NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
621502 |
5o2q   |
34143 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5o2q
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 2484
_Distance_constraint_stats_list.Viol_count 7192
_Distance_constraint_stats_list.Viol_total 10779.979
_Distance_constraint_stats_list.Viol_max 0.500
_Distance_constraint_stats_list.Viol_rms 0.0177
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0027
_Distance_constraint_stats_list.Viol_average_violations_only 0.0375
_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 4 LYS 0.689 0.097 35 0 "[ . 1 . 2 . 3 . 4]"
1 5 TYR 3.074 0.097 35 0 "[ . 1 . 2 . 3 . 4]"
1 6 LEU 9.336 0.170 12 0 "[ . 1 . 2 . 3 . 4]"
1 7 ASN 0.836 0.140 32 0 "[ . 1 . 2 . 3 . 4]"
1 8 VAL 12.303 0.201 15 0 "[ . 1 . 2 . 3 . 4]"
1 9 LEU 2.884 0.047 21 0 "[ . 1 . 2 . 3 . 4]"
1 10 ALA 7.083 0.115 8 0 "[ . 1 . 2 . 3 . 4]"
1 11 LYS 7.729 0.123 38 0 "[ . 1 . 2 . 3 . 4]"
1 12 ALA 5.639 0.097 32 0 "[ . 1 . 2 . 3 . 4]"
1 13 LEU 10.768 0.144 5 0 "[ . 1 . 2 . 3 . 4]"
1 14 TYR 7.801 0.174 28 0 "[ . 1 . 2 . 3 . 4]"
1 15 ASP 1.026 0.136 39 0 "[ . 1 . 2 . 3 . 4]"
1 16 ASN 6.109 0.250 25 0 "[ . 1 . 2 . 3 . 4]"
1 17 VAL 3.125 0.250 25 0 "[ . 1 . 2 . 3 . 4]"
1 18 ALA 4.962 0.175 27 0 "[ . 1 . 2 . 3 . 4]"
1 19 GLU 0.995 0.040 17 0 "[ . 1 . 2 . 3 . 4]"
1 20 SER 3.237 0.050 24 0 "[ . 1 . 2 . 3 . 4]"
1 21 PRO 1.426 0.050 24 0 "[ . 1 . 2 . 3 . 4]"
1 22 ASP 3.408 0.106 2 0 "[ . 1 . 2 . 3 . 4]"
1 23 GLU 5.089 0.098 17 0 "[ . 1 . 2 . 3 . 4]"
1 24 LEU 8.516 0.116 22 0 "[ . 1 . 2 . 3 . 4]"
1 25 SER 4.364 0.096 29 0 "[ . 1 . 2 . 3 . 4]"
1 26 PHE 15.671 0.175 27 0 "[ . 1 . 2 . 3 . 4]"
1 27 ARG 3.101 0.212 5 0 "[ . 1 . 2 . 3 . 4]"
1 28 LYS 3.063 0.082 32 0 "[ . 1 . 2 . 3 . 4]"
1 29 GLY 1.918 0.111 21 0 "[ . 1 . 2 . 3 . 4]"
1 30 ASP 8.777 0.236 3 0 "[ . 1 . 2 . 3 . 4]"
1 31 ILE 9.266 0.117 39 0 "[ . 1 . 2 . 3 . 4]"
1 32 MET 8.602 0.152 36 0 "[ . 1 . 2 . 3 . 4]"
1 33 THR 12.593 0.293 39 0 "[ . 1 . 2 . 3 . 4]"
1 34 VAL 12.915 0.176 35 0 "[ . 1 . 2 . 3 . 4]"
1 35 LEU 13.812 0.173 32 0 "[ . 1 . 2 . 3 . 4]"
1 36 GLU 17.927 0.284 24 0 "[ . 1 . 2 . 3 . 4]"
1 37 ARG 4.143 0.170 12 0 "[ . 1 . 2 . 3 . 4]"
1 38 ASP 0.551 0.099 37 0 "[ . 1 . 2 . 3 . 4]"
1 39 THR 13.723 0.284 24 0 "[ . 1 . 2 . 3 . 4]"
1 40 GLN 5.207 0.087 2 0 "[ . 1 . 2 . 3 . 4]"
1 41 GLY 0.477 0.057 24 0 "[ . 1 . 2 . 3 . 4]"
1 42 LEU 35.749 0.500 16 0 "[ . 1 . 2 . 3 . 4]"
1 43 ASP 5.266 0.100 4 0 "[ . 1 . 2 . 3 . 4]"
1 44 GLY 0.708 0.098 26 0 "[ . 1 . 2 . 3 . 4]"
1 45 TRP 15.211 0.242 39 0 "[ . 1 . 2 . 3 . 4]"
1 46 TRP 8.728 0.202 24 0 "[ . 1 . 2 . 3 . 4]"
1 47 LEU 12.489 0.173 32 0 "[ . 1 . 2 . 3 . 4]"
1 48 CYS 4.230 0.072 12 0 "[ . 1 . 2 . 3 . 4]"
1 49 SER 6.347 0.058 32 0 "[ . 1 . 2 . 3 . 4]"
1 50 LEU 14.092 0.293 39 0 "[ . 1 . 2 . 3 . 4]"
1 51 HIS 2.201 0.116 22 0 "[ . 1 . 2 . 3 . 4]"
1 52 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
1 53 ARG 3.592 0.096 40 0 "[ . 1 . 2 . 3 . 4]"
1 54 GLN 3.269 0.093 27 0 "[ . 1 . 2 . 3 . 4]"
1 55 GLY 0.147 0.022 24 0 "[ . 1 . 2 . 3 . 4]"
1 56 ILE 12.808 0.100 24 0 "[ . 1 . 2 . 3 . 4]"
1 57 VAL 23.294 0.242 39 0 "[ . 1 . 2 . 3 . 4]"
1 58 PRO 3.214 0.065 34 0 "[ . 1 . 2 . 3 . 4]"
1 59 GLY 0.778 0.071 28 0 "[ . 1 . 2 . 3 . 4]"
1 60 ASN 0.239 0.023 9 0 "[ . 1 . 2 . 3 . 4]"
1 61 ARG 0.617 0.029 27 0 "[ . 1 . 2 . 3 . 4]"
1 62 LEU 35.034 0.414 5 0 "[ . 1 . 2 . 3 . 4]"
1 63 LYS 19.739 0.408 39 0 "[ . 1 . 2 . 3 . 4]"
1 64 ILE 17.391 0.414 5 0 "[ . 1 . 2 . 3 . 4]"
1 65 LEU 15.097 0.408 39 0 "[ . 1 . 2 . 3 . 4]"
1 66 VAL 1.378 0.201 15 0 "[ . 1 . 2 . 3 . 4]"
1 67 GLY 0.509 0.198 9 0 "[ . 1 . 2 . 3 . 4]"
1 68 MET 0.743 0.108 10 0 "[ . 1 . 2 . 3 . 4]"
1 69 TYR 0.743 0.108 10 0 "[ . 1 . 2 . 3 . 4]"
1 71 LYS 0.159 0.043 11 0 "[ . 1 . 2 . 3 . 4]"
1 72 LYS 0.371 0.041 32 0 "[ . 1 . 2 . 3 . 4]"
1 73 PRO 0.346 0.041 32 0 "[ . 1 . 2 . 3 . 4]"
1 74 ALA 0.017 0.017 4 0 "[ . 1 . 2 . 3 . 4]"
1 75 GLY 0.017 0.017 4 0 "[ . 1 . 2 . 3 . 4]"
1 82 GLY 0.009 0.009 22 0 "[ . 1 . 2 . 3 . 4]"
1 83 LEU 0.209 0.177 38 0 "[ . 1 . 2 . 3 . 4]"
1 84 THR 0.333 0.049 36 0 "[ . 1 . 2 . 3 . 4]"
1 85 ASP 0.237 0.037 38 0 "[ . 1 . 2 . 3 . 4]"
1 86 GLU 0.745 0.050 38 0 "[ . 1 . 2 . 3 . 4]"
1 87 LEU 0.863 0.050 38 0 "[ . 1 . 2 . 3 . 4]"
1 88 ALA 3.600 0.174 28 0 "[ . 1 . 2 . 3 . 4]"
1 89 PRO 0.588 0.034 29 0 "[ . 1 . 2 . 3 . 4]"
1 90 PRO 0.513 0.024 27 0 "[ . 1 . 2 . 3 . 4]"
1 91 LYS 0.620 0.062 14 0 "[ . 1 . 2 . 3 . 4]"
1 92 PRO 0.690 0.025 40 0 "[ . 1 . 2 . 3 . 4]"
1 93 PRO 0.674 0.084 29 0 "[ . 1 . 2 . 3 . 4]"
1 94 LEU 21.750 0.500 16 0 "[ . 1 . 2 . 3 . 4]"
1 95 PRO 5.504 0.110 26 0 "[ . 1 . 2 . 3 . 4]"
1 96 GLU 2.321 0.119 19 0 "[ . 1 . 2 . 3 . 4]"
1 97 GLY 0.956 0.119 19 0 "[ . 1 . 2 . 3 . 4]"
1 98 GLU 0.032 0.017 11 0 "[ . 1 . 2 . 3 . 4]"
1 99 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4]"
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 4 LYS HA 1 4 LYS QD 4.000 . 4.000 2.905 2.017 4.022 0.022 12 0 "[ . 1 . 2 . 3 . 4]" 1
2 1 4 LYS HA 1 4 LYS HG2 3.880 . 3.880 2.956 2.400 3.742 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
3 1 4 LYS HA 1 4 LYS HG3 3.880 . 3.880 3.184 2.183 3.862 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
4 1 4 LYS HA 1 5 TYR H 3.370 . 3.370 2.483 2.093 3.409 0.039 6 0 "[ . 1 . 2 . 3 . 4]" 1
5 1 4 LYS HA 1 5 TYR HB2 5.500 . 5.500 4.860 4.453 5.452 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
6 1 4 LYS HA 1 5 TYR QD 5.160 . 5.160 4.996 4.487 5.257 0.097 35 0 "[ . 1 . 2 . 3 . 4]" 1
7 1 4 LYS QB 1 4 LYS QE 4.520 . 4.520 3.633 2.086 3.902 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
8 1 4 LYS QB 1 5 TYR H 3.750 . 3.750 3.156 1.863 3.757 0.007 15 0 "[ . 1 . 2 . 3 . 4]" 1
9 1 4 LYS QB 1 5 TYR QD 4.390 . 4.390 3.265 2.452 3.966 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
10 1 4 LYS QB 1 5 TYR QE 4.630 . 4.630 4.186 3.359 4.720 0.090 12 0 "[ . 1 . 2 . 3 . 4]" 1
11 1 4 LYS HB2 1 5 TYR H 4.470 . 4.470 4.051 2.172 4.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
12 1 4 LYS HB3 1 5 TYR H 4.470 . 4.470 3.370 2.028 4.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
13 1 4 LYS QE 1 4 LYS HG2 3.610 . 3.610 2.569 2.319 3.363 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
14 1 4 LYS QE 1 4 LYS HG3 3.610 . 3.610 2.534 2.286 3.037 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
15 1 5 TYR H 1 5 TYR HB2 3.430 . 3.430 3.197 2.335 3.490 0.060 12 0 "[ . 1 . 2 . 3 . 4]" 1
16 1 5 TYR H 1 5 TYR HB3 4.000 . 4.000 3.940 3.587 4.046 0.046 12 0 "[ . 1 . 2 . 3 . 4]" 1
17 1 5 TYR H 1 5 TYR QD 4.090 . 4.090 3.583 3.342 3.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
18 1 5 TYR H 1 5 TYR QE 5.500 . 5.500 5.056 4.655 5.563 0.063 3 0 "[ . 1 . 2 . 3 . 4]" 1
19 1 5 TYR HA 1 5 TYR QD 2.830 . 2.830 2.232 2.072 2.560 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
20 1 5 TYR HA 1 5 TYR QE 4.540 . 4.540 4.346 4.295 4.450 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
21 1 5 TYR HA 1 6 LEU H 3.050 . 3.050 2.420 2.301 2.647 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
22 1 5 TYR HA 1 6 LEU HB2 5.380 . 5.380 4.897 4.769 5.116 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
23 1 5 TYR HA 1 6 LEU QD 5.440 . 5.440 4.101 3.992 4.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
24 1 5 TYR HA 1 6 LEU HG 4.380 . 4.380 3.826 3.591 4.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
25 1 5 TYR HA 1 7 ASN H 4.830 . 4.830 4.451 4.264 4.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
26 1 5 TYR HA 1 35 LEU QD 5.410 . 5.410 4.648 4.523 4.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
27 1 5 TYR HB2 1 6 LEU H 3.970 . 3.970 3.623 3.403 3.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
28 1 5 TYR HB2 1 7 ASN H 4.340 . 4.340 3.765 3.362 3.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
29 1 5 TYR HB2 1 7 ASN HA 5.500 . 5.500 4.836 4.254 5.086 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
30 1 5 TYR HB2 1 7 ASN HD21 3.950 . 3.950 2.697 2.223 3.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
31 1 5 TYR HB2 1 7 ASN HD22 3.950 . 3.950 3.599 2.507 3.977 0.027 24 0 "[ . 1 . 2 . 3 . 4]" 1
32 1 5 TYR HB2 1 35 LEU HA 4.090 . 4.090 3.672 3.363 3.884 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
33 1 5 TYR HB2 1 35 LEU QD 3.520 . 3.520 2.858 2.630 3.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
34 1 5 TYR HB3 1 6 LEU H 3.710 . 3.710 2.250 1.966 2.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
35 1 5 TYR HB3 1 7 ASN H 4.060 . 4.060 2.765 2.508 2.931 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
36 1 5 TYR HB3 1 7 ASN QD 4.810 . 4.810 3.489 2.620 3.958 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
37 1 5 TYR HB3 1 35 LEU HA 3.730 . 3.730 2.240 2.143 2.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
38 1 5 TYR HB3 1 35 LEU HB3 4.660 . 4.660 2.723 2.511 2.926 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
39 1 5 TYR HB3 1 35 LEU MD1 4.900 . 4.900 4.378 4.179 4.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
40 1 5 TYR HB3 1 35 LEU QD 3.360 . 3.360 2.752 2.607 2.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
41 1 5 TYR HB3 1 35 LEU MD2 4.900 . 4.900 2.781 2.630 2.943 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
42 1 5 TYR QD 1 6 LEU H 3.860 . 3.860 3.215 3.079 3.306 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
43 1 5 TYR QD 1 6 LEU MD1 5.500 . 5.500 5.103 5.001 5.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
44 1 5 TYR QD 1 6 LEU QD 4.810 . 4.810 4.573 4.458 4.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
45 1 5 TYR QD 1 6 LEU MD2 5.500 . 5.500 5.165 4.984 5.312 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
46 1 5 TYR QD 1 35 LEU HA 4.100 . 4.100 3.857 3.709 3.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
47 1 5 TYR QD 1 35 LEU HB2 4.460 . 4.460 4.047 3.701 4.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
48 1 5 TYR QD 1 35 LEU HB3 3.800 . 3.800 2.943 2.699 3.018 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
49 1 5 TYR QD 1 35 LEU MD1 4.450 . 4.450 3.656 3.483 4.041 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
50 1 5 TYR QD 1 35 LEU QD 3.540 . 3.540 2.721 2.502 3.345 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
51 1 5 TYR QD 1 35 LEU MD2 4.450 . 4.450 2.811 2.548 3.569 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
52 1 5 TYR QD 1 35 LEU HG 5.500 . 5.500 5.209 5.086 5.364 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
53 1 5 TYR QD 1 36 GLU H 5.060 . 5.060 4.378 4.135 4.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
54 1 5 TYR QD 1 36 GLU HB2 4.220 . 4.220 3.791 3.606 4.064 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
55 1 5 TYR QD 1 36 GLU HB3 4.070 . 4.070 2.243 2.118 2.436 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
56 1 5 TYR QD 1 36 GLU HG2 5.350 . 5.350 4.170 3.978 4.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
57 1 5 TYR QD 1 36 GLU HG3 5.350 . 5.350 5.088 4.904 5.243 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
58 1 5 TYR QD 1 47 LEU QD 4.310 . 4.310 3.741 3.555 3.920 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
59 1 5 TYR QD 1 47 LEU HG 5.500 . 5.500 5.491 5.362 5.528 0.028 17 0 "[ . 1 . 2 . 3 . 4]" 1
60 1 5 TYR QE 1 6 LEU H 5.500 . 5.500 5.488 5.368 5.546 0.046 19 0 "[ . 1 . 2 . 3 . 4]" 1
61 1 5 TYR QE 1 35 LEU HB2 4.930 . 4.930 4.375 4.210 4.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
62 1 5 TYR QE 1 35 LEU MD1 4.570 . 4.570 3.547 3.303 4.091 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
63 1 5 TYR QE 1 35 LEU QD 4.000 . 4.000 3.333 3.106 3.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
64 1 5 TYR QE 1 35 LEU MD2 4.570 . 4.570 4.057 3.715 4.604 0.034 11 0 "[ . 1 . 2 . 3 . 4]" 1
65 1 5 TYR QE 1 36 GLU HB2 4.590 . 4.590 4.243 3.963 4.584 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
66 1 5 TYR QE 1 36 GLU HB3 4.350 . 4.350 2.866 2.662 3.149 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
67 1 5 TYR QE 1 36 GLU HG2 4.990 . 4.990 3.547 3.363 3.748 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
68 1 5 TYR QE 1 36 GLU QG 4.340 . 4.340 3.435 3.274 3.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
69 1 5 TYR QE 1 36 GLU HG3 4.990 . 4.990 4.597 4.319 4.956 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
70 1 5 TYR QE 1 47 LEU QD 3.510 . 3.510 2.721 2.586 2.904 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
71 1 5 TYR QE 1 47 LEU HG 5.500 . 5.500 4.986 4.839 5.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
72 1 6 LEU H 1 6 LEU HB2 3.440 . 3.440 2.499 2.466 2.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
73 1 6 LEU H 1 6 LEU HB3 3.750 . 3.750 3.587 3.566 3.606 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
74 1 6 LEU H 1 6 LEU MD1 3.950 . 3.950 3.599 3.515 3.661 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
75 1 6 LEU H 1 6 LEU QD 3.460 . 3.460 3.097 3.013 3.186 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
76 1 6 LEU H 1 6 LEU MD2 3.950 . 3.950 3.379 3.231 3.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
77 1 6 LEU H 1 6 LEU HG 3.320 . 3.320 2.282 2.141 2.424 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
78 1 6 LEU H 1 7 ASN H 3.730 . 3.730 2.546 2.327 2.715 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
79 1 6 LEU H 1 7 ASN HA 4.990 . 4.990 4.801 4.584 4.977 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
80 1 6 LEU H 1 8 VAL QG 4.710 . 4.710 4.405 4.322 4.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
81 1 6 LEU H 1 35 LEU HA 3.860 . 3.860 3.019 2.837 3.283 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
82 1 6 LEU H 1 35 LEU QD 4.720 . 4.720 4.237 4.102 4.455 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
83 1 6 LEU HA 1 6 LEU MD1 4.030 . 4.030 3.950 3.929 3.966 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
84 1 6 LEU HA 1 6 LEU QD 2.610 . 2.610 2.256 2.216 2.291 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
85 1 6 LEU HA 1 6 LEU MD2 4.030 . 4.030 2.269 2.228 2.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
86 1 6 LEU HA 1 6 LEU HG 3.760 . 3.760 3.239 3.192 3.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
87 1 6 LEU HA 1 8 VAL QG 4.020 . 4.020 3.596 3.532 3.642 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
88 1 6 LEU HB2 1 6 LEU MD1 3.490 . 3.490 2.273 2.253 2.285 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
89 1 6 LEU HB2 1 6 LEU QD 2.800 . 2.800 2.230 2.212 2.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
90 1 6 LEU HB2 1 6 LEU MD2 3.490 . 3.490 3.230 3.224 3.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
91 1 6 LEU HB2 1 7 ASN H 3.720 . 3.720 2.542 2.460 2.730 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
92 1 6 LEU HB2 1 7 ASN HA 4.510 . 4.510 4.368 4.287 4.518 0.008 33 0 "[ . 1 . 2 . 3 . 4]" 1
93 1 6 LEU HB2 1 8 VAL H 4.280 . 4.280 3.235 3.116 3.386 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
94 1 6 LEU HB2 1 8 VAL MG1 4.880 . 4.880 2.483 2.391 2.575 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
95 1 6 LEU HB2 1 8 VAL QG 3.450 . 3.450 2.465 2.378 2.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
96 1 6 LEU HB2 1 8 VAL MG2 4.880 . 4.880 4.201 4.106 4.282 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
97 1 6 LEU HB2 1 34 VAL QG 3.930 . 3.930 3.351 3.291 3.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
98 1 6 LEU HB2 1 35 LEU H 5.270 . 5.270 4.965 4.848 5.071 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
99 1 6 LEU HB2 1 35 LEU QD 5.400 . 5.400 4.849 4.701 5.017 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
100 1 6 LEU HB2 1 36 GLU HA 4.820 . 4.820 3.776 3.646 3.885 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
101 1 6 LEU HB3 1 6 LEU MD1 3.230 . 3.230 2.383 2.366 2.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
102 1 6 LEU HB3 1 6 LEU QD 2.720 . 2.720 2.119 2.109 2.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
103 1 6 LEU HB3 1 6 LEU MD2 3.230 . 3.230 2.375 2.354 2.394 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
104 1 6 LEU HB3 1 7 ASN H 4.000 . 4.000 3.664 3.591 3.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
105 1 6 LEU HB3 1 7 ASN HA 5.500 . 5.500 5.250 5.137 5.381 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
106 1 6 LEU HB3 1 8 VAL H 4.130 . 4.130 3.750 3.568 3.881 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
107 1 6 LEU HB3 1 8 VAL MG1 4.240 . 4.240 2.070 2.034 2.121 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
108 1 6 LEU HB3 1 8 VAL QG 3.200 . 3.200 2.064 2.028 2.115 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
109 1 6 LEU HB3 1 8 VAL MG2 4.240 . 4.240 4.093 3.962 4.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
110 1 6 LEU HB3 1 34 VAL QG 4.260 . 4.260 4.300 4.266 4.355 0.095 39 0 "[ . 1 . 2 . 3 . 4]" 1
111 1 6 LEU QD 1 7 ASN H 4.560 . 4.560 4.030 3.971 4.133 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
112 1 6 LEU QD 1 8 VAL H 4.860 . 4.860 4.280 4.184 4.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
113 1 6 LEU QD 1 8 VAL HB 5.310 . 5.310 5.024 4.962 5.133 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
114 1 6 LEU QD 1 8 VAL QG 2.990 . 2.990 2.662 2.611 2.745 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
115 1 6 LEU QD 1 34 VAL HB 3.940 . 3.940 3.709 3.587 3.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
116 1 6 LEU QD 1 34 VAL QG 2.820 . 2.820 2.388 2.299 2.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
117 1 6 LEU QD 1 35 LEU HA 5.040 . 5.040 4.362 4.248 4.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
118 1 6 LEU QD 1 36 GLU H 4.440 . 4.440 3.987 3.875 4.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
119 1 6 LEU QD 1 36 GLU HA 3.140 . 3.140 2.294 2.215 2.364 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
120 1 6 LEU QD 1 37 ARG H 3.630 . 3.630 3.163 3.017 3.293 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
121 1 6 LEU QD 1 37 ARG HA 4.810 . 4.810 4.564 4.472 4.663 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
122 1 6 LEU QD 1 37 ARG HB2 4.400 . 4.400 3.655 3.494 3.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
123 1 6 LEU QD 1 37 ARG HB3 4.900 . 4.900 4.660 4.563 4.758 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
124 1 6 LEU QD 1 37 ARG HD2 4.440 . 4.440 4.523 4.443 4.610 0.170 12 0 "[ . 1 . 2 . 3 . 4]" 1
125 1 6 LEU QD 1 37 ARG HD3 3.770 . 3.770 3.511 3.412 3.771 0.001 39 0 "[ . 1 . 2 . 3 . 4]" 1
126 1 6 LEU QD 1 37 ARG HG3 3.800 . 3.800 2.374 2.297 2.483 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
127 1 6 LEU MD1 1 36 GLU HA 3.880 . 3.880 2.310 2.227 2.384 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
128 1 6 LEU MD1 1 37 ARG H 4.940 . 4.940 3.210 3.054 3.352 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
129 1 6 LEU MD1 1 37 ARG HG3 5.080 . 5.080 2.382 2.304 2.491 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
130 1 6 LEU MD2 1 36 GLU HA 3.880 . 3.880 3.899 3.880 3.921 0.041 30 0 "[ . 1 . 2 . 3 . 4]" 1
131 1 6 LEU MD2 1 37 ARG H 4.940 . 4.940 4.771 4.652 4.876 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
132 1 6 LEU MD2 1 37 ARG HG3 5.080 . 5.080 4.600 4.469 4.795 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
133 1 6 LEU HG 1 7 ASN H 4.620 . 4.620 4.242 4.144 4.338 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
134 1 6 LEU HG 1 8 VAL QG 4.160 . 4.160 4.240 4.203 4.287 0.127 9 0 "[ . 1 . 2 . 3 . 4]" 1
135 1 6 LEU HG 1 34 VAL QG 4.610 . 4.610 4.283 4.203 4.384 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
136 1 6 LEU HG 1 36 GLU HA 3.900 . 3.900 2.554 2.498 2.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
137 1 7 ASN H 1 7 ASN QD 3.730 . 3.730 3.367 2.019 3.764 0.034 4 0 "[ . 1 . 2 . 3 . 4]" 1
138 1 7 ASN H 1 8 VAL H 3.620 . 3.620 2.988 2.927 3.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
139 1 7 ASN H 1 8 VAL MG1 5.500 . 5.500 3.579 3.500 3.686 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
140 1 7 ASN H 1 8 VAL QG 4.010 . 4.010 3.515 3.442 3.617 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
141 1 7 ASN H 1 8 VAL MG2 5.500 . 5.500 5.137 5.007 5.292 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
142 1 7 ASN H 1 33 THR MG 3.960 . 3.960 3.842 3.672 3.987 0.027 8 0 "[ . 1 . 2 . 3 . 4]" 1
143 1 7 ASN H 1 35 LEU HA 3.640 . 3.640 2.352 2.179 2.553 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
144 1 7 ASN H 1 35 LEU QD 3.840 . 3.840 3.183 3.006 3.348 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
145 1 7 ASN HA 1 8 VAL H 3.230 . 3.230 2.669 2.556 2.858 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
146 1 7 ASN HA 1 8 VAL QG 4.290 . 4.290 3.916 3.832 4.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
147 1 7 ASN HA 1 33 THR MG 2.940 . 2.940 2.300 2.136 2.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
148 1 7 ASN HA 1 34 VAL H 4.910 . 4.910 4.447 4.205 4.730 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
149 1 7 ASN HA 1 35 LEU QD 3.690 . 3.690 2.925 2.714 3.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
150 1 7 ASN QB 1 7 ASN QD 3.080 . 3.080 2.280 2.063 2.691 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
151 1 7 ASN QB 1 33 THR MG 3.580 . 3.580 3.257 3.009 3.690 0.110 36 0 "[ . 1 . 2 . 3 . 4]" 1
152 1 7 ASN HB2 1 8 VAL H 4.590 . 4.590 4.441 4.313 4.599 0.009 36 0 "[ . 1 . 2 . 3 . 4]" 1
153 1 7 ASN HB3 1 8 VAL H 4.590 . 4.590 4.434 4.363 4.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
154 1 7 ASN QD 1 35 LEU QD 3.810 . 3.810 2.965 2.116 3.950 0.140 32 0 "[ . 1 . 2 . 3 . 4]" 1
155 1 8 VAL H 1 8 VAL HB 3.920 . 3.920 3.763 3.714 3.808 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
156 1 8 VAL H 1 8 VAL MG1 3.820 . 3.820 2.085 1.999 2.159 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
157 1 8 VAL H 1 8 VAL QG 2.880 . 2.880 2.030 1.959 2.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
158 1 8 VAL H 1 8 VAL MG2 3.820 . 3.820 2.795 2.659 2.898 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
159 1 8 VAL H 1 9 LEU H 4.530 . 4.530 4.553 4.538 4.569 0.039 30 0 "[ . 1 . 2 . 3 . 4]" 1
160 1 8 VAL H 1 9 LEU QD 5.050 . 5.050 4.989 4.883 5.091 0.041 35 0 "[ . 1 . 2 . 3 . 4]" 1
161 1 8 VAL H 1 33 THR MG 3.480 . 3.480 3.356 3.189 3.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
162 1 8 VAL H 1 34 VAL H 3.900 . 3.900 3.242 3.121 3.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
163 1 8 VAL H 1 34 VAL HB 3.950 . 3.950 3.008 2.908 3.203 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
164 1 8 VAL H 1 34 VAL MG1 4.390 . 4.390 4.170 4.081 4.303 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
165 1 8 VAL H 1 34 VAL QG 3.830 . 3.830 3.733 3.676 3.837 0.007 26 0 "[ . 1 . 2 . 3 . 4]" 1
166 1 8 VAL H 1 34 VAL MG2 4.390 . 4.390 4.213 4.116 4.353 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
167 1 8 VAL H 1 35 LEU QD 5.400 . 5.400 4.575 4.352 4.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
168 1 8 VAL HA 1 8 VAL MG1 3.250 . 3.250 2.782 2.733 2.821 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
169 1 8 VAL HA 1 8 VAL QG 2.840 . 2.840 2.606 2.580 2.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
170 1 8 VAL HA 1 8 VAL MG2 3.250 . 3.250 3.146 3.125 3.168 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
171 1 8 VAL HA 1 9 LEU H 2.930 . 2.930 2.446 2.358 2.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
172 1 8 VAL HA 1 9 LEU MD1 5.440 . 5.440 5.184 5.136 5.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
173 1 8 VAL HA 1 9 LEU QD 4.150 . 4.150 4.134 4.051 4.176 0.026 8 0 "[ . 1 . 2 . 3 . 4]" 1
174 1 8 VAL HA 1 9 LEU MD2 5.440 . 5.440 4.344 4.242 4.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
175 1 8 VAL HA 1 9 LEU HG 4.220 . 4.220 3.817 3.742 3.878 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
176 1 8 VAL HA 1 33 THR MG 4.490 . 4.490 4.360 4.186 4.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
177 1 8 VAL HA 1 34 VAL QG 5.180 . 5.180 5.068 5.020 5.195 0.015 26 0 "[ . 1 . 2 . 3 . 4]" 1
178 1 8 VAL HA 1 64 ILE MG 5.350 . 5.350 5.141 5.055 5.240 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
179 1 8 VAL HB 1 9 LEU H 3.500 . 3.500 2.942 2.834 3.022 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
180 1 8 VAL HB 1 34 VAL H 5.500 . 5.500 5.469 5.299 5.522 0.022 39 0 "[ . 1 . 2 . 3 . 4]" 1
181 1 8 VAL HB 1 34 VAL QG 4.660 . 4.660 4.759 4.701 4.836 0.176 35 0 "[ . 1 . 2 . 3 . 4]" 1
182 1 8 VAL HB 1 64 ILE MD 4.870 . 4.870 4.727 4.602 4.892 0.022 38 0 "[ . 1 . 2 . 3 . 4]" 1
183 1 8 VAL HB 1 64 ILE MG 3.590 . 3.590 3.496 3.339 3.610 0.020 38 0 "[ . 1 . 2 . 3 . 4]" 1
184 1 8 VAL QG 1 9 LEU H 3.320 . 3.320 2.632 2.516 2.763 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
185 1 8 VAL QG 1 9 LEU HA 4.360 . 4.360 3.588 3.511 3.682 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
186 1 8 VAL QG 1 34 VAL H 3.980 . 3.980 2.947 2.689 3.060 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
187 1 8 VAL QG 1 34 VAL HA 4.600 . 4.600 4.304 4.192 4.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
188 1 8 VAL QG 1 34 VAL HB 2.860 . 2.860 1.933 1.901 1.997 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
189 1 8 VAL QG 1 34 VAL QG 3.360 . 3.360 2.358 2.288 2.433 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
190 1 8 VAL QG 1 64 ILE MG 3.280 . 3.280 1.921 1.890 1.943 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
191 1 8 VAL QG 1 65 LEU HB2 4.840 . 4.840 4.501 4.299 4.723 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
192 1 8 VAL QG 1 65 LEU HG 5.440 . 5.440 5.157 5.043 5.319 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
193 1 8 VAL QG 1 66 VAL H 5.440 . 5.440 5.104 3.024 5.479 0.039 40 0 "[ . 1 . 2 . 3 . 4]" 1
194 1 8 VAL QG 1 66 VAL HA 4.680 . 4.680 4.353 2.966 4.881 0.201 15 0 "[ . 1 . 2 . 3 . 4]" 1
195 1 8 VAL MG1 1 9 LEU H 4.310 . 4.310 4.198 4.152 4.247 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
196 1 8 VAL MG1 1 9 LEU HA 5.500 . 5.500 5.469 5.430 5.519 0.019 24 0 "[ . 1 . 2 . 3 . 4]" 1
197 1 8 VAL MG1 1 34 VAL H 4.800 . 4.800 4.324 4.271 4.377 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
198 1 8 VAL MG1 1 34 VAL HA 5.280 . 5.280 5.360 5.318 5.396 0.116 24 0 "[ . 1 . 2 . 3 . 4]" 1
199 1 8 VAL MG1 1 34 VAL HB 3.670 . 3.670 2.970 2.893 3.104 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
200 1 8 VAL MG2 1 9 LEU H 4.310 . 4.310 2.660 2.538 2.802 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
201 1 8 VAL MG2 1 9 LEU HA 5.500 . 5.500 3.638 3.555 3.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
202 1 8 VAL MG2 1 34 VAL H 4.800 . 4.800 3.000 2.717 3.124 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
203 1 8 VAL MG2 1 34 VAL HA 5.280 . 5.280 4.535 4.372 4.638 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
204 1 8 VAL MG2 1 34 VAL HB 3.670 . 3.670 1.959 1.918 2.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
205 1 9 LEU H 1 9 LEU HB2 3.460 . 3.460 2.506 2.479 2.524 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
206 1 9 LEU H 1 9 LEU HB3 3.910 . 3.910 3.688 3.661 3.708 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
207 1 9 LEU H 1 9 LEU MD1 4.100 . 4.100 3.870 3.785 3.922 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
208 1 9 LEU H 1 9 LEU QD 3.550 . 3.550 3.333 3.236 3.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
209 1 9 LEU H 1 9 LEU MD2 4.100 . 4.100 3.638 3.515 3.716 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
210 1 9 LEU H 1 9 LEU HG 4.240 . 4.240 2.707 2.536 2.814 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
211 1 9 LEU H 1 10 ALA H 4.630 . 4.630 4.589 4.559 4.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
212 1 9 LEU H 1 10 ALA MB 5.500 . 5.500 4.996 4.937 5.057 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
213 1 9 LEU H 1 31 ILE MG 5.500 . 5.500 5.215 5.103 5.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
214 1 9 LEU H 1 34 VAL H 4.890 . 4.890 4.761 4.668 4.833 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
215 1 9 LEU H 1 34 VAL QG 4.920 . 4.920 4.722 4.568 4.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
216 1 9 LEU H 1 64 ILE MG 4.360 . 4.360 4.378 4.304 4.407 0.047 21 0 "[ . 1 . 2 . 3 . 4]" 1
217 1 9 LEU H 1 65 LEU MD1 5.500 . 5.500 5.029 4.725 5.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
218 1 9 LEU HA 1 9 LEU MD1 4.100 . 4.100 3.874 3.854 3.886 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
219 1 9 LEU HA 1 9 LEU QD 2.730 . 2.730 2.143 2.129 2.164 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
220 1 9 LEU HA 1 9 LEU MD2 4.100 . 4.100 2.153 2.139 2.175 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
221 1 9 LEU HA 1 9 LEU HG 3.860 . 3.860 3.188 3.166 3.231 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
222 1 9 LEU HA 1 10 ALA H 2.870 . 2.870 2.235 2.189 2.297 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
223 1 9 LEU HA 1 31 ILE MG 3.880 . 3.880 3.381 3.241 3.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
224 1 9 LEU HA 1 33 THR MG 4.520 . 4.520 4.060 3.985 4.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
225 1 9 LEU HA 1 34 VAL H 3.980 . 3.980 3.205 3.055 3.362 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
226 1 9 LEU HA 1 34 VAL QG 3.870 . 3.870 3.643 3.492 3.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
227 1 9 LEU HB2 1 9 LEU MD1 3.220 . 3.220 2.314 2.295 2.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
228 1 9 LEU HB2 1 9 LEU QD 2.760 . 2.760 2.267 2.250 2.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
229 1 9 LEU HB2 1 9 LEU MD2 3.220 . 3.220 3.244 3.238 3.255 0.035 24 0 "[ . 1 . 2 . 3 . 4]" 1
230 1 9 LEU HB2 1 10 ALA H 4.340 . 4.340 4.008 3.949 4.056 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
231 1 9 LEU HB2 1 65 LEU HB2 4.210 . 4.210 2.806 2.534 3.082 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
232 1 9 LEU HB2 1 65 LEU HB3 4.730 . 4.730 4.257 3.910 4.570 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
233 1 9 LEU HB2 1 65 LEU MD1 3.690 . 3.690 3.100 2.735 3.629 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
234 1 9 LEU HB3 1 9 LEU MD1 3.200 . 3.200 2.363 2.342 2.375 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
235 1 9 LEU HB3 1 9 LEU QD 2.770 . 2.770 2.128 2.120 2.139 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
236 1 9 LEU HB3 1 9 LEU MD2 3.200 . 3.200 2.417 2.399 2.443 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
237 1 9 LEU HB3 1 10 ALA H 3.540 . 3.540 2.955 2.872 3.051 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
238 1 9 LEU HB3 1 31 ILE MD 4.330 . 4.330 3.667 3.508 3.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
239 1 9 LEU HB3 1 31 ILE MG 3.190 . 3.190 2.277 2.161 2.419 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
240 1 9 LEU HB3 1 32 MET H 5.500 . 5.500 4.732 4.565 4.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
241 1 9 LEU HB3 1 65 LEU HB2 4.090 . 4.090 3.751 3.549 3.998 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
242 1 9 LEU HB3 1 65 LEU MD1 3.640 . 3.640 2.895 2.488 3.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
243 1 9 LEU QD 1 10 ALA H 3.840 . 3.840 3.501 3.409 3.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
244 1 9 LEU QD 1 31 ILE HB 5.300 . 5.300 4.051 3.970 4.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
245 1 9 LEU QD 1 32 MET H 5.220 . 5.220 4.388 4.209 4.524 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
246 1 9 LEU QD 1 32 MET HA 4.940 . 4.940 4.392 4.231 4.565 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
247 1 9 LEU QD 1 33 THR HA 3.090 . 3.090 2.576 2.370 2.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
248 1 9 LEU QD 1 33 THR HB 4.760 . 4.760 4.407 4.268 4.646 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
249 1 9 LEU QD 1 33 THR MG 3.570 . 3.570 3.064 2.958 3.191 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
250 1 9 LEU QD 1 34 VAL H 4.270 . 4.270 4.013 3.810 4.139 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
251 1 10 ALA H 1 10 ALA MB 3.070 . 3.070 2.587 2.558 2.616 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
252 1 10 ALA H 1 11 LYS H 4.530 . 4.530 4.418 4.389 4.450 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
253 1 10 ALA H 1 31 ILE HA 4.970 . 4.970 4.021 3.906 4.098 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
254 1 10 ALA H 1 31 ILE MG 3.500 . 3.500 2.760 2.688 2.882 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
255 1 10 ALA H 1 32 MET HA 5.500 . 5.500 4.807 4.726 4.862 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
256 1 10 ALA H 1 32 MET HG2 4.600 . 4.600 3.587 3.422 3.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
257 1 10 ALA H 1 32 MET HG3 4.500 . 4.500 4.482 4.346 4.512 0.012 3 0 "[ . 1 . 2 . 3 . 4]" 1
258 1 10 ALA H 1 33 THR HA 4.100 . 4.100 3.804 3.746 3.867 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
259 1 10 ALA H 1 33 THR MG 5.500 . 5.500 5.515 5.466 5.546 0.046 24 0 "[ . 1 . 2 . 3 . 4]" 1
260 1 10 ALA H 1 34 VAL H 4.370 . 4.370 3.988 3.930 4.071 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
261 1 10 ALA H 1 34 VAL QG 3.750 . 3.750 3.297 3.211 3.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
262 1 10 ALA H 1 62 LEU QD 5.440 . 5.440 4.236 4.144 4.360 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
263 1 10 ALA H 1 65 LEU MD1 4.470 . 4.470 4.074 3.783 4.306 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
264 1 10 ALA H 1 65 LEU HG 4.760 . 4.760 4.417 4.242 4.535 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
265 1 10 ALA HA 1 11 LYS H 2.980 . 2.980 2.248 2.215 2.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
266 1 10 ALA HA 1 11 LYS HB2 4.620 . 4.620 4.553 4.445 4.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
267 1 10 ALA HA 1 11 LYS HB3 4.540 . 4.540 4.540 4.501 4.554 0.014 30 0 "[ . 1 . 2 . 3 . 4]" 1
268 1 10 ALA HA 1 62 LEU MD1 5.450 . 5.450 4.930 4.748 5.122 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
269 1 10 ALA HA 1 62 LEU QD 4.360 . 4.360 4.010 3.729 4.294 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
270 1 10 ALA HA 1 62 LEU MD2 5.450 . 5.450 4.302 3.862 4.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
271 1 10 ALA HA 1 64 ILE H 4.840 . 4.840 4.803 4.758 4.842 0.002 21 0 "[ . 1 . 2 . 3 . 4]" 1
272 1 10 ALA HA 1 64 ILE HA 3.850 . 3.850 2.560 2.527 2.611 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
273 1 10 ALA HA 1 64 ILE HB 5.500 . 5.500 5.509 5.489 5.533 0.033 35 0 "[ . 1 . 2 . 3 . 4]" 1
274 1 10 ALA HA 1 64 ILE MD 4.340 . 4.340 3.794 3.688 3.898 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
275 1 10 ALA HA 1 64 ILE HG12 5.500 . 5.500 5.502 5.469 5.521 0.021 8 0 "[ . 1 . 2 . 3 . 4]" 1
276 1 10 ALA HA 1 64 ILE MG 4.190 . 4.190 4.080 4.030 4.123 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
277 1 10 ALA HA 1 65 LEU H 3.440 . 3.440 2.327 2.198 2.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
