NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
605156 |
2n7e   |
25803 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n7e
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 1590
_Distance_constraint_stats_list.Viol_count 4541
_Distance_constraint_stats_list.Viol_total 4931.902
_Distance_constraint_stats_list.Viol_max 0.497
_Distance_constraint_stats_list.Viol_rms 0.0121
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0017
_Distance_constraint_stats_list.Viol_average_violations_only 0.0253
_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 1 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 ]"
1 2 ILE 0.486 0.090 23 0 "[ . 1 . 2 . 3 . 4 ]"
1 3 GLU 0.527 0.090 23 0 "[ . 1 . 2 . 3 . 4 ]"
1 4 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 ]"
1 5 ARG 0.299 0.093 10 0 "[ . 1 . 2 . 3 . 4 ]"
1 6 HIS 0.305 0.064 26 0 "[ . 1 . 2 . 3 . 4 ]"
1 7 MET 8.351 0.497 27 0 "[ . 1 . 2 . 3 . 4 ]"
1 8 ASP 1.304 0.077 27 0 "[ . 1 . 2 . 3 . 4 ]"
1 9 LEU 5.318 0.263 27 0 "[ . 1 . 2 . 3 . 4 ]"
1 10 THR 5.451 0.263 27 0 "[ . 1 . 2 . 3 . 4 ]"
1 11 ILE 8.716 0.444 32 0 "[ . 1 . 2 . 3 . 4 ]"
1 12 SER 2.973 0.156 29 0 "[ . 1 . 2 . 3 . 4 ]"
1 13 ASN 8.581 0.292 21 0 "[ . 1 . 2 . 3 . 4 ]"
1 14 GLU 1.162 0.128 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 15 LEU 3.123 0.292 21 0 "[ . 1 . 2 . 3 . 4 ]"
1 16 THR 4.099 0.256 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 17 GLY 1.519 0.102 21 0 "[ . 1 . 2 . 3 . 4 ]"
1 18 GLU 0.467 0.049 1 0 "[ . 1 . 2 . 3 . 4 ]"
1 19 ILE 0.373 0.049 1 0 "[ . 1 . 2 . 3 . 4 ]"
1 20 TYR 0.021 0.006 42 0 "[ . 1 . 2 . 3 . 4 ]"
1 21 GLY 13.926 0.444 32 0 "[ . 1 . 2 . 3 . 4 ]"
1 22 PRO 3.592 0.270 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 23 ILE 10.987 0.322 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 24 GLU 0.654 0.037 32 0 "[ . 1 . 2 . 3 . 4 ]"
1 25 VAL 5.312 0.222 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 26 SER 3.718 0.135 27 0 "[ . 1 . 2 . 3 . 4 ]"
1 27 GLU 1.912 0.222 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 28 ASP 2.585 0.280 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 29 MET 1.497 0.091 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 30 ALA 0.692 0.061 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 31 LEU 5.199 0.188 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 32 THR 1.305 0.123 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 33 ASP 0.061 0.025 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 34 LEU 1.679 0.091 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 35 ILE 6.505 0.175 21 0 "[ . 1 . 2 . 3 . 4 ]"
1 36 ALA 1.949 0.101 14 0 "[ . 1 . 2 . 3 . 4 ]"
1 37 LEU 1.884 0.174 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 38 LEU 3.285 0.103 26 0 "[ . 1 . 2 . 3 . 4 ]"
1 39 GLN 4.134 0.137 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 40 ALA 0.172 0.031 11 0 "[ . 1 . 2 . 3 . 4 ]"
1 41 ASP 0.099 0.054 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 42 CYS 1.793 0.174 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 43 GLY 0.099 0.054 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 44 PHE 3.710 0.257 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 45 ASP 0.705 0.130 41 0 "[ . 1 . 2 . 3 . 4 ]"
1 46 LYS 2.140 0.093 31 0 "[ . 1 . 2 . 3 . 4 ]"
1 47 THR 2.680 0.093 31 0 "[ . 1 . 2 . 3 . 4 ]"
1 48 LYS 0.563 0.130 41 0 "[ . 1 . 2 . 3 . 4 ]"
1 49 HIS 2.274 0.114 21 0 "[ . 1 . 2 . 3 . 4 ]"
1 50 ASP 1.483 0.116 31 0 "[ . 1 . 2 . 3 . 4 ]"
1 51 LEU 1.884 0.119 14 0 "[ . 1 . 2 . 3 . 4 ]"
1 52 TYR 2.417 0.166 27 0 "[ . 1 . 2 . 3 . 4 ]"
1 53 TYR 0.632 0.091 31 0 "[ . 1 . 2 . 3 . 4 ]"
1 54 ASN 1.443 0.352 31 0 "[ . 1 . 2 . 3 . 4 ]"
1 55 MET 0.873 0.052 31 0 "[ . 1 . 2 . 3 . 4 ]"
1 56 ASP 1.177 0.052 31 0 "[ . 1 . 2 . 3 . 4 ]"
1 57 ILE 1.568 0.063 27 0 "[ . 1 . 2 . 3 . 4 ]"
1 58 LEU 1.664 0.166 27 0 "[ . 1 . 2 . 3 . 4 ]"
1 59 ASP 1.683 0.188 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 60 SER 0.032 0.019 21 0 "[ . 1 . 2 . 3 . 4 ]"
1 61 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 ]"
1 62 ARG 0.331 0.091 23 0 "[ . 1 . 2 . 3 . 4 ]"
1 63 THR 1.576 0.135 31 0 "[ . 1 . 2 . 3 . 4 ]"
1 64 GLN 3.943 0.135 31 0 "[ . 1 . 2 . 3 . 4 ]"
1 65 SER 4.046 0.110 27 0 "[ . 1 . 2 . 3 . 4 ]"
1 66 LEU 3.780 0.280 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 67 LYS 4.516 0.192 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 68 GLU 1.900 0.097 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 69 LEU 5.444 0.142 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 70 GLY 1.960 0.084 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 71 LEU 6.682 0.497 27 0 "[ . 1 . 2 . 3 . 4 ]"
1 72 LYS 1.278 0.079 14 0 "[ . 1 . 2 . 3 . 4 ]"
1 73 THR 4.205 0.240 32 0 "[ . 1 . 2 . 3 . 4 ]"
1 74 ASP 0.946 0.077 27 0 "[ . 1 . 2 . 3 . 4 ]"
1 75 ASP 6.427 0.240 32 0 "[ . 1 . 2 . 3 . 4 ]"
1 76 LEU 0.485 0.067 27 0 "[ . 1 . 2 . 3 . 4 ]"
1 77 LEU 1.509 0.352 31 0 "[ . 1 . 2 . 3 . 4 ]"
1 78 LEU 0.427 0.042 41 0 "[ . 1 . 2 . 3 . 4 ]"
1 79 ILE 7.427 0.265 26 0 "[ . 1 . 2 . 3 . 4 ]"
1 80 ARG 2.101 0.275 42 0 "[ . 1 . 2 . 3 . 4 ]"
1 81 GLY 1.970 0.109 43 0 "[ . 1 . 2 . 3 . 4 ]"
1 82 LYS 3.238 0.134 32 0 "[ . 1 . 2 . 3 . 4 ]"
1 83 ILE 1.041 0.134 32 0 "[ . 1 . 2 . 3 . 4 ]"
1 85 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 ]"
1 86 SER 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 1 HIS QB 1 2 ILE H 4.620 . 4.620 3.193 1.941 4.062 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
2 1 2 ILE H 1 2 ILE HB 3.860 . 3.860 3.172 2.439 3.868 0.008 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
3 1 2 ILE H 1 2 ILE MD 5.260 . 5.260 3.624 2.262 4.940 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
4 1 2 ILE H 1 2 ILE HG12 4.660 . 4.660 3.143 1.888 4.591 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
5 1 2 ILE H 1 2 ILE HG13 4.660 . 4.660 3.478 2.105 4.667 0.007 17 0 "[ . 1 . 2 . 3 . 4 ]" 1
6 1 2 ILE H 1 2 ILE MG 4.640 . 4.640 3.535 2.125 4.147 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
7 1 2 ILE HA 1 2 ILE QG 3.730 . 3.730 2.908 2.238 3.442 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
8 1 2 ILE HA 1 2 ILE MG 3.670 . 3.670 2.448 2.296 3.282 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
9 1 2 ILE HA 1 3 GLU H 3.090 . 3.090 2.302 2.037 2.970 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
10 1 2 ILE HB 1 3 GLU H 4.560 . 4.560 3.817 2.344 4.533 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
11 1 2 ILE MD 1 3 GLU H 4.910 . 4.910 4.273 3.286 5.000 0.090 23 0 "[ . 1 . 2 . 3 . 4 ]" 1
12 1 2 ILE MG 1 3 GLU H 4.290 . 4.290 3.348 2.086 4.335 0.045 37 0 "[ . 1 . 2 . 3 . 4 ]" 1
13 1 3 GLU H 1 3 GLU HB2 3.900 . 3.900 2.778 2.054 3.859 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
14 1 3 GLU H 1 3 GLU QB 3.330 . 3.330 2.519 2.037 3.045 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
15 1 3 GLU H 1 3 GLU HB3 3.900 . 3.900 3.441 2.541 3.932 0.032 42 0 "[ . 1 . 2 . 3 . 4 ]" 1
16 1 3 GLU H 1 3 GLU QG 3.960 . 3.960 2.759 1.701 3.978 0.018 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
17 1 3 GLU QB 1 4 GLY H 4.050 . 4.050 2.671 1.881 3.883 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
18 1 3 GLU HB2 1 4 GLY H 4.710 . 4.710 3.454 2.296 4.515 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
19 1 3 GLU HB3 1 4 GLY H 4.710 . 4.710 3.118 1.902 4.455 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
20 1 3 GLU QG 1 4 GLY H 4.950 . 4.950 3.886 2.197 4.715 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
21 1 4 GLY QA 1 5 ARG H 3.330 . 3.330 2.458 2.097 2.955 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
22 1 5 ARG H 1 5 ARG QB 3.560 . 3.560 2.714 2.100 3.467 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
23 1 5 ARG H 1 5 ARG QD 4.630 . 4.630 4.151 2.973 4.723 0.093 10 0 "[ . 1 . 2 . 3 . 4 ]" 1
24 1 5 ARG H 1 5 ARG HG2 4.070 . 4.070 3.088 2.028 4.075 0.005 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
25 1 5 ARG H 1 5 ARG QG 3.410 . 3.410 2.500 2.001 3.170 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
26 1 5 ARG H 1 5 ARG HG3 4.070 . 4.070 2.993 2.229 4.078 0.008 23 0 "[ . 1 . 2 . 3 . 4 ]" 1
27 1 5 ARG HA 1 5 ARG QD 4.410 . 4.410 3.864 1.975 4.425 0.015 37 0 "[ . 1 . 2 . 3 . 4 ]" 1
28 1 5 ARG QB 1 5 ARG QD 3.280 . 3.280 2.174 2.006 2.886 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
29 1 5 ARG HB2 1 5 ARG QD 3.830 . 3.830 2.573 2.150 3.536 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
30 1 5 ARG HB3 1 5 ARG QD 3.830 . 3.830 2.426 2.065 3.187 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
31 1 6 HIS H 1 6 HIS HD2 5.040 . 5.040 4.547 3.919 5.050 0.010 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
32 1 6 HIS H 1 7 MET H 4.670 . 4.670 4.414 4.184 4.615 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
33 1 6 HIS HA 1 26 SER HA 3.530 . 3.530 2.338 2.139 2.593 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
34 1 6 HIS HD2 1 7 MET H 4.540 . 4.540 3.628 2.774 4.018 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
35 1 6 HIS HD2 1 25 VAL H 4.820 . 4.820 4.621 3.869 4.884 0.064 26 0 "[ . 1 . 2 . 3 . 4 ]" 1
36 1 6 HIS HD2 1 26 SER H 4.560 . 4.560 3.685 3.360 4.007 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
37 1 6 HIS HD2 1 27 GLU H 4.670 . 4.670 4.537 4.183 4.716 0.046 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
38 1 7 MET H 1 7 MET HB2 3.820 . 3.820 3.782 3.682 3.834 0.014 41 0 "[ . 1 . 2 . 3 . 4 ]" 1
39 1 7 MET H 1 7 MET HB3 3.750 . 3.750 3.450 3.321 3.572 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
40 1 7 MET H 1 7 MET HG2 3.790 . 3.790 2.358 2.191 2.524 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
41 1 7 MET H 1 7 MET QG 3.270 . 3.270 2.261 2.110 2.379 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
42 1 7 MET H 1 7 MET HG3 3.790 . 3.790 2.923 2.685 3.146 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
43 1 7 MET H 1 8 ASP H 4.620 . 4.620 4.362 4.282 4.430 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
44 1 7 MET H 1 9 LEU QD 5.440 . 5.440 4.664 3.952 5.450 0.010 5 0 "[ . 1 . 2 . 3 . 4 ]" 1
45 1 7 MET H 1 24 GLU HA 4.900 . 4.900 3.969 3.768 4.211 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
46 1 7 MET H 1 25 VAL H 3.610 . 3.610 2.950 2.821 3.184 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
47 1 7 MET H 1 25 VAL QG 3.590 . 3.590 3.390 3.295 3.560 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
48 1 7 MET H 1 26 SER HG 5.000 . 5.000 4.966 4.603 5.052 0.052 26 0 "[ . 1 . 2 . 3 . 4 ]" 1
49 1 7 MET H 1 27 GLU H 4.740 . 4.740 4.716 4.383 4.772 0.032 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
50 1 7 MET H 1 73 THR HB 5.190 . 5.190 5.188 5.084 5.273 0.083 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
51 1 7 MET HA 1 7 MET ME 5.500 . 5.500 5.379 5.252 5.412 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
52 1 7 MET HA 1 8 ASP H 3.100 . 3.100 2.301 2.212 2.509 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
53 1 7 MET HA 1 73 THR HA 4.200 . 4.200 3.852 3.698 4.064 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
54 1 7 MET HA 1 73 THR HB 3.860 . 3.860 2.513 2.354 2.654 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
55 1 7 MET HA 1 73 THR MG 4.540 . 4.540 3.991 3.848 4.067 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
56 1 7 MET HB2 1 8 ASP H 3.810 . 3.810 2.722 2.509 2.836 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
57 1 7 MET HB2 1 9 LEU H 5.500 . 5.500 5.283 5.053 5.511 0.011 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
58 1 7 MET HB2 1 25 VAL QG 4.140 . 4.140 4.163 3.931 4.361 0.221 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
59 1 7 MET HB2 1 73 THR H 4.260 . 4.260 2.954 2.631 3.180 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
60 1 7 MET HB2 1 73 THR HA 4.260 . 4.260 2.326 2.176 2.449 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
61 1 7 MET HB2 1 73 THR HB 4.480 . 4.480 2.412 2.209 2.654 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
62 1 7 MET HB2 1 75 ASP H 5.500 . 5.500 5.416 5.167 5.545 0.045 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
63 1 7 MET HB3 1 8 ASP H 3.810 . 3.810 3.809 3.703 3.833 0.023 10 0 "[ . 1 . 2 . 3 . 4 ]" 1
64 1 7 MET HB3 1 72 LYS HA 4.580 . 4.580 3.847 3.332 4.171 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
65 1 7 MET HB3 1 73 THR H 3.440 . 3.440 3.330 2.846 3.467 0.027 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
66 1 7 MET HB3 1 73 THR HA 3.920 . 3.920 3.880 3.768 3.942 0.022 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
67 1 7 MET HB3 1 73 THR HB 4.050 . 4.050 2.729 2.520 2.977 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
68 1 7 MET HB3 1 73 THR MG 4.590 . 4.590 4.146 3.969 4.336 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
69 1 7 MET ME 1 7 MET HG2 3.850 . 3.850 2.644 2.236 2.995 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
70 1 7 MET ME 1 7 MET HG3 3.850 . 3.850 2.370 2.202 2.796 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
71 1 7 MET ME 1 9 LEU QD 3.840 . 3.840 2.180 1.951 2.572 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
72 1 7 MET ME 1 25 VAL H 5.500 . 5.500 4.863 4.676 4.985 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
73 1 7 MET ME 1 25 VAL HA 5.500 . 5.500 5.501 5.371 5.621 0.121 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
74 1 7 MET ME 1 25 VAL QG 3.710 . 3.710 2.473 2.380 2.658 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
75 1 7 MET ME 1 27 GLU H 3.880 . 3.880 3.680 3.323 3.896 0.016 42 0 "[ . 1 . 2 . 3 . 4 ]" 1
76 1 7 MET ME 1 27 GLU HA 3.280 . 3.280 2.145 1.989 2.323 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
77 1 7 MET ME 1 27 GLU QG 4.770 . 4.770 4.589 4.244 4.795 0.025 34 0 "[ . 1 . 2 . 3 . 4 ]" 1
78 1 7 MET ME 1 28 ASP H 4.910 . 4.910 4.819 4.656 4.932 0.022 25 0 "[ . 1 . 2 . 3 . 4 ]" 1
79 1 7 MET ME 1 66 LEU H 5.400 . 5.400 4.619 4.477 4.841 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
80 1 7 MET ME 1 66 LEU HA 4.580 . 4.580 4.317 4.220 4.485 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
81 1 7 MET ME 1 66 LEU HB2 3.310 . 3.310 2.479 2.328 2.724 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
82 1 7 MET ME 1 66 LEU HB3 3.170 . 3.170 2.341 2.244 2.513 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
83 1 7 MET ME 1 66 LEU MD1 3.260 . 3.260 2.157 2.068 2.245 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
84 1 7 MET ME 1 66 LEU MD2 4.840 . 4.840 3.809 3.629 4.028 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
85 1 7 MET ME 1 71 LEU H 4.780 . 4.780 4.216 3.957 4.528 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
86 1 7 MET ME 1 71 LEU QB 3.550 . 3.550 2.731 2.134 4.047 0.497 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
87 1 7 MET ME 1 71 LEU MD1 4.400 . 4.400 2.802 1.875 3.357 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
88 1 7 MET ME 1 71 LEU QD 3.750 . 3.750 2.724 1.871 3.234 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
89 1 7 MET ME 1 71 LEU MD2 4.400 . 4.400 3.997 3.632 4.276 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
90 1 7 MET ME 1 72 LYS H 4.900 . 4.900 4.226 3.957 4.675 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
91 1 7 MET ME 1 72 LYS HA 3.850 . 3.850 3.669 3.030 3.865 0.015 9 0 "[ . 1 . 2 . 3 . 4 ]" 1
92 1 7 MET QG 1 8 ASP H 4.190 . 4.190 4.011 3.807 4.143 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
93 1 7 MET QG 1 25 VAL H 3.760 . 3.760 3.471 3.196 3.626 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
94 1 7 MET QG 1 25 VAL QG 3.600 . 3.600 2.181 2.055 2.339 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
95 1 7 MET QG 1 27 GLU H 4.450 . 4.450 3.464 3.199 3.806 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
96 1 7 MET QG 1 73 THR HA 4.470 . 4.470 4.053 3.808 4.221 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
97 1 7 MET QG 1 73 THR HB 4.770 . 4.770 4.334 4.201 4.506 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
98 1 7 MET HG2 1 8 ASP H 5.030 . 5.030 4.990 4.864 5.043 0.013 23 0 "[ . 1 . 2 . 3 . 4 ]" 1
99 1 7 MET HG2 1 73 THR H 5.500 . 5.500 5.397 5.042 5.506 0.006 33 0 "[ . 1 . 2 . 3 . 4 ]" 1
100 1 7 MET HG2 1 73 THR HB 5.500 . 5.500 4.974 4.834 5.178 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
101 1 7 MET HG3 1 8 ASP H 5.030 . 5.030 4.227 3.973 4.406 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
102 1 7 MET HG3 1 73 THR H 5.500 . 5.500 5.100 4.694 5.416 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
103 1 7 MET HG3 1 73 THR HB 5.500 . 5.500 4.771 4.588 4.955 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
104 1 8 ASP H 1 8 ASP HB2 3.930 . 3.930 2.436 2.305 3.736 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
105 1 8 ASP H 1 8 ASP QB 3.210 . 3.210 2.393 2.278 3.218 0.008 13 0 "[ . 1 . 2 . 3 . 4 ]" 1
106 1 8 ASP H 1 8 ASP HB3 3.930 . 3.930 3.631 3.513 3.705 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
107 1 8 ASP H 1 9 LEU H 4.430 . 4.430 4.370 4.266 4.434 0.004 42 0 "[ . 1 . 2 . 3 . 4 ]" 1
108 1 8 ASP H 1 9 LEU HA 5.250 . 5.250 4.976 4.720 5.170 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
109 1 8 ASP H 1 9 LEU QD 4.880 . 4.880 3.867 3.258 4.598 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
110 1 8 ASP H 1 24 GLU HA 5.500 . 5.500 4.872 4.579 5.200 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
111 1 8 ASP H 1 25 VAL H 5.390 . 5.390 5.057 4.907 5.179 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
112 1 8 ASP H 1 73 THR H 4.600 . 4.600 4.465 4.183 4.619 0.019 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
113 1 8 ASP H 1 73 THR HA 3.450 . 3.450 2.460 2.361 2.546 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
114 1 8 ASP H 1 73 THR HB 3.660 . 3.660 2.614 2.406 2.853 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
115 1 8 ASP H 1 73 THR MG 4.010 . 4.010 3.741 3.663 3.889 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
116 1 8 ASP H 1 74 ASP H 5.500 . 5.500 5.520 5.503 5.577 0.077 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
117 1 8 ASP HA 1 9 LEU H 2.760 . 2.760 2.179 2.118 2.216 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
118 1 8 ASP HA 1 23 ILE H 4.260 . 4.260 4.213 3.995 4.285 0.025 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
119 1 8 ASP HA 1 24 GLU H 5.470 . 5.470 4.623 4.369 4.864 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
120 1 8 ASP HA 1 24 GLU HA 3.720 . 3.720 2.678 2.316 2.995 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
121 1 8 ASP HA 1 25 VAL H 3.930 . 3.930 3.405 2.983 3.695 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
122 1 8 ASP QB 1 9 LEU H 3.730 . 3.730 3.427 2.982 3.538 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
123 1 8 ASP QB 1 22 PRO HB3 4.460 . 4.460 2.957 2.365 3.481 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
124 1 8 ASP QB 1 23 ILE H 4.730 . 4.730 4.396 3.827 4.671 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
125 1 8 ASP HB2 1 9 LEU H 4.590 . 4.590 4.369 3.114 4.492 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
126 1 8 ASP HB3 1 9 LEU H 4.590 . 4.590 3.596 3.237 3.812 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
127 1 9 LEU H 1 9 LEU HB2 3.710 . 3.710 2.441 2.300 2.614 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
128 1 9 LEU H 1 9 LEU QB 3.230 . 3.230 2.406 2.272 2.565 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
129 1 9 LEU H 1 9 LEU HB3 3.710 . 3.710 3.637 3.511 3.749 0.039 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
130 1 9 LEU H 1 9 LEU MD1 4.210 . 4.210 3.644 2.873 4.213 0.003 36 0 "[ . 1 . 2 . 3 . 4 ]" 1
131 1 9 LEU H 1 9 LEU MD2 4.210 . 4.210 3.726 2.716 4.242 0.032 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
132 1 9 LEU H 1 10 THR H 4.650 . 4.650 4.406 4.320 4.491 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
133 1 9 LEU H 1 22 PRO HB2 4.540 . 4.540 4.377 3.784 4.562 0.022 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
134 1 9 LEU H 1 22 PRO HB3 5.050 . 5.050 4.571 4.114 4.982 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
135 1 9 LEU H 1 23 ILE H 3.450 . 3.450 2.944 2.718 3.140 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
136 1 9 LEU H 1 23 ILE HB 5.160 . 5.160 5.036 4.878 5.163 0.003 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
137 1 9 LEU H 1 23 ILE QG 3.670 . 3.670 3.062 2.874 3.175 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
138 1 9 LEU H 1 25 VAL H 4.480 . 4.480 3.909 3.700 4.138 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
139 1 9 LEU H 1 25 VAL QG 3.940 . 3.940 3.028 2.804 3.291 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
140 1 9 LEU HA 1 9 LEU MD1 4.630 . 4.630 2.915 2.066 3.830 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
141 1 9 LEU HA 1 9 LEU QD 3.200 . 3.200 2.231 2.004 2.478 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
142 1 9 LEU HA 1 9 LEU MD2 4.630 . 4.630 2.943 2.044 3.872 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
143 1 9 LEU HA 1 9 LEU HG 4.120 . 4.120 3.099 2.555 3.826 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
144 1 9 LEU HA 1 10 THR H 2.830 . 2.830 2.102 2.037 2.204 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
145 1 9 LEU HA 1 23 ILE H 5.370 . 5.370 4.760 4.591 4.864 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
146 1 9 LEU HA 1 75 ASP H 4.460 . 4.460 4.056 3.649 4.340 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
147 1 9 LEU QB 1 10 THR H 3.410 . 3.410 3.079 2.965 3.206 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
148 1 9 LEU HB2 1 10 THR H 4.170 . 4.170 4.191 4.055 4.275 0.105 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
149 1 9 LEU HB3 1 10 THR H 4.170 . 4.170 3.169 3.034 3.325 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
150 1 9 LEU QD 1 10 THR H 3.930 . 3.930 3.617 3.080 3.980 0.050 4 0 "[ . 1 . 2 . 3 . 4 ]" 1
151 1 9 LEU QD 1 25 VAL QG 3.310 . 3.310 2.015 1.819 2.258 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
152 1 9 LEU QD 1 71 LEU QB 4.410 . 4.410 2.551 2.086 3.427 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
153 1 9 LEU QD 1 71 LEU QD 4.100 . 4.100 2.002 1.837 2.272 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
