.616 . 0 0 "[ . 1 . 2]" 1
214 1 21 PHE H 1 21 PHE QD 3.400 . 3.910 2.514 2.239 2.815 . 0 0 "[ . 1 . 2]" 1
215 1 21 PHE H 1 22 CYS H 2.950 . 3.390 2.523 2.270 2.840 . 0 0 "[ . 1 . 2]" 1
216 1 21 PHE H 1 22 CYS HB2 4.800 . 5.520 4.683 4.207 5.336 . 0 0 "[ . 1 . 2]" 1
217 1 21 PHE HA 1 86 LEU MD1 3.780 . 4.350 3.022 2.306 4.183 . 0 0 "[ . 1 . 2]" 1
218 1 21 PHE HA 1 86 LEU MD2 4.040 . 4.650 2.875 2.112 4.324 . 0 0 "[ . 1 . 2]" 1
219 1 21 PHE HB2 1 61 PHE QE 3.710 . 4.270 3.698 3.095 4.097 . 0 0 "[ . 1 . 2]" 1
220 1 21 PHE HB3 1 22 CYS H 4.370 . 5.030 4.276 4.008 4.651 . 0 0 "[ . 1 . 2]" 1
221 1 21 PHE QD 1 61 PHE QE 3.660 . 4.210 3.889 2.876 4.086 . 0 0 "[ . 1 . 2]" 1
222 1 22 CYS H 1 22 CYS HB2 3.190 . 3.670 2.625 2.369 3.604 . 0 0 "[ . 1 . 2]" 1
223 1 22 CYS H 1 22 CYS HB3 3.210 . 3.690 3.014 2.387 3.604 . 0 0 "[ . 1 . 2]" 1
224 1 22 CYS H 1 23 ASN H 3.460 . 3.980 2.550 2.187 3.004 . 0 0 "[ . 1 . 2]" 1
225 1 22 CYS HA 1 57 LEU MD1 3.530 . 4.060 2.662 1.800 3.930 . 0 0 "[ . 1 . 2]" 1
226 1 22 CYS HA 1 57 LEU MD2 3.360 . 3.860 3.227 2.121 3.880 0.020 7 0 "[ . 1 . 2]" 1
227 1 23 ASN H 1 23 ASN HB2 3.610 . 4.150 2.991 2.412 3.418 . 0 0 "[ . 1 . 2]" 1
228 1 23 ASN H 1 23 ASN HB3 3.240 . 3.730 2.795 2.477 3.615 . 0 0 "[ . 1 . 2]" 1
229 1 23 ASN H 1 24 VAL H 3.000 . 3.450 2.984 1.785 3.421 0.015 12 0 "[ . 1 . 2]" 1
230 1 23 ASN HA 1 23 ASN HD21 3.410 . 3.920 2.860 1.920 3.755 . 0 0 "[ . 1 . 2]" 1
231 1 23 ASN HA 1 23 ASN HD22 3.700 . 4.260 3.889 3.544 4.183 . 0 0 "[ . 1 . 2]" 1
232 1 24 VAL H 1 24 VAL HB 2.890 . 3.320 2.869 2.346 3.201 . 0 0 "[ . 1 . 2]" 1
233 1 24 VAL H 1 24 VAL MG1 3.000 . 3.450 2.475 2.170 2.646 . 0 0 "[ . 1 . 2]" 1
234 1 24 VAL H 1 24 VAL MG2 4.400 . 5.060 3.916 3.709 4.022 . 0 0 "[ . 1 . 2]" 1
235 1 24 VAL H 1 57 LEU MD2 4.160 . 4.780 4.070 3.411 4.653 . 0 0 "[ . 1 . 2]" 1
236 1 24 VAL HA 1 24 VAL MG1 2.990 . 3.440 3.215 3.183 3.249 . 0 0 "[ . 1 . 2]" 1
237 1 24 VAL HA 1 24 VAL MG2 3.220 . 3.700 2.300 2.245 2.351 . 0 0 "[ . 1 . 2]" 1
238 1 24 VAL HA 1 25 ASP H 2.580 . 2.970 2.459 2.207 2.641 . 0 0 "[ . 1 . 2]" 1
239 1 24 VAL HA 1 83 LEU MD1 3.720 . 4.280 2.614 1.887 3.889 . 0 0 "[ . 1 . 2]" 1
240 1 24 VAL HA 1 83 LEU MD2 4.230 . 4.860 4.182 3.223 4.689 . 0 0 "[ . 1 . 2]" 1
241 1 24 VAL HB 1 25 ASP H 3.900 . 4.490 4.023 3.851 4.235 . 0 0 "[ . 1 . 2]" 1
242 1 24 VAL HB 1 57 LEU MD1 3.350 . 3.850 3.843 3.783 3.911 0.061 12 0 "[ . 1 . 2]" 1
243 1 24 VAL HB 1 57 LEU MD2 4.170 . 4.800 4.029 3.341 4.606 . 0 0 "[ . 1 . 2]" 1
244 1 24 VAL MG1 1 25 ASP H 4.010 . 4.610 3.055 2.642 3.539 . 0 0 "[ . 1 . 2]" 1
245 1 24 VAL MG1 1 83 LEU MD1 3.560 . 4.090 3.956 3.862 4.017 . 0 0 "[ . 1 . 2]" 1
246 1 24 VAL MG1 1 86 LEU MD1 3.530 . 4.060 3.596 3.286 3.850 . 0 0 "[ . 1 . 2]" 1
247 1 24 VAL MG1 1 86 LEU MD2 4.290 . 4.930 4.798 4.737 4.867 . 0 0 "[ . 1 . 2]" 1
248 1 24 VAL MG2 1 25 ASP H 3.280 . 3.770 1.952 1.776 2.281 0.024 16 0 "[ . 1 . 2]" 1
249 1 24 VAL MG2 1 25 ASP HA 3.950 . 4.540 4.242 4.015 4.362 . 0 0 "[ . 1 . 2]" 1
250 1 24 VAL MG2 1 25 ASP HB2 4.010 . 4.610 4.258 3.744 4.468 . 0 0 "[ . 1 . 2]" 1
251 1 25 ASP H 1 25 ASP HB2 3.050 . 3.510 2.665 2.356 2.948 . 0 0 "[ . 1 . 2]" 1
252 1 25 ASP H 1 25 ASP HB3 3.040 . 3.500 2.727 2.509 3.515 0.015 8 0 "[ . 1 . 2]" 1
253 1 25 ASP H 1 53 ASN HD21 4.440 . 5.110 4.857 4.145 5.022 . 0 0 "[ . 1 . 2]" 1
254 1 25 ASP H 1 83 LEU MD1 4.110 . 4.730 2.734 1.972 3.265 . 0 0 "[ . 1 . 2]" 1
255 1 25 ASP HA 1 26 VAL H 2.780 . 3.200 2.298 2.070 2.736 . 0 0 "[ . 1 . 2]" 1
256 1 25 ASP HA 1 53 ASN HD21 3.800 . 4.370 3.166 1.845 4.151 . 0 0 "[ . 1 . 2]" 1
257 1 25 ASP HB2 1 28 GLU HB3 4.390 . 5.050 4.749 3.982 4.927 . 0 0 "[ . 1 . 2]" 1
258 1 25 ASP HB3 1 26 VAL H 3.980 . 4.580 3.704 2.779 4.289 . 0 0 "[ . 1 . 2]" 1
259 1 25 ASP HB3 1 28 GLU HB3 3.960 . 4.550 3.520 2.374 4.371 . 0 0 "[ . 1 . 2]" 1
260 1 26 VAL H 1 26 VAL HB 2.980 . 3.430 2.679 2.329 3.001 . 0 0 "[ . 1 . 2]" 1
261 1 26 VAL H 1 26 VAL MG2 3.970 . 4.570 2.418 1.906 3.265 . 0 0 "[ . 1 . 2]" 1
262 1 26 VAL H 1 27 VAL H 3.440 . 3.960 2.203 1.756 2.616 0.044 10 0 "[ . 1 . 2]" 1
263 1 26 VAL H 1 27 VAL MG1 4.460 . 5.130 4.005 3.503 4.409 . 0 0 "[ . 1 . 2]" 1
264 1 26 VAL H 1 53 ASN HD21 4.380 . 5.040 3.769 3.224 4.489 . 0 0 "[ . 1 . 2]" 1
265 1 26 VAL HA 1 26 VAL MG1 3.140 . 3.610 2.383 2.288 2.575 . 0 0 "[ . 1 . 2]" 1
266 1 26 VAL HA 1 26 VAL MG2 3.320 . 3.820 2.433 2.261 2.579 . 0 0 "[ . 1 . 2]" 1
267 1 26 VAL HA 1 29 ILE MD 3.320 . 3.820 2.285 1.971 2.990 . 0 0 "[ . 1 . 2]" 1
268 1 26 VAL HA 1 29 ILE QG 4.060 . 4.670 3.362 2.730 4.196 . 0 0 "[ . 1 . 2]" 1
269 1 26 VAL HA 1 60 LEU MD2 4.010 . 4.610 3.261 2.581 3.813 . 0 0 "[ . 1 . 2]" 1
270 1 26 VAL HB 1 27 VAL H 2.770 . 3.190 2.883 2.368 3.096 . 0 0 "[ . 1 . 2]" 1
271 1 26 VAL HB 1 56 THR MG 4.210 . 4.840 3.142 2.485 3.621 . 0 0 "[ . 1 . 2]" 1
272 1 26 VAL MG1 1 27 VAL H 3.620 . 4.160 3.746 3.434 3.983 . 0 0 "[ . 1 . 2]" 1
273 1 26 VAL MG1 1 53 ASN HD21 4.810 . 5.530 5.289 4.697 5.416 . 0 0 "[ . 1 . 2]" 1
274 1 26 VAL MG1 1 56 THR HB 3.770 . 4.340 3.117 2.781 4.143 . 0 0 "[ . 1 . 2]" 1
275 1 26 VAL MG1 1 56 THR MG 3.540 . 4.070 1.951 1.793 2.162 0.007 4 0 "[ . 1 . 2]" 1
276 1 26 VAL MG1 1 57 LEU H 3.940 . 4.530 4.250 3.677 4.411 . 0 0 "[ . 1 . 2]" 1
277 1 26 VAL MG1 1 57 LEU HA 3.320 . 3.820 3.430 2.528 3.698 . 0 0 "[ . 1 . 2]" 1
278 1 26 VAL MG1 1 57 LEU HG 4.050 . 4.660 4.438 4.077 4.601 . 0 0 "[ . 1 . 2]" 1
279 1 26 VAL MG1 1 60 LEU MD2 3.470 . 3.990 2.038 1.864 2.445 . 0 0 "[ . 1 . 2]" 1
280 1 26 VAL MG2 1 27 VAL H 3.830 . 4.400 3.839 3.476 4.114 . 0 0 "[ . 1 . 2]" 1
281 1 26 VAL MG2 1 53 ASN HA 4.340 . 4.990 2.916 2.170 4.285 . 0 0 "[ . 1 . 2]" 1
282 1 26 VAL MG2 1 53 ASN HD21 4.890 . 5.620 2.686 2.122 3.039 . 0 0 "[ . 1 . 2]" 1
283 1 26 VAL MG2 1 56 THR MG 3.310 . 3.810 2.941 1.952 3.462 . 0 0 "[ . 1 . 2]" 1
284 1 26 VAL MG2 1 57 LEU H 4.090 . 4.700 3.303 2.861 3.751 . 0 0 "[ . 1 . 2]" 1
285 1 26 VAL MG2 1 57 LEU HA 3.270 . 3.760 3.111 2.544 3.636 . 0 0 "[ . 1 . 2]" 1
286 1 26 VAL MG2 1 60 LEU MD2 2.650 . 3.050 2.747 2.149 3.001 . 0 0 "[ . 1 . 2]" 1
287 1 27 VAL H 1 27 VAL MG1 2.860 . 3.290 2.536 2.249 2.737 . 0 0 "[ . 1 . 2]" 1
288 1 27 VAL H 1 27 VAL MG2 3.760 . 4.320 2.035 1.904 2.304 . 0 0 "[ . 1 . 2]" 1
289 1 27 VAL H 1 28 GLU H 3.140 . 3.610 2.465 2.247 2.798 . 0 0 "[ . 1 . 2]" 1
290 1 27 VAL H 1 29 ILE H 4.090 . 4.700 3.813 3.586 3.993 . 0 0 "[ . 1 . 2]" 1
291 1 27 VAL H 1 29 ILE MD 4.550 . 5.230 5.047 5.018 5.118 . 0 0 "[ . 1 . 2]" 1
292 1 27 VAL HA 1 27 VAL HB 3.000 . 3.450 2.468 2.339 2.542 . 0 0 "[ . 1 . 2]" 1
293 1 27 VAL HA 1 27 VAL MG1 3.100 . 3.570 2.287 2.188 2.382 . 0 0 "[ . 1 . 2]" 1
294 1 27 VAL HA 1 27 VAL MG2 3.140 . 3.610 3.216 3.185 3.245 . 0 0 "[ . 1 . 2]" 1
295 1 27 VAL HA 1 30 LEU HB2 3.890 . 4.470 3.370 2.946 3.843 . 0 0 "[ . 1 . 2]" 1
296 1 27 VAL HA 1 30 LEU MD1 3.570 . 4.110 2.297 2.167 2.624 . 0 0 "[ . 1 . 2]" 1
297 1 27 VAL HA 1 30 LEU HG 3.810 . 4.380 2.242 1.984 2.793 . 0 0 "[ . 1 . 2]" 1
298 1 27 VAL HB 1 28 GLU H 3.450 . 3.970 3.857 3.815 3.909 . 0 0 "[ . 1 . 2]" 1
299 1 27 VAL MG1 1 28 GLU H 4.170 . 4.800 4.109 3.945 4.217 . 0 0 "[ . 1 . 2]" 1
300 1 27 VAL MG1 1 45 ARG HA 4.200 . 4.830 2.319 1.890 2.924 . 0 0 "[ . 1 . 2]" 1
301 1 27 VAL MG1 1 56 THR MG 3.650 . 4.200 3.931 3.314 4.117 . 0 0 "[ . 1 . 2]" 1
302 1 27 VAL MG2 1 28 GLU H 4.160 . 4.780 2.428 2.276 2.574 . 0 0 "[ . 1 . 2]" 1
303 1 27 VAL MG2 1 28 GLU HA 3.500 . 4.030 3.637 3.285 3.851 . 0 0 "[ . 1 . 2]" 1
304 1 28 GLU H 1 28 GLU HB2 3.130 . 3.600 2.267 2.100 2.512 . 0 0 "[ . 1 . 2]" 1
305 1 28 GLU H 1 28 GLU HB3 3.020 . 3.470 3.170 2.581 3.499 0.029 10 0 "[ . 1 . 2]" 1
306 1 28 GLU H 1 28 GLU QG 3.860 . 4.440 3.099 2.188 4.094 . 0 0 "[ . 1 . 2]" 1
307 1 28 GLU H 1 29 ILE H 3.010 . 3.460 2.504 2.320 2.645 . 0 0 "[ . 1 . 2]" 1
308 1 28 GLU HA 1 28 GLU QG 3.380 . 3.890 2.679 2.248 2.946 . 0 0 "[ . 1 . 2]" 1
309 1 28 GLU HB2 1 29 ILE H 3.600 . 4.140 3.407 2.772 3.940 . 0 0 "[ . 1 . 2]" 1
310 1 28 GLU HB2 1 81 CYS HB2 3.830 . 4.400 4.071 3.653 4.266 . 0 0 "[ . 1 . 2]" 1
311 1 28 GLU HB2 1 81 CYS HB3 3.640 . 4.190 3.727 2.977 4.042 . 0 0 "[ . 1 . 2]" 1
312 1 28 GLU HB3 1 29 ILE H 3.650 . 4.200 3.448 2.453 4.103 . 0 0 "[ . 1 . 2]" 1
313 1 28 GLU HB3 1 81 CYS HB2 3.840 . 4.420 3.438 2.774 4.227 . 0 0 "[ . 1 . 2]" 1
314 1 29 ILE H 1 29 ILE HB 3.030 . 3.480 2.319 2.168 2.610 . 0 0 "[ . 1 . 2]" 1
315 1 29 ILE H 1 29 ILE MD 4.250 . 4.890 3.746 3.577 4.193 . 0 0 "[ . 1 . 2]" 1
316 1 29 ILE H 1 29 ILE QG 3.600 . 4.140 2.515 2.195 3.035 . 0 0 "[ . 1 . 2]" 1
317 1 29 ILE H 1 30 LEU H 3.150 . 3.620 2.441 1.958 2.746 . 0 0 "[ . 1 . 2]" 1