278 1 10 ALA HA 1 65 LEU HB2 4.580 . 4.580 3.626 3.472 3.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
279 1 10 ALA HA 1 65 LEU HB3 5.100 . 5.100 4.863 4.761 4.965 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
280 1 10 ALA HA 1 65 LEU MD1 3.690 . 3.690 3.441 3.360 3.535 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
281 1 10 ALA HA 1 65 LEU MD2 3.860 . 3.860 3.706 3.553 3.792 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
282 1 10 ALA HA 1 65 LEU HG 3.620 . 3.620 2.201 2.120 2.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
283 1 10 ALA MB 1 11 LYS H 3.140 . 3.140 2.824 2.755 2.902 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
284 1 10 ALA MB 1 11 LYS HB3 5.250 . 5.250 4.887 4.832 4.957 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
285 1 10 ALA MB 1 32 MET H 3.940 . 3.940 3.549 3.506 3.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
286 1 10 ALA MB 1 32 MET ME 4.390 . 4.390 4.052 3.919 4.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
287 1 10 ALA MB 1 32 MET HG2 3.660 . 3.660 2.818 2.713 2.957 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
288 1 10 ALA MB 1 32 MET HG3 3.790 . 3.790 3.238 3.131 3.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
289 1 10 ALA MB 1 33 THR HA 5.500 . 5.500 4.768 4.697 4.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
290 1 10 ALA MB 1 34 VAL H 4.250 . 4.250 3.886 3.796 3.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
291 1 10 ALA MB 1 34 VAL HA 4.620 . 4.620 4.647 4.621 4.668 0.048 12 0 "[ . 1 . 2 . 3 . 4]" 1
292 1 10 ALA MB 1 34 VAL MG1 3.840 . 3.840 3.911 3.877 3.949 0.109 40 0 "[ . 1 . 2 . 3 . 4]" 1
293 1 10 ALA MB 1 34 VAL QG 2.590 . 2.590 1.962 1.935 1.991 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
294 1 10 ALA MB 1 34 VAL MG2 3.840 . 3.840 1.968 1.940 1.996 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
295 1 10 ALA MB 1 46 TRP HE3 4.190 . 4.190 3.734 3.598 3.868 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
296 1 10 ALA MB 1 46 TRP HZ3 4.000 . 4.000 3.610 3.424 3.847 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
297 1 10 ALA MB 1 62 LEU HA 4.510 . 4.510 4.240 4.106 4.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
298 1 10 ALA MB 1 62 LEU HB3 3.680 . 3.680 3.288 2.781 3.795 0.115 8 0 "[ . 1 . 2 . 3 . 4]" 1
299 1 10 ALA MB 1 62 LEU MD1 2.870 . 2.870 2.667 2.407 2.901 0.031 34 0 "[ . 1 . 2 . 3 . 4]" 1
300 1 10 ALA MB 1 62 LEU QD 2.500 . 2.500 2.057 1.938 2.204 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
301 1 10 ALA MB 1 62 LEU MD2 2.870 . 2.870 2.141 2.039 2.290 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
302 1 10 ALA MB 1 63 LYS H 3.460 . 3.460 3.160 2.986 3.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
303 1 10 ALA MB 1 63 LYS HA 5.500 . 5.500 4.336 4.260 4.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
304 1 10 ALA MB 1 63 LYS QB 4.850 . 4.850 4.427 4.327 4.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
305 1 10 ALA MB 1 64 ILE HA 3.070 . 3.070 2.374 2.322 2.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
306 1 10 ALA MB 1 64 ILE MD 2.970 . 2.970 2.100 2.031 2.169 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
307 1 10 ALA MB 1 65 LEU H 3.600 . 3.600 3.374 3.247 3.456 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
308 1 10 ALA MB 1 65 LEU HG 4.030 . 4.030 3.883 3.823 3.967 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
309 1 11 LYS H 1 11 LYS HB2 3.570 . 3.570 2.989 2.940 3.034 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
310 1 11 LYS H 1 11 LYS HB3 3.390 . 3.390 2.465 2.426 2.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
311 1 11 LYS H 1 11 LYS QD 4.810 . 4.810 4.823 4.773 4.837 0.027 1 0 "[ . 1 . 2 . 3 . 4]" 1
312 1 11 LYS H 1 11 LYS QE 4.920 . 4.920 4.923 4.764 4.955 0.035 10 0 "[ . 1 . 2 . 3 . 4]" 1
313 1 11 LYS H 1 11 LYS QG 4.420 . 4.420 4.001 3.965 4.045 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
314 1 11 LYS H 1 12 ALA H 4.560 . 4.560 4.525 4.497 4.558 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
315 1 11 LYS H 1 13 LEU MD1 4.980 . 4.980 4.757 4.587 4.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
316 1 11 LYS H 1 13 LEU QD 4.290 . 4.290 4.314 4.224 4.362 0.072 3 0 "[ . 1 . 2 . 3 . 4]" 1
317 1 11 LYS H 1 13 LEU MD2 4.980 . 4.980 4.943 4.780 5.009 0.029 12 0 "[ . 1 . 2 . 3 . 4]" 1
318 1 11 LYS H 1 31 ILE HA 5.200 . 5.200 4.897 4.836 4.945 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
319 1 11 LYS H 1 31 ILE MD 4.580 . 4.580 3.816 3.773 3.870 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
320 1 11 LYS H 1 31 ILE MG 4.960 . 4.960 4.835 4.776 4.912 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
321 1 11 LYS H 1 32 MET ME 5.500 . 5.500 5.286 5.130 5.410 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
322 1 11 LYS H 1 34 VAL QG 5.430 . 5.430 5.275 5.209 5.331 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
323 1 11 LYS H 1 62 LEU HA 5.500 . 5.500 4.904 4.780 5.014 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
324 1 11 LYS H 1 62 LEU MD1 5.460 . 5.460 4.658 3.981 5.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
325 1 11 LYS H 1 62 LEU QD 4.090 . 4.090 3.561 3.238 3.936 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
326 1 11 LYS H 1 62 LEU MD2 5.460 . 5.460 4.079 3.272 5.005 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
327 1 11 LYS H 1 63 LYS H 3.480 . 3.480 3.042 2.922 3.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
328 1 11 LYS H 1 63 LYS QB 4.280 . 4.280 3.181 3.032 3.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
329 1 11 LYS H 1 64 ILE HA 4.180 . 4.180 3.958 3.912 4.019 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
330 1 11 LYS H 1 65 LEU H 4.130 . 4.130 4.003 3.888 4.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
331 1 11 LYS H 1 65 LEU HB2 5.260 . 5.260 4.852 4.735 4.920 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
332 1 11 LYS H 1 65 LEU HB3 5.500 . 5.500 5.484 5.418 5.513 0.013 11 0 "[ . 1 . 2 . 3 . 4]" 1
333 1 11 LYS H 1 65 LEU MD1 3.340 . 3.340 3.345 3.226 3.395 0.055 9 0 "[ . 1 . 2 . 3 . 4]" 1
334 1 11 LYS H 1 65 LEU MD2 3.390 . 3.390 3.012 2.858 3.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
335 1 11 LYS H 1 65 LEU HG 3.610 . 3.610 2.488 2.424 2.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
336 1 11 LYS HA 1 11 LYS QD 4.330 . 4.330 4.227 4.193 4.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
337 1 11 LYS HA 1 11 LYS QE 4.660 . 4.660 3.585 3.324 3.838 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
338 1 11 LYS HA 1 11 LYS HG2 3.960 . 3.960 3.395 3.230 3.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
339 1 11 LYS HA 1 11 LYS QG 3.390 . 3.390 2.473 2.447 2.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
340 1 11 LYS HA 1 11 LYS HG3 3.960 . 3.960 2.541 2.509 2.574 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
341 1 11 LYS HA 1 12 ALA H 2.830 . 2.830 2.168 2.132 2.199 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
342 1 11 LYS HA 1 12 ALA MB 4.050 . 4.050 3.960 3.924 3.997 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
343 1 11 LYS HA 1 31 ILE H 4.980 . 4.980 4.935 4.884 4.989 0.009 8 0 "[ . 1 . 2 . 3 . 4]" 1
344 1 11 LYS HA 1 31 ILE HA 4.580 . 4.580 2.596 2.559 2.635 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
345 1 11 LYS HA 1 31 ILE MD 3.350 . 3.350 2.183 2.149 2.223 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
346 1 11 LYS HA 1 31 ILE HG12 4.450 . 4.450 4.430 4.383 4.453 0.003 3 0 "[ . 1 . 2 . 3 . 4]" 1
347 1 11 LYS HA 1 31 ILE HG13 5.030 . 5.030 5.049 5.038 5.071 0.041 34 0 "[ . 1 . 2 . 3 . 4]" 1
348 1 11 LYS HA 1 31 ILE MG 3.840 . 3.840 3.881 3.856 3.913 0.073 12 0 "[ . 1 . 2 . 3 . 4]" 1
349 1 11 LYS HA 1 32 MET ME 4.000 . 4.000 3.622 3.486 3.753 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
350 1 11 LYS HA 1 62 LEU QD 4.230 . 4.230 3.619 3.488 3.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
351 1 11 LYS HA 1 65 LEU MD1 4.140 . 4.140 3.657 3.581 3.704 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
352 1 11 LYS HB2 1 11 LYS QD 3.340 . 3.340 2.687 2.607 2.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
353 1 11 LYS HB2 1 11 LYS QE 3.590 . 3.590 2.243 2.119 2.374 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
354 1 11 LYS HB2 1 12 ALA H 4.030 . 4.030 4.047 4.032 4.068 0.038 24 0 "[ . 1 . 2 . 3 . 4]" 1
355 1 11 LYS HB2 1 31 ILE HA 4.720 . 4.720 4.273 4.210 4.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
356 1 11 LYS HB2 1 31 ILE MD 3.530 . 3.530 2.225 2.205 2.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
357 1 11 LYS HB2 1 31 ILE HG12 4.750 . 4.750 4.743 4.709 4.757 0.007 21 0 "[ . 1 . 2 . 3 . 4]" 1
358 1 11 LYS HB2 1 65 LEU MD1 2.830 . 2.830 2.078 1.968 2.233 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
359 1 11 LYS HB3 1 11 LYS QE 4.220 . 4.220 3.401 3.155 3.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
360 1 11 LYS HB3 1 12 ALA H 4.260 . 4.260 4.131 4.068 4.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
361 1 11 LYS HB3 1 31 ILE HA 5.500 . 5.500 5.454 5.398 5.502 0.002 8 0 "[ . 1 . 2 . 3 . 4]" 1
362 1 11 LYS HB3 1 31 ILE MD 3.660 . 3.660 3.577 3.561 3.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
363 1 11 LYS HB3 1 62 LEU QD 5.160 . 5.160 4.674 4.477 4.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
364 1 11 LYS HB3 1 65 LEU MD2 2.670 . 2.670 2.373 2.243 2.584 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
365 1 11 LYS QD 1 12 ALA H 4.580 . 4.580 4.513 4.476 4.566 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
366 1 11 LYS QD 1 13 LEU HA 5.360 . 5.360 4.638 4.324 4.848 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
367 1 11 LYS QD 1 13 LEU QD 3.670 . 3.670 3.621 3.306 3.793 0.123 38 0 "[ . 1 . 2 . 3 . 4]" 1
368 1 11 LYS QD 1 29 GLY H 4.790 . 4.790 4.210 4.006 4.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
369 1 11 LYS QD 1 29 GLY HA2 3.960 . 3.960 2.581 2.435 2.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
370 1 11 LYS QD 1 29 GLY HA3 4.760 . 4.760 4.082 3.906 4.254 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
371 1 11 LYS QD 1 30 ASP H 5.500 . 5.500 5.476 5.346 5.519 0.019 21 0 "[ . 1 . 2 . 3 . 4]" 1
372 1 11 LYS QD 1 31 ILE MD 3.940 . 3.940 3.521 3.465 3.648 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
373 1 11 LYS QD 1 65 LEU MD2 3.600 . 3.600 3.227 3.118 3.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
374 1 11 LYS QE 1 11 LYS HG2 3.440 . 3.440 3.284 3.262 3.324 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
375 1 11 LYS QE 1 11 LYS HG3 3.440 . 3.440 2.194 2.111 2.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
376 1 11 LYS QE 1 12 ALA H 4.700 . 4.700 4.286 4.043 4.688 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
377 1 11 LYS QE 1 29 GLY H 5.500 . 5.500 4.853 4.668 5.304 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
378 1 11 LYS QE 1 29 GLY HA2 3.830 . 3.830 3.074 2.878 3.524 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
379 1 11 LYS QE 1 29 GLY HA3 5.130 . 5.130 4.145 3.955 4.635 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
380 1 11 LYS QE 1 31 ILE MD 3.300 . 3.300 1.932 1.851 2.111 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
381 1 11 LYS QE 1 31 ILE HG12 4.870 . 4.870 3.409 3.243 3.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
382 1 11 LYS QE 1 31 ILE HG13 4.790 . 4.790 3.909 3.810 4.160 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
383 1 11 LYS QE 1 65 LEU MD1 3.420 . 3.420 2.813 2.487 3.075 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
384 1 11 LYS QE 1 65 LEU MD2 3.660 . 3.660 3.533 3.007 3.744 0.084 37 0 "[ . 1 . 2 . 3 . 4]" 1
385 1 11 LYS QG 1 12 ALA H 3.280 . 3.280 2.433 2.376 2.516 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
386 1 11 LYS QG 1 13 LEU QD 3.770 . 3.770 2.867 2.582 3.116 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
387 1 11 LYS QG 1 29 GLY H 4.350 . 4.350 3.231 3.133 3.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
388 1 11 LYS QG 1 29 GLY HA2 3.780 . 3.780 2.555 2.423 2.690 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
389 1 11 LYS QG 1 30 ASP H 4.700 . 4.700 4.014 3.900 4.084 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
390 1 11 LYS QG 1 31 ILE MD 4.440 . 4.440 2.605 2.328 2.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
391 1 11 LYS QG 1 62 LEU QD 4.950 . 4.950 4.363 4.249 4.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
392 1 11 LYS HG2 1 12 ALA H 3.750 . 3.750 3.175 2.913 3.348 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
393 1 11 LYS HG2 1 12 ALA MB 4.540 . 4.540 4.086 3.887 4.207 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
394 1 11 LYS HG2 1 29 GLY HA2 4.330 . 4.330 3.269 3.054 3.422 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
395 1 11 LYS HG3 1 12 ALA H 3.750 . 3.750 2.532 2.441 2.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
396 1 11 LYS HG3 1 12 ALA MB 4.540 . 4.540 3.805 3.668 4.019 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
397 1 11 LYS HG3 1 29 GLY HA2 4.330 . 4.330 2.670 2.536 2.814 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
398 1 12 ALA H 1 12 ALA MB 2.750 . 2.750 2.189 2.170 2.219 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
399 1 12 ALA H 1 13 LEU H 4.600 . 4.600 4.603 4.573 4.621 0.021 12 0 "[ . 1 . 2 . 3 . 4]" 1
400 1 12 ALA H 1 28 LYS HA 4.830 . 4.830 4.844 4.808 4.880 0.050 32 0 "[ . 1 . 2 . 3 . 4]" 1
401 1 12 ALA H 1 30 ASP H 3.930 . 3.930 3.488 3.338 3.594 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
402 1 12 ALA H 1 30 ASP QB 4.740 . 4.740 3.751 3.638 3.815 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
403 1 12 ALA H 1 31 ILE HA 3.970 . 3.970 3.753 3.704 3.819 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
404 1 12 ALA H 1 31 ILE MD 3.950 . 3.950 3.507 3.464 3.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
405 1 12 ALA H 1 31 ILE MG 5.480 . 5.480 5.416 5.373 5.477 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
406 1 12 ALA H 1 32 MET ME 3.630 . 3.630 3.032 2.934 3.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
407 1 12 ALA H 1 62 LEU QD 3.670 . 3.670 3.259 3.180 3.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
408 1 12 ALA HA 1 13 LEU H 3.140 . 3.140 2.213 2.195 2.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
409 1 12 ALA HA 1 13 LEU MD1 4.260 . 4.260 4.130 3.950 4.266 0.006 16 0 "[ . 1 . 2 . 3 . 4]" 1
410 1 12 ALA HA 1 13 LEU QD 3.730 . 3.730 3.291 3.178 3.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
411 1 12 ALA HA 1 13 LEU MD2 4.260 . 4.260 3.458 3.336 3.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
412 1 12 ALA HA 1 14 TYR H 3.940 . 3.940 3.422 3.329 3.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
413 1 12 ALA HA 1 32 MET ME 4.030 . 4.030 3.721 3.641 3.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
414 1 12 ALA HA 1 57 VAL QG 4.890 . 4.890 4.814 4.725 4.874 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
415 1 12 ALA HA 1 62 LEU H 5.240 . 5.240 5.229 5.163 5.251 0.011 16 0 "[ . 1 . 2 . 3 . 4]" 1
416 1 12 ALA HA 1 62 LEU QD 2.800 . 2.800 1.976 1.918 2.039 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
417 1 12 ALA HA 1 62 LEU HG 4.790 . 4.790 3.924 3.635 4.197 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
418 1 12 ALA HA 1 63 LYS H 4.000 . 4.000 3.759 3.613 3.868 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
419 1 12 ALA MB 1 13 LEU H 3.350 . 3.350 3.212 3.117 3.297 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
420 1 12 ALA MB 1 13 LEU HA 4.460 . 4.460 4.334 4.279 4.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
421 1 12 ALA MB 1 13 LEU HB2 5.180 . 5.180 5.057 4.996 5.128 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
422 1 12 ALA MB 1 13 LEU MD1 4.890 . 4.890 4.655 4.510 4.752 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
423 1 12 ALA MB 1 13 LEU QD 4.120 . 4.120 4.098 3.999 4.167 0.047 31 0 "[ . 1 . 2 . 3 . 4]" 1
424 1 12 ALA MB 1 13 LEU MD2 4.890 . 4.890 4.549 4.445 4.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
425 1 12 ALA MB 1 14 TYR H 3.210 . 3.210 2.818 2.702 2.916 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
426 1 12 ALA MB 1 14 TYR HA 4.980 . 4.980 4.607 4.484 4.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
427 1 12 ALA MB 1 15 ASP HA 4.730 . 4.730 3.795 3.414 4.215 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
428 1 12 ALA MB 1 16 ASN HB2 5.260 . 5.260 4.651 4.453 5.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
429 1 12 ALA MB 1 16 ASN QB 4.510 . 4.510 4.319 4.056 4.444 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
430 1 12 ALA MB 1 16 ASN HB3 5.260 . 5.260 5.172 4.270 5.333 0.073 30 0 "[ . 1 . 2 . 3 . 4]" 1
431 1 12 ALA MB 1 26 PHE HA 5.500 . 5.500 5.533 5.496 5.597 0.097 32 0 "[ . 1 . 2 . 3 . 4]" 1
432 1 12 ALA MB 1 26 PHE HB2 3.700 . 3.700 3.694 3.664 3.746 0.046 32 0 "[ . 1 . 2 . 3 . 4]" 1
433 1 12 ALA MB 1 26 PHE HB3 4.910 . 4.910 4.726 4.667 4.785 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
434 1 12 ALA MB 1 26 PHE QD 3.140 . 3.140 2.435 2.392 2.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
435 1 12 ALA MB 1 26 PHE QE 3.110 . 3.110 2.163 2.118 2.214 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
436 1 12 ALA MB 1 26 PHE HZ 4.330 . 4.330 3.768 3.670 3.858 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
437 1 12 ALA MB 1 27 ARG H 4.420 . 4.420 4.334 4.148 4.428 0.008 28 0 "[ . 1 . 2 . 3 . 4]" 1
438 1 12 ALA MB 1 27 ARG HA 4.700 . 4.700 4.655 4.258 4.728 0.028 17 0 "[ . 1 . 2 . 3 . 4]" 1
439 1 12 ALA MB 1 28 LYS H 4.270 . 4.270 4.263 4.189 4.335 0.065 32 0 "[ . 1 . 2 . 3 . 4]" 1
440 1 12 ALA MB 1 28 LYS HA 2.980 . 2.980 2.432 2.363 2.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
441 1 12 ALA MB 1 29 GLY H 2.980 . 2.980 2.249 2.089 2.420 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
442 1 12 ALA MB 1 29 GLY HA2 4.300 . 4.300 3.948 3.825 4.140 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
443 1 12 ALA MB 1 30 ASP H 2.860 . 2.860 2.284 2.106 2.371 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
444 1 12 ALA MB 1 30 ASP HA 5.100 . 5.100 4.434 4.325 4.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
445 1 12 ALA MB 1 30 ASP HB2 4.000 . 4.000 2.844 2.690 3.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
446 1 12 ALA MB 1 30 ASP QB 3.330 . 3.330 2.713 2.577 2.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
447 1 12 ALA MB 1 30 ASP HB3 4.000 . 4.000 3.774 2.981 4.061 0.061 40 0 "[ . 1 . 2 . 3 . 4]" 1
448 1 12 ALA MB 1 31 ILE MD 4.830 . 4.830 4.702 4.649 4.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
449 1 12 ALA MB 1 32 MET ME 2.670 . 2.670 2.218 2.130 2.308 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
450 1 12 ALA MB 1 50 LEU QD 5.440 . 5.440 4.326 4.219 4.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
451 1 12 ALA MB 1 57 VAL QG 4.360 . 4.360 4.262 4.149 4.337 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
452 1 12 ALA MB 1 62 LEU HA 4.300 . 4.300 4.219 4.150 4.289 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
453 1 12 ALA MB 1 62 LEU QD 3.110 . 3.110 2.794 2.717 2.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
454 1 12 ALA MB 1 62 LEU HG 5.000 . 5.000 4.611 4.142 5.038 0.038 31 0 "[ . 1 . 2 . 3 . 4]" 1
455 1 13 LEU H 1 13 LEU HB2 3.480 . 3.480 2.452 2.419 2.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
456 1 13 LEU H 1 13 LEU HB3 3.940 . 3.940 3.645 3.622 3.669 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
457 1 13 LEU H 1 13 LEU MD1 3.550 . 3.550 3.124 3.001 3.222 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
458 1 13 LEU H 1 13 LEU QD 3.110 . 3.110 2.224 2.179 2.264 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
459 1 13 LEU H 1 13 LEU MD2 3.550 . 3.550 2.277 2.227 2.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
460 1 13 LEU H 1 13 LEU HG 4.170 . 4.170 4.199 4.185 4.213 0.043 40 0 "[ . 1 . 2 . 3 . 4]" 1
461 1 13 LEU H 1 14 TYR H 3.100 . 3.100 2.186 2.131 2.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
462 1 13 LEU H 1 26 PHE QE 4.720 . 4.720 4.413 4.214 4.577 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
463 1 13 LEU H 1 62 LEU H 4.920 . 4.920 4.736 4.650 4.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
464 1 13 LEU H 1 62 LEU HA 3.780 . 3.780 2.983 2.858 3.153 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
465 1 13 LEU H 1 62 LEU QD 3.910 . 3.910 3.586 3.458 3.736 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
466 1 13 LEU H 1 63 LYS H 4.730 . 4.730 4.209 3.988 4.485 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
467 1 13 LEU HA 1 13 LEU MD1 3.510 . 3.510 2.215 2.150 2.276 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
468 1 13 LEU HA 1 13 LEU QD 2.530 . 2.530 2.193 2.132 2.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
469 1 13 LEU HA 1 13 LEU MD2 3.510 . 3.510 3.519 3.481 3.556 0.046 2 0 "[ . 1 . 2 . 3 . 4]" 1
470 1 13 LEU HA 1 13 LEU HG 3.880 . 3.880 3.674 3.630 3.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
471 1 13 LEU HA 1 28 LYS QD 4.570 . 4.570 4.591 4.355 4.652 0.082 32 0 "[ . 1 . 2 . 3 . 4]" 1
472 1 13 LEU HA 1 28 LYS QE 4.430 . 4.430 3.542 2.991 4.011 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
473 1 13 LEU HA 1 28 LYS HG2 4.690 . 4.690 4.467 4.341 4.600 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
474 1 13 LEU HA 1 28 LYS HG3 4.390 . 4.390 3.082 2.946 3.221 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
475 1 13 LEU HA 1 29 GLY H 4.830 . 4.830 3.962 3.813 4.149 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
476 1 13 LEU HB2 1 14 TYR H 3.850 . 3.850 3.049 2.951 3.120 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
477 1 13 LEU HB2 1 14 TYR QD 4.220 . 4.220 2.356 2.230 2.504 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
478 1 13 LEU HB2 1 14 TYR QE 4.000 . 4.000 2.873 2.736 3.023 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
479 1 13 LEU HB2 1 61 ARG HA 4.660 . 4.660 3.243 3.061 3.399 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
480 1 13 LEU HB3 1 13 LEU MD1 3.410 . 3.410 2.696 2.659 2.737 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
481 1 13 LEU HB3 1 13 LEU MD2 3.410 . 3.410 3.074 3.044 3.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
482 1 13 LEU HB3 1 14 TYR H 4.310 . 4.310 3.965 3.862 4.019 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
483 1 13 LEU HB3 1 14 TYR HA 5.430 . 5.430 4.763 4.712 4.831 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
484 1 13 LEU HB3 1 14 TYR QD 4.490 . 4.490 3.505 3.307 3.674 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
485 1 13 LEU HB3 1 14 TYR QE 3.940 . 3.940 3.235 3.147 3.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
486 1 13 LEU HB3 1 61 ARG HA 5.500 . 5.500 4.847 4.626 5.023 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
487 1 13 LEU QD 1 14 TYR H 3.960 . 3.960 3.716 3.668 3.755 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
488 1 13 LEU QD 1 14 TYR QD 3.930 . 3.930 3.392 3.269 3.516 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
489 1 13 LEU QD 1 14 TYR QE 3.820 . 3.820 3.371 3.114 3.606 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
490 1 13 LEU QD 1 29 GLY H 4.840 . 4.840 4.637 4.456 4.817 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
491 1 13 LEU QD 1 61 ARG H 5.220 . 5.220 4.550 4.424 4.703 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
492 1 13 LEU QD 1 61 ARG HA 3.740 . 3.740 2.972 2.851 3.152 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
493 1 13 LEU QD 1 62 LEU H 4.010 . 4.010 3.213 3.081 3.336 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
494 1 13 LEU QD 1 62 LEU HA 3.950 . 3.950 2.456 2.414 2.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
495 1 13 LEU QD 1 62 LEU QD 3.750 . 3.750 3.518 3.442 3.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
496 1 13 LEU QD 1 63 LYS H 3.570 . 3.570 2.676 2.530 2.806 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
497 1 13 LEU QD 1 63 LYS HA 3.940 . 3.940 3.230 3.144 3.331 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
498 1 13 LEU QD 1 63 LYS QB 2.380 . 2.380 1.862 1.825 1.903 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
499 1 13 LEU QD 1 63 LYS QD 3.150 . 3.150 2.696 2.418 3.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
500 1 13 LEU QD 1 63 LYS QE 3.350 . 3.350 2.229 1.972 2.744 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
501 1 13 LEU QD 1 63 LYS QG 3.500 . 3.500 3.420 3.353 3.565 0.065 19 0 "[ . 1 . 2 . 3 . 4]" 1
502 1 13 LEU QD 1 64 ILE H 5.010 . 5.010 4.812 4.728 4.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
503 1 13 LEU MD1 1 14 TYR H 4.530 . 4.530 4.507 4.441 4.541 0.011 27 0 "[ . 1 . 2 . 3 . 4]" 1
504 1 13 LEU MD1 1 14 TYR QD 5.090 . 5.090 4.998 4.934 5.068 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
505 1 13 LEU MD1 1 14 TYR QE 4.800 . 4.800 4.885 4.830 4.944 0.144 5 0 "[ . 1 . 2 . 3 . 4]" 1
506 1 13 LEU MD1 1 63 LYS H 4.450 . 4.450 3.716 3.502 3.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
507 1 13 LEU MD1 1 63 LYS HA 4.920 . 4.920 4.468 4.344 4.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
508 1 13 LEU MD1 1 63 LYS HB2 3.120 . 3.120 2.407 2.278 2.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
509 1 13 LEU MD1 1 63 LYS HB3 3.120 . 3.120 2.686 2.556 2.874 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
510 1 13 LEU MD1 1 63 LYS HD2 5.120 . 5.120 3.541 2.469 4.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
511 1 13 LEU MD1 1 63 LYS HD3 5.120 . 5.120 3.445 2.583 4.279 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
512 1 13 LEU MD1 1 63 LYS QE 3.940 . 3.940 2.279 2.012 2.790 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
513 1 13 LEU MD1 1 63 LYS HG2 4.670 . 4.670 4.305 4.123 4.632 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
514 1 13 LEU MD1 1 63 LYS HG3 4.670 . 4.670 4.276 4.118 4.667 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
515 1 13 LEU MD2 1 14 TYR H 4.530 . 4.530 3.958 3.895 4.015 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
516 1 13 LEU MD2 1 14 TYR QD 5.090 . 5.090 3.451 3.316 3.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
517 1 13 LEU MD2 1 14 TYR QE 4.800 . 4.800 3.437 3.150 3.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
518 1 13 LEU MD2 1 63 LYS H 4.450 . 4.450 2.745 2.571 2.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
519 1 13 LEU MD2 1 63 LYS HA 4.920 . 4.920 3.314 3.224 3.419 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
520 1 13 LEU MD2 1 63 LYS HB2 3.120 . 3.120 2.019 1.956 2.064 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
521 1 13 LEU MD2 1 63 LYS HB3 3.120 . 3.120 3.034 2.939 3.138 0.018 37 0 "[ . 1 . 2 . 3 . 4]" 1
522 1 13 LEU MD2 1 63 LYS HD2 5.120 . 5.120 4.656 3.953 5.139 0.019 19 0 "[ . 1 . 2 . 3 . 4]" 1
523 1 13 LEU MD2 1 63 LYS HD3 5.120 . 5.120 4.378 3.577 5.174 0.054 11 0 "[ . 1 . 2 . 3 . 4]" 1
524 1 13 LEU MD2 1 63 LYS QE 3.940 . 3.940 3.353 2.455 4.073 0.133 16 0 "[ . 1 . 2 . 3 . 4]" 1
525 1 13 LEU MD2 1 63 LYS HG2 4.670 . 4.670 4.656 4.595 4.686 0.016 30 0 "[ . 1 . 2 . 3 . 4]" 1
526 1 13 LEU MD2 1 63 LYS HG3 4.670 . 4.670 4.124 3.995 4.291 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
527 1 13 LEU HG 1 14 TYR H 5.410 . 5.410 5.419 5.365 5.458 0.048 24 0 "[ . 1 . 2 . 3 . 4]" 1
528 1 13 LEU HG 1 63 LYS QB 4.610 . 4.610 3.681 3.592 3.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
529 1 13 LEU HG 1 63 LYS QD 5.040 . 5.040 4.675 4.236 5.061 0.021 5 0 "[ . 1 . 2 . 3 . 4]" 1
530 1 14 TYR H 1 14 TYR HB2 3.730 . 3.730 2.803 2.773 2.862 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
531 1 14 TYR H 1 14 TYR HB3 4.170 . 4.170 3.870 3.849 3.897 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
532 1 14 TYR H 1 14 TYR QD 3.810 . 3.810 3.119 2.964 3.255 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
533 1 14 TYR H 1 15 ASP H 4.410 . 4.410 4.383 4.345 4.417 0.007 36 0 "[ . 1 . 2 . 3 . 4]" 1
534 1 14 TYR H 1 28 LYS HA 4.120 . 4.120 3.465 3.297 3.590 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
535 1 14 TYR H 1 28 LYS QB 4.440 . 4.440 4.146 4.009 4.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
536 1 14 TYR H 1 28 LYS QD 4.890 . 4.890 4.722 4.455 4.903 0.013 14 0 "[ . 1 . 2 . 3 . 4]" 1
537 1 14 TYR H 1 28 LYS HG2 5.500 . 5.500 5.512 5.499 5.525 0.025 32 0 "[ . 1 . 2 . 3 . 4]" 1
538 1 14 TYR H 1 28 LYS HG3 4.790 . 4.790 3.834 3.768 3.922 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
539 1 14 TYR H 1 61 ARG HB2 4.830 . 4.830 4.755 4.633 4.841 0.011 34 0 "[ . 1 . 2 . 3 . 4]" 1
540 1 14 TYR H 1 61 ARG QB 4.200 . 4.200 3.149 3.040 3.274 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
541 1 14 TYR H 1 61 ARG HB3 4.830 . 4.830 3.196 3.083 3.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
542 1 14 TYR H 1 62 LEU HA 5.140 . 5.140 4.846 4.704 5.027 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
543 1 14 TYR H 1 62 LEU QD 5.280 . 5.280 4.772 4.595 4.953 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
544 1 14 TYR HA 1 15 ASP H 3.100 . 3.100 2.416 2.284 2.545 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
545 1 14 TYR HA 1 28 LYS HA 4.680 . 4.680 3.698 3.581 3.813 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
546 1 14 TYR HA 1 28 LYS HB2 4.510 . 4.510 2.464 2.287 2.704 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
547 1 14 TYR HA 1 28 LYS QB 3.910 . 3.910 2.446 2.274 2.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
548 1 14 TYR HA 1 28 LYS HB3 4.510 . 4.510 4.153 4.021 4.345 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
549 1 14 TYR HA 1 28 LYS QD 3.700 . 3.700 2.499 2.036 2.962 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
550 1 14 TYR HA 1 28 LYS HG2 5.110 . 5.110 4.542 4.301 4.758 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
551 1 14 TYR HB2 1 15 ASP H 3.910 . 3.910 3.579 3.431 3.797 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
552 1 14 TYR HB2 1 61 ARG HD2 4.840 . 4.840 4.067 3.868 4.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
553 1 14 TYR HB2 1 61 ARG HD3 4.560 . 4.560 2.427 2.226 2.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
554 1 14 TYR HB2 1 88 ALA MB 3.900 . 3.900 2.853 2.709 3.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
555 1 14 TYR HB2 1 89 PRO QG 5.350 . 5.350 4.912 4.560 5.303 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
556 1 14 TYR HB3 1 15 ASP H 3.290 . 3.290 2.542 2.395 2.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
557 1 14 TYR HB3 1 61 ARG HD3 4.610 . 4.610 3.420 3.180 3.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
558 1 14 TYR HB3 1 88 ALA MB 3.680 . 3.680 2.139 2.021 2.237 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
559 1 14 TYR QD 1 15 ASP H 4.360 . 4.360 4.000 3.727 4.311 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
560 1 14 TYR QD 1 61 ARG HB2 4.770 . 4.770 4.172 3.910 4.406 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
561 1 14 TYR QD 1 61 ARG QB 4.090 . 4.090 2.683 2.422 2.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
562 1 14 TYR QD 1 61 ARG HB3 4.770 . 4.770 2.716 2.443 2.967 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
563 1 14 TYR QD 1 61 ARG HD2 5.500 . 5.500 5.060 4.689 5.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
564 1 14 TYR QD 1 61 ARG HD3 4.980 . 4.980 3.911 3.511 4.204 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
565 1 14 TYR QD 1 61 ARG HG2 4.470 . 4.470 2.784 2.495 2.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
566 1 14 TYR QD 1 61 ARG HG3 5.130 . 5.130 4.250 3.994 4.441 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
567 1 14 TYR QD 1 88 ALA H 4.700 . 4.700 4.118 3.824 4.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
568 1 14 TYR QD 1 88 ALA HA 5.220 . 5.220 2.866 2.690 3.117 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
569 1 14 TYR QD 1 88 ALA MB 3.750 . 3.750 2.776 2.654 2.898 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
570 1 14 TYR QD 1 89 PRO QD 5.350 . 5.350 2.919 2.785 3.073 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
571 1 14 TYR QE 1 61 ARG HA 3.630 . 3.630 3.299 2.729 3.646 0.016 5 0 "[ . 1 . 2 . 3 . 4]" 1
572 1 14 TYR QE 1 61 ARG HG2 4.810 . 4.810 4.261 3.781 4.584 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
573 1 14 TYR QE 1 86 GLU HA 5.500 . 5.500 4.602 3.636 5.290 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
574 1 14 TYR QE 1 86 GLU QB 4.700 . 4.700 3.485 2.168 4.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
575 1 14 TYR QE 1 86 GLU QG 5.090 . 5.090 2.959 1.961 5.056 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
576 1 14 TYR QE 1 87 LEU H 5.500 . 5.500 4.796 3.950 5.491 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
577 1 14 TYR QE 1 88 ALA H 5.440 . 5.440 4.953 4.590 5.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
578 1 14 TYR QE 1 88 ALA HA 4.050 . 4.050 3.141 3.038 3.286 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
579 1 14 TYR QE 1 88 ALA MB 3.980 . 3.980 4.062 3.997 4.154 0.174 28 0 "[ . 1 . 2 . 3 . 4]" 1
580 1 14 TYR QE 1 89 PRO HD2 4.570 . 4.570 3.379 3.179 3.574 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
581 1 14 TYR QE 1 89 PRO HD3 4.570 . 4.570 3.084 2.906 3.207 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
582 1 14 TYR QE 1 89 PRO HG2 5.180 . 5.180 4.316 4.024 4.575 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
583 1 14 TYR QE 1 89 PRO QG 4.310 . 4.310 3.206 2.924 3.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
584 1 14 TYR QE 1 89 PRO HG3 5.180 . 5.180 3.306 2.993 3.620 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
585 1 15 ASP H 1 15 ASP HB2 3.620 . 3.620 2.883 2.255 3.631 0.011 8 0 "[ . 1 . 2 . 3 . 4]" 1
586 1 15 ASP H 1 15 ASP QB 2.990 . 2.990 2.470 2.148 2.917 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
587 1 15 ASP H 1 15 ASP HB3 3.620 . 3.620 3.181 2.574 3.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
588 1 15 ASP H 1 27 ARG HA 4.950 . 4.950 4.847 4.440 4.986 0.036 40 0 "[ . 1 . 2 . 3 . 4]" 1
589 1 15 ASP H 1 28 LYS H 4.090 . 4.090 3.801 3.605 3.949 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
590 1 15 ASP H 1 28 LYS HA 4.850 . 4.850 4.327 4.016 4.548 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
591 1 15 ASP H 1 28 LYS HB2 4.580 . 4.580 2.882 2.462 3.107 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
592 1 15 ASP H 1 28 LYS QB 3.710 . 3.710 2.845 2.443 3.059 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
593 1 15 ASP H 1 28 LYS HB3 4.580 . 4.580 4.397 4.063 4.580 0.000 21 0 "[ . 1 . 2 . 3 . 4]" 1
594 1 15 ASP H 1 28 LYS QD 4.540 . 4.540 3.910 3.142 4.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