154 1 9 LEU QD 1 73 THR H 4.940 . 4.940 4.184 3.623 4.677 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
155 1 9 LEU QD 1 74 ASP H 4.600 . 4.600 4.180 3.741 4.550 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
156 1 9 LEU QD 1 75 ASP H 3.380 . 3.380 3.199 2.647 3.511 0.131 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
157 1 9 LEU QD 1 75 ASP QB 4.130 . 4.130 2.608 1.969 4.199 0.069 28 0 "[ . 1 . 2 . 3 . 4 ]" 1
158 1 9 LEU MD1 1 10 THR H 4.730 . 4.730 4.268 3.145 4.993 0.263 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
159 1 9 LEU MD2 1 10 THR H 4.730 . 4.730 4.231 3.322 4.775 0.045 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
160 1 9 LEU HG 1 25 VAL QG 4.240 . 4.240 3.198 2.020 4.258 0.018 28 0 "[ . 1 . 2 . 3 . 4 ]" 1
161 1 9 LEU HG 1 71 LEU QD 4.850 . 4.850 3.413 2.366 4.226 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
162 1 10 THR H 1 10 THR HB 3.390 . 3.390 2.657 2.600 2.731 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
163 1 10 THR H 1 10 THR HG1 3.950 . 3.950 2.339 2.188 2.526 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
164 1 10 THR H 1 10 THR MG 3.960 . 3.960 3.881 3.837 3.933 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
165 1 10 THR H 1 11 ILE H 4.630 . 4.630 4.560 4.500 4.612 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
166 1 10 THR H 1 22 PRO HB3 5.500 . 5.500 4.374 3.920 5.076 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
167 1 10 THR H 1 76 LEU HA 4.100 . 4.100 2.890 2.581 3.314 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
168 1 10 THR H 1 76 LEU QB 5.340 . 5.340 4.355 3.972 5.012 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
169 1 10 THR H 1 77 LEU H 4.270 . 4.270 4.023 3.699 4.263 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
170 1 10 THR H 1 77 LEU HB2 5.500 . 5.500 5.300 4.883 5.579 0.079 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
171 1 10 THR HA 1 10 THR MG 3.490 . 3.490 2.287 2.243 2.318 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
172 1 10 THR HA 1 11 ILE H 3.450 . 3.450 2.193 2.102 2.248 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
173 1 10 THR HA 1 11 ILE MD 4.440 . 4.440 3.893 3.740 4.020 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
174 1 10 THR HA 1 22 PRO HA 3.820 . 3.820 2.165 1.988 2.542 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
175 1 10 THR HB 1 11 ILE H 4.330 . 4.330 3.998 3.889 4.074 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
176 1 10 THR HB 1 76 LEU HA 4.150 . 4.150 2.934 2.582 3.339 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
177 1 10 THR HB 1 76 LEU QD 3.730 . 3.730 2.390 2.159 3.056 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
178 1 10 THR HB 1 77 LEU H 4.780 . 4.780 4.113 3.888 4.352 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
179 1 10 THR MG 1 11 ILE H 3.070 . 3.070 2.477 2.365 2.570 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
180 1 10 THR MG 1 11 ILE HA 4.920 . 4.920 4.025 3.948 4.100 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
181 1 10 THR MG 1 12 SER H 4.790 . 4.790 4.626 4.494 4.743 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
182 1 10 THR MG 1 12 SER HA 4.920 . 4.920 4.541 4.328 4.740 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
183 1 10 THR MG 1 19 ILE MG 3.130 . 3.130 2.595 2.299 2.994 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
184 1 10 THR MG 1 20 TYR H 4.550 . 4.550 3.958 3.695 4.223 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
185 1 10 THR MG 1 21 GLY H 5.130 . 5.130 5.170 5.139 5.293 0.163 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
186 1 10 THR MG 1 21 GLY QA 4.840 . 4.840 3.847 3.613 4.111 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
187 1 10 THR MG 1 22 PRO HA 4.140 . 4.140 3.472 3.325 3.721 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
188 1 10 THR MG 1 76 LEU QD 3.260 . 3.260 2.564 2.385 2.943 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
189 1 10 THR MG 1 77 LEU H 4.920 . 4.920 4.605 4.397 4.867 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
190 1 11 ILE H 1 11 ILE HB 3.380 . 3.380 2.653 2.565 2.850 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
191 1 11 ILE H 1 11 ILE MD 3.700 . 3.700 3.421 3.305 3.547 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
192 1 11 ILE H 1 11 ILE QG 3.470 . 3.470 2.426 2.293 2.572 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
193 1 11 ILE H 1 11 ILE MG 4.230 . 4.230 3.893 3.849 3.958 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
194 1 11 ILE H 1 12 SER H 5.070 . 5.070 4.462 4.372 4.519 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
195 1 11 ILE H 1 20 TYR H 4.510 . 4.510 3.865 3.571 4.072 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
196 1 11 ILE H 1 20 TYR HB2 4.510 . 4.510 3.662 2.890 3.985 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
197 1 11 ILE H 1 20 TYR HB3 4.510 . 4.510 4.178 3.568 4.515 0.005 28 0 "[ . 1 . 2 . 3 . 4 ]" 1
198 1 11 ILE HA 1 11 ILE MD 3.810 . 3.810 2.285 2.234 2.362 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
199 1 11 ILE HA 1 11 ILE MG 3.610 . 3.610 2.342 2.273 2.376 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
200 1 11 ILE HA 1 12 SER H 2.800 . 2.800 2.213 2.114 2.285 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
201 1 11 ILE HA 1 77 LEU H 3.550 . 3.550 2.860 2.699 3.008 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
202 1 11 ILE HA 1 77 LEU HB2 4.640 . 4.640 2.768 2.446 3.219 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
203 1 11 ILE HB 1 12 SER H 4.540 . 4.540 4.049 3.784 4.118 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
204 1 11 ILE HB 1 20 TYR H 3.950 . 3.950 3.570 3.156 3.850 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
205 1 11 ILE HB 1 20 TYR HB2 4.310 . 4.310 2.004 1.906 2.210 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
206 1 11 ILE HB 1 20 TYR QB 3.770 . 3.770 1.944 1.891 2.021 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
207 1 11 ILE HB 1 20 TYR HB3 4.310 . 4.310 2.755 2.199 3.342 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
208 1 11 ILE HB 1 20 TYR QD 4.380 . 4.380 3.880 2.600 4.111 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
209 1 11 ILE HB 1 21 GLY H 4.890 . 4.890 4.465 4.110 4.915 0.025 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
210 1 11 ILE MD 1 12 SER H 4.000 . 4.000 4.047 4.007 4.156 0.156 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
211 1 11 ILE MD 1 38 LEU MD1 3.850 . 3.850 3.064 2.578 3.353 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
212 1 11 ILE MD 1 77 LEU H 4.020 . 4.020 3.157 2.904 3.494 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
213 1 11 ILE MD 1 77 LEU HB2 3.680 . 3.680 2.113 2.022 2.338 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
214 1 11 ILE MD 1 77 LEU HB3 4.290 . 4.290 3.172 2.833 3.589 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
215 1 11 ILE MD 1 78 LEU H 5.410 . 5.410 5.408 5.285 5.452 0.042 41 0 "[ . 1 . 2 . 3 . 4 ]" 1
216 1 11 ILE QG 1 12 SER H 4.780 . 4.780 4.792 4.727 4.818 0.038 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
217 1 11 ILE QG 1 20 TYR H 5.430 . 5.430 5.042 4.643 5.278 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
218 1 11 ILE QG 1 21 GLY H 5.170 . 5.170 4.653 4.484 4.955 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
219 1 11 ILE QG 1 21 GLY QA 4.720 . 4.720 4.849 4.732 5.164 0.444 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
220 1 11 ILE QG 1 23 ILE MG 3.940 . 3.940 3.235 2.957 3.623 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
221 1 11 ILE QG 1 38 LEU MD2 3.810 . 3.810 2.402 2.176 2.621 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
222 1 11 ILE MG 1 12 SER H 2.990 . 2.990 2.642 2.440 2.781 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
223 1 11 ILE MG 1 12 SER HA 4.370 . 4.370 3.763 3.594 3.937 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
224 1 11 ILE MG 1 13 ASN H 4.620 . 4.620 4.478 4.048 4.627 0.007 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
225 1 11 ILE MG 1 13 ASN HA 5.000 . 5.000 4.450 4.013 4.661 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
226 1 11 ILE MG 1 20 TYR H 4.680 . 4.680 4.141 3.816 4.559 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
227 1 11 ILE MG 1 20 TYR QD 4.180 . 4.180 3.584 2.783 4.067 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
228 1 11 ILE MG 1 38 LEU MD1 3.830 . 3.830 3.342 3.124 3.648 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
229 1 11 ILE MG 1 38 LEU MD2 3.450 . 3.450 2.368 2.131 2.787 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
230 1 11 ILE MG 1 42 CYS HB2 4.390 . 4.390 3.861 3.524 4.435 0.045 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
231 1 11 ILE MG 1 42 CYS HB3 4.390 . 4.390 3.415 2.992 4.051 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
232 1 11 ILE MG 1 79 ILE H 4.460 . 4.460 4.291 4.048 4.491 0.031 42 0 "[ . 1 . 2 . 3 . 4 ]" 1
233 1 11 ILE MG 1 79 ILE HG12 4.160 . 4.160 2.542 2.399 2.668 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
234 1 11 ILE MG 1 79 ILE QG 3.500 . 3.500 2.361 2.149 2.512 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
235 1 11 ILE MG 1 79 ILE HG13 4.160 . 4.160 2.820 2.268 3.141 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
236 1 12 SER H 1 12 SER HB2 3.840 . 3.840 3.006 2.639 3.376 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
237 1 12 SER H 1 12 SER QB 3.200 . 3.200 2.623 2.447 2.745 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
238 1 12 SER H 1 12 SER HB3 3.840 . 3.840 3.238 2.567 3.878 0.038 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
239 1 12 SER H 1 13 ASN H 5.350 . 5.350 4.391 4.275 4.467 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
240 1 12 SER H 1 51 LEU QD 5.440 . 5.440 5.071 4.926 5.324 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
241 1 12 SER H 1 77 LEU H 4.460 . 4.460 3.883 3.680 4.194 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
242 1 12 SER H 1 77 LEU HA 5.500 . 5.500 5.130 5.007 5.290 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
243 1 12 SER H 1 77 LEU HB3 5.100 . 5.100 4.539 4.290 5.047 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
244 1 12 SER H 1 78 LEU HA 3.430 . 3.430 2.992 2.698 3.120 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
245 1 12 SER H 1 78 LEU HB3 5.500 . 5.500 5.429 5.044 5.504 0.004 2 0 "[ . 1 . 2 . 3 . 4 ]" 1
246 1 12 SER H 1 78 LEU HG 5.500 . 5.500 5.163 4.907 5.428 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
247 1 12 SER H 1 79 ILE HB 5.500 . 5.500 5.343 5.076 5.541 0.041 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
248 1 12 SER H 1 79 ILE QG 5.340 . 5.340 3.502 3.301 3.710 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
249 1 12 SER HA 1 13 ASN H 2.870 . 2.870 2.175 2.124 2.244 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
250 1 12 SER HA 1 19 ILE HA 3.420 . 3.420 2.466 2.108 2.693 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
251 1 12 SER HA 1 19 ILE MD 4.620 . 4.620 3.238 2.512 4.638 0.018 15 0 "[ . 1 . 2 . 3 . 4 ]" 1
252 1 12 SER HA 1 19 ILE QG 5.170 . 5.170 4.661 2.949 5.176 0.006 5 0 "[ . 1 . 2 . 3 . 4 ]" 1
253 1 12 SER HA 1 20 TYR H 3.870 . 3.870 2.827 2.515 3.189 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
254 1 12 SER QB 1 13 ASN H 3.950 . 3.950 3.388 2.890 3.940 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
255 1 12 SER QB 1 19 ILE MD 4.150 . 4.150 2.688 2.363 4.005 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
256 1 12 SER QB 1 78 LEU HA 4.390 . 4.390 3.197 2.648 3.471 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
257 1 12 SER QB 1 78 LEU MD2 3.200 . 3.200 2.095 1.952 2.295 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
258 1 12 SER QB 1 79 ILE H 4.530 . 4.530 4.274 3.886 4.510 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
259 1 12 SER HB2 1 13 ASN H 4.640 . 4.640 4.143 3.983 4.413 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
260 1 12 SER HB2 1 78 LEU MD2 3.790 . 3.790 2.900 2.030 3.791 0.001 38 0 "[ . 1 . 2 . 3 . 4 ]" 1
261 1 12 SER HB3 1 13 ASN H 4.640 . 4.640 3.677 2.961 4.432 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
262 1 12 SER HB3 1 78 LEU MD2 3.790 . 3.790 2.643 1.967 3.427 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
263 1 13 ASN H 1 13 ASN HB2 3.630 . 3.630 2.230 2.065 2.349 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
264 1 13 ASN H 1 13 ASN QB 3.100 . 3.100 2.187 2.015 2.321 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
265 1 13 ASN H 1 13 ASN HB3 3.630 . 3.630 3.233 2.610 3.613 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
266 1 13 ASN H 1 13 ASN HD21 5.240 . 5.240 4.515 3.925 5.018 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
267 1 13 ASN H 1 13 ASN HD22 5.240 . 5.240 5.270 5.167 5.468 0.228 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
268 1 13 ASN H 1 14 GLU H 4.520 . 4.520 4.298 4.021 4.523 0.003 2 0 "[ . 1 . 2 . 3 . 4 ]" 1
269 1 13 ASN H 1 14 GLU HA 5.440 . 5.440 5.201 4.957 5.437 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
270 1 13 ASN H 1 16 THR H 5.500 . 5.500 5.064 4.865 5.320 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
271 1 13 ASN H 1 17 GLY H 4.780 . 4.780 4.585 4.391 4.782 0.002 35 0 "[ . 1 . 2 . 3 . 4 ]" 1
272 1 13 ASN H 1 18 GLU H 4.140 . 4.140 3.954 3.625 4.145 0.005 9 0 "[ . 1 . 2 . 3 . 4 ]" 1
273 1 13 ASN H 1 18 GLU HA 5.100 . 5.100 4.926 4.770 5.098 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
274 1 13 ASN H 1 18 GLU QB 4.310 . 4.310 3.646 3.195 3.959 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
275 1 13 ASN H 1 20 TYR H 4.970 . 4.970 4.160 3.748 4.476 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
276 1 13 ASN H 1 20 TYR QD 4.850 . 4.850 3.589 2.941 4.405 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
277 1 13 ASN H 1 79 ILE HB 4.830 . 4.830 4.706 4.567 4.835 0.005 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
278 1 13 ASN HA 1 14 GLU H 2.900 . 2.900 2.156 2.114 2.250 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
279 1 13 ASN HA 1 15 LEU H 3.960 . 3.960 3.355 3.128 3.594 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
280 1 13 ASN HA 1 15 LEU QD 5.440 . 5.440 4.656 3.498 5.528 0.088 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
281 1 13 ASN HA 1 16 THR H 4.900 . 4.900 4.326 4.250 4.501 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
282 1 13 ASN HA 1 79 ILE H 3.560 . 3.560 2.737 2.535 3.117 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
283 1 13 ASN HA 1 79 ILE HB 3.420 . 3.420 1.979 1.887 2.124 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
284 1 13 ASN HA 1 79 ILE MD 4.650 . 4.650 4.556 4.329 4.746 0.096 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
285 1 13 ASN HA 1 79 ILE MG 4.080 . 4.080 3.630 3.395 3.796 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
286 1 13 ASN QB 1 13 ASN QD 2.970 . 2.970 2.063 1.980 2.195 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
287 1 13 ASN QB 1 14 GLU H 3.910 . 3.910 3.735 3.608 3.910 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
288 1 13 ASN QB 1 16 THR H 3.850 . 3.850 2.475 2.199 2.770 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
289 1 13 ASN QB 1 17 GLY H 4.000 . 4.000 2.997 2.330 3.456 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
290 1 13 ASN QB 1 18 GLU H 3.280 . 3.280 2.607 2.182 2.905 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
291 1 13 ASN QB 1 18 GLU QB 4.460 . 4.460 2.442 2.141 2.776 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
292 1 13 ASN QB 1 79 ILE H 5.340 . 5.340 4.831 4.664 5.166 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
293 1 13 ASN HB2 1 13 ASN HD22 4.090 . 4.090 3.615 3.329 3.908 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
294 1 13 ASN HB2 1 14 GLU H 4.570 . 4.570 4.544 4.470 4.583 0.013 22 0 "[ . 1 . 2 . 3 . 4 ]" 1
295 1 13 ASN HB2 1 15 LEU H 4.900 . 4.900 4.542 4.161 4.895 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
296 1 13 ASN HB2 1 16 THR H 4.590 . 4.590 3.763 3.298 4.319 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
297 1 13 ASN HB2 1 17 GLY H 4.640 . 4.640 4.004 3.369 4.618 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
298 1 13 ASN HB2 1 18 GLU H 3.880 . 3.880 3.141 2.534 3.822 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
299 1 13 ASN HB3 1 13 ASN HD22 4.090 . 4.090 3.677 3.425 3.992 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
300 1 13 ASN HB3 1 14 GLU H 4.570 . 4.570 3.977 3.793 4.241 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
301 1 13 ASN HB3 1 15 LEU H 4.900 . 4.900 3.266 2.745 3.856 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
302 1 13 ASN HB3 1 16 THR H 4.590 . 4.590 2.517 2.210 2.807 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
303 1 13 ASN HB3 1 17 GLY H 4.640 . 4.640 3.220 2.344 3.849 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
304 1 13 ASN HB3 1 18 GLU H 3.880 . 3.880 3.183 2.205 3.881 0.001 6 0 "[ . 1 . 2 . 3 . 4 ]" 1
305 1 13 ASN QD 1 15 LEU H 5.340 . 5.340 4.493 4.133 4.843 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
306 1 13 ASN QD 1 15 LEU QB 5.080 . 5.080 3.839 3.195 4.196 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
307 1 13 ASN QD 1 15 LEU QD 4.910 . 4.910 3.845 3.023 5.202 0.292 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
308 1 13 ASN QD 1 16 THR H 4.620 . 4.620 4.218 3.939 4.630 0.010 33 0 "[ . 1 . 2 . 3 . 4 ]" 1
309 1 13 ASN QD 1 16 THR MG 3.570 . 3.570 3.058 2.667 3.605 0.035 33 0 "[ . 1 . 2 . 3 . 4 ]" 1
310 1 13 ASN QD 1 79 ILE HB 4.880 . 4.880 3.428 2.832 4.172 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
311 1 13 ASN QD 1 79 ILE MD 4.250 . 4.250 4.354 4.263 4.515 0.265 26 0 "[ . 1 . 2 . 3 . 4 ]" 1
312 1 13 ASN QD 1 79 ILE QG 4.440 . 4.440 3.252 3.003 4.136 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
313 1 13 ASN QD 1 79 ILE MG 3.780 . 3.780 2.978 2.625 3.538 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
314 1 13 ASN HD21 1 16 THR MG 4.130 . 4.130 3.413 2.700 4.243 0.113 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
315 1 13 ASN HD21 1 18 GLU QB 5.500 . 5.500 3.877 3.230 4.688 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
316 1 13 ASN HD21 1 79 ILE MG 4.370 . 4.370 3.782 3.280 4.329 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
317 1 13 ASN HD22 1 16 THR MG 4.130 . 4.130 3.949 3.524 4.386 0.256 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
318 1 13 ASN HD22 1 18 GLU QB 5.500 . 5.500 4.750 3.872 5.249 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
319 1 13 ASN HD22 1 79 ILE MG 4.370 . 4.370 3.133 2.699 3.833 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
320 1 14 GLU H 1 14 GLU QB 3.030 . 3.030 2.051 1.927 2.508 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
321 1 14 GLU H 1 14 GLU HG2 4.590 . 4.590 3.736 2.051 4.317 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
322 1 14 GLU H 1 14 GLU QG 3.990 . 3.990 3.322 2.037 3.893 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
323 1 14 GLU H 1 14 GLU HG3 4.590 . 4.590 3.856 2.124 4.426 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
324 1 14 GLU H 1 15 LEU H 3.100 . 3.100 2.601 2.424 2.794 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
325 1 14 GLU H 1 15 LEU HA 5.300 . 5.300 5.213 5.051 5.380 0.080 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
326 1 14 GLU H 1 16 THR H 4.920 . 4.920 4.412 4.323 4.529 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
327 1 14 GLU H 1 17 GLY H 4.900 . 4.900 4.834 4.743 4.926 0.026 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
328 1 14 GLU H 1 78 LEU HA 4.770 . 4.770 4.108 3.788 4.419 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
329 1 14 GLU H 1 79 ILE H 3.620 . 3.620 2.518 2.175 2.727 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
330 1 14 GLU H 1 79 ILE HB 3.280 . 3.280 3.036 2.757 3.249 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
331 1 14 GLU H 1 79 ILE MG 4.330 . 4.330 4.209 3.948 4.393 0.063 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
332 1 14 GLU HA 1 14 GLU QG 3.610 . 3.610 2.227 2.015 2.998 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
333 1 14 GLU QB 1 15 LEU H 3.810 . 3.810 3.036 2.836 3.284 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
334 1 14 GLU QB 1 15 LEU QD 4.220 . 4.220 3.602 2.343 4.203 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
335 1 14 GLU QB 1 79 ILE H 4.490 . 4.490 3.364 2.809 3.909 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
336 1 14 GLU QB 1 80 ARG H 5.340 . 5.340 4.598 4.267 5.036 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
337 1 14 GLU QB 1 80 ARG HA 4.850 . 4.850 2.957 2.475 3.429 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
338 1 14 GLU QB 1 81 GLY H 5.210 . 5.210 4.664 3.979 5.217 0.007 30 0 "[ . 1 . 2 . 3 . 4 ]" 1
339 1 14 GLU HB2 1 79 ILE H 5.100 . 5.100 3.425 2.898 4.036 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
340 1 14 GLU HB3 1 79 ILE H 5.100 . 5.100 4.960 3.750 5.228 0.128 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
341 1 14 GLU HG2 1 79 ILE H 5.500 . 5.500 5.088 2.542 5.541 0.041 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
342 1 14 GLU HG3 1 79 ILE H 5.500 . 5.500 4.673 2.315 5.402 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
343 1 15 LEU H 1 15 LEU QB 3.130 . 3.130 2.323 2.027 2.490 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
344 1 15 LEU H 1 15 LEU QD 3.320 . 3.320 3.037 2.106 3.346 0.026 30 0 "[ . 1 . 2 . 3 . 4 ]" 1
345 1 15 LEU H 1 16 THR H 2.910 . 2.910 2.479 2.320 2.569 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
346 1 15 LEU H 1 16 THR HA 5.280 . 5.280 5.184 5.055 5.255 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
347 1 15 LEU H 1 16 THR MG 4.180 . 4.180 3.922 3.827 4.009 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
348 1 15 LEU H 1 17 GLY H 3.790 . 3.790 3.749 3.517 3.827 0.037 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