318 1 29 ILE HA 1 29 ILE MD 4.260 . 4.900 3.826 3.786 3.860 . 0 0 "[ . 1 . 2]" 1
319 1 29 ILE HA 1 29 ILE QG 3.300 . 3.800 2.365 2.294 2.411 . 0 0 "[ . 1 . 2]" 1
320 1 29 ILE HA 1 32 TYR HB3 3.480 . 4.000 3.937 3.889 3.991 . 0 0 "[ . 1 . 2]" 1
321 1 29 ILE HA 1 32 TYR QD 2.830 . 3.250 2.957 2.054 3.149 . 0 0 "[ . 1 . 2]" 1
322 1 29 ILE HA 1 77 ALA MB 4.100 . 4.720 2.340 1.996 3.245 . 0 0 "[ . 1 . 2]" 1
323 1 29 ILE HB 1 29 ILE MD 3.240 . 3.730 2.442 2.382 2.496 . 0 0 "[ . 1 . 2]" 1
324 1 29 ILE MD 1 29 ILE MG 2.780 . 3.200 1.905 1.852 1.932 . 0 0 "[ . 1 . 2]" 1
325 1 29 ILE MD 1 60 LEU MD2 3.760 . 4.320 2.673 2.285 2.966 . 0 0 "[ . 1 . 2]" 1
326 1 29 ILE MD 1 77 ALA MB 3.740 . 4.300 3.194 2.956 3.509 . 0 0 "[ . 1 . 2]" 1
327 1 29 ILE MD 1 78 LEU HA 4.150 . 4.770 3.901 3.165 4.579 . 0 0 "[ . 1 . 2]" 1
328 1 29 ILE MD 1 78 LEU HG 4.390 . 5.050 4.646 4.072 4.866 . 0 0 "[ . 1 . 2]" 1
329 1 29 ILE QG 1 30 LEU H 4.300 . 4.950 4.210 4.086 4.418 . 0 0 "[ . 1 . 2]" 1
330 1 29 ILE QG 1 77 ALA HA 3.930 . 4.520 4.104 3.490 4.374 . 0 0 "[ . 1 . 2]" 1
331 1 29 ILE MG 1 30 LEU H 3.670 . 4.220 3.312 3.144 3.456 . 0 0 "[ . 1 . 2]" 1
332 1 29 ILE MG 1 30 LEU HA 3.640 . 4.190 3.190 2.986 3.369 . 0 0 "[ . 1 . 2]" 1
333 1 29 ILE MG 1 60 LEU MD2 3.610 . 4.150 2.638 2.188 3.382 . 0 0 "[ . 1 . 2]" 1
334 1 29 ILE MG 1 77 ALA MB 3.320 . 3.820 1.939 1.806 2.114 . 0 0 "[ . 1 . 2]" 1
335 1 30 LEU H 1 30 LEU HB2 3.160 . 3.630 2.597 2.504 2.667 . 0 0 "[ . 1 . 2]" 1
336 1 30 LEU H 1 30 LEU HB3 3.590 . 4.130 3.621 3.573 3.644 . 0 0 "[ . 1 . 2]" 1
337 1 30 LEU H 1 30 LEU MD1 4.090 . 4.700 3.599 3.539 3.662 . 0 0 "[ . 1 . 2]" 1
338 1 30 LEU H 1 30 LEU MD2 4.110 . 4.730 3.179 2.922 3.383 . 0 0 "[ . 1 . 2]" 1
339 1 30 LEU H 1 30 LEU HG 3.300 . 3.800 2.165 1.990 2.308 . 0 0 "[ . 1 . 2]" 1
340 1 30 LEU H 1 31 PRO HD2 3.360 . 3.860 2.673 2.360 3.385 . 0 0 "[ . 1 . 2]" 1
341 1 30 LEU HA 1 30 LEU MD2 2.910 . 3.350 2.038 1.999 2.103 . 0 0 "[ . 1 . 2]" 1
342 1 30 LEU HA 1 33 LEU H 4.300 . 4.950 3.635 3.306 3.885 . 0 0 "[ . 1 . 2]" 1
343 1 30 LEU HA 1 33 LEU MD2 3.400 . 3.910 3.778 3.627 3.844 . 0 0 "[ . 1 . 2]" 1
344 1 30 LEU HB2 1 30 LEU MD1 3.490 . 4.010 2.309 2.262 2.365 . 0 0 "[ . 1 . 2]" 1
345 1 30 LEU HB2 1 31 PRO HD2 3.050 . 3.510 2.903 2.579 3.401 . 0 0 "[ . 1 . 2]" 1
346 1 30 LEU HB3 1 30 LEU MD1 3.260 . 3.750 2.377 2.355 2.426 . 0 0 "[ . 1 . 2]" 1
347 1 30 LEU HB3 1 30 LEU MD2 3.490 . 4.010 2.362 2.318 2.430 . 0 0 "[ . 1 . 2]" 1
348 1 30 LEU HB3 1 31 PRO HD3 3.510 . 4.040 3.411 3.177 3.703 . 0 0 "[ . 1 . 2]" 1
349 1 30 LEU MD1 1 41 GLN HA 4.120 . 4.740 3.387 2.875 4.036 . 0 0 "[ . 1 . 2]" 1
350 1 30 LEU MD1 1 44 LEU HB3 3.840 . 4.420 3.195 2.812 3.661 . 0 0 "[ . 1 . 2]" 1
351 1 30 LEU MD1 1 45 ARG H 4.120 . 4.740 2.790 2.508 3.344 . 0 0 "[ . 1 . 2]" 1
352 1 30 LEU MD1 1 45 ARG HA 4.120 . 4.740 2.809 2.315 3.697 . 0 0 "[ . 1 . 2]" 1
353 1 30 LEU MD1 1 45 ARG HG3 4.460 . 5.130 3.297 2.105 4.412 . 0 0 "[ . 1 . 2]" 1
354 1 30 LEU MD2 1 41 GLN HA 3.610 . 4.150 2.328 2.025 2.744 . 0 0 "[ . 1 . 2]" 1
355 1 30 LEU MD2 1 41 GLN HG3 3.870 . 4.450 3.881 3.465 4.149 . 0 0 "[ . 1 . 2]" 1
356 1 30 LEU MD2 1 42 ASP H 4.570 . 5.260 5.012 4.744 5.089 . 0 0 "[ . 1 . 2]" 1
357 1 31 PRO HA 1 33 LEU H 3.890 . 4.470 3.834 3.683 4.008 . 0 0 "[ . 1 . 2]" 1
358 1 31 PRO HB2 1 32 TYR H 3.680 . 4.230 3.726 3.319 4.025 . 0 0 "[ . 1 . 2]" 1
359 1 31 PRO HB3 1 32 TYR H 4.250 . 4.890 4.406 4.315 4.524 . 0 0 "[ . 1 . 2]" 1
360 1 31 PRO HD2 1 32 TYR H 3.670 . 4.220 2.936 2.801 3.079 . 0 0 "[ . 1 . 2]" 1
361 1 32 TYR H 1 32 TYR HB2 3.530 . 4.060 2.198 2.084 2.264 . 0 0 "[ . 1 . 2]" 1
362 1 32 TYR H 1 32 TYR HB3 3.180 . 3.660 3.511 3.442 3.554 . 0 0 "[ . 1 . 2]" 1
363 1 32 TYR H 1 32 TYR QD 3.300 . 3.800 2.997 2.181 3.608 . 0 0 "[ . 1 . 2]" 1
364 1 32 TYR HA 1 32 TYR QD 3.080 . 3.540 2.697 2.009 3.204 . 0 0 "[ . 1 . 2]" 1
365 1 32 TYR HB2 1 33 LEU H 4.460 . 5.130 3.341 3.049 3.631 . 0 0 "[ . 1 . 2]" 1
366 1 32 TYR HB2 1 77 ALA HA 3.440 . 3.960 2.936 2.706 3.395 . 0 0 "[ . 1 . 2]" 1
367 1 32 TYR HB2 1 77 ALA MB 3.470 . 3.990 2.794 2.508 3.551 . 0 0 "[ . 1 . 2]" 1
368 1 32 TYR HB3 1 77 ALA HA 3.430 . 3.940 2.282 1.925 2.614 . 0 0 "[ . 1 . 2]" 1
369 1 32 TYR HB3 1 77 ALA MB 3.380 . 3.890 2.618 2.254 3.578 . 0 0 "[ . 1 . 2]" 1
370 1 32 TYR QD 1 77 ALA MB 4.450 . 5.120 3.731 2.498 4.871 . 0 0 "[ . 1 . 2]" 1
371 1 33 LEU H 1 33 LEU HB2 3.350 . 3.850 2.514 2.258 3.060 . 0 0 "[ . 1 . 2]" 1
372 1 33 LEU H 1 33 LEU HB3 3.680 . 4.230 3.447 2.515 3.665 . 0 0 "[ . 1 . 2]" 1
373 1 33 LEU H 1 33 LEU MD1 5.080 . 5.840 2.896 2.584 4.326 . 0 0 "[ . 1 . 2]" 1
374 1 33 LEU H 1 33 LEU MD2 4.110 . 4.730 4.152 4.001 4.417 . 0 0 "[ . 1 . 2]" 1
375 1 33 LEU H 1 33 LEU HG 3.800 . 4.370 4.247 4.211 4.272 . 0 0 "[ . 1 . 2]" 1
376 1 33 LEU H 1 34 PRO QD 3.480 . 4.000 3.608 3.293 3.896 . 0 0 "[ . 1 . 2]" 1
377 1 33 LEU HA 1 33 LEU MD1 3.240 . 3.730 2.587 2.107 2.806 . 0 0 "[ . 1 . 2]" 1
378 1 33 LEU HA 1 34 PRO QD 3.030 . 3.480 2.062 1.928 2.187 . 0 0 "[ . 1 . 2]" 1
379 1 33 LEU HA 1 73 TYR HB2 3.810 . 4.380 3.618 3.032 4.245 . 0 0 "[ . 1 . 2]" 1
380 1 33 LEU HB2 1 33 LEU MD2 3.350 . 3.850 2.343 2.267 2.446 . 0 0 "[ . 1 . 2]" 1
381 1 33 LEU HB3 1 33 LEU MD2 3.330 . 3.830 2.320 2.248 2.366 . 0 0 "[ . 1 . 2]" 1
382 1 33 LEU MD1 1 34 PRO QD 4.240 . 4.880 3.764 2.955 4.073 . 0 0 "[ . 1 . 2]" 1
383 1 33 LEU MD1 1 73 TYR HB2 3.620 . 4.160 3.549 2.319 4.021 . 0 0 "[ . 1 . 2]" 1
384 1 33 LEU MD1 1 73 TYR HB3 3.880 . 4.460 3.042 2.239 3.577 . 0 0 "[ . 1 . 2]" 1
385 1 33 LEU MD1 1 74 PHE H 4.530 . 5.210 3.846 3.131 4.114 . 0 0 "[ . 1 . 2]" 1
386 1 33 LEU MD1 1 74 PHE HA 3.390 . 3.900 2.106 1.861 2.263 . 0 0 "[ . 1 . 2]" 1
387 1 33 LEU MD1 1 74 PHE QD 3.640 . 4.190 2.740 2.060 3.099 . 0 0 "[ . 1 . 2]" 1
388 1 33 LEU MD1 1 77 ALA H 4.820 . 5.540 3.607 3.328 3.842 . 0 0 "[ . 1 . 2]" 1
389 1 33 LEU MD1 1 77 ALA MB 3.480 . 4.000 1.869 1.786 2.006 0.014 20 0 "[ . 1 . 2]" 1
390 1 33 LEU MD2 1 60 LEU MD2 3.720 . 4.280 3.953 3.229 4.140 . 0 0 "[ . 1 . 2]" 1
391 1 33 LEU MD2 1 64 LEU HG 4.240 . 4.880 3.247 2.293 4.626 . 0 0 "[ . 1 . 2]" 1
392 1 33 LEU HG 1 77 ALA MB 3.430 . 3.940 3.862 3.801 3.984 0.044 1 0 "[ . 1 . 2]" 1
393 1 35 CYS H 1 35 CYS HB3 3.800 . 4.370 2.988 2.477 3.707 . 0 0 "[ . 1 . 2]" 1
394 1 35 CYS H 1 36 LEU H 3.140 . 3.610 2.487 2.043 3.363 . 0 0 "[ . 1 . 2]" 1
395 1 35 CYS HA 1 35 CYS HB2 2.830 . 3.250 2.609 2.437 3.021 . 0 0 "[ . 1 . 2]" 1
396 1 35 CYS HA 1 35 CYS HB3 3.000 . 3.450 2.670 2.324 3.037 . 0 0 "[ . 1 . 2]" 1
397 1 35 CYS HB3 1 36 LEU H 3.960 . 4.550 3.771 2.758 4.420 . 0 0 "[ . 1 . 2]" 1
398 1 36 LEU H 1 36 LEU HB2 3.180 . 3.660 2.481 2.265 2.724 . 0 0 "[ . 1 . 2]" 1
399 1 36 LEU H 1 36 LEU HB3 3.670 . 4.220 3.652 3.529 3.800 . 0 0 "[ . 1 . 2]" 1
400 1 36 LEU H 1 36 LEU MD1 4.160 . 4.780 2.557 2.099 3.928 . 0 0 "[ . 1 . 2]" 1
401 1 36 LEU H 1 36 LEU MD2 4.360 . 5.010 4.079 2.166 4.531 . 0 0 "[ . 1 . 2]" 1
402 1 36 LEU H 1 37 THR H 4.680 . 5.380 4.463 4.234 4.551 . 0 0 "[ . 1 . 2]" 1
403 1 36 LEU H 1 41 GLN HG3 4.300 . 4.950 4.640 4.237 4.813 . 0 0 "[ . 1 . 2]" 1
404 1 36 LEU HA 1 36 LEU MD1 3.040 . 3.500 3.191 2.129 3.607 0.107 18 0 "[ . 1 . 2]" 1
405 1 36 LEU HA 1 36 LEU MD2 3.000 . 3.450 3.272 1.958 3.541 0.091 12 0 "[ . 1 . 2]" 1
406 1 36 LEU HA 1 37 THR H 2.920 . 3.360 2.266 2.082 2.469 . 0 0 "[ . 1 . 2]" 1
407 1 36 LEU HB2 1 36 LEU MD1 3.470 . 3.990 2.304 2.161 3.208 . 0 0 "[ . 1 . 2]" 1
408 1 36 LEU HB2 1 37 THR H 3.760 . 4.320 3.860 3.399 4.215 . 0 0 "[ . 1 . 2]" 1
409 1 36 LEU HB2 1 41 GLN HE21 4.600 . 5.290 3.149 2.469 4.564 . 0 0 "[ . 1 . 2]" 1
410 1 36 LEU HB2 1 41 GLN HE22 4.290 . 4.930 4.098 3.501 4.724 . 0 0 "[ . 1 . 2]" 1
411 1 36 LEU HB2 1 41 GLN HG3 3.460 . 3.980 2.790 2.101 3.467 . 0 0 "[ . 1 . 2]" 1
412 1 36 LEU HB3 1 36 LEU MD1 3.460 . 3.980 3.017 2.116 3.213 . 0 0 "[ . 1 . 2]" 1
413 1 36 LEU HB3 1 37 THR H 2.970 . 3.420 2.720 2.116 3.232 . 0 0 "[ . 1 . 2]" 1
414 1 36 LEU HB3 1 40 ASP HB2 3.410 . 3.920 2.708 1.821 3.795 . 0 0 "[ . 1 . 2]" 1
415 1 36 LEU HB3 1 40 ASP HB3 3.980 . 4.580 2.847 2.289 3.616 . 0 0 "[ . 1 . 2]" 1
416 1 36 LEU HB3 1 41 GLN H 4.170 . 4.800 3.715 3.156 4.347 . 0 0 "[ . 1 . 2]" 1
417 1 36 LEU MD2 1 37 THR H 4.120 . 4.740 3.993 3.504 4.570 . 0 0 "[ . 1 . 2]" 1
418 1 36 LEU MD2 1 40 ASP HB2 3.870 . 4.450 3.471 2.811 4.345 . 0 0 "[ . 1 . 2]" 1
419 1 36 LEU MD2 1 40 ASP HB3 3.810 . 4.380 2.696 2.023 4.194 . 0 0 "[ . 1 . 2]" 1
420 1 36 LEU MD2 1 64 LEU H 4.320 . 4.970 3.733 3.030 4.677 . 0 0 "[ . 1 . 2]" 1
421 1 36 LEU MD2 1 64 LEU HA 3.520 . 4.050 2.799 1.865 3.880 . 0 0 "[ . 1 . 2]" 1