595 1 15 ASP H 1 28 LYS HG3 5.300 . 5.300 4.902 4.442 5.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
596 1 15 ASP H 1 88 ALA MB 4.590 . 4.590 3.779 3.482 4.027 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
597 1 15 ASP HA 1 16 ASN H 2.860 . 2.860 2.396 2.297 2.550 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
598 1 15 ASP HA 1 27 ARG H 5.370 . 5.370 4.643 4.298 4.845 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
599 1 15 ASP HA 1 27 ARG QD 4.840 . 4.840 4.261 3.609 4.930 0.090 11 0 "[ . 1 . 2 . 3 . 4]" 1
600 1 15 ASP HA 1 28 LYS H 3.320 . 3.320 2.795 2.537 3.013 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
601 1 15 ASP HA 1 28 LYS HA 4.560 . 4.560 3.684 3.410 3.981 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
602 1 15 ASP HA 1 28 LYS HB2 4.890 . 4.890 3.766 3.447 4.026 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
603 1 15 ASP HA 1 28 LYS HB3 4.890 . 4.890 4.746 4.555 4.894 0.004 13 0 "[ . 1 . 2 . 3 . 4]" 1
604 1 15 ASP QB 1 16 ASN H 3.160 . 3.160 2.571 2.256 3.296 0.136 39 0 "[ . 1 . 2 . 3 . 4]" 1
605 1 15 ASP QB 1 17 VAL QG 4.210 . 4.210 3.853 3.428 4.211 0.001 3 0 "[ . 1 . 2 . 3 . 4]" 1
606 1 15 ASP QB 1 27 ARG HA 4.220 . 4.220 2.845 1.919 3.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
607 1 15 ASP QB 1 28 LYS H 4.120 . 4.120 3.107 1.959 3.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
608 1 15 ASP HB2 1 16 ASN H 3.990 . 3.990 3.262 2.275 4.009 0.019 25 0 "[ . 1 . 2 . 3 . 4]" 1
609 1 15 ASP HB2 1 28 LYS H 4.840 . 4.840 4.043 3.242 4.660 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
610 1 15 ASP HB3 1 16 ASN H 3.990 . 3.990 3.174 2.524 3.843 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
611 1 15 ASP HB3 1 28 LYS H 4.840 . 4.840 3.357 1.974 4.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
612 1 16 ASN H 1 16 ASN HB2 3.680 . 3.680 3.207 3.109 3.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
613 1 16 ASN H 1 16 ASN HB3 3.680 . 3.680 2.953 2.543 3.116 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
614 1 16 ASN H 1 16 ASN HD22 5.040 . 5.040 5.016 4.596 5.062 0.022 39 0 "[ . 1 . 2 . 3 . 4]" 1
615 1 16 ASN H 1 17 VAL H 4.640 . 4.640 4.255 3.737 4.344 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
616 1 16 ASN H 1 17 VAL QG 4.090 . 4.090 4.134 3.875 4.340 0.250 25 0 "[ . 1 . 2 . 3 . 4]" 1
617 1 16 ASN H 1 26 PHE QD 4.340 . 4.340 3.507 3.338 3.922 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
618 1 16 ASN H 1 26 PHE QE 4.780 . 4.780 4.242 4.119 4.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
619 1 16 ASN H 1 27 ARG HA 3.580 . 3.580 3.450 2.550 3.606 0.026 29 0 "[ . 1 . 2 . 3 . 4]" 1
620 1 16 ASN H 1 27 ARG QD 5.500 . 5.500 5.096 4.511 5.712 0.212 5 0 "[ . 1 . 2 . 3 . 4]" 1
621 1 16 ASN HA 1 16 ASN HD22 4.980 . 4.980 4.092 2.018 4.272 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
622 1 16 ASN HA 1 17 VAL H 2.870 . 2.870 2.152 2.110 2.193 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
623 1 16 ASN HA 1 17 VAL QG 3.750 . 3.750 3.603 3.346 3.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
624 1 16 ASN QB 1 17 VAL H 4.080 . 4.080 3.647 3.560 3.927 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
625 1 16 ASN QB 1 25 SER HA 4.250 . 4.250 3.047 2.854 4.085 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
626 1 16 ASN QB 1 26 PHE H 3.320 . 3.320 2.600 2.179 2.761 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
627 1 16 ASN QB 1 26 PHE QD 4.660 . 4.660 3.303 2.947 3.429 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
628 1 16 ASN QB 1 26 PHE HZ 3.890 . 3.890 3.003 2.755 3.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
629 1 16 ASN QB 1 57 VAL QG 4.300 . 4.300 3.594 3.405 3.833 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
630 1 16 ASN HB2 1 17 VAL H 4.690 . 4.690 4.239 3.805 4.545 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
631 1 16 ASN HB2 1 26 PHE H 4.080 . 4.080 4.087 3.920 4.152 0.072 40 0 "[ . 1 . 2 . 3 . 4]" 1
632 1 16 ASN HB2 1 26 PHE QE 4.350 . 4.350 2.927 2.749 3.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
633 1 16 ASN HB2 1 26 PHE HZ 4.520 . 4.520 3.149 2.835 3.598 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
634 1 16 ASN HB3 1 17 VAL H 4.690 . 4.690 3.990 3.857 4.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
635 1 16 ASN HB3 1 26 PHE H 4.080 . 4.080 2.630 2.190 2.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
636 1 16 ASN HB3 1 26 PHE QE 4.350 . 4.350 3.418 2.889 3.593 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
637 1 16 ASN HB3 1 26 PHE HZ 4.520 . 4.520 3.814 3.630 4.028 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
638 1 16 ASN HD21 1 18 ALA HA 4.880 . 4.880 3.449 3.292 3.558 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
639 1 16 ASN HD21 1 18 ALA MB 4.300 . 4.300 4.303 3.782 4.358 0.058 5 0 "[ . 1 . 2 . 3 . 4]" 1
640 1 16 ASN HD21 1 23 GLU HG2 4.940 . 4.940 2.674 2.459 2.848 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
641 1 16 ASN HD21 1 23 GLU QG 4.170 . 4.170 2.574 2.423 2.744 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
642 1 16 ASN HD21 1 23 GLU HG3 4.940 . 4.940 3.367 3.140 3.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
643 1 16 ASN HD21 1 25 SER HA 4.990 . 4.990 4.452 3.316 4.660 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
644 1 16 ASN HD21 1 57 VAL QG 4.510 . 4.510 4.019 3.810 4.175 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
645 1 16 ASN HD21 1 58 PRO HD2 4.720 . 4.720 3.281 3.060 3.773 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
646 1 16 ASN HD21 1 58 PRO HD3 4.690 . 4.690 2.867 2.687 3.641 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
647 1 16 ASN HD22 1 18 ALA HA 5.030 . 5.030 3.874 3.673 4.548 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
648 1 16 ASN HD22 1 18 ALA MB 5.200 . 5.200 4.006 3.804 5.253 0.053 27 0 "[ . 1 . 2 . 3 . 4]" 1
649 1 16 ASN HD22 1 23 GLU QG 4.390 . 4.390 2.968 2.751 4.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
650 1 16 ASN HD22 1 25 SER HA 4.370 . 4.370 3.136 2.912 4.377 0.007 36 0 "[ . 1 . 2 . 3 . 4]" 1
651 1 16 ASN HD22 1 26 PHE H 4.840 . 4.840 4.033 3.651 4.864 0.024 27 0 "[ . 1 . 2 . 3 . 4]" 1
652 1 16 ASN HD22 1 26 PHE QE 4.720 . 4.720 3.732 3.375 4.889 0.169 27 0 "[ . 1 . 2 . 3 . 4]" 1
653 1 16 ASN HD22 1 57 VAL QG 4.410 . 4.410 3.684 3.528 4.499 0.089 27 0 "[ . 1 . 2 . 3 . 4]" 1
654 1 16 ASN HD22 1 58 PRO HD2 5.090 . 5.090 3.613 3.460 3.965 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
655 1 17 VAL H 1 17 VAL HB 3.100 . 3.100 2.577 2.503 3.118 0.018 25 0 "[ . 1 . 2 . 3 . 4]" 1
656 1 17 VAL H 1 17 VAL QG 3.030 . 3.030 2.631 1.766 2.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
657 1 17 VAL H 1 18 ALA H 4.270 . 4.270 4.288 4.258 4.328 0.058 25 0 "[ . 1 . 2 . 3 . 4]" 1
658 1 17 VAL HA 1 17 VAL QG 2.550 . 2.550 2.165 2.149 2.524 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
659 1 17 VAL HA 1 18 ALA H 2.650 . 2.650 2.129 2.092 2.146 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
660 1 17 VAL HA 1 18 ALA HA 4.880 . 4.880 4.370 4.342 4.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
661 1 17 VAL HA 1 18 ALA MB 4.160 . 4.160 3.944 3.873 3.988 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
662 1 17 VAL HA 1 25 SER HA 4.530 . 4.530 3.411 3.102 3.569 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
663 1 17 VAL HB 1 18 ALA H 4.640 . 4.640 4.225 4.059 4.262 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
664 1 17 VAL QG 1 18 ALA H 3.200 . 3.200 2.760 2.652 2.850 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
665 1 17 VAL QG 1 18 ALA HA 4.560 . 4.560 4.125 3.924 4.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
666 1 17 VAL QG 1 18 ALA MB 4.020 . 4.020 3.760 3.663 3.824 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
667 1 17 VAL QG 1 19 GLU H 4.830 . 4.830 4.444 4.138 4.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
668 1 17 VAL QG 1 19 GLU HA 4.130 . 4.130 3.928 3.659 4.137 0.007 35 0 "[ . 1 . 2 . 3 . 4]" 1
669 1 17 VAL QG 1 19 GLU HG2 4.170 . 4.170 3.442 2.843 3.887 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
670 1 17 VAL QG 1 19 GLU HG3 4.170 . 4.170 3.310 2.627 3.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
671 1 17 VAL QG 1 25 SER HA 4.980 . 4.980 4.517 4.268 4.878 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
672 1 17 VAL QG 1 25 SER HB2 5.010 . 5.010 4.121 3.654 5.052 0.042 25 0 "[ . 1 . 2 . 3 . 4]" 1
673 1 17 VAL QG 1 25 SER QB 4.250 . 4.250 3.516 3.295 3.941 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
674 1 17 VAL QG 1 25 SER HB3 5.010 . 5.010 3.900 3.505 4.989 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
675 1 17 VAL QG 1 26 PHE H 5.500 . 5.500 4.780 4.520 5.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
676 1 18 ALA H 1 18 ALA MB 2.650 . 2.650 2.211 2.169 2.235 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
677 1 18 ALA H 1 19 GLU H 4.530 . 4.530 4.477 4.360 4.537 0.007 25 0 "[ . 1 . 2 . 3 . 4]" 1
678 1 18 ALA H 1 25 SER H 5.140 . 5.140 4.719 4.518 5.147 0.007 27 0 "[ . 1 . 2 . 3 . 4]" 1
679 1 18 ALA H 1 25 SER HA 3.710 . 3.710 3.207 2.993 3.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
680 1 18 ALA H 1 25 SER HB2 4.420 . 4.420 3.238 1.998 4.021 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
681 1 18 ALA H 1 25 SER QB 3.780 . 3.780 2.020 1.751 3.171 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
682 1 18 ALA H 1 25 SER HB3 4.420 . 4.420 2.250 1.756 3.994 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
683 1 18 ALA HA 1 19 GLU H 3.120 . 3.120 2.140 2.120 2.153 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
684 1 18 ALA HA 1 19 GLU HA 4.880 . 4.880 4.443 4.433 4.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
685 1 18 ALA HA 1 19 GLU HB2 4.620 . 4.620 4.492 4.413 4.529 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
686 1 18 ALA HA 1 19 GLU QG 4.960 . 4.960 3.815 3.638 3.936 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
687 1 18 ALA HA 1 20 SER H 3.850 . 3.850 3.462 3.278 3.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
688 1 18 ALA HA 1 23 GLU HB2 4.620 . 4.620 4.038 3.840 4.278 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
689 1 18 ALA HA 1 23 GLU HB3 4.210 . 4.210 2.680 2.458 2.965 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
690 1 18 ALA HA 1 23 GLU HG2 4.730 . 4.730 2.745 2.533 2.894 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
691 1 18 ALA HA 1 23 GLU QG 3.870 . 3.870 2.706 2.506 2.846 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
692 1 18 ALA HA 1 23 GLU HG3 4.730 . 4.730 4.100 3.976 4.206 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
693 1 18 ALA MB 1 19 GLU H 3.470 . 3.470 3.232 3.046 3.390 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
694 1 18 ALA MB 1 19 GLU HA 4.590 . 4.590 4.265 4.152 4.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
695 1 18 ALA MB 1 19 GLU HB2 5.280 . 5.280 5.224 5.118 5.301 0.021 30 0 "[ . 1 . 2 . 3 . 4]" 1
696 1 18 ALA MB 1 20 SER H 3.980 . 3.980 3.467 3.234 3.726 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
697 1 18 ALA MB 1 20 SER HA 5.500 . 5.500 5.340 5.190 5.491 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
698 1 18 ALA MB 1 21 PRO HA 5.040 . 5.040 4.477 4.189 4.758 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
699 1 18 ALA MB 1 23 GLU H 3.830 . 3.830 3.511 3.339 3.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
700 1 18 ALA MB 1 23 GLU HA 4.390 . 4.390 4.211 4.125 4.287 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
701 1 18 ALA MB 1 23 GLU HB2 4.400 . 4.400 3.789 3.728 3.884 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
702 1 18 ALA MB 1 23 GLU HB3 3.250 . 3.250 2.218 2.153 2.317 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
703 1 18 ALA MB 1 23 GLU HG2 4.290 . 4.290 2.961 2.794 3.110 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
704 1 18 ALA MB 1 23 GLU QG 3.460 . 3.460 2.909 2.755 3.046 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
705 1 18 ALA MB 1 23 GLU HG3 4.290 . 4.290 4.271 4.169 4.355 0.065 40 0 "[ . 1 . 2 . 3 . 4]" 1
706 1 18 ALA MB 1 24 LEU H 4.150 . 4.150 3.830 3.696 3.968 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
707 1 18 ALA MB 1 24 LEU HA 3.830 . 3.830 3.188 3.021 3.391 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
708 1 18 ALA MB 1 24 LEU MD2 4.640 . 4.640 4.436 4.277 4.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
709 1 18 ALA MB 1 25 SER H 3.650 . 3.650 3.147 2.950 3.656 0.006 27 0 "[ . 1 . 2 . 3 . 4]" 1
710 1 18 ALA MB 1 25 SER HA 4.010 . 4.010 3.173 2.916 3.278 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
711 1 18 ALA MB 1 25 SER HB2 3.860 . 3.860 3.615 2.198 3.894 0.034 39 0 "[ . 1 . 2 . 3 . 4]" 1
712 1 18 ALA MB 1 25 SER HB3 3.860 . 3.860 2.669 2.208 3.956 0.096 29 0 "[ . 1 . 2 . 3 . 4]" 1
713 1 18 ALA MB 1 26 PHE H 4.990 . 4.990 5.043 4.795 5.165 0.175 27 0 "[ . 1 . 2 . 3 . 4]" 1
714 1 19 GLU H 1 19 GLU HB2 3.710 . 3.710 2.451 2.371 2.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
715 1 19 GLU H 1 19 GLU HB3 4.020 . 4.020 3.683 3.640 3.757 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
716 1 19 GLU H 1 19 GLU HG2 4.030 . 4.030 3.931 3.823 4.052 0.022 35 0 "[ . 1 . 2 . 3 . 4]" 1
717 1 19 GLU H 1 19 GLU HG3 4.030 . 4.030 2.790 2.640 2.894 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
718 1 19 GLU H 1 20 SER H 2.860 . 2.860 1.915 1.808 2.004 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
719 1 19 GLU H 1 23 GLU H 5.500 . 5.500 5.128 4.904 5.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
720 1 19 GLU H 1 23 GLU HB2 4.570 . 4.570 3.826 3.653 3.979 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
721 1 19 GLU H 1 23 GLU HB3 4.080 . 4.080 3.008 2.832 3.154 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
722 1 19 GLU H 1 23 GLU QG 4.660 . 4.660 3.836 3.637 3.929 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
723 1 19 GLU HA 1 19 GLU HG2 3.600 . 3.600 2.515 2.449 2.597 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
724 1 19 GLU HA 1 19 GLU QG 3.130 . 3.130 2.394 2.348 2.449 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
725 1 19 GLU HA 1 19 GLU HG3 3.600 . 3.600 3.010 2.866 3.089 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
726 1 19 GLU HA 1 20 SER H 3.510 . 3.510 3.456 3.398 3.535 0.025 35 0 "[ . 1 . 2 . 3 . 4]" 1
727 1 19 GLU HB2 1 20 SER H 3.710 . 3.710 2.963 2.694 3.097 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
728 1 19 GLU HB3 1 20 SER H 3.990 . 3.990 3.923 3.692 4.009 0.019 27 0 "[ . 1 . 2 . 3 . 4]" 1
729 1 19 GLU HG2 1 20 SER H 5.060 . 5.060 5.078 5.057 5.100 0.040 17 0 "[ . 1 . 2 . 3 . 4]" 1
730 1 19 GLU HG3 1 20 SER H 5.060 . 5.060 4.375 4.310 4.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
731 1 20 SER H 1 20 SER HB2 3.930 . 3.930 2.786 2.448 3.207 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
732 1 20 SER H 1 20 SER QB 3.270 . 3.270 2.400 2.213 2.774 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
733 1 20 SER H 1 20 SER HB3 3.930 . 3.930 3.021 2.280 3.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
734 1 20 SER H 1 21 PRO HD2 5.310 . 5.310 4.960 4.934 4.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
735 1 20 SER H 1 21 PRO QD 4.530 . 4.530 4.512 4.497 4.534 0.004 39 0 "[ . 1 . 2 . 3 . 4]" 1
736 1 20 SER H 1 21 PRO HD3 5.310 . 5.310 5.187 5.132 5.249 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
737 1 20 SER H 1 22 ASP H 4.750 . 4.750 4.738 4.576 4.778 0.028 30 0 "[ . 1 . 2 . 3 . 4]" 1
738 1 20 SER H 1 23 GLU H 3.860 . 3.860 3.871 3.822 3.889 0.029 39 0 "[ . 1 . 2 . 3 . 4]" 1
739 1 20 SER H 1 23 GLU HA 5.450 . 5.450 5.272 5.219 5.314 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
740 1 20 SER H 1 23 GLU HB2 3.630 . 3.630 2.981 2.880 3.077 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
741 1 20 SER H 1 23 GLU HB3 3.380 . 3.380 2.615 2.482 2.753 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
742 1 20 SER H 1 23 GLU QG 4.190 . 4.190 4.167 4.074 4.215 0.025 6 0 "[ . 1 . 2 . 3 . 4]" 1
743 1 20 SER HA 1 21 PRO HB3 4.910 . 4.910 4.853 4.793 4.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
744 1 20 SER HA 1 21 PRO HD2 3.520 . 3.520 2.423 2.340 2.509 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
745 1 20 SER HA 1 21 PRO QD 3.040 . 3.040 2.193 2.168 2.218 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
746 1 20 SER HA 1 21 PRO HD3 3.520 . 3.520 2.513 2.460 2.578 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
747 1 20 SER HA 1 21 PRO HG2 4.760 . 4.760 4.532 4.468 4.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
748 1 20 SER HA 1 21 PRO HG3 4.560 . 4.560 4.595 4.578 4.610 0.050 24 0 "[ . 1 . 2 . 3 . 4]" 1
749 1 20 SER QB 1 22 ASP H 3.520 . 3.520 2.836 2.323 3.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
750 1 20 SER QB 1 23 GLU H 3.770 . 3.770 2.929 2.542 3.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
751 1 20 SER QB 1 23 GLU HB2 4.250 . 4.250 2.095 1.955 2.328 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
752 1 20 SER QB 1 56 ILE MD 4.220 . 4.220 3.117 2.925 3.328 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
753 1 20 SER QB 1 94 LEU QD 3.510 . 3.510 2.456 2.060 2.967 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
754 1 20 SER HB2 1 22 ASP H 4.250 . 4.250 3.550 2.398 4.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
755 1 20 SER HB2 1 56 ILE MD 4.830 . 4.830 3.594 3.236 4.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
756 1 20 SER HB2 1 94 LEU MD1 5.290 . 5.290 2.708 2.125 3.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
757 1 20 SER HB2 1 94 LEU MD2 5.290 . 5.290 4.721 4.245 5.125 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
758 1 20 SER HB3 1 22 ASP H 4.250 . 4.250 3.029 2.528 3.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
759 1 20 SER HB3 1 56 ILE MD 4.830 . 4.830 3.586 3.075 4.119 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
760 1 20 SER HB3 1 94 LEU MD1 5.290 . 5.290 3.004 2.599 3.371 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
761 1 20 SER HB3 1 94 LEU MD2 5.290 . 5.290 4.853 4.534 5.191 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
762 1 21 PRO HA 1 22 ASP H 3.540 . 3.540 3.457 3.393 3.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
763 1 21 PRO HA 1 23 GLU H 4.060 . 4.060 3.698 3.552 3.900 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
764 1 21 PRO HB2 1 22 ASP H 3.890 . 3.890 3.799 3.732 3.891 0.001 10 0 "[ . 1 . 2 . 3 . 4]" 1
765 1 21 PRO HB3 1 22 ASP H 4.580 . 4.580 4.394 4.343 4.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
766 1 21 PRO QD 1 23 GLU H 5.350 . 5.350 4.444 4.383 4.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
767 1 21 PRO HD2 1 22 ASP H 4.400 . 4.400 2.863 2.748 2.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
768 1 21 PRO HD3 1 22 ASP H 4.400 . 4.400 3.982 3.902 4.076 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
769 1 21 PRO HG2 1 22 ASP H 3.920 . 3.920 2.806 2.710 2.938 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
770 1 21 PRO HG2 1 22 ASP HA 5.060 . 5.060 4.433 4.319 4.554 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
771 1 21 PRO HG3 1 22 ASP H 4.450 . 4.450 4.262 4.177 4.372 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
772 1 22 ASP H 1 22 ASP HB2 3.110 . 3.110 2.255 2.059 2.459 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
773 1 22 ASP H 1 22 ASP HB3 3.730 . 3.730 3.313 2.793 3.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
774 1 22 ASP H 1 23 GLU H 2.920 . 2.920 2.354 2.158 2.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
775 1 22 ASP H 1 23 GLU HB2 4.530 . 4.530 4.056 3.935 4.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
776 1 22 ASP H 1 23 GLU HB3 4.840 . 4.840 4.540 4.347 4.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
777 1 22 ASP H 1 56 ILE H 5.500 . 5.500 5.529 5.489 5.573 0.073 2 0 "[ . 1 . 2 . 3 . 4]" 1
778 1 22 ASP H 1 56 ILE MD 4.710 . 4.710 4.421 4.202 4.647 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
779 1 22 ASP H 1 56 ILE HG12 5.030 . 5.030 4.697 4.523 4.869 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
780 1 22 ASP HA 1 56 ILE MG 5.400 . 5.400 4.775 4.477 4.947 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
781 1 22 ASP HB2 1 23 GLU H 3.890 . 3.890 3.708 3.409 3.945 0.055 17 0 "[ . 1 . 2 . 3 . 4]" 1
782 1 22 ASP HB2 1 56 ILE H 5.160 . 5.160 4.656 4.178 5.024 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
783 1 22 ASP HB2 1 56 ILE MD 3.810 . 3.810 3.353 2.765 3.834 0.024 33 0 "[ . 1 . 2 . 3 . 4]" 1
784 1 22 ASP HB2 1 56 ILE HG12 4.820 . 4.820 3.766 3.084 4.326 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
785 1 22 ASP HB2 1 56 ILE MG 4.260 . 4.260 4.056 3.635 4.350 0.090 26 0 "[ . 1 . 2 . 3 . 4]" 1
786 1 22 ASP HB3 1 23 GLU H 4.240 . 4.240 3.915 3.290 4.263 0.023 4 0 "[ . 1 . 2 . 3 . 4]" 1
787 1 22 ASP HB3 1 42 LEU MD1 4.870 . 4.870 4.712 4.393 4.976 0.106 2 0 "[ . 1 . 2 . 3 . 4]" 1
788 1 22 ASP HB3 1 56 ILE H 4.480 . 4.480 3.322 3.025 3.641 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
789 1 22 ASP HB3 1 56 ILE MD 3.890 . 3.890 2.984 2.477 3.633 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
790 1 22 ASP HB3 1 56 ILE HG12 4.700 . 4.700 2.825 2.386 3.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
791 1 22 ASP HB3 1 56 ILE MG 3.770 . 3.770 2.854 2.438 3.108 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
792 1 23 GLU H 1 23 GLU HB2 3.200 . 3.200 2.592 2.463 2.761 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
793 1 23 GLU H 1 23 GLU HB3 3.140 . 3.140 2.533 2.453 2.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
794 1 23 GLU H 1 23 GLU HG2 4.730 . 4.730 4.493 4.433 4.526 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
795 1 23 GLU H 1 23 GLU HG3 4.730 . 4.730 4.507 4.428 4.610 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
796 1 23 GLU H 1 24 LEU H 4.600 . 4.600 4.613 4.602 4.625 0.025 33 0 "[ . 1 . 2 . 3 . 4]" 1
797 1 23 GLU H 1 24 LEU MD2 5.500 . 5.500 5.558 5.515 5.598 0.098 17 0 "[ . 1 . 2 . 3 . 4]" 1
798 1 23 GLU H 1 56 ILE H 4.760 . 4.760 4.531 4.458 4.605 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
799 1 23 GLU H 1 56 ILE MD 4.510 . 4.510 4.402 4.073 4.529 0.019 9 0 "[ . 1 . 2 . 3 . 4]" 1
800 1 23 GLU H 1 56 ILE HG12 4.570 . 4.570 3.973 3.758 4.060 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
801 1 23 GLU H 1 56 ILE HG13 5.030 . 5.030 4.830 4.499 4.998 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
802 1 23 GLU H 1 56 ILE MG 5.430 . 5.430 5.429 5.324 5.498 0.068 25 0 "[ . 1 . 2 . 3 . 4]" 1
803 1 23 GLU HA 1 24 LEU H 3.170 . 3.170 2.268 2.222 2.335 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
804 1 23 GLU HA 1 24 LEU HB2 4.890 . 4.890 4.581 4.535 4.622 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
805 1 23 GLU HA 1 24 LEU MD2 4.980 . 4.980 4.735 4.563 4.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
806 1 23 GLU HA 1 24 LEU HG 4.680 . 4.680 4.071 3.918 4.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
807 1 23 GLU HA 1 56 ILE HB 4.910 . 4.910 4.677 4.606 4.755 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
808 1 23 GLU HA 1 56 ILE MD 3.850 . 3.850 3.698 3.604 3.816 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
809 1 23 GLU HA 1 56 ILE HG12 3.870 . 3.870 2.366 2.234 2.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
810 1 23 GLU HA 1 56 ILE HG13 4.070 . 4.070 2.675 2.532 2.790 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
811 1 23 GLU HA 1 57 VAL QG 4.610 . 4.610 4.343 4.230 4.431 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
812 1 23 GLU HB2 1 24 LEU H 4.990 . 4.990 4.071 3.990 4.112 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
813 1 23 GLU HB2 1 45 TRP HH2 5.020 . 5.020 4.434 4.193 4.633 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
814 1 23 GLU HB2 1 56 ILE MD 4.190 . 4.190 3.155 2.973 3.336 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
815 1 23 GLU HB2 1 56 ILE HG12 3.800 . 3.800 3.340 3.128 3.494 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
816 1 23 GLU HB2 1 94 LEU QD 4.690 . 4.690 3.786 3.470 4.131 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
817 1 23 GLU HB3 1 24 LEU H 4.520 . 4.520 3.811 3.712 3.956 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
818 1 23 GLU QG 1 45 TRP HZ3 4.240 . 4.240 2.223 2.130 2.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
819 1 23 GLU QG 1 56 ILE HG12 4.970 . 4.970 3.578 3.433 3.872 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
820 1 23 GLU QG 1 57 VAL HA 4.510 . 4.510 3.041 2.851 3.166 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
821 1 23 GLU HG2 1 24 LEU H 3.820 . 3.820 2.427 2.280 2.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
822 1 23 GLU HG2 1 45 TRP HZ3 5.040 . 5.040 3.686 3.577 3.888 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
823 1 23 GLU HG2 1 57 VAL HA 5.220 . 5.220 3.917 3.684 4.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
824 1 23 GLU HG3 1 24 LEU H 3.820 . 3.820 2.799 2.676 2.894 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
825 1 23 GLU HG3 1 45 TRP HZ3 5.040 . 5.040 2.242 2.143 2.417 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
826 1 23 GLU HG3 1 57 VAL HA 5.220 . 5.220 3.170 2.934 3.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
827 1 24 LEU H 1 24 LEU HB2 3.430 . 3.430 2.420 2.382 2.450 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
828 1 24 LEU H 1 24 LEU HB3 3.800 . 3.800 3.657 3.634 3.679 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
829 1 24 LEU H 1 24 LEU MD1 4.160 . 4.160 3.899 3.809 4.006 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
830 1 24 LEU H 1 24 LEU MD2 4.090 . 4.090 3.791 3.667 3.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
831 1 24 LEU H 1 24 LEU HG 3.550 . 3.550 2.897 2.757 2.999 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
832 1 24 LEU H 1 25 SER H 5.460 . 5.460 4.574 4.545 4.602 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
833 1 24 LEU H 1 45 TRP HZ3 4.990 . 4.990 4.610 4.343 4.784 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
834 1 24 LEU H 1 55 GLY HA3 4.810 . 4.810 3.807 3.596 4.115 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
835 1 24 LEU H 1 56 ILE H 4.000 . 4.000 3.910 3.803 4.010 0.010 30 0 "[ . 1 . 2 . 3 . 4]" 1
836 1 24 LEU H 1 56 ILE HG12 4.590 . 4.590 4.347 4.208 4.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
837 1 24 LEU H 1 56 ILE HG13 4.460 . 4.460 4.063 3.944 4.219 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
838 1 24 LEU H 1 57 VAL HA 4.830 . 4.830 3.605 3.526 3.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
839 1 24 LEU H 1 57 VAL QG 3.580 . 3.580 2.989 2.863 3.118 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
840 1 24 LEU HA 1 24 LEU MD1 3.930 . 3.930 3.845 3.830 3.866 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
841 1 24 LEU HA 1 24 LEU MD2 2.740 . 2.740 2.059 2.035 2.085 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
842 1 24 LEU HA 1 24 LEU HG 4.020 . 4.020 3.061 2.966 3.150 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
843 1 24 LEU HA 1 25 SER H 2.660 . 2.660 2.187 2.140 2.474 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
844 1 24 LEU HA 1 50 LEU QD 5.440 . 5.440 4.637 4.240 5.182 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
845 1 24 LEU HA 1 57 VAL QG 4.650 . 4.650 4.532 4.466 4.666 0.016 40 0 "[ . 1 . 2 . 3 . 4]" 1
846 1 24 LEU HB2 1 24 LEU MD1 2.800 . 2.800 2.342 2.297 2.383 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
847 1 24 LEU HB2 1 24 LEU MD2 3.200 . 3.200 3.220 3.212 3.229 0.029 39 0 "[ . 1 . 2 . 3 . 4]" 1
848 1 24 LEU HB2 1 25 SER H 4.150 . 4.150 3.984 3.549 4.057 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
849 1 24 LEU HB2 1 26 PHE QD 4.490 . 4.490 3.079 2.896 3.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
850 1 24 LEU HB2 1 55 GLY H 5.450 . 5.450 5.390 5.253 5.460 0.010 30 0 "[ . 1 . 2 . 3 . 4]" 1
851 1 24 LEU HB2 1 57 VAL QG 2.750 . 2.750 2.082 2.036 2.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
852 1 24 LEU HB3 1 24 LEU MD1 3.170 . 3.170 2.331 2.283 2.372 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
853 1 24 LEU HB3 1 24 LEU MD2 3.440 . 3.440 2.371 2.347 2.398 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
854 1 24 LEU HB3 1 25 SER H 3.520 . 3.520 2.811 2.238 2.918 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
855 1 24 LEU HB3 1 26 PHE H 5.150 . 5.150 5.148 4.695 5.187 0.037 12 0 "[ . 1 . 2 . 3 . 4]" 1
856 1 24 LEU HB3 1 26 PHE HB3 4.460 . 4.460 4.065 3.899 4.193 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
857 1 24 LEU HB3 1 26 PHE QD 4.490 . 4.490 2.693 2.558 2.951 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
858 1 24 LEU HB3 1 50 LEU QD 3.860 . 3.860 3.031 2.607 3.628 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
859 1 24 LEU HB3 1 57 VAL QG 3.580 . 3.580 3.428 3.358 3.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
860 1 24 LEU MD1 1 25 SER H 4.620 . 4.620 4.605 4.112 4.672 0.052 10 0 "[ . 1 . 2 . 3 . 4]" 1
861 1 24 LEU MD1 1 26 PHE QD 4.150 . 4.150 3.554 3.302 3.727 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
862 1 24 LEU MD1 1 26 PHE QE 4.660 . 4.660 3.976 3.737 4.130 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
863 1 24 LEU MD1 1 32 MET HB2 3.800 . 3.800 3.482 3.356 3.673 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
864 1 24 LEU MD1 1 32 MET HB3 4.280 . 4.280 3.773 3.597 4.111 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
865 1 24 LEU MD1 1 32 MET HG2 5.500 . 5.500 5.260 5.035 5.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
866 1 24 LEU MD1 1 32 MET HG3 4.620 . 4.620 4.297 4.103 4.461 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
867 1 24 LEU MD1 1 33 THR H 5.500 . 5.500 4.984 4.906 5.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
868 1 24 LEU MD1 1 48 CYS H 3.800 . 3.800 3.311 3.226 3.419 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
869 1 24 LEU MD1 1 48 CYS HA 4.520 . 4.520 4.295 4.232 4.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
870 1 24 LEU MD1 1 48 CYS HB2 3.410 . 3.410 2.263 2.171 2.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
871 1 24 LEU MD1 1 48 CYS HB3 4.000 . 4.000 3.514 3.418 3.672 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
872 1 24 LEU MD1 1 49 SER H 4.160 . 4.160 3.763 3.687 3.875 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
873 1 24 LEU MD1 1 49 SER HA 3.680 . 3.680 2.652 2.545 2.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
874 1 24 LEU MD1 1 49 SER HB2 5.190 . 5.190 4.626 4.506 4.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
875 1 24 LEU MD1 1 49 SER HB3 5.070 . 5.070 4.838 4.751 4.966 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
876 1 24 LEU MD1 1 50 LEU H 3.400 . 3.400 2.772 2.624 2.930 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
877 1 24 LEU MD1 1 50 LEU HA 4.190 . 4.190 4.196 4.146 4.234 0.044 14 0 "[ . 1 . 2 . 3 . 4]" 1
878 1 24 LEU MD1 1 50 LEU HB2 2.910 . 2.910 2.494 2.392 2.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
879 1 24 LEU MD1 1 50 LEU HB3 3.070 . 3.070 2.214 2.105 2.347 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
880 1 24 LEU MD1 1 53 ARG H 4.950 . 4.950 4.784 4.638 4.958 0.008 27 0 "[ . 1 . 2 . 3 . 4]" 1
881 1 24 LEU MD1 1 54 GLN H 5.280 . 5.280 5.006 4.845 5.261 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
882 1 24 LEU MD1 1 54 GLN HA 3.550 . 3.550 3.067 2.934 3.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
883 1 24 LEU MD1 1 55 GLY H 3.220 . 3.220 2.785 2.557 2.971 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
884 1 24 LEU MD1 1 55 GLY HA2 5.190 . 5.190 4.581 4.424 4.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
885 1 24 LEU MD1 1 55 GLY HA3 3.850 . 3.850 3.613 3.424 3.850 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
886 1 24 LEU MD1 1 56 ILE H 5.350 . 5.350 4.984 4.797 5.154 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
887 1 24 LEU MD1 1 56 ILE HA 5.070 . 5.070 4.809 4.694 4.950 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
888 1 24 LEU MD1 1 57 VAL QG 2.640 . 2.640 2.277 2.159 2.364 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
889 1 24 LEU MD2 1 25 SER H 3.190 . 3.190 3.223 3.194 3.244 0.054 35 0 "[ . 1 . 2 . 3 . 4]" 1
890 1 24 LEU MD2 1 26 PHE QD 4.820 . 4.820 4.552 4.393 4.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
891 1 24 LEU MD2 1 48 CYS H 5.500 . 5.500 5.204 4.897 5.387 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
892 1 24 LEU MD2 1 49 SER HB2 5.500 . 5.500 5.346 5.107 5.491 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
893 1 24 LEU MD2 1 50 LEU H 4.030 . 4.030 3.197 3.005 3.320 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
894 1 24 LEU MD2 1 50 LEU HB3 3.420 . 3.420 2.812 2.499 3.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
895 1 24 LEU MD2 1 50 LEU QD 4.220 . 4.220 3.216 2.755 3.826 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
896 1 24 LEU MD2 1 51 HIS QB 4.730 . 4.730 4.518 3.854 4.846 0.116 22 0 "[ . 1 . 2 . 3 . 4]" 1
897 1 24 LEU MD2 1 53 ARG H 4.070 . 4.070 4.014 3.863 4.091 0.021 33 0 "[ . 1 . 2 . 3 . 4]" 1
898 1 24 LEU MD2 1 53 ARG HB2 3.710 . 3.710 3.740 3.610 3.806 0.096 40 0 "[ . 1 . 2 . 3 . 4]" 1
899 1 24 LEU MD2 1 53 ARG HB3 3.340 . 3.340 2.332 2.214 2.397 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
900 1 24 LEU MD2 1 53 ARG QD 3.350 . 3.350 2.115 1.951 2.462 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
901 1 24 LEU MD2 1 54 GLN H 4.010 . 4.010 3.791 3.596 4.014 0.004 29 0 "[ . 1 . 2 . 3 . 4]" 1
902 1 24 LEU MD2 1 54 GLN HA 3.980 . 3.980 3.228 2.835 3.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
903 1 24 LEU MD2 1 55 GLY H 3.920 . 3.920 3.425 3.044 3.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
904 1 24 LEU MD2 1 55 GLY HA2 5.420 . 5.420 4.221 4.000 4.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
905 1 24 LEU MD2 1 55 GLY HA3 3.090 . 3.090 2.926 2.724 3.087 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
906 1 24 LEU MD2 1 56 ILE H 5.500 . 5.500 4.990 4.685 5.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
907 1 24 LEU MD2 1 57 VAL QG 4.780 . 4.780 4.109 4.007 4.199 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
908 1 24 LEU HG 1 25 SER H 4.980 . 4.980 4.894 4.788 4.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
909 1 24 LEU HG 1 55 GLY H 4.240 . 4.240 3.256 3.119 3.368 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
910 1 24 LEU HG 1 55 GLY HA2 4.040 . 4.040 3.852 3.783 3.995 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
911 1 24 LEU HG 1 55 GLY HA3 3.750 . 3.750 2.267 2.153 2.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