349 1 15 LEU H 1 18 GLU H 5.500 . 5.500 5.478 5.232 5.515 0.015 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
350 1 15 LEU H 1 79 ILE MG 4.620 . 4.620 4.259 3.959 4.663 0.043 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
351 1 15 LEU HA 1 15 LEU MD1 3.920 . 3.920 3.721 2.171 3.921 0.001 26 0 "[ . 1 . 2 . 3 . 4 ]" 1
352 1 15 LEU HA 1 15 LEU QD 3.310 . 3.310 2.287 1.928 3.132 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
353 1 15 LEU HA 1 15 LEU MD2 3.920 . 3.920 2.397 2.052 3.561 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
354 1 15 LEU HA 1 17 GLY H 4.910 . 4.910 4.688 4.484 4.910 0.000 30 0 "[ . 1 . 2 . 3 . 4 ]" 1
355 1 15 LEU QB 1 16 THR H 3.080 . 3.080 2.606 2.424 2.986 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
356 1 15 LEU QB 1 16 THR HB 4.800 . 4.800 4.802 4.693 4.862 0.062 11 0 "[ . 1 . 2 . 3 . 4 ]" 1
357 1 15 LEU QB 1 16 THR MG 3.730 . 3.730 2.358 2.257 2.440 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
358 1 15 LEU QB 1 17 GLY H 4.440 . 4.440 4.419 4.351 4.542 0.102 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
359 1 15 LEU HB2 1 16 THR H 3.570 . 3.570 2.689 2.466 3.513 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
360 1 15 LEU HB2 1 16 THR MG 4.390 . 4.390 2.511 2.321 3.419 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
361 1 15 LEU HB3 1 16 THR H 3.570 . 3.570 3.574 3.232 3.622 0.052 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
362 1 15 LEU HB3 1 16 THR MG 4.390 . 4.390 2.952 2.311 3.242 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
363 1 15 LEU QD 1 16 THR H 4.360 . 4.360 4.035 3.477 4.239 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
364 1 15 LEU QD 1 50 ASP H 5.440 . 5.440 4.496 3.990 5.399 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
365 1 15 LEU QD 1 80 ARG QD 4.500 . 4.500 4.165 2.465 4.775 0.275 42 0 "[ . 1 . 2 . 3 . 4 ]" 1
366 1 15 LEU QD 1 81 GLY H 3.370 . 3.370 2.278 1.901 2.879 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
367 1 15 LEU QD 1 81 GLY HA2 4.270 . 4.270 2.713 2.494 3.739 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
368 1 15 LEU QD 1 81 GLY HA3 3.810 . 3.810 2.195 1.981 2.698 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
369 1 15 LEU QD 1 82 LYS H 5.200 . 5.200 4.257 3.954 4.966 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
370 1 15 LEU MD1 1 16 THR H 5.170 . 5.170 4.416 3.804 4.711 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
371 1 15 LEU MD1 1 81 GLY HA2 5.150 . 5.150 2.907 2.571 5.043 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
372 1 15 LEU MD1 1 81 GLY HA3 5.030 . 5.030 2.690 2.176 3.786 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
373 1 15 LEU MD2 1 16 THR H 5.170 . 5.170 4.734 3.618 4.938 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
374 1 15 LEU MD2 1 81 GLY HA2 5.150 . 5.150 3.488 2.697 4.064 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
375 1 15 LEU MD2 1 81 GLY HA3 5.030 . 5.030 2.425 2.067 3.282 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
376 1 15 LEU HG 1 80 ARG HA 4.820 . 4.820 2.756 2.065 4.824 0.004 2 0 "[ . 1 . 2 . 3 . 4 ]" 1
377 1 15 LEU HG 1 81 GLY H 4.520 . 4.520 3.239 2.616 4.416 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
378 1 16 THR H 1 16 THR MG 3.080 . 3.080 2.527 2.340 2.739 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
379 1 16 THR H 1 17 GLY H 2.830 . 2.830 2.052 1.823 2.255 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
380 1 16 THR H 1 17 GLY QA 4.890 . 4.890 4.065 3.866 4.231 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
381 1 16 THR H 1 18 GLU H 4.070 . 4.070 3.491 3.372 3.663 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
382 1 16 THR HA 1 16 THR MG 3.350 . 3.350 2.425 2.393 2.453 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
383 1 16 THR HA 1 18 GLU H 4.680 . 4.680 4.267 4.197 4.438 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
384 1 16 THR HB 1 17 GLY H 5.190 . 5.190 4.148 4.033 4.227 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
385 1 16 THR HB 1 18 GLU H 4.590 . 4.590 3.397 3.232 3.670 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
386 1 16 THR HB 1 18 GLU HG2 5.010 . 5.010 3.204 2.598 4.462 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
387 1 16 THR HB 1 18 GLU QG 4.250 . 4.250 2.763 2.539 3.211 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
388 1 16 THR HB 1 18 GLU HG3 5.010 . 5.010 3.424 2.565 3.968 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
389 1 16 THR MG 1 17 GLY H 3.950 . 3.950 3.976 3.956 4.028 0.078 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
390 1 16 THR MG 1 18 GLU H 4.390 . 4.390 4.019 3.935 4.127 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
391 1 16 THR MG 1 18 GLU QG 4.880 . 4.880 3.672 3.478 4.050 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
392 1 17 GLY H 1 18 GLU H 2.950 . 2.950 2.522 2.351 2.611 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
393 1 17 GLY H 1 18 GLU HA 5.230 . 5.230 5.165 5.034 5.231 0.001 7 0 "[ . 1 . 2 . 3 . 4 ]" 1
394 1 17 GLY H 1 18 GLU QB 4.570 . 4.570 4.457 4.327 4.548 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
395 1 17 GLY H 1 18 GLU QG 5.340 . 5.340 4.601 4.256 4.933 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
396 1 18 GLU H 1 18 GLU QB 2.860 . 2.860 2.333 2.200 2.399 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
397 1 18 GLU H 1 18 GLU HG2 3.840 . 3.840 2.858 2.420 3.842 0.002 25 0 "[ . 1 . 2 . 3 . 4 ]" 1
398 1 18 GLU H 1 18 GLU QG 3.150 . 3.150 2.534 2.357 2.805 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
399 1 18 GLU H 1 18 GLU HG3 3.840 . 3.840 3.460 2.382 3.858 0.018 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
400 1 18 GLU H 1 19 ILE H 4.680 . 4.680 4.627 4.580 4.656 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
401 1 18 GLU HA 1 18 GLU HG2 4.190 . 4.190 2.795 2.561 3.066 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
402 1 18 GLU HA 1 18 GLU QG 3.650 . 3.650 2.686 2.416 2.938 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
403 1 18 GLU HA 1 18 GLU HG3 4.190 . 4.190 3.552 2.843 3.789 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
404 1 18 GLU HA 1 19 ILE H 2.710 . 2.710 2.217 2.147 2.325 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
405 1 18 GLU QB 1 19 ILE H 3.310 . 3.310 2.692 2.491 3.129 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
406 1 18 GLU HG2 1 19 ILE H 4.870 . 4.870 4.550 4.071 4.878 0.008 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
407 1 18 GLU HG3 1 19 ILE H 4.870 . 4.870 4.862 4.667 4.919 0.049 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
408 1 19 ILE H 1 19 ILE HB 3.040 . 3.040 2.667 2.578 2.765 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
409 1 19 ILE H 1 19 ILE QG 3.230 . 3.230 2.707 2.471 2.939 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
410 1 19 ILE H 1 20 TYR H 4.500 . 4.500 4.314 4.164 4.427 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
411 1 19 ILE HA 1 19 ILE MD 4.260 . 4.260 2.426 2.146 3.919 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
412 1 19 ILE HA 1 19 ILE MG 3.390 . 3.390 2.380 2.332 2.433 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
413 1 19 ILE HB 1 20 TYR H 4.400 . 4.400 4.226 4.117 4.337 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
414 1 19 ILE MD 1 20 TYR H 5.320 . 5.320 4.082 3.793 5.326 0.006 42 0 "[ . 1 . 2 . 3 . 4 ]" 1
415 1 19 ILE QG 1 20 TYR H 5.080 . 5.080 4.718 4.094 4.884 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
416 1 19 ILE MG 1 20 TYR H 3.230 . 3.230 2.820 2.620 3.110 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
417 1 20 TYR H 1 20 TYR HB2 3.710 . 3.710 2.281 2.159 2.450 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
418 1 20 TYR H 1 20 TYR HB3 3.710 . 3.710 3.534 3.271 3.659 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
419 1 20 TYR H 1 20 TYR QD 3.520 . 3.520 2.882 2.414 3.524 0.004 16 0 "[ . 1 . 2 . 3 . 4 ]" 1
420 1 20 TYR H 1 21 GLY H 4.630 . 4.630 4.488 4.448 4.533 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
421 1 20 TYR HA 1 20 TYR QD 3.910 . 3.910 3.052 2.698 3.159 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
422 1 20 TYR HA 1 21 GLY H 3.540 . 3.540 2.572 2.507 2.628 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
423 1 20 TYR QB 1 21 GLY H 3.510 . 3.510 2.214 2.069 2.317 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
424 1 20 TYR HB2 1 21 GLY H 4.060 . 4.060 3.620 3.240 3.786 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
425 1 20 TYR HB3 1 21 GLY H 4.060 . 4.060 2.234 2.093 2.338 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
426 1 20 TYR QD 1 21 GLY H 3.860 . 3.860 3.222 2.298 3.713 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
427 1 21 GLY H 1 23 ILE MD 5.500 . 5.500 5.547 5.507 5.766 0.266 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
428 1 21 GLY H 1 23 ILE MG 3.890 . 3.890 3.709 3.564 3.896 0.006 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
429 1 21 GLY QA 1 23 ILE H 4.420 . 4.420 4.527 4.450 4.742 0.322 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
430 1 21 GLY QA 1 23 ILE MG 3.960 . 3.960 3.201 2.986 3.606 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
431 1 22 PRO HA 1 23 ILE H 3.490 . 3.490 2.008 1.910 2.132 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
432 1 22 PRO HB2 1 23 ILE H 3.910 . 3.910 3.719 3.550 3.951 0.041 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
433 1 22 PRO HB3 1 23 ILE H 3.810 . 3.810 3.886 3.828 4.080 0.270 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
434 1 23 ILE H 1 23 ILE HB 3.970 . 3.970 3.734 3.664 3.779 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
435 1 23 ILE H 1 23 ILE MD 3.990 . 3.990 3.712 3.603 3.785 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
436 1 23 ILE H 1 23 ILE HG12 3.890 . 3.890 1.996 1.889 2.081 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
437 1 23 ILE H 1 23 ILE QG 3.250 . 3.250 1.956 1.850 2.027 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
438 1 23 ILE H 1 23 ILE HG13 3.890 . 3.890 2.824 2.647 3.047 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
439 1 23 ILE H 1 23 ILE MG 3.550 . 3.550 2.817 2.672 2.902 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
440 1 23 ILE H 1 24 GLU H 4.520 . 4.520 4.524 4.489 4.545 0.025 10 0 "[ . 1 . 2 . 3 . 4 ]" 1
441 1 23 ILE H 1 24 GLU HA 5.500 . 5.500 5.178 5.051 5.284 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
442 1 23 ILE HA 1 23 ILE MD 4.300 . 4.300 4.235 4.189 4.250 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
443 1 23 ILE HA 1 23 ILE MG 3.320 . 3.320 2.249 2.224 2.271 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
444 1 23 ILE HA 1 24 GLU H 2.600 . 2.600 2.108 2.065 2.152 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
445 1 23 ILE HA 1 25 VAL H 5.500 . 5.500 5.498 5.402 5.537 0.037 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
446 1 23 ILE HB 1 23 ILE MD 3.540 . 3.540 2.436 2.396 2.487 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
447 1 23 ILE HB 1 24 GLU H 3.350 . 3.350 3.027 2.791 3.237 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
448 1 23 ILE HB 1 25 VAL H 5.500 . 5.500 5.182 4.962 5.331 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
449 1 23 ILE MD 1 24 GLU H 5.500 . 5.500 4.928 4.698 5.135 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
450 1 23 ILE QG 1 23 ILE MG 3.230 . 3.230 2.320 2.297 2.365 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
451 1 23 ILE QG 1 24 GLU H 4.340 . 4.340 4.150 4.011 4.248 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
452 1 23 ILE QG 1 25 VAL H 4.500 . 4.500 4.377 4.061 4.497 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
453 1 23 ILE QG 1 25 VAL QG 4.380 . 4.380 2.391 2.101 2.528 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
454 1 23 ILE HG12 1 24 GLU H 5.130 . 5.130 5.107 5.010 5.167 0.037 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
455 1 23 ILE HG13 1 24 GLU H 5.130 . 5.130 4.393 4.220 4.523 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
456 1 23 ILE MG 1 24 GLU H 3.850 . 3.850 3.693 3.546 3.821 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
457 1 24 GLU H 1 24 GLU HB2 3.880 . 3.880 2.723 2.021 3.689 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
458 1 24 GLU H 1 24 GLU QB 3.010 . 3.010 2.409 2.003 2.835 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
459 1 24 GLU H 1 24 GLU HB3 3.880 . 3.880 3.257 2.830 3.625 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
460 1 24 GLU H 1 24 GLU HG2 4.180 . 4.180 3.378 1.973 4.185 0.005 19 0 "[ . 1 . 2 . 3 . 4 ]" 1
461 1 24 GLU H 1 24 GLU QG 3.530 . 3.530 2.678 1.916 3.449 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
462 1 24 GLU H 1 24 GLU HG3 4.180 . 4.180 2.961 2.200 3.749 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
463 1 24 GLU H 1 25 VAL H 4.350 . 4.350 4.291 4.254 4.330 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
464 1 24 GLU H 1 25 VAL QG 5.440 . 5.440 3.863 3.751 3.996 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
465 1 24 GLU HA 1 24 GLU QG 3.680 . 3.680 2.701 2.140 3.474 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
466 1 24 GLU HA 1 25 VAL H 2.760 . 2.760 2.122 2.019 2.197 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
467 1 24 GLU QB 1 25 VAL H 3.680 . 3.680 3.570 3.422 3.700 0.020 34 0 "[ . 1 . 2 . 3 . 4 ]" 1
468 1 25 VAL H 1 25 VAL HB 4.120 . 4.120 3.800 3.757 3.858 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
469 1 25 VAL H 1 25 VAL MG1 4.150 . 4.150 2.936 2.821 3.023 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
470 1 25 VAL H 1 25 VAL QG 2.850 . 2.850 2.073 2.019 2.127 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
471 1 25 VAL H 1 25 VAL MG2 4.150 . 4.150 2.119 2.060 2.177 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
472 1 25 VAL H 1 26 SER H 4.530 . 4.530 4.497 4.454 4.534 0.004 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
473 1 25 VAL HA 1 25 VAL QG 3.110 . 3.110 2.258 2.240 2.283 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
474 1 25 VAL HA 1 26 SER H 3.290 . 3.290 2.453 2.370 2.594 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
475 1 25 VAL HA 1 29 MET ME 4.900 . 4.900 4.307 3.998 4.522 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
476 1 25 VAL HB 1 26 SER H 3.460 . 3.460 2.364 2.222 2.483 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
477 1 25 VAL HB 1 29 MET ME 4.500 . 4.500 3.988 3.599 4.227 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
478 1 25 VAL QG 1 27 GLU H 4.960 . 4.960 4.929 4.736 5.182 0.222 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
479 1 25 VAL QG 1 29 MET ME 3.320 . 3.320 2.953 2.564 3.146 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
480 1 25 VAL QG 1 66 LEU MD1 3.380 . 3.380 2.361 2.265 2.531 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
481 1 25 VAL MG1 1 26 SER H 3.580 . 3.580 3.623 3.591 3.715 0.135 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
482 1 25 VAL MG2 1 26 SER H 3.580 . 3.580 3.456 3.290 3.584 0.004 2 0 "[ . 1 . 2 . 3 . 4 ]" 1
483 1 26 SER H 1 26 SER HB2 3.640 . 3.640 2.509 2.258 2.772 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
484 1 26 SER H 1 26 SER QB 2.980 . 2.980 2.378 2.224 2.432 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
485 1 26 SER H 1 26 SER HB3 3.640 . 3.640 3.221 2.615 3.675 0.035 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
486 1 26 SER H 1 26 SER HG 4.190 . 4.190 4.137 3.806 4.261 0.071 10 0 "[ . 1 . 2 . 3 . 4 ]" 1
487 1 26 SER H 1 27 GLU H 4.640 . 4.640 4.565 4.520 4.622 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
488 1 26 SER H 1 28 ASP H 5.340 . 5.340 4.915 4.678 5.170 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
489 1 26 SER H 1 29 MET H 4.850 . 4.850 3.986 3.740 4.146 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
490 1 26 SER H 1 29 MET HB2 3.740 . 3.740 2.539 2.267 2.727 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
491 1 26 SER H 1 29 MET HB3 4.260 . 4.260 3.391 3.051 3.648 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
492 1 26 SER H 1 29 MET ME 4.510 . 4.510 4.426 4.239 4.577 0.067 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
493 1 26 SER H 1 29 MET QG 5.140 . 5.140 4.212 3.943 4.446 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
494 1 26 SER H 1 34 LEU MD1 5.200 . 5.200 5.181 4.967 5.259 0.059 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
495 1 26 SER H 1 66 LEU MD1 4.150 . 4.150 3.655 3.456 3.904 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
496 1 26 SER QB 1 28 ASP H 3.720 . 3.720 2.512 2.046 2.921 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
497 1 26 SER QB 1 29 MET H 3.840 . 3.840 2.857 2.522 3.260 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
498 1 26 SER QB 1 29 MET HB2 3.850 . 3.850 2.577 2.158 2.953 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
499 1 26 SER HB2 1 27 GLU H 4.340 . 4.340 4.061 3.808 4.228 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
500 1 26 SER HB2 1 28 ASP H 4.410 . 4.410 3.822 3.244 4.358 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
501 1 26 SER HB2 1 29 MET H 4.520 . 4.520 3.833 2.926 4.523 0.003 3 0 "[ . 1 . 2 . 3 . 4 ]" 1
502 1 26 SER HB2 1 29 MET HB2 4.440 . 4.440 3.123 2.224 3.879 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
503 1 26 SER HB3 1 27 GLU H 4.340 . 4.340 3.153 2.568 3.824 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
504 1 26 SER HB3 1 28 ASP H 4.410 . 4.410 2.549 2.069 2.987 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
505 1 26 SER HB3 1 29 MET H 4.520 . 4.520 3.106 2.540 3.705 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
506 1 26 SER HB3 1 29 MET HB2 4.440 . 4.440 3.322 2.179 4.162 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
507 1 26 SER HG 1 27 GLU H 3.580 . 3.580 3.073 2.302 3.709 0.129 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
508 1 26 SER HG 1 28 ASP H 4.620 . 4.620 3.888 2.837 4.623 0.003 24 0 "[ . 1 . 2 . 3 . 4 ]" 1
509 1 27 GLU H 1 27 GLU HB2 3.680 . 3.680 3.592 3.558 3.665 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
510 1 27 GLU H 1 27 GLU QB 3.110 . 3.110 2.476 2.323 2.710 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
511 1 27 GLU H 1 27 GLU HB3 3.680 . 3.680 2.524 2.353 2.792 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
512 1 27 GLU H 1 27 GLU HG2 3.780 . 3.780 2.130 1.899 2.487 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
513 1 27 GLU H 1 27 GLU QG 3.110 . 3.110 2.100 1.877 2.372 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
514 1 27 GLU H 1 27 GLU HG3 3.780 . 3.780 3.308 2.422 3.671 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
515 1 27 GLU H 1 28 ASP H 3.310 . 3.310 2.635 2.404 2.890 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
516 1 27 GLU H 1 29 MET H 4.450 . 4.450 4.151 4.001 4.291 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
517 1 27 GLU HA 1 66 LEU H 5.120 . 5.120 4.445 4.121 4.790 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
518 1 27 GLU HA 1 66 LEU HB2 4.080 . 4.080 2.502 2.145 2.941 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
519 1 27 GLU HA 1 66 LEU HB3 4.830 . 4.830 3.812 3.537 4.302 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
520 1 27 GLU HA 1 66 LEU MD1 4.300 . 4.300 3.384 3.086 3.661 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
521 1 27 GLU HB2 1 28 ASP H 4.380 . 4.380 4.001 3.830 4.149 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
522 1 27 GLU HB3 1 28 ASP H 4.380 . 4.380 4.088 3.951 4.211 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
523 1 27 GLU QG 1 28 ASP H 3.000 . 3.000 2.424 2.174 2.649 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
524 1 27 GLU QG 1 28 ASP HA 4.730 . 4.730 3.528 3.241 3.865 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
525 1 27 GLU QG 1 28 ASP QB 3.290 . 3.290 2.967 2.452 3.489 0.199 26 0 "[ . 1 . 2 . 3 . 4 ]" 1
526 1 28 ASP H 1 28 ASP QB 3.480 . 3.480 2.365 2.127 2.777 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
527 1 28 ASP H 1 29 MET H 2.900 . 2.900 2.492 2.375 2.623 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
528 1 28 ASP H 1 29 MET HB2 4.730 . 4.730 4.414 4.320 4.530 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
529 1 28 ASP H 1 66 LEU H 5.500 . 5.500 5.364 5.157 5.512 0.012 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
530 1 28 ASP H 1 66 LEU MD1 5.000 . 5.000 5.041 4.958 5.280 0.280 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
531 1 28 ASP HA 1 65 SER HA 5.450 . 5.450 4.636 4.176 5.008 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
532 1 28 ASP HA 1 65 SER HB2 4.000 . 4.000 3.562 2.125 4.025 0.025 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
533 1 28 ASP HA 1 65 SER QB 3.370 . 3.370 2.455 1.982 2.815 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
534 1 28 ASP HA 1 65 SER HB3 4.000 . 4.000 2.653 2.000 3.642 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
535 1 28 ASP HA 1 67 LYS H 4.970 . 4.970 3.906 3.510 4.282 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
536 1 29 MET H 1 29 MET HB2 2.920 . 2.920 2.506 2.428 2.571 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
537 1 29 MET H 1 29 MET HB3 2.880 . 2.880 2.471 2.419 2.543 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
538 1 29 MET H 1 29 MET HG2 4.750 . 4.750 4.497 4.453 4.566 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
539 1 29 MET H 1 29 MET HG3 4.750 . 4.750 4.479 4.434 4.505 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
540 1 29 MET H 1 30 ALA H 4.830 . 4.830 4.659 4.600 4.688 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
541 1 29 MET H 1 66 LEU H 4.370 . 4.370 3.731 3.552 3.864 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
542 1 29 MET H 1 66 LEU HB3 5.500 . 5.500 5.474 5.309 5.515 0.015 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
543 1 29 MET H 1 66 LEU MD1 4.590 . 4.590 3.617 3.482 3.773 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
544 1 29 MET H 1 66 LEU MD2 5.500 . 5.500 5.021 4.721 5.285 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