422 1 37 THR H 1 37 THR MG 3.060 . 3.520 3.279 2.678 3.527 0.007 18 0 "[ . 1 . 2]" 1
423 1 37 THR H 1 40 ASP H 4.340 . 4.990 4.053 3.625 4.609 . 0 0 "[ . 1 . 2]" 1
424 1 37 THR H 1 40 ASP HB2 3.410 . 3.920 2.829 2.465 3.193 . 0 0 "[ . 1 . 2]" 1
425 1 37 THR H 1 40 ASP HB3 3.760 . 4.320 3.815 2.668 4.242 . 0 0 "[ . 1 . 2]" 1
426 1 37 THR H 1 67 ARG QD 4.060 . 4.670 4.280 2.309 4.549 . 0 0 "[ . 1 . 2]" 1
427 1 37 THR H 1 67 ARG HE 4.420 . 5.080 4.116 2.771 4.955 . 0 0 "[ . 1 . 2]" 1
428 1 37 THR HA 1 37 THR MG 3.080 . 3.540 2.160 2.131 2.212 . 0 0 "[ . 1 . 2]" 1
429 1 37 THR HA 1 38 ALA H 2.840 . 3.270 2.379 2.255 2.563 . 0 0 "[ . 1 . 2]" 1
430 1 37 THR HA 1 38 ALA MB 4.160 . 4.780 4.141 4.049 4.250 . 0 0 "[ . 1 . 2]" 1
431 1 37 THR HB 1 38 ALA H 3.010 . 3.460 3.147 2.653 3.368 . 0 0 "[ . 1 . 2]" 1
432 1 37 THR HB 1 38 ALA MB 4.110 . 4.730 4.395 4.030 4.592 . 0 0 "[ . 1 . 2]" 1
433 1 37 THR HB 1 39 ARG H 3.440 . 3.960 2.975 2.593 3.366 . 0 0 "[ . 1 . 2]" 1
434 1 37 THR HB 1 40 ASP H 3.920 . 4.510 2.606 2.128 3.030 . 0 0 "[ . 1 . 2]" 1
435 1 37 THR HB 1 40 ASP HB2 3.040 . 3.500 3.341 2.969 3.432 . 0 0 "[ . 1 . 2]" 1
436 1 37 THR MG 1 38 ALA H 3.960 . 4.550 2.457 1.971 3.383 . 0 0 "[ . 1 . 2]" 1
437 1 38 ALA H 1 38 ALA MB 2.770 . 3.190 2.221 2.196 2.252 . 0 0 "[ . 1 . 2]" 1
438 1 38 ALA H 1 39 ARG H 3.330 . 3.830 2.807 2.553 3.069 . 0 0 "[ . 1 . 2]" 1
439 1 38 ALA HA 1 41 GLN H 3.840 . 4.420 3.615 3.357 3.912 . 0 0 "[ . 1 . 2]" 1
440 1 38 ALA HA 1 41 GLN QB 3.950 . 4.540 2.965 2.535 3.528 . 0 0 "[ . 1 . 2]" 1
441 1 38 ALA MB 1 39 ARG H 3.080 . 3.540 2.492 2.324 2.698 . 0 0 "[ . 1 . 2]" 1
442 1 38 ALA MB 1 41 GLN H 4.850 . 5.580 4.738 4.564 4.943 . 0 0 "[ . 1 . 2]" 1
443 1 39 ARG H 1 39 ARG HB2 3.120 . 3.590 2.507 2.211 3.519 . 0 0 "[ . 1 . 2]" 1
444 1 39 ARG H 1 39 ARG HB3 3.120 . 3.590 3.123 2.406 3.556 . 0 0 "[ . 1 . 2]" 1
445 1 39 ARG H 1 39 ARG HG3 4.370 . 5.030 3.288 1.776 4.540 0.024 11 0 "[ . 1 . 2]" 1
446 1 39 ARG H 1 40 ASP H 3.250 . 3.740 2.643 2.531 2.807 . 0 0 "[ . 1 . 2]" 1
447 1 39 ARG HA 1 39 ARG QD 3.930 . 4.520 3.437 2.001 4.304 . 0 0 "[ . 1 . 2]" 1
448 1 39 ARG HA 1 39 ARG HG2 3.460 . 3.980 3.071 2.437 3.816 . 0 0 "[ . 1 . 2]" 1
449 1 39 ARG HA 1 39 ARG HG3 3.500 . 4.030 3.067 2.396 3.738 . 0 0 "[ . 1 . 2]" 1
450 1 39 ARG HA 1 42 ASP H 4.350 . 5.000 3.466 2.910 4.575 . 0 0 "[ . 1 . 2]" 1
451 1 39 ARG HA 1 42 ASP HB3 3.650 . 4.200 2.482 2.020 4.064 . 0 0 "[ . 1 . 2]" 1
452 1 39 ARG HB2 1 40 ASP H 3.730 . 4.290 3.190 2.460 4.127 . 0 0 "[ . 1 . 2]" 1
453 1 39 ARG HB3 1 39 ARG QD 3.560 . 4.090 2.848 2.250 3.522 . 0 0 "[ . 1 . 2]" 1
454 1 39 ARG HB3 1 39 ARG HG3 2.750 . 3.160 2.814 2.385 3.014 . 0 0 "[ . 1 . 2]" 1
455 1 39 ARG HB3 1 40 ASP H 3.590 . 4.130 3.347 2.357 3.940 . 0 0 "[ . 1 . 2]" 1
456 1 39 ARG QD 1 39 ARG HG3 2.670 . 3.070 2.281 2.152 2.405 . 0 0 "[ . 1 . 2]" 1
457 1 39 ARG QD 1 40 ASP H 4.420 . 5.080 4.720 4.187 4.935 . 0 0 "[ . 1 . 2]" 1
458 1 39 ARG HG3 1 40 ASP H 4.540 . 5.220 4.316 2.148 5.049 . 0 0 "[ . 1 . 2]" 1
459 1 40 ASP H 1 40 ASP HB2 3.240 . 3.730 2.405 2.223 2.628 . 0 0 "[ . 1 . 2]" 1
460 1 40 ASP H 1 40 ASP HB3 3.930 . 4.520 3.442 2.666 3.692 . 0 0 "[ . 1 . 2]" 1
461 1 40 ASP H 1 41 GLN H 3.250 . 3.740 2.612 2.419 2.835 . 0 0 "[ . 1 . 2]" 1
462 1 40 ASP H 1 42 ASP H 4.230 . 4.860 3.880 3.610 4.091 . 0 0 "[ . 1 . 2]" 1
463 1 40 ASP HA 1 43 ARG QB 3.300 . 3.800 3.072 2.567 3.657 . 0 0 "[ . 1 . 2]" 1
464 1 40 ASP HB2 1 41 GLN H 3.350 . 3.850 2.673 2.092 3.560 . 0 0 "[ . 1 . 2]" 1
465 1 40 ASP HB2 1 63 THR MG 4.140 . 4.760 4.048 3.531 4.608 . 0 0 "[ . 1 . 2]" 1
466 1 40 ASP HB3 1 41 GLN H 3.560 . 4.090 3.182 2.253 3.551 . 0 0 "[ . 1 . 2]" 1
467 1 40 ASP HB3 1 63 THR MG 3.790 . 4.360 2.964 2.084 4.222 . 0 0 "[ . 1 . 2]" 1
468 1 41 GLN H 1 41 GLN QB 3.100 . 3.570 2.435 2.350 2.520 . 0 0 "[ . 1 . 2]" 1
469 1 41 GLN H 1 41 GLN HG2 3.190 . 3.670 3.172 2.126 3.541 . 0 0 "[ . 1 . 2]" 1
470 1 41 GLN H 1 41 GLN HG3 3.760 . 4.320 2.615 1.998 3.785 . 0 0 "[ . 1 . 2]" 1
471 1 41 GLN H 1 42 ASP H 2.980 . 3.430 2.558 2.340 2.688 . 0 0 "[ . 1 . 2]" 1
472 1 41 GLN HA 1 41 GLN HG2 3.730 . 4.290 2.698 2.341 3.140 . 0 0 "[ . 1 . 2]" 1
473 1 41 GLN HA 1 41 GLN HG3 3.270 . 3.760 3.223 2.932 3.697 . 0 0 "[ . 1 . 2]" 1
474 1 41 GLN QB 1 42 ASP H 3.150 . 3.620 2.585 2.370 3.039 . 0 0 "[ . 1 . 2]" 1
475 1 42 ASP H 1 42 ASP HB2 3.000 . 3.450 2.500 2.364 2.588 . 0 0 "[ . 1 . 2]" 1
476 1 42 ASP H 1 42 ASP HB3 2.910 . 3.350 2.519 2.354 2.630 . 0 0 "[ . 1 . 2]" 1
477 1 42 ASP H 1 43 ARG H 3.230 . 3.710 2.692 2.447 2.858 . 0 0 "[ . 1 . 2]" 1
478 1 42 ASP HA 1 43 ARG H 3.540 . 4.070 3.501 3.447 3.554 . 0 0 "[ . 1 . 2]" 1
479 1 42 ASP HB2 1 43 ARG H 3.370 . 3.880 3.749 3.690 3.797 . 0 0 "[ . 1 . 2]" 1
480 1 42 ASP HB3 1 43 ARG H 3.420 . 3.930 2.432 2.316 2.689 . 0 0 "[ . 1 . 2]" 1
481 1 43 ARG H 1 43 ARG QB 2.780 . 3.200 2.348 2.126 2.598 . 0 0 "[ . 1 . 2]" 1
482 1 43 ARG H 1 43 ARG HG2 3.970 . 4.570 3.592 1.962 4.465 . 0 0 "[ . 1 . 2]" 1
483 1 43 ARG HA 1 43 ARG HG2 3.490 . 4.010 3.064 2.544 3.843 . 0 0 "[ . 1 . 2]" 1
484 1 43 ARG HA 1 43 ARG HG3 3.730 . 4.290 3.154 2.511 3.813 . 0 0 "[ . 1 . 2]" 1
485 1 43 ARG QB 1 43 ARG QD 3.150 . 3.620 2.356 2.081 2.894 . 0 0 "[ . 1 . 2]" 1
486 1 43 ARG QB 1 43 ARG HG2 2.540 . 2.920 2.309 2.099 2.423 . 0 0 "[ . 1 . 2]" 1
487 1 44 LEU H 1 44 LEU HB2 2.750 . 3.160 2.429 2.389 2.511 . 0 0 "[ . 1 . 2]" 1
488 1 44 LEU H 1 44 LEU HB3 3.360 . 3.860 3.569 3.547 3.596 . 0 0 "[ . 1 . 2]" 1
489 1 44 LEU H 1 44 LEU MD1 3.800 . 4.370 3.517 3.423 3.600 . 0 0 "[ . 1 . 2]" 1
490 1 44 LEU H 1 44 LEU HG 3.070 . 3.530 2.326 2.113 2.450 . 0 0 "[ . 1 . 2]" 1
491 1 44 LEU H 1 45 ARG H 3.010 . 3.460 2.600 2.429 2.740 . 0 0 "[ . 1 . 2]" 1
492 1 44 LEU HA 1 44 LEU MD1 4.120 . 4.740 3.871 3.839 3.900 . 0 0 "[ . 1 . 2]" 1
493 1 44 LEU HA 1 44 LEU MD2 2.900 . 3.340 2.065 2.009 2.149 . 0 0 "[ . 1 . 2]" 1
494 1 44 LEU HA 1 44 LEU HG 3.920 . 4.510 3.005 2.894 3.163 . 0 0 "[ . 1 . 2]" 1
495 1 44 LEU HA 1 47 THR HB 3.580 . 4.120 2.853 2.547 3.320 . 0 0 "[ . 1 . 2]" 1
496 1 44 LEU HB2 1 44 LEU MD1 3.190 . 3.670 2.299 2.240 2.352 . 0 0 "[ . 1 . 2]" 1
497 1 44 LEU HB2 1 45 ARG H 3.430 . 3.940 2.578 2.344 2.895 . 0 0 "[ . 1 . 2]" 1
498 1 44 LEU HB3 1 44 LEU MD1 3.360 . 3.860 2.431 2.372 2.482 . 0 0 "[ . 1 . 2]" 1
499 1 44 LEU HB3 1 44 LEU MD2 3.080 . 3.540 2.333 2.273 2.401 . 0 0 "[ . 1 . 2]" 1
500 1 44 LEU HB3 1 45 ARG H 3.880 . 4.460 3.583 3.405 3.831 . 0 0 "[ . 1 . 2]" 1
501 1 44 LEU MD1 1 60 LEU HA 3.880 . 4.460 2.401 2.073 3.228 . 0 0 "[ . 1 . 2]" 1
502 1 44 LEU MD2 1 47 THR HB 4.180 . 4.810 3.785 3.313 4.306 . 0 0 "[ . 1 . 2]" 1
503 1 44 LEU MD2 1 59 HIS QB 3.350 . 3.850 2.295 2.027 3.084 . 0 0 "[ . 1 . 2]" 1
504 1 44 LEU MD2 1 60 LEU H 3.820 . 4.390 2.831 2.643 3.148 . 0 0 "[ . 1 . 2]" 1
505 1 44 LEU MD2 1 60 LEU HA 3.270 . 3.760 2.254 1.887 2.562 . 0 0 "[ . 1 . 2]" 1
506 1 44 LEU MD2 1 60 LEU HB3 3.440 . 3.960 3.843 3.808 3.890 . 0 0 "[ . 1 . 2]" 1
507 1 45 ARG H 1 45 ARG QB 3.080 . 3.540 2.252 2.105 2.497 . 0 0 "[ . 1 . 2]" 1
508 1 45 ARG H 1 45 ARG HG3 4.180 . 4.810 4.252 2.352 4.522 . 0 0 "[ . 1 . 2]" 1
509 1 45 ARG H 1 46 ALA H 3.070 . 3.530 2.707 2.364 3.055 . 0 0 "[ . 1 . 2]" 1
510 1 45 ARG HA 1 45 ARG HD3 3.990 . 4.590 4.209 2.609 4.512 . 0 0 "[ . 1 . 2]" 1
511 1 45 ARG HA 1 45 ARG HG2 4.040 . 4.650 3.133 2.594 3.778 . 0 0 "[ . 1 . 2]" 1
512 1 45 ARG HA 1 45 ARG HG3 3.490 . 4.010 2.696 2.468 3.151 . 0 0 "[ . 1 . 2]" 1
513 1 45 ARG HA 1 48 CYS H 3.840 . 4.420 3.576 3.177 3.929 . 0 0 "[ . 1 . 2]" 1
514 1 45 ARG HA 1 48 CYS HB2 3.630 . 4.170 3.374 2.826 4.116 . 0 0 "[ . 1 . 2]" 1
515 1 45 ARG HA 1 48 CYS HB3 3.860 . 4.440 3.081 2.580 4.194 . 0 0 "[ . 1 . 2]" 1
516 1 45 ARG QB 1 45 ARG HD2 3.120 . 3.590 3.029 2.211 3.319 . 0 0 "[ . 1 . 2]" 1
517 1 45 ARG QB 1 45 ARG HE 4.070 . 4.680 2.752 1.978 3.934 . 0 0 "[ . 1 . 2]" 1
518 1 45 ARG QB 1 46 ALA H 3.300 . 3.800 2.619 2.176 3.462 . 0 0 "[ . 1 . 2]" 1
519 1 46 ALA H 1 46 ALA MB 2.770 . 3.190 2.248 2.217 2.375 . 0 0 "[ . 1 . 2]" 1
520 1 46 ALA H 1 47 THR H 3.050 . 3.510 2.633 2.108 2.879 . 0 0 "[ . 1 . 2]" 1
521 1 46 ALA H 1 47 THR HB 4.950 . 5.690 4.900 4.242 5.242 . 0 0 "[ . 1 . 2]" 1
522 1 46 ALA MB 1 47 THR H 3.250 . 3.740 2.405 2.224 2.789 . 0 0 "[ . 1 . 2]" 1
523 1 46 ALA MB 1 48 CYS H 4.880 . 5.610 4.382 4.280 4.534 . 0 0 "[ . 1 . 2]" 1
524 1 47 THR H 1 47 THR HB 3.170 . 3.650 2.601 2.515 2.692 . 0 0 "[ . 1 . 2]" 1
525 1 47 THR H 1 47 THR MG 4.130 . 4.750 3.743 3.684 3.808 . 0 0 "[ . 1 . 2]" 1
526 1 47 THR H 1 48 CYS H 3.040 . 3.500 2.653 2.406 2.872 . 0 0 "[ . 1 . 2]" 1