912 1 24 LEU HG 1 56 ILE H 4.350 . 4.350 4.043 3.803 4.167 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
913 1 24 LEU HG 1 57 VAL QG 3.710 . 3.710 3.273 3.054 3.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
914 1 25 SER H 1 25 SER HB2 3.950 . 3.950 3.425 2.517 3.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
915 1 25 SER H 1 25 SER QB 3.340 . 3.340 2.889 2.407 3.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
916 1 25 SER H 1 25 SER HB3 3.950 . 3.950 3.194 2.557 3.713 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
917 1 25 SER H 1 26 PHE H 4.340 . 4.340 4.356 4.072 4.399 0.059 24 0 "[ . 1 . 2 . 3 . 4]" 1
918 1 25 SER H 1 50 LEU QD 4.280 . 4.280 3.845 3.357 4.233 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
919 1 25 SER H 1 57 VAL QG 5.230 . 5.230 5.234 4.948 5.295 0.065 29 0 "[ . 1 . 2 . 3 . 4]" 1
920 1 25 SER HA 1 26 PHE H 2.780 . 2.780 2.134 2.104 2.190 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
921 1 25 SER HA 1 50 LEU QD 5.440 . 5.440 4.882 4.677 5.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
922 1 25 SER QB 1 26 PHE H 3.920 . 3.920 3.202 2.997 3.880 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
923 1 25 SER HB2 1 26 PHE H 4.610 . 4.610 3.466 3.086 4.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
924 1 25 SER HB3 1 26 PHE H 4.610 . 4.610 3.950 3.200 4.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
925 1 26 PHE H 1 26 PHE HB2 4.120 . 4.120 3.957 3.880 4.028 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
926 1 26 PHE H 1 26 PHE QD 4.280 . 4.280 3.379 3.195 3.455 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
927 1 26 PHE H 1 26 PHE QE 4.790 . 4.790 4.539 4.318 4.645 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
928 1 26 PHE H 1 27 ARG H 4.650 . 4.650 4.441 4.371 4.530 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
929 1 26 PHE H 1 50 LEU QD 4.720 . 4.720 4.464 4.218 4.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
930 1 26 PHE HA 1 27 ARG H 3.280 . 3.280 2.466 2.380 2.584 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
931 1 26 PHE HA 1 32 MET ME 5.030 . 5.030 4.961 4.857 5.040 0.010 21 0 "[ . 1 . 2 . 3 . 4]" 1
932 1 26 PHE HA 1 50 LEU QD 3.560 . 3.560 3.094 2.987 3.205 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
933 1 26 PHE HB2 1 27 ARG H 3.270 . 3.270 2.185 2.125 2.282 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
934 1 26 PHE HB2 1 27 ARG QB 4.890 . 4.890 4.216 4.046 4.788 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
935 1 26 PHE HB2 1 30 ASP H 5.420 . 5.420 4.461 4.330 4.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
936 1 26 PHE HB2 1 30 ASP HB2 4.730 . 4.730 2.539 2.368 2.879 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
937 1 26 PHE HB2 1 30 ASP HB3 4.730 . 4.730 3.068 2.437 3.346 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
938 1 26 PHE HB2 1 32 MET ME 3.500 . 3.500 3.012 2.884 3.111 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
939 1 26 PHE HB2 1 50 LEU MD1 4.120 . 4.120 3.201 2.998 3.936 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
940 1 26 PHE HB2 1 50 LEU QD 3.120 . 3.120 2.855 2.790 2.945 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
941 1 26 PHE HB2 1 50 LEU MD2 4.120 . 4.120 3.238 2.929 3.826 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
942 1 26 PHE HB3 1 27 ARG H 3.620 . 3.620 3.548 3.496 3.631 0.011 5 0 "[ . 1 . 2 . 3 . 4]" 1
943 1 26 PHE HB3 1 30 ASP HB2 4.790 . 4.790 4.082 3.877 4.503 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
944 1 26 PHE HB3 1 30 ASP QB 4.060 . 4.060 3.631 3.491 3.790 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
945 1 26 PHE HB3 1 30 ASP HB3 4.790 . 4.790 4.100 3.760 4.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
946 1 26 PHE HB3 1 32 MET HB3 5.100 . 5.100 4.955 4.828 5.058 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
947 1 26 PHE HB3 1 32 MET ME 3.560 . 3.560 3.258 3.151 3.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
948 1 26 PHE HB3 1 50 LEU MD1 4.130 . 4.130 2.807 2.303 3.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
949 1 26 PHE HB3 1 50 LEU QD 3.210 . 3.210 2.045 1.965 2.283 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
950 1 26 PHE HB3 1 50 LEU MD2 4.130 . 4.130 2.139 2.000 3.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
951 1 26 PHE QD 1 27 ARG H 4.100 . 4.100 3.275 3.057 3.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
952 1 26 PHE QD 1 32 MET ME 3.430 . 3.430 2.904 2.873 2.930 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
953 1 26 PHE QD 1 50 LEU MD1 4.820 . 4.820 3.521 3.257 4.403 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
954 1 26 PHE QD 1 50 LEU QD 3.730 . 3.730 2.798 2.465 3.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
955 1 26 PHE QD 1 50 LEU MD2 4.820 . 4.820 2.971 2.522 4.646 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
956 1 26 PHE QD 1 57 VAL QG 3.550 . 3.550 3.211 3.146 3.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
957 1 26 PHE QD 1 62 LEU MD1 5.430 . 5.430 4.852 4.229 5.446 0.016 21 0 "[ . 1 . 2 . 3 . 4]" 1
958 1 26 PHE QD 1 62 LEU QD 4.600 . 4.600 4.300 4.095 4.499 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
959 1 26 PHE QD 1 62 LEU MD2 5.430 . 5.430 5.103 4.702 5.530 0.100 34 0 "[ . 1 . 2 . 3 . 4]" 1
960 1 26 PHE QE 1 32 MET ME 3.640 . 3.640 3.258 3.191 3.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
961 1 26 PHE QE 1 57 VAL HB 3.970 . 3.970 4.031 3.994 4.072 0.102 24 0 "[ . 1 . 2 . 3 . 4]" 1
962 1 26 PHE QE 1 57 VAL QG 2.970 . 2.970 1.810 1.789 1.832 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
963 1 26 PHE QE 1 58 PRO HD2 4.660 . 4.660 3.509 3.335 3.660 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
964 1 26 PHE QE 1 61 ARG HB2 4.910 . 4.910 4.052 3.938 4.235 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
965 1 26 PHE QE 1 61 ARG QB 4.300 . 4.300 3.443 3.331 3.576 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
966 1 26 PHE QE 1 61 ARG HB3 4.910 . 4.910 3.726 3.583 3.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
967 1 26 PHE QE 1 61 ARG HD2 5.500 . 5.500 4.809 4.553 5.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
968 1 26 PHE QE 1 62 LEU MD1 4.100 . 4.100 3.645 3.115 4.130 0.030 21 0 "[ . 1 . 2 . 3 . 4]" 1
969 1 26 PHE QE 1 62 LEU QD 3.470 . 3.470 3.311 3.033 3.575 0.105 30 0 "[ . 1 . 2 . 3 . 4]" 1
970 1 26 PHE QE 1 62 LEU MD2 4.100 . 4.100 3.997 3.805 4.196 0.096 5 0 "[ . 1 . 2 . 3 . 4]" 1
971 1 26 PHE HZ 1 32 MET ME 4.780 . 4.780 3.818 3.714 3.927 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
972 1 26 PHE HZ 1 57 VAL HB 4.750 . 4.750 4.758 4.726 4.780 0.030 40 0 "[ . 1 . 2 . 3 . 4]" 1
973 1 26 PHE HZ 1 57 VAL QG 3.170 . 3.170 2.013 1.992 2.048 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
974 1 26 PHE HZ 1 58 PRO HD2 4.300 . 4.300 3.173 3.034 3.366 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
975 1 26 PHE HZ 1 58 PRO HD3 5.240 . 5.240 4.928 4.784 5.117 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
976 1 26 PHE HZ 1 58 PRO HG3 5.080 . 5.080 5.031 4.852 5.101 0.021 27 0 "[ . 1 . 2 . 3 . 4]" 1
977 1 26 PHE HZ 1 61 ARG QB 3.980 . 3.980 3.381 3.195 3.545 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
978 1 26 PHE HZ 1 61 ARG HD2 5.450 . 5.450 4.642 4.260 4.937 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
979 1 26 PHE HZ 1 61 ARG HD3 5.450 . 5.450 5.220 4.915 5.465 0.015 40 0 "[ . 1 . 2 . 3 . 4]" 1
980 1 26 PHE HZ 1 62 LEU MD1 4.000 . 4.000 3.351 2.533 4.096 0.096 30 0 "[ . 1 . 2 . 3 . 4]" 1
981 1 26 PHE HZ 1 62 LEU QD 3.510 . 3.510 3.067 2.508 3.602 0.092 30 0 "[ . 1 . 2 . 3 . 4]" 1
982 1 26 PHE HZ 1 62 LEU MD2 4.000 . 4.000 3.960 3.785 4.050 0.050 39 0 "[ . 1 . 2 . 3 . 4]" 1
983 1 26 PHE HZ 1 62 LEU HG 5.500 . 5.500 4.325 3.112 5.547 0.047 28 0 "[ . 1 . 2 . 3 . 4]" 1
984 1 27 ARG H 1 27 ARG HB2 3.880 . 3.880 2.852 2.466 3.896 0.016 21 0 "[ . 1 . 2 . 3 . 4]" 1
985 1 27 ARG H 1 27 ARG QB 3.130 . 3.130 2.339 2.091 2.887 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
986 1 27 ARG H 1 27 ARG HB3 3.880 . 3.880 2.527 2.122 2.976 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
987 1 27 ARG H 1 27 ARG QD 4.750 . 4.750 4.098 1.784 4.617 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
988 1 27 ARG H 1 27 ARG HG2 4.840 . 4.840 4.512 3.496 4.735 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
989 1 27 ARG H 1 27 ARG QG 4.040 . 4.040 3.937 2.502 4.113 0.073 30 0 "[ . 1 . 2 . 3 . 4]" 1
990 1 27 ARG H 1 27 ARG HG3 4.840 . 4.840 4.356 2.563 4.543 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
991 1 27 ARG H 1 28 LYS H 4.560 . 4.560 4.551 4.515 4.576 0.016 34 0 "[ . 1 . 2 . 3 . 4]" 1
992 1 27 ARG H 1 30 ASP H 4.240 . 4.240 4.195 4.052 4.245 0.005 1 0 "[ . 1 . 2 . 3 . 4]" 1
993 1 27 ARG H 1 30 ASP HA 5.500 . 5.500 5.162 4.953 5.298 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
994 1 27 ARG H 1 30 ASP HB2 4.390 . 4.390 3.007 2.414 3.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
995 1 27 ARG H 1 30 ASP QB 3.730 . 3.730 2.917 2.368 3.106 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
996 1 27 ARG H 1 30 ASP HB3 4.390 . 4.390 3.965 3.409 4.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
997 1 27 ARG H 1 32 MET ME 4.820 . 4.820 4.663 4.510 4.793 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
998 1 27 ARG H 1 50 LEU MD1 5.300 . 5.300 4.549 3.925 5.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
999 1 27 ARG H 1 50 LEU QD 4.300 . 4.300 3.931 3.778 4.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1000 1 27 ARG H 1 50 LEU MD2 5.300 . 5.300 4.319 4.053 4.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1001 1 27 ARG HA 1 27 ARG QD 3.750 . 3.750 2.483 2.018 3.563 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1002 1 27 ARG HA 1 28 LYS H 2.930 . 2.930 2.329 2.207 2.541 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1003 1 27 ARG HA 1 28 LYS HA 4.610 . 4.610 4.419 4.279 4.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1004 1 27 ARG HA 1 28 LYS HB2 5.210 . 5.210 4.659 4.473 4.806 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1005 1 27 ARG HA 1 28 LYS QB 4.500 . 4.500 4.167 4.000 4.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1006 1 27 ARG HA 1 28 LYS HB3 5.210 . 5.210 4.700 4.484 4.988 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1007 1 27 ARG QB 1 27 ARG QD 3.220 . 3.220 2.279 1.985 2.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1008 1 27 ARG QB 1 28 LYS H 3.580 . 3.580 3.347 2.469 3.586 0.006 27 0 "[ . 1 . 2 . 3 . 4]" 1
1009 1 27 ARG HB2 1 27 ARG QD 3.790 . 3.790 2.411 2.014 3.293 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1010 1 27 ARG HB2 1 28 LYS H 4.180 . 4.180 3.873 2.497 4.144 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1011 1 27 ARG HB3 1 27 ARG QD 3.790 . 3.790 3.201 2.374 3.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1012 1 27 ARG HB3 1 28 LYS H 4.180 . 4.180 3.798 3.440 4.202 0.022 40 0 "[ . 1 . 2 . 3 . 4]" 1
1013 1 27 ARG QD 1 28 LYS H 4.210 . 4.210 2.961 1.862 4.175 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1014 1 27 ARG QG 1 28 LYS H 3.880 . 3.880 2.392 1.919 3.616 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1015 1 27 ARG QG 1 30 ASP H 4.860 . 4.860 4.505 3.610 4.917 0.057 3 0 "[ . 1 . 2 . 3 . 4]" 1
1016 1 27 ARG HG2 1 28 LYS H 4.730 . 4.730 3.854 2.768 4.619 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1017 1 27 ARG HG3 1 28 LYS H 4.730 . 4.730 2.545 1.940 4.361 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1018 1 28 LYS H 1 28 LYS HB2 3.230 . 3.230 2.510 2.389 2.632 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1019 1 28 LYS H 1 28 LYS QB 2.790 . 2.790 2.181 2.113 2.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1020 1 28 LYS H 1 28 LYS HB3 3.230 . 3.230 2.398 2.323 2.480 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1021 1 28 LYS H 1 28 LYS QD 4.570 . 4.570 4.262 4.087 4.447 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1022 1 28 LYS H 1 28 LYS HG2 4.510 . 4.510 4.420 4.371 4.498 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1023 1 28 LYS H 1 28 LYS HG3 4.560 . 4.560 4.471 4.422 4.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1024 1 28 LYS H 1 29 GLY H 4.590 . 4.590 4.589 4.538 4.619 0.029 35 0 "[ . 1 . 2 . 3 . 4]" 1
1025 1 28 LYS HA 1 28 LYS QD 4.120 . 4.120 3.960 3.827 4.031 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1026 1 28 LYS HA 1 28 LYS QE 5.080 . 5.080 4.760 4.573 4.920 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1027 1 28 LYS HA 1 28 LYS HG2 3.730 . 3.730 3.329 3.215 3.438 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1028 1 28 LYS HA 1 28 LYS HG3 3.550 . 3.550 2.624 2.562 2.695 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1029 1 28 LYS HA 1 29 GLY H 2.850 . 2.850 2.151 2.115 2.184 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1030 1 28 LYS HA 1 29 GLY HA3 4.470 . 4.470 4.433 4.417 4.450 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1031 1 28 LYS HA 1 30 ASP H 3.840 . 3.840 3.477 3.385 3.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1032 1 28 LYS QB 1 28 LYS QD 3.320 . 3.320 2.087 2.019 2.179 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1033 1 28 LYS QB 1 28 LYS QE 4.310 . 4.310 3.543 3.492 3.585 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1034 1 28 LYS HB2 1 29 GLY H 4.490 . 4.490 4.225 4.108 4.309 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1035 1 28 LYS HB3 1 29 GLY H 4.490 . 4.490 4.252 4.144 4.336 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1036 1 28 LYS QE 1 28 LYS HG3 3.200 . 3.200 2.425 2.266 2.609 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1037 1 28 LYS QE 1 29 GLY H 5.340 . 5.340 4.828 4.301 5.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1038 1 28 LYS HE2 1 28 LYS HG2 3.550 . 3.550 2.721 2.432 3.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1039 1 28 LYS HE2 1 28 LYS HG3 3.660 . 3.660 3.282 3.015 3.668 0.008 2 0 "[ . 1 . 2 . 3 . 4]" 1
1040 1 28 LYS HE3 1 28 LYS HG2 3.550 . 3.550 2.931 2.420 3.223 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1041 1 28 LYS HE3 1 28 LYS HG3 3.660 . 3.660 2.509 2.297 2.748 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1042 1 28 LYS HG2 1 29 GLY H 3.710 . 3.710 3.359 2.973 3.672 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1043 1 28 LYS HG2 1 29 GLY HA2 4.660 . 4.660 4.028 3.647 4.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1044 1 28 LYS HG2 1 30 ASP H 5.500 . 5.500 5.300 4.959 5.514 0.014 29 0 "[ . 1 . 2 . 3 . 4]" 1
1045 1 28 LYS HG3 1 29 GLY H 3.880 . 3.880 3.051 2.767 3.231 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1046 1 28 LYS HG3 1 29 GLY HA2 5.100 . 5.100 4.452 4.213 4.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1047 1 28 LYS HG3 1 30 ASP H 5.500 . 5.500 5.391 5.148 5.503 0.003 14 0 "[ . 1 . 2 . 3 . 4]" 1
1048 1 29 GLY H 1 30 ASP H 3.270 . 3.270 2.613 2.485 2.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1049 1 29 GLY H 1 31 ILE MD 5.420 . 5.420 5.415 5.311 5.488 0.068 32 0 "[ . 1 . 2 . 3 . 4]" 1
1050 1 29 GLY H 1 32 MET ME 5.340 . 5.340 5.282 5.192 5.363 0.023 32 0 "[ . 1 . 2 . 3 . 4]" 1
1051 1 29 GLY H 1 62 LEU QD 5.440 . 5.440 5.462 5.385 5.551 0.111 21 0 "[ . 1 . 2 . 3 . 4]" 1
1052 1 29 GLY HA3 1 30 ASP H 3.520 . 3.520 3.243 3.193 3.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1053 1 29 GLY HA3 1 31 ILE MD 5.380 . 5.380 5.336 5.243 5.423 0.043 33 0 "[ . 1 . 2 . 3 . 4]" 1
1054 1 30 ASP H 1 30 ASP HB2 3.630 . 3.630 2.272 2.109 2.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1055 1 30 ASP H 1 30 ASP QB 2.890 . 2.890 2.240 2.078 2.336 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1056 1 30 ASP H 1 30 ASP HB3 3.630 . 3.630 3.437 2.823 3.593 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1057 1 30 ASP H 1 31 ILE H 4.810 . 4.810 4.652 4.634 4.675 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1058 1 30 ASP H 1 31 ILE MD 4.880 . 4.880 4.919 4.864 4.952 0.072 39 0 "[ . 1 . 2 . 3 . 4]" 1
1059 1 30 ASP H 1 32 MET ME 4.280 . 4.280 4.240 4.171 4.298 0.018 5 0 "[ . 1 . 2 . 3 . 4]" 1
1060 1 30 ASP H 1 50 LEU QD 5.440 . 5.440 5.076 4.945 5.166 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1061 1 30 ASP H 1 62 LEU QD 5.440 . 5.440 5.588 5.512 5.676 0.236 3 0 "[ . 1 . 2 . 3 . 4]" 1
1062 1 30 ASP HA 1 31 ILE H 2.650 . 2.650 2.330 2.263 2.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1063 1 30 ASP HA 1 31 ILE HB 4.850 . 4.850 4.632 4.584 4.666 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1064 1 30 ASP HA 1 31 ILE MD 4.460 . 4.460 4.145 4.082 4.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1065 1 30 ASP HA 1 31 ILE HG12 4.550 . 4.550 3.622 3.537 3.717 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1066 1 30 ASP HA 1 32 MET ME 4.930 . 4.930 4.541 4.428 4.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1067 1 30 ASP HA 1 50 LEU QD 4.570 . 4.570 4.253 4.049 4.372 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1068 1 30 ASP QB 1 31 ILE H 3.320 . 3.320 2.645 2.433 3.176 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1069 1 30 ASP QB 1 32 MET HB3 4.790 . 4.790 4.410 3.972 4.810 0.020 8 0 "[ . 1 . 2 . 3 . 4]" 1
1070 1 30 ASP QB 1 32 MET ME 3.300 . 3.300 2.492 2.217 2.632 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1071 1 30 ASP QB 1 50 LEU QD 3.010 . 3.010 2.416 2.212 2.920 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1072 1 30 ASP QB 1 62 LEU QD 5.280 . 5.280 4.664 4.506 4.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1073 1 30 ASP HB2 1 32 MET ME 3.980 . 3.980 3.040 2.768 3.958 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1074 1 30 ASP HB2 1 50 LEU MD1 4.700 . 4.700 3.595 3.325 4.341 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1075 1 30 ASP HB2 1 50 LEU MD2 4.700 . 4.700 4.599 3.915 4.761 0.061 8 0 "[ . 1 . 2 . 3 . 4]" 1
1076 1 30 ASP HB3 1 32 MET ME 3.980 . 3.980 2.736 2.250 2.990 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1077 1 30 ASP HB3 1 50 LEU MD1 4.700 . 4.700 2.524 2.264 3.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1078 1 30 ASP HB3 1 50 LEU MD2 4.700 . 4.700 3.991 2.545 4.289 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1079 1 31 ILE H 1 31 ILE HB 2.930 . 2.930 2.649 2.612 2.698 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1080 1 31 ILE H 1 31 ILE MD 3.790 . 3.790 3.682 3.602 3.801 0.011 21 0 "[ . 1 . 2 . 3 . 4]" 1
1081 1 31 ILE H 1 31 ILE HG12 3.600 . 3.600 2.894 2.797 3.011 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1082 1 31 ILE H 1 31 ILE HG13 4.310 . 4.310 4.221 4.143 4.313 0.003 21 0 "[ . 1 . 2 . 3 . 4]" 1
1083 1 31 ILE H 1 31 ILE MG 4.080 . 4.080 3.893 3.869 3.922 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1084 1 31 ILE H 1 32 MET ME 4.180 . 4.180 3.888 3.694 4.037 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1085 1 31 ILE H 1 50 LEU QD 3.640 . 3.640 3.331 3.144 3.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1086 1 31 ILE HA 1 31 ILE MD 3.180 . 3.180 2.237 2.217 2.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1087 1 31 ILE HA 1 31 ILE HG12 3.670 . 3.670 3.205 3.176 3.223 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1088 1 31 ILE HA 1 31 ILE HG13 3.790 . 3.790 3.772 3.758 3.792 0.002 21 0 "[ . 1 . 2 . 3 . 4]" 1
1089 1 31 ILE HA 1 31 ILE MG 2.870 . 2.870 2.386 2.356 2.404 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1090 1 31 ILE HA 1 32 MET H 2.800 . 2.800 2.160 2.129 2.184 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1091 1 31 ILE HA 1 32 MET ME 3.400 . 3.400 3.260 3.050 3.422 0.022 24 0 "[ . 1 . 2 . 3 . 4]" 1
1092 1 31 ILE HA 1 32 MET HG2 4.370 . 4.370 3.831 3.779 3.882 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1093 1 31 ILE HA 1 65 LEU MD1 4.260 . 4.260 4.302 4.231 4.340 0.080 1 0 "[ . 1 . 2 . 3 . 4]" 1
1094 1 31 ILE HB 1 31 ILE MD 3.340 . 3.340 3.273 3.260 3.287 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1095 1 31 ILE MD 1 32 MET H 3.890 . 3.890 3.754 3.702 3.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1096 1 31 ILE MD 1 32 MET HG2 5.290 . 5.290 5.138 5.063 5.205 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1097 1 31 ILE MD 1 65 LEU H 5.500 . 5.500 5.574 5.533 5.617 0.117 39 0 "[ . 1 . 2 . 3 . 4]" 1
1098 1 31 ILE HG12 1 31 ILE MG 3.270 . 3.270 3.236 3.229 3.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1099 1 31 ILE HG13 1 31 ILE MG 2.970 . 2.970 2.298 2.279 2.328 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1100 1 31 ILE MG 1 32 MET H 3.060 . 3.060 2.677 2.629 2.774 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1101 1 31 ILE MG 1 33 THR H 5.500 . 5.500 4.592 4.474 4.689 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1102 1 31 ILE MG 1 33 THR HA 5.500 . 5.500 4.344 4.260 4.448 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1103 1 31 ILE MG 1 65 LEU HG 5.060 . 5.060 4.529 4.385 4.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1104 1 32 MET H 1 32 MET HB3 3.630 . 3.630 3.262 3.179 3.291 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1105 1 32 MET H 1 32 MET ME 3.520 . 3.520 2.896 2.709 3.018 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1106 1 32 MET H 1 32 MET HG2 3.420 . 3.420 2.020 1.961 2.064 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1107 1 32 MET H 1 32 MET HG3 3.530 . 3.530 3.539 3.531 3.553 0.023 5 0 "[ . 1 . 2 . 3 . 4]" 1
1108 1 32 MET H 1 50 LEU HB2 5.500 . 5.500 5.495 5.435 5.513 0.013 1 0 "[ . 1 . 2 . 3 . 4]" 1
1109 1 32 MET H 1 50 LEU QD 4.180 . 4.180 3.909 3.796 3.989 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1110 1 32 MET H 1 62 LEU MD1 5.500 . 5.500 4.511 3.924 5.040 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1111 1 32 MET H 1 62 LEU QD 4.090 . 4.090 3.744 3.653 3.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1112 1 32 MET H 1 62 LEU MD2 5.500 . 5.500 4.202 3.771 4.723 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1113 1 32 MET HA 1 32 MET HG3 4.250 . 4.250 4.018 3.980 4.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1114 1 32 MET HA 1 33 THR H 2.910 . 2.910 2.264 2.217 2.307 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1115 1 32 MET HA 1 33 THR MG 5.500 . 5.500 5.440 5.394 5.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1116 1 32 MET HA 1 49 SER H 4.970 . 4.970 4.517 4.420 4.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1117 1 32 MET HA 1 50 LEU HB2 4.710 . 4.710 3.524 3.406 3.636 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1118 1 32 MET HA 1 50 LEU QD 3.260 . 3.260 2.647 2.467 2.763 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1119 1 32 MET HB2 1 32 MET ME 3.840 . 3.840 3.592 3.541 3.628 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1120 1 32 MET HB2 1 33 THR H 3.270 . 3.270 2.579 2.508 2.674 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1121 1 32 MET HB2 1 33 THR HA 5.500 . 5.500 4.764 4.712 4.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1122 1 32 MET HB2 1 48 CYS HB2 4.690 . 4.690 3.159 3.024 3.270 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1123 1 32 MET HB2 1 48 CYS HB3 4.680 . 4.680 2.388 2.289 2.535 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1124 1 32 MET HB2 1 49 SER H 4.250 . 4.250 3.066 2.996 3.132 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1125 1 32 MET HB2 1 49 SER HA 5.460 . 5.460 4.682 4.631 4.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1126 1 32 MET HB2 1 50 LEU H 4.750 . 4.750 4.724 4.599 4.767 0.017 10 0 "[ . 1 . 2 . 3 . 4]" 1
1127 1 32 MET HB2 1 50 LEU HA 5.500 . 5.500 4.018 3.918 4.170 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1128 1 32 MET HB2 1 50 LEU HB2 4.000 . 4.000 2.770 2.534 2.929 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1129 1 32 MET HB2 1 50 LEU QD 3.280 . 3.280 3.263 3.198 3.308 0.028 9 0 "[ . 1 . 2 . 3 . 4]" 1
1130 1 32 MET HB2 1 57 VAL QG 5.500 . 5.500 4.108 3.998 4.222 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1131 1 32 MET HB3 1 32 MET ME 2.950 . 2.950 2.173 2.129 2.211 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1132 1 32 MET HB3 1 33 THR H 3.830 . 3.830 3.766 3.722 3.822 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1133 1 32 MET HB3 1 48 CYS HB3 4.680 . 4.680 3.957 3.865 4.108 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1134 1 32 MET HB3 1 49 SER H 4.860 . 4.860 4.763 4.677 4.842 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1135 1 32 MET HB3 1 50 LEU HA 4.800 . 4.800 3.938 3.820 4.072 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1136 1 32 MET HB3 1 50 LEU HB2 4.190 . 4.190 2.350 2.313 2.414 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1137 1 32 MET HB3 1 50 LEU MD1 4.600 . 4.600 2.123 2.022 4.224 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1138 1 32 MET HB3 1 50 LEU QD 3.060 . 3.060 2.067 2.017 2.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1139 1 32 MET HB3 1 50 LEU MD2 4.600 . 4.600 3.956 2.259 4.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1140 1 32 MET HB3 1 57 VAL QG 5.090 . 5.090 4.268 4.149 4.400 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1141 1 32 MET HB3 1 62 LEU QD 5.130 . 5.130 4.161 4.121 4.209 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1142 1 32 MET ME 1 32 MET HG2 3.050 . 3.050 2.416 2.373 2.439 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1143 1 32 MET ME 1 32 MET HG3 3.490 . 3.490 3.434 3.412 3.450 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1144 1 32 MET ME 1 48 CYS HB2 5.120 . 5.120 5.036 4.937 5.113 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1145 1 32 MET ME 1 48 CYS HB3 5.380 . 5.380 5.001 4.926 5.069 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1146 1 32 MET ME 1 50 LEU HB2 4.170 . 4.170 3.651 3.502 3.725 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1147 1 32 MET ME 1 50 LEU MD1 3.700 . 3.700 2.016 1.933 3.724 0.024 23 0 "[ . 1 . 2 . 3 . 4]" 1
1148 1 32 MET ME 1 50 LEU QD 2.780 . 2.780 1.982 1.922 2.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1149 1 32 MET ME 1 50 LEU MD2 3.700 . 3.700 3.557 2.776 3.734 0.034 39 0 "[ . 1 . 2 . 3 . 4]" 1
1150 1 32 MET ME 1 50 LEU HG 4.580 . 4.580 4.613 2.501 4.730 0.150 35 0 "[ . 1 . 2 . 3 . 4]" 1
1151 1 32 MET ME 1 57 VAL QG 3.320 . 3.320 3.397 3.279 3.472 0.152 36 0 "[ . 1 . 2 . 3 . 4]" 1
1152 1 32 MET ME 1 62 LEU MD1 3.690 . 3.690 3.009 2.225 3.712 0.022 12 0 "[ . 1 . 2 . 3 . 4]" 1
1153 1 32 MET ME 1 62 LEU QD 2.590 . 2.590 2.288 2.206 2.377 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1154 1 32 MET ME 1 62 LEU MD2 3.690 . 3.690 2.972 2.263 3.736 0.046 9 0 "[ . 1 . 2 . 3 . 4]" 1
1155 1 32 MET ME 1 62 LEU HG 4.730 . 4.730 4.255 4.041 4.552 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1156 1 32 MET ME 1 63 LYS H 5.500 . 5.500 5.465 5.363 5.553 0.053 19 0 "[ . 1 . 2 . 3 . 4]" 1
1157 1 32 MET HG2 1 33 THR H 4.540 . 4.540 4.532 4.471 4.558 0.018 30 0 "[ . 1 . 2 . 3 . 4]" 1
1158 1 32 MET HG2 1 48 CYS HB2 4.730 . 4.730 4.744 4.737 4.756 0.026 24 0 "[ . 1 . 2 . 3 . 4]" 1
1159 1 32 MET HG2 1 48 CYS HB3 4.790 . 4.790 3.944 3.917 3.986 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1160 1 32 MET HG2 1 50 LEU QD 4.380 . 4.380 4.010 3.969 4.322 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1161 1 32 MET HG2 1 57 VAL QG 4.720 . 4.720 4.166 4.085 4.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1162 1 32 MET HG2 1 62 LEU MD1 3.940 . 3.940 3.096 2.727 3.444 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1163 1 32 MET HG2 1 62 LEU QD 3.450 . 3.450 2.559 2.506 2.601 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1164 1 32 MET HG2 1 62 LEU MD2 3.940 . 3.940 2.808 2.599 3.055 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1165 1 32 MET HG3 1 48 CYS HB2 4.900 . 4.900 3.101 3.074 3.132 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1166 1 32 MET HG3 1 48 CYS HB3 4.360 . 4.360 2.294 2.241 2.362 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1167 1 32 MET HG3 1 50 LEU QD 4.960 . 4.960 4.403 4.332 4.730 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1168 1 32 MET HG3 1 57 VAL QG 4.270 . 4.270 3.398 3.249 3.530 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1169 1 32 MET HG3 1 62 LEU MD1 3.930 . 3.930 3.185 2.831 3.557 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1170 1 32 MET HG3 1 62 LEU QD 3.430 . 3.430 2.665 2.521 2.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1171 1 32 MET HG3 1 62 LEU MD2 3.930 . 3.930 3.005 2.594 3.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1172 1 33 THR H 1 33 THR HB 3.070 . 3.070 2.475 2.442 2.496 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1173 1 33 THR H 1 33 THR MG 3.810 . 3.810 3.792 3.772 3.810 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1174 1 33 THR H 1 34 VAL H 4.650 . 4.650 4.422 4.406 4.451 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1175 1 33 THR H 1 34 VAL QG 5.440 . 5.440 4.816 4.767 4.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1176 1 33 THR H 1 35 LEU QD 5.440 . 5.440 5.035 4.941 5.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1177 1 33 THR H 1 48 CYS HA 4.890 . 4.890 4.750 4.692 4.802 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1178 1 33 THR H 1 48 CYS HB2 4.960 . 4.960 4.968 4.960 4.977 0.017 2 0 "[ . 1 . 2 . 3 . 4]" 1
1179 1 33 THR H 1 48 CYS HB3 5.020 . 5.020 3.594 3.546 3.650 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1180 1 33 THR H 1 49 SER H 3.490 . 3.490 2.725 2.683 2.789 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1181 1 33 THR H 1 49 SER HB2 5.370 . 5.370 5.209 5.125 5.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1182 1 33 THR H 1 49 SER HB3 4.330 . 4.330 4.332 4.207 4.345 0.015 39 0 "[ . 1 . 2 . 3 . 4]" 1
1183 1 33 THR H 1 50 LEU HB2 4.590 . 4.590 4.323 4.192 4.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1184 1 33 THR H 1 50 LEU QD 4.090 . 4.090 4.277 4.116 4.383 0.293 39 0 "[ . 1 . 2 . 3 . 4]" 1
1185 1 33 THR HA 1 33 THR MG 3.070 . 3.070 2.375 2.349 2.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1186 1 33 THR HA 1 34 VAL H 3.250 . 3.250 2.195 2.176 2.224 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1187 1 33 THR HA 1 34 VAL QG 3.930 . 3.930 3.673 3.633 3.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1188 1 33 THR HA 1 35 LEU QD 5.420 . 5.420 4.923 4.820 4.992 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1189 1 33 THR HA 1 49 SER H 5.460 . 5.460 4.458 4.432 4.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1190 1 33 THR HB 1 34 VAL H 4.580 . 4.580 4.386 4.357 4.403 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1191 1 33 THR HB 1 35 LEU MD1 5.000 . 5.000 4.562 4.378 4.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1192 1 33 THR HB 1 35 LEU QD 3.690 . 3.690 3.470 3.350 3.544 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1193 1 33 THR HB 1 35 LEU MD2 5.000 . 5.000 3.597 3.476 3.684 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1194 1 33 THR HB 1 49 SER H 3.730 . 3.730 2.977 2.921 3.040 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1195 1 33 THR HB 1 49 SER HB2 4.510 . 4.510 4.307 4.228 4.374 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1196 1 33 THR HB 1 49 SER HB3 3.410 . 3.410 3.042 2.902 3.126 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1197 1 33 THR MG 1 34 VAL H 3.080 . 3.080 3.063 3.006 3.091 0.011 25 0 "[ . 1 . 2 . 3 . 4]" 1
1198 1 33 THR MG 1 34 VAL HA 4.410 . 4.410 4.149 4.102 4.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1199 1 33 THR MG 1 35 LEU H 4.670 . 4.670 4.298 4.213 4.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1200 1 33 THR MG 1 35 LEU HA 4.050 . 4.050 3.688 3.625 3.812 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1201 1 33 THR MG 1 35 LEU MD1 4.140 . 4.140 4.111 4.001 4.178 0.038 27 0 "[ . 1 . 2 . 3 . 4]" 1
1202 1 33 THR MG 1 35 LEU QD 2.690 . 2.690 2.330 2.254 2.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1203 1 33 THR MG 1 35 LEU MD2 4.140 . 4.140 2.343 2.266 2.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1204 1 33 THR MG 1 35 LEU HG 3.760 . 3.760 3.244 3.148 3.336 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1205 1 33 THR MG 1 48 CYS HA 4.460 . 4.460 4.483 4.460 4.503 0.043 40 0 "[ . 1 . 2 . 3 . 4]" 1
1206 1 33 THR MG 1 49 SER H 3.970 . 3.970 3.993 3.976 4.008 0.038 23 0 "[ . 1 . 2 . 3 . 4]" 1
1207 1 33 THR MG 1 49 SER HB2 5.090 . 5.090 5.110 5.073 5.147 0.057 30 0 "[ . 1 . 2 . 3 . 4]" 1
1208 1 33 THR MG 1 49 SER HB3 3.820 . 3.820 3.837 3.813 3.854 0.034 8 0 "[ . 1 . 2 . 3 . 4]" 1