545 1 29 MET H 1 66 LEU HG 3.840 . 3.840 3.558 3.237 3.868 0.028 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
546 1 29 MET H 1 67 LYS H 5.230 . 5.230 4.749 4.551 4.923 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
547 1 29 MET HA 1 29 MET HG2 4.220 . 4.220 3.368 3.273 3.503 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
548 1 29 MET HA 1 29 MET QG 3.550 . 3.550 2.439 2.366 2.514 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
549 1 29 MET HA 1 29 MET HG3 4.220 . 4.220 2.504 2.406 2.606 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
550 1 29 MET HA 1 30 ALA H 2.460 . 2.460 2.293 2.231 2.327 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
551 1 29 MET HA 1 30 ALA MB 4.170 . 4.170 4.087 4.050 4.116 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
552 1 29 MET HA 1 66 LEU H 5.500 . 5.500 5.030 4.969 5.122 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
553 1 29 MET HB2 1 29 MET ME 4.670 . 4.670 3.834 3.709 3.939 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
554 1 29 MET HB2 1 30 ALA H 4.280 . 4.280 4.235 4.192 4.276 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
555 1 29 MET HB2 1 66 LEU H 5.500 . 5.500 5.335 5.225 5.428 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
556 1 29 MET HB3 1 30 ALA H 4.040 . 4.040 4.034 3.975 4.050 0.010 13 0 "[ . 1 . 2 . 3 . 4 ]" 1
557 1 29 MET HB3 1 34 LEU H 5.050 . 5.050 4.995 4.884 5.065 0.015 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
558 1 29 MET HB3 1 66 LEU MD1 4.220 . 4.220 2.389 2.261 2.490 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
559 1 29 MET HB3 1 66 LEU MD2 4.180 . 4.180 3.694 3.376 4.093 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
560 1 29 MET HB3 1 66 LEU HG 4.420 . 4.420 2.502 2.306 2.827 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
561 1 29 MET ME 1 29 MET HG2 3.580 . 3.580 2.691 2.459 2.776 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
562 1 29 MET ME 1 29 MET QG 3.120 . 3.120 2.256 2.214 2.290 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
563 1 29 MET ME 1 29 MET HG3 3.580 . 3.580 2.429 2.349 2.638 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
564 1 29 MET ME 1 30 ALA H 4.540 . 4.540 4.545 4.472 4.601 0.061 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
565 1 29 MET ME 1 33 ASP H 5.350 . 5.350 4.631 4.519 4.738 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
566 1 29 MET ME 1 33 ASP HA 5.160 . 5.160 3.885 3.797 4.066 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
567 1 29 MET ME 1 33 ASP HB3 3.580 . 3.580 2.425 2.159 2.654 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
568 1 29 MET ME 1 34 LEU H 3.740 . 3.740 3.323 3.161 3.502 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
569 1 29 MET ME 1 34 LEU HA 3.330 . 3.330 2.234 2.070 2.366 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
570 1 29 MET ME 1 34 LEU HB3 4.810 . 4.810 4.576 4.417 4.752 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
571 1 29 MET ME 1 34 LEU MD1 3.650 . 3.650 3.340 3.089 3.499 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
572 1 29 MET QG 1 30 ALA H 3.160 . 3.160 2.617 2.489 2.678 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
573 1 29 MET QG 1 33 ASP H 4.780 . 4.780 3.940 3.864 4.073 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
574 1 29 MET QG 1 34 LEU H 3.620 . 3.620 2.884 2.806 3.022 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
575 1 29 MET HG2 1 30 ALA H 3.680 . 3.680 3.152 2.980 3.340 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
576 1 29 MET HG2 1 34 LEU H 4.170 . 4.170 2.939 2.849 3.097 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
577 1 29 MET HG3 1 30 ALA H 3.680 . 3.680 2.804 2.568 2.933 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
578 1 29 MET HG3 1 34 LEU H 4.170 . 4.170 4.185 4.173 4.261 0.091 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
579 1 30 ALA H 1 30 ALA MB 2.650 . 2.650 2.276 2.254 2.290 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
580 1 30 ALA H 1 31 LEU H 4.670 . 4.670 4.638 4.592 4.665 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
581 1 30 ALA H 1 32 THR H 5.500 . 5.500 5.263 5.180 5.371 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
582 1 30 ALA H 1 33 ASP H 4.160 . 4.160 3.836 3.734 4.016 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
583 1 30 ALA H 1 33 ASP HB2 3.830 . 3.830 2.615 2.467 2.749 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
584 1 30 ALA H 1 33 ASP HB3 4.150 . 4.150 3.975 3.845 4.160 0.010 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
585 1 30 ALA H 1 34 LEU H 4.530 . 4.530 4.507 4.413 4.553 0.023 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
586 1 30 ALA H 1 65 SER HA 4.870 . 4.870 4.525 4.440 4.760 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
587 1 30 ALA HA 1 31 LEU H 2.710 . 2.710 2.299 2.232 2.362 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
588 1 30 ALA HA 1 31 LEU HA 4.650 . 4.650 4.402 4.377 4.436 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
589 1 30 ALA HA 1 32 THR H 4.440 . 4.440 4.120 4.028 4.352 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
590 1 30 ALA HA 1 33 ASP H 4.820 . 4.820 4.361 4.287 4.467 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
591 1 30 ALA HA 1 65 SER H 4.800 . 4.800 4.570 4.445 4.788 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
592 1 30 ALA HA 1 65 SER HA 3.270 . 3.270 2.083 1.932 2.282 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
593 1 30 ALA HA 1 65 SER QB 4.920 . 4.920 3.821 3.291 4.160 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
594 1 30 ALA HA 1 66 LEU H 4.040 . 4.040 3.698 3.509 3.890 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
595 1 30 ALA MB 1 31 LEU H 3.190 . 3.190 2.671 2.574 2.783 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
596 1 30 ALA MB 1 32 THR H 2.980 . 2.980 2.623 2.533 2.736 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
597 1 30 ALA MB 1 32 THR HB 5.020 . 5.020 4.314 4.199 4.424 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
598 1 30 ALA MB 1 32 THR MG 4.060 . 4.060 3.577 3.427 4.044 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
599 1 30 ALA MB 1 33 ASP H 2.960 . 2.960 2.283 2.148 2.514 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
600 1 30 ALA MB 1 33 ASP HB2 4.340 . 4.340 2.876 2.512 3.231 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
601 1 30 ALA MB 1 34 LEU H 4.200 . 4.200 4.030 3.942 4.152 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
602 1 30 ALA MB 1 63 THR HA 4.050 . 4.050 3.339 3.030 3.636 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
603 1 30 ALA MB 1 64 GLN H 5.500 . 5.500 4.724 4.467 5.118 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
604 1 30 ALA MB 1 65 SER H 5.440 . 5.440 5.308 5.117 5.492 0.052 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
605 1 30 ALA MB 1 65 SER HA 4.170 . 4.170 3.741 3.560 3.887 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
606 1 30 ALA MB 1 66 LEU H 5.280 . 5.280 5.133 4.985 5.281 0.001 13 0 "[ . 1 . 2 . 3 . 4 ]" 1
607 1 31 LEU H 1 31 LEU HB2 3.350 . 3.350 2.486 2.435 2.563 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
608 1 31 LEU H 1 31 LEU QB 2.820 . 2.820 2.180 2.137 2.250 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
609 1 31 LEU H 1 31 LEU HB3 3.350 . 3.350 2.413 2.333 2.537 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
610 1 31 LEU H 1 31 LEU MD1 4.440 . 4.440 4.158 4.112 4.239 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
611 1 31 LEU H 1 31 LEU QD 3.870 . 3.870 3.728 3.698 3.782 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
612 1 31 LEU H 1 31 LEU MD2 4.440 . 4.440 4.212 4.157 4.269 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
613 1 31 LEU H 1 31 LEU HG 4.790 . 4.790 4.484 4.442 4.546 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
614 1 31 LEU H 1 32 THR H 3.420 . 3.420 2.674 2.620 2.749 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
615 1 31 LEU H 1 32 THR MG 4.520 . 4.520 4.277 4.154 4.596 0.076 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
616 1 31 LEU H 1 33 ASP H 4.660 . 4.660 4.079 4.000 4.195 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
617 1 31 LEU H 1 34 LEU H 4.940 . 4.940 4.776 4.679 4.862 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
618 1 31 LEU H 1 63 THR HA 4.500 . 4.500 4.010 3.439 4.396 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
619 1 31 LEU H 1 64 GLN H 4.890 . 4.890 3.910 3.775 4.159 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
620 1 31 LEU H 1 64 GLN HB2 5.500 . 5.500 4.354 4.183 4.541 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
621 1 31 LEU H 1 65 SER HA 3.450 . 3.450 3.165 3.011 3.451 0.001 36 0 "[ . 1 . 2 . 3 . 4 ]" 1
622 1 31 LEU H 1 66 LEU H 4.880 . 4.880 4.478 4.275 4.724 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
623 1 31 LEU H 1 66 LEU MD2 4.150 . 4.150 3.602 3.381 3.824 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
624 1 31 LEU H 1 66 LEU HG 5.500 . 5.500 4.860 4.472 5.169 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
625 1 31 LEU HA 1 31 LEU MD1 4.170 . 4.170 3.077 2.125 3.548 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
626 1 31 LEU HA 1 31 LEU QD 3.200 . 3.200 2.249 2.116 2.317 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
627 1 31 LEU HA 1 31 LEU MD2 4.170 . 4.170 2.791 2.267 3.929 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
628 1 31 LEU HA 1 33 ASP H 4.250 . 4.250 4.185 4.105 4.256 0.006 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
629 1 31 LEU HA 1 34 LEU H 3.700 . 3.700 3.385 3.204 3.525 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
630 1 31 LEU HA 1 34 LEU HB2 4.290 . 4.290 3.422 3.213 3.593 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
631 1 31 LEU HA 1 34 LEU HB3 4.770 . 4.770 2.822 2.516 3.050 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
632 1 31 LEU HA 1 35 ILE H 4.440 . 4.440 4.162 3.887 4.373 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
633 1 31 LEU HA 1 66 LEU MD2 3.850 . 3.850 2.276 2.105 2.613 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
634 1 31 LEU QB 1 32 THR H 3.420 . 3.420 2.546 2.485 2.638 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
635 1 31 LEU QB 1 33 ASP H 5.340 . 5.340 4.626 4.570 4.705 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
636 1 31 LEU QB 1 64 GLN H 4.620 . 4.620 3.155 3.017 3.301 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
637 1 31 LEU QB 1 66 LEU MD2 4.340 . 4.340 3.106 2.894 3.323 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
638 1 31 LEU QB 1 69 LEU MD1 3.940 . 3.940 2.334 2.106 2.618 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
639 1 31 LEU HB2 1 64 GLN H 5.500 . 5.500 3.905 3.737 4.053 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
640 1 31 LEU HB2 1 69 LEU MD1 4.680 . 4.680 2.354 2.120 2.645 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
641 1 31 LEU HB3 1 64 GLN H 5.500 . 5.500 3.334 3.143 3.519 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
642 1 31 LEU HB3 1 69 LEU MD1 4.680 . 4.680 3.846 3.606 4.177 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
643 1 31 LEU QD 1 32 THR H 3.960 . 3.960 3.353 3.076 3.955 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
644 1 31 LEU QD 1 34 LEU H 4.780 . 4.780 4.227 4.101 4.415 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
645 1 31 LEU QD 1 34 LEU HB2 4.930 . 4.930 4.035 3.762 4.221 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
646 1 31 LEU QD 1 35 ILE H 3.790 . 3.790 3.554 3.327 3.805 0.015 15 0 "[ . 1 . 2 . 3 . 4 ]" 1
647 1 31 LEU QD 1 35 ILE MD 3.710 . 3.710 2.094 1.931 2.532 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
648 1 31 LEU QD 1 35 ILE HG13 4.030 . 4.030 2.656 2.374 2.969 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
649 1 31 LEU QD 1 58 LEU HB3 4.400 . 4.400 2.344 2.119 3.028 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
650 1 31 LEU QD 1 59 ASP H 4.390 . 4.390 4.260 3.743 4.578 0.188 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
651 1 31 LEU QD 1 60 SER H 4.950 . 4.950 4.190 3.944 4.570 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
652 1 31 LEU QD 1 60 SER HA 3.860 . 3.860 2.384 2.013 3.091 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
653 1 31 LEU QD 1 62 ARG H 3.590 . 3.590 2.906 2.543 3.427 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
654 1 31 LEU QD 1 62 ARG QB 4.110 . 4.110 2.543 2.016 4.201 0.091 23 0 "[ . 1 . 2 . 3 . 4 ]" 1
655 1 31 LEU QD 1 62 ARG QD 4.710 . 4.710 3.581 2.702 4.713 0.003 39 0 "[ . 1 . 2 . 3 . 4 ]" 1
656 1 31 LEU QD 1 64 GLN H 4.720 . 4.720 4.064 3.652 4.387 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
657 1 31 LEU MD1 1 32 THR H 4.620 . 4.620 3.618 3.145 4.629 0.009 25 0 "[ . 1 . 2 . 3 . 4 ]" 1
658 1 31 LEU MD1 1 35 ILE H 5.270 . 5.270 3.948 3.669 4.101 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
659 1 31 LEU MD1 1 59 ASP H 5.500 . 5.500 4.991 4.678 5.557 0.057 11 0 "[ . 1 . 2 . 3 . 4 ]" 1
660 1 31 LEU MD1 1 60 SER HA 4.600 . 4.600 2.866 2.019 4.619 0.019 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
661 1 31 LEU MD1 1 64 GLN H 5.500 . 5.500 4.683 4.086 5.581 0.081 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
662 1 31 LEU MD2 1 32 THR H 4.620 . 4.620 4.305 4.147 4.439 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
663 1 31 LEU MD2 1 35 ILE H 5.270 . 5.270 4.273 3.610 5.445 0.175 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
664 1 31 LEU MD2 1 59 ASP H 5.500 . 5.500 4.876 3.816 5.516 0.016 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
665 1 31 LEU MD2 1 60 SER HA 4.600 . 4.600 3.690 2.571 4.500 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
666 1 31 LEU MD2 1 64 GLN H 5.500 . 5.500 5.038 3.707 5.621 0.121 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
667 1 31 LEU HG 1 32 THR H 5.120 . 5.120 4.522 3.735 4.877 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
668 1 31 LEU HG 1 32 THR HA 5.500 . 5.500 4.972 3.557 5.623 0.123 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
669 1 31 LEU HG 1 60 SER HA 5.500 . 5.500 4.357 3.395 5.095 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
670 1 32 THR H 1 32 THR HB 3.750 . 3.750 3.595 3.530 3.616 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
671 1 32 THR H 1 32 THR MG 3.030 . 3.030 2.289 2.197 2.467 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
672 1 32 THR H 1 33 ASP H 3.280 . 3.280 2.641 2.598 2.718 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
673 1 32 THR H 1 35 ILE H 5.390 . 5.390 4.821 4.710 4.899 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
674 1 32 THR H 1 35 ILE MD 4.800 . 4.800 4.719 4.340 4.843 0.043 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
675 1 32 THR H 1 63 THR HA 4.090 . 4.090 3.366 2.678 3.852 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
676 1 32 THR HA 1 32 THR MG 3.410 . 3.410 2.309 2.185 2.349 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
677 1 32 THR HA 1 34 LEU H 4.800 . 4.800 4.461 4.327 4.528 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
678 1 32 THR HA 1 35 ILE H 3.970 . 3.970 3.476 3.297 3.611 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
679 1 32 THR HA 1 35 ILE HB 3.780 . 3.780 2.870 2.654 3.079 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
680 1 32 THR HA 1 35 ILE MD 4.330 . 4.330 2.846 2.551 3.091 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
681 1 32 THR HA 1 35 ILE MG 4.600 . 4.600 4.307 4.098 4.529 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
682 1 32 THR HA 1 36 ALA H 4.930 . 4.930 4.183 4.029 4.362 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
683 1 32 THR HA 1 36 ALA MB 5.500 . 5.500 4.868 4.657 5.120 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
684 1 32 THR HB 1 33 ASP H 3.920 . 3.920 3.745 3.616 3.825 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
685 1 32 THR MG 1 33 ASP H 4.170 . 4.170 4.031 3.950 4.195 0.025 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
686 1 32 THR MG 1 61 ASN HA 4.180 . 4.180 3.510 2.688 4.104 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
687 1 32 THR MG 1 62 ARG H 4.630 . 4.630 4.117 3.707 4.566 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
688 1 32 THR MG 1 63 THR HA 3.620 . 3.620 2.484 2.215 3.308 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
689 1 33 ASP H 1 33 ASP HB2 3.050 . 3.050 2.446 2.278 2.526 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
690 1 33 ASP H 1 33 ASP HB3 3.650 . 3.650 3.615 3.562 3.632 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
691 1 33 ASP H 1 34 LEU H 2.840 . 2.840 2.458 2.427 2.512 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
692 1 33 ASP H 1 34 LEU HA 5.260 . 5.260 5.142 5.120 5.166 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
693 1 33 ASP H 1 34 LEU HB2 5.140 . 5.140 4.896 4.809 4.971 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
694 1 33 ASP H 1 34 LEU HB3 4.770 . 4.770 4.611 4.536 4.719 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
695 1 33 ASP H 1 35 ILE H 4.360 . 4.360 4.030 3.910 4.135 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
696 1 33 ASP H 1 36 ALA H 5.080 . 5.080 4.461 4.396 4.578 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
697 1 33 ASP HA 1 36 ALA H 3.570 . 3.570 3.035 2.908 3.204 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
698 1 33 ASP HA 1 36 ALA MB 3.480 . 3.480 2.333 2.220 2.435 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
699 1 33 ASP HB2 1 34 LEU H 3.570 . 3.570 2.690 2.561 2.868 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
700 1 33 ASP HB2 1 35 ILE H 5.310 . 5.310 5.158 5.061 5.289 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
701 1 33 ASP HB3 1 34 LEU H 3.750 . 3.750 3.721 3.529 3.752 0.002 34 0 "[ . 1 . 2 . 3 . 4 ]" 1
702 1 33 ASP HB3 1 36 ALA H 5.500 . 5.500 4.990 4.899 5.129 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
703 1 34 LEU H 1 34 LEU HB2 3.060 . 3.060 2.571 2.501 2.621 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
704 1 34 LEU H 1 34 LEU HB3 3.050 . 3.050 2.511 2.449 2.575 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
705 1 34 LEU H 1 34 LEU MD1 4.170 . 4.170 4.177 4.119 4.209 0.039 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
706 1 34 LEU H 1 34 LEU MD2 4.390 . 4.390 4.293 4.246 4.371 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
707 1 34 LEU H 1 34 LEU HG 4.640 . 4.640 4.499 4.462 4.539 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
708 1 34 LEU H 1 35 ILE H 2.940 . 2.940 2.748 2.667 2.833 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
709 1 34 LEU H 1 35 ILE HA 5.500 . 5.500 5.351 5.302 5.405 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
710 1 34 LEU H 1 35 ILE HG13 4.680 . 4.680 4.507 4.441 4.607 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
711 1 34 LEU H 1 36 ALA H 4.170 . 4.170 3.967 3.900 4.041 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
712 1 34 LEU H 1 66 LEU MD2 4.380 . 4.380 3.746 3.470 4.010 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
713 1 34 LEU HA 1 34 LEU MD1 3.200 . 3.200 2.193 2.147 2.242 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
714 1 34 LEU HA 1 34 LEU MD2 4.420 . 4.420 3.931 3.901 3.953 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
715 1 34 LEU HB2 1 66 LEU MD2 3.800 . 3.800 2.268 2.139 2.473 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
716 1 34 LEU HB3 1 35 ILE H 3.020 . 3.020 2.455 2.387 2.527 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
717 1 34 LEU HB3 1 66 LEU MD2 4.180 . 4.180 2.864 2.729 3.102 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
718 1 34 LEU MD1 1 35 ILE H 5.500 . 5.500 4.497 4.415 4.612 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
719 1 34 LEU MD1 1 38 LEU MD1 4.130 . 4.130 3.390 2.841 3.717 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
720 1 34 LEU MD1 1 38 LEU HG 4.970 . 4.970 3.216 2.895 3.542 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
721 1 34 LEU MD2 1 35 ILE H 4.190 . 4.190 4.091 3.975 4.264 0.074 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
722 1 34 LEU HG 1 35 ILE H 4.090 . 4.090 3.632 3.511 3.834 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
723 1 34 LEU HG 1 38 LEU H 4.870 . 4.870 4.375 4.221 4.607 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
724 1 34 LEU HG 1 38 LEU MD1 4.240 . 4.240 2.603 2.293 2.953 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
725 1 34 LEU HG 1 66 LEU MD2 4.880 . 4.880 4.236 4.152 4.331 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
726 1 35 ILE H 1 35 ILE HB 2.830 . 2.830 2.513 2.441 2.577 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
727 1 35 ILE H 1 35 ILE MD 3.740 . 3.740 3.530 3.395 3.683 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
728 1 35 ILE H 1 35 ILE HG12 4.410 . 4.410 3.478 3.436 3.554 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
729 1 35 ILE H 1 35 ILE HG13 3.120 . 3.120 2.131 2.041 2.235 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
730 1 35 ILE H 1 35 ILE MG 3.800 . 3.800 3.815 3.791 3.848 0.048 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
731 1 35 ILE H 1 36 ALA H 3.090 . 3.090 2.679 2.581 2.735 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
732 1 35 ILE H 1 36 ALA HA 5.410 . 5.410 5.307 5.241 5.347 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
733 1 35 ILE H 1 38 LEU HB2 5.460 . 5.460 5.079 4.954 5.311 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
734 1 35 ILE H 1 38 LEU MD1 4.580 . 4.580 4.211 4.059 4.406 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
735 1 35 ILE HA 1 35 ILE MD 3.930 . 3.930 3.826 3.760 3.887 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
736 1 35 ILE HA 1 35 ILE MG 3.570 . 3.570 2.402 2.329 2.456 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
737 1 35 ILE HA 1 38 LEU H 3.440 . 3.440 3.011 2.870 3.184 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
738 1 35 ILE HA 1 38 LEU HB2 4.260 . 4.260 2.298 2.162 2.547 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