527 1 47 THR HA 1 47 THR MG 2.990 . 3.440 2.345 2.274 2.379 . 0 0 "[ . 1 . 2]" 1
528 1 47 THR HA 1 50 LEU HB2 3.930 . 4.520 2.328 2.140 3.052 . 0 0 "[ . 1 . 2]" 1
529 1 47 THR HA 1 50 LEU HB3 3.490 . 4.010 3.777 2.117 3.923 . 0 0 "[ . 1 . 2]" 1
530 1 47 THR HB 1 48 CYS H 4.030 . 4.630 2.878 2.632 3.190 . 0 0 "[ . 1 . 2]" 1
531 1 47 THR MG 1 48 CYS H 4.050 . 4.660 3.810 3.649 4.000 . 0 0 "[ . 1 . 2]" 1
532 1 47 THR MG 1 50 LEU HB2 4.160 . 4.780 3.487 3.004 4.449 . 0 0 "[ . 1 . 2]" 1
533 1 47 THR MG 1 51 SER H 3.860 . 4.440 3.288 2.995 3.847 . 0 0 "[ . 1 . 2]" 1
534 1 47 THR MG 1 51 SER HB3 3.240 . 3.730 3.251 2.376 3.630 . 0 0 "[ . 1 . 2]" 1
535 1 48 CYS H 1 48 CYS HB2 3.040 . 3.500 2.557 2.171 3.457 . 0 0 "[ . 1 . 2]" 1
536 1 48 CYS H 1 48 CYS HB3 2.950 . 3.390 2.573 2.220 3.437 0.047 15 0 "[ . 1 . 2]" 1
537 1 48 CYS H 1 49 THR H 3.220 . 3.700 2.651 2.470 2.984 . 0 0 "[ . 1 . 2]" 1
538 1 48 CYS H 1 56 THR MG 3.560 . 4.090 2.970 2.665 3.238 . 0 0 "[ . 1 . 2]" 1
539 1 48 CYS HB2 1 49 THR H 3.230 . 3.710 3.597 2.849 3.681 . 0 0 "[ . 1 . 2]" 1
540 1 48 CYS HB2 1 56 THR MG 4.100 . 4.720 2.568 2.027 3.864 . 0 0 "[ . 1 . 2]" 1
541 1 48 CYS HB3 1 49 THR H 3.490 . 4.010 2.788 2.152 3.847 . 0 0 "[ . 1 . 2]" 1
542 1 48 CYS HB3 1 56 THR MG 3.370 . 3.880 3.465 2.261 3.793 . 0 0 "[ . 1 . 2]" 1
543 1 49 THR H 1 49 THR HB 3.040 . 3.500 2.692 2.492 3.454 . 0 0 "[ . 1 . 2]" 1
544 1 49 THR H 1 49 THR MG 3.890 . 4.470 2.943 1.973 3.785 . 0 0 "[ . 1 . 2]" 1
545 1 49 THR H 1 50 LEU H 3.180 . 3.660 2.465 2.228 2.675 . 0 0 "[ . 1 . 2]" 1
546 1 49 THR H 1 51 SER H 4.260 . 4.900 4.496 4.254 4.733 . 0 0 "[ . 1 . 2]" 1
547 1 49 THR HA 1 49 THR HB 2.940 . 3.380 2.762 2.454 3.045 . 0 0 "[ . 1 . 2]" 1
548 1 49 THR HA 1 49 THR MG 3.130 . 3.600 2.734 2.255 3.242 . 0 0 "[ . 1 . 2]" 1
549 1 49 THR MG 1 50 LEU H 4.290 . 4.930 3.455 2.600 4.017 . 0 0 "[ . 1 . 2]" 1
550 1 49 THR MG 1 50 LEU HB2 5.130 . 5.900 4.885 3.456 5.704 . 0 0 "[ . 1 . 2]" 1
551 1 49 THR MG 1 50 LEU QD 4.420 . 5.080 3.336 2.477 4.767 . 0 0 "[ . 1 . 2]" 1
552 1 50 LEU H 1 50 LEU HB2 3.190 . 3.670 2.426 2.204 2.858 . 0 0 "[ . 1 . 2]" 1
553 1 50 LEU H 1 50 LEU QD 4.120 . 4.740 3.260 2.280 3.735 . 0 0 "[ . 1 . 2]" 1
554 1 50 LEU H 1 50 LEU HG 3.500 . 4.030 2.811 2.332 4.011 . 0 0 "[ . 1 . 2]" 1
555 1 50 LEU H 1 51 SER H 3.130 . 3.600 2.577 2.147 2.904 . 0 0 "[ . 1 . 2]" 1
556 1 50 LEU H 1 52 GLY H 4.940 . 5.680 3.924 3.018 4.654 . 0 0 "[ . 1 . 2]" 1
557 1 50 LEU HA 1 50 LEU QD 3.190 . 3.670 2.073 1.953 2.633 . 0 0 "[ . 1 . 2]" 1
558 1 50 LEU HA 1 50 LEU HG 3.760 . 4.320 3.065 2.457 3.218 . 0 0 "[ . 1 . 2]" 1
559 1 50 LEU HB2 1 51 SER H 3.520 . 4.050 2.456 2.076 3.749 . 0 0 "[ . 1 . 2]" 1
560 1 50 LEU HB3 1 51 SER H 3.310 . 3.810 3.217 2.282 3.756 . 0 0 "[ . 1 . 2]" 1
561 1 51 SER H 1 51 SER HB2 3.900 . 4.490 2.891 2.362 3.786 . 0 0 "[ . 1 . 2]" 1
562 1 51 SER H 1 51 SER HB3 3.300 . 3.800 2.974 2.410 3.647 . 0 0 "[ . 1 . 2]" 1
563 1 51 SER H 1 52 GLY H 2.900 . 3.340 2.379 2.162 2.694 . 0 0 "[ . 1 . 2]" 1
564 1 51 SER HB2 1 55 ASP HB2 3.700 . 4.260 3.396 2.273 4.109 . 0 0 "[ . 1 . 2]" 1
565 1 51 SER HB2 1 55 ASP HB3 3.870 . 4.450 3.154 1.910 4.294 . 0 0 "[ . 1 . 2]" 1
566 1 51 SER HB3 1 52 GLY H 3.980 . 4.580 3.259 2.067 4.427 . 0 0 "[ . 1 . 2]" 1
567 1 51 SER HB3 1 55 ASP HB3 3.730 . 4.290 3.228 2.270 4.115 . 0 0 "[ . 1 . 2]" 1
568 1 52 GLY H 1 53 ASN H 3.820 . 4.390 4.064 3.102 4.323 . 0 0 "[ . 1 . 2]" 1
569 1 52 GLY HA3 1 53 ASN H 3.090 . 3.550 2.503 2.006 2.948 . 0 0 "[ . 1 . 2]" 1
570 1 53 ASN H 1 53 ASN HB2 3.210 . 3.690 2.905 2.195 3.658 . 0 0 "[ . 1 . 2]" 1
571 1 53 ASN H 1 53 ASN HB3 3.000 . 3.450 2.819 2.499 3.459 0.009 14 0 "[ . 1 . 2]" 1
572 1 53 ASN H 1 54 ARG H 3.470 . 3.990 2.397 1.836 2.657 . 0 0 "[ . 1 . 2]" 1
573 1 53 ASN H 1 54 ARG HB3 4.320 . 4.970 4.501 3.660 4.777 . 0 0 "[ . 1 . 2]" 1
574 1 53 ASN HA 1 57 LEU H 4.300 . 4.950 4.146 3.689 4.571 . 0 0 "[ . 1 . 2]" 1
575 1 53 ASN HB2 1 53 ASN HD22 3.280 . 3.770 3.586 3.377 3.849 0.079 8 0 "[ . 1 . 2]" 1
576 1 53 ASN HB2 1 54 ARG H 3.240 . 3.730 3.484 2.497 3.678 . 0 0 "[ . 1 . 2]" 1
577 1 53 ASN HB3 1 53 ASN HD22 3.420 . 3.930 3.631 3.357 3.918 . 0 0 "[ . 1 . 2]" 1
578 1 53 ASN HB3 1 54 ARG H 3.320 . 3.820 2.776 2.137 3.728 . 0 0 "[ . 1 . 2]" 1
579 1 53 ASN HD21 1 57 LEU MD2 4.120 . 4.740 4.158 3.403 4.591 . 0 0 "[ . 1 . 2]" 1
580 1 53 ASN HD22 1 57 LEU MD2 4.160 . 4.780 3.945 2.702 4.712 . 0 0 "[ . 1 . 2]" 1
581 1 54 ARG H 1 54 ARG HB2 3.040 . 3.500 2.500 2.329 2.690 . 0 0 "[ . 1 . 2]" 1
582 1 54 ARG H 1 54 ARG HB3 3.050 . 3.510 2.592 2.429 2.856 . 0 0 "[ . 1 . 2]" 1
583 1 54 ARG H 1 55 ASP H 3.320 . 3.820 2.954 2.528 3.573 . 0 0 "[ . 1 . 2]" 1
584 1 54 ARG HA 1 54 ARG HG2 4.120 . 4.740 3.121 2.888 3.332 . 0 0 "[ . 1 . 2]" 1
585 1 54 ARG HA 1 54 ARG HG3 3.970 . 4.570 2.646 2.390 2.928 . 0 0 "[ . 1 . 2]" 1
586 1 54 ARG HA 1 57 LEU H 4.440 . 5.110 3.500 3.007 4.207 . 0 0 "[ . 1 . 2]" 1
587 1 54 ARG HA 1 57 LEU MD2 3.570 . 4.110 3.742 2.926 4.102 . 0 0 "[ . 1 . 2]" 1
588 1 54 ARG HB2 1 54 ARG QD 3.200 . 3.680 2.524 2.245 3.078 . 0 0 "[ . 1 . 2]" 1
589 1 54 ARG HB2 1 55 ASP H 3.570 . 4.110 3.844 3.631 3.957 . 0 0 "[ . 1 . 2]" 1
590 1 54 ARG HB3 1 54 ARG QD 2.770 . 3.190 2.532 2.332 2.963 . 0 0 "[ . 1 . 2]" 1
591 1 54 ARG HB3 1 55 ASP H 3.190 . 3.670 2.513 2.168 2.817 . 0 0 "[ . 1 . 2]" 1
592 1 54 ARG QD 1 55 ASP H 4.460 . 5.130 4.527 4.025 4.940 . 0 0 "[ . 1 . 2]" 1
593 1 54 ARG HG2 1 55 ASP HA 3.770 . 4.340 3.675 3.209 4.159 . 0 0 "[ . 1 . 2]" 1
594 1 55 ASP H 1 55 ASP HB2 3.100 . 3.570 2.497 2.242 2.753 . 0 0 "[ . 1 . 2]" 1
595 1 55 ASP H 1 55 ASP HB3 3.070 . 3.530 2.903 2.465 3.540 0.010 20 0 "[ . 1 . 2]" 1
596 1 55 ASP H 1 56 THR H 3.400 . 3.910 2.517 2.387 2.673 . 0 0 "[ . 1 . 2]" 1
597 1 55 ASP H 1 57 LEU H 4.730 . 5.440 4.024 3.864 4.311 . 0 0 "[ . 1 . 2]" 1
598 1 55 ASP HB2 1 56 THR H 3.790 . 4.360 3.427 2.349 4.109 . 0 0 "[ . 1 . 2]" 1
599 1 55 ASP HB3 1 56 THR H 3.870 . 4.450 2.996 2.178 3.899 . 0 0 "[ . 1 . 2]" 1
600 1 56 THR H 1 56 THR HB 3.440 . 3.960 2.533 2.432 2.709 . 0 0 "[ . 1 . 2]" 1
601 1 56 THR H 1 56 THR MG 4.160 . 4.780 3.623 2.319 3.740 . 0 0 "[ . 1 . 2]" 1
602 1 56 THR H 1 57 LEU H 3.220 . 3.700 2.585 2.425 2.799 . 0 0 "[ . 1 . 2]" 1
603 1 56 THR H 1 58 TRP H 4.120 . 4.740 4.234 3.875 4.535 . 0 0 "[ . 1 . 2]" 1
604 1 56 THR HA 1 56 THR MG 3.330 . 3.830 2.382 2.234 3.213 . 0 0 "[ . 1 . 2]" 1
605 1 56 THR HA 1 59 HIS H 4.310 . 4.960 3.337 2.922 3.713 . 0 0 "[ . 1 . 2]" 1
606 1 56 THR HA 1 59 HIS QB 3.500 . 4.030 2.691 2.123 3.486 . 0 0 "[ . 1 . 2]" 1
607 1 56 THR HB 1 57 LEU H 3.960 . 4.550 2.837 2.415 4.164 . 0 0 "[ . 1 . 2]" 1
608 1 56 THR MG 1 57 LEU H 4.180 . 4.810 3.697 2.605 3.904 . 0 0 "[ . 1 . 2]" 1
609 1 56 THR MG 1 59 HIS QB 4.330 . 4.980 3.355 2.701 4.319 . 0 0 "[ . 1 . 2]" 1
610 1 56 THR MG 1 60 LEU MD2 4.090 . 4.700 4.199 3.885 4.513 . 0 0 "[ . 1 . 2]" 1
611 1 57 LEU H 1 57 LEU HB2 3.120 . 3.590 2.329 1.897 2.605 . 0 0 "[ . 1 . 2]" 1
612 1 57 LEU H 1 57 LEU HB3 3.530 . 4.060 3.322 2.347 3.653 . 0 0 "[ . 1 . 2]" 1
613 1 57 LEU H 1 57 LEU MD2 4.120 . 4.740 3.756 3.151 4.182 . 0 0 "[ . 1 . 2]" 1
614 1 57 LEU H 1 57 LEU HG 3.620 . 4.160 3.181 2.092 4.164 0.004 17 0 "[ . 1 . 2]" 1
615 1 57 LEU H 1 58 TRP H 3.520 . 4.050 2.764 2.451 2.912 . 0 0 "[ . 1 . 2]" 1
616 1 57 LEU H 1 59 HIS H 4.350 . 5.000 4.196 3.857 4.627 . 0 0 "[ . 1 . 2]" 1
617 1 57 LEU HA 1 57 LEU HB2 2.980 . 3.430 2.890 2.486 3.032 . 0 0 "[ . 1 . 2]" 1
618 1 57 LEU HA 1 57 LEU MD1 3.620 . 4.160 3.197 2.168 3.892 . 0 0 "[ . 1 . 2]" 1
619 1 57 LEU HA 1 57 LEU MD2 3.480 . 4.000 2.806 1.899 3.874 . 0 0 "[ . 1 . 2]" 1
620 1 57 LEU HA 1 57 LEU HG 3.430 . 3.940 2.750 2.346 3.192 . 0 0 "[ . 1 . 2]" 1
621 1 57 LEU HA 1 60 LEU H 3.640 . 4.190 3.310 3.102 3.546 . 0 0 "[ . 1 . 2]" 1
622 1 57 LEU HA 1 60 LEU HB2 3.380 . 3.890 2.867 2.616 3.308 . 0 0 "[ . 1 . 2]" 1
623 1 57 LEU HA 1 60 LEU HB3 3.540 . 4.070 2.332 2.156 2.558 . 0 0 "[ . 1 . 2]" 1
624 1 57 LEU HA 1 60 LEU MD2 3.910 . 4.500 2.795 2.568 3.061 . 0 0 "[ . 1 . 2]" 1
625 1 57 LEU HB2 1 57 LEU MD1 3.450 . 3.970 2.326 2.246 2.422 . 0 0 "[ . 1 . 2]" 1
626 1 57 LEU HB2 1 57 LEU MD2 3.410 . 3.920 2.844 2.330 3.177 . 0 0 "[ . 1 . 2]" 1
627 1 57 LEU HB2 1 58 TRP H 3.800 . 4.370 2.963 2.525 3.798 . 0 0 "[ . 1 . 2]" 1
628 1 57 LEU HB3 1 57 LEU MD1 3.470 . 3.990 2.763 2.304 3.206 . 0 0 "[ . 1 . 2]" 1
629 1 57 LEU HB3 1 58 TRP H 4.190 . 4.820 3.226 2.431 3.718 . 0 0 "[ . 1 . 2]" 1
630 1 57 LEU HG 1 60 LEU MD2 4.410 . 5.070 3.760 2.740 4.654 . 0 0 "[ . 1 . 2]" 1
631 1 58 TRP H 1 58 TRP HB2 3.270 . 3.760 2.479 2.324 2.641 . 0 0 "[ . 1 . 2]" 1