1209 1 34 VAL H 1 34 VAL HB 3.430 . 3.430 2.575 2.543 2.622 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1210 1 34 VAL H 1 34 VAL MG1 3.880 . 3.880 3.827 3.815 3.848 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1211 1 34 VAL H 1 34 VAL QG 2.890 . 2.890 2.148 2.113 2.188 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1212 1 34 VAL H 1 34 VAL MG2 3.880 . 3.880 2.160 2.123 2.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1213 1 34 VAL H 1 35 LEU H 4.720 . 4.720 4.479 4.439 4.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1214 1 34 VAL H 1 35 LEU QD 5.420 . 5.420 4.805 4.723 4.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1215 1 34 VAL H 1 64 ILE MD 4.870 . 4.870 4.753 4.664 4.851 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1216 1 34 VAL HA 1 34 VAL MG1 3.060 . 3.060 2.349 2.328 2.366 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1217 1 34 VAL HA 1 34 VAL MG2 3.060 . 3.060 2.394 2.362 2.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1218 1 34 VAL HA 1 35 LEU H 3.100 . 3.100 2.100 2.070 2.116 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1219 1 34 VAL HA 1 35 LEU QD 4.900 . 4.900 4.213 4.155 4.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1220 1 34 VAL HA 1 35 LEU HG 4.070 . 4.070 3.705 3.606 3.810 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1221 1 34 VAL HA 1 48 CYS H 5.390 . 5.390 4.824 4.778 4.890 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1222 1 34 VAL HA 1 48 CYS HA 3.800 . 3.800 2.378 2.309 2.487 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1223 1 34 VAL HA 1 49 SER H 4.310 . 4.310 3.891 3.820 3.964 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1224 1 34 VAL HA 1 57 VAL QG 5.500 . 5.500 5.206 5.116 5.404 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1225 1 34 VAL HB 1 35 LEU H 4.920 . 4.920 4.165 4.120 4.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1226 1 34 VAL HB 1 64 ILE MD 4.230 . 4.230 3.335 3.139 3.424 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1227 1 34 VAL QG 1 35 LEU H 3.150 . 3.150 2.740 2.663 2.852 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1228 1 34 VAL QG 1 35 LEU HB2 4.800 . 4.800 4.355 4.303 4.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1229 1 34 VAL QG 1 36 GLU H 3.270 . 3.270 2.906 2.849 2.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1230 1 34 VAL QG 1 36 GLU HA 4.010 . 4.010 3.347 3.260 3.464 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1231 1 34 VAL QG 1 36 GLU HB3 5.440 . 5.440 5.016 4.952 5.108 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1232 1 34 VAL QG 1 36 GLU QG 4.850 . 4.850 4.541 4.421 4.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1233 1 34 VAL QG 1 37 ARG H 4.890 . 4.890 4.363 4.194 4.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1234 1 34 VAL QG 1 37 ARG HA 4.310 . 4.310 3.839 3.692 3.936 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1235 1 34 VAL QG 1 37 ARG HD2 4.790 . 4.790 4.071 3.808 4.435 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1236 1 34 VAL QG 1 37 ARG HD3 4.300 . 4.300 3.333 2.937 3.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1237 1 34 VAL QG 1 37 ARG HG3 4.090 . 4.090 2.945 2.726 3.193 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1238 1 34 VAL QG 1 46 TRP HA 4.920 . 4.920 4.015 3.924 4.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1239 1 34 VAL QG 1 46 TRP HB2 4.380 . 4.380 3.511 3.423 3.616 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1240 1 34 VAL QG 1 46 TRP HB3 3.360 . 3.360 2.390 2.295 2.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1241 1 34 VAL QG 1 46 TRP HE3 3.240 . 3.240 2.830 2.650 3.017 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1242 1 34 VAL QG 1 46 TRP HZ3 4.270 . 4.270 3.829 3.615 4.008 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1243 1 34 VAL QG 1 47 LEU H 4.330 . 4.330 3.807 3.713 3.908 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1244 1 34 VAL QG 1 48 CYS HA 3.890 . 3.890 3.566 3.478 3.662 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1245 1 34 VAL QG 1 48 CYS HB2 4.880 . 4.880 4.227 4.114 4.336 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1246 1 34 VAL QG 1 48 CYS HB3 4.530 . 4.530 3.359 3.196 3.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1247 1 34 VAL QG 1 48 CYS HG 3.490 . 3.490 3.373 3.304 3.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1248 1 34 VAL QG 1 49 SER H 5.040 . 5.040 4.583 4.496 4.662 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1249 1 34 VAL QG 1 62 LEU QD 4.050 . 4.050 2.589 2.423 2.729 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1250 1 34 VAL QG 1 64 ILE HA 4.300 . 4.300 3.732 3.623 3.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1251 1 34 VAL QG 1 64 ILE MD 3.160 . 3.160 2.002 1.962 2.048 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1252 1 34 VAL QG 1 64 ILE HG12 5.440 . 5.440 4.204 4.126 4.261 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1253 1 34 VAL QG 1 64 ILE HG13 4.210 . 4.210 4.109 3.996 4.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1254 1 34 VAL QG 1 64 ILE MG 4.340 . 4.340 3.527 3.436 3.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1255 1 34 VAL QG 1 65 LEU H 4.900 . 4.900 4.649 4.448 4.759 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1256 1 34 VAL MG1 1 35 LEU H 4.220 . 4.220 2.785 2.701 2.908 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1257 1 34 VAL MG1 1 46 TRP HB2 5.170 . 5.170 3.739 3.627 3.855 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1258 1 34 VAL MG1 1 46 TRP HB3 4.360 . 4.360 2.421 2.319 2.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1259 1 34 VAL MG1 1 46 TRP HE3 3.750 . 3.750 3.367 3.195 3.503 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1260 1 34 VAL MG1 1 46 TRP HZ3 4.850 . 4.850 4.752 4.575 4.877 0.027 5 0 "[ . 1 . 2 . 3 . 4]" 1
1261 1 34 VAL MG1 1 48 CYS HA 4.520 . 4.520 3.937 3.827 4.041 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1262 1 34 VAL MG1 1 48 CYS HB3 5.290 . 5.290 4.557 4.421 4.687 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1263 1 34 VAL MG1 1 48 CYS HG 4.090 . 4.090 3.731 3.621 3.845 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1264 1 34 VAL MG1 1 64 ILE HG13 4.780 . 4.780 4.699 4.522 4.799 0.019 3 0 "[ . 1 . 2 . 3 . 4]" 1
1265 1 34 VAL MG2 1 35 LEU H 4.220 . 4.220 4.079 4.041 4.133 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1266 1 34 VAL MG2 1 46 TRP HB2 5.170 . 5.170 4.259 4.178 4.388 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1267 1 34 VAL MG2 1 46 TRP HB3 4.360 . 4.360 3.688 3.587 3.851 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1268 1 34 VAL MG2 1 46 TRP HE3 3.750 . 3.750 3.044 2.822 3.294 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1269 1 34 VAL MG2 1 46 TRP HZ3 4.850 . 4.850 4.039 3.787 4.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1270 1 34 VAL MG2 1 48 CYS HA 4.520 . 4.520 4.076 3.968 4.204 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1271 1 34 VAL MG2 1 48 CYS HB3 5.290 . 5.290 3.459 3.279 3.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1272 1 34 VAL MG2 1 48 CYS HG 4.090 . 4.090 3.849 3.797 3.939 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1273 1 34 VAL MG2 1 64 ILE HG13 4.780 . 4.780 4.536 4.409 4.626 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1274 1 35 LEU H 1 35 LEU HB2 3.780 . 3.780 2.392 2.373 2.423 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1275 1 35 LEU H 1 35 LEU HB3 3.860 . 3.860 3.603 3.588 3.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1276 1 35 LEU H 1 35 LEU MD1 3.910 . 3.910 3.572 3.522 3.640 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1277 1 35 LEU H 1 35 LEU QD 3.310 . 3.310 3.218 3.183 3.249 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1278 1 35 LEU H 1 35 LEU MD2 3.910 . 3.910 3.657 3.565 3.705 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1279 1 35 LEU H 1 35 LEU HG 3.480 . 3.480 2.525 2.451 2.587 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1280 1 35 LEU H 1 36 GLU H 3.030 . 3.030 2.277 2.244 2.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1281 1 35 LEU H 1 47 LEU HB3 4.830 . 4.830 3.640 3.582 3.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1282 1 35 LEU H 1 47 LEU MD1 4.910 . 4.910 4.935 4.876 4.964 0.054 19 0 "[ . 1 . 2 . 3 . 4]" 1
1283 1 35 LEU H 1 47 LEU MD2 4.910 . 4.910 4.467 4.370 4.577 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1284 1 35 LEU H 1 48 CYS HA 3.550 . 3.550 2.421 2.364 2.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1285 1 35 LEU H 1 48 CYS HB3 4.940 . 4.940 4.414 4.363 4.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1286 1 35 LEU H 1 48 CYS HG 4.840 . 4.840 4.583 4.498 4.668 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1287 1 35 LEU H 1 49 SER H 4.750 . 4.750 4.447 4.364 4.507 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1288 1 35 LEU HA 1 35 LEU MD1 4.060 . 4.060 3.850 3.835 3.866 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1289 1 35 LEU HA 1 35 LEU QD 2.730 . 2.730 2.125 2.103 2.149 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1290 1 35 LEU HA 1 35 LEU MD2 4.060 . 4.060 2.135 2.113 2.160 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1291 1 35 LEU HA 1 35 LEU HG 3.830 . 3.830 3.057 3.025 3.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1292 1 35 LEU HB2 1 35 LEU MD1 3.380 . 3.380 2.269 2.240 2.295 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1293 1 35 LEU HB2 1 35 LEU QD 2.840 . 2.840 2.226 2.201 2.249 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1294 1 35 LEU HB2 1 35 LEU MD2 3.380 . 3.380 3.231 3.219 3.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1295 1 35 LEU HB2 1 36 GLU H 3.410 . 3.410 2.435 2.376 2.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1296 1 35 LEU HB2 1 47 LEU H 5.500 . 5.500 4.789 4.709 4.868 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1297 1 35 LEU HB2 1 47 LEU HB3 4.400 . 4.400 2.750 2.676 2.815 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1298 1 35 LEU HB2 1 47 LEU QD 4.410 . 4.410 2.558 2.444 2.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1299 1 35 LEU HB2 1 47 LEU HG 3.940 . 3.940 2.240 2.196 2.296 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1300 1 35 LEU HB3 1 35 LEU MD1 3.500 . 3.500 2.355 2.320 2.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1301 1 35 LEU HB3 1 35 LEU QD 2.880 . 2.880 2.101 2.088 2.111 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1302 1 35 LEU HB3 1 35 LEU MD2 3.500 . 3.500 2.363 2.335 2.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1303 1 35 LEU HB3 1 36 GLU H 4.140 . 4.140 3.551 3.482 3.618 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1304 1 35 LEU HB3 1 47 LEU HB3 5.060 . 5.060 4.151 4.033 4.263 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1305 1 35 LEU QD 1 36 GLU H 3.860 . 3.860 3.961 3.933 3.993 0.133 34 0 "[ . 1 . 2 . 3 . 4]" 1
1306 1 35 LEU QD 1 36 GLU HB3 5.440 . 5.440 4.896 4.845 4.957 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1307 1 35 LEU QD 1 36 GLU QG 4.850 . 4.850 4.601 4.433 4.736 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1308 1 35 LEU QD 1 47 LEU H 5.440 . 5.440 5.482 5.448 5.509 0.069 27 0 "[ . 1 . 2 . 3 . 4]" 1
1309 1 35 LEU QD 1 47 LEU HA 4.470 . 4.470 4.590 4.536 4.643 0.173 32 0 "[ . 1 . 2 . 3 . 4]" 1
1310 1 35 LEU QD 1 47 LEU HB2 4.720 . 4.720 4.607 4.574 4.639 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1311 1 35 LEU QD 1 47 LEU HB3 4.310 . 4.310 3.861 3.818 3.900 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1312 1 35 LEU QD 1 47 LEU QD 2.640 . 2.640 2.457 2.413 2.517 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1313 1 35 LEU QD 1 48 CYS H 4.180 . 4.180 4.055 3.945 4.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1314 1 35 LEU QD 1 48 CYS HA 3.460 . 3.460 3.270 3.135 3.388 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1315 1 35 LEU QD 1 49 SER H 3.850 . 3.850 3.682 3.563 3.802 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1316 1 35 LEU QD 1 49 SER HA 4.120 . 4.120 3.927 3.801 4.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1317 1 35 LEU QD 1 49 SER HB2 3.330 . 3.330 3.138 3.005 3.245 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1318 1 35 LEU QD 1 49 SER HB3 3.230 . 3.230 2.350 2.221 2.451 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1319 1 35 LEU QD 1 54 GLN HA 4.130 . 4.130 3.920 3.836 4.004 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1320 1 35 LEU QD 1 54 GLN HB2 4.900 . 4.900 4.317 4.283 4.342 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1321 1 35 LEU QD 1 54 GLN HB3 3.930 . 3.930 3.929 3.739 4.023 0.093 27 0 "[ . 1 . 2 . 3 . 4]" 1
1322 1 35 LEU QD 1 54 GLN QE 3.330 . 3.330 2.814 2.590 3.020 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1323 1 35 LEU QD 1 54 GLN QG 2.870 . 2.870 2.073 2.022 2.125 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1324 1 35 LEU QD 1 55 GLY H 4.390 . 4.390 4.125 4.031 4.247 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1325 1 35 LEU MD1 1 36 GLU H 4.750 . 4.750 4.261 4.222 4.309 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1326 1 35 LEU MD1 1 48 CYS HA 4.280 . 4.280 3.390 3.221 3.543 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1327 1 35 LEU MD1 1 49 SER H 4.700 . 4.700 3.950 3.789 4.123 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1328 1 35 LEU MD1 1 49 SER HB2 4.470 . 4.470 3.237 3.080 3.367 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1329 1 35 LEU MD1 1 49 SER HB3 3.890 . 3.890 2.451 2.291 2.576 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1330 1 35 LEU MD1 1 54 GLN HG2 4.570 . 4.570 2.152 2.074 2.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1331 1 35 LEU MD1 1 54 GLN HG3 4.570 . 4.570 2.759 2.630 2.868 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1332 1 35 LEU MD2 1 36 GLU H 4.750 . 4.750 4.708 4.668 4.728 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1333 1 35 LEU MD2 1 48 CYS HA 4.280 . 4.280 4.302 4.240 4.352 0.072 12 0 "[ . 1 . 2 . 3 . 4]" 1
1334 1 35 LEU MD2 1 49 SER H 4.700 . 4.700 4.401 4.334 4.482 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1335 1 35 LEU MD2 1 49 SER HB2 4.470 . 4.470 4.222 4.132 4.347 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1336 1 35 LEU MD2 1 49 SER HB3 3.890 . 3.890 3.023 2.948 3.157 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1337 1 35 LEU MD2 1 54 GLN HG2 4.570 . 4.570 4.464 4.281 4.573 0.003 27 0 "[ . 1 . 2 . 3 . 4]" 1
1338 1 35 LEU MD2 1 54 GLN HG3 4.570 . 4.570 4.552 4.499 4.599 0.029 29 0 "[ . 1 . 2 . 3 . 4]" 1
1339 1 35 LEU HG 1 36 GLU H 4.470 . 4.470 4.234 4.180 4.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1340 1 35 LEU HG 1 48 CYS H 5.280 . 5.280 4.992 4.906 5.059 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1341 1 35 LEU HG 1 48 CYS HA 3.650 . 3.650 2.720 2.642 2.777 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1342 1 35 LEU HG 1 49 SER H 4.000 . 4.000 3.505 3.412 3.607 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1343 1 35 LEU HG 1 49 SER HB2 4.890 . 4.890 4.669 4.604 4.822 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1344 1 35 LEU HG 1 49 SER HB3 4.870 . 4.870 3.051 2.971 3.218 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1345 1 35 LEU HG 1 54 GLN QG 4.470 . 4.470 3.997 3.919 4.085 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1346 1 36 GLU H 1 36 GLU HB2 4.170 . 4.170 4.052 4.028 4.070 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1347 1 36 GLU H 1 36 GLU HB3 4.060 . 4.060 3.308 3.250 3.375 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1348 1 36 GLU H 1 36 GLU HG2 4.500 . 4.500 2.847 2.745 2.940 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1349 1 36 GLU H 1 36 GLU QG 3.880 . 3.880 2.777 2.676 2.855 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1350 1 36 GLU H 1 36 GLU HG3 4.500 . 4.500 3.867 3.581 4.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1351 1 36 GLU H 1 37 ARG H 4.470 . 4.470 4.413 4.395 4.440 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1352 1 36 GLU H 1 37 ARG HA 5.050 . 5.050 4.625 4.573 4.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1353 1 36 GLU H 1 39 THR HB 5.240 . 5.240 4.617 4.455 4.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1354 1 36 GLU H 1 46 TRP HA 5.490 . 5.490 4.876 4.781 4.999 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1355 1 36 GLU H 1 47 LEU H 3.570 . 3.570 3.200 3.096 3.292 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1356 1 36 GLU H 1 47 LEU HA 4.770 . 4.770 4.623 4.567 4.719 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1357 1 36 GLU H 1 47 LEU HB2 4.280 . 4.280 3.935 3.868 4.034 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1358 1 36 GLU H 1 47 LEU HB3 3.290 . 3.290 2.222 2.170 2.320 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1359 1 36 GLU H 1 47 LEU MD1 4.750 . 4.750 4.802 4.772 4.851 0.101 12 0 "[ . 1 . 2 . 3 . 4]" 1
1360 1 36 GLU H 1 47 LEU QD 3.670 . 3.670 3.438 3.369 3.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1361 1 36 GLU H 1 47 LEU MD2 4.750 . 4.750 3.523 3.442 3.615 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1362 1 36 GLU H 1 47 LEU HG 4.870 . 4.870 3.687 3.631 3.744 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1363 1 36 GLU H 1 48 CYS HA 4.300 . 4.300 4.294 4.253 4.314 0.014 12 0 "[ . 1 . 2 . 3 . 4]" 1
1364 1 36 GLU HA 1 36 GLU HG2 4.070 . 4.070 3.758 3.724 3.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1365 1 36 GLU HA 1 36 GLU HG3 4.070 . 4.070 3.708 3.649 3.763 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1366 1 36 GLU HA 1 37 ARG H 2.750 . 2.750 2.549 2.506 2.576 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1367 1 36 GLU HA 1 37 ARG HA 5.050 . 5.050 4.496 4.465 4.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1368 1 36 GLU HA 1 37 ARG HG2 4.930 . 4.930 4.623 4.501 4.753 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1369 1 36 GLU HA 1 47 LEU H 5.010 . 5.010 4.908 4.815 5.006 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1370 1 36 GLU HA 1 47 LEU QD 5.440 . 5.440 4.989 4.903 5.059 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1371 1 36 GLU HB2 1 37 ARG H 3.780 . 3.780 2.376 2.292 2.433 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1372 1 36 GLU HB2 1 39 THR H 5.500 . 5.500 5.497 5.419 5.514 0.014 32 0 "[ . 1 . 2 . 3 . 4]" 1
1373 1 36 GLU HB2 1 39 THR HA 5.120 . 5.120 4.665 4.466 4.786 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1374 1 36 GLU HB2 1 39 THR HB 4.660 . 4.660 4.306 4.249 4.352 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1375 1 36 GLU HB2 1 39 THR MG 5.500 . 5.500 5.521 5.483 5.574 0.074 34 0 "[ . 1 . 2 . 3 . 4]" 1
1376 1 36 GLU HB2 1 47 LEU H 5.270 . 5.270 5.152 5.080 5.211 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1377 1 36 GLU HB2 1 47 LEU HB3 4.600 . 4.600 4.626 4.613 4.649 0.049 39 0 "[ . 1 . 2 . 3 . 4]" 1
1378 1 36 GLU HB3 1 37 ARG H 4.110 . 4.110 3.816 3.760 3.861 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1379 1 36 GLU HB3 1 39 THR HA 5.500 . 5.500 5.463 5.251 5.516 0.016 10 0 "[ . 1 . 2 . 3 . 4]" 1
1380 1 36 GLU HB3 1 39 THR HB 5.070 . 5.070 4.585 4.521 4.638 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1381 1 36 GLU HB3 1 39 THR MG 5.500 . 5.500 5.715 5.622 5.784 0.284 24 0 "[ . 1 . 2 . 3 . 4]" 1
1382 1 36 GLU HB3 1 47 LEU H 5.500 . 5.500 5.201 5.103 5.314 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1383 1 36 GLU HB3 1 47 LEU HB2 5.460 . 5.460 5.048 4.921 5.156 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1384 1 36 GLU HB3 1 47 LEU QD 3.970 . 3.970 3.507 3.360 3.624 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1385 1 36 GLU HB3 1 47 LEU HG 5.500 . 5.500 5.442 5.308 5.511 0.011 32 0 "[ . 1 . 2 . 3 . 4]" 1
1386 1 36 GLU QG 1 37 ARG H 4.020 . 4.020 2.880 2.754 3.024 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1387 1 36 GLU QG 1 39 THR H 4.870 . 4.870 3.393 3.311 3.484 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1388 1 36 GLU QG 1 39 THR HA 3.910 . 3.910 2.833 2.613 3.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1389 1 36 GLU QG 1 39 THR MG 4.330 . 4.330 3.267 3.216 3.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1390 1 36 GLU QG 1 47 LEU HB3 4.520 . 4.520 1.964 1.928 2.007 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1391 1 36 GLU QG 1 47 LEU QD 3.270 . 3.270 2.390 2.249 2.522 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1392 1 36 GLU QG 1 47 LEU HG 4.650 . 4.650 3.920 3.740 4.020 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1393 1 36 GLU HG2 1 37 ARG H 4.770 . 4.770 4.108 3.980 4.289 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1394 1 36 GLU HG2 1 39 THR HA 4.550 . 4.550 4.100 3.880 4.377 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1395 1 36 GLU HG2 1 39 THR HB 4.630 . 4.630 2.432 2.266 2.702 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1396 1 36 GLU HG2 1 39 THR MG 4.980 . 4.980 3.748 3.589 3.923 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1397 1 36 GLU HG2 1 47 LEU H 5.060 . 5.060 3.291 3.138 3.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1398 1 36 GLU HG2 1 47 LEU HB2 4.910 . 4.910 2.673 2.570 2.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1399 1 36 GLU HG3 1 37 ARG H 4.770 . 4.770 2.941 2.807 3.108 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1400 1 36 GLU HG3 1 39 THR HA 4.550 . 4.550 2.888 2.657 3.164 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1401 1 36 GLU HG3 1 39 THR HB 4.630 . 4.630 1.991 1.908 2.073 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1402 1 36 GLU HG3 1 39 THR MG 4.980 . 4.980 3.603 3.497 3.657 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1403 1 36 GLU HG3 1 47 LEU H 5.060 . 5.060 3.500 3.169 3.699 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1404 1 36 GLU HG3 1 47 LEU HB2 4.910 . 4.910 3.652 3.379 3.831 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1405 1 37 ARG H 1 37 ARG HB2 3.330 . 3.330 2.656 2.574 2.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1406 1 37 ARG H 1 37 ARG HB3 3.820 . 3.820 3.794 3.745 3.821 0.001 30 0 "[ . 1 . 2 . 3 . 4]" 1
1407 1 37 ARG H 1 37 ARG HD2 5.490 . 5.490 5.389 5.235 5.481 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1408 1 37 ARG H 1 37 ARG HD3 5.390 . 5.390 5.365 5.254 5.410 0.020 24 0 "[ . 1 . 2 . 3 . 4]" 1
1409 1 37 ARG H 1 37 ARG HG2 3.920 . 3.920 3.924 3.872 3.942 0.022 11 0 "[ . 1 . 2 . 3 . 4]" 1
1410 1 37 ARG H 1 37 ARG HG3 3.980 . 3.980 3.035 2.973 3.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1411 1 37 ARG H 1 38 ASP H 4.550 . 4.550 4.399 4.367 4.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1412 1 37 ARG H 1 47 LEU H 5.040 . 5.040 4.627 4.582 4.692 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1413 1 37 ARG HA 1 37 ARG HD2 4.520 . 4.520 4.247 4.186 4.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1414 1 37 ARG HA 1 37 ARG HD3 4.980 . 4.980 4.889 4.758 4.993 0.013 25 0 "[ . 1 . 2 . 3 . 4]" 1
1415 1 37 ARG HA 1 37 ARG HG2 4.060 . 4.060 2.581 2.488 2.690 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1416 1 37 ARG HA 1 37 ARG HG3 3.930 . 3.930 3.307 3.207 3.382 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1417 1 37 ARG HA 1 38 ASP H 3.190 . 3.190 2.272 2.240 2.303 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1418 1 37 ARG HA 1 38 ASP HA 4.460 . 4.460 4.420 4.392 4.457 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1419 1 37 ARG HA 1 39 THR H 4.170 . 4.170 3.385 3.272 3.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1420 1 37 ARG HA 1 39 THR MG 4.680 . 4.680 3.919 3.779 4.135 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1421 1 37 ARG HA 1 46 TRP HA 3.860 . 3.860 2.042 2.002 2.109 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1422 1 37 ARG HA 1 46 TRP HB2 5.050 . 5.050 4.410 4.287 4.490 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1423 1 37 ARG HA 1 46 TRP HB3 4.970 . 4.970 3.221 3.052 3.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1424 1 37 ARG HA 1 46 TRP HD1 3.760 . 3.760 2.696 2.611 2.808 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1425 1 37 ARG HA 1 46 TRP HE1 4.620 . 4.620 4.390 4.276 4.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1426 1 37 ARG HA 1 47 LEU H 4.370 . 4.370 3.035 2.922 3.105 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1427 1 37 ARG HB2 1 37 ARG HD2 3.750 . 3.750 3.251 3.039 3.436 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1428 1 37 ARG HB2 1 37 ARG HD3 4.060 . 4.060 3.733 3.600 3.791 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1429 1 37 ARG HB2 1 38 ASP H 4.100 . 4.100 3.802 3.697 3.892 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1430 1 37 ARG HB2 1 46 TRP HD1 5.020 . 5.020 4.520 4.458 4.588 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1431 1 37 ARG HB2 1 46 TRP HE1 4.740 . 4.740 4.586 4.504 4.677 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1432 1 37 ARG HB3 1 37 ARG HD2 3.700 . 3.700 2.492 2.359 2.662 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1433 1 37 ARG HB3 1 37 ARG HD3 3.830 . 3.830 3.672 3.613 3.699 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1434 1 37 ARG HB3 1 38 ASP H 3.900 . 3.900 2.778 2.707 2.912 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1435 1 37 ARG HB3 1 46 TRP HA 4.810 . 4.810 4.018 3.904 4.110 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1436 1 37 ARG HB3 1 46 TRP HB3 5.320 . 5.320 4.569 4.458 4.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1437 1 37 ARG HB3 1 46 TRP HD1 4.410 . 4.410 2.932 2.864 2.994 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1438 1 37 ARG HB3 1 46 TRP HE1 4.280 . 4.280 2.897 2.820 2.981 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1439 1 37 ARG HB3 1 47 LEU H 5.500 . 5.500 5.464 5.345 5.511 0.011 21 0 "[ . 1 . 2 . 3 . 4]" 1
1440 1 37 ARG HD2 1 38 ASP H 5.500 . 5.500 5.056 4.966 5.198 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1441 1 37 ARG HD2 1 46 TRP HE1 4.580 . 4.580 3.360 3.242 3.489 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1442 1 37 ARG HD2 1 46 TRP HH2 4.820 . 4.820 4.250 4.014 4.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1443 1 37 ARG HD2 1 46 TRP HZ2 4.150 . 4.150 3.280 3.138 3.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1444 1 37 ARG HD2 1 64 ILE MD 4.580 . 4.580 3.719 3.247 4.276 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1445 1 37 ARG HD3 1 46 TRP HE1 5.220 . 5.220 5.077 4.937 5.197 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1446 1 37 ARG HD3 1 46 TRP HH2 4.980 . 4.980 4.833 4.533 4.992 0.012 25 0 "[ . 1 . 2 . 3 . 4]" 1
1447 1 37 ARG HD3 1 46 TRP HZ2 4.890 . 4.890 4.654 4.442 4.795 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1448 1 37 ARG HD3 1 64 ILE MD 3.960 . 3.960 2.957 2.501 3.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1449 1 37 ARG HG2 1 38 ASP H 4.850 . 4.850 4.337 4.233 4.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1450 1 37 ARG HG2 1 46 TRP HE1 5.040 . 5.040 4.338 4.248 4.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1451 1 37 ARG HG2 1 47 LEU H 5.140 . 5.140 4.716 4.444 4.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1452 1 37 ARG HG2 1 64 ILE MD 4.530 . 4.530 3.710 3.535 3.896 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1453 1 37 ARG HG3 1 38 ASP H 5.480 . 5.480 5.111 5.061 5.175 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1454 1 37 ARG HG3 1 46 TRP HE1 5.500 . 5.500 5.508 5.485 5.531 0.031 30 0 "[ . 1 . 2 . 3 . 4]" 1
1455 1 37 ARG HG3 1 64 ILE MD 5.500 . 5.500 4.328 4.076 4.656 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1456 1 38 ASP H 1 39 THR H 3.410 . 3.410 2.491 2.431 2.538 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1457 1 38 ASP H 1 39 THR HA 5.330 . 5.330 5.014 4.941 5.059 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1458 1 38 ASP H 1 39 THR HB 5.500 . 5.500 4.633 4.520 4.708 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1459 1 38 ASP H 1 39 THR MG 4.260 . 4.260 3.618 3.537 3.737 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1460 1 38 ASP H 1 42 LEU HB2 5.500 . 5.500 5.446 5.311 5.509 0.009 12 0 "[ . 1 . 2 . 3 . 4]" 1
1461 1 38 ASP H 1 43 ASP HA 5.470 . 5.470 4.749 4.256 4.985 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1462 1 38 ASP H 1 44 GLY H 4.760 . 4.760 3.992 3.802 4.255 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1463 1 38 ASP H 1 45 TRP H 4.580 . 4.580 3.927 3.823 4.109 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1464 1 38 ASP H 1 46 TRP H 5.010 . 5.010 4.700 4.606 4.872 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1465 1 38 ASP H 1 46 TRP HA 3.770 . 3.770 2.794 2.614 2.943 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1466 1 38 ASP H 1 46 TRP HB2 5.410 . 5.410 5.263 5.053 5.438 0.028 4 0 "[ . 1 . 2 . 3 . 4]" 1
1467 1 38 ASP H 1 46 TRP HD1 3.170 . 3.170 1.995 1.761 2.234 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1468 1 38 ASP H 1 46 TRP HE1 3.950 . 3.950 3.634 3.397 3.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1469 1 38 ASP H 1 47 LEU H 4.790 . 4.790 4.343 4.202 4.516 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1470 1 38 ASP HA 1 39 THR H 3.200 . 3.200 2.700 2.653 2.746 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1471 1 38 ASP HA 1 39 THR MG 3.940 . 3.940 3.944 3.904 3.969 0.029 25 0 "[ . 1 . 2 . 3 . 4]" 1
1472 1 38 ASP HA 1 42 LEU H 4.820 . 4.820 4.049 3.709 4.188 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1473 1 38 ASP HA 1 43 ASP HA 4.770 . 4.770 2.886 2.592 3.144 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1474 1 38 ASP HA 1 44 GLY H 3.920 . 3.920 3.122 2.998 3.752 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1475 1 38 ASP HA 1 45 TRP H 3.600 . 3.600 3.145 3.036 3.608 0.008 4 0 "[ . 1 . 2 . 3 . 4]" 1
1476 1 38 ASP HA 1 46 TRP HD1 4.100 . 4.100 3.763 3.458 4.119 0.019 37 0 "[ . 1 . 2 . 3 . 4]" 1
1477 1 38 ASP QB 1 39 THR H 4.250 . 4.250 3.875 3.853 3.935 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1478 1 38 ASP QB 1 42 LEU H 5.210 . 5.210 4.615 4.484 5.002 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1479 1 38 ASP QB 1 43 ASP H 5.000 . 5.000 4.619 4.422 5.099 0.099 37 0 "[ . 1 . 2 . 3 . 4]" 1
1480 1 38 ASP QB 1 43 ASP HA 3.880 . 3.880 2.663 2.395 3.069 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1481 1 38 ASP QB 1 44 GLY H 4.360 . 4.360 3.555 3.390 3.816 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1482 1 38 ASP HB2 1 39 THR H 4.850 . 4.850 4.232 4.176 4.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1483 1 38 ASP HB2 1 43 ASP HA 4.650 . 4.650 4.260 3.031 4.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1484 1 38 ASP HB3 1 39 THR H 4.850 . 4.850 4.502 4.295 4.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1485 1 38 ASP HB3 1 43 ASP HA 4.650 . 4.650 2.755 2.412 4.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1486 1 39 THR H 1 39 THR HB 3.210 . 3.210 2.589 2.544 2.684 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1487 1 39 THR H 1 39 THR MG 2.710 . 2.710 1.927 1.868 1.963 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1488 1 39 THR H 1 40 GLN H 4.650 . 4.650 4.633 4.590 4.647 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1489 1 39 THR H 1 42 LEU H 4.830 . 4.830 4.271 4.044 4.362 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1490 1 39 THR H 1 42 LEU HB2 5.180 . 5.180 4.117 3.989 4.199 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1491 1 39 THR H 1 42 LEU MD1 4.910 . 4.910 4.808 4.696 4.925 0.015 36 0 "[ . 1 . 2 . 3 . 4]" 1
1492 1 39 THR H 1 45 TRP H 5.500 . 5.500 4.607 4.493 4.769 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1493 1 39 THR H 1 45 TRP HB2 5.330 . 5.330 4.140 3.990 4.295 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1494 1 39 THR H 1 46 TRP H 5.480 . 5.480 5.330 5.250 5.436 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1495 1 39 THR H 1 46 TRP HA 3.710 . 3.710 3.363 3.242 3.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1496 1 39 THR H 1 46 TRP HD1 4.430 . 4.430 4.046 3.855 4.241 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1497 1 39 THR H 1 47 LEU H 4.270 . 4.270 3.732 3.657 3.799 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1498 1 39 THR H 1 47 LEU HB2 4.900 . 4.900 4.566 4.488 4.625 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1499 1 39 THR H 1 47 LEU HB3 5.310 . 5.310 5.224 5.160 5.296 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1500 1 39 THR H 1 56 ILE MG 4.800 . 4.800 4.784 4.696 4.822 0.022 26 0 "[ . 1 . 2 . 3 . 4]" 1
1501 1 39 THR HA 1 39 THR MG 3.350 . 3.350 3.227 3.217 3.237 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1502 1 39 THR HA 1 40 GLN H 2.830 . 2.830 2.220 2.165 2.256 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1503 1 39 THR HA 1 40 GLN HB2 5.500 . 5.500 5.114 5.051 5.202 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1504 1 39 THR HA 1 40 GLN HG2 4.810 . 4.810 4.673 4.443 4.827 0.017 24 0 "[ . 1 . 2 . 3 . 4]" 1
1505 1 39 THR HA 1 40 GLN HG3 4.600 . 4.600 4.240 4.104 4.411 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1506 1 39 THR HA 1 41 GLY H 4.490 . 4.490 3.315 3.235 3.381 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1507 1 39 THR HA 1 47 LEU H 5.500 . 5.500 5.199 5.015 5.310 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1508 1 39 THR HA 1 47 LEU HB2 5.090 . 5.090 4.770 4.522 4.946 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1509 1 39 THR HB 1 40 GLN H 3.980 . 3.980 3.967 3.920 3.991 0.011 4 0 "[ . 1 . 2 . 3 . 4]" 1
1510 1 39 THR HB 1 46 TRP HA 5.070 . 5.070 4.136 3.995 4.296 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1511 1 39 THR HB 1 47 LEU H 3.770 . 3.770 2.955 2.787 3.092 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1512 1 39 THR HB 1 47 LEU HB2 4.360 . 4.360 2.457 2.284 2.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1513 1 39 THR HB 1 47 LEU HB3 4.410 . 4.410 3.166 3.019 3.272 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1514 1 39 THR HB 1 47 LEU MD1 4.410 . 4.410 4.352 4.212 4.427 0.017 9 0 "[ . 1 . 2 . 3 . 4]" 1
1515 1 39 THR HB 1 47 LEU QD 3.800 . 3.800 3.387 3.298 3.466 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1516 1 39 THR HB 1 47 LEU MD2 4.410 . 4.410 3.533 3.418 3.627 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1517 1 39 THR MG 1 40 GLN H 3.980 . 3.980 3.841 3.783 3.940 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1518 1 39 THR MG 1 40 GLN HA 5.350 . 5.350 4.993 4.898 5.123 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1519 1 39 THR MG 1 40 GLN HB2 4.190 . 4.190 3.704 3.513 3.949 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1520 1 39 THR MG 1 40 GLN HB3 5.250 . 5.250 4.947 4.803 5.114 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1521 1 39 THR MG 1 40 GLN HE21 4.900 . 4.900 4.709 4.404 4.919 0.019 1 0 "[ . 1 . 2 . 3 . 4]" 1
1522 1 39 THR MG 1 40 GLN HE22 4.060 . 4.060 3.298 3.052 4.077 0.017 25 0 "[ . 1 . 2 . 3 . 4]" 1
1523 1 39 THR MG 1 40 GLN HG2 4.040 . 4.040 4.056 3.965 4.089 0.049 30 0 "[ . 1 . 2 . 3 . 4]" 1
1524 1 39 THR MG 1 40 GLN HG3 3.630 . 3.630 2.654 2.459 2.756 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1525 1 39 THR MG 1 41 GLY H 4.990 . 4.990 4.533 4.401 4.648 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1526 1 39 THR MG 1 42 LEU H 4.010 . 4.010 3.851 3.830 3.873 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1527 1 39 THR MG 1 42 LEU HA 5.500 . 5.500 5.559 5.510 5.588 0.088 34 0 "[ . 1 . 2 . 3 . 4]" 1
1528 1 39 THR MG 1 42 LEU HB2 3.810 . 3.810 3.044 2.988 3.118 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1529 1 39 THR MG 1 42 LEU HB3 4.620 . 4.620 4.398 4.337 4.469 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1530 1 39 THR MG 1 42 LEU MD1 2.960 . 2.960 2.552 2.448 2.636 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1531 1 39 THR MG 1 42 LEU HG 4.330 . 4.330 4.113 4.032 4.187 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1532 1 39 THR MG 1 45 TRP H 5.140 . 5.140 4.523 4.416 4.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1533 1 39 THR MG 1 45 TRP HB2 3.720 . 3.720 3.312 3.173 3.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1534 1 39 THR MG 1 45 TRP HB3 3.590 . 3.590 3.047 2.893 3.180 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1535 1 39 THR MG 1 45 TRP HE3 5.090 . 5.090 4.939 4.813 5.100 0.010 8 0 "[ . 1 . 2 . 3 . 4]" 1
1536 1 39 THR MG 1 46 TRP H 4.540 . 4.540 4.127 3.928 4.294 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1537 1 39 THR MG 1 46 TRP HA 3.600 . 3.600 3.001 2.804 3.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1538 1 39 THR MG 1 46 TRP HD1 5.080 . 5.080 4.338 4.159 4.525 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1539 1 39 THR MG 1 47 LEU H 3.430 . 3.430 2.682 2.575 2.820 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1540 1 39 THR MG 1 47 LEU HA 3.710 . 3.710 3.008 2.841 3.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1541 1 39 THR MG 1 47 LEU HB2 3.340 . 3.340 2.088 2.044 2.138 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1542 1 39 THR MG 1 47 LEU HB3 3.760 . 3.760 3.464 3.411 3.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1543 1 39 THR MG 1 47 LEU QD 3.470 . 3.470 2.904 2.827 3.004 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1544 1 39 THR MG 1 47 LEU HG 4.810 . 4.810 4.678 4.626 4.746 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1545 1 39 THR MG 1 48 CYS H 5.170 . 5.170 4.897 4.765 5.046 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1546 1 39 THR MG 1 56 ILE H 5.030 . 5.030 4.936 4.861 5.057 0.027 25 0 "[ . 1 . 2 . 3 . 4]" 1