739 1 35 ILE HA 1 38 LEU MD1 4.280 . 4.280 2.286 2.123 2.567 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
740 1 35 ILE HA 1 38 LEU HG 4.690 . 4.690 2.970 2.614 3.478 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
741 1 35 ILE HA 1 39 GLN H 4.590 . 4.590 3.922 3.699 4.246 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
742 1 35 ILE HB 1 36 ALA H 3.060 . 3.060 2.868 2.748 2.972 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
743 1 35 ILE MD 1 35 ILE MG 3.260 . 3.260 2.080 2.018 2.113 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
744 1 35 ILE MD 1 36 ALA H 4.780 . 4.780 4.775 4.631 4.878 0.098 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
745 1 35 ILE MD 1 38 LEU HB2 5.500 . 5.500 5.271 5.079 5.519 0.019 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
746 1 35 ILE MD 1 44 PHE QE 4.550 . 4.550 2.856 2.332 3.456 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
747 1 35 ILE MD 1 46 LYS QB 4.730 . 4.730 3.313 2.711 4.343 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
748 1 35 ILE MD 1 46 LYS QD 5.500 . 5.500 3.546 2.523 5.240 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
749 1 35 ILE MD 1 60 SER HA 3.560 . 3.560 2.236 2.151 2.418 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
750 1 35 ILE MD 1 60 SER HB2 4.540 . 4.540 2.947 2.208 3.885 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
751 1 35 ILE MD 1 60 SER QB 3.800 . 3.800 2.339 2.099 2.891 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
752 1 35 ILE MD 1 60 SER HB3 4.540 . 4.540 2.715 2.114 3.955 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
753 1 35 ILE HG12 1 60 SER HA 5.500 . 5.500 4.893 4.497 5.203 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
754 1 35 ILE HG13 1 36 ALA H 4.320 . 4.320 4.344 4.323 4.420 0.100 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
755 1 35 ILE MG 1 36 ALA H 3.780 . 3.780 3.584 3.433 3.725 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
756 1 35 ILE MG 1 36 ALA HA 4.500 . 4.500 3.540 3.344 3.697 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
757 1 35 ILE MG 1 38 LEU H 4.720 . 4.720 4.321 4.211 4.440 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
758 1 35 ILE MG 1 38 LEU HB2 4.160 . 4.160 3.052 2.822 3.350 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
759 1 35 ILE MG 1 39 GLN H 4.120 . 4.120 3.639 3.469 3.870 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
760 1 35 ILE MG 1 39 GLN QE 4.460 . 4.460 2.492 1.685 3.982 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
761 1 35 ILE MG 1 39 GLN QG 4.170 . 4.170 2.370 2.117 3.698 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
762 1 35 ILE MG 1 44 PHE H 5.500 . 5.500 5.572 5.516 5.667 0.167 41 0 "[ . 1 . 2 . 3 . 4 ]" 1
763 1 35 ILE MG 1 44 PHE QD 3.950 . 3.950 2.070 1.897 2.251 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
764 1 35 ILE MG 1 44 PHE QE 4.020 . 4.020 2.295 2.141 2.461 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
765 1 35 ILE MG 1 46 LYS HA 5.380 . 5.380 4.196 3.737 4.780 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
766 1 35 ILE MG 1 46 LYS QD 4.740 . 4.740 2.682 2.083 4.690 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
767 1 35 ILE MG 1 46 LYS QE 4.560 . 4.560 3.966 2.333 4.608 0.048 9 0 "[ . 1 . 2 . 3 . 4 ]" 1
768 1 35 ILE MG 1 60 SER HA 5.500 . 5.500 4.481 4.222 4.795 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
769 1 35 ILE MG 1 60 SER QB 4.390 . 4.390 3.271 2.938 4.084 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
770 1 36 ALA H 1 36 ALA MB 2.660 . 2.660 2.266 2.232 2.302 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
771 1 36 ALA HA 1 38 LEU H 4.700 . 4.700 4.501 4.361 4.585 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
772 1 36 ALA HA 1 39 GLN H 3.760 . 3.760 3.477 3.212 3.643 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
773 1 36 ALA HA 1 39 GLN QB 4.020 . 4.020 2.926 2.624 3.975 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
774 1 36 ALA HA 1 39 GLN QE 4.420 . 4.420 2.401 1.663 4.439 0.019 5 0 "[ . 1 . 2 . 3 . 4 ]" 1
775 1 36 ALA MB 1 37 LEU H 2.930 . 2.930 2.598 2.551 2.700 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
776 1 36 ALA MB 1 38 LEU H 4.580 . 4.580 4.575 4.513 4.611 0.031 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
777 1 36 ALA MB 1 39 GLN QE 5.340 . 5.340 3.639 3.085 5.441 0.101 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
778 1 37 LEU H 1 37 LEU HB2 2.820 . 2.820 2.550 2.498 2.600 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
779 1 37 LEU H 1 37 LEU HB3 2.830 . 2.830 2.456 2.407 2.529 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
780 1 37 LEU H 1 37 LEU QD 4.230 . 4.230 3.748 3.733 3.787 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
781 1 37 LEU H 1 38 LEU H 2.920 . 2.920 2.610 2.582 2.640 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
782 1 37 LEU H 1 38 LEU HA 5.230 . 5.230 5.242 5.232 5.283 0.053 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
783 1 37 LEU H 1 38 LEU MD1 5.500 . 5.500 5.349 5.239 5.460 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
784 1 37 LEU H 1 38 LEU MD2 5.450 . 5.450 5.326 5.093 5.491 0.041 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
785 1 37 LEU H 1 39 GLN H 4.180 . 4.180 4.076 3.976 4.180 0.000 2 0 "[ . 1 . 2 . 3 . 4 ]" 1
786 1 37 LEU HA 1 37 LEU MD1 3.870 . 3.870 2.759 2.152 3.595 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
787 1 37 LEU HA 1 37 LEU QD 3.400 . 3.400 2.579 2.141 3.121 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
788 1 37 LEU HA 1 37 LEU MD2 3.870 . 3.870 3.691 3.391 3.888 0.018 41 0 "[ . 1 . 2 . 3 . 4 ]" 1
789 1 37 LEU HA 1 37 LEU HG 4.140 . 4.140 2.958 2.401 3.375 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
790 1 37 LEU HA 1 40 ALA H 5.290 . 5.290 3.399 3.228 3.559 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
791 1 37 LEU HA 1 40 ALA MB 3.850 . 3.850 2.838 2.696 3.177 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
792 1 37 LEU HB2 1 38 LEU H 4.490 . 4.490 3.885 3.826 3.942 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
793 1 37 LEU HB3 1 38 LEU H 3.180 . 3.180 2.582 2.491 2.708 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
794 1 37 LEU HB3 1 39 GLN H 5.170 . 5.170 4.986 4.899 5.066 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
795 1 37 LEU QD 1 38 LEU H 4.260 . 4.260 3.619 3.127 4.020 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
796 1 37 LEU QD 1 38 LEU HA 4.390 . 4.390 3.592 2.627 4.390 . 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
797 1 37 LEU QD 1 39 GLN H 5.190 . 5.190 4.942 4.654 5.195 0.005 18 0 "[ . 1 . 2 . 3 . 4 ]" 1
798 1 37 LEU QD 1 40 ALA H 4.550 . 4.550 4.336 4.020 4.581 0.031 11 0 "[ . 1 . 2 . 3 . 4 ]" 1
799 1 37 LEU QD 1 40 ALA MB 5.150 . 5.150 3.325 2.571 4.084 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
800 1 37 LEU QD 1 41 ASP H 4.230 . 4.230 3.521 3.348 3.688 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
801 1 37 LEU QD 1 41 ASP QB 5.240 . 5.240 2.651 2.254 2.956 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
802 1 37 LEU QD 1 42 CYS H 4.820 . 4.820 4.376 3.506 4.994 0.174 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
803 1 37 LEU MD1 1 38 LEU H 5.220 . 5.220 4.574 4.417 4.805 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
804 1 37 LEU MD2 1 38 LEU H 5.220 . 5.220 3.899 3.177 4.510 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
805 1 37 LEU HG 1 41 ASP H 5.500 . 5.500 4.249 3.915 4.553 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
806 1 37 LEU HG 1 42 CYS H 5.500 . 5.500 5.242 4.883 5.522 0.022 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
807 1 38 LEU H 1 38 LEU HB2 3.080 . 3.080 2.514 2.454 2.591 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
808 1 38 LEU H 1 38 LEU HB3 3.780 . 3.780 3.617 3.588 3.644 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
809 1 38 LEU H 1 38 LEU MD1 3.890 . 3.890 3.647 3.571 3.738 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
810 1 38 LEU H 1 38 LEU MD2 3.530 . 3.530 3.369 3.184 3.526 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
811 1 38 LEU H 1 38 LEU HG 2.920 . 2.920 2.339 2.251 2.404 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
812 1 38 LEU H 1 39 GLN H 3.070 . 3.070 2.724 2.661 2.771 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
813 1 38 LEU H 1 39 GLN QB 5.080 . 5.080 4.721 4.590 5.089 0.009 5 0 "[ . 1 . 2 . 3 . 4 ]" 1
814 1 38 LEU H 1 39 GLN QG 5.060 . 5.060 4.510 4.025 4.646 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
815 1 38 LEU H 1 42 CYS HB2 5.450 . 5.450 5.444 5.280 5.546 0.096 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
816 1 38 LEU H 1 44 PHE HB3 5.320 . 5.320 5.005 4.865 5.123 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
817 1 38 LEU HA 1 38 LEU MD1 4.760 . 4.760 3.886 3.857 3.920 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
818 1 38 LEU HA 1 38 LEU MD2 3.460 . 3.460 2.122 2.056 2.231 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
819 1 38 LEU HA 1 40 ALA H 4.340 . 4.340 4.165 4.077 4.292 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
820 1 38 LEU HA 1 41 ASP H 3.970 . 3.970 3.407 3.261 3.514 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
821 1 38 LEU HA 1 42 CYS H 3.600 . 3.600 2.559 2.463 2.714 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
822 1 38 LEU HA 1 42 CYS HB2 4.160 . 4.160 2.851 2.627 3.007 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
823 1 38 LEU HA 1 42 CYS HB3 4.750 . 4.750 4.478 4.290 4.636 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
824 1 38 LEU HB2 1 39 GLN H 3.500 . 3.500 2.842 2.751 2.955 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
825 1 38 LEU HB2 1 40 ALA H 5.500 . 5.500 5.108 4.930 5.265 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
826 1 38 LEU HB2 1 42 CYS H 5.500 . 5.500 5.184 5.022 5.290 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
827 1 38 LEU HB2 1 44 PHE H 5.010 . 5.010 4.538 4.355 4.727 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
828 1 38 LEU HB2 1 44 PHE HB2 4.830 . 4.830 3.834 3.313 4.338 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
829 1 38 LEU HB2 1 44 PHE HB3 4.740 . 4.740 2.898 2.662 3.178 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
830 1 38 LEU HB3 1 39 GLN H 3.910 . 3.910 3.803 3.698 3.924 0.014 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
831 1 38 LEU HB3 1 42 CYS H 4.650 . 4.650 4.173 3.921 4.328 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
832 1 38 LEU HB3 1 44 PHE H 4.170 . 4.170 3.606 3.448 3.808 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
833 1 38 LEU HB3 1 44 PHE HB2 4.570 . 4.570 2.635 2.352 3.022 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
834 1 38 LEU HB3 1 44 PHE HB3 4.490 . 4.490 2.448 2.085 3.034 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
835 1 38 LEU MD1 1 39 GLN H 4.770 . 4.770 4.691 4.611 4.786 0.016 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
836 1 38 LEU MD1 1 44 PHE H 5.500 . 5.500 5.269 5.075 5.483 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
837 1 38 LEU MD2 1 39 GLN H 4.730 . 4.730 4.778 4.737 4.833 0.103 26 0 "[ . 1 . 2 . 3 . 4 ]" 1
838 1 38 LEU MD2 1 41 ASP H 5.160 . 5.160 4.888 4.748 5.032 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
839 1 38 LEU MD2 1 42 CYS H 4.220 . 4.220 3.738 3.547 3.924 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
840 1 38 LEU MD2 1 42 CYS HB2 4.440 . 4.440 2.890 2.588 3.209 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
841 1 38 LEU MD2 1 42 CYS HB3 4.800 . 4.800 3.645 3.343 3.906 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
842 1 38 LEU MD2 1 44 PHE H 5.350 . 5.350 4.894 4.672 5.220 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
843 1 38 LEU HG 1 39 GLN H 4.540 . 4.540 4.518 4.433 4.571 0.031 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
844 1 39 GLN H 1 39 GLN HB2 3.750 . 3.750 2.440 2.310 3.689 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
845 1 39 GLN H 1 39 GLN QB 3.100 . 3.100 2.379 2.283 2.718 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
846 1 39 GLN H 1 39 GLN HB3 3.750 . 3.750 3.581 2.596 3.676 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
847 1 39 GLN H 1 39 GLN HE21 5.500 . 5.500 3.728 3.206 4.711 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
848 1 39 GLN H 1 39 GLN QE 4.810 . 4.810 3.644 3.166 4.456 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
849 1 39 GLN H 1 39 GLN HE22 5.500 . 5.500 5.233 4.900 5.556 0.056 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
850 1 39 GLN H 1 39 GLN HG2 3.700 . 3.700 3.495 2.206 3.837 0.137 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
851 1 39 GLN H 1 39 GLN QG 3.060 . 3.060 2.410 2.036 2.517 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
852 1 39 GLN H 1 39 GLN HG3 3.700 . 3.700 2.577 2.291 3.691 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
853 1 39 GLN H 1 40 ALA H 3.040 . 3.040 2.610 2.510 2.687 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
854 1 39 GLN H 1 40 ALA MB 4.380 . 4.380 4.313 4.207 4.378 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
855 1 39 GLN H 1 41 ASP H 5.150 . 5.150 4.282 4.122 4.379 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
856 1 39 GLN H 1 44 PHE H 4.480 . 4.480 4.392 4.191 4.485 0.005 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
857 1 39 GLN H 1 44 PHE QD 5.500 . 5.500 4.201 3.872 4.565 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
858 1 39 GLN HA 1 39 GLN QG 3.600 . 3.600 2.447 2.311 3.348 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
859 1 39 GLN HA 1 44 PHE H 3.920 . 3.920 2.573 2.219 2.749 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
860 1 39 GLN QB 1 39 GLN QE 3.960 . 3.960 2.587 1.780 3.579 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
861 1 39 GLN QB 1 44 PHE H 5.290 . 5.290 4.657 3.914 4.837 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
862 1 39 GLN HB2 1 40 ALA H 4.240 . 4.240 2.791 2.521 4.234 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
863 1 39 GLN HB3 1 40 ALA H 4.240 . 4.240 3.687 3.531 4.162 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
864 1 39 GLN QE 1 46 LYS H 4.810 . 4.810 4.370 2.181 4.879 0.069 11 0 "[ . 1 . 2 . 3 . 4 ]" 1
865 1 39 GLN QE 1 46 LYS QD 4.670 . 4.670 3.436 2.310 4.682 0.012 24 0 "[ . 1 . 2 . 3 . 4 ]" 1
866 1 39 GLN QE 1 46 LYS QG 5.090 . 5.090 4.060 2.407 5.105 0.015 10 0 "[ . 1 . 2 . 3 . 4 ]" 1
867 1 39 GLN HE21 1 46 LYS H 5.500 . 5.500 5.043 2.466 5.513 0.013 9 0 "[ . 1 . 2 . 3 . 4 ]" 1
868 1 39 GLN HE22 1 46 LYS H 5.500 . 5.500 4.909 2.210 5.558 0.058 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
869 1 39 GLN QG 1 40 ALA H 4.830 . 4.830 4.167 2.714 4.302 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
870 1 39 GLN HG2 1 44 PHE QD 5.500 . 5.500 3.564 2.285 4.918 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
871 1 39 GLN HG3 1 44 PHE QD 5.500 . 5.500 3.307 2.420 5.558 0.058 9 0 "[ . 1 . 2 . 3 . 4 ]" 1
872 1 40 ALA H 1 40 ALA MB 2.510 . 2.510 2.245 2.227 2.262 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
873 1 40 ALA H 1 41 ASP H 3.000 . 3.000 2.556 2.483 2.644 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
874 1 40 ALA H 1 42 CYS H 4.420 . 4.420 4.380 4.126 4.428 0.008 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
875 1 40 ALA MB 1 41 ASP H 3.030 . 3.030 2.508 2.431 2.601 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
876 1 40 ALA MB 1 42 CYS H 5.050 . 5.050 4.715 4.567 4.822 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
877 1 41 ASP H 1 41 ASP HB2 3.280 . 3.280 2.709 2.382 2.881 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
878 1 41 ASP H 1 41 ASP HB3 3.280 . 3.280 2.434 2.315 2.672 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
879 1 41 ASP H 1 42 CYS H 2.970 . 2.970 2.535 2.397 2.620 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
880 1 41 ASP H 1 43 GLY H 4.000 . 4.000 3.580 3.479 3.733 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
881 1 41 ASP H 1 44 PHE H 5.450 . 5.450 5.017 4.886 5.250 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
882 1 41 ASP HA 1 43 GLY H 5.060 . 5.060 4.131 3.963 4.490 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
883 1 41 ASP QB 1 42 CYS H 3.490 . 3.490 2.233 2.087 2.525 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
884 1 41 ASP QB 1 43 GLY H 4.660 . 4.660 4.312 4.227 4.454 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
885 1 41 ASP HB2 1 42 CYS H 3.990 . 3.990 3.692 3.567 3.781 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
886 1 41 ASP HB2 1 43 GLY H 5.500 . 5.500 5.427 5.300 5.554 0.054 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
887 1 41 ASP HB3 1 42 CYS H 3.990 . 3.990 2.253 2.101 2.566 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
888 1 41 ASP HB3 1 43 GLY H 5.500 . 5.500 4.526 4.420 4.703 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
889 1 42 CYS H 1 42 CYS HB2 3.510 . 3.510 2.480 2.409 2.545 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
890 1 42 CYS H 1 42 CYS HB3 3.840 . 3.840 3.612 3.577 3.689 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
891 1 42 CYS H 1 43 GLY H 3.010 . 3.010 2.597 2.294 2.786 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
892 1 42 CYS H 1 44 PHE H 4.260 . 4.260 3.757 3.572 3.885 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
893 1 42 CYS HA 1 44 PHE H 4.630 . 4.630 4.594 4.499 4.664 0.034 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
894 1 42 CYS HB2 1 43 GLY H 4.240 . 4.240 3.488 3.205 3.700 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
895 1 42 CYS HB3 1 43 GLY H 4.550 . 4.550 4.281 4.145 4.344 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
896 1 42 CYS HB3 1 44 PHE H 4.100 . 4.100 3.988 3.770 4.114 0.014 42 0 "[ . 1 . 2 . 3 . 4 ]" 1
897 1 42 CYS HB3 1 79 ILE MD 4.870 . 4.870 3.924 3.378 4.431 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
898 1 43 GLY H 1 44 PHE H 3.480 . 3.480 2.630 2.426 2.717 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
899 1 43 GLY H 1 44 PHE HB3 5.500 . 5.500 4.803 4.609 5.111 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
900 1 44 PHE H 1 44 PHE HB2 3.090 . 3.090 2.612 2.430 2.780 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
901 1 44 PHE H 1 44 PHE HB3 3.080 . 3.080 2.375 2.213 2.596 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
902 1 44 PHE H 1 44 PHE QD 4.190 . 4.190 4.150 4.076 4.203 0.013 41 0 "[ . 1 . 2 . 3 . 4 ]" 1
903 1 44 PHE H 1 79 ILE MD 5.030 . 5.030 4.830 4.525 5.287 0.257 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
904 1 44 PHE HA 1 44 PHE QD 4.310 . 4.310 2.646 2.322 3.003 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
905 1 44 PHE HA 1 79 ILE MD 4.650 . 4.650 3.992 3.386 4.606 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
906 1 44 PHE HA 1 79 ILE MG 4.550 . 4.550 3.552 3.165 3.973 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
907 1 44 PHE HB2 1 79 ILE MD 3.820 . 3.820 2.647 2.218 3.274 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
908 1 44 PHE HB3 1 79 ILE MD 4.800 . 4.800 3.955 3.470 4.536 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
909 1 44 PHE QD 1 79 ILE MD 3.780 . 3.780 2.265 2.026 2.631 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
910 1 44 PHE QD 1 79 ILE MG 3.760 . 3.760 2.083 1.959 2.340 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
911 1 44 PHE QD 1 80 ARG H 5.210 . 5.210 4.970 4.640 5.205 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
912 1 44 PHE QE 1 50 ASP H 4.250 . 4.250 3.056 2.732 3.518 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
913 1 44 PHE QE 1 50 ASP HA 4.680 . 4.680 3.375 2.984 3.767 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
914 1 44 PHE QE 1 51 LEU H 4.120 . 4.120 3.770 3.474 4.027 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
915 1 44 PHE QE 1 51 LEU HA 5.220 . 5.220 3.471 2.938 3.840 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
916 1 44 PHE QE 1 79 ILE MG 4.120 . 4.120 2.597 2.299 2.922 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
917 1 44 PHE QE 1 80 ARG H 4.690 . 4.690 3.654 3.272 3.893 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
918 1 44 PHE HZ 1 50 ASP H 4.860 . 4.860 4.316 3.892 4.767 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
919 1 44 PHE HZ 1 50 ASP HA 4.610 . 4.610 2.613 2.262 3.003 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
920 1 44 PHE HZ 1 51 LEU H 3.730 . 3.730 2.824 2.560 3.174 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
921 1 45 ASP QB 1 46 LYS H 4.050 . 4.050 3.892 3.302 4.032 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
922 1 45 ASP QB 1 47 THR H 4.300 . 4.300 3.460 2.309 3.790 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
923 1 45 ASP QB 1 48 LYS H 3.700 . 3.700 2.799 1.875 3.295 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
924 1 45 ASP QB 1 48 LYS QB 4.040 . 4.040 2.451 2.084 4.170 0.130 41 0 "[ . 1 . 2 . 3 . 4 ]" 1
925 1 45 ASP QB 1 49 HIS H 3.680 . 3.680 3.579 2.655 3.794 0.114 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
926 1 45 ASP HB2 1 46 LYS H 4.650 . 4.650 4.478 3.555 4.671 0.021 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
927 1 45 ASP HB2 1 47 THR H 5.040 . 5.040 4.520 2.328 4.960 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
928 1 45 ASP HB3 1 46 LYS H 4.650 . 4.650 4.292 3.810 4.453 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
929 1 45 ASP HB3 1 47 THR H 5.040 . 5.040 3.633 2.623 3.953 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
930 1 46 LYS H 1 46 LYS HB2 3.770 . 3.770 3.600 3.512 3.679 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
931 1 46 LYS H 1 46 LYS HB3 3.770 . 3.770 2.473 2.217 2.688 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
932 1 46 LYS H 1 46 LYS QE 5.150 . 5.150 4.490 3.487 5.134 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
933 1 46 LYS H 1 46 LYS HG2 3.850 . 3.850 2.289 1.931 2.807 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
934 1 46 LYS H 1 46 LYS HG3 3.850 . 3.850 3.538 2.711 3.864 0.014 41 0 "[ . 1 . 2 . 3 . 4 ]" 1