632 1 58 TRP H 1 58 TRP HB3 3.150 . 3.620 2.965 2.481 3.554 . 0 0 "[ . 1 . 2]" 1
633 1 58 TRP H 1 59 HIS H 3.490 . 4.010 2.631 2.482 2.782 . 0 0 "[ . 1 . 2]" 1
634 1 58 TRP H 1 59 HIS QB 4.630 . 5.320 4.517 4.084 4.791 . 0 0 "[ . 1 . 2]" 1
635 1 58 TRP H 1 60 LEU H 4.340 . 4.990 3.916 3.794 4.058 . 0 0 "[ . 1 . 2]" 1
636 1 58 TRP HA 1 58 TRP HE3 3.310 . 3.810 2.754 2.191 3.532 . 0 0 "[ . 1 . 2]" 1
637 1 58 TRP HB2 1 58 TRP HD1 3.600 . 4.140 3.286 2.578 3.843 . 0 0 "[ . 1 . 2]" 1
638 1 58 TRP HB2 1 58 TRP HE3 3.650 . 4.200 3.291 2.537 4.096 . 0 0 "[ . 1 . 2]" 1
639 1 58 TRP HB2 1 59 HIS H 3.560 . 4.090 3.429 2.444 3.935 . 0 0 "[ . 1 . 2]" 1
640 1 58 TRP HB3 1 59 HIS H 3.880 . 4.460 3.002 2.359 4.121 . 0 0 "[ . 1 . 2]" 1
641 1 59 HIS H 1 59 HIS QB 3.150 . 3.620 2.347 2.169 2.486 . 0 0 "[ . 1 . 2]" 1
642 1 59 HIS H 1 60 LEU H 3.220 . 3.700 2.452 1.941 2.672 . 0 0 "[ . 1 . 2]" 1
643 1 59 HIS HA 1 62 ASN HB2 3.440 . 3.960 3.162 2.912 3.499 . 0 0 "[ . 1 . 2]" 1
644 1 59 HIS HA 1 62 ASN HB3 3.570 . 4.110 2.352 2.079 2.671 . 0 0 "[ . 1 . 2]" 1
645 1 59 HIS QB 1 59 HIS HD2 3.340 . 3.840 2.869 2.676 3.233 . 0 0 "[ . 1 . 2]" 1
646 1 59 HIS QB 1 60 LEU H 3.450 . 3.970 2.746 2.523 3.080 . 0 0 "[ . 1 . 2]" 1
647 1 60 LEU H 1 60 LEU HB2 3.210 . 3.690 2.490 2.381 2.646 . 0 0 "[ . 1 . 2]" 1
648 1 60 LEU H 1 60 LEU HB3 3.190 . 3.670 2.407 2.323 2.493 . 0 0 "[ . 1 . 2]" 1
649 1 60 LEU H 1 60 LEU MD2 4.410 . 5.070 4.200 4.141 4.280 . 0 0 "[ . 1 . 2]" 1
650 1 60 LEU H 1 61 PHE H 3.340 . 3.840 2.816 2.437 2.956 . 0 0 "[ . 1 . 2]" 1
651 1 60 LEU H 1 61 PHE HB2 5.000 . 5.750 4.911 4.482 5.080 . 0 0 "[ . 1 . 2]" 1
652 1 60 LEU HA 1 60 LEU MD1 3.030 . 3.480 2.271 2.162 2.361 . 0 0 "[ . 1 . 2]" 1
653 1 60 LEU HA 1 60 LEU MD2 4.080 . 4.690 3.962 3.927 3.991 . 0 0 "[ . 1 . 2]" 1
654 1 60 LEU HA 1 60 LEU HG 3.820 . 4.390 3.151 3.075 3.255 . 0 0 "[ . 1 . 2]" 1
655 1 60 LEU HB2 1 60 LEU MD1 3.420 . 3.930 2.352 2.304 2.420 . 0 0 "[ . 1 . 2]" 1
656 1 60 LEU HB2 1 60 LEU MD2 3.300 . 3.800 2.470 2.417 2.542 . 0 0 "[ . 1 . 2]" 1
657 1 60 LEU HB2 1 61 PHE H 3.240 . 3.730 3.604 3.576 3.648 . 0 0 "[ . 1 . 2]" 1
658 1 60 LEU HB3 1 60 LEU MD1 3.400 . 3.910 3.208 3.188 3.221 . 0 0 "[ . 1 . 2]" 1
659 1 60 LEU HB3 1 61 PHE H 3.580 . 4.120 2.148 2.080 2.276 . 0 0 "[ . 1 . 2]" 1
660 1 60 LEU MD1 1 61 PHE H 4.230 . 4.860 4.307 4.188 4.425 . 0 0 "[ . 1 . 2]" 1
661 1 61 PHE H 1 61 PHE HB2 3.210 . 3.690 2.450 2.279 2.644 . 0 0 "[ . 1 . 2]" 1
662 1 61 PHE H 1 61 PHE HB3 3.510 . 4.040 3.630 3.561 3.687 . 0 0 "[ . 1 . 2]" 1
663 1 61 PHE H 1 61 PHE QD 4.050 . 4.660 2.646 2.139 3.185 . 0 0 "[ . 1 . 2]" 1
664 1 61 PHE H 1 62 ASN H 3.420 . 3.930 2.740 2.477 3.501 . 0 0 "[ . 1 . 2]" 1
665 1 61 PHE HA 1 61 PHE QD 3.220 . 3.700 2.697 2.269 3.099 . 0 0 "[ . 1 . 2]" 1
666 1 61 PHE HB2 1 62 ASN H 4.020 . 4.620 3.102 2.616 4.373 . 0 0 "[ . 1 . 2]" 1
667 1 62 ASN H 1 62 ASN HB2 3.080 . 3.540 2.672 2.445 3.439 . 0 0 "[ . 1 . 2]" 1
668 1 62 ASN H 1 62 ASN HB3 3.050 . 3.510 2.534 2.317 2.995 . 0 0 "[ . 1 . 2]" 1
669 1 62 ASN HA 1 62 ASN HD21 4.480 . 5.150 3.517 1.960 4.491 . 0 0 "[ . 1 . 2]" 1
670 1 62 ASN HA 1 65 GLN H 4.370 . 5.030 3.999 3.634 4.412 . 0 0 "[ . 1 . 2]" 1
671 1 62 ASN HA 1 65 GLN HE21 4.230 . 4.860 2.648 1.771 4.710 0.029 17 0 "[ . 1 . 2]" 1
672 1 62 ASN HA 1 65 GLN HG2 3.510 . 4.040 2.728 2.218 3.677 . 0 0 "[ . 1 . 2]" 1
673 1 62 ASN HA 1 65 GLN HG3 3.800 . 4.370 3.975 3.089 4.222 . 0 0 "[ . 1 . 2]" 1
674 1 62 ASN HB2 1 63 THR H 3.720 . 4.280 3.940 3.626 4.166 . 0 0 "[ . 1 . 2]" 1
675 1 62 ASN HB3 1 63 THR H 3.600 . 4.140 2.793 2.240 3.972 . 0 0 "[ . 1 . 2]" 1
676 1 63 THR H 1 63 THR HB 3.320 . 3.820 2.977 2.432 3.655 . 0 0 "[ . 1 . 2]" 1
677 1 63 THR H 1 63 THR MG 3.980 . 4.580 3.472 2.593 4.136 . 0 0 "[ . 1 . 2]" 1
678 1 63 THR H 1 64 LEU H 3.060 . 3.520 2.503 1.890 3.178 . 0 0 "[ . 1 . 2]" 1
679 1 63 THR H 1 64 LEU HB2 4.650 . 5.350 4.492 4.053 5.351 0.001 13 0 "[ . 1 . 2]" 1
680 1 63 THR H 1 65 GLN H 4.330 . 4.980 4.099 3.510 4.443 . 0 0 "[ . 1 . 2]" 1
681 1 63 THR HA 1 63 THR MG 3.090 . 3.550 2.324 2.141 2.514 . 0 0 "[ . 1 . 2]" 1
682 1 63 THR HB 1 64 LEU H 3.440 . 3.960 3.042 2.527 3.652 . 0 0 "[ . 1 . 2]" 1
683 1 64 LEU H 1 64 LEU HB2 3.160 . 3.630 2.298 2.118 3.510 . 0 0 "[ . 1 . 2]" 1
684 1 64 LEU H 1 64 LEU HB3 3.840 . 4.420 3.012 2.143 3.502 . 0 0 "[ . 1 . 2]" 1
685 1 64 LEU H 1 64 LEU MD1 4.010 . 4.610 2.925 2.270 4.093 . 0 0 "[ . 1 . 2]" 1
686 1 64 LEU H 1 64 LEU MD2 4.470 . 5.140 3.839 3.639 4.064 . 0 0 "[ . 1 . 2]" 1
687 1 64 LEU H 1 64 LEU HG 3.600 . 4.140 3.964 2.137 4.149 0.009 3 0 "[ . 1 . 2]" 1
688 1 64 LEU H 1 65 GLN H 3.460 . 3.980 2.767 2.547 2.988 . 0 0 "[ . 1 . 2]" 1
689 1 64 LEU HA 1 64 LEU MD1 3.120 . 3.590 2.287 2.088 3.553 . 0 0 "[ . 1 . 2]" 1
690 1 64 LEU HA 1 64 LEU HG 3.930 . 4.520 2.803 2.485 3.794 . 0 0 "[ . 1 . 2]" 1
691 1 64 LEU HB2 1 65 GLN H 3.660 . 4.210 3.225 2.647 3.981 . 0 0 "[ . 1 . 2]" 1
692 1 64 LEU HB3 1 65 GLN H 3.870 . 4.450 3.011 2.143 4.288 . 0 0 "[ . 1 . 2]" 1
693 1 64 LEU MD1 1 70 TRP HB3 4.170 . 4.800 3.884 2.595 4.644 . 0 0 "[ . 1 . 2]" 1
694 1 64 LEU MD2 1 70 TRP HB3 4.080 . 4.690 4.340 3.760 4.559 . 0 0 "[ . 1 . 2]" 1
695 1 64 LEU MD2 1 74 PHE HB2 3.590 . 4.130 2.972 2.161 3.418 . 0 0 "[ . 1 . 2]" 1
696 1 64 LEU MD2 1 74 PHE QD 3.230 . 3.710 2.696 2.444 3.254 . 0 0 "[ . 1 . 2]" 1
697 1 65 GLN H 1 65 GLN HB3 3.430 . 3.940 2.628 2.506 2.976 . 0 0 "[ . 1 . 2]" 1
698 1 65 GLN H 1 65 GLN HG2 3.240 . 3.730 2.290 1.953 3.436 . 0 0 "[ . 1 . 2]" 1
699 1 65 GLN H 1 65 GLN HG3 3.680 . 4.230 3.128 1.846 3.429 . 0 0 "[ . 1 . 2]" 1
700 1 65 GLN H 1 66 ARG H 3.830 . 4.400 2.693 2.526 2.876 . 0 0 "[ . 1 . 2]" 1
701 1 65 GLN HA 1 65 GLN HB2 2.990 . 3.440 2.448 2.404 2.589 . 0 0 "[ . 1 . 2]" 1
702 1 65 GLN HA 1 67 ARG H 3.800 . 4.370 3.542 3.336 3.941 . 0 0 "[ . 1 . 2]" 1
703 1 65 GLN HA 1 70 TRP HD1 3.270 . 3.760 3.012 2.603 3.432 . 0 0 "[ . 1 . 2]" 1
704 1 65 GLN HA 1 70 TRP HE1 3.500 . 4.030 2.745 2.405 3.246 . 0 0 "[ . 1 . 2]" 1
705 1 65 GLN HB2 1 70 TRP HE1 4.130 . 4.750 3.968 3.063 4.551 . 0 0 "[ . 1 . 2]" 1
706 1 65 GLN HB3 1 65 GLN HG3 2.950 . 3.390 2.980 2.556 3.017 . 0 0 "[ . 1 . 2]" 1
707 1 65 GLN HG3 1 66 ARG HG3 4.230 . 4.860 3.220 2.077 4.678 . 0 0 "[ . 1 . 2]" 1
708 1 66 ARG H 1 66 ARG HB2 3.590 . 4.130 2.470 2.232 2.586 . 0 0 "[ . 1 . 2]" 1
709 1 66 ARG H 1 66 ARG HB3 3.440 . 3.960 3.635 3.507 3.696 . 0 0 "[ . 1 . 2]" 1
710 1 66 ARG H 1 66 ARG HG2 3.520 . 4.050 3.371 2.466 3.908 . 0 0 "[ . 1 . 2]" 1
711 1 66 ARG H 1 66 ARG HG3 3.750 . 4.310 2.941 2.155 4.056 . 0 0 "[ . 1 . 2]" 1
712 1 66 ARG H 1 67 ARG H 3.130 . 3.600 2.356 2.134 2.620 . 0 0 "[ . 1 . 2]" 1
713 1 66 ARG HA 1 66 ARG HG2 3.320 . 3.820 2.742 2.477 3.266 . 0 0 "[ . 1 . 2]" 1
714 1 66 ARG HA 1 66 ARG HG3 3.840 . 4.420 3.267 2.660 3.845 . 0 0 "[ . 1 . 2]" 1
715 1 66 ARG HB2 1 66 ARG QD 3.630 . 4.170 2.722 2.273 3.514 . 0 0 "[ . 1 . 2]" 1
716 1 66 ARG HB3 1 66 ARG HG3 2.920 . 3.360 2.841 2.434 3.012 . 0 0 "[ . 1 . 2]" 1
717 1 66 ARG HE 1 66 ARG HG3 4.120 . 4.740 3.223 2.353 3.740 . 0 0 "[ . 1 . 2]" 1
718 1 67 ARG H 1 67 ARG HB2 3.250 . 3.740 2.576 2.254 2.735 . 0 0 "[ . 1 . 2]" 1
719 1 67 ARG H 1 67 ARG HG2 3.770 . 4.340 2.855 2.046 4.240 . 0 0 "[ . 1 . 2]" 1
720 1 67 ARG H 1 67 ARG HG3 4.110 . 4.730 3.994 3.519 4.389 . 0 0 "[ . 1 . 2]" 1
721 1 67 ARG HA 1 67 ARG QD 3.160 . 3.630 2.303 1.932 3.258 . 0 0 "[ . 1 . 2]" 1
722 1 67 ARG HA 1 67 ARG HG2 3.740 . 4.300 3.318 3.053 3.709 . 0 0 "[ . 1 . 2]" 1
723 1 67 ARG HA 1 68 PRO HD2 3.250 . 3.740 2.619 2.091 3.155 . 0 0 "[ . 1 . 2]" 1
724 1 67 ARG HA 1 68 PRO HD3 2.920 . 3.360 2.038 1.876 2.279 . 0 0 "[ . 1 . 2]" 1
725 1 67 ARG HB2 1 67 ARG QD 3.720 . 4.280 3.261 2.417 3.516 . 0 0 "[ . 1 . 2]" 1
726 1 67 ARG HB3 1 67 ARG QD 3.610 . 4.150 2.704 2.417 3.520 . 0 0 "[ . 1 . 2]" 1
727 1 67 ARG HB3 1 68 PRO HD3 4.060 . 4.670 3.927 2.947 4.483 . 0 0 "[ . 1 . 2]" 1
728 1 67 ARG HE 1 67 ARG HG2 4.070 . 4.680 2.819 2.307 3.686 . 0 0 "[ . 1 . 2]" 1
729 1 67 ARG HE 1 67 ARG HG3 3.870 . 4.450 2.665 2.281 3.717 . 0 0 "[ . 1 . 2]" 1
730 1 68 PRO HA 1 69 GLY H 2.850 . 3.280 2.442 2.082 3.217 . 0 0 "[ . 1 . 2]" 1
731 1 68 PRO HB2 1 69 GLY H 3.910 . 4.500 3.971 3.508 4.258 . 0 0 "[ . 1 . 2]" 1
732 1 68 PRO HG3 1 69 GLY H 4.790 . 5.510 5.082 4.407 5.320 . 0 0 "[ . 1 . 2]" 1
733 1 69 GLY H 1 70 TRP H 3.200 . 3.680 2.645 1.796 3.394 0.004 10 0 "[ . 1 . 2]" 1
734 1 69 GLY H 1 71 VAL H 4.790 . 5.510 4.548 3.430 5.285 . 0 0 "[ . 1 . 2]" 1
735 1 70 TRP H 1 70 TRP HB2 3.390 . 3.900 3.674 3.564 3.780 . 0 0 "[ . 1 . 2]" 1
736 1 70 TRP H 1 70 TRP HB3 3.830 . 4.400 2.849 2.515 3.245 . 0 0 "[ . 1 . 2]" 1