1547 1 39 THR MG 1 56 ILE HA 4.020 . 4.020 3.438 3.266 3.597 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1548 1 39 THR MG 1 56 ILE HB 3.760 . 3.760 3.412 3.304 3.532 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1549 1 39 THR MG 1 56 ILE MD 4.260 . 4.260 4.055 3.940 4.138 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1550 1 39 THR MG 1 56 ILE MG 2.600 . 2.600 2.051 1.999 2.119 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1551 1 39 THR MG 1 57 VAL H 4.480 . 4.480 4.300 4.155 4.447 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1552 1 40 GLN H 1 40 GLN HA 2.760 . 2.760 2.265 2.257 2.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1553 1 40 GLN H 1 40 GLN HB2 3.860 . 3.860 3.776 3.737 3.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1554 1 40 GLN H 1 40 GLN HB3 4.150 . 4.150 3.973 3.922 4.009 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1555 1 40 GLN H 1 40 GLN HG2 3.700 . 3.700 2.908 2.804 3.081 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1556 1 40 GLN H 1 40 GLN HG3 3.430 . 3.430 3.157 3.062 3.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1557 1 40 GLN H 1 41 GLY H 3.310 . 3.310 2.821 2.768 2.856 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1558 1 40 GLN H 1 42 LEU H 4.440 . 4.440 4.265 4.246 4.288 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1559 1 40 GLN H 1 42 LEU HG 5.150 . 5.150 5.169 5.156 5.194 0.044 24 0 "[ . 1 . 2 . 3 . 4]" 1
1560 1 40 GLN HA 1 40 GLN HG2 3.580 . 3.580 2.668 2.591 2.790 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1561 1 40 GLN HA 1 40 GLN HG3 3.780 . 3.780 3.503 3.410 3.580 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1562 1 40 GLN HA 1 41 GLY H 3.250 . 3.250 3.149 3.063 3.197 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1563 1 40 GLN HA 1 42 LEU H 4.730 . 4.730 4.412 4.352 4.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1564 1 40 GLN HA 1 42 LEU MD1 4.820 . 4.820 4.872 4.843 4.907 0.087 2 0 "[ . 1 . 2 . 3 . 4]" 1
1565 1 40 GLN HB2 1 40 GLN HE22 5.100 . 5.100 3.592 3.182 4.460 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1566 1 40 GLN HB2 1 41 GLY H 4.520 . 4.520 3.930 3.804 4.034 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1567 1 40 GLN HB2 1 42 LEU H 4.170 . 4.170 3.293 3.169 3.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1568 1 40 GLN HB2 1 42 LEU MD1 3.410 . 3.410 2.406 2.358 2.458 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1569 1 40 GLN HB2 1 42 LEU MD2 4.220 . 4.220 3.495 3.414 3.560 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1570 1 40 GLN HB2 1 42 LEU HG 3.840 . 3.840 2.091 2.022 2.159 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1571 1 40 GLN HB3 1 40 GLN HG2 2.980 . 2.980 2.571 2.511 2.619 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1572 1 40 GLN HB3 1 41 GLY H 4.810 . 4.810 4.556 4.516 4.625 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1573 1 40 GLN HB3 1 42 LEU H 5.190 . 5.190 4.639 4.542 4.849 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1574 1 40 GLN HB3 1 42 LEU MD1 4.200 . 4.200 3.631 3.552 3.739 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1575 1 40 GLN HB3 1 42 LEU MD2 4.680 . 4.680 4.355 4.242 4.516 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1576 1 40 GLN HB3 1 42 LEU HG 4.250 . 4.250 3.549 3.419 3.743 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1577 1 40 GLN HE21 1 42 LEU MD1 4.610 . 4.610 3.560 3.285 4.096 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1578 1 40 GLN HE21 1 47 LEU QD 5.440 . 5.440 4.800 4.487 5.133 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1579 1 40 GLN HE21 1 56 ILE MG 4.320 . 4.320 3.454 3.018 3.935 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1580 1 40 GLN HE22 1 42 LEU MD1 4.670 . 4.670 2.957 2.459 4.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1581 1 40 GLN HE22 1 47 LEU MD1 5.280 . 5.280 4.203 3.648 4.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1582 1 40 GLN HE22 1 47 LEU QD 4.630 . 4.630 4.005 3.489 4.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1583 1 40 GLN HE22 1 47 LEU MD2 5.280 . 5.280 5.051 4.343 5.322 0.042 30 0 "[ . 1 . 2 . 3 . 4]" 1
1584 1 40 GLN HE22 1 56 ILE MG 4.850 . 4.850 2.674 2.374 3.967 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1585 1 40 GLN HG2 1 41 GLY H 4.980 . 4.980 4.989 4.957 5.037 0.057 24 0 "[ . 1 . 2 . 3 . 4]" 1
1586 1 40 GLN HG2 1 42 LEU H 5.500 . 5.500 5.511 5.500 5.527 0.027 8 0 "[ . 1 . 2 . 3 . 4]" 1
1587 1 40 GLN HG2 1 42 LEU MD1 4.280 . 4.280 4.248 4.064 4.312 0.032 26 0 "[ . 1 . 2 . 3 . 4]" 1
1588 1 40 GLN HG2 1 42 LEU HG 5.090 . 5.090 5.050 4.954 5.096 0.006 17 0 "[ . 1 . 2 . 3 . 4]" 1
1589 1 40 GLN HG3 1 41 GLY H 4.960 . 4.960 4.750 4.513 4.878 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1590 1 40 GLN HG3 1 42 LEU H 4.970 . 4.970 4.599 4.405 4.705 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1591 1 40 GLN HG3 1 42 LEU MD1 3.510 . 3.510 2.958 2.769 3.085 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1592 1 40 GLN HG3 1 42 LEU MD2 5.200 . 5.200 5.130 4.982 5.218 0.018 26 0 "[ . 1 . 2 . 3 . 4]" 1
1593 1 40 GLN HG3 1 42 LEU HG 4.650 . 4.650 4.064 3.902 4.159 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1594 1 41 GLY H 1 42 LEU H 2.850 . 2.850 2.379 2.295 2.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1595 1 41 GLY H 1 42 LEU MD1 5.160 . 5.160 4.912 4.794 5.070 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1596 1 41 GLY H 1 42 LEU HG 4.630 . 4.630 4.177 4.100 4.327 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1597 1 41 GLY QA 1 43 ASP H 4.810 . 4.810 4.306 4.163 4.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1598 1 42 LEU H 1 42 LEU HB2 3.230 . 3.230 2.426 2.411 2.451 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1599 1 42 LEU H 1 42 LEU HB3 3.710 . 3.710 3.592 3.577 3.609 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1600 1 42 LEU H 1 42 LEU MD1 3.570 . 3.570 3.464 3.412 3.489 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1601 1 42 LEU H 1 42 LEU MD2 3.890 . 3.890 3.638 3.586 3.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1602 1 42 LEU H 1 42 LEU HG 3.010 . 3.010 2.416 2.357 2.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1603 1 42 LEU H 1 43 ASP H 4.180 . 4.180 4.057 3.951 4.192 0.012 24 0 "[ . 1 . 2 . 3 . 4]" 1
1604 1 42 LEU H 1 45 TRP H 5.440 . 5.440 5.173 5.109 5.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1605 1 42 LEU H 1 45 TRP HB2 4.480 . 4.480 4.310 4.279 4.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1606 1 42 LEU H 1 45 TRP HB3 5.500 . 5.500 5.544 5.527 5.563 0.063 17 0 "[ . 1 . 2 . 3 . 4]" 1
1607 1 42 LEU H 1 45 TRP HD1 5.480 . 5.480 5.207 5.119 5.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1608 1 42 LEU HA 1 42 LEU MD1 4.100 . 4.100 3.929 3.913 3.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1609 1 42 LEU HA 1 42 LEU MD2 2.680 . 2.680 2.273 2.217 2.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1610 1 42 LEU HA 1 42 LEU HG 3.910 . 3.910 3.102 3.074 3.136 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1611 1 42 LEU HA 1 43 ASP H 2.650 . 2.650 2.256 2.192 2.312 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1612 1 42 LEU HA 1 43 ASP QB 4.280 . 4.280 4.255 4.096 4.377 0.097 24 0 "[ . 1 . 2 . 3 . 4]" 1
1613 1 42 LEU HB2 1 42 LEU MD1 3.060 . 3.060 2.211 2.174 2.251 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1614 1 42 LEU HB2 1 42 LEU MD2 3.330 . 3.330 3.185 3.156 3.195 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1615 1 42 LEU HB2 1 43 ASP H 4.540 . 4.540 4.445 4.404 4.464 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1616 1 42 LEU HB2 1 45 TRP H 4.250 . 4.250 3.746 3.693 3.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1617 1 42 LEU HB2 1 45 TRP HB2 4.050 . 4.050 2.158 2.131 2.202 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1618 1 42 LEU HB2 1 45 TRP HB3 4.290 . 4.290 3.280 3.247 3.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1619 1 42 LEU HB2 1 45 TRP HD1 4.140 . 4.140 3.326 3.196 3.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1620 1 42 LEU HB2 1 56 ILE MD 4.570 . 4.570 4.292 4.163 4.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1621 1 42 LEU HB3 1 42 LEU MD1 2.980 . 2.980 2.428 2.409 2.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1622 1 42 LEU HB3 1 42 LEU MD2 3.090 . 3.090 2.284 2.256 2.304 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1623 1 42 LEU HB3 1 43 ASP H 4.280 . 4.280 4.048 3.910 4.117 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1624 1 42 LEU HB3 1 45 TRP H 4.360 . 4.360 3.802 3.752 3.881 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1625 1 42 LEU HB3 1 45 TRP HB2 4.080 . 4.080 2.481 2.367 2.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1626 1 42 LEU HB3 1 45 TRP HB3 4.260 . 4.260 3.660 3.561 3.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1627 1 42 LEU HB3 1 45 TRP HD1 3.680 . 3.680 1.956 1.820 2.080 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1628 1 42 LEU HB3 1 45 TRP HE1 4.980 . 4.980 3.958 3.845 4.060 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1629 1 42 LEU HB3 1 94 LEU QD 4.250 . 4.250 2.985 2.882 3.127 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1630 1 42 LEU MD1 1 43 ASP H 5.500 . 5.500 5.571 5.535 5.600 0.100 4 0 "[ . 1 . 2 . 3 . 4]" 1
1631 1 42 LEU MD1 1 45 TRP H 5.020 . 5.020 4.985 4.912 5.048 0.028 36 0 "[ . 1 . 2 . 3 . 4]" 1
1632 1 42 LEU MD1 1 45 TRP HB2 3.710 . 3.710 3.229 3.138 3.316 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1633 1 42 LEU MD1 1 45 TRP HB3 3.920 . 3.920 3.264 3.145 3.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1634 1 42 LEU MD1 1 45 TRP HD1 4.010 . 4.010 3.681 3.470 3.870 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1635 1 42 LEU MD1 1 56 ILE MD 3.090 . 3.090 2.365 2.252 2.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1636 1 42 LEU MD1 1 56 ILE MG 2.910 . 2.910 2.317 2.212 2.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1637 1 42 LEU MD1 1 94 LEU HA 5.040 . 5.040 4.690 4.539 4.870 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1638 1 42 LEU MD1 1 94 LEU QB 5.490 . 5.490 4.736 4.568 4.963 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1639 1 42 LEU MD1 1 94 LEU QD 3.100 . 3.100 2.334 2.207 2.542 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1640 1 42 LEU MD1 1 94 LEU HG 5.500 . 5.500 4.804 4.656 5.049 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1641 1 42 LEU MD1 1 95 PRO HD2 4.630 . 4.630 3.943 3.758 4.069 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1642 1 42 LEU MD1 1 95 PRO HD3 4.200 . 4.200 4.250 4.208 4.310 0.110 26 0 "[ . 1 . 2 . 3 . 4]" 1
1643 1 42 LEU MD1 1 95 PRO HG2 4.920 . 4.920 4.861 4.620 4.975 0.055 33 0 "[ . 1 . 2 . 3 . 4]" 1
1644 1 42 LEU MD1 1 95 PRO QG 4.210 . 4.210 4.104 4.012 4.214 0.004 36 0 "[ . 1 . 2 . 3 . 4]" 1
1645 1 42 LEU MD1 1 95 PRO HG3 4.920 . 4.920 4.429 4.272 4.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1646 1 42 LEU MD2 1 45 TRP H 5.430 . 5.430 5.466 5.437 5.505 0.075 24 0 "[ . 1 . 2 . 3 . 4]" 1
1647 1 42 LEU MD2 1 45 TRP HD1 3.840 . 3.840 3.400 3.215 3.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1648 1 42 LEU MD2 1 56 ILE MD 3.850 . 3.850 3.812 3.590 3.920 0.070 34 0 "[ . 1 . 2 . 3 . 4]" 1
1649 1 42 LEU MD2 1 94 LEU MD1 3.610 . 3.610 4.101 4.012 4.110 0.500 16 0 "[ . 1 . 2 . 3 . 4]" 1
1650 1 42 LEU MD2 1 94 LEU QD 2.940 . 2.940 1.983 1.945 2.030 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1651 1 42 LEU MD2 1 94 LEU MD2 3.610 . 3.610 1.987 1.949 2.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1652 1 42 LEU MD2 1 95 PRO QB 4.340 . 4.340 3.743 3.527 3.932 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1653 1 42 LEU MD2 1 95 PRO HD2 3.150 . 3.150 2.538 2.430 2.665 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1654 1 42 LEU MD2 1 95 PRO HD3 3.180 . 3.180 2.180 2.088 2.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1655 1 42 LEU MD2 1 95 PRO HG2 3.660 . 3.660 3.395 3.183 3.561 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1656 1 42 LEU MD2 1 95 PRO QG 3.170 . 3.170 2.441 2.329 2.563 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1657 1 42 LEU MD2 1 95 PRO HG3 3.660 . 3.660 2.503 2.371 2.633 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1658 1 42 LEU HG 1 43 ASP H 5.170 . 5.170 5.163 5.130 5.187 0.017 24 0 "[ . 1 . 2 . 3 . 4]" 1
1659 1 42 LEU HG 1 94 LEU QD 4.960 . 4.960 4.207 4.125 4.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1660 1 43 ASP H 1 43 ASP QB 2.630 . 2.630 2.262 2.062 2.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1661 1 43 ASP H 1 44 GLY H 4.700 . 4.700 4.608 4.590 4.633 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1662 1 43 ASP H 1 45 TRP H 4.750 . 4.750 4.503 4.375 4.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1663 1 43 ASP H 1 45 TRP HD1 4.740 . 4.740 4.281 4.078 4.478 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1664 1 43 ASP HA 1 44 GLY H 2.840 . 2.840 2.146 2.124 2.186 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1665 1 43 ASP HA 1 45 TRP H 3.760 . 3.760 3.531 3.328 3.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1666 1 43 ASP QB 1 44 GLY H 3.490 . 3.490 3.231 2.847 3.512 0.022 30 0 "[ . 1 . 2 . 3 . 4]" 1
1667 1 43 ASP QB 1 44 GLY HA2 4.640 . 4.640 4.491 4.389 4.738 0.098 26 0 "[ . 1 . 2 . 3 . 4]" 1
1668 1 43 ASP QB 1 45 TRP H 4.520 . 4.520 4.548 4.525 4.619 0.099 37 0 "[ . 1 . 2 . 3 . 4]" 1
1669 1 44 GLY H 1 45 TRP H 3.310 . 3.310 2.886 2.792 3.116 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1670 1 44 GLY H 1 45 TRP HB2 5.310 . 5.310 4.947 4.892 5.194 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1671 1 44 GLY H 1 46 TRP HD1 4.850 . 4.850 4.176 4.017 4.347 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1672 1 44 GLY H 1 46 TRP HE1 4.780 . 4.780 3.753 3.478 4.072 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1673 1 44 GLY HA2 1 59 GLY H 5.190 . 5.190 4.044 3.931 4.236 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1674 1 44 GLY HA2 1 92 PRO HG3 4.230 . 4.230 3.907 3.513 4.231 0.001 13 0 "[ . 1 . 2 . 3 . 4]" 1
1675 1 44 GLY HA3 1 46 TRP HE1 5.500 . 5.500 4.793 4.630 5.344 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1676 1 44 GLY HA3 1 59 GLY H 5.170 . 5.170 4.271 4.182 4.422 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1677 1 44 GLY HA3 1 92 PRO HB2 4.550 . 4.550 3.881 3.318 4.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1678 1 44 GLY HA3 1 92 PRO HB3 4.420 . 4.420 3.440 2.847 3.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1679 1 44 GLY HA3 1 92 PRO HG2 4.560 . 4.560 3.859 2.681 4.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1680 1 44 GLY HA3 1 92 PRO HG3 4.230 . 4.230 2.446 2.126 2.730 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1681 1 45 TRP H 1 45 TRP HB2 3.350 . 3.350 2.200 2.178 2.248 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1682 1 45 TRP H 1 45 TRP HB3 3.620 . 3.620 3.501 3.487 3.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1683 1 45 TRP H 1 45 TRP HD1 3.740 . 3.740 3.090 2.848 3.290 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1684 1 45 TRP H 1 46 TRP H 4.550 . 4.550 4.514 4.470 4.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1685 1 45 TRP H 1 46 TRP HD1 4.450 . 4.450 3.872 3.764 4.072 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1686 1 45 TRP H 1 46 TRP HE1 5.500 . 5.500 4.939 4.771 5.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1687 1 45 TRP H 1 56 ILE HB 5.500 . 5.500 5.563 5.541 5.600 0.100 24 0 "[ . 1 . 2 . 3 . 4]" 1
1688 1 45 TRP H 1 59 GLY H 5.300 . 5.300 4.853 4.767 4.921 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1689 1 45 TRP H 1 92 PRO HG2 4.920 . 4.920 4.377 3.654 4.671 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1690 1 45 TRP HA 1 45 TRP HE3 4.580 . 4.580 2.733 2.610 2.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1691 1 45 TRP HA 1 46 TRP H 3.060 . 3.060 2.189 2.159 2.215 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1692 1 45 TRP HA 1 46 TRP HD1 4.680 . 4.680 3.909 3.818 4.015 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1693 1 45 TRP HA 1 56 ILE HB 4.490 . 4.490 3.834 3.737 3.905 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1694 1 45 TRP HA 1 56 ILE MD 4.780 . 4.780 4.624 4.531 4.694 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1695 1 45 TRP HA 1 58 PRO HA 3.760 . 3.760 2.888 2.749 3.044 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1696 1 45 TRP HA 1 59 GLY H 3.630 . 3.630 3.066 2.969 3.185 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1697 1 45 TRP HB2 1 46 TRP H 4.610 . 4.610 4.329 4.250 4.359 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1698 1 45 TRP HB2 1 56 ILE HB 4.610 . 4.610 3.818 3.764 3.871 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1699 1 45 TRP HB2 1 56 ILE MD 4.390 . 4.390 3.891 3.807 3.972 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1700 1 45 TRP HB2 1 56 ILE MG 4.640 . 4.640 3.967 3.895 4.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1701 1 45 TRP HB3 1 45 TRP HE3 4.050 . 4.050 2.779 2.727 2.828 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1702 1 45 TRP HB3 1 46 TRP H 4.060 . 4.060 3.385 3.273 3.444 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1703 1 45 TRP HB3 1 56 ILE HB 4.000 . 4.000 2.114 2.080 2.149 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1704 1 45 TRP HB3 1 56 ILE MD 3.850 . 3.850 2.968 2.878 3.082 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1705 1 45 TRP HB3 1 56 ILE MG 4.040 . 4.040 2.969 2.898 3.032 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1706 1 45 TRP HB3 1 57 VAL H 4.890 . 4.890 3.639 3.524 3.708 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1707 1 45 TRP HD1 1 56 ILE MD 4.920 . 4.920 4.224 4.126 4.319 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1708 1 45 TRP HD1 1 92 PRO HB2 4.110 . 4.110 3.849 3.078 4.094 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1709 1 45 TRP HD1 1 94 LEU MD1 5.450 . 5.450 5.293 5.080 5.457 0.007 35 0 "[ . 1 . 2 . 3 . 4]" 1
1710 1 45 TRP HD1 1 94 LEU QD 4.120 . 4.120 3.040 2.948 3.162 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1711 1 45 TRP HD1 1 94 LEU MD2 5.450 . 5.450 3.058 2.964 3.183 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1712 1 45 TRP HE1 1 92 PRO HB2 3.880 . 3.880 3.323 2.277 3.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1713 1 45 TRP HE1 1 92 PRO HB3 4.930 . 4.930 4.909 4.018 4.944 0.014 34 0 "[ . 1 . 2 . 3 . 4]" 1
1714 1 45 TRP HE1 1 92 PRO QD 5.350 . 5.350 4.304 3.590 4.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1715 1 45 TRP HE1 1 92 PRO HG2 4.560 . 4.560 2.802 2.672 3.803 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1716 1 45 TRP HE1 1 92 PRO HG3 5.010 . 5.010 4.431 4.326 5.016 0.006 13 0 "[ . 1 . 2 . 3 . 4]" 1
1717 1 45 TRP HE1 1 94 LEU H 5.030 . 5.030 4.592 4.460 4.746 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1718 1 45 TRP HE1 1 94 LEU QB 4.760 . 4.760 4.326 4.194 4.471 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1719 1 45 TRP HE1 1 94 LEU MD1 4.220 . 4.220 4.038 3.856 4.225 0.005 35 0 "[ . 1 . 2 . 3 . 4]" 1
1720 1 45 TRP HE1 1 94 LEU QD 3.570 . 3.570 2.437 2.357 2.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1721 1 45 TRP HE1 1 94 LEU MD2 4.220 . 4.220 2.458 2.371 2.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1722 1 45 TRP HE1 1 94 LEU HG 4.510 . 4.510 2.633 2.462 2.899 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1723 1 45 TRP HE1 1 95 PRO HD2 5.320 . 5.320 5.344 5.324 5.362 0.042 5 0 "[ . 1 . 2 . 3 . 4]" 1
1724 1 45 TRP HE1 1 95 PRO HD3 5.230 . 5.230 5.219 5.044 5.253 0.023 16 0 "[ . 1 . 2 . 3 . 4]" 1
1725 1 45 TRP HE3 1 46 TRP H 4.350 . 4.350 3.300 3.227 3.404 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1726 1 45 TRP HE3 1 56 ILE HA 4.740 . 4.740 3.984 3.891 4.050 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1727 1 45 TRP HE3 1 56 ILE HB 3.670 . 3.670 2.327 2.264 2.368 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1728 1 45 TRP HE3 1 56 ILE MD 3.620 . 3.620 3.047 2.978 3.151 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1729 1 45 TRP HE3 1 56 ILE HG12 4.560 . 4.560 4.257 4.205 4.329 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1730 1 45 TRP HE3 1 56 ILE HG13 4.910 . 4.910 2.716 2.659 2.808 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1731 1 45 TRP HE3 1 56 ILE MG 4.040 . 4.040 4.025 3.977 4.054 0.014 9 0 "[ . 1 . 2 . 3 . 4]" 1
1732 1 45 TRP HE3 1 57 VAL H 4.150 . 4.150 2.590 2.534 2.644 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1733 1 45 TRP HE3 1 57 VAL QG 4.220 . 4.220 4.143 4.117 4.175 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1734 1 45 TRP HH2 1 56 ILE MD 4.590 . 4.590 4.084 3.947 4.233 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1735 1 45 TRP HH2 1 57 VAL QG 5.500 . 5.500 5.665 5.545 5.742 0.242 39 0 "[ . 1 . 2 . 3 . 4]" 1
1736 1 45 TRP HH2 1 58 PRO HD3 4.940 . 4.940 3.359 3.197 3.425 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1737 1 45 TRP HH2 1 58 PRO HG3 5.040 . 5.040 4.232 4.018 4.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1738 1 45 TRP HH2 1 91 LYS QB 5.290 . 5.290 3.009 2.728 3.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1739 1 45 TRP HH2 1 91 LYS QD 3.770 . 3.770 2.142 2.013 3.812 0.042 14 0 "[ . 1 . 2 . 3 . 4]" 1
1740 1 45 TRP HH2 1 94 LEU MD1 5.350 . 5.350 3.725 3.409 4.293 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1741 1 45 TRP HH2 1 94 LEU QD 4.220 . 4.220 3.590 3.330 4.007 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1742 1 45 TRP HH2 1 94 LEU MD2 5.350 . 5.350 4.726 4.539 4.847 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1743 1 45 TRP HZ2 1 91 LYS QB 4.060 . 4.060 3.109 2.594 3.547 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1744 1 45 TRP HZ2 1 91 LYS QD 4.390 . 4.390 2.916 2.465 4.452 0.062 14 0 "[ . 1 . 2 . 3 . 4]" 1
1745 1 45 TRP HZ2 1 94 LEU H 5.500 . 5.500 5.139 4.913 5.379 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1746 1 45 TRP HZ2 1 94 LEU QB 5.090 . 5.090 4.345 4.127 4.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1747 1 45 TRP HZ2 1 94 LEU MD1 4.360 . 4.360 3.185 2.975 3.564 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1748 1 45 TRP HZ2 1 94 LEU QD 3.580 . 3.580 2.965 2.808 3.156 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1749 1 45 TRP HZ2 1 94 LEU MD2 4.360 . 4.360 3.549 3.401 3.670 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1750 1 45 TRP HZ2 1 94 LEU HG 4.170 . 4.170 2.482 2.318 2.768 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1751 1 45 TRP HZ3 1 56 ILE HB 4.940 . 4.940 4.249 4.182 4.313 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1752 1 45 TRP HZ3 1 56 ILE MD 4.130 . 4.130 3.671 3.564 3.732 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1753 1 45 TRP HZ3 1 56 ILE HG12 4.800 . 4.800 4.534 4.452 4.623 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1754 1 45 TRP HZ3 1 57 VAL H 4.890 . 4.890 4.216 4.163 4.280 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1755 1 45 TRP HZ3 1 57 VAL HA 4.420 . 4.420 2.776 2.681 2.882 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1756 1 45 TRP HZ3 1 57 VAL HB 5.500 . 5.500 5.439 5.380 5.500 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1757 1 45 TRP HZ3 1 58 PRO HD2 4.410 . 4.410 3.551 3.515 3.594 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1758 1 45 TRP HZ3 1 58 PRO HD3 4.320 . 4.320 2.023 1.988 2.056 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1759 1 45 TRP HZ3 1 58 PRO HG2 5.050 . 5.050 4.925 4.863 4.980 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1760 1 45 TRP HZ3 1 58 PRO HG3 4.890 . 4.890 4.088 4.004 4.218 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1761 1 46 TRP H 1 46 TRP HB2 3.640 . 3.640 2.531 2.513 2.548 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1762 1 46 TRP H 1 46 TRP HB3 3.830 . 3.830 3.728 3.715 3.744 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1763 1 46 TRP H 1 46 TRP HD1 4.200 . 4.200 3.379 3.300 3.460 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1764 1 46 TRP H 1 47 LEU H 4.890 . 4.890 4.434 4.401 4.473 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1765 1 46 TRP H 1 48 CYS HG 4.850 . 4.850 4.335 4.285 4.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1766 1 46 TRP H 1 56 ILE HA 4.660 . 4.660 4.087 4.001 4.173 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1767 1 46 TRP H 1 56 ILE HB 4.640 . 4.640 3.786 3.677 3.901 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1768 1 46 TRP H 1 56 ILE MD 5.460 . 5.460 5.353 5.268 5.433 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1769 1 46 TRP H 1 56 ILE MG 4.900 . 4.900 4.766 4.688 4.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1770 1 46 TRP H 1 57 VAL H 3.610 . 3.610 2.316 2.239 2.401 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1771 1 46 TRP H 1 57 VAL HB 4.710 . 4.710 3.371 3.232 3.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1772 1 46 TRP H 1 57 VAL QG 4.010 . 4.010 3.852 3.769 3.925 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1773 1 46 TRP H 1 58 PRO HA 4.290 . 4.290 3.903 3.782 4.045 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1774 1 46 TRP H 1 59 GLY H 4.030 . 4.030 3.578 3.422 3.702 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1775 1 46 TRP H 1 62 LEU QD 4.810 . 4.810 4.568 4.359 4.782 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1776 1 46 TRP HA 1 46 TRP HD1 3.770 . 3.770 2.395 2.357 2.433 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1777 1 46 TRP HA 1 46 TRP HE1 4.810 . 4.810 4.795 4.761 4.821 0.011 37 0 "[ . 1 . 2 . 3 . 4]" 1
1778 1 46 TRP HA 1 47 LEU H 3.160 . 3.160 2.166 2.151 2.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1779 1 46 TRP HA 1 47 LEU HB3 5.260 . 5.260 4.561 4.528 4.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1780 1 46 TRP HA 1 57 VAL QG 5.500 . 5.500 5.301 5.192 5.402 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1781 1 46 TRP HB2 1 47 LEU H 4.340 . 4.340 4.250 4.193 4.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1782 1 46 TRP HB2 1 48 CYS HG 4.060 . 4.060 3.098 3.018 3.168 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1783 1 46 TRP HB2 1 57 VAL H 4.830 . 4.830 3.729 3.653 3.825 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1784 1 46 TRP HB2 1 57 VAL HB 4.760 . 4.760 2.896 2.739 3.040 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1785 1 46 TRP HB2 1 57 VAL QG 3.770 . 3.770 3.578 3.451 3.694 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1786 1 46 TRP HB2 1 59 GLY H 5.000 . 5.000 4.480 4.288 4.647 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1787 1 46 TRP HB2 1 62 LEU HB3 5.500 . 5.500 5.132 4.754 5.470 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1788 1 46 TRP HB2 1 62 LEU QD 3.940 . 3.940 3.003 2.792 3.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1789 1 46 TRP HB3 1 46 TRP HE3 4.050 . 4.050 3.061 3.018 3.097 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1790 1 46 TRP HB3 1 47 LEU H 3.710 . 3.710 3.329 3.269 3.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1791 1 46 TRP HB3 1 48 CYS HG 4.040 . 4.040 3.362 3.215 3.452 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1792 1 46 TRP HB3 1 57 VAL H 5.070 . 5.070 4.890 4.813 4.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1793 1 46 TRP HB3 1 57 VAL HB 4.980 . 4.980 4.355 4.213 4.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1794 1 46 TRP HB3 1 57 VAL QG 4.650 . 4.650 4.588 4.465 4.684 0.034 4 0 "[ . 1 . 2 . 3 . 4]" 1
1795 1 46 TRP HB3 1 62 LEU QD 4.100 . 4.100 3.781 3.664 3.925 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1796 1 46 TRP HD1 1 47 LEU H 4.810 . 4.810 4.521 4.466 4.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1797 1 46 TRP HD1 1 59 GLY H 4.900 . 4.900 4.493 4.304 4.681 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1798 1 46 TRP HD1 1 59 GLY HA3 5.310 . 5.310 4.440 4.146 4.747 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1799 1 46 TRP HE1 1 59 GLY H 5.340 . 5.340 4.757 4.618 4.934 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1800 1 46 TRP HE1 1 59 GLY HA3 4.820 . 4.820 3.732 3.469 4.073 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1801 1 46 TRP HE3 1 48 CYS HG 5.190 . 5.190 4.942 4.825 5.048 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1802 1 46 TRP HE3 1 57 VAL QG 4.860 . 4.860 4.469 4.281 4.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1803 1 46 TRP HE3 1 59 GLY HA3 5.500 . 5.500 4.375 4.015 4.652 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1804 1 46 TRP HE3 1 62 LEU HB3 4.200 . 4.200 3.174 3.028 3.328 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1805 1 46 TRP HE3 1 62 LEU QD 3.060 . 3.060 2.182 1.967 2.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1806 1 46 TRP HE3 1 64 ILE MD 4.000 . 4.000 2.683 2.569 2.815 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1807 1 46 TRP HE3 1 64 ILE HG12 5.500 . 5.500 4.331 4.169 4.465 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1808 1 46 TRP HE3 1 64 ILE MG 5.500 . 5.500 5.624 5.569 5.702 0.202 24 0 "[ . 1 . 2 . 3 . 4]" 1
1809 1 46 TRP HH2 1 62 LEU QD 5.440 . 5.440 5.075 4.972 5.175 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1810 1 46 TRP HH2 1 64 ILE H 4.530 . 4.530 3.999 3.780 4.285 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1811 1 46 TRP HH2 1 64 ILE HB 5.000 . 5.000 4.961 4.840 5.011 0.011 21 0 "[ . 1 . 2 . 3 . 4]" 1
1812 1 46 TRP HH2 1 64 ILE MD 3.770 . 3.770 3.694 3.582 3.791 0.021 18 0 "[ . 1 . 2 . 3 . 4]" 1
1813 1 46 TRP HH2 1 64 ILE HG12 4.240 . 4.240 2.905 2.807 3.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1814 1 46 TRP HH2 1 64 ILE HG13 3.800 . 3.800 3.811 3.799 3.826 0.026 39 0 "[ . 1 . 2 . 3 . 4]" 1
1815 1 46 TRP HH2 1 64 ILE MG 5.400 . 5.400 5.439 5.422 5.462 0.062 8 0 "[ . 1 . 2 . 3 . 4]" 1
1816 1 46 TRP HZ2 1 59 GLY HA2 5.500 . 5.500 4.769 4.548 4.993 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1817 1 46 TRP HZ2 1 59 GLY HA3 4.760 . 4.760 3.650 3.510 3.796 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1818 1 46 TRP HZ2 1 64 ILE MD 5.300 . 5.300 4.846 4.708 5.030 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1819 1 46 TRP HZ3 1 62 LEU HB2 4.890 . 4.890 3.996 3.295 4.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1820 1 46 TRP HZ3 1 62 LEU HB3 4.940 . 4.940 2.738 2.540 2.974 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1821 1 46 TRP HZ3 1 62 LEU MD1 5.240 . 5.240 4.260 3.380 5.241 0.001 16 0 "[ . 1 . 2 . 3 . 4]" 1
1822 1 46 TRP HZ3 1 62 LEU QD 3.780 . 3.780 3.265 3.021 3.413 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1823 1 46 TRP HZ3 1 62 LEU MD2 5.240 . 5.240 3.839 3.045 4.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1824 1 46 TRP HZ3 1 64 ILE MD 3.440 . 3.440 2.305 2.204 2.380 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1825 1 46 TRP HZ3 1 64 ILE HG12 4.450 . 4.450 2.296 2.205 2.392 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1826 1 46 TRP HZ3 1 64 ILE HG13 4.150 . 4.150 3.618 3.434 3.765 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1827 1 46 TRP HZ3 1 64 ILE MG 4.710 . 4.710 4.733 4.691 4.764 0.054 5 0 "[ . 1 . 2 . 3 . 4]" 1
1828 1 47 LEU H 1 47 LEU HB2 3.680 . 3.680 2.630 2.603 2.668 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1829 1 47 LEU H 1 47 LEU HB3 3.450 . 3.450 2.408 2.386 2.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1830 1 47 LEU H 1 47 LEU MD1 4.390 . 4.390 4.215 4.199 4.244 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1831 1 47 LEU H 1 47 LEU MD2 4.390 . 4.390 4.230 4.209 4.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1832 1 47 LEU H 1 47 LEU HG 4.510 . 4.510 4.426 4.404 4.442 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1833 1 47 LEU H 1 48 CYS HG 4.580 . 4.580 4.195 4.154 4.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1834 1 47 LEU H 1 57 VAL QG 5.500 . 5.500 5.403 5.312 5.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1835 1 47 LEU HA 1 47 LEU QD 2.790 . 2.790 2.173 2.145 2.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1836 1 47 LEU HA 1 47 LEU HG 4.010 . 4.010 3.215 3.170 3.268 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1837 1 47 LEU HA 1 48 CYS H 3.000 . 3.000 2.163 2.144 2.178 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1838 1 47 LEU HA 1 55 GLY H 4.750 . 4.750 4.180 4.103 4.237 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1839 1 47 LEU HA 1 56 ILE HA 3.670 . 3.670 2.348 2.235 2.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1840 1 47 LEU HA 1 56 ILE MG 4.220 . 4.220 3.072 2.921 3.188 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1841 1 47 LEU HA 1 57 VAL H 4.300 . 4.300 3.941 3.853 4.051 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1842 1 47 LEU HA 1 57 VAL QG 4.550 . 4.550 4.102 4.006 4.213 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1843 1 47 LEU HB2 1 47 LEU MD1 3.430 . 3.430 2.409 2.378 2.433 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1844 1 47 LEU HB2 1 47 LEU QD 2.910 . 2.910 2.119 2.109 2.128 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1845 1 47 LEU HB2 1 47 LEU MD2 3.430 . 3.430 2.351 2.325 2.379 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1846 1 47 LEU HB2 1 48 CYS H 4.630 . 4.630 4.357 4.328 4.383 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1847 1 47 LEU HB2 1 56 ILE MG 4.530 . 4.530 3.472 3.258 3.592 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1848 1 47 LEU HB3 1 47 LEU MD1 3.270 . 3.270 3.225 3.215 3.239 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1849 1 47 LEU HB3 1 47 LEU QD 2.770 . 2.770 2.275 2.254 2.304 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1850 1 47 LEU HB3 1 47 LEU MD2 3.270 . 3.270 2.325 2.301 2.360 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1851 1 47 LEU HB3 1 48 CYS H 4.550 . 4.550 4.293 4.263 4.314 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1852 1 47 LEU QD 1 48 CYS H 2.930 . 2.930 2.504 2.439 2.584 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1853 1 47 LEU QD 1 48 CYS HA 4.510 . 4.510 4.124 4.077 4.155 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1854 1 47 LEU QD 1 48 CYS HG 4.680 . 4.680 4.647 4.598 4.682 0.002 16 0 "[ . 1 . 2 . 3 . 4]" 1