935 1 46 LYS H 1 47 THR H 3.980 . 3.980 2.878 2.673 3.080 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
936 1 46 LYS H 1 47 THR MG 4.590 . 4.590 4.254 3.905 4.683 0.093 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
937 1 46 LYS H 1 48 LYS H 4.530 . 4.530 4.423 4.271 4.590 0.060 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
938 1 46 LYS HA 1 46 LYS QD 4.320 . 4.320 4.217 3.820 4.381 0.061 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
939 1 46 LYS HA 1 46 LYS QG 3.670 . 3.670 3.375 3.323 3.435 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
940 1 46 LYS HA 1 48 LYS H 4.620 . 4.620 4.052 3.841 4.339 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
941 1 46 LYS HA 1 49 HIS H 3.970 . 3.970 3.420 3.140 3.781 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
942 1 46 LYS QB 1 46 LYS QE 4.550 . 4.550 3.387 2.021 3.746 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
943 1 46 LYS HB2 1 47 THR H 4.440 . 4.440 4.290 4.021 4.437 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
944 1 46 LYS HB3 1 47 THR H 4.440 . 4.440 4.339 4.055 4.448 0.008 28 0 "[ . 1 . 2 . 3 . 4 ]" 1
945 1 46 LYS QD 1 47 THR H 4.950 . 4.950 4.901 4.122 5.014 0.064 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
946 1 46 LYS QE 1 46 LYS QG 3.450 . 3.450 2.288 2.056 2.826 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
947 1 46 LYS QG 1 47 THR H 3.770 . 3.770 2.929 2.436 3.071 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
948 1 46 LYS HG2 1 47 THR H 4.410 . 4.410 3.256 2.456 3.933 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
949 1 46 LYS HG3 1 47 THR H 4.410 . 4.410 3.455 2.817 4.141 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
950 1 47 THR H 1 47 THR HB 3.670 . 3.670 3.409 2.439 3.694 0.024 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
951 1 47 THR H 1 47 THR MG 3.040 . 3.040 2.424 2.137 2.747 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
952 1 47 THR H 1 48 LYS H 3.030 . 3.030 2.264 1.978 2.375 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
953 1 47 THR H 1 48 LYS HA 5.160 . 5.160 5.025 4.794 5.127 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
954 1 47 THR H 1 48 LYS QB 4.500 . 4.500 4.397 4.085 4.570 0.070 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
955 1 47 THR H 1 48 LYS QG 4.500 . 4.500 3.899 3.479 4.515 0.015 36 0 "[ . 1 . 2 . 3 . 4 ]" 1
956 1 47 THR H 1 49 HIS H 3.770 . 3.770 3.530 3.220 3.676 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
957 1 47 THR HA 1 47 THR MG 3.280 . 3.280 2.593 2.269 3.239 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
958 1 47 THR HA 1 49 HIS H 4.630 . 4.630 4.330 3.807 4.662 0.032 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
959 1 47 THR HA 1 82 LYS QE 4.390 . 4.390 3.068 2.217 4.396 0.006 8 0 "[ . 1 . 2 . 3 . 4 ]" 1
960 1 47 THR HB 1 49 HIS H 5.500 . 5.500 5.528 5.505 5.584 0.084 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
961 1 48 LYS H 1 48 LYS HB2 3.780 . 3.780 2.628 2.327 3.796 0.016 41 0 "[ . 1 . 2 . 3 . 4 ]" 1
962 1 48 LYS H 1 48 LYS QB 3.220 . 3.220 2.521 2.300 2.851 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
963 1 48 LYS H 1 48 LYS HB3 3.780 . 3.780 3.658 2.828 3.783 0.003 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
964 1 48 LYS H 1 48 LYS QD 4.630 . 4.630 3.982 3.098 4.646 0.016 30 0 "[ . 1 . 2 . 3 . 4 ]" 1
965 1 48 LYS H 1 48 LYS QE 5.320 . 5.320 4.733 3.358 5.337 0.017 11 0 "[ . 1 . 2 . 3 . 4 ]" 1
966 1 48 LYS H 1 48 LYS QG 3.610 . 3.610 2.624 2.106 3.252 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
967 1 48 LYS H 1 49 HIS H 2.780 . 2.780 1.940 1.759 2.177 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
968 1 48 LYS H 1 49 HIS HA 4.940 . 4.940 4.755 4.590 4.948 0.008 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
969 1 48 LYS H 1 82 LYS QE 4.880 . 4.880 4.170 3.460 4.897 0.017 34 0 "[ . 1 . 2 . 3 . 4 ]" 1
970 1 48 LYS HA 1 48 LYS QG 3.810 . 3.810 2.668 2.375 3.349 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
971 1 48 LYS QB 1 49 HIS H 3.800 . 3.800 3.010 2.718 3.710 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
972 1 48 LYS HB2 1 49 HIS H 4.650 . 4.650 3.126 2.773 4.229 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
973 1 48 LYS HB3 1 49 HIS H 4.650 . 4.650 4.037 3.805 4.176 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
974 1 48 LYS QG 1 49 HIS H 4.470 . 4.470 4.000 2.485 4.469 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
975 1 49 HIS H 1 49 HIS HB2 3.890 . 3.890 2.673 2.568 2.770 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
976 1 49 HIS H 1 49 HIS HB3 3.970 . 3.970 3.802 3.734 3.864 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
977 1 49 HIS H 1 49 HIS HD2 5.500 . 5.500 4.654 3.926 5.218 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
978 1 49 HIS H 1 50 ASP H 4.500 . 4.500 4.466 4.414 4.501 0.001 38 0 "[ . 1 . 2 . 3 . 4 ]" 1
979 1 49 HIS H 1 82 LYS H 4.900 . 4.900 4.430 4.067 4.758 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
980 1 49 HIS H 1 82 LYS QE 4.550 . 4.550 3.463 2.614 4.590 0.040 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
981 1 49 HIS H 1 82 LYS HG2 5.080 . 5.080 3.929 3.109 5.099 0.019 7 0 "[ . 1 . 2 . 3 . 4 ]" 1
982 1 49 HIS H 1 82 LYS QG 4.460 . 4.460 3.338 2.835 3.760 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
983 1 49 HIS H 1 82 LYS HG3 5.080 . 5.080 3.977 3.001 5.072 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
984 1 49 HIS HA 1 49 HIS HD2 4.020 . 4.020 2.775 2.344 3.206 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
985 1 49 HIS HA 1 50 ASP H 2.920 . 2.920 2.347 2.267 2.400 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
986 1 49 HIS HA 1 79 ILE MG 5.410 . 5.410 4.474 4.250 4.701 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
987 1 49 HIS HA 1 80 ARG H 5.080 . 5.080 4.896 4.602 5.049 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
988 1 49 HIS HA 1 81 GLY H 5.040 . 5.040 4.749 4.585 4.955 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
989 1 49 HIS HA 1 81 GLY HA2 4.200 . 4.200 2.132 1.893 2.549 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
990 1 49 HIS HA 1 81 GLY HA3 4.630 . 4.630 3.864 3.557 4.317 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
991 1 49 HIS HA 1 82 LYS H 3.210 . 3.210 2.400 2.160 2.521 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
992 1 49 HIS HB2 1 50 ASP H 3.770 . 3.770 3.604 3.489 3.742 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
993 1 49 HIS HB2 1 79 ILE MG 3.980 . 3.980 3.518 3.091 3.825 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
994 1 49 HIS HB2 1 80 ARG H 5.500 . 5.500 5.348 4.875 5.505 0.005 42 0 "[ . 1 . 2 . 3 . 4 ]" 1
995 1 49 HIS HB2 1 82 LYS H 5.500 . 5.500 5.326 5.089 5.489 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
996 1 49 HIS HB3 1 50 ASP H 3.410 . 3.410 2.464 2.360 2.675 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
997 1 49 HIS HB3 1 79 ILE MG 3.650 . 3.650 2.588 2.359 2.781 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
998 1 49 HIS HB3 1 80 ARG H 4.510 . 4.510 3.776 3.277 3.990 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
999 1 49 HIS HB3 1 82 LYS H 4.790 . 4.790 4.750 4.469 4.844 0.054 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
1000 1 49 HIS HD2 1 50 ASP H 4.420 . 4.420 4.298 3.979 4.432 0.012 37 0 "[ . 1 . 2 . 3 . 4 ]" 1
1001 1 49 HIS HD2 1 81 GLY H 4.850 . 4.850 4.410 3.656 4.860 0.010 30 0 "[ . 1 . 2 . 3 . 4 ]" 1
1002 1 49 HIS HD2 1 81 GLY HA2 4.340 . 4.340 2.196 1.875 2.680 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1003 1 49 HIS HD2 1 81 GLY HA3 4.690 . 4.690 3.082 2.627 3.696 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1004 1 49 HIS HD2 1 82 LYS H 4.290 . 4.290 3.631 2.819 4.293 0.003 18 0 "[ . 1 . 2 . 3 . 4 ]" 1
1005 1 50 ASP H 1 50 ASP QB 3.290 . 3.290 2.480 2.394 2.555 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1006 1 50 ASP H 1 51 LEU H 4.610 . 4.610 4.439 4.400 4.491 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1007 1 50 ASP H 1 52 TYR QD 5.110 . 5.110 4.649 4.359 5.014 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1008 1 50 ASP H 1 52 TYR QE 4.650 . 4.650 4.367 3.918 4.668 0.018 11 0 "[ . 1 . 2 . 3 . 4 ]" 1
1009 1 50 ASP H 1 79 ILE MD 5.500 . 5.500 5.275 5.018 5.501 0.001 9 0 "[ . 1 . 2 . 3 . 4 ]" 1
1010 1 50 ASP H 1 79 ILE MG 3.830 . 3.830 3.805 3.568 3.946 0.116 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1011 1 50 ASP H 1 80 ARG H 3.680 . 3.680 2.994 2.837 3.125 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1012 1 50 ASP H 1 80 ARG QB 4.520 . 4.520 3.449 3.052 3.891 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1013 1 50 ASP H 1 81 GLY HA2 4.340 . 4.340 3.349 2.992 3.828 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1014 1 50 ASP H 1 81 GLY HA3 5.500 . 5.500 4.919 4.585 5.377 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1015 1 50 ASP H 1 82 LYS H 4.150 . 4.150 4.079 3.681 4.263 0.113 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1016 1 50 ASP H 1 82 LYS QD 5.340 . 5.340 4.646 3.777 5.360 0.020 19 0 "[ . 1 . 2 . 3 . 4 ]" 1
1017 1 50 ASP H 1 82 LYS QG 4.370 . 4.370 3.704 3.031 4.294 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1018 1 50 ASP HA 1 51 LEU H 2.730 . 2.730 2.278 2.188 2.370 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1019 1 50 ASP QB 1 51 LEU H 3.320 . 3.320 2.906 2.678 3.320 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1020 1 50 ASP QB 1 52 TYR H 5.460 . 5.460 4.981 4.733 5.272 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1021 1 50 ASP QB 1 52 TYR QE 3.740 . 3.740 2.177 2.021 2.436 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1022 1 50 ASP QB 1 57 ILE QG 5.340 . 5.340 3.366 2.720 4.236 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1023 1 50 ASP QB 1 57 ILE MG 3.760 . 3.760 2.692 2.252 3.771 0.011 40 0 "[ . 1 . 2 . 3 . 4 ]" 1
1024 1 50 ASP QB 1 80 ARG H 4.430 . 4.430 3.759 3.265 4.112 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1025 1 50 ASP QB 1 80 ARG QB 5.190 . 5.190 2.868 2.124 3.534 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1026 1 50 ASP QB 1 82 LYS H 5.060 . 5.060 4.620 3.827 5.118 0.058 26 0 "[ . 1 . 2 . 3 . 4 ]" 1
1027 1 51 LEU H 1 51 LEU HB2 3.310 . 3.310 2.635 2.130 2.938 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1028 1 51 LEU H 1 51 LEU HB3 3.310 . 3.310 2.716 2.378 3.271 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1029 1 51 LEU H 1 51 LEU MD1 4.520 . 4.520 4.283 4.026 4.374 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1030 1 51 LEU H 1 51 LEU QD 3.920 . 3.920 3.839 3.705 3.899 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1031 1 51 LEU H 1 51 LEU MD2 4.520 . 4.520 4.339 4.217 4.426 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1032 1 51 LEU H 1 51 LEU HG 4.790 . 4.790 4.330 3.791 4.500 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1033 1 51 LEU H 1 52 TYR H 4.660 . 4.660 4.470 4.391 4.559 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1034 1 51 LEU H 1 52 TYR QD 4.900 . 4.900 4.204 3.935 4.434 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1035 1 51 LEU H 1 52 TYR QE 5.110 . 5.110 5.025 4.647 5.180 0.070 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1036 1 51 LEU H 1 57 ILE MG 5.090 . 5.090 3.346 2.997 3.903 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1037 1 51 LEU H 1 58 LEU H 4.760 . 4.760 3.904 3.747 4.066 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1038 1 51 LEU H 1 58 LEU HB2 4.920 . 4.920 4.094 3.841 4.241 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1039 1 51 LEU H 1 58 LEU QD 5.090 . 5.090 5.031 4.706 5.209 0.119 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
1040 1 51 LEU H 1 79 ILE MD 5.270 . 5.270 5.234 4.916 5.358 0.088 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1041 1 51 LEU HA 1 51 LEU MD1 4.410 . 4.410 2.801 2.169 3.844 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1042 1 51 LEU HA 1 51 LEU QD 3.280 . 3.280 2.195 2.153 2.338 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1043 1 51 LEU HA 1 51 LEU MD2 4.410 . 4.410 3.274 2.165 3.920 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1044 1 51 LEU HA 1 52 TYR H 2.870 . 2.870 2.202 2.116 2.269 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1045 1 51 LEU HA 1 79 ILE HA 4.270 . 4.270 2.939 2.807 3.060 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1046 1 51 LEU HA 1 80 ARG H 3.890 . 3.890 3.556 3.391 3.772 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1047 1 51 LEU QB 1 52 TYR H 3.890 . 3.890 3.616 3.101 3.792 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1048 1 51 LEU QB 1 58 LEU H 4.350 . 4.350 3.502 3.111 3.886 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1049 1 51 LEU QB 1 58 LEU HB2 4.700 . 4.700 2.341 2.022 2.637 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1050 1 51 LEU QB 1 58 LEU QD 4.720 . 4.720 2.949 2.117 3.423 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1051 1 51 LEU HB2 1 52 TYR H 4.520 . 4.520 4.337 4.251 4.472 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1052 1 51 LEU HB3 1 52 TYR H 4.520 . 4.520 3.917 3.181 4.216 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1053 1 51 LEU QD 1 52 TYR H 3.230 . 3.230 2.440 2.128 2.630 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1054 1 51 LEU QD 1 58 LEU H 5.300 . 5.300 4.399 4.052 4.696 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1055 1 51 LEU QD 1 58 LEU HB2 4.740 . 4.740 2.870 2.557 3.416 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1056 1 51 LEU QD 1 58 LEU QD 3.820 . 3.820 2.158 1.926 2.298 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1057 1 51 LEU QD 1 77 LEU HB2 4.670 . 4.670 3.405 3.101 3.759 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1058 1 51 LEU QD 1 77 LEU HB3 4.330 . 4.330 2.254 2.120 2.485 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1059 1 51 LEU QD 1 77 LEU QD 3.740 . 3.740 2.196 1.960 2.379 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1060 1 51 LEU QD 1 77 LEU HG 3.760 . 3.760 2.918 2.384 3.823 0.063 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1061 1 51 LEU QD 1 78 LEU H 3.890 . 3.890 3.368 3.079 3.598 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1062 1 51 LEU QD 1 78 LEU HA 5.040 . 5.040 4.479 4.299 4.736 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1063 1 51 LEU QD 1 79 ILE MD 3.470 . 3.470 2.199 2.045 2.477 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1064 1 51 LEU MD1 1 52 TYR H 4.530 . 4.530 3.279 2.374 4.594 0.064 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
1065 1 51 LEU MD1 1 77 LEU HG 5.220 . 5.220 3.437 2.480 5.225 0.005 39 0 "[ . 1 . 2 . 3 . 4 ]" 1
1066 1 51 LEU MD2 1 52 TYR H 4.530 . 4.530 3.715 2.132 4.572 0.042 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
1067 1 51 LEU MD2 1 77 LEU HG 5.220 . 5.220 3.325 2.751 4.637 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1068 1 51 LEU HG 1 52 TYR H 4.340 . 4.340 3.514 3.017 4.348 0.008 37 0 "[ . 1 . 2 . 3 . 4 ]" 1
1069 1 52 TYR H 1 52 TYR HB2 3.870 . 3.870 2.406 2.313 2.511 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1070 1 52 TYR H 1 52 TYR QB 3.190 . 3.190 2.373 2.283 2.470 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1071 1 52 TYR H 1 52 TYR HB3 3.870 . 3.870 3.610 3.515 3.686 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1072 1 52 TYR H 1 52 TYR QD 3.260 . 3.260 3.007 2.801 3.194 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1073 1 52 TYR H 1 52 TYR QE 5.500 . 5.500 5.311 5.111 5.501 0.001 36 0 "[ . 1 . 2 . 3 . 4 ]" 1
1074 1 52 TYR H 1 53 TYR H 4.600 . 4.600 4.468 4.405 4.521 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1075 1 52 TYR H 1 57 ILE HA 5.500 . 5.500 5.119 5.020 5.292 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1076 1 52 TYR H 1 58 LEU QD 4.400 . 4.400 4.354 3.959 4.566 0.166 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
1077 1 52 TYR H 1 77 LEU HB3 5.300 . 5.300 4.344 3.875 4.726 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1078 1 52 TYR H 1 77 LEU QD 4.960 . 4.960 3.933 3.550 4.646 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1079 1 52 TYR H 1 78 LEU H 3.580 . 3.580 3.090 2.901 3.244 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1080 1 52 TYR H 1 78 LEU HB2 4.930 . 4.930 3.546 3.430 3.736 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1081 1 52 TYR H 1 78 LEU HB3 5.500 . 5.500 4.622 4.371 4.818 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1082 1 52 TYR H 1 79 ILE MD 5.350 . 5.350 4.121 3.687 4.363 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1083 1 52 TYR H 1 80 ARG H 5.010 . 5.010 4.320 4.084 4.504 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1084 1 52 TYR HA 1 52 TYR QD 4.490 . 4.490 3.091 2.992 3.163 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1085 1 52 TYR HA 1 53 TYR H 2.710 . 2.710 2.148 2.118 2.206 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1086 1 52 TYR HA 1 56 ASP H 4.380 . 4.380 4.367 4.227 4.409 0.029 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
1087 1 52 TYR HA 1 57 ILE H 5.180 . 5.180 4.904 4.812 4.982 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1088 1 52 TYR HA 1 57 ILE HA 3.600 . 3.600 2.610 2.485 2.757 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1089 1 52 TYR HA 1 58 LEU H 3.920 . 3.920 2.881 2.679 3.091 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1090 1 52 TYR HA 1 58 LEU HB2 5.500 . 5.500 4.364 4.010 4.648 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1091 1 52 TYR HA 1 58 LEU HG 5.500 . 5.500 3.588 3.288 4.004 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1092 1 52 TYR QB 1 53 TYR H 3.820 . 3.820 2.992 2.881 3.100 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1093 1 52 TYR QB 1 78 LEU H 3.880 . 3.880 3.212 2.860 3.429 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1094 1 52 TYR QB 1 78 LEU HB2 3.900 . 3.900 2.064 1.932 2.221 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1095 1 52 TYR QB 1 78 LEU HB3 4.690 . 4.690 3.268 2.960 3.608 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1096 1 52 TYR HB2 1 78 LEU HB2 4.500 . 4.500 2.108 1.964 2.292 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1097 1 52 TYR HB3 1 78 LEU HB2 4.500 . 4.500 2.979 2.563 3.375 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1098 1 52 TYR QD 1 53 TYR H 4.630 . 4.630 3.898 3.703 4.135 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1099 1 52 TYR QD 1 55 MET H 5.170 . 5.170 4.249 3.889 4.612 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1100 1 52 TYR QD 1 55 MET HA 4.480 . 4.480 2.806 2.308 3.472 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1101 1 52 TYR QD 1 56 ASP H 4.110 . 4.110 3.627 3.260 3.937 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1102 1 52 TYR QD 1 57 ILE H 5.200 . 5.200 4.693 4.247 5.100 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1103 1 52 TYR QD 1 80 ARG H 3.990 . 3.990 3.252 2.899 3.454 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1104 1 52 TYR QE 1 57 ILE H 5.380 . 5.380 4.560 4.071 4.963 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1105 1 52 TYR QE 1 80 ARG H 4.620 . 4.620 4.250 3.702 4.623 0.003 13 0 "[ . 1 . 2 . 3 . 4 ]" 1
1106 1 52 TYR QE 1 80 ARG HB2 4.710 . 4.710 3.043 2.376 4.037 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1107 1 52 TYR QE 1 80 ARG QB 4.030 . 4.030 2.285 2.012 2.556 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1108 1 52 TYR QE 1 80 ARG HB3 4.710 . 4.710 2.419 2.054 3.312 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1109 1 52 TYR QE 1 80 ARG HD2 5.180 . 5.180 3.769 2.383 5.258 0.078 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
1110 1 52 TYR QE 1 80 ARG QD 4.490 . 4.490 3.238 2.318 4.554 0.064 8 0 "[ . 1 . 2 . 3 . 4 ]" 1
1111 1 52 TYR QE 1 80 ARG HD3 5.180 . 5.180 3.760 2.620 5.186 0.006 11 0 "[ . 1 . 2 . 3 . 4 ]" 1
1112 1 53 TYR H 1 53 TYR QB 3.160 . 3.160 2.639 2.528 2.720 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1113 1 53 TYR H 1 53 TYR QD 4.420 . 4.420 4.357 4.177 4.435 0.015 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
1114 1 53 TYR H 1 54 ASN H 4.460 . 4.460 4.251 4.206 4.311 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1115 1 53 TYR H 1 56 ASP H 3.550 . 3.550 2.893 2.765 2.994 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1116 1 53 TYR H 1 56 ASP HB3 4.560 . 4.560 4.142 3.825 4.375 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1117 1 53 TYR H 1 57 ILE HA 4.140 . 4.140 3.816 3.673 4.007 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1118 1 53 TYR H 1 58 LEU MD1 4.850 . 4.850 4.105 3.957 4.288 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1119 1 53 TYR H 1 58 LEU QD 3.750 . 3.750 3.689 3.568 3.811 0.061 10 0 "[ . 1 . 2 . 3 . 4 ]" 1
1120 1 53 TYR H 1 58 LEU MD2 4.850 . 4.850 4.192 3.942 4.634 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1121 1 53 TYR H 1 58 LEU HG 3.830 . 3.830 3.150 2.974 3.368 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1122 1 53 TYR HA 1 53 TYR QD 3.490 . 3.490 2.461 2.255 2.978 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1123 1 53 TYR HA 1 53 TYR QE 4.820 . 4.820 4.565 4.393 4.738 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1124 1 53 TYR HA 1 54 ASN H 2.990 . 2.990 2.209 2.121 2.259 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1125 1 53 TYR HA 1 77 LEU QD 3.960 . 3.960 2.974 2.632 3.772 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1126 1 53 TYR HA 1 78 LEU H 4.590 . 4.590 3.891 3.590 4.135 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1127 1 53 TYR QB 1 54 ASN H 4.050 . 4.050 3.680 3.611 3.743 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1128 1 53 TYR QB 1 56 ASP H 4.800 . 4.800 4.396 4.104 4.553 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1129 1 53 TYR QB 1 58 LEU MD1 4.180 . 4.180 2.143 2.035 2.253 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1130 1 53 TYR QB 1 58 LEU QD 3.490 . 3.490 2.006 1.911 2.143 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1131 1 53 TYR QB 1 58 LEU MD2 4.180 . 4.180 2.440 2.192 2.834 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1132 1 53 TYR QB 1 71 LEU QD 5.030 . 5.030 3.243 2.714 4.625 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1133 1 53 TYR QB 1 77 LEU QD 3.470 . 3.470 2.184 2.010 3.561 0.091 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1134 1 53 TYR QD 1 54 ASN H 3.420 . 3.420 2.807 2.505 3.097 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1135 1 53 TYR QD 1 71 LEU QD 4.250 . 4.250 3.030 2.680 3.611 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1136 1 53 TYR QE 1 54 ASN H 4.470 . 4.470 3.949 3.772 4.223 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1137 1 53 TYR QE 1 71 LEU QD 4.090 . 4.090 2.866 2.360 3.722 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1138 1 53 TYR QE 1 75 ASP QB 4.520 . 4.520 2.854 2.145 4.028 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1139 1 53 TYR QE 1 76 LEU H 4.290 . 4.290 3.952 3.277 4.357 0.067 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