737 1 70 TRP H 1 70 TRP HD1 2.860 . 3.290 2.593 2.176 3.063 . 0 0 "[ . 1 . 2]" 1
738 1 70 TRP H 1 71 VAL H 3.520 . 4.050 2.400 1.914 2.846 . 0 0 "[ . 1 . 2]" 1
739 1 70 TRP HA 1 73 TYR H 4.200 . 4.830 3.811 3.602 4.057 . 0 0 "[ . 1 . 2]" 1
740 1 70 TRP HA 1 73 TYR QD 2.940 . 3.380 2.590 1.866 3.277 . 0 0 "[ . 1 . 2]" 1
741 1 70 TRP HB3 1 70 TRP HD1 3.680 . 4.230 2.724 2.672 2.866 . 0 0 "[ . 1 . 2]" 1
742 1 70 TRP HB3 1 70 TRP HE3 4.040 . 4.650 4.114 3.994 4.189 . 0 0 "[ . 1 . 2]" 1
743 1 70 TRP HE1 1 71 VAL MG2 4.850 . 5.580 3.596 3.189 3.967 . 0 0 "[ . 1 . 2]" 1
744 1 71 VAL H 1 71 VAL HB 3.090 . 3.550 2.650 2.575 2.716 . 0 0 "[ . 1 . 2]" 1
745 1 71 VAL H 1 71 VAL MG2 3.490 . 4.010 1.973 1.833 2.117 . 0 0 "[ . 1 . 2]" 1
746 1 71 VAL H 1 72 GLU H 3.350 . 3.850 2.808 2.454 3.073 . 0 0 "[ . 1 . 2]" 1
747 1 71 VAL HA 1 71 VAL MG1 3.330 . 3.830 2.354 2.299 2.463 . 0 0 "[ . 1 . 2]" 1
748 1 71 VAL HA 1 71 VAL MG2 3.470 . 3.990 2.428 2.303 2.483 . 0 0 "[ . 1 . 2]" 1
749 1 71 VAL HA 1 74 PHE H 3.860 . 4.440 3.435 3.211 3.732 . 0 0 "[ . 1 . 2]" 1
750 1 71 VAL HA 1 74 PHE HB2 3.770 . 4.340 3.242 2.928 3.796 . 0 0 "[ . 1 . 2]" 1
751 1 71 VAL HA 1 74 PHE HB3 3.500 . 4.030 2.477 2.144 2.955 . 0 0 "[ . 1 . 2]" 1
752 1 71 VAL HB 1 72 GLU H 3.280 . 3.770 2.583 2.353 2.869 . 0 0 "[ . 1 . 2]" 1
753 1 71 VAL MG1 1 72 GLU H 4.390 . 5.050 3.489 3.215 3.683 . 0 0 "[ . 1 . 2]" 1
754 1 71 VAL MG1 1 75 ILE MD 3.600 . 4.140 2.277 2.049 2.651 . 0 0 "[ . 1 . 2]" 1
755 1 71 VAL MG1 1 75 ILE HG12 4.250 . 4.890 3.243 2.630 3.715 . 0 0 "[ . 1 . 2]" 1
756 1 71 VAL MG1 1 94 TYR HB2 3.730 . 4.290 2.128 1.889 2.734 . 0 0 "[ . 1 . 2]" 1
757 1 71 VAL MG1 1 94 TYR HB3 4.260 . 4.900 2.971 2.262 3.600 . 0 0 "[ . 1 . 2]" 1
758 1 71 VAL MG1 1 94 TYR QD 3.600 . 4.140 2.691 2.264 3.138 . 0 0 "[ . 1 . 2]" 1
759 1 71 VAL MG2 1 72 GLU H 4.850 . 5.580 3.777 3.616 3.975 . 0 0 "[ . 1 . 2]" 1
760 1 72 GLU H 1 72 GLU QB 3.080 . 3.540 2.446 2.187 2.734 . 0 0 "[ . 1 . 2]" 1
761 1 72 GLU H 1 72 GLU HB3 3.080 . 3.540 3.329 2.593 3.524 . 0 0 "[ . 1 . 2]" 1
762 1 72 GLU H 1 72 GLU HG2 3.660 . 4.210 3.005 2.004 3.670 . 0 0 "[ . 1 . 2]" 1
763 1 72 GLU H 1 72 GLU HG3 3.690 . 4.240 2.806 2.002 3.714 . 0 0 "[ . 1 . 2]" 1
764 1 72 GLU H 1 73 TYR H 3.270 . 3.760 2.709 2.515 2.845 . 0 0 "[ . 1 . 2]" 1
765 1 72 GLU HA 1 72 GLU HG3 3.980 . 4.580 3.276 2.501 4.279 . 0 0 "[ . 1 . 2]" 1
766 1 72 GLU HA 1 75 ILE H 3.650 . 4.200 3.641 3.249 3.953 . 0 0 "[ . 1 . 2]" 1
767 1 72 GLU HA 1 75 ILE HB 3.660 . 4.210 3.346 2.817 3.915 . 0 0 "[ . 1 . 2]" 1
768 1 72 GLU HA 1 75 ILE MD 3.680 . 4.230 2.971 1.991 4.132 . 0 0 "[ . 1 . 2]" 1
769 1 72 GLU QB 1 73 TYR H 3.430 . 3.940 2.770 2.374 3.467 . 0 0 "[ . 1 . 2]" 1
770 1 72 GLU HB3 1 73 TYR H 3.590 . 4.130 3.751 3.379 4.014 . 0 0 "[ . 1 . 2]" 1
771 1 73 TYR H 1 73 TYR HB2 3.570 . 4.110 2.441 2.325 2.583 . 0 0 "[ . 1 . 2]" 1
772 1 73 TYR H 1 73 TYR HB3 3.130 . 3.600 3.529 3.508 3.547 . 0 0 "[ . 1 . 2]" 1
773 1 73 TYR H 1 73 TYR QD 2.400 . 2.760 2.404 2.092 2.676 . 0 0 "[ . 1 . 2]" 1
774 1 73 TYR H 1 74 PHE H 3.160 . 3.630 2.361 2.128 2.541 . 0 0 "[ . 1 . 2]" 1
775 1 73 TYR HA 1 76 ALA H 4.130 . 4.750 3.472 3.298 3.658 . 0 0 "[ . 1 . 2]" 1
776 1 73 TYR HA 1 76 ALA MB 3.430 . 3.940 2.800 2.543 3.069 . 0 0 "[ . 1 . 2]" 1
777 1 73 TYR HA 1 77 ALA H 4.260 . 4.900 4.519 4.241 4.725 . 0 0 "[ . 1 . 2]" 1
778 1 73 TYR HB2 1 74 PHE H 3.670 . 4.220 2.701 2.543 2.894 . 0 0 "[ . 1 . 2]" 1
779 1 73 TYR HB3 1 74 PHE H 3.710 . 4.270 3.770 3.601 3.953 . 0 0 "[ . 1 . 2]" 1
780 1 74 PHE H 1 74 PHE HB2 3.160 . 3.630 2.454 2.320 2.598 . 0 0 "[ . 1 . 2]" 1
781 1 74 PHE H 1 74 PHE HB3 3.170 . 3.650 2.553 2.496 2.648 . 0 0 "[ . 1 . 2]" 1
782 1 74 PHE H 1 75 ILE H 3.390 . 3.900 2.661 2.528 2.772 . 0 0 "[ . 1 . 2]" 1
783 1 74 PHE HA 1 74 PHE QD 3.350 . 3.850 2.437 2.256 2.551 . 0 0 "[ . 1 . 2]" 1
784 1 74 PHE HA 1 77 ALA H 4.430 . 5.090 3.209 2.910 3.314 . 0 0 "[ . 1 . 2]" 1
785 1 74 PHE HA 1 77 ALA MB 3.490 . 4.010 2.399 2.165 2.577 . 0 0 "[ . 1 . 2]" 1
786 1 74 PHE HB2 1 75 ILE H 3.920 . 4.510 3.886 3.811 3.941 . 0 0 "[ . 1 . 2]" 1
787 1 74 PHE HB3 1 75 ILE H 3.770 . 4.340 2.665 2.559 2.855 . 0 0 "[ . 1 . 2]" 1
788 1 74 PHE QD 1 78 LEU MD2 4.150 . 4.770 3.046 2.847 3.209 . 0 0 "[ . 1 . 2]" 1
789 1 74 PHE QD 1 90 VAL MG1 3.270 . 3.760 2.140 2.002 2.408 . 0 0 "[ . 1 . 2]" 1
790 1 74 PHE QD 1 90 VAL MG2 3.120 . 3.590 2.613 2.094 3.205 . 0 0 "[ . 1 . 2]" 1
791 1 75 ILE H 1 75 ILE HB 2.950 . 3.390 2.625 2.539 2.797 . 0 0 "[ . 1 . 2]" 1
792 1 75 ILE H 1 75 ILE MD 3.980 . 4.580 3.369 2.871 3.621 . 0 0 "[ . 1 . 2]" 1
793 1 75 ILE H 1 75 ILE HG12 3.120 . 3.590 2.990 2.002 3.434 . 0 0 "[ . 1 . 2]" 1
794 1 75 ILE H 1 75 ILE HG13 3.750 . 4.310 2.543 1.976 3.646 . 0 0 "[ . 1 . 2]" 1
795 1 75 ILE H 1 75 ILE MG 3.770 . 4.340 3.809 3.782 3.833 . 0 0 "[ . 1 . 2]" 1
796 1 75 ILE H 1 76 ALA H 3.300 . 3.800 2.716 2.637 2.794 . 0 0 "[ . 1 . 2]" 1
797 1 75 ILE HA 1 75 ILE MD 4.180 . 4.810 3.358 2.115 3.889 . 0 0 "[ . 1 . 2]" 1
798 1 75 ILE HA 1 75 ILE HG12 3.330 . 3.830 2.777 2.518 3.284 . 0 0 "[ . 1 . 2]" 1
799 1 75 ILE HA 1 75 ILE HG13 3.610 . 4.150 3.238 2.935 3.860 . 0 0 "[ . 1 . 2]" 1
800 1 75 ILE HA 1 75 ILE MG 3.210 . 3.690 2.432 2.351 2.493 . 0 0 "[ . 1 . 2]" 1
801 1 75 ILE HA 1 78 LEU H 4.010 . 4.610 3.774 3.652 4.082 . 0 0 "[ . 1 . 2]" 1
802 1 75 ILE HA 1 78 LEU MD2 3.600 . 4.140 2.867 2.236 3.244 . 0 0 "[ . 1 . 2]" 1
803 1 75 ILE HA 1 87 ALA HA 3.640 . 4.190 2.953 2.705 3.390 . 0 0 "[ . 1 . 2]" 1
804 1 75 ILE HB 1 75 ILE MD 3.360 . 3.860 2.670 2.402 3.249 . 0 0 "[ . 1 . 2]" 1
805 1 75 ILE HB 1 76 ALA H 3.130 . 3.600 2.522 2.255 2.741 . 0 0 "[ . 1 . 2]" 1
806 1 75 ILE MD 1 75 ILE MG 3.140 . 3.610 1.993 1.927 2.100 . 0 0 "[ . 1 . 2]" 1
807 1 75 ILE MD 1 90 VAL H 4.760 . 5.470 4.909 3.914 5.308 . 0 0 "[ . 1 . 2]" 1
808 1 75 ILE MD 1 90 VAL HB 4.130 . 4.750 3.265 2.054 4.078 . 0 0 "[ . 1 . 2]" 1
809 1 75 ILE MD 1 90 VAL MG1 3.190 . 3.670 2.643 2.144 3.510 . 0 0 "[ . 1 . 2]" 1
810 1 75 ILE MD 1 91 ALA H 4.310 . 4.960 3.281 2.542 3.603 . 0 0 "[ . 1 . 2]" 1
811 1 75 ILE MD 1 91 ALA HA 3.500 . 4.030 2.199 1.903 2.542 . 0 0 "[ . 1 . 2]" 1
812 1 75 ILE MD 1 91 ALA MB 3.380 . 3.890 2.273 1.986 2.620 . 0 0 "[ . 1 . 2]" 1
813 1 75 ILE HG12 1 90 VAL MG1 3.790 . 4.360 3.065 2.246 4.151 . 0 0 "[ . 1 . 2]" 1
814 1 75 ILE MG 1 76 ALA H 3.640 . 4.190 3.424 3.302 3.578 . 0 0 "[ . 1 . 2]" 1
815 1 75 ILE MG 1 76 ALA HA 3.710 . 4.270 3.439 3.319 3.588 . 0 0 "[ . 1 . 2]" 1
816 1 75 ILE MG 1 78 LEU H 4.900 . 5.640 4.973 4.789 5.249 . 0 0 "[ . 1 . 2]" 1
817 1 75 ILE MG 1 78 LEU HB2 4.290 . 4.930 4.384 4.168 4.643 . 0 0 "[ . 1 . 2]" 1
818 1 75 ILE MG 1 78 LEU MD2 4.130 . 4.750 4.360 3.543 4.587 . 0 0 "[ . 1 . 2]" 1
819 1 75 ILE MG 1 79 ARG H 4.170 . 4.800 4.179 3.964 4.414 . 0 0 "[ . 1 . 2]" 1
820 1 75 ILE MG 1 79 ARG HB2 4.200 . 4.830 3.488 3.082 3.848 . 0 0 "[ . 1 . 2]" 1
821 1 75 ILE MG 1 79 ARG HD3 4.070 . 4.680 3.889 3.083 4.536 . 0 0 "[ . 1 . 2]" 1
822 1 75 ILE MG 1 79 ARG HE 3.820 . 4.390 3.902 2.830 4.249 . 0 0 "[ . 1 . 2]" 1
823 1 75 ILE MG 1 87 ALA HA 3.990 . 4.590 3.192 2.889 3.739 . 0 0 "[ . 1 . 2]" 1
824 1 75 ILE MG 1 87 ALA MB 3.250 . 3.740 2.302 2.021 2.664 . 0 0 "[ . 1 . 2]" 1
825 1 75 ILE MG 1 91 ALA MB 3.410 . 3.920 2.375 2.023 2.813 . 0 0 "[ . 1 . 2]" 1
826 1 76 ALA H 1 76 ALA MB 2.840 . 3.270 2.236 2.211 2.253 . 0 0 "[ . 1 . 2]" 1
827 1 76 ALA H 1 77 ALA H 3.070 . 3.530 2.530 2.432 2.688 . 0 0 "[ . 1 . 2]" 1
828 1 76 ALA HA 1 79 ARG HB2 3.530 . 4.060 3.680 2.719 3.905 . 0 0 "[ . 1 . 2]" 1
829 1 76 ALA HA 1 80 GLY H 4.450 . 5.120 3.797 3.376 4.037 . 0 0 "[ . 1 . 2]" 1
830 1 76 ALA MB 1 77 ALA H 3.180 . 3.660 2.862 2.651 3.105 . 0 0 "[ . 1 . 2]" 1
831 1 76 ALA MB 1 77 ALA HA 3.890 . 4.470 3.913 3.824 4.030 . 0 0 "[ . 1 . 2]" 1
832 1 77 ALA H 1 77 ALA MB 2.880 . 3.310 2.242 2.212 2.323 . 0 0 "[ . 1 . 2]" 1
833 1 77 ALA H 1 78 LEU H 3.200 . 3.680 2.809 2.614 2.999 . 0 0 "[ . 1 . 2]" 1
834 1 77 ALA H 1 78 LEU HB2 5.200 . 5.980 4.764 4.519 5.203 . 0 0 "[ . 1 . 2]" 1
835 1 77 ALA H 1 79 ARG H 4.330 . 4.980 3.949 3.677 4.149 . 0 0 "[ . 1 . 2]" 1
836 1 77 ALA HA 1 80 GLY H 3.840 . 4.420 3.512 3.192 3.853 . 0 0 "[ . 1 . 2]" 1
837 1 77 ALA MB 1 78 LEU H 3.400 . 3.910 2.348 2.071 2.507 . 0 0 "[ . 1 . 2]" 1
838 1 77 ALA MB 1 78 LEU MD1 4.610 . 5.300 3.526 2.235 4.037 . 0 0 "[ . 1 . 2]" 1
839 1 78 LEU H 1 78 LEU HB2 3.240 . 3.730 2.363 2.113 2.629 . 0 0 "[ . 1 . 2]" 1
840 1 78 LEU H 1 78 LEU HB3 3.560 . 4.090 3.512 3.373 3.574 . 0 0 "[ . 1 . 2]" 1
841 1 78 LEU H 1 78 LEU MD1 4.190 . 4.820 3.147 1.994 3.523 . 0 0 "[ . 1 . 2]" 1