1855 1 47 LEU QD 1 49 SER HA 4.880 . 4.880 4.900 4.859 4.938 0.058 32 0 "[ . 1 . 2 . 3 . 4]" 1
1856 1 47 LEU QD 1 54 GLN H 5.440 . 5.440 5.349 5.250 5.415 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1857 1 47 LEU QD 1 54 GLN HA 3.920 . 3.920 3.905 3.789 3.951 0.031 34 0 "[ . 1 . 2 . 3 . 4]" 1
1858 1 47 LEU QD 1 54 GLN HB2 4.520 . 4.520 4.220 4.049 4.340 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1859 1 47 LEU QD 1 54 GLN HB3 3.260 . 3.260 2.868 2.638 3.021 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1860 1 47 LEU QD 1 54 GLN QE 3.310 . 3.310 2.156 1.901 2.441 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1861 1 47 LEU QD 1 54 GLN QG 3.080 . 3.080 2.817 2.686 2.994 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1862 1 47 LEU QD 1 55 GLY H 3.210 . 3.210 2.582 2.506 2.680 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1863 1 47 LEU QD 1 55 GLY HA2 3.530 . 3.530 2.998 2.903 3.119 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1864 1 47 LEU QD 1 55 GLY HA3 4.360 . 4.360 3.990 3.909 4.099 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1865 1 47 LEU QD 1 56 ILE H 4.230 . 4.230 3.858 3.747 4.032 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1866 1 47 LEU QD 1 56 ILE HA 3.550 . 3.550 3.389 3.308 3.476 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1867 1 47 LEU QD 1 56 ILE HB 5.440 . 5.440 4.886 4.794 4.971 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1868 1 47 LEU QD 1 57 VAL H 5.180 . 5.180 5.090 4.993 5.165 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1869 1 47 LEU MD1 1 54 GLN HE21 4.650 . 4.650 3.680 3.485 3.977 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1870 1 47 LEU MD1 1 54 GLN HE22 4.650 . 4.650 2.301 2.005 2.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1871 1 47 LEU MD1 1 54 GLN HG2 5.270 . 5.270 2.941 2.793 3.168 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1872 1 47 LEU MD1 1 54 GLN HG3 5.270 . 5.270 4.382 4.270 4.519 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1873 1 47 LEU MD2 1 54 GLN HE21 4.650 . 4.650 3.199 2.916 3.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1874 1 47 LEU MD2 1 54 GLN HE22 4.650 . 4.650 2.859 2.511 3.163 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1875 1 47 LEU MD2 1 54 GLN HG2 5.270 . 5.270 3.949 3.793 4.024 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1876 1 47 LEU MD2 1 54 GLN HG3 5.270 . 5.270 5.234 5.084 5.285 0.015 32 0 "[ . 1 . 2 . 3 . 4]" 1
1877 1 47 LEU HG 1 48 CYS H 5.470 . 5.470 3.451 3.361 3.549 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1878 1 47 LEU HG 1 54 GLN QG 5.120 . 5.120 3.404 3.276 3.486 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1879 1 47 LEU HG 1 55 GLY H 5.410 . 5.410 4.309 4.198 4.447 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1880 1 48 CYS H 1 48 CYS HB2 3.820 . 3.820 2.865 2.835 2.910 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1881 1 48 CYS H 1 48 CYS HB3 3.960 . 3.960 3.890 3.871 3.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1882 1 48 CYS H 1 48 CYS HG 3.950 . 3.950 2.775 2.679 2.833 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1883 1 48 CYS H 1 49 SER H 4.530 . 4.530 4.436 4.422 4.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1884 1 48 CYS H 1 55 GLY H 3.580 . 3.580 2.881 2.845 2.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1885 1 48 CYS H 1 55 GLY HA2 5.500 . 5.500 4.587 4.524 4.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1886 1 48 CYS H 1 56 ILE HA 3.950 . 3.950 3.284 3.196 3.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1887 1 48 CYS H 1 57 VAL QG 3.980 . 3.980 3.156 3.054 3.259 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1888 1 48 CYS HA 1 48 CYS HG 4.470 . 4.470 3.481 3.457 3.517 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1889 1 48 CYS HA 1 49 SER H 3.080 . 3.080 2.412 2.384 2.446 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1890 1 48 CYS HA 1 49 SER HB2 5.240 . 5.240 5.271 5.260 5.284 0.044 32 0 "[ . 1 . 2 . 3 . 4]" 1
1891 1 48 CYS HA 1 49 SER HB3 4.850 . 4.850 3.922 3.889 3.996 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1892 1 48 CYS HA 1 57 VAL QG 5.230 . 5.230 4.553 4.474 4.697 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1893 1 48 CYS HB2 1 49 SER H 3.630 . 3.630 3.299 3.249 3.342 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1894 1 48 CYS HB2 1 55 GLY H 4.910 . 4.910 4.430 4.346 4.505 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1895 1 48 CYS HB2 1 57 VAL QG 3.360 . 3.360 2.374 2.305 2.528 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1896 1 48 CYS HB2 1 62 LEU QD 4.590 . 4.590 4.025 3.886 4.166 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1897 1 48 CYS HB3 1 49 SER H 3.560 . 3.560 2.316 2.276 2.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1898 1 48 CYS HB3 1 57 VAL QG 4.130 . 4.130 3.561 3.477 3.712 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1899 1 48 CYS HB3 1 62 LEU QD 4.710 . 4.710 3.981 3.875 4.084 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1900 1 48 CYS HG 1 49 SER H 5.290 . 5.290 5.105 5.089 5.125 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1901 1 48 CYS HG 1 57 VAL H 4.570 . 4.570 3.677 3.588 3.779 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1902 1 48 CYS HG 1 57 VAL HB 3.720 . 3.720 2.742 2.603 2.906 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1903 1 48 CYS HG 1 62 LEU QD 3.570 . 3.570 3.499 3.392 3.598 0.028 10 0 "[ . 1 . 2 . 3 . 4]" 1
1904 1 49 SER H 1 49 SER HB2 3.980 . 3.980 3.782 3.753 3.806 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1905 1 49 SER H 1 49 SER HB3 3.570 . 3.570 2.650 2.601 2.685 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1906 1 49 SER H 1 50 LEU HA 5.500 . 5.500 4.964 4.908 5.091 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1907 1 49 SER H 1 50 LEU HB2 5.250 . 5.250 4.643 4.521 4.733 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1908 1 49 SER H 1 57 VAL QG 5.440 . 5.440 5.006 4.912 5.175 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1909 1 49 SER HA 1 50 LEU H 2.860 . 2.860 2.127 2.109 2.145 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1910 1 49 SER HA 1 50 LEU HB2 5.000 . 5.000 4.418 4.365 4.489 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1911 1 49 SER HA 1 50 LEU HB3 5.010 . 5.010 4.430 4.298 4.628 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1912 1 49 SER HA 1 53 ARG H 4.340 . 4.340 4.358 4.342 4.378 0.038 30 0 "[ . 1 . 2 . 3 . 4]" 1
1913 1 49 SER HA 1 54 GLN H 4.780 . 4.780 4.697 4.582 4.767 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1914 1 49 SER HA 1 54 GLN HA 3.840 . 3.840 2.214 2.151 2.272 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1915 1 49 SER HA 1 54 GLN HB2 4.890 . 4.890 4.748 4.634 4.856 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1916 1 49 SER HA 1 54 GLN HB3 5.100 . 5.100 4.874 4.772 4.964 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1917 1 49 SER HA 1 54 GLN HG2 4.610 . 4.610 3.499 3.396 3.668 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1918 1 49 SER HA 1 54 GLN HG3 4.610 . 4.610 3.259 3.106 3.499 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1919 1 49 SER HA 1 55 GLY H 3.790 . 3.790 3.553 3.468 3.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1920 1 49 SER HB2 1 50 LEU H 3.990 . 3.990 3.528 3.455 3.643 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1921 1 49 SER HB2 1 54 GLN HA 4.280 . 4.280 3.204 3.005 3.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1922 1 49 SER HB2 1 54 GLN HB2 4.840 . 4.840 4.415 4.275 4.508 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1923 1 49 SER HB2 1 54 GLN HB3 5.120 . 5.120 5.035 4.867 5.122 0.002 23 0 "[ . 1 . 2 . 3 . 4]" 1
1924 1 49 SER HB2 1 54 GLN HG2 4.280 . 4.280 3.344 3.085 3.492 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1925 1 49 SER HB2 1 54 GLN QG 3.650 . 3.650 2.228 2.096 2.318 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1926 1 49 SER HB2 1 54 GLN HG3 4.280 . 4.280 2.263 2.121 2.357 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1927 1 49 SER HB2 1 55 GLY H 5.360 . 5.360 5.030 4.876 5.148 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1928 1 49 SER HB3 1 50 LEU H 4.700 . 4.700 4.463 4.425 4.531 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1929 1 49 SER HB3 1 54 GLN HA 4.750 . 4.750 4.049 3.869 4.176 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1930 1 49 SER HB3 1 54 GLN HB2 5.500 . 5.500 5.520 5.510 5.529 0.029 12 0 "[ . 1 . 2 . 3 . 4]" 1
1931 1 49 SER HB3 1 54 GLN HG2 4.820 . 4.820 3.450 3.187 3.648 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1932 1 49 SER HB3 1 54 GLN QG 4.110 . 4.110 2.912 2.851 2.955 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1933 1 49 SER HB3 1 54 GLN HG3 4.820 . 4.820 3.142 3.085 3.213 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1934 1 50 LEU H 1 50 LEU HB2 3.560 . 3.560 3.262 3.176 3.315 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1935 1 50 LEU H 1 50 LEU HB3 3.440 . 3.440 2.774 2.719 2.899 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1936 1 50 LEU H 1 50 LEU MD1 4.670 . 4.670 4.650 4.370 4.702 0.032 24 0 "[ . 1 . 2 . 3 . 4]" 1
1937 1 50 LEU H 1 50 LEU MD2 4.670 . 4.670 4.321 4.249 4.527 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1938 1 50 LEU H 1 50 LEU HG 5.090 . 5.090 4.537 4.489 5.093 0.003 23 0 "[ . 1 . 2 . 3 . 4]" 1
1939 1 50 LEU H 1 52 GLY H 4.490 . 4.490 3.811 3.671 4.019 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1940 1 50 LEU H 1 53 ARG H 3.240 . 3.240 2.845 2.801 2.925 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1941 1 50 LEU H 1 53 ARG HB2 5.010 . 5.010 4.691 4.577 4.981 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1942 1 50 LEU H 1 53 ARG HB3 4.650 . 4.650 3.763 3.656 3.889 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1943 1 50 LEU H 1 54 GLN H 5.280 . 5.280 4.985 4.924 5.065 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1944 1 50 LEU H 1 54 GLN HA 3.630 . 3.630 3.540 3.485 3.625 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1945 1 50 LEU H 1 55 GLY H 4.970 . 4.970 4.947 4.831 4.992 0.022 24 0 "[ . 1 . 2 . 3 . 4]" 1
1946 1 50 LEU HA 1 50 LEU MD1 3.910 . 3.910 2.793 2.342 3.297 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1947 1 50 LEU HA 1 50 LEU QD 2.890 . 2.890 2.703 2.154 2.818 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1948 1 50 LEU HA 1 50 LEU MD2 3.910 . 3.910 3.801 2.183 3.910 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1949 1 50 LEU HA 1 51 HIS QB 4.970 . 4.970 4.603 4.250 4.672 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1950 1 50 LEU HB2 1 50 LEU MD1 3.220 . 3.220 2.185 2.119 3.201 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1951 1 50 LEU HB2 1 50 LEU QD 2.650 . 2.650 2.101 2.070 2.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1952 1 50 LEU HB2 1 50 LEU MD2 3.220 . 3.220 2.807 2.527 2.912 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1953 1 50 LEU HB3 1 50 LEU MD1 3.200 . 3.200 3.008 2.270 3.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1954 1 50 LEU HB3 1 50 LEU QD 2.770 . 2.770 2.089 2.048 2.226 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1955 1 50 LEU HB3 1 50 LEU MD2 3.200 . 3.200 2.153 2.081 3.218 0.018 23 0 "[ . 1 . 2 . 3 . 4]" 1
1956 1 50 LEU HB3 1 51 HIS QB 5.400 . 5.400 4.143 3.405 4.261 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1957 1 50 LEU QD 1 51 HIS H 4.610 . 4.610 3.341 2.049 3.506 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1958 1 50 LEU QD 1 51 HIS QB 3.790 . 3.790 3.055 2.129 3.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1959 1 50 LEU QD 1 53 ARG H 5.440 . 5.440 4.763 4.620 4.994 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1960 1 50 LEU MD1 1 51 HIS QB 4.870 . 4.870 4.787 2.138 4.971 0.101 8 0 "[ . 1 . 2 . 3 . 4]" 1
1961 1 50 LEU MD1 1 51 HIS HD2 4.020 . 4.020 3.885 1.982 4.092 0.072 39 0 "[ . 1 . 2 . 3 . 4]" 1
1962 1 50 LEU MD2 1 51 HIS QB 4.870 . 4.870 3.137 2.648 3.938 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1963 1 50 LEU MD2 1 51 HIS HD2 4.020 . 4.020 3.701 2.001 4.118 0.098 9 0 "[ . 1 . 2 . 3 . 4]" 1
1964 1 50 LEU HG 1 51 HIS QB 4.570 . 4.570 3.670 3.427 4.584 0.014 23 0 "[ . 1 . 2 . 3 . 4]" 1
1965 1 50 LEU HG 1 51 HIS HD2 4.580 . 4.580 3.006 2.044 4.596 0.016 23 0 "[ . 1 . 2 . 3 . 4]" 1
1966 1 51 HIS HA 1 51 HIS HD2 4.400 . 4.400 2.722 2.402 4.415 0.015 13 0 "[ . 1 . 2 . 3 . 4]" 1
1967 1 51 HIS HA 1 53 ARG H 4.640 . 4.640 4.450 4.407 4.513 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1968 1 51 HIS QB 1 51 HIS HD2 3.660 . 3.660 3.169 2.640 3.297 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1969 1 51 HIS QB 1 52 GLY H 4.750 . 4.750 3.836 3.801 3.867 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1970 1 51 HIS QB 1 53 ARG H 3.840 . 3.840 3.476 3.347 3.629 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1971 1 51 HIS QB 1 53 ARG HB2 4.000 . 4.000 3.467 3.164 3.791 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1972 1 51 HIS QB 1 53 ARG QG 5.340 . 5.340 4.792 4.408 5.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1973 1 52 GLY H 1 53 ARG H 3.330 . 3.330 2.617 2.555 2.678 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1974 1 53 ARG H 1 53 ARG HB2 2.970 . 2.970 2.601 2.506 2.859 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1975 1 53 ARG H 1 53 ARG HB3 3.290 . 3.290 2.858 2.742 2.981 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1976 1 53 ARG H 1 53 ARG HD2 5.400 . 5.400 4.994 4.835 5.309 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1977 1 53 ARG H 1 53 ARG HD3 5.400 . 5.400 5.090 4.852 5.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1978 1 53 ARG H 1 53 ARG HG2 4.920 . 4.920 4.506 4.451 4.569 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1979 1 53 ARG H 1 53 ARG QG 4.140 . 4.140 4.117 4.065 4.167 0.027 9 0 "[ . 1 . 2 . 3 . 4]" 1
1980 1 53 ARG H 1 53 ARG HG3 4.920 . 4.920 4.762 4.698 4.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1981 1 53 ARG H 1 54 GLN H 4.390 . 4.390 4.406 4.393 4.420 0.030 39 0 "[ . 1 . 2 . 3 . 4]" 1
1982 1 53 ARG H 1 54 GLN HA 5.030 . 5.030 4.788 4.705 4.874 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1983 1 53 ARG H 1 54 GLN QG 5.340 . 5.340 5.339 5.193 5.377 0.037 34 0 "[ . 1 . 2 . 3 . 4]" 1
1984 1 53 ARG HA 1 53 ARG HD2 4.370 . 4.370 3.886 3.408 4.428 0.058 10 0 "[ . 1 . 2 . 3 . 4]" 1
1985 1 53 ARG HA 1 53 ARG HD3 4.370 . 4.370 3.043 2.559 3.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1986 1 53 ARG HA 1 53 ARG HG2 3.830 . 3.830 2.362 2.167 2.556 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1987 1 53 ARG HA 1 53 ARG HG3 3.830 . 3.830 3.601 3.132 3.736 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1988 1 53 ARG HA 1 54 GLN H 2.630 . 2.630 2.232 2.194 2.311 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1989 1 53 ARG HB2 1 53 ARG HD2 4.140 . 4.140 3.542 3.018 3.663 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1990 1 53 ARG HB2 1 53 ARG QD 3.490 . 3.490 3.282 2.873 3.351 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1991 1 53 ARG HB2 1 53 ARG HD3 4.140 . 4.140 3.884 3.607 3.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1992 1 53 ARG HB3 1 53 ARG HD2 3.700 . 3.700 2.332 2.194 2.453 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1993 1 53 ARG HB3 1 53 ARG HD3 3.700 . 3.700 3.084 2.387 3.371 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1994 1 53 ARG HB3 1 54 GLN H 3.890 . 3.890 3.728 3.465 3.855 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1995 1 53 ARG QD 1 54 GLN H 4.230 . 4.230 2.280 1.997 3.114 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1996 1 53 ARG HD2 1 54 GLN H 4.900 . 4.900 3.552 2.873 4.510 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1997 1 53 ARG HD3 1 54 GLN H 4.900 . 4.900 2.309 2.020 3.174 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1998 1 53 ARG QG 1 54 GLN H 3.790 . 3.790 3.288 2.069 3.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
1999 1 53 ARG HG2 1 54 GLN H 4.620 . 4.620 3.382 2.079 3.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2000 1 53 ARG HG3 1 54 GLN H 4.620 . 4.620 4.548 3.807 4.639 0.019 12 0 "[ . 1 . 2 . 3 . 4]" 1
2001 1 54 GLN H 1 54 GLN HB2 3.070 . 3.070 2.260 2.170 2.359 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2002 1 54 GLN H 1 54 GLN HB3 3.490 . 3.490 3.286 3.235 3.381 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2003 1 54 GLN H 1 54 GLN QG 3.740 . 3.740 3.643 3.386 3.764 0.024 27 0 "[ . 1 . 2 . 3 . 4]" 1
2004 1 54 GLN H 1 55 GLY H 4.610 . 4.610 4.551 4.482 4.596 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2005 1 54 GLN HA 1 54 GLN HG2 4.010 . 4.010 2.455 2.400 2.502 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2006 1 54 GLN HA 1 54 GLN QG 3.510 . 3.510 2.205 2.188 2.230 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2007 1 54 GLN HA 1 54 GLN HG3 4.010 . 4.010 2.498 2.423 2.589 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2008 1 54 GLN HA 1 55 GLY H 2.850 . 2.850 2.275 2.244 2.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2009 1 54 GLN HB2 1 54 GLN QE 4.250 . 4.250 3.085 2.947 3.313 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2010 1 54 GLN HB2 1 55 GLY H 4.460 . 4.460 4.328 4.269 4.448 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2011 1 54 GLN HB3 1 54 GLN HE21 4.780 . 4.780 3.602 3.544 3.667 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2012 1 54 GLN HB3 1 54 GLN QE 4.170 . 4.170 2.139 2.026 2.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2013 1 54 GLN HB3 1 54 GLN HE22 4.780 . 4.780 2.156 2.038 2.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2014 1 54 GLN HB3 1 55 GLY H 3.550 . 3.550 3.221 3.079 3.451 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2015 1 54 GLN QG 1 55 GLY H 3.750 . 3.750 3.040 2.905 3.237 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2016 1 54 GLN HG2 1 55 GLY H 4.410 . 4.410 3.117 2.968 3.331 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2017 1 54 GLN HG3 1 55 GLY H 4.410 . 4.410 4.218 4.110 4.408 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2018 1 55 GLY H 1 56 ILE H 4.580 . 4.580 4.408 4.384 4.434 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2019 1 55 GLY H 1 56 ILE HA 4.850 . 4.850 4.716 4.647 4.771 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2020 1 55 GLY H 1 56 ILE MG 5.360 . 5.360 5.076 5.000 5.157 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2021 1 55 GLY H 1 57 VAL QG 4.610 . 4.610 4.451 4.347 4.518 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2022 1 55 GLY HA2 1 56 ILE H 3.380 . 3.380 2.473 2.439 2.546 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2023 1 55 GLY HA2 1 56 ILE MG 4.040 . 4.040 3.565 3.515 3.634 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2024 1 55 GLY HA2 1 57 VAL QG 5.500 . 5.500 5.255 5.206 5.313 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2025 1 55 GLY HA3 1 56 ILE H 3.390 . 3.390 2.667 2.598 2.711 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2026 1 56 ILE H 1 56 ILE MD 3.840 . 3.840 3.637 3.592 3.685 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2027 1 56 ILE H 1 56 ILE HG12 3.650 . 3.650 2.020 1.981 2.067 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2028 1 56 ILE H 1 56 ILE HG13 3.390 . 3.390 3.182 3.123 3.218 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2029 1 56 ILE H 1 56 ILE MG 3.170 . 3.170 2.338 2.295 2.387 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2030 1 56 ILE H 1 57 VAL H 4.770 . 4.770 4.609 4.593 4.625 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2031 1 56 ILE H 1 57 VAL QG 4.580 . 4.580 4.446 4.402 4.488 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2032 1 56 ILE HA 1 56 ILE MD 4.210 . 4.210 4.235 4.224 4.250 0.040 24 0 "[ . 1 . 2 . 3 . 4]" 1
2033 1 56 ILE HA 1 56 ILE MG 2.880 . 2.880 2.332 2.320 2.349 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2034 1 56 ILE HA 1 57 VAL H 3.080 . 3.080 2.271 2.243 2.299 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2035 1 56 ILE HA 1 57 VAL HB 4.810 . 4.810 4.379 4.294 4.441 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2036 1 56 ILE HA 1 57 VAL QG 3.700 . 3.700 3.317 3.281 3.354 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2037 1 56 ILE HB 1 56 ILE MD 3.120 . 3.120 2.444 2.429 2.464 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2038 1 56 ILE HB 1 57 VAL H 3.540 . 3.540 2.630 2.585 2.677 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2039 1 56 ILE HB 1 57 VAL QG 4.560 . 4.560 4.578 4.556 4.604 0.044 32 0 "[ . 1 . 2 . 3 . 4]" 1
2040 1 56 ILE MD 1 56 ILE MG 2.600 . 2.600 2.146 2.125 2.166 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2041 1 56 ILE MD 1 57 VAL H 4.510 . 4.510 4.484 4.438 4.516 0.006 27 0 "[ . 1 . 2 . 3 . 4]" 1
2042 1 56 ILE MD 1 57 VAL QG 5.320 . 5.320 5.209 5.191 5.236 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2043 1 56 ILE MD 1 94 LEU HA 5.350 . 5.350 5.179 5.089 5.301 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2044 1 56 ILE MD 1 94 LEU QB 4.830 . 4.830 4.412 4.231 4.631 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2045 1 56 ILE MD 1 94 LEU MD1 3.280 . 3.280 2.225 2.047 2.468 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2046 1 56 ILE MD 1 94 LEU QD 2.840 . 2.840 1.930 1.837 2.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2047 1 56 ILE MD 1 94 LEU MD2 3.280 . 3.280 2.121 2.066 2.236 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2048 1 56 ILE MD 1 94 LEU HG 4.990 . 4.990 3.790 3.650 3.941 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2049 1 56 ILE HG12 1 56 ILE MG 3.490 . 3.490 2.356 2.321 2.378 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2050 1 56 ILE HG12 1 57 VAL H 4.880 . 4.880 4.729 4.679 4.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2051 1 56 ILE HG13 1 57 VAL H 5.000 . 5.000 3.761 3.700 3.822 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2052 1 56 ILE HG13 1 57 VAL QG 4.430 . 4.430 4.489 4.458 4.517 0.087 40 0 "[ . 1 . 2 . 3 . 4]" 1
2053 1 56 ILE MG 1 57 VAL H 3.740 . 3.740 3.799 3.777 3.830 0.090 32 0 "[ . 1 . 2 . 3 . 4]" 1
2054 1 56 ILE MG 1 94 LEU MD1 4.850 . 4.850 4.769 4.586 4.944 0.094 24 0 "[ . 1 . 2 . 3 . 4]" 1
2055 1 56 ILE MG 1 94 LEU QD 3.980 . 3.980 3.795 3.669 3.907 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2056 1 56 ILE MG 1 94 LEU MD2 4.850 . 4.850 3.985 3.860 4.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2057 1 57 VAL H 1 57 VAL HB 3.700 . 3.700 2.719 2.658 2.772 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2058 1 57 VAL H 1 57 VAL QG 3.050 . 3.050 2.866 2.830 2.893 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2059 1 57 VAL H 1 62 LEU QD 4.990 . 4.990 4.823 4.616 5.022 0.032 40 0 "[ . 1 . 2 . 3 . 4]" 1
2060 1 57 VAL HA 1 57 VAL QG 3.030 . 3.030 2.143 2.134 2.151 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2061 1 57 VAL HA 1 58 PRO HD2 3.680 . 3.680 2.359 2.292 2.413 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2062 1 57 VAL HA 1 58 PRO HG2 4.740 . 4.740 4.511 4.462 4.555 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2063 1 57 VAL HA 1 58 PRO HG3 4.680 . 4.680 4.630 4.584 4.662 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2064 1 57 VAL HA 1 62 LEU QD 4.820 . 4.820 4.709 4.649 4.797 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2065 1 57 VAL HB 1 58 PRO HD2 4.080 . 4.080 4.127 4.110 4.145 0.065 34 0 "[ . 1 . 2 . 3 . 4]" 1
2066 1 57 VAL HB 1 58 PRO HD3 5.000 . 5.000 5.028 5.014 5.046 0.046 27 0 "[ . 1 . 2 . 3 . 4]" 1
2067 1 57 VAL HB 1 62 LEU MD1 4.770 . 4.770 3.440 2.531 4.424 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2068 1 57 VAL HB 1 62 LEU QD 3.550 . 3.550 2.705 2.521 2.922 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2069 1 57 VAL HB 1 62 LEU MD2 4.770 . 4.770 3.868 2.704 4.824 0.054 17 0 "[ . 1 . 2 . 3 . 4]" 1
2070 1 57 VAL QG 1 58 PRO HB2 4.670 . 4.670 4.428 4.393 4.479 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2071 1 57 VAL QG 1 58 PRO HD2 3.310 . 3.310 1.884 1.860 1.908 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2072 1 57 VAL QG 1 58 PRO HD3 3.610 . 3.610 3.228 3.197 3.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2073 1 57 VAL QG 1 58 PRO HG2 3.790 . 3.790 3.167 3.056 3.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2074 1 57 VAL QG 1 58 PRO HG3 4.400 . 4.400 4.062 3.983 4.103 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2075 1 57 VAL QG 1 59 GLY H 4.580 . 4.580 4.216 4.025 4.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2076 1 57 VAL QG 1 59 GLY HA2 3.850 . 3.850 3.620 3.394 3.834 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2077 1 57 VAL QG 1 60 ASN H 5.410 . 5.410 5.140 5.020 5.291 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2078 1 57 VAL QG 1 61 ARG H 4.560 . 4.560 4.189 4.090 4.261 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2079 1 57 VAL QG 1 61 ARG QB 4.800 . 4.800 3.610 3.334 3.789 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2080 1 57 VAL QG 1 62 LEU H 5.260 . 5.260 4.546 4.442 4.623 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2081 1 57 VAL QG 1 62 LEU HA 4.900 . 4.900 4.513 4.352 4.635 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2082 1 57 VAL QG 1 62 LEU HB2 4.230 . 4.230 3.093 2.542 3.579 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2083 1 57 VAL QG 1 62 LEU MD1 3.000 . 3.000 2.139 2.001 2.321 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2084 1 57 VAL QG 1 62 LEU QD 2.480 . 2.480 1.959 1.874 2.047 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2085 1 57 VAL QG 1 62 LEU MD2 3.000 . 3.000 2.574 2.029 3.067 0.067 26 0 "[ . 1 . 2 . 3 . 4]" 1
2086 1 58 PRO HA 1 59 GLY H 2.930 . 2.930 2.196 2.172 2.221 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2087 1 58 PRO HA 1 59 GLY HA2 4.480 . 4.480 4.460 4.407 4.487 0.007 22 0 "[ . 1 . 2 . 3 . 4]" 1
2088 1 58 PRO HA 1 59 GLY HA3 4.510 . 4.510 4.422 4.396 4.443 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2089 1 58 PRO HA 1 60 ASN H 4.110 . 4.110 3.622 3.481 3.840 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2090 1 58 PRO HA 1 91 LYS QB 5.220 . 5.220 4.272 4.036 4.780 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2091 1 58 PRO HA 1 92 PRO HD2 4.970 . 4.970 2.950 2.769 3.093 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2092 1 58 PRO HA 1 92 PRO QD 4.370 . 4.370 2.818 2.629 2.947 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2093 1 58 PRO HA 1 92 PRO HD3 4.970 . 4.970 3.598 3.075 3.895 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2094 1 58 PRO HB2 1 60 ASN H 3.530 . 3.530 3.073 2.948 3.333 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2095 1 58 PRO HB2 1 61 ARG H 4.280 . 4.280 3.298 3.136 3.412 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2096 1 58 PRO HB2 1 92 PRO HD2 4.630 . 4.630 3.100 2.719 3.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2097 1 58 PRO HB2 1 92 PRO HD3 4.630 . 4.630 3.239 2.839 3.498 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2098 1 58 PRO HB3 1 59 GLY H 4.460 . 4.460 4.277 4.210 4.364 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2099 1 58 PRO HB3 1 60 ASN H 4.880 . 4.880 4.413 4.271 4.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2100 1 58 PRO HB3 1 61 ARG H 5.080 . 5.080 4.975 4.825 5.084 0.004 14 0 "[ . 1 . 2 . 3 . 4]" 1
2101 1 58 PRO HB3 1 91 LYS HA 4.460 . 4.460 2.890 2.610 3.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2102 1 58 PRO HB3 1 91 LYS QB 4.090 . 4.090 2.382 2.124 2.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2103 1 58 PRO HB3 1 92 PRO HD2 4.180 . 4.180 2.141 2.050 2.559 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2104 1 58 PRO HB3 1 92 PRO HD3 4.180 . 4.180 3.258 2.593 3.535 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2105 1 58 PRO HD2 1 61 ARG QB 5.090 . 5.090 3.977 3.778 4.106 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2106 1 58 PRO HD2 1 61 ARG HD2 4.920 . 4.920 4.176 3.914 4.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2107 1 58 PRO HG2 1 61 ARG H 5.330 . 5.330 3.451 3.327 3.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2108 1 58 PRO HG2 1 61 ARG HD2 4.520 . 4.520 2.462 2.268 2.664 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2109 1 58 PRO HG2 1 91 LYS QE 5.120 . 5.120 4.540 4.199 5.154 0.034 14 0 "[ . 1 . 2 . 3 . 4]" 1
2110 1 58 PRO HG3 1 61 ARG H 5.270 . 5.270 4.981 4.836 5.172 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2111 1 58 PRO HG3 1 61 ARG HD2 4.110 . 4.110 2.731 2.505 2.875 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2112 1 58 PRO HG3 1 61 ARG HD3 4.630 . 4.630 4.486 4.250 4.635 0.005 12 0 "[ . 1 . 2 . 3 . 4]" 1
2113 1 58 PRO HG3 1 91 LYS QE 4.260 . 4.260 2.900 2.537 3.534 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2114 1 59 GLY H 1 60 ASN H 3.230 . 3.230 2.732 2.650 2.844 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2115 1 59 GLY H 1 61 ARG H 4.620 . 4.620 4.349 4.307 4.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2116 1 59 GLY H 1 62 LEU HB2 5.090 . 5.090 5.035 4.891 5.103 0.013 16 0 "[ . 1 . 2 . 3 . 4]" 1
2117 1 59 GLY H 1 62 LEU QD 4.920 . 4.920 4.848 4.619 4.991 0.071 28 0 "[ . 1 . 2 . 3 . 4]" 1
2118 1 59 GLY H 1 92 PRO QD 5.140 . 5.140 3.911 3.755 4.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2119 1 59 GLY H 1 92 PRO HG2 5.500 . 5.500 4.888 4.027 5.167 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2120 1 59 GLY H 1 92 PRO HG3 5.500 . 5.500 3.948 3.504 4.511 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2121 1 59 GLY HA2 1 61 ARG H 5.130 . 5.130 3.554 3.464 3.617 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2122 1 59 GLY HA2 1 62 LEU H 5.320 . 5.320 3.289 3.118 3.437 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2123 1 59 GLY HA2 1 62 LEU QD 3.460 . 3.460 3.157 2.858 3.403 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2124 1 59 GLY HA3 1 60 ASN H 3.500 . 3.500 3.030 2.999 3.069 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2125 1 59 GLY HA3 1 61 ARG H 5.030 . 5.030 4.345 4.277 4.389 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2126 1 59 GLY HA3 1 62 LEU H 4.500 . 4.500 4.399 4.270 4.493 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2127 1 59 GLY HA3 1 62 LEU QD 4.790 . 4.790 4.463 4.204 4.638 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2128 1 60 ASN H 1 60 ASN HB2 3.730 . 3.730 2.330 2.090 3.659 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2129 1 60 ASN H 1 60 ASN QB 3.100 . 3.100 2.161 2.055 2.586 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2130 1 60 ASN H 1 60 ASN HB3 3.730 . 3.730 2.860 2.581 3.035 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2131 1 60 ASN H 1 60 ASN QD 5.090 . 5.090 4.463 3.974 4.595 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2132 1 60 ASN H 1 61 ARG H 3.070 . 3.070 2.723 2.650 2.784 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2133 1 60 ASN H 1 62 LEU H 4.250 . 4.250 4.151 4.039 4.251 0.001 19 0 "[ . 1 . 2 . 3 . 4]" 1
2134 1 60 ASN H 1 62 LEU HB2 5.230 . 5.230 5.147 4.976 5.253 0.023 9 0 "[ . 1 . 2 . 3 . 4]" 1
2135 1 60 ASN HA 1 62 LEU H 4.250 . 4.250 3.829 3.444 3.953 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2136 1 60 ASN QB 1 61 ARG H 4.100 . 4.100 3.230 3.044 3.929 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2137 1 60 ASN QB 1 89 PRO QG 4.280 . 4.280 3.002 2.567 3.416 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2138 1 60 ASN HB2 1 61 ARG H 4.950 . 4.950 4.022 3.869 4.402 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2139 1 60 ASN HB3 1 61 ARG H 4.950 . 4.950 3.419 3.178 4.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2140 1 60 ASN QD 1 89 PRO QB 3.570 . 3.570 2.467 2.144 2.928 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2141 1 60 ASN QD 1 89 PRO QG 3.830 . 3.830 2.691 2.195 3.369 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2142 1 60 ASN HD21 1 89 PRO HB2 5.100 . 5.100 2.767 2.233 3.512 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2143 1 60 ASN HD21 1 89 PRO HB3 5.100 . 5.100 3.817 3.542 4.562 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2144 1 60 ASN HD21 1 89 PRO HG2 5.120 . 5.120 3.835 3.097 4.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2145 1 60 ASN HD21 1 89 PRO HG3 5.120 . 5.120 3.709 3.111 4.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2146 1 60 ASN HD22 1 89 PRO HB2 5.100 . 5.100 3.040 2.722 3.638 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2147 1 60 ASN HD22 1 89 PRO HB3 5.100 . 5.100 4.256 3.726 4.700 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2148 1 60 ASN HD22 1 89 PRO HG2 5.120 . 5.120 3.307 2.762 3.943 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2149 1 60 ASN HD22 1 89 PRO HG3 5.120 . 5.120 3.531 2.313 4.777 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2150 1 61 ARG H 1 61 ARG HB2 3.900 . 3.900 2.556 2.526 2.583 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2151 1 61 ARG H 1 61 ARG QB 3.290 . 3.290 2.515 2.487 2.541 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2152 1 61 ARG H 1 61 ARG HB3 3.900 . 3.900 3.741 3.722 3.766 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2153 1 61 ARG H 1 61 ARG HD2 4.670 . 4.670 4.492 4.361 4.585 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2154 1 61 ARG H 1 61 ARG HD3 5.180 . 5.180 5.192 5.162 5.209 0.029 27 0 "[ . 1 . 2 . 3 . 4]" 1
2155 1 61 ARG H 1 61 ARG HG2 4.240 . 4.240 3.927 3.826 4.033 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2156 1 61 ARG H 1 61 ARG HG3 3.530 . 3.530 2.900 2.845 2.979 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2157 1 61 ARG H 1 62 LEU HB2 4.320 . 4.320 3.672 3.520 3.811 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2158 1 61 ARG H 1 62 LEU MD1 5.470 . 5.470 4.957 4.785 5.060 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2159 1 61 ARG H 1 62 LEU MD2 5.470 . 5.470 5.366 5.204 5.476 0.006 26 0 "[ . 1 . 2 . 3 . 4]" 1
2160 1 61 ARG HA 1 61 ARG HD2 4.900 . 4.900 4.703 4.667 4.736 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2161 1 61 ARG HA 1 61 ARG HD3 4.530 . 4.530 4.283 4.168 4.407 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2162 1 61 ARG QB 1 62 LEU H 3.960 . 3.960 3.587 3.512 3.621 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2163 1 61 ARG QB 1 62 LEU QD 5.280 . 5.280 4.053 3.859 4.227 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2164 1 61 ARG HD2 1 88 ALA MB 4.950 . 4.950 4.077 3.900 4.343 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2165 1 61 ARG HD3 1 88 ALA MB 4.960 . 4.960 2.881 2.661 3.192 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2166 1 61 ARG HG2 1 88 ALA MB 4.710 . 4.710 3.005 2.729 3.312 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2167 1 61 ARG HG3 1 88 ALA MB 4.820 . 4.820 4.222 4.017 4.503 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2168 1 62 LEU H 1 62 LEU HB2 3.210 . 3.210 2.547 2.378 2.741 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2169 1 62 LEU H 1 62 LEU HB3 3.510 . 3.510 3.229 2.872 3.538 0.028 30 0 "[ . 1 . 2 . 3 . 4]" 1