1140 1 54 ASN H 1 54 ASN HA 2.780 . 2.780 2.297 2.276 2.321 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1141 1 54 ASN H 1 54 ASN HB2 3.920 . 3.920 2.982 2.890 3.044 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1142 1 54 ASN H 1 54 ASN HB3 3.920 . 3.920 3.731 3.632 3.835 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1143 1 54 ASN H 1 55 MET H 4.090 . 4.090 2.756 2.612 3.056 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1144 1 54 ASN H 1 56 ASP H 4.890 . 4.890 4.355 4.263 4.407 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1145 1 54 ASN H 1 58 LEU QD 5.440 . 5.440 5.243 5.100 5.474 0.034 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1146 1 54 ASN H 1 77 LEU HA 5.500 . 5.500 4.956 3.708 5.314 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1147 1 54 ASN H 1 77 LEU MD1 5.500 . 5.500 4.586 4.262 5.379 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1148 1 54 ASN H 1 77 LEU QD 4.490 . 4.490 4.352 4.041 4.842 0.352 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1149 1 54 ASN H 1 77 LEU MD2 5.500 . 5.500 5.453 4.987 5.587 0.087 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
1150 1 54 ASN HA 1 54 ASN HD21 4.530 . 4.530 2.929 1.791 4.048 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1151 1 54 ASN HA 1 54 ASN HD22 4.730 . 4.730 3.816 3.378 4.388 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1152 1 54 ASN HA 1 55 MET H 3.540 . 3.540 2.832 2.599 2.897 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1153 1 54 ASN HA 1 56 ASP H 4.640 . 4.640 4.435 4.383 4.504 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1154 1 54 ASN QB 1 54 ASN HD21 2.970 . 2.970 2.352 2.096 2.753 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1155 1 54 ASN QB 1 54 ASN HD22 3.460 . 3.460 3.343 3.257 3.472 0.012 7 0 "[ . 1 . 2 . 3 . 4 ]" 1
1156 1 54 ASN QB 1 56 ASP H 4.680 . 4.680 3.489 3.318 3.940 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1157 1 54 ASN HD21 1 55 MET H 5.300 . 5.300 5.128 4.451 5.343 0.043 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
1158 1 55 MET H 1 55 MET HB2 4.120 . 4.120 3.689 3.604 3.737 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1159 1 55 MET H 1 55 MET QB 3.510 . 3.510 3.421 3.367 3.444 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1160 1 55 MET H 1 55 MET HB3 4.120 . 4.120 4.049 3.992 4.068 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1161 1 55 MET H 1 55 MET HG2 3.710 . 3.710 3.188 3.055 3.270 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1162 1 55 MET H 1 55 MET QG 3.210 . 3.210 2.739 2.670 2.776 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1163 1 55 MET H 1 55 MET HG3 3.710 . 3.710 2.986 2.838 3.083 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1164 1 55 MET H 1 56 ASP H 3.220 . 3.220 2.805 2.723 2.890 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1165 1 55 MET HA 1 55 MET ME 4.300 . 4.300 3.753 3.625 3.851 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1166 1 55 MET HA 1 55 MET HG2 3.970 . 3.970 2.483 2.452 2.615 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1167 1 55 MET HA 1 55 MET QG 3.460 . 3.460 2.407 2.378 2.534 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1168 1 55 MET HA 1 55 MET HG3 3.970 . 3.970 3.233 3.133 3.399 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1169 1 55 MET HA 1 56 ASP H 3.470 . 3.470 3.117 3.020 3.218 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1170 1 55 MET QG 1 56 ASP H 4.450 . 4.450 4.440 4.376 4.466 0.016 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
1171 1 55 MET HG2 1 56 ASP H 5.120 . 5.120 5.132 5.083 5.172 0.052 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1172 1 55 MET HG3 1 56 ASP H 5.120 . 5.120 4.861 4.727 4.923 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1173 1 56 ASP H 1 56 ASP HB2 3.100 . 3.100 2.933 2.709 3.059 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1174 1 56 ASP H 1 56 ASP HB3 3.450 . 3.450 2.762 2.583 2.992 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1175 1 56 ASP H 1 57 ILE H 4.470 . 4.470 4.476 4.444 4.502 0.032 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1176 1 56 ASP HA 1 57 ILE H 2.630 . 2.630 2.446 2.370 2.525 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1177 1 56 ASP HB2 1 57 ILE H 4.310 . 4.310 3.925 3.849 4.017 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1178 1 56 ASP HB3 1 57 ILE H 3.450 . 3.450 3.381 3.120 3.459 0.009 16 0 "[ . 1 . 2 . 3 . 4 ]" 1
1179 1 57 ILE H 1 57 ILE HB 2.760 . 2.760 2.510 2.464 2.576 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1180 1 57 ILE H 1 57 ILE MD 3.480 . 3.480 3.490 3.341 3.543 0.063 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
1181 1 57 ILE H 1 57 ILE HG12 3.930 . 3.930 3.699 3.488 3.850 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1182 1 57 ILE H 1 57 ILE QG 3.410 . 3.410 2.302 2.018 2.455 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1183 1 57 ILE H 1 57 ILE HG13 3.930 . 3.930 2.325 2.031 2.483 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1184 1 57 ILE H 1 57 ILE MG 3.820 . 3.820 3.833 3.818 3.853 0.033 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1185 1 57 ILE H 1 58 LEU H 4.720 . 4.720 4.556 4.493 4.672 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1186 1 57 ILE HA 1 57 ILE MD 3.980 . 3.980 3.949 3.925 4.021 0.041 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1187 1 57 ILE HA 1 57 ILE HG12 4.200 . 4.200 2.694 2.645 2.807 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1188 1 57 ILE HA 1 57 ILE QG 3.650 . 3.650 2.491 2.451 2.584 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1189 1 57 ILE HA 1 57 ILE HG13 4.200 . 4.200 2.935 2.869 3.020 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1190 1 57 ILE HA 1 57 ILE MG 3.630 . 3.630 2.409 2.352 2.442 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1191 1 57 ILE HA 1 58 LEU H 2.670 . 2.670 2.159 2.134 2.208 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1192 1 57 ILE HA 1 58 LEU QD 5.180 . 5.180 4.586 4.434 4.737 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1193 1 57 ILE HB 1 57 ILE MD 3.590 . 3.590 2.353 2.324 2.393 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1194 1 57 ILE HB 1 58 LEU H 4.470 . 4.470 4.236 4.126 4.295 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1195 1 57 ILE QG 1 58 LEU H 4.440 . 4.440 4.203 4.125 4.290 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1196 1 57 ILE HG12 1 58 LEU H 5.190 . 5.190 4.520 4.413 4.629 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1197 1 57 ILE HG13 1 58 LEU H 5.190 . 5.190 4.999 4.953 5.071 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1198 1 57 ILE MG 1 58 LEU H 3.180 . 3.180 2.732 2.591 2.856 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1199 1 57 ILE MG 1 58 LEU HA 4.430 . 4.430 3.860 3.681 3.998 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1200 1 57 ILE MG 1 59 ASP H 4.530 . 4.530 3.585 2.880 4.375 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1201 1 57 ILE MG 1 59 ASP HA 4.500 . 4.500 3.077 2.568 4.052 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1202 1 57 ILE MG 1 59 ASP QB 5.030 . 5.030 3.856 3.028 4.711 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1203 1 57 ILE MG 1 60 SER H 5.320 . 5.320 4.336 3.901 5.028 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1204 1 58 LEU H 1 58 LEU HB2 3.030 . 3.030 2.406 2.256 2.515 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1205 1 58 LEU H 1 58 LEU HB3 3.720 . 3.720 3.636 3.554 3.693 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1206 1 58 LEU H 1 58 LEU MD1 4.140 . 4.140 3.808 3.690 3.971 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1207 1 58 LEU H 1 58 LEU QD 3.530 . 3.530 3.379 3.318 3.485 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1208 1 58 LEU H 1 58 LEU MD2 4.140 . 4.140 3.782 3.660 4.017 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1209 1 58 LEU H 1 59 ASP H 4.690 . 4.690 4.284 3.944 4.513 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1210 1 58 LEU HA 1 58 LEU MD1 4.310 . 4.310 3.874 3.808 3.909 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1211 1 58 LEU HA 1 58 LEU QD 3.050 . 3.050 2.137 2.040 2.203 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1212 1 58 LEU HA 1 58 LEU MD2 4.310 . 4.310 2.147 2.048 2.215 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1213 1 58 LEU HA 1 59 ASP H 3.070 . 3.070 2.153 2.079 2.235 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1214 1 58 LEU HB2 1 59 ASP H 4.780 . 4.780 4.418 4.296 4.509 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1215 1 58 LEU HB3 1 59 ASP H 4.280 . 4.280 3.700 3.285 4.037 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1216 1 58 LEU QD 1 59 ASP H 4.540 . 4.540 3.691 3.115 3.918 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1217 1 58 LEU QD 1 71 LEU QD 5.340 . 5.340 2.770 2.310 3.820 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1218 1 58 LEU MD1 1 59 ASP H 5.500 . 5.500 5.321 4.906 5.510 0.010 17 0 "[ . 1 . 2 . 3 . 4 ]" 1
1219 1 58 LEU MD2 1 59 ASP H 5.500 . 5.500 3.765 3.150 4.010 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1220 1 58 LEU HG 1 59 ASP H 5.360 . 5.360 5.161 4.785 5.274 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1221 1 59 ASP H 1 59 ASP QB 3.290 . 3.290 2.225 2.159 2.478 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1222 1 59 ASP H 1 62 ARG HD2 5.500 . 5.500 3.522 2.442 5.347 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1223 1 59 ASP H 1 62 ARG QD 4.750 . 4.750 3.337 2.279 4.193 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1224 1 59 ASP H 1 62 ARG HD3 5.500 . 5.500 4.527 2.727 5.522 0.022 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
1225 1 59 ASP H 1 62 ARG QG 4.820 . 4.820 3.858 3.090 4.825 0.005 12 0 "[ . 1 . 2 . 3 . 4 ]" 1
1226 1 59 ASP QB 1 60 SER H 4.830 . 4.830 3.773 3.214 3.933 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1227 1 59 ASP QB 1 62 ARG H 4.340 . 4.340 3.674 2.926 3.987 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1228 1 59 ASP QB 1 62 ARG HD2 4.500 . 4.500 3.067 2.009 4.010 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1229 1 59 ASP QB 1 62 ARG HD3 4.500 . 4.500 3.860 2.158 4.503 0.003 38 0 "[ . 1 . 2 . 3 . 4 ]" 1
1230 1 59 ASP QB 1 62 ARG QG 4.170 . 4.170 2.232 1.955 3.477 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1231 1 60 SER HA 1 62 ARG H 4.030 . 4.030 3.676 3.430 4.044 0.014 23 0 "[ . 1 . 2 . 3 . 4 ]" 1
1232 1 60 SER QB 1 61 ASN H 4.410 . 4.410 3.558 3.167 3.892 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1233 1 61 ASN H 1 61 ASN QB 3.290 . 3.290 2.361 2.242 2.509 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1234 1 61 ASN H 1 62 ARG H 3.730 . 3.730 2.407 2.278 2.574 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1235 1 61 ASN QB 1 61 ASN HD22 3.770 . 3.770 3.280 3.223 3.484 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1236 1 61 ASN QB 1 62 ARG H 3.860 . 3.860 3.363 2.912 3.491 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1237 1 62 ARG H 1 62 ARG HB2 3.730 . 3.730 2.489 2.269 3.661 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1238 1 62 ARG H 1 62 ARG QB 3.030 . 3.030 2.426 2.245 2.547 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1239 1 62 ARG H 1 62 ARG HB3 3.730 . 3.730 3.617 2.566 3.686 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1240 1 62 ARG H 1 62 ARG HD2 5.310 . 5.310 4.219 3.813 4.899 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1241 1 62 ARG H 1 62 ARG QD 4.540 . 4.540 3.892 3.321 4.349 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1242 1 62 ARG H 1 62 ARG HD3 5.310 . 5.310 4.732 3.424 5.057 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1243 1 62 ARG H 1 62 ARG HG2 3.970 . 3.970 3.588 2.306 3.972 0.002 12 0 "[ . 1 . 2 . 3 . 4 ]" 1
1244 1 62 ARG H 1 62 ARG QG 3.270 . 3.270 2.426 2.204 2.680 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1245 1 62 ARG H 1 62 ARG HG3 3.970 . 3.970 2.511 2.235 3.755 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1246 1 62 ARG HA 1 62 ARG HD2 4.850 . 4.850 4.655 4.343 4.870 0.020 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
1247 1 62 ARG HA 1 62 ARG QD 4.160 . 4.160 4.032 3.823 4.197 0.037 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
1248 1 62 ARG HA 1 62 ARG HD3 4.850 . 4.850 4.424 4.183 4.847 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1249 1 62 ARG HA 1 62 ARG QG 3.530 . 3.530 2.469 2.328 3.409 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1250 1 62 ARG QB 1 62 ARG QD 3.310 . 3.310 2.125 2.031 2.360 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1251 1 62 ARG QB 1 64 GLN H 3.890 . 3.890 2.568 2.275 3.131 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1252 1 62 ARG HD2 1 69 LEU MD2 5.500 . 5.500 3.843 2.839 5.522 0.022 9 0 "[ . 1 . 2 . 3 . 4 ]" 1
1253 1 62 ARG HD3 1 69 LEU MD2 5.500 . 5.500 3.553 2.390 5.109 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1254 1 62 ARG QG 1 64 GLN H 5.230 . 5.230 4.542 2.778 4.915 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1255 1 63 THR H 1 63 THR MG 4.700 . 4.700 2.781 1.994 3.805 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1256 1 63 THR HA 1 63 THR MG 3.310 . 3.310 2.377 2.114 3.265 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1257 1 63 THR HA 1 64 GLN H 3.490 . 3.490 2.951 2.890 3.189 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1258 1 63 THR MG 1 64 GLN H 4.280 . 4.280 4.262 3.635 4.415 0.135 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1259 1 64 GLN H 1 64 GLN HB2 3.830 . 3.830 2.474 2.398 2.593 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1260 1 64 GLN H 1 64 GLN HB3 3.850 . 3.850 3.626 3.591 3.664 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1261 1 64 GLN H 1 64 GLN HG2 4.340 . 4.340 3.538 3.196 3.656 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1262 1 64 GLN H 1 64 GLN QG 3.660 . 3.660 2.378 2.138 2.483 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1263 1 64 GLN H 1 64 GLN HG3 4.340 . 4.340 2.418 2.172 2.529 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1264 1 64 GLN H 1 65 SER H 4.670 . 4.670 4.609 4.580 4.656 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1265 1 64 GLN H 1 69 LEU MD1 5.500 . 5.500 4.998 4.637 5.233 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1266 1 64 GLN H 1 69 LEU MD2 5.440 . 5.440 4.327 4.005 4.570 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1267 1 64 GLN HA 1 64 GLN HE21 4.870 . 4.870 4.106 3.791 4.218 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1268 1 64 GLN HA 1 64 GLN HG2 3.950 . 3.950 2.547 2.423 2.628 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1269 1 64 GLN HA 1 64 GLN QG 3.400 . 3.400 2.448 2.360 2.513 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1270 1 64 GLN HA 1 64 GLN HG3 3.950 . 3.950 3.178 3.100 3.289 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1271 1 64 GLN HA 1 65 SER H 2.730 . 2.730 2.433 2.287 2.486 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1272 1 64 GLN HB2 1 65 SER H 3.500 . 3.500 3.520 3.504 3.606 0.106 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1273 1 64 GLN HB2 1 68 GLU H 5.500 . 5.500 5.453 5.298 5.531 0.031 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1274 1 64 GLN HB2 1 69 LEU H 5.210 . 5.210 5.128 4.945 5.223 0.013 3 0 "[ . 1 . 2 . 3 . 4 ]" 1
1275 1 64 GLN HB2 1 69 LEU MD2 4.220 . 4.220 2.480 2.326 2.626 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1276 1 64 GLN HB3 1 64 GLN HE22 5.010 . 5.010 3.673 3.466 3.769 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1277 1 64 GLN HB3 1 65 SER H 3.610 . 3.610 2.350 2.283 2.472 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1278 1 64 GLN HB3 1 68 GLU H 4.770 . 4.770 4.303 4.201 4.442 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1279 1 64 GLN HB3 1 68 GLU QG 4.660 . 4.660 3.626 2.596 3.980 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1280 1 64 GLN HB3 1 69 LEU MD2 4.320 . 4.320 3.203 3.079 3.378 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1281 1 64 GLN HE21 1 68 GLU QB 4.690 . 4.690 2.293 1.957 2.452 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1282 1 64 GLN HE21 1 69 LEU MD2 4.610 . 4.610 3.685 2.491 4.057 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1283 1 64 GLN HE22 1 68 GLU QB 4.960 . 4.960 2.941 2.630 3.326 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1284 1 64 GLN HE22 1 69 LEU MD2 4.640 . 4.640 3.165 2.676 3.555 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1285 1 64 GLN HE22 1 69 LEU HG 5.500 . 5.500 5.234 4.810 5.503 0.003 15 0 "[ . 1 . 2 . 3 . 4 ]" 1
1286 1 64 GLN QG 1 65 SER H 4.250 . 4.250 3.878 3.789 3.958 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1287 1 64 GLN QG 1 69 LEU MD2 4.380 . 4.380 3.671 3.461 3.967 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1288 1 64 GLN HG2 1 69 LEU MD2 5.050 . 5.050 4.423 4.219 4.762 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1289 1 64 GLN HG3 1 69 LEU MD2 5.050 . 5.050 3.922 3.655 4.245 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1290 1 65 SER H 1 65 SER HB2 3.940 . 3.940 2.757 2.454 3.735 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1291 1 65 SER H 1 65 SER QB 3.280 . 3.280 2.572 2.420 2.965 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1292 1 65 SER H 1 65 SER HB3 3.940 . 3.940 3.552 2.884 3.724 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1293 1 65 SER H 1 66 LEU H 4.580 . 4.580 4.581 4.532 4.622 0.042 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
1294 1 65 SER H 1 67 LYS H 4.970 . 4.970 4.959 4.793 5.049 0.079 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1295 1 65 SER H 1 68 GLU H 4.030 . 4.030 3.620 3.499 3.742 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1296 1 65 SER H 1 68 GLU HA 5.500 . 5.500 5.418 5.239 5.516 0.016 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1297 1 65 SER H 1 68 GLU QB 3.760 . 3.760 2.894 2.656 3.061 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1298 1 65 SER H 1 68 GLU QG 3.260 . 3.260 2.755 2.083 3.181 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1299 1 65 SER H 1 69 LEU H 4.960 . 4.960 4.968 4.902 5.005 0.045 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
1300 1 65 SER H 1 69 LEU MD1 5.500 . 5.500 5.331 5.150 5.506 0.006 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
1301 1 65 SER H 1 69 LEU MD2 4.750 . 4.750 4.787 4.759 4.860 0.110 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
1302 1 65 SER H 1 69 LEU HG 5.010 . 5.010 4.666 4.540 4.791 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1303 1 65 SER HA 1 66 LEU H 3.110 . 3.110 2.379 2.340 2.421 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1304 1 65 SER HA 1 67 LYS H 4.360 . 4.360 4.211 4.063 4.369 0.009 40 0 "[ . 1 . 2 . 3 . 4 ]" 1
1305 1 65 SER QB 1 66 LEU H 3.230 . 3.230 2.571 2.357 2.885 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1306 1 65 SER QB 1 67 LYS H 3.820 . 3.820 2.669 2.440 2.867 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1307 1 65 SER QB 1 68 GLU H 4.400 . 4.400 2.957 2.445 3.905 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1308 1 65 SER HB2 1 66 LEU H 3.730 . 3.730 3.449 2.382 3.738 0.008 7 0 "[ . 1 . 2 . 3 . 4 ]" 1
1309 1 65 SER HB2 1 67 LYS H 4.470 . 4.470 3.080 2.462 3.402 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1310 1 65 SER HB3 1 66 LEU H 3.730 . 3.730 2.858 2.513 3.753 0.023 9 0 "[ . 1 . 2 . 3 . 4 ]" 1
1311 1 65 SER HB3 1 67 LYS H 4.470 . 4.470 3.171 2.615 4.482 0.012 24 0 "[ . 1 . 2 . 3 . 4 ]" 1
1312 1 66 LEU H 1 66 LEU HB2 3.350 . 3.350 2.592 2.511 2.672 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1313 1 66 LEU H 1 66 LEU HB3 3.650 . 3.650 3.607 3.580 3.634 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1314 1 66 LEU H 1 66 LEU MD1 3.680 . 3.680 3.687 3.582 3.778 0.098 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1315 1 66 LEU H 1 66 LEU MD2 3.170 . 3.170 2.927 2.658 3.154 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1316 1 66 LEU H 1 66 LEU HG 2.860 . 2.860 2.147 2.069 2.235 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1317 1 66 LEU H 1 67 LYS H 3.520 . 3.520 2.689 2.544 2.862 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1318 1 66 LEU H 1 67 LYS QB 5.340 . 5.340 4.306 3.986 4.747 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1319 1 66 LEU H 1 68 GLU H 4.550 . 4.550 4.309 4.178 4.408 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1320 1 66 LEU H 1 69 LEU H 5.280 . 5.280 5.083 4.986 5.148 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1321 1 66 LEU H 1 69 LEU MD1 4.850 . 4.850 4.485 4.383 4.724 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1322 1 66 LEU H 1 69 LEU HG 5.500 . 5.500 4.814 4.706 4.989 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1323 1 66 LEU HA 1 66 LEU MD1 4.240 . 4.240 3.825 3.751 3.887 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1324 1 66 LEU HA 1 66 LEU MD2 3.340 . 3.340 2.167 2.108 2.228 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1325 1 66 LEU HA 1 68 GLU H 4.610 . 4.610 4.066 3.911 4.182 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1326 1 66 LEU HA 1 69 LEU H 3.750 . 3.750 3.294 3.208 3.470 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1327 1 66 LEU HA 1 69 LEU HB3 4.910 . 4.910 4.466 4.358 4.643 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1328 1 66 LEU HA 1 69 LEU MD1 3.830 . 3.830 2.285 2.182 2.572 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1329 1 66 LEU HA 1 71 LEU H 4.530 . 4.530 4.384 4.185 4.563 0.033 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1330 1 66 LEU HA 1 71 LEU QD 4.020 . 4.020 2.603 2.323 3.069 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1331 1 66 LEU HB2 1 67 LYS H 3.270 . 3.270 2.808 2.714 2.900 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1332 1 66 LEU HB3 1 67 LYS H 4.450 . 4.450 3.881 3.783 3.978 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1333 1 66 LEU HB3 1 69 LEU H 5.500 . 5.500 4.984 4.912 5.106 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1334 1 66 LEU HB3 1 71 LEU QD 3.580 . 3.580 2.166 1.922 2.342 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1335 1 66 LEU MD1 1 67 LYS H 4.800 . 4.800 4.729 4.593 4.805 0.005 9 0 "[ . 1 . 2 . 3 . 4 ]" 1
1336 1 66 LEU MD1 1 71 LEU MD1 4.630 . 4.630 2.557 2.097 2.885 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1337 1 66 LEU MD1 1 71 LEU QD 3.420 . 3.420 2.535 2.083 2.859 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1338 1 66 LEU MD1 1 71 LEU MD2 4.630 . 4.630 4.196 3.195 4.648 0.018 5 0 "[ . 1 . 2 . 3 . 4 ]" 1
1339 1 66 LEU MD2 1 67 LYS H 4.650 . 4.650 4.614 4.555 4.668 0.018 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1340 1 66 LEU MD2 1 69 LEU H 5.090 . 5.090 4.902 4.805 5.058 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1341 1 66 LEU MD2 1 69 LEU MD1 3.380 . 3.380 2.380 2.219 2.680 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1342 1 66 LEU MD2 1 69 LEU HG 5.250 . 5.250 3.827 3.683 4.066 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1343 1 66 LEU MD2 1 71 LEU QD 4.470 . 4.470 2.109 2.002 2.241 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1344 1 66 LEU HG 1 67 LYS H 4.260 . 4.260 4.270 4.229 4.313 0.053 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1345 1 67 LYS H 1 67 LYS HB2 3.310 . 3.310 2.404 1.959 3.396 0.086 8 0 "[ . 1 . 2 . 3 . 4 ]" 1
1346 1 67 LYS H 1 67 LYS QB 2.800 . 2.800 2.109 1.928 2.289 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1347 1 67 LYS H 1 67 LYS HB3 3.310 . 3.310 2.512 2.050 2.865 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1348 1 67 LYS H 1 67 LYS HD2 5.500 . 5.500 4.373 2.907 5.214 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1349 1 67 LYS H 1 67 LYS HD3 5.500 . 5.500 4.598 2.624 5.534 0.034 18 0 "[ . 1 . 2 . 3 . 4 ]" 1
1350 1 67 LYS H 1 67 LYS QE 5.500 . 5.500 5.302 4.058 5.692 0.192 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1351 1 67 LYS H 1 67 LYS HG2 4.870 . 4.870 4.236 2.024 4.597 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1352 1 67 LYS H 1 67 LYS QG 4.290 . 4.290 3.725 2.009 4.029 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1353 1 67 LYS H 1 67 LYS HG3 4.870 . 4.870 4.224 3.376 4.508 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1354 1 67 LYS H 1 68 GLU H 3.200 . 3.200 2.775 2.655 2.839 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1355 1 67 LYS H 1 68 GLU HA 5.500 . 5.500 5.395 5.272 5.446 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1356 1 67 LYS H 1 68 GLU QB 5.100 . 5.100 4.859 4.764 4.958 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1357 1 67 LYS H 1 68 GLU QG 4.250 . 4.250 4.235 4.073 4.291 0.041 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
1358 1 67 LYS H 1 69 LEU H 4.270 . 4.270 4.090 3.983 4.183 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1359 1 67 LYS H 1 69 LEU MD1 5.500 . 5.500 5.308 5.194 5.520 0.020 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1360 1 67 LYS HA 1 67 LYS QD 4.860 . 4.860 3.537 2.012 4.262 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1361 1 67 LYS HA 1 67 LYS QG 3.740 . 3.740 2.600 2.178 3.397 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1362 1 67 LYS HA 1 69 LEU H 4.650 . 4.650 4.100 3.820 4.241 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1363 1 67 LYS HA 1 70 GLY H 3.710 . 3.710 3.476 3.129 3.690 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1364 1 67 LYS HA 1 71 LEU H 4.190 . 4.190 3.806 3.064 4.218 0.028 26 0 "[ . 1 . 2 . 3 . 4 ]" 1
1365 1 67 LYS QB 1 67 LYS QD 3.310 . 3.310 2.086 1.941 2.260 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1366 1 67 LYS QB 1 67 LYS QE 4.410 . 4.410 3.320 2.185 3.630 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1367 1 67 LYS QB 1 68 GLU H 3.990 . 3.990 2.701 2.377 3.632 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1368 1 67 LYS QD 1 68 GLU H 5.340 . 5.340 4.594 2.293 5.067 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1369 1 67 LYS QG 1 68 GLU H 4.030 . 4.030 3.680 2.423 4.040 0.010 38 0 "[ . 1 . 2 . 3 . 4 ]" 1
1370 1 67 LYS QG 1 70 GLY H 5.340 . 5.340 4.706 4.473 5.071 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1371 1 67 LYS HG2 1 68 GLU H 4.780 . 4.780 4.037 2.582 4.823 0.043 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1372 1 67 LYS HG3 1 68 GLU H 4.780 . 4.780 4.439 2.933 4.825 0.045 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
1373 1 68 GLU H 1 68 GLU QB 3.390 . 3.390 2.433 2.374 2.493 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1374 1 68 GLU H 1 68 GLU QG 2.900 . 2.900 2.203 2.054 2.335 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1375 1 68 GLU H 1 69 LEU HB2 5.260 . 5.260 4.791 4.602 4.889 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1376 1 68 GLU H 1 69 LEU MD1 5.330 . 5.330 5.018 4.835 5.153 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1377 1 68 GLU H 1 69 LEU MD2 4.710 . 4.710 4.687 4.569 4.807 0.097 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1378 1 68 GLU H 1 70 GLY H 4.460 . 4.460 3.817 3.626 3.935 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1379 1 68 GLU HA 1 68 GLU HG2 3.960 . 3.960 2.629 2.515 3.264 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1380 1 68 GLU HA 1 68 GLU QG 3.380 . 3.380 2.504 2.385 3.083 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1381 1 68 GLU HA 1 68 GLU HG3 3.960 . 3.960 3.160 2.885 3.846 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1382 1 68 GLU HA 1 70 GLY H 3.930 . 3.930 3.700 3.497 3.935 0.005 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1383 1 68 GLU QB 1 69 LEU H 3.930 . 3.930 2.820 2.671 3.027 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1384 1 68 GLU QB 1 69 LEU MD1 5.300 . 5.300 4.594 4.425 4.801 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1385 1 68 GLU QB 1 69 LEU MD2 4.340 . 4.340 3.158 3.003 3.413 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1386 1 68 GLU QB 1 70 GLY H 4.970 . 4.970 4.405 4.300 4.539 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1387 1 68 GLU QG 1 69 LEU H 4.060 . 4.060 4.067 3.991 4.143 0.083 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1388 1 68 GLU QG 1 70 GLY H 5.340 . 5.340 5.211 5.035 5.353 0.013 12 0 "[ . 1 . 2 . 3 . 4 ]" 1
1389 1 69 LEU H 1 69 LEU HB2 3.260 . 3.260 2.553 2.494 2.598 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1390 1 69 LEU H 1 69 LEU HB3 3.750 . 3.750 3.634 3.608 3.663 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1391 1 69 LEU H 1 69 LEU MD1 3.720 . 3.720 3.631 3.558 3.749 0.029 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
1392 1 69 LEU H 1 69 LEU MD2 3.520 . 3.520 3.247 3.127 3.415 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1393 1 69 LEU H 1 69 LEU HG 3.000 . 3.000 2.233 2.107 2.435 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1394 1 69 LEU H 1 70 GLY H 3.030 . 3.030 2.344 2.192 2.486 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1395 1 69 LEU H 1 70 GLY QA 4.750 . 4.750 4.303 4.156 4.440 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1396 1 69 LEU H 1 71 LEU H 4.060 . 4.060 3.699 3.510 3.951 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1397 1 69 LEU H 1 71 LEU QB 5.500 . 5.500 4.980 4.608 5.618 0.118 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
1398 1 69 LEU H 1 71 LEU QD 4.280 . 4.280 4.241 3.940 4.422 0.142 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1399 1 69 LEU H 1 71 LEU HG 5.030 . 5.030 4.618 4.258 4.878 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1400 1 69 LEU HA 1 69 LEU MD2 3.330 . 3.330 2.270 2.223 2.327 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1401 1 69 LEU HA 1 69 LEU HG 4.230 . 4.230 3.285 3.205 3.337 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1402 1 69 LEU HA 1 70 GLY H 3.510 . 3.510 3.392 3.351 3.458 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1403 1 69 LEU HB2 1 69 LEU MD1 3.610 . 3.610 2.295 2.245 2.347 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1404 1 69 LEU HB2 1 70 GLY H 3.960 . 3.960 3.232 3.050 3.317 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1405 1 69 LEU HB2 1 71 LEU MD1 5.200 . 5.200 3.147 2.444 4.638 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1406 1 69 LEU HB2 1 71 LEU QD 3.800 . 3.800 2.476 2.028 2.758 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1407 1 69 LEU HB2 1 71 LEU MD2 5.200 . 5.200 3.469 2.031 4.207 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1408 1 69 LEU HB3 1 69 LEU MD1 3.640 . 3.640 2.353 2.307 2.392 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1409 1 69 LEU HB3 1 69 LEU MD2 3.570 . 3.570 2.461 2.412 2.504 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1410 1 69 LEU HB3 1 70 GLY H 4.290 . 4.290 4.207 4.108 4.269 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1411 1 69 LEU HB3 1 71 LEU H 4.920 . 4.920 4.140 3.911 4.378 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1412 1 69 LEU HB3 1 71 LEU QD 3.880 . 3.880 3.100 2.493 3.488 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1413 1 69 LEU MD1 1 70 GLY H 4.900 . 4.900 4.915 4.768 4.982 0.082 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1414 1 69 LEU MD1 1 71 LEU MD1 4.630 . 4.630 2.694 2.088 4.359 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1415 1 69 LEU MD1 1 71 LEU QD 3.170 . 3.170 2.139 2.074 2.332 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1416 1 69 LEU MD1 1 71 LEU MD2 4.630 . 4.630 3.403 2.085 4.101 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1417 1 69 LEU MD2 1 70 GLY H 4.850 . 4.850 4.665 4.619 4.704 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1418 1 69 LEU HG 1 70 GLY H 4.360 . 4.360 4.330 4.211 4.444 0.084 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1419 1 69 LEU HG 1 71 LEU QD 4.480 . 4.480 3.806 3.665 4.002 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1420 1 70 GLY H 1 71 LEU H 2.910 . 2.910 2.432 2.319 2.601 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1421 1 70 GLY H 1 71 LEU QB 5.500 . 5.500 4.497 4.205 4.901 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1422 1 70 GLY H 1 71 LEU MD1 5.500 . 5.500 5.077 4.710 5.566 0.066 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1423 1 70 GLY H 1 71 LEU QD 4.610 . 4.610 4.490 3.976 4.628 0.018 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1424 1 70 GLY H 1 71 LEU MD2 5.500 . 5.500 5.204 4.075 5.566 0.066 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
1425 1 70 GLY H 1 71 LEU HG 4.350 . 4.350 4.302 4.171 4.403 0.053 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1426 1 71 LEU H 1 71 LEU QB 2.960 . 2.960 2.422 2.261 2.800 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1427 1 71 LEU H 1 71 LEU MD1 4.130 . 4.130 3.558 3.360 3.841 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1428 1 71 LEU H 1 71 LEU QD 3.360 . 3.360 3.132 2.683 3.278 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1429 1 71 LEU H 1 71 LEU MD2 4.130 . 4.130 3.564 2.741 3.844 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1430 1 71 LEU H 1 71 LEU HG 3.140 . 3.140 2.464 2.138 2.685 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1431 1 71 LEU H 1 72 LYS H 4.740 . 4.740 4.631 4.580 4.690 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1432 1 71 LEU HA 1 71 LEU MD1 4.230 . 4.230 3.818 3.668 3.887 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1433 1 71 LEU HA 1 71 LEU QD 3.500 . 3.500 2.481 2.038 3.434 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1434 1 71 LEU HA 1 71 LEU MD2 4.230 . 4.230 2.654 2.045 4.023 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1435 1 71 LEU HA 1 71 LEU HG 4.040 . 4.040 3.123 2.756 3.820 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1436 1 71 LEU HA 1 72 LYS H 2.720 . 2.720 2.249 2.126 2.465 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1437 1 71 LEU QB 1 72 LYS H 3.400 . 3.400 2.668 2.219 2.897 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1438 1 71 LEU QD 1 72 LYS H 3.560 . 3.560 3.136 2.827 3.443 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1439 1 71 LEU QD 1 75 ASP H 5.230 . 5.230 4.964 4.629 5.298 0.068 7 0 "[ . 1 . 2 . 3 . 4 ]" 1
1440 1 71 LEU QD 1 75 ASP QB 3.960 . 3.960 2.887 2.341 3.965 0.005 34 0 "[ . 1 . 2 . 3 . 4 ]" 1
1441 1 71 LEU QD 1 77 LEU QD 4.130 . 4.130 2.125 1.876 3.339 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1442 1 71 LEU QD 1 77 LEU HG 5.130 . 5.130 3.783 3.264 4.829 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1443 1 71 LEU HG 1 72 LYS H 5.060 . 5.060 4.681 4.358 4.908 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1444 1 72 LYS H 1 72 LYS HB3 3.440 . 3.440 3.303 3.015 3.456 0.016 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
1445 1 72 LYS H 1 72 LYS QD 5.150 . 5.150 4.244 3.497 4.522 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1446 1 72 LYS H 1 72 LYS QE 4.900 . 4.900 3.964 2.463 4.921 0.021 42 0 "[ . 1 . 2 . 3 . 4 ]" 1
1447 1 72 LYS H 1 72 LYS HG2 3.760 . 3.760 2.351 2.067 2.923 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1448 1 72 LYS H 1 72 LYS QG 3.290 . 3.290 2.256 2.023 2.495 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1449 1 72 LYS H 1 72 LYS HG3 3.760 . 3.760 3.229 2.273 3.780 0.020 5 0 "[ . 1 . 2 . 3 . 4 ]" 1
1450 1 72 LYS H 1 73 THR H 4.450 . 4.450 4.409 4.360 4.465 0.015 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1451 1 72 LYS H 1 75 ASP H 4.310 . 4.310 3.857 3.406 4.305 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1452 1 72 LYS H 1 75 ASP HB2 4.190 . 4.190 2.734 1.899 4.205 0.015 28 0 "[ . 1 . 2 . 3 . 4 ]" 1
1453 1 72 LYS H 1 75 ASP QB 3.650 . 3.650 2.564 1.882 3.232 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1454 1 72 LYS H 1 75 ASP HB3 4.190 . 4.190 3.655 2.110 4.212 0.022 21 0 "[ . 1 . 2 . 3 . 4 ]" 1
1455 1 72 LYS HA 1 73 THR H 2.750 . 2.750 2.535 2.374 2.700 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1456 1 72 LYS HB2 1 72 LYS QE 4.340 . 4.340 3.513 2.025 4.346 0.006 40 0 "[ . 1 . 2 . 3 . 4 ]" 1
1457 1 72 LYS HB2 1 73 THR H 3.050 . 3.050 2.286 1.990 2.528 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1458 1 72 LYS HB2 1 75 ASP H 5.080 . 5.080 4.964 4.612 5.116 0.036 26 0 "[ . 1 . 2 . 3 . 4 ]" 1
1459 1 72 LYS HB3 1 72 LYS QE 4.830 . 4.830 2.818 2.009 4.265 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1460 1 72 LYS QD 1 73 THR MG 4.880 . 4.880 4.286 2.688 4.907 0.027 39 0 "[ . 1 . 2 . 3 . 4 ]" 1
1461 1 72 LYS QD 1 74 ASP QB 4.300 . 4.300 2.408 1.997 2.859 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1462 1 72 LYS QD 1 75 ASP H 4.750 . 4.750 4.726 3.981 4.829 0.079 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
1463 1 72 LYS QG 1 73 THR H 3.960 . 3.960 3.363 3.002 3.728 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1464 1 72 LYS QG 1 74 ASP HA 5.260 . 5.260 4.209 3.948 4.843 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1465 1 72 LYS QG 1 74 ASP QB 4.970 . 4.970 2.409 2.021 3.048 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1466 1 72 LYS QG 1 75 ASP H 4.210 . 4.210 3.033 2.842 3.314 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1467 1 72 LYS HG2 1 73 THR H 4.780 . 4.780 4.389 3.702 4.785 0.005 28 0 "[ . 1 . 2 . 3 . 4 ]" 1
1468 1 72 LYS HG2 1 75 ASP H 4.920 . 4.920 3.943 3.037 4.927 0.007 14 0 "[ . 1 . 2 . 3 . 4 ]" 1
1469 1 72 LYS HG3 1 73 THR H 4.780 . 4.780 3.496 3.174 3.889 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1470 1 72 LYS HG3 1 75 ASP H 4.920 . 4.920 3.282 2.900 3.862 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1471 1 73 THR H 1 73 THR HB 3.150 . 3.150 2.397 2.292 2.489 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1472 1 73 THR H 1 73 THR MG 2.940 . 2.940 2.213 2.099 2.378 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1473 1 73 THR H 1 74 ASP H 4.240 . 4.240 2.807 2.533 3.032 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1474 1 73 THR H 1 75 ASP H 4.730 . 4.730 4.490 4.262 4.685 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1475 1 73 THR HA 1 75 ASP H 3.670 . 3.670 3.509 3.385 3.649 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1476 1 73 THR MG 1 74 ASP H 4.260 . 4.260 2.940 2.714 3.250 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1477 1 73 THR MG 1 74 ASP QB 4.360 . 4.360 3.236 2.614 4.009 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1478 1 73 THR MG 1 75 ASP H 4.410 . 4.410 4.493 4.427 4.650 0.240 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
1479 1 74 ASP H 1 74 ASP QB 3.610 . 3.610 2.445 2.290 2.632 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1480 1 74 ASP H 1 75 ASP H 3.330 . 3.330 2.295 1.985 2.729 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1481 1 74 ASP HA 1 75 ASP H 3.250 . 3.250 3.171 2.930 3.262 0.012 34 0 "[ . 1 . 2 . 3 . 4 ]" 1
1482 1 74 ASP QB 1 75 ASP H 3.840 . 3.840 3.539 3.379 3.798 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1483 1 74 ASP HB2 1 75 ASP H 4.490 . 4.490 4.090 3.532 4.496 0.006 28 0 "[ . 1 . 2 . 3 . 4 ]" 1
1484 1 74 ASP HB3 1 75 ASP H 4.490 . 4.490 4.010 3.563 4.509 0.019 9 0 "[ . 1 . 2 . 3 . 4 ]" 1
1485 1 75 ASP H 1 75 ASP QB 2.940 . 2.940 2.379 2.196 2.899 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1486 1 75 ASP H 1 76 LEU H 4.600 . 4.600 4.594 4.539 4.616 0.016 3 0 "[ . 1 . 2 . 3 . 4 ]" 1
1487 1 75 ASP HA 1 76 LEU H 3.150 . 3.150 2.266 2.092 2.599 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1488 1 75 ASP QB 1 76 LEU H 3.400 . 3.400 2.654 2.118 3.356 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1489 1 75 ASP HB2 1 76 LEU H 4.200 . 4.200 3.762 2.132 4.016 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1490 1 75 ASP HB3 1 76 LEU H 4.200 . 4.200 2.844 2.250 3.985 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1491 1 76 LEU H 1 76 LEU HB2 3.490 . 3.490 3.116 2.841 3.297 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1492 1 76 LEU H 1 76 LEU QB 2.980 . 2.980 2.539 2.349 2.736 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1493 1 76 LEU H 1 76 LEU HB3 3.490 . 3.490 2.696 2.465 3.160 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1494 1 76 LEU H 1 76 LEU MD1 5.500 . 5.500 4.616 4.379 4.798 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1495 1 76 LEU H 1 76 LEU MD2 5.500 . 5.500 4.222 4.030 4.640 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1496 1 76 LEU H 1 76 LEU HG 4.840 . 4.840 4.624 4.408 4.821 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1497 1 76 LEU H 1 77 LEU H 4.830 . 4.830 4.345 4.138 4.462 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1498 1 76 LEU H 1 77 LEU QD 5.440 . 5.440 3.572 3.253 3.976 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1499 1 76 LEU HA 1 76 LEU QD 3.880 . 3.880 2.888 2.215 3.149 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1500 1 76 LEU HA 1 77 LEU H 2.990 . 2.990 2.175 2.121 2.228 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1501 1 76 LEU QD 1 77 LEU H 3.240 . 3.240 2.894 2.168 3.243 0.003 35 0 "[ . 1 . 2 . 3 . 4 ]" 1
1502 1 76 LEU HG 1 77 LEU H 3.610 . 3.610 2.768 2.361 3.617 0.007 10 0 "[ . 1 . 2 . 3 . 4 ]" 1
1503 1 77 LEU H 1 77 LEU HB2 3.180 . 3.180 2.358 2.279 2.532 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1504 1 77 LEU H 1 77 LEU MD1 4.400 . 4.400 3.986 2.545 4.286 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1505 1 77 LEU H 1 77 LEU QD 3.560 . 3.560 2.666 2.446 2.819 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1506 1 77 LEU H 1 77 LEU MD2 4.400 . 4.400 2.855 2.471 4.403 0.003 39 0 "[ . 1 . 2 . 3 . 4 ]" 1
1507 1 77 LEU H 1 78 LEU H 4.740 . 4.740 4.545 4.486 4.646 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1508 1 77 LEU HA 1 77 LEU MD1 4.400 . 4.400 2.269 2.131 3.330 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1509 1 77 LEU HA 1 77 LEU QD 3.070 . 3.070 2.177 2.050 3.028 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1510 1 77 LEU HA 1 77 LEU MD2 4.400 . 4.400 2.824 2.536 3.740 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1511 1 77 LEU HA 1 78 LEU H 2.750 . 2.750 2.238 2.188 2.340 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1512 1 77 LEU HB3 1 78 LEU H 3.150 . 3.150 2.940 2.624 3.119 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1513 1 77 LEU QD 1 78 LEU H 4.070 . 4.070 3.223 2.984 4.010 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1514 1 77 LEU MD1 1 78 LEU H 5.500 . 5.500 3.358 3.030 4.914 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1515 1 77 LEU MD2 1 78 LEU H 5.500 . 5.500 4.534 4.021 4.815 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1516 1 77 LEU HG 1 78 LEU H 5.480 . 5.480 4.947 3.912 5.202 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1517 1 78 LEU H 1 78 LEU HB2 3.200 . 3.200 2.528 2.409 2.611 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1518 1 78 LEU H 1 78 LEU MD2 4.100 . 4.100 3.912 3.639 4.103 0.003 15 0 "[ . 1 . 2 . 3 . 4 ]" 1
1519 1 78 LEU H 1 78 LEU HG 3.630 . 3.630 2.963 2.674 3.185 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1520 1 78 LEU H 1 79 ILE H 4.650 . 4.650 4.521 4.452 4.565 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1521 1 78 LEU HA 1 78 LEU MD2 3.870 . 3.870 2.169 2.098 2.301 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1522 1 78 LEU HA 1 79 ILE H 2.770 . 2.770 2.185 2.122 2.300 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1523 1 78 LEU HB3 1 79 ILE H