842 1 78 LEU H 1 78 LEU MD2 3.680 . 4.230 1.929 1.793 3.274 0.007 7 0 "[ . 1 . 2]" 1
843 1 78 LEU H 1 78 LEU HG 3.270 . 3.760 3.784 3.757 3.810 0.050 19 0 "[ . 1 . 2]" 1
844 1 78 LEU H 1 79 ARG H 3.260 . 3.750 2.692 2.584 2.829 . 0 0 "[ . 1 . 2]" 1
845 1 78 LEU H 1 79 ARG HB2 4.690 . 5.390 4.990 4.824 5.142 . 0 0 "[ . 1 . 2]" 1
846 1 78 LEU HA 1 78 LEU MD1 3.010 . 3.460 2.097 2.012 2.291 . 0 0 "[ . 1 . 2]" 1
847 1 78 LEU HA 1 78 LEU HG 4.020 . 4.620 3.642 2.740 3.783 . 0 0 "[ . 1 . 2]" 1
848 1 78 LEU HA 1 83 LEU HB2 3.830 . 4.400 2.973 2.549 3.688 . 0 0 "[ . 1 . 2]" 1
849 1 78 LEU HA 1 83 LEU MD1 3.920 . 4.510 3.533 2.819 4.261 . 0 0 "[ . 1 . 2]" 1
850 1 78 LEU HB2 1 79 ARG H 3.670 . 4.220 2.566 2.468 2.671 . 0 0 "[ . 1 . 2]" 1
851 1 78 LEU HB2 1 87 ALA HA 3.780 . 4.350 2.620 2.324 2.930 . 0 0 "[ . 1 . 2]" 1
852 1 78 LEU HB2 1 87 ALA MB 3.220 . 3.700 2.098 1.880 2.489 . 0 0 "[ . 1 . 2]" 1
853 1 78 LEU HB3 1 78 LEU MD1 3.440 . 3.960 2.519 2.380 3.200 . 0 0 "[ . 1 . 2]" 1
854 1 78 LEU HB3 1 78 LEU MD2 3.190 . 3.670 3.146 2.490 3.211 . 0 0 "[ . 1 . 2]" 1
855 1 78 LEU MD1 1 83 LEU HB2 3.690 . 4.240 2.892 2.165 4.117 . 0 0 "[ . 1 . 2]" 1
856 1 78 LEU MD1 1 86 LEU HB2 3.670 . 4.220 2.682 2.151 4.045 . 0 0 "[ . 1 . 2]" 1
857 1 78 LEU MD1 1 86 LEU MD2 4.210 . 4.840 3.895 3.500 4.681 . 0 0 "[ . 1 . 2]" 1
858 1 78 LEU MD2 1 86 LEU MD1 4.610 . 5.300 4.197 3.288 4.759 . 0 0 "[ . 1 . 2]" 1
859 1 78 LEU MD2 1 87 ALA H 4.460 . 5.130 4.351 3.001 4.852 . 0 0 "[ . 1 . 2]" 1
860 1 78 LEU MD2 1 87 ALA HA 3.190 . 3.670 2.922 2.063 3.467 . 0 0 "[ . 1 . 2]" 1
861 1 78 LEU MD2 1 87 ALA MB 3.880 . 4.460 3.540 2.996 3.941 . 0 0 "[ . 1 . 2]" 1
862 1 78 LEU MD2 1 90 VAL H 4.840 . 5.570 5.073 3.814 5.387 . 0 0 "[ . 1 . 2]" 1
863 1 78 LEU MD2 1 90 VAL MG2 3.530 . 4.060 2.947 2.177 3.371 . 0 0 "[ . 1 . 2]" 1
864 1 79 ARG H 1 79 ARG HB2 3.010 . 3.460 2.464 2.330 2.615 . 0 0 "[ . 1 . 2]" 1
865 1 79 ARG H 1 79 ARG HB3 3.820 . 4.390 2.580 2.432 3.614 . 0 0 "[ . 1 . 2]" 1
866 1 79 ARG H 1 80 GLY H 3.300 . 3.800 2.546 2.412 2.762 . 0 0 "[ . 1 . 2]" 1
867 1 79 ARG H 1 81 CYS H 4.290 . 4.930 4.134 4.011 4.361 . 0 0 "[ . 1 . 2]" 1
868 1 79 ARG H 1 87 ALA MB 3.660 . 4.210 2.504 2.284 2.692 . 0 0 "[ . 1 . 2]" 1
869 1 79 ARG HA 1 79 ARG HB2 2.940 . 3.380 2.509 2.447 2.995 . 0 0 "[ . 1 . 2]" 1
870 1 79 ARG HA 1 82 GLU H 4.410 . 5.070 3.932 3.338 4.867 . 0 0 "[ . 1 . 2]" 1
871 1 79 ARG HA 1 83 LEU H 3.830 . 4.400 3.550 3.020 4.034 . 0 0 "[ . 1 . 2]" 1
872 1 79 ARG HA 1 84 VAL HA 3.890 . 4.470 2.781 2.135 3.408 . 0 0 "[ . 1 . 2]" 1
873 1 79 ARG HA 1 84 VAL MG1 4.170 . 4.800 4.023 3.189 4.604 . 0 0 "[ . 1 . 2]" 1
874 1 79 ARG HA 1 84 VAL MG2 3.820 . 4.390 2.896 2.050 3.835 . 0 0 "[ . 1 . 2]" 1
875 1 79 ARG HA 1 87 ALA MB 4.060 . 4.670 2.998 2.707 3.574 . 0 0 "[ . 1 . 2]" 1
876 1 79 ARG HB2 1 79 ARG HD2 3.440 . 3.960 3.587 2.326 3.717 . 0 0 "[ . 1 . 2]" 1
877 1 79 ARG HB2 1 79 ARG HD3 2.990 . 3.440 2.485 2.382 2.916 . 0 0 "[ . 1 . 2]" 1
878 1 79 ARG HB2 1 79 ARG HE 3.600 . 4.140 3.168 2.571 4.121 . 0 0 "[ . 1 . 2]" 1
879 1 79 ARG HB2 1 80 GLY H 3.560 . 4.090 3.893 3.259 3.984 . 0 0 "[ . 1 . 2]" 1
880 1 79 ARG HB2 1 87 ALA MB 3.170 . 3.650 2.272 2.001 3.329 . 0 0 "[ . 1 . 2]" 1
881 1 79 ARG HB3 1 79 ARG HD3 3.360 . 3.860 3.172 2.461 3.672 . 0 0 "[ . 1 . 2]" 1
882 1 79 ARG HB3 1 79 ARG HE 4.540 . 5.220 2.461 1.975 4.221 . 0 0 "[ . 1 . 2]" 1
883 1 79 ARG HD2 1 84 VAL MG1 4.110 . 4.730 4.016 3.199 4.531 . 0 0 "[ . 1 . 2]" 1
884 1 79 ARG HE 1 87 ALA MB 4.160 . 4.780 4.264 2.398 4.671 . 0 0 "[ . 1 . 2]" 1
885 1 80 GLY H 1 80 GLY HA3 2.940 . 3.380 2.286 2.256 2.390 . 0 0 "[ . 1 . 2]" 1
886 1 80 GLY H 1 81 CYS H 3.300 . 3.800 2.629 2.533 2.776 . 0 0 "[ . 1 . 2]" 1
887 1 80 GLY HA3 1 81 CYS H 3.490 . 4.010 2.967 2.792 3.424 . 0 0 "[ . 1 . 2]" 1
888 1 81 CYS H 1 81 CYS HB2 3.970 . 4.570 3.672 3.607 3.864 . 0 0 "[ . 1 . 2]" 1
889 1 81 CYS H 1 81 CYS HB3 3.220 . 3.700 3.000 2.783 3.354 . 0 0 "[ . 1 . 2]" 1
890 1 81 CYS H 1 82 GLU H 3.260 . 3.750 2.634 2.259 3.094 . 0 0 "[ . 1 . 2]" 1
891 1 81 CYS HB2 1 83 LEU MD1 4.010 . 4.610 3.759 3.319 4.261 . 0 0 "[ . 1 . 2]" 1
892 1 81 CYS HB3 1 83 LEU MD1 4.310 . 4.960 4.636 4.273 4.776 . 0 0 "[ . 1 . 2]" 1
893 1 82 GLU H 1 82 GLU HA 2.760 . 3.170 2.345 2.167 2.868 . 0 0 "[ . 1 . 2]" 1
894 1 82 GLU H 1 82 GLU QB 3.280 . 3.770 3.365 3.240 3.490 . 0 0 "[ . 1 . 2]" 1
895 1 82 GLU H 1 82 GLU HG2 3.990 . 4.590 3.248 2.674 4.471 . 0 0 "[ . 1 . 2]" 1
896 1 82 GLU H 1 83 LEU H 3.090 . 3.550 2.483 1.783 2.852 0.017 17 0 "[ . 1 . 2]" 1
897 1 82 GLU HA 1 82 GLU HG2 3.340 . 3.840 3.015 2.402 3.725 . 0 0 "[ . 1 . 2]" 1
898 1 82 GLU HA 1 82 GLU HG3 3.580 . 4.120 3.438 2.525 3.831 . 0 0 "[ . 1 . 2]" 1
899 1 82 GLU HA 1 83 LEU H 3.460 . 3.980 3.054 2.840 3.233 . 0 0 "[ . 1 . 2]" 1
900 1 82 GLU HA 1 84 VAL MG2 3.410 . 3.920 3.080 2.329 3.777 . 0 0 "[ . 1 . 2]" 1
901 1 82 GLU QB 1 83 LEU H 4.040 . 4.650 3.727 3.462 4.052 . 0 0 "[ . 1 . 2]" 1
902 1 83 LEU H 1 83 LEU HB2 3.260 . 3.750 2.522 2.465 2.619 . 0 0 "[ . 1 . 2]" 1
903 1 83 LEU H 1 83 LEU HB3 3.670 . 4.220 3.665 3.616 3.744 . 0 0 "[ . 1 . 2]" 1
904 1 83 LEU H 1 83 LEU MD1 3.950 . 4.540 3.817 3.612 3.937 . 0 0 "[ . 1 . 2]" 1
905 1 83 LEU H 1 83 LEU MD2 4.010 . 4.610 3.619 3.370 3.928 . 0 0 "[ . 1 . 2]" 1
906 1 83 LEU H 1 84 VAL H 3.620 . 4.160 3.563 2.978 3.866 . 0 0 "[ . 1 . 2]" 1
907 1 83 LEU HA 1 83 LEU MD1 4.330 . 4.980 3.891 3.860 3.925 . 0 0 "[ . 1 . 2]" 1
908 1 83 LEU HA 1 83 LEU MD2 2.760 . 3.170 2.103 2.064 2.212 . 0 0 "[ . 1 . 2]" 1
909 1 83 LEU HA 1 83 LEU HG 3.890 . 4.470 3.122 2.988 3.243 . 0 0 "[ . 1 . 2]" 1
910 1 83 LEU HA 1 84 VAL H 2.970 . 3.420 2.278 2.120 2.574 . 0 0 "[ . 1 . 2]" 1
911 1 83 LEU HA 1 85 ASP H 3.930 . 4.520 3.485 3.235 3.828 . 0 0 "[ . 1 . 2]" 1
912 1 83 LEU HB2 1 83 LEU MD1 3.200 . 3.680 2.332 2.266 2.381 . 0 0 "[ . 1 . 2]" 1
913 1 83 LEU HB3 1 83 LEU MD1 3.310 . 3.810 2.423 2.371 2.500 . 0 0 "[ . 1 . 2]" 1
914 1 83 LEU HB3 1 83 LEU MD2 3.150 . 3.620 2.363 2.289 2.430 . 0 0 "[ . 1 . 2]" 1
915 1 83 LEU HB3 1 84 VAL H 4.330 . 4.980 4.166 3.969 4.390 . 0 0 "[ . 1 . 2]" 1
916 1 83 LEU HB3 1 85 ASP H 4.470 . 5.140 4.340 3.933 4.675 . 0 0 "[ . 1 . 2]" 1
917 1 83 LEU MD2 1 84 VAL H 4.110 . 4.730 4.037 3.840 4.307 . 0 0 "[ . 1 . 2]" 1
918 1 84 VAL H 1 84 VAL HB 2.880 . 3.310 2.568 2.529 2.627 . 0 0 "[ . 1 . 2]" 1
919 1 84 VAL H 1 84 VAL MG2 2.890 . 3.320 2.032 1.909 2.189 . 0 0 "[ . 1 . 2]" 1
920 1 84 VAL H 1 85 ASP H 3.110 . 3.580 2.552 2.327 2.741 . 0 0 "[ . 1 . 2]" 1
921 1 84 VAL HA 1 84 VAL MG1 2.930 . 3.370 2.404 2.382 2.426 . 0 0 "[ . 1 . 2]" 1
922 1 84 VAL HA 1 84 VAL MG2 3.150 . 3.620 2.425 2.390 2.463 . 0 0 "[ . 1 . 2]" 1
923 1 84 VAL HA 1 85 ASP H 3.530 . 4.060 3.477 3.422 3.531 . 0 0 "[ . 1 . 2]" 1
924 1 84 VAL HA 1 87 ALA H 3.470 . 3.990 3.304 2.847 3.578 . 0 0 "[ . 1 . 2]" 1
925 1 84 VAL HA 1 87 ALA MB 3.030 . 3.480 2.455 2.074 2.756 . 0 0 "[ . 1 . 2]" 1
926 1 84 VAL HB 1 85 ASP H 3.270 . 3.760 2.847 2.496 3.128 . 0 0 "[ . 1 . 2]" 1
927 1 84 VAL MG1 1 85 ASP H 3.920 . 4.510 3.703 3.424 3.869 . 0 0 "[ . 1 . 2]" 1
928 1 84 VAL MG1 1 85 ASP HA 4.220 . 4.850 3.691 3.417 3.924 . 0 0 "[ . 1 . 2]" 1
929 1 84 VAL MG1 1 87 ALA H 4.700 . 5.410 4.521 4.148 4.829 . 0 0 "[ . 1 . 2]" 1
930 1 85 ASP H 1 85 ASP QB 2.880 . 3.310 2.463 2.275 2.620 . 0 0 "[ . 1 . 2]" 1
931 1 85 ASP H 1 86 LEU H 3.110 . 3.580 2.669 2.554 2.749 . 0 0 "[ . 1 . 2]" 1
932 1 85 ASP HA 1 88 ASP HB2 3.880 . 4.460 3.638 3.125 4.160 . 0 0 "[ . 1 . 2]" 1
933 1 85 ASP HA 1 88 ASP HB3 3.440 . 3.960 2.878 2.372 3.400 . 0 0 "[ . 1 . 2]" 1
934 1 85 ASP QB 1 86 LEU H 3.290 . 3.780 2.753 2.207 3.526 . 0 0 "[ . 1 . 2]" 1
935 1 86 LEU H 1 86 LEU HB2 3.190 . 3.670 2.414 2.327 2.480 . 0 0 "[ . 1 . 2]" 1
936 1 86 LEU H 1 86 LEU HB3 3.500 . 4.030 3.587 3.558 3.611 . 0 0 "[ . 1 . 2]" 1
937 1 86 LEU H 1 86 LEU MD1 4.830 . 5.550 3.607 3.484 3.698 . 0 0 "[ . 1 . 2]" 1
938 1 86 LEU H 1 86 LEU MD2 4.250 . 4.890 3.570 3.408 3.788 . 0 0 "[ . 1 . 2]" 1
939 1 86 LEU H 1 86 LEU HG 3.540 . 4.070 2.474 2.308 2.654 . 0 0 "[ . 1 . 2]" 1
940 1 86 LEU H 1 87 ALA H 3.210 . 3.690 2.588 2.446 2.688 . 0 0 "[ . 1 . 2]" 1
941 1 86 LEU HA 1 86 LEU MD2 3.090 . 3.550 2.036 1.961 2.158 . 0 0 "[ . 1 . 2]" 1
942 1 86 LEU HA 1 86 LEU HG 3.780 . 4.350 2.983 2.828 3.096 . 0 0 "[ . 1 . 2]" 1
943 1 86 LEU HA 1 89 GLU HB3 3.870 . 4.450 3.887 2.989 4.149 . 0 0 "[ . 1 . 2]" 1
944 1 86 LEU HB2 1 86 LEU MD1 3.470 . 3.990 2.289 2.218 2.321 . 0 0 "[ . 1 . 2]" 1
945 1 86 LEU HB2 1 86 LEU HG 2.980 . 3.430 2.511 2.469 2.562 . 0 0 "[ . 1 . 2]" 1
946 1 86 LEU HB2 1 87 ALA H 3.460 . 3.980 2.771 2.501 3.034 . 0 0 "[ . 1 . 2]" 1