2170 1 62 LEU H 1 62 LEU MD1 4.710 . 4.710 4.210 4.122 4.287 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2171 1 62 LEU H 1 62 LEU QD 3.930 . 3.930 3.820 3.777 3.859 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2172 1 62 LEU H 1 62 LEU MD2 4.710 . 4.710 4.389 4.255 4.533 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2173 1 62 LEU H 1 63 LYS H 4.640 . 4.640 4.491 4.454 4.514 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2174 1 62 LEU HA 1 62 LEU MD1 3.830 . 3.830 2.941 1.975 3.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2175 1 62 LEU HA 1 62 LEU QD 2.780 . 2.780 2.030 1.968 2.086 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2176 1 62 LEU HA 1 62 LEU MD2 3.830 . 3.830 2.895 2.009 3.836 0.006 2 0 "[ . 1 . 2 . 3 . 4]" 1
2177 1 62 LEU HA 1 62 LEU HG 3.830 . 3.830 2.779 2.720 2.820 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2178 1 62 LEU HA 1 63 LYS H 2.930 . 2.930 2.183 2.140 2.232 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2179 1 62 LEU HA 1 63 LYS HB2 4.790 . 4.790 4.504 4.315 4.604 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2180 1 62 LEU HA 1 63 LYS QB 4.210 . 4.210 4.009 3.921 4.123 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2181 1 62 LEU HA 1 63 LYS HB3 4.790 . 4.790 4.498 4.371 4.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2182 1 62 LEU HB2 1 62 LEU MD1 3.300 . 3.300 2.344 2.272 2.420 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2183 1 62 LEU HB2 1 62 LEU QD 2.790 . 2.790 2.191 2.119 2.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2184 1 62 LEU HB2 1 62 LEU MD2 3.300 . 3.300 2.833 2.357 3.252 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2185 1 62 LEU HB2 1 63 LYS H 4.210 . 4.210 4.143 4.024 4.246 0.036 28 0 "[ . 1 . 2 . 3 . 4]" 1
2186 1 62 LEU HB3 1 62 LEU QD 2.500 . 2.500 2.166 2.086 2.277 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2187 1 62 LEU HB3 1 62 LEU MD2 2.940 . 2.940 2.357 2.275 2.433 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2188 1 62 LEU HB3 1 63 LYS H 4.110 . 4.110 3.202 2.735 3.709 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2189 1 62 LEU QD 1 63 LYS H 3.240 . 3.240 2.637 2.394 2.921 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2190 1 62 LEU QD 1 63 LYS HA 4.440 . 4.440 4.577 4.468 4.696 0.256 40 0 "[ . 1 . 2 . 3 . 4]" 1
2191 1 62 LEU QD 1 63 LYS QB 4.320 . 4.320 4.302 4.119 4.511 0.191 16 0 "[ . 1 . 2 . 3 . 4]" 1
2192 1 62 LEU QD 1 64 ILE H 5.440 . 5.440 4.867 4.778 4.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2193 1 62 LEU QD 1 64 ILE MD 3.400 . 3.400 3.173 2.872 3.460 0.060 19 0 "[ . 1 . 2 . 3 . 4]" 1
2194 1 62 LEU QD 1 64 ILE HG12 5.440 . 5.440 4.712 4.533 4.887 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2195 1 62 LEU MD1 1 63 LYS H 4.190 . 4.190 3.586 2.864 4.236 0.046 17 0 "[ . 1 . 2 . 3 . 4]" 1
2196 1 62 LEU MD1 1 63 LYS HA 5.500 . 5.500 5.405 5.231 5.593 0.093 30 0 "[ . 1 . 2 . 3 . 4]" 1
2197 1 62 LEU MD1 1 64 ILE MD 4.410 . 4.410 4.104 3.365 4.824 0.414 5 0 "[ . 1 . 2 . 3 . 4]" 1
2198 1 62 LEU MD2 1 63 LYS H 4.190 . 4.190 3.256 2.408 4.180 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2199 1 62 LEU MD2 1 63 LYS HA 5.500 . 5.500 4.976 4.716 5.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2200 1 62 LEU MD2 1 64 ILE MD 4.410 . 4.410 3.657 2.900 4.351 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2201 1 62 LEU HG 1 63 LYS H 4.350 . 4.350 3.498 2.457 4.403 0.053 32 0 "[ . 1 . 2 . 3 . 4]" 1
2202 1 63 LYS H 1 63 LYS HB2 3.400 . 3.400 3.199 3.102 3.327 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2203 1 63 LYS H 1 63 LYS HB3 3.400 . 3.400 2.661 2.568 2.836 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2204 1 63 LYS H 1 63 LYS QE 5.230 . 5.230 4.759 4.378 5.173 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2205 1 63 LYS H 1 63 LYS HG2 4.980 . 4.980 4.455 4.392 4.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2206 1 63 LYS H 1 63 LYS QG 4.390 . 4.390 4.081 4.046 4.133 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2207 1 63 LYS H 1 63 LYS HG3 4.980 . 4.980 4.737 4.665 4.800 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2208 1 63 LYS H 1 64 ILE H 4.400 . 4.400 4.242 4.191 4.290 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2209 1 63 LYS HA 1 63 LYS QD 4.730 . 4.730 4.100 3.872 4.286 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2210 1 63 LYS HA 1 63 LYS HG2 3.870 . 3.870 3.267 3.115 3.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2211 1 63 LYS HA 1 63 LYS QG 3.330 . 3.330 2.460 2.356 2.551 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2212 1 63 LYS HA 1 63 LYS HG3 3.870 . 3.870 2.546 2.430 2.651 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2213 1 63 LYS HA 1 64 ILE H 3.010 . 3.010 2.086 2.048 2.117 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2214 1 63 LYS HA 1 64 ILE HB 4.970 . 4.970 4.548 4.464 4.617 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2215 1 63 LYS HA 1 64 ILE MD 4.530 . 4.530 4.446 4.221 4.569 0.039 32 0 "[ . 1 . 2 . 3 . 4]" 1
2216 1 63 LYS HA 1 64 ILE HG12 4.870 . 4.870 3.754 3.625 3.823 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2217 1 63 LYS HA 1 64 ILE MG 5.500 . 5.500 5.417 5.368 5.448 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2218 1 63 LYS QB 1 65 LEU MD2 4.320 . 4.320 3.216 2.940 3.450 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2219 1 63 LYS HB2 1 63 LYS QE 4.430 . 4.430 2.513 1.950 3.127 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2220 1 63 LYS HB2 1 64 ILE H 4.540 . 4.540 4.257 4.193 4.330 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2221 1 63 LYS HB3 1 63 LYS QE 4.430 . 4.430 2.674 2.061 3.363 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2222 1 63 LYS HB3 1 64 ILE H 4.540 . 4.540 4.306 4.240 4.339 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2223 1 63 LYS QD 1 64 ILE H 5.340 . 5.340 4.894 4.707 5.058 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2224 1 63 LYS QD 1 65 LEU MD2 3.560 . 3.560 3.304 2.656 3.722 0.162 32 0 "[ . 1 . 2 . 3 . 4]" 1
2225 1 63 LYS QE 1 63 LYS QG 3.080 . 3.080 2.315 2.161 2.777 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2226 1 63 LYS QE 1 64 ILE H 5.500 . 5.500 5.192 4.632 5.529 0.029 2 0 "[ . 1 . 2 . 3 . 4]" 1
2227 1 63 LYS QE 1 65 LEU MD2 4.230 . 4.230 3.339 1.942 4.638 0.408 39 0 "[ . 1 . 2 . 3 . 4]" 1
2228 1 63 LYS QG 1 64 ILE H 3.430 . 3.430 2.927 2.793 3.036 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2229 1 63 LYS HG2 1 64 ILE H 3.950 . 3.950 3.484 3.227 3.718 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2230 1 63 LYS HG2 1 65 LEU MD2 4.170 . 4.170 2.451 2.203 2.673 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2231 1 63 LYS HG3 1 64 ILE H 3.950 . 3.950 3.157 2.955 3.378 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2232 1 63 LYS HG3 1 65 LEU MD2 4.170 . 4.170 4.023 3.784 4.216 0.046 21 0 "[ . 1 . 2 . 3 . 4]" 1
2233 1 64 ILE H 1 64 ILE HB 2.830 . 2.830 2.514 2.468 2.567 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2234 1 64 ILE H 1 64 ILE MD 3.520 . 3.520 3.234 3.101 3.332 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2235 1 64 ILE H 1 64 ILE HG12 3.460 . 3.460 2.087 2.023 2.148 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2236 1 64 ILE H 1 64 ILE HG13 3.650 . 3.650 3.550 3.503 3.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2237 1 64 ILE H 1 64 ILE MG 3.790 . 3.790 3.755 3.724 3.779 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2238 1 64 ILE H 1 65 LEU H 4.760 . 4.760 4.562 4.516 4.603 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2239 1 64 ILE HA 1 64 ILE MD 3.430 . 3.430 2.254 2.220 2.284 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2240 1 64 ILE HA 1 64 ILE HG12 3.700 . 3.700 3.169 3.122 3.213 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2241 1 64 ILE HA 1 64 ILE HG13 3.860 . 3.860 3.803 3.769 3.837 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2242 1 64 ILE HA 1 64 ILE MG 3.130 . 3.130 2.333 2.287 2.361 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2243 1 64 ILE HA 1 65 LEU H 3.060 . 3.060 2.173 2.137 2.200 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2244 1 64 ILE HA 1 65 LEU HB2 5.080 . 5.080 4.653 4.620 4.697 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2245 1 64 ILE HA 1 65 LEU HG 4.140 . 4.140 3.830 3.738 3.921 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2246 1 64 ILE HB 1 64 ILE MD 3.330 . 3.330 3.299 3.292 3.306 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2247 1 64 ILE HB 1 65 LEU H 4.250 . 4.250 4.222 4.183 4.255 0.005 22 0 "[ . 1 . 2 . 3 . 4]" 1
2248 1 64 ILE HB 1 66 VAL H 4.970 . 4.970 4.232 3.516 4.973 0.003 23 0 "[ . 1 . 2 . 3 . 4]" 1
2249 1 64 ILE HB 1 66 VAL QG 4.250 . 4.250 3.150 2.624 4.276 0.026 38 0 "[ . 1 . 2 . 3 . 4]" 1
2250 1 64 ILE MD 1 64 ILE MG 2.550 . 2.550 2.064 2.030 2.129 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2251 1 64 ILE MD 1 65 LEU H 4.070 . 4.070 3.875 3.798 3.935 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2252 1 64 ILE HG12 1 64 ILE MG 3.310 . 3.310 3.199 3.189 3.216 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2253 1 64 ILE HG12 1 65 LEU H 5.230 . 5.230 5.196 5.141 5.232 0.002 18 0 "[ . 1 . 2 . 3 . 4]" 1
2254 1 64 ILE HG13 1 64 ILE MG 3.400 . 3.400 2.297 2.236 2.345 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2255 1 64 ILE HG13 1 65 LEU H 5.500 . 5.500 5.518 5.492 5.536 0.036 30 0 "[ . 1 . 2 . 3 . 4]" 1
2256 1 64 ILE MG 1 65 LEU H 3.240 . 3.240 2.738 2.660 2.792 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2257 1 64 ILE MG 1 65 LEU HA 4.270 . 4.270 4.015 3.770 4.212 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2258 1 64 ILE MG 1 65 LEU HB2 5.140 . 5.140 4.501 4.402 4.649 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2259 1 64 ILE MG 1 65 LEU HG 5.500 . 5.500 4.834 4.744 4.928 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2260 1 64 ILE MG 1 66 VAL H 3.990 . 3.990 3.072 1.867 3.519 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2261 1 64 ILE MG 1 66 VAL HA 4.190 . 4.190 3.252 2.553 4.152 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2262 1 65 LEU H 1 65 LEU HB2 3.690 . 3.690 2.517 2.485 2.577 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2263 1 65 LEU H 1 65 LEU HB3 3.800 . 3.800 3.669 3.645 3.710 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2264 1 65 LEU H 1 65 LEU MD1 4.050 . 4.050 3.782 3.708 3.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2265 1 65 LEU H 1 65 LEU MD2 3.450 . 3.450 3.470 3.350 3.498 0.048 9 0 "[ . 1 . 2 . 3 . 4]" 1
2266 1 65 LEU H 1 65 LEU HG 3.580 . 3.580 2.526 2.439 2.671 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2267 1 65 LEU H 1 66 VAL H 4.160 . 4.160 3.835 2.088 4.168 0.008 23 0 "[ . 1 . 2 . 3 . 4]" 1
2268 1 65 LEU HA 1 65 LEU MD1 4.140 . 4.140 3.867 3.818 3.919 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2269 1 65 LEU HA 1 65 LEU MD2 2.750 . 2.750 2.206 2.140 2.355 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2270 1 65 LEU HA 1 65 LEU HG 4.050 . 4.050 3.247 3.178 3.370 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2271 1 65 LEU HA 1 66 VAL H 3.110 . 3.110 2.342 2.160 3.147 0.037 22 0 "[ . 1 . 2 . 3 . 4]" 1
2272 1 65 LEU HA 1 66 VAL QG 4.380 . 4.380 3.680 3.134 4.361 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2273 1 65 LEU HB2 1 65 LEU MD1 2.850 . 2.850 2.300 2.269 2.325 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2274 1 65 LEU HB3 1 65 LEU MD1 3.320 . 3.320 2.335 2.231 2.399 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2275 1 65 LEU HB3 1 65 LEU MD2 3.500 . 3.500 2.439 2.370 2.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2276 1 65 LEU HB3 1 66 VAL H 4.620 . 4.620 4.125 3.775 4.463 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2277 1 65 LEU MD2 1 66 VAL H 4.490 . 4.490 4.139 3.952 4.541 0.051 22 0 "[ . 1 . 2 . 3 . 4]" 1
2278 1 66 VAL H 1 66 VAL HB 3.760 . 3.760 2.961 2.510 3.766 0.006 18 0 "[ . 1 . 2 . 3 . 4]" 1
2279 1 66 VAL H 1 66 VAL MG2 3.390 . 3.390 2.037 1.721 2.793 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2280 1 66 VAL HA 1 66 VAL MG1 3.280 . 3.280 2.337 2.158 2.426 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2281 1 66 VAL HA 1 66 VAL MG2 3.280 . 3.280 2.698 2.361 3.271 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2282 1 66 VAL HB 1 69 TYR QD 5.500 . 5.500 3.811 2.001 5.246 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2283 1 66 VAL QG 1 67 GLY QA 4.050 . 4.050 3.833 3.421 4.248 0.198 9 0 "[ . 1 . 2 . 3 . 4]" 1
2284 1 66 VAL QG 1 69 TYR QB 4.970 . 4.970 3.543 2.227 4.792 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2285 1 66 VAL QG 1 69 TYR QD 4.140 . 4.140 2.651 2.080 3.637 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2286 1 66 VAL QG 1 69 TYR QE 4.530 . 4.530 3.076 2.115 4.186 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2287 1 68 MET QB 1 69 TYR QD 4.700 . 4.700 3.492 2.248 4.716 0.016 38 0 "[ . 1 . 2 . 3 . 4]" 1
2288 1 68 MET QB 1 69 TYR QE 5.450 . 5.450 4.060 2.894 5.509 0.059 2 0 "[ . 1 . 2 . 3 . 4]" 1
2289 1 68 MET ME 1 69 TYR QD 5.050 . 5.050 4.361 2.453 5.158 0.108 10 0 "[ . 1 . 2 . 3 . 4]" 1
2290 1 69 TYR HA 1 69 TYR QD 3.900 . 3.900 2.917 2.206 3.789 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2291 1 71 LYS HA 1 71 LYS QD 4.160 . 4.160 3.707 2.093 4.203 0.043 11 0 "[ . 1 . 2 . 3 . 4]" 1
2292 1 71 LYS HA 1 71 LYS HG2 4.140 . 4.140 2.854 2.200 3.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2293 1 71 LYS HA 1 71 LYS QG 3.630 . 3.630 2.470 2.178 3.395 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2294 1 71 LYS HA 1 71 LYS HG3 4.140 . 4.140 2.940 2.376 3.899 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2295 1 72 LYS HA 1 72 LYS QD 4.450 . 4.450 4.024 2.077 4.472 0.022 36 0 "[ . 1 . 2 . 3 . 4]" 1
2296 1 72 LYS HA 1 72 LYS HG2 3.960 . 3.960 2.828 2.381 3.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2297 1 72 LYS HA 1 72 LYS HG3 3.960 . 3.960 3.135 2.119 3.806 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2298 1 72 LYS HA 1 73 PRO HD2 3.090 . 3.090 2.581 2.442 2.821 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2299 1 72 LYS HA 1 73 PRO HD3 3.090 . 3.090 2.508 2.295 2.737 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2300 1 72 LYS QB 1 73 PRO QD 3.270 . 3.270 2.378 2.028 3.309 0.039 32 0 "[ . 1 . 2 . 3 . 4]" 1
2301 1 72 LYS HB2 1 73 PRO HD2 4.930 . 4.930 3.719 2.180 4.409 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2302 1 72 LYS HB2 1 73 PRO HD3 4.930 . 4.930 4.722 3.546 4.971 0.041 32 0 "[ . 1 . 2 . 3 . 4]" 1
2303 1 72 LYS HB3 1 73 PRO HD2 4.930 . 4.930 2.661 2.060 3.839 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2304 1 72 LYS HB3 1 73 PRO HD3 4.930 . 4.930 3.925 3.331 4.749 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2305 1 74 ALA MB 1 75 GLY QA 4.160 . 4.160 3.759 3.494 4.177 0.017 4 0 "[ . 1 . 2 . 3 . 4]" 1
2306 1 82 GLY QA 1 83 LEU H 3.540 . 3.540 2.472 2.137 2.956 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2307 1 82 GLY QA 1 83 LEU QB 5.340 . 5.340 4.166 3.583 4.722 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2308 1 82 GLY QA 1 83 LEU QD 5.040 . 5.040 4.075 2.814 4.885 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2309 1 82 GLY QA 1 83 LEU HG 5.500 . 5.500 4.212 3.502 5.509 0.009 22 0 "[ . 1 . 2 . 3 . 4]" 1
2310 1 83 LEU H 1 83 LEU HB2 4.140 . 4.140 2.752 2.156 3.636 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2311 1 83 LEU H 1 83 LEU QB 3.470 . 3.470 2.670 2.133 3.396 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2312 1 83 LEU H 1 83 LEU HB3 4.140 . 4.140 3.737 2.898 4.082 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2313 1 83 LEU H 1 83 LEU MD1 4.770 . 4.770 3.904 2.612 4.552 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2314 1 83 LEU H 1 83 LEU QD 4.100 . 4.100 3.290 2.580 3.917 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2315 1 83 LEU H 1 83 LEU MD2 4.770 . 4.770 3.725 2.619 4.536 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2316 1 83 LEU H 1 83 LEU HG 4.620 . 4.620 3.123 2.131 4.643 0.023 14 0 "[ . 1 . 2 . 3 . 4]" 1
2317 1 83 LEU HA 1 83 LEU MD1 4.020 . 4.020 3.762 2.193 3.964 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2318 1 83 LEU HA 1 83 LEU QD 2.870 . 2.870 2.257 1.951 3.047 0.177 38 0 "[ . 1 . 2 . 3 . 4]" 1
2319 1 83 LEU HA 1 83 LEU MD2 4.020 . 4.020 2.365 2.099 3.809 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2320 1 83 LEU HA 1 83 LEU HG 3.920 . 3.920 3.005 2.428 3.632 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2321 1 83 LEU QB 1 83 LEU QD 2.650 . 2.650 1.939 1.880 2.078 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2322 1 83 LEU HG 1 84 THR H 5.500 . 5.500 4.719 3.542 5.234 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2323 1 84 THR H 1 84 THR MG 4.500 . 4.500 3.147 2.200 3.962 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2324 1 84 THR HA 1 84 THR MG 3.200 . 3.200 2.419 2.179 3.249 0.049 36 0 "[ . 1 . 2 . 3 . 4]" 1
2325 1 84 THR HB 1 85 ASP H 4.180 . 4.180 3.257 1.662 4.217 0.037 38 0 "[ . 1 . 2 . 3 . 4]" 1
2326 1 84 THR MG 1 85 ASP H 5.070 . 5.070 3.678 1.812 4.462 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2327 1 85 ASP H 1 85 ASP QB 3.660 . 3.660 2.715 2.244 3.393 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2328 1 85 ASP HA 1 86 GLU H 3.200 . 3.200 2.489 2.148 3.152 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2329 1 85 ASP HB2 1 86 GLU H 4.450 . 4.450 3.955 2.113 4.483 0.033 22 0 "[ . 1 . 2 . 3 . 4]" 1
2330 1 85 ASP HB3 1 86 GLU H 4.450 . 4.450 3.467 1.730 4.472 0.022 26 0 "[ . 1 . 2 . 3 . 4]" 1
2331 1 86 GLU H 1 86 GLU HB2 4.160 . 4.160 3.026 2.343 3.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2332 1 86 GLU H 1 86 GLU QB 3.290 . 3.290 2.719 2.259 3.314 0.024 39 0 "[ . 1 . 2 . 3 . 4]" 1
2333 1 86 GLU H 1 86 GLU HB3 4.160 . 4.160 3.310 2.543 4.068 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2334 1 86 GLU H 1 86 GLU HG2 5.290 . 5.290 4.370 1.821 5.074 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2335 1 86 GLU H 1 86 GLU QG 4.520 . 4.520 3.743 1.789 4.260 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2336 1 86 GLU H 1 86 GLU HG3 5.290 . 5.290 4.205 2.518 5.106 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2337 1 86 GLU H 1 87 LEU H 4.070 . 4.070 3.735 2.881 4.120 0.050 38 0 "[ . 1 . 2 . 3 . 4]" 1
2338 1 86 GLU H 1 87 LEU HG 4.890 . 4.890 4.568 3.709 4.906 0.016 7 0 "[ . 1 . 2 . 3 . 4]" 1
2339 1 86 GLU HA 1 86 GLU HG2 3.980 . 3.980 2.873 2.355 3.805 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2340 1 86 GLU HA 1 86 GLU QG 3.420 . 3.420 2.433 2.276 3.387 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2341 1 86 GLU HA 1 86 GLU HG3 3.980 . 3.980 2.767 2.353 3.970 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2342 1 86 GLU HA 1 87 LEU H 2.760 . 2.760 2.245 2.122 2.740 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2343 1 86 GLU HA 1 87 LEU HB2 5.410 . 5.410 4.615 4.485 4.969 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2344 1 86 GLU HA 1 87 LEU HG 5.500 . 5.500 4.204 3.700 4.864 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2345 1 86 GLU QB 1 86 GLU QG 2.330 . 2.330 2.097 2.011 2.122 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2346 1 86 GLU QB 1 87 LEU H 4.020 . 4.020 3.868 3.073 4.043 0.023 26 0 "[ . 1 . 2 . 3 . 4]" 1
2347 1 86 GLU HB2 1 87 LEU H 4.720 . 4.720 4.481 3.169 4.630 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2348 1 86 GLU HB3 1 87 LEU H 4.720 . 4.720 4.260 3.350 4.537 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2349 1 86 GLU QG 1 87 LEU H 4.460 . 4.460 3.752 2.808 4.502 0.042 39 0 "[ . 1 . 2 . 3 . 4]" 1
2350 1 86 GLU HG2 1 87 LEU H 5.090 . 5.090 4.147 2.936 5.109 0.019 8 0 "[ . 1 . 2 . 3 . 4]" 1
2351 1 86 GLU HG3 1 87 LEU H 5.090 . 5.090 4.363 3.455 5.139 0.049 32 0 "[ . 1 . 2 . 3 . 4]" 1
2352 1 87 LEU H 1 87 LEU HB2 3.060 . 3.060 2.464 2.411 2.531 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2353 1 87 LEU H 1 87 LEU HB3 3.690 . 3.690 3.619 3.577 3.694 0.004 25 0 "[ . 1 . 2 . 3 . 4]" 1
2354 1 87 LEU H 1 87 LEU MD1 4.150 . 4.150 3.635 3.468 3.845 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2355 1 87 LEU H 1 87 LEU QD 3.620 . 3.620 3.183 3.058 3.345 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2356 1 87 LEU H 1 87 LEU MD2 4.150 . 4.150 3.520 3.322 3.714 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2357 1 87 LEU H 1 87 LEU HG 3.280 . 3.280 2.411 2.201 2.701 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2358 1 87 LEU H 1 88 ALA HA 5.500 . 5.500 5.407 5.119 5.527 0.027 39 0 "[ . 1 . 2 . 3 . 4]" 1
2359 1 87 LEU HA 1 87 LEU MD1 4.130 . 4.130 3.890 3.857 3.914 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2360 1 87 LEU HA 1 87 LEU QD 2.710 . 2.710 2.143 2.094 2.181 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2361 1 87 LEU HA 1 87 LEU MD2 4.130 . 4.130 2.153 2.103 2.192 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2362 1 87 LEU HA 1 87 LEU HG 4.200 . 4.200 3.095 3.006 3.159 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2363 1 87 LEU HA 1 88 ALA H 2.790 . 2.790 2.155 2.085 2.265 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2364 1 87 LEU HA 1 88 ALA MB 4.050 . 4.050 3.890 3.773 3.987 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2365 1 87 LEU HB2 1 87 LEU QD 3.120 . 3.120 2.248 2.228 2.263 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2366 1 87 LEU HB2 1 88 ALA H 4.520 . 4.520 4.098 3.839 4.358 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2367 1 87 LEU HB3 1 87 LEU MD1 3.220 . 3.220 2.404 2.366 2.454 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2368 1 87 LEU HB3 1 87 LEU MD2 3.220 . 3.220 2.381 2.348 2.418 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2369 1 87 LEU HB3 1 88 ALA H 3.550 . 3.550 3.080 2.660 3.572 0.022 30 0 "[ . 1 . 2 . 3 . 4]" 1
2370 1 87 LEU HB3 1 88 ALA MB 4.860 . 4.860 4.616 4.325 4.885 0.025 30 0 "[ . 1 . 2 . 3 . 4]" 1
2371 1 88 ALA H 1 88 ALA MB 2.900 . 2.900 2.230 2.191 2.275 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2372 1 88 ALA MB 1 89 PRO HD2 3.610 . 3.610 2.371 2.209 2.539 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2373 1 88 ALA MB 1 89 PRO HD3 3.610 . 3.610 3.573 3.497 3.644 0.034 29 0 "[ . 1 . 2 . 3 . 4]" 1
2374 1 88 ALA MB 1 89 PRO QG 4.240 . 4.240 3.756 3.572 3.924 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2375 1 89 PRO HA 1 90 PRO HD2 3.290 . 3.290 2.822 2.687 3.238 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2376 1 89 PRO HA 1 90 PRO HD3 3.290 . 3.290 2.499 2.101 2.655 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2377 1 89 PRO HA 1 90 PRO QG 4.310 . 4.310 4.210 3.855 4.319 0.009 34 0 "[ . 1 . 2 . 3 . 4]" 1
2378 1 89 PRO QB 1 90 PRO QD 3.090 . 3.090 2.266 2.126 2.521 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2379 1 89 PRO HB2 1 90 PRO HD2 4.110 . 4.110 2.363 2.187 2.720 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2380 1 89 PRO HB2 1 90 PRO HD3 4.110 . 4.110 3.620 3.197 3.801 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2381 1 89 PRO HB3 1 90 PRO HD2 4.110 . 4.110 3.274 3.131 3.760 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2382 1 89 PRO HB3 1 90 PRO HD3 4.110 . 4.110 4.046 3.627 4.134 0.024 27 0 "[ . 1 . 2 . 3 . 4]" 1
2383 1 90 PRO HA 1 91 LYS H 2.900 . 2.900 2.331 2.251 2.430 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2384 1 90 PRO QB 1 91 LYS H 3.660 . 3.660 2.738 2.535 2.997 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2385 1 90 PRO QG 1 91 LYS H 4.640 . 4.640 4.269 4.072 4.475 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2386 1 91 LYS H 1 91 LYS QB 3.160 . 3.160 2.730 2.350 2.983 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2387 1 91 LYS H 1 91 LYS QD 4.640 . 4.640 4.034 3.789 4.189 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2388 1 91 LYS H 1 91 LYS HE2 5.500 . 5.500 4.829 4.318 5.508 0.008 26 0 "[ . 1 . 2 . 3 . 4]" 1
2389 1 91 LYS H 1 91 LYS QE 4.660 . 4.660 4.069 3.647 4.666 0.006 14 0 "[ . 1 . 2 . 3 . 4]" 1
2390 1 91 LYS H 1 91 LYS HE3 5.500 . 5.500 4.384 3.931 5.253 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2391 1 91 LYS H 1 91 LYS HG2 4.080 . 4.080 2.378 1.881 3.676 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2392 1 91 LYS H 1 91 LYS QG 3.340 . 3.340 2.076 1.856 2.451 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2393 1 91 LYS H 1 91 LYS HG3 4.080 . 4.080 2.757 2.399 3.012 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2394 1 91 LYS H 1 92 PRO HD2 5.220 . 5.220 5.024 4.984 5.244 0.024 13 0 "[ . 1 . 2 . 3 . 4]" 1
2395 1 91 LYS H 1 92 PRO QD 4.550 . 4.550 4.553 4.495 4.568 0.018 30 0 "[ . 1 . 2 . 3 . 4]" 1
2396 1 91 LYS H 1 92 PRO HD3 5.220 . 5.220 5.211 4.890 5.245 0.025 40 0 "[ . 1 . 2 . 3 . 4]" 1
2397 1 91 LYS HA 1 92 PRO HD2 3.980 . 3.980 2.564 2.451 3.047 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2398 1 91 LYS HA 1 92 PRO QD 3.320 . 3.320 2.263 2.102 2.303 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2399 1 91 LYS HA 1 92 PRO HD3 3.980 . 3.980 2.529 2.142 2.599 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2400 1 91 LYS QB 1 91 LYS QE 4.530 . 4.530 2.465 2.099 3.553 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2401 1 91 LYS QB 1 92 PRO HD2 4.260 . 4.260 2.338 2.206 2.574 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2402 1 91 LYS QB 1 92 PRO HD3 4.260 . 4.260 3.585 3.060 3.783 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2403 1 91 LYS QE 1 91 LYS QG 3.340 . 3.340 2.319 2.149 2.384 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2404 1 91 LYS QG 1 92 PRO QD 5.180 . 5.180 3.832 3.380 4.038 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2405 1 92 PRO HA 1 93 PRO HD2 3.430 . 3.430 2.753 2.636 3.065 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2406 1 92 PRO HA 1 93 PRO HD3 3.550 . 3.550 2.514 2.117 2.653 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2407 1 92 PRO HA 1 93 PRO QG 4.340 . 4.340 4.239 3.890 4.298 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2408 1 92 PRO HB2 1 93 PRO HD2 3.890 . 3.890 2.469 2.326 3.055 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2409 1 92 PRO HB2 1 93 PRO HD3 4.300 . 4.300 3.784 3.496 4.301 0.001 13 0 "[ . 1 . 2 . 3 . 4]" 1
2410 1 92 PRO HB2 1 94 LEU QD 5.440 . 5.440 5.016 4.231 5.105 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2411 1 92 PRO HB3 1 93 PRO HD2 3.710 . 3.710 3.218 2.497 3.624 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2412 1 92 PRO HB3 1 93 PRO HD3 4.250 . 4.250 4.087 3.720 4.250 . 38 0 "[ . 1 . 2 . 3 . 4]" 1
2413 1 92 PRO HG2 1 93 PRO HD2 4.960 . 4.960 4.579 4.463 4.960 0.000 13 0 "[ . 1 . 2 . 3 . 4]" 1
2414 1 93 PRO HA 1 94 LEU H 2.560 . 2.560 2.467 2.197 2.550 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2415 1 93 PRO HA 1 94 LEU QB 4.290 . 4.290 4.153 4.050 4.249 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2416 1 93 PRO HB2 1 94 LEU H 3.490 . 3.490 2.484 2.320 3.320 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2417 1 93 PRO HB2 1 94 LEU HA 4.430 . 4.430 4.233 4.118 4.300 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2418 1 93 PRO HB3 1 94 LEU H 3.500 . 3.500 3.440 2.648 3.509 0.009 13 0 "[ . 1 . 2 . 3 . 4]" 1
2419 1 93 PRO HD2 1 94 LEU H 5.500 . 5.500 5.501 5.216 5.531 0.031 34 0 "[ . 1 . 2 . 3 . 4]" 1
2420 1 93 PRO HD3 1 94 LEU H 5.500 . 5.500 5.484 5.437 5.584 0.084 29 0 "[ . 1 . 2 . 3 . 4]" 1
2421 1 93 PRO QG 1 94 LEU H 4.240 . 4.240 3.953 3.843 4.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2422 1 94 LEU H 1 94 LEU QB 2.860 . 2.860 2.540 2.446 2.573 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2423 1 94 LEU H 1 94 LEU MD1 4.670 . 4.670 4.337 4.177 4.427 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2424 1 94 LEU H 1 94 LEU QD 3.990 . 3.990 3.792 3.728 3.841 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2425 1 94 LEU H 1 94 LEU MD2 4.670 . 4.670 4.186 4.136 4.229 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2426 1 94 LEU H 1 94 LEU HG 4.300 . 4.300 3.634 3.508 3.736 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2427 1 94 LEU H 1 95 PRO HD2 4.900 . 4.900 4.904 4.855 4.930 0.030 34 0 "[ . 1 . 2 . 3 . 4]" 1
2428 1 94 LEU H 1 95 PRO HD3 5.140 . 5.140 4.978 4.833 5.101 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2429 1 94 LEU HA 1 94 LEU MD1 3.990 . 3.990 3.808 3.778 3.827 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2430 1 94 LEU HA 1 94 LEU QD 2.940 . 2.940 2.012 1.984 2.039 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2431 1 94 LEU HA 1 94 LEU MD2 3.990 . 3.990 2.020 1.991 2.046 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2432 1 94 LEU HA 1 94 LEU HG 3.800 . 3.800 2.975 2.877 3.043 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2433 1 94 LEU HA 1 95 PRO HD2 3.270 . 3.270 2.537 2.462 2.613 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2434 1 94 LEU HA 1 95 PRO HD3 3.180 . 3.180 2.363 2.230 2.474 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2435 1 94 LEU HA 1 95 PRO QG 4.540 . 4.540 4.109 4.050 4.180 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2436 1 94 LEU QB 1 94 LEU MD1 2.990 . 2.990 2.060 2.032 2.080 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2437 1 94 LEU QB 1 94 LEU QD 2.550 . 2.550 1.935 1.913 1.953 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2438 1 94 LEU QB 1 94 LEU MD2 2.990 . 2.990 2.348 2.315 2.385 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2439 1 94 LEU QB 1 95 PRO HD2 3.240 . 3.240 2.204 2.092 2.312 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2440 1 94 LEU QB 1 95 PRO HD3 3.640 . 3.640 3.494 3.417 3.533 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2441 1 94 LEU QB 1 95 PRO HG2 4.850 . 4.850 3.852 3.690 4.072 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2442 1 94 LEU QB 1 95 PRO QG 4.070 . 4.070 3.687 3.546 3.875 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2443 1 94 LEU QB 1 95 PRO HG3 4.850 . 4.850 4.708 4.585 4.860 0.010 26 0 "[ . 1 . 2 . 3 . 4]" 1
2444 1 94 LEU QD 1 95 PRO HD2 3.180 . 3.180 2.132 2.025 2.250 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2445 1 94 LEU QD 1 95 PRO HD3 3.520 . 3.520 2.859 2.751 2.951 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2446 1 94 LEU QD 1 95 PRO QG 3.870 . 3.870 3.512 3.387 3.608 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2447 1 94 LEU MD1 1 95 PRO HD2 3.820 . 3.820 3.556 3.345 3.675 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2448 1 94 LEU MD1 1 95 PRO HD3 4.820 . 4.820 4.827 4.668 4.885 0.065 9 0 "[ . 1 . 2 . 3 . 4]" 1
2449 1 94 LEU MD2 1 95 PRO HD2 3.820 . 3.820 2.149 2.042 2.273 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2450 1 94 LEU MD2 1 95 PRO HD3 4.820 . 4.820 2.880 2.768 2.975 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2451 1 94 LEU HG 1 95 PRO HD2 4.370 . 4.370 4.292 4.189 4.371 0.001 26 0 "[ . 1 . 2 . 3 . 4]" 1
2452 1 94 LEU HG 1 95 PRO HD3 5.280 . 5.280 4.999 4.873 5.085 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2453 1 95 PRO HA 1 96 GLU H 2.780 . 2.780 2.524 2.335 2.798 0.018 15 0 "[ . 1 . 2 . 3 . 4]" 1
2454 1 95 PRO HA 1 96 GLU QB 4.610 . 4.610 4.497 4.057 4.625 0.015 3 0 "[ . 1 . 2 . 3 . 4]" 1
2455 1 95 PRO QB 1 96 GLU H 3.030 . 3.030 2.298 1.883 2.520 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2456 1 95 PRO QB 1 97 GLY H 4.710 . 4.710 3.481 2.212 4.428 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2457 1 95 PRO HB2 1 96 GLU H 3.510 . 3.510 2.336 1.895 2.582 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2458 1 95 PRO HB3 1 96 GLU H 3.510 . 3.510 3.459 3.268 3.539 0.029 26 0 "[ . 1 . 2 . 3 . 4]" 1
2459 1 95 PRO HD2 1 96 GLU H 5.460 . 5.460 5.382 5.008 5.493 0.033 5 0 "[ . 1 . 2 . 3 . 4]" 1
2460 1 95 PRO QG 1 96 GLU H 4.360 . 4.360 3.808 3.270 4.045 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2461 1 95 PRO QG 1 97 GLY H 5.050 . 5.050 3.729 2.340 5.108 0.058 33 0 "[ . 1 . 2 . 3 . 4]" 1
2462 1 95 PRO HG2 1 96 GLU H 5.000 . 5.000 3.994 3.383 4.267 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2463 1 95 PRO HG3 1 96 GLU H 5.000 . 5.000 4.805 4.335 5.017 0.017 36 0 "[ . 1 . 2 . 3 . 4]" 1
2464 1 96 GLU H 1 96 GLU HB2 3.770 . 3.770 2.668 2.324 3.147 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2465 1 96 GLU H 1 96 GLU QB 2.990 . 2.990 2.600 2.202 3.003 0.013 14 0 "[ . 1 . 2 . 3 . 4]" 1
2466 1 96 GLU H 1 96 GLU HB3 3.770 . 3.770 3.682 2.639 3.861 0.091 30 0 "[ . 1 . 2 . 3 . 4]" 1
2467 1 96 GLU H 1 96 GLU HG2 4.680 . 4.680 3.995 2.380 4.721 0.041 19 0 "[ . 1 . 2 . 3 . 4]" 1
2468 1 96 GLU H 1 96 GLU HG3 4.680 . 4.680 3.420 2.298 4.524 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2469 1 96 GLU H 1 97 GLY H 4.010 . 4.010 3.039 2.461 4.025 0.015 40 0 "[ . 1 . 2 . 3 . 4]" 1
2470 1 96 GLU HA 1 96 GLU HG2 4.110 . 4.110 2.714 2.117 3.751 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2471 1 96 GLU HA 1 96 GLU QG 3.600 . 3.600 2.402 2.088 2.930 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2472 1 96 GLU HA 1 96 GLU HG3 4.110 . 4.110 2.918 2.343 3.844 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2473 1 96 GLU HA 1 97 GLY H 3.080 . 3.080 2.914 2.293 3.199 0.119 19 0 "[ . 1 . 2 . 3 . 4]" 1
2474 1 96 GLU QB 1 97 GLY H 4.370 . 4.370 3.729 3.188 4.025 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2475 1 96 GLU QG 1 97 GLY H 5.020 . 5.020 4.536 4.294 4.829 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2476 1 97 GLY QA 1 98 GLU H 3.060 . 3.060 2.343 2.119 2.958 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2477 1 97 GLY HA2 1 98 GLU H 3.500 . 3.500 2.697 2.168 3.515 0.015 37 0 "[ . 1 . 2 . 3 . 4]" 1
2478 1 97 GLY HA3 1 98 GLU H 3.500 . 3.500 2.743 2.144 3.517 0.017 11 0 "[ . 1 . 2 . 3 . 4]" 1
2479 1 98 GLU H 1 98 GLU HB2 4.200 . 4.200 2.757 2.056 3.947 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2480 1 98 GLU H 1 98 GLU QB 3.380 . 3.380 2.483 2.028 3.150 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2481 1 98 GLU H 1 98 GLU HB3 4.200 . 4.200 3.183 2.476 4.048 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2482 1 98 GLU H 1 98 GLU QG 4.790 . 4.790 3.237 2.084 4.305 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2483 1 98 GLU HA 1 99 VAL H 3.080 . 3.080 2.308 2.061 2.972 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
2484 1 98 GLU HA 1 99 VAL QG 5.200 . 5.200 3.629 3.109 4.499 . 0 0 "[ . 1 . 2 . 3 . 4]" 1
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