947 1 86 LEU HB3 1 87 ALA H 3.480 . 4.000 3.670 3.439 3.844 . 0 0 "[ . 1 . 2]" 1
948 1 86 LEU MD2 1 89 GLU HB3 4.020 . 4.620 4.417 4.061 4.576 . 0 0 "[ . 1 . 2]" 1
949 1 87 ALA H 1 87 ALA MB 2.860 . 3.290 2.255 2.215 2.288 . 0 0 "[ . 1 . 2]" 1
950 1 87 ALA H 1 88 ASP H 3.160 . 3.630 2.600 2.345 2.741 . 0 0 "[ . 1 . 2]" 1
951 1 87 ALA HA 1 90 VAL HB 3.870 . 4.450 3.379 3.118 3.559 . 0 0 "[ . 1 . 2]" 1
952 1 87 ALA HA 1 90 VAL MG2 4.120 . 4.740 3.406 2.959 3.867 . 0 0 "[ . 1 . 2]" 1
953 1 87 ALA MB 1 88 ASP H 3.130 . 3.600 2.430 2.305 2.616 . 0 0 "[ . 1 . 2]" 1
954 1 88 ASP H 1 88 ASP HB2 3.140 . 3.610 2.543 2.398 2.623 . 0 0 "[ . 1 . 2]" 1
955 1 88 ASP H 1 88 ASP HB3 3.090 . 3.550 2.516 2.413 2.660 . 0 0 "[ . 1 . 2]" 1
956 1 88 ASP H 1 89 GLU H 3.180 . 3.660 2.683 2.557 2.816 . 0 0 "[ . 1 . 2]" 1
957 1 88 ASP HA 1 91 ALA H 4.040 . 4.650 3.408 3.119 3.642 . 0 0 "[ . 1 . 2]" 1
958 1 88 ASP HA 1 91 ALA MB 3.220 . 3.700 2.356 2.103 2.605 . 0 0 "[ . 1 . 2]" 1
959 1 88 ASP HA 1 92 SER H 4.420 . 5.080 3.962 3.656 4.248 . 0 0 "[ . 1 . 2]" 1
960 1 88 ASP HB2 1 89 GLU H 3.560 . 4.090 3.931 3.845 3.969 . 0 0 "[ . 1 . 2]" 1
961 1 88 ASP HB3 1 89 GLU H 3.740 . 4.300 2.667 2.546 2.818 . 0 0 "[ . 1 . 2]" 1
962 1 89 GLU H 1 89 GLU HB3 3.040 . 3.500 2.971 2.213 3.493 . 0 0 "[ . 1 . 2]" 1
963 1 89 GLU H 1 89 GLU HG2 3.610 . 4.150 2.487 2.089 4.068 . 0 0 "[ . 1 . 2]" 1
964 1 89 GLU H 1 89 GLU HG3 3.760 . 4.320 3.568 2.254 4.240 . 0 0 "[ . 1 . 2]" 1
965 1 89 GLU H 1 90 VAL H 3.160 . 3.630 2.712 2.509 2.903 . 0 0 "[ . 1 . 2]" 1
966 1 89 GLU HA 1 89 GLU HG2 3.930 . 4.520 3.343 2.411 3.895 . 0 0 "[ . 1 . 2]" 1
967 1 89 GLU HA 1 89 GLU HG3 3.580 . 4.120 3.637 2.460 3.835 . 0 0 "[ . 1 . 2]" 1
968 1 89 GLU HB3 1 90 VAL H 3.550 . 4.080 3.615 2.835 3.996 . 0 0 "[ . 1 . 2]" 1
969 1 89 GLU HG2 1 90 VAL H 4.570 . 5.260 3.670 2.663 4.945 . 0 0 "[ . 1 . 2]" 1
970 1 90 VAL H 1 90 VAL HB 3.030 . 3.480 2.600 2.530 2.651 . 0 0 "[ . 1 . 2]" 1
971 1 90 VAL H 1 90 VAL MG1 4.110 . 4.730 3.801 3.776 3.830 . 0 0 "[ . 1 . 2]" 1
972 1 90 VAL H 1 90 VAL MG2 2.880 . 3.310 2.105 1.929 2.283 . 0 0 "[ . 1 . 2]" 1
973 1 90 VAL H 1 91 ALA H 3.140 . 3.610 2.507 2.282 2.673 . 0 0 "[ . 1 . 2]" 1
974 1 90 VAL HA 1 90 VAL MG1 3.150 . 3.620 2.400 2.363 2.456 . 0 0 "[ . 1 . 2]" 1
975 1 90 VAL HA 1 90 VAL MG2 3.040 . 3.500 2.442 2.385 2.498 . 0 0 "[ . 1 . 2]" 1
976 1 90 VAL HA 1 93 VAL HB 3.420 . 3.930 3.135 2.586 3.796 . 0 0 "[ . 1 . 2]" 1
977 1 90 VAL HA 1 93 VAL MG2 3.610 . 4.150 2.847 2.406 3.678 . 0 0 "[ . 1 . 2]" 1
978 1 90 VAL HB 1 91 ALA H 3.240 . 3.730 2.625 2.358 2.792 . 0 0 "[ . 1 . 2]" 1
979 1 90 VAL HB 1 92 SER H 4.750 . 5.460 5.082 4.935 5.242 . 0 0 "[ . 1 . 2]" 1
980 1 90 VAL MG1 1 91 ALA H 3.720 . 4.280 3.566 3.362 3.704 . 0 0 "[ . 1 . 2]" 1
981 1 90 VAL MG1 1 91 ALA HA 4.000 . 4.600 3.621 3.437 3.797 . 0 0 "[ . 1 . 2]" 1
982 1 90 VAL MG2 1 91 ALA H 4.270 . 4.910 3.743 3.595 3.890 . 0 0 "[ . 1 . 2]" 1
983 1 91 ALA H 1 91 ALA MB 2.820 . 3.240 2.232 2.208 2.255 . 0 0 "[ . 1 . 2]" 1
984 1 91 ALA H 1 92 SER H 3.130 . 3.600 2.736 2.649 2.829 . 0 0 "[ . 1 . 2]" 1
985 1 91 ALA HA 1 94 TYR H 3.870 . 4.450 3.536 3.357 3.840 . 0 0 "[ . 1 . 2]" 1
986 1 91 ALA HA 1 94 TYR HB3 3.780 . 4.350 3.058 2.633 3.719 . 0 0 "[ . 1 . 2]" 1
987 1 91 ALA MB 1 92 SER H 3.120 . 3.590 2.613 2.398 2.748 . 0 0 "[ . 1 . 2]" 1
988 1 92 SER H 1 92 SER QB 2.940 . 3.380 2.459 2.190 2.751 . 0 0 "[ . 1 . 2]" 1
989 1 92 SER H 1 93 VAL H 3.290 . 3.780 2.613 2.383 2.792 . 0 0 "[ . 1 . 2]" 1
990 1 92 SER HA 1 95 GLN H 4.340 . 4.990 3.541 3.185 3.972 . 0 0 "[ . 1 . 2]" 1
991 1 92 SER HA 1 95 GLN QB 3.990 . 4.590 2.735 2.182 4.040 . 0 0 "[ . 1 . 2]" 1
992 1 92 SER QB 1 93 VAL H 3.550 . 4.080 2.992 2.498 3.577 . 0 0 "[ . 1 . 2]" 1
993 1 92 SER QB 1 95 GLN H 4.990 . 5.740 4.896 4.658 5.308 . 0 0 "[ . 1 . 2]" 1
994 1 93 VAL H 1 93 VAL HB 2.910 . 3.350 2.551 2.489 2.617 . 0 0 "[ . 1 . 2]" 1
995 1 93 VAL H 1 93 VAL MG1 3.940 . 4.530 3.783 3.764 3.808 . 0 0 "[ . 1 . 2]" 1
996 1 93 VAL H 1 93 VAL MG2 3.160 . 3.630 2.128 1.973 2.317 . 0 0 "[ . 1 . 2]" 1
997 1 93 VAL H 1 94 TYR H 3.280 . 3.770 2.548 2.291 2.796 . 0 0 "[ . 1 . 2]" 1
998 1 93 VAL HA 1 93 VAL MG1 3.240 . 3.730 2.405 2.275 2.491 . 0 0 "[ . 1 . 2]" 1
999 1 93 VAL HA 1 93 VAL MG2 3.040 . 3.500 2.412 2.338 2.509 . 0 0 "[ . 1 . 2]" 1
1000 1 93 VAL HB 1 94 TYR H 3.160 . 3.630 2.437 2.130 2.708 . 0 0 "[ . 1 . 2]" 1
1001 1 93 VAL MG1 1 94 TYR H 3.800 . 4.370 3.380 3.267 3.548 . 0 0 "[ . 1 . 2]" 1
1002 1 93 VAL MG1 1 94 TYR HA 4.330 . 4.980 3.423 3.226 3.623 . 0 0 "[ . 1 . 2]" 1
1003 1 93 VAL MG1 1 97 TYR QD 4.390 . 5.050 2.294 1.981 3.028 . 0 0 "[ . 1 . 2]" 1
1004 1 93 VAL MG1 1 97 TYR QE 3.190 . 3.670 2.462 1.921 2.946 . 0 0 "[ . 1 . 2]" 1
1005 1 93 VAL MG2 1 94 TYR H 3.970 . 4.570 3.696 3.494 3.874 . 0 0 "[ . 1 . 2]" 1
1006 1 94 TYR H 1 94 TYR HB2 3.140 . 3.610 2.441 2.313 2.597 . 0 0 "[ . 1 . 2]" 1
1007 1 94 TYR H 1 94 TYR HB3 3.100 . 3.570 2.597 2.433 2.722 . 0 0 "[ . 1 . 2]" 1
1008 1 94 TYR H 1 95 GLN H 3.180 . 3.660 2.547 2.425 2.724 . 0 0 "[ . 1 . 2]" 1
1009 1 94 TYR HA 1 94 TYR QD 2.880 . 3.310 2.612 2.357 2.831 . 0 0 "[ . 1 . 2]" 1
1010 1 94 TYR HB2 1 95 GLN H 4.170 . 4.800 4.092 3.942 4.213 . 0 0 "[ . 1 . 2]" 1
1011 1 94 TYR HB3 1 95 GLN H 3.460 . 3.980 3.200 2.974 3.521 . 0 0 "[ . 1 . 2]" 1
1012 1 94 TYR QD 1 95 GLN H 4.080 . 4.690 4.434 3.902 4.586 . 0 0 "[ . 1 . 2]" 1
1013 1 95 GLN H 1 95 GLN QB 2.990 . 3.440 2.336 2.183 2.733 . 0 0 "[ . 1 . 2]" 1
1014 1 95 GLN H 1 95 GLN QG 3.750 . 4.310 3.503 2.049 4.080 . 0 0 "[ . 1 . 2]" 1
1015 1 95 GLN H 1 96 SER H 3.160 . 3.630 2.494 2.174 2.669 . 0 0 "[ . 1 . 2]" 1
1016 1 95 GLN H 1 97 TYR H 4.100 . 4.720 3.897 3.587 4.043 . 0 0 "[ . 1 . 2]" 1
1017 1 95 GLN HA 1 95 GLN QG 3.520 . 4.050 2.715 2.335 3.361 . 0 0 "[ . 1 . 2]" 1
1018 1 95 GLN QB 1 96 SER H 3.660 . 4.210 2.986 2.547 3.797 . 0 0 "[ . 1 . 2]" 1
1019 1 96 SER H 1 96 SER HB2 3.460 . 3.980 2.718 2.443 3.697 . 0 0 "[ . 1 . 2]" 1
1020 1 96 SER H 1 96 SER HB3 3.460 . 3.980 3.191 2.457 3.643 . 0 0 "[ . 1 . 2]" 1
1021 1 96 SER H 1 97 TYR H 3.440 . 3.960 2.278 2.145 2.475 . 0 0 "[ . 1 . 2]" 1
1022 1 97 TYR H 1 97 TYR HB2 3.960 . 4.550 2.621 2.419 2.767 . 0 0 "[ . 1 . 2]" 1
1023 1 97 TYR H 1 97 TYR HB3 3.400 . 3.910 3.708 3.598 3.805 . 0 0 "[ . 1 . 2]" 1
1024 1 97 TYR HA 1 97 TYR QD 2.770 . 3.190 2.719 2.354 3.008 . 0 0 "[ . 1 . 2]" 1
1025 1 97 TYR HA 1 98 GLN H 2.760 . 3.170 2.144 2.005 2.280 . 0 0 "[ . 1 . 2]" 1
1026 1 98 GLN H 1 98 GLN HB2 3.840 . 4.420 3.381 2.807 4.017 . 0 0 "[ . 1 . 2]" 1
1027 1 98 GLN H 1 98 GLN QG 3.290 . 3.780 2.835 2.448 3.407 . 0 0 "[ . 1 . 2]" 1
1028 1 98 GLN H 1 99 PRO HD2 4.010 . 4.610 3.640 3.068 4.434 . 0 0 "[ . 1 . 2]" 1
1029 1 98 GLN H 1 99 PRO HD3 3.920 . 4.510 3.055 2.721 3.725 . 0 0 "[ . 1 . 2]" 1
1030 1 98 GLN HA 1 98 GLN QG 3.420 . 3.930 2.482 2.274 3.271 . 0 0 "[ . 1 . 2]" 1
1031 1 98 GLN HA 1 99 PRO HD2 2.970 . 3.420 2.051 1.925 2.193 . 0 0 "[ . 1 . 2]" 1
1032 1 98 GLN HA 1 99 PRO HD3 2.980 . 3.430 2.694 2.362 3.021 . 0 0 "[ . 1 . 2]" 1
1033 1 98 GLN HB2 1 98 GLN QG 2.540 . 2.920 2.304 2.158 2.403 . 0 0 "[ . 1 . 2]" 1
1034 1 98 GLN QG 1 99 PRO HD3 4.250 . 4.890 4.691 4.493 4.754 . 0 0 "[ . 1 . 2]" 1
1035 1 99 PRO HA 1 100 ARG H 3.370 . 3.880 3.387 3.170 3.491 . 0 0 "[ . 1 . 2]" 1
1036 1 99 PRO HB2 1 100 ARG H 4.210 . 4.840 3.608 3.044 4.073 . 0 0 "[ . 1 . 2]" 1
1037 1 99 PRO HB3 1 100 ARG H 3.990 . 4.590 4.201 3.901 4.402 . 0 0 "[ . 1 . 2]" 1
1038 1 99 PRO HG2 1 100 ARG H 4.450 . 5.120 2.534 1.969 3.190 . 0 0 "[ . 1 . 2]" 1
1039 1 99 PRO HG3 1 100 ARG QG 3.120 . 3.590 3.510 3.472 3.535 . 0 0 "[ . 1 . 2]" 1
1040 1 100 ARG H 1 100 ARG HB3 3.310 . 3.810 3.552 3.280 3.691 . 0 0 "[ . 1 . 2]" 1
1041 1 100 ARG H 1 100 ARG QG 4.000 . 4.600 2.547 2.220 2.881 . 0 0 "[ . 1 . 2]" 1
1042 1 100 ARG HA 1 101 THR H 2.840 . 3.270 2.422 2.029 3.142 . 0 0 "[ . 1 . 2]" 1
1043 1 100 ARG HB2 1 100 ARG QG 2.460 . 2.830 2.322 2.162 2.413 . 0 0 "[ . 1 . 2]" 1
1044 1 100 ARG HB2 1 101 THR H 3.990 . 4.590 3.456 2.253 4.414 . 0 0 "[ . 1 . 2]" 1
1045 1 100 ARG HB3 1 100 ARG QG 2.480 . 2.850 2.338 2.180 2.398 . 0 0 "[ . 1 . 2]" 1
1046 1 101 THR H 1 101 THR MG 4.460 . 5.130 3.509 1.859 3.972 . 0 0 "[ . 1 . 2]" 1
1047 1 101 THR HA 1 101 THR HB 2.900 . 3.340 2.924 2.416 3.044 . 0 0 "[ . 1 . 2]" 1
1048 1 101 THR HA 1 101 THR MG 3.020 . 3.470 2.416 2.258 3.231 . 0 0 "[ . 1 . 2]" 1
1049 1 101 THR HA 1 102 SER H 3.570 . 4.110 2.716 2.128 3.562 . 0 0 "[ . 1 . 2]" 1
1050 1 101 THR MG 1 102 SER H 4.050 . 4.660 3.468 2.163 4.018 . 0 0 "[ . 1 . 2]" 1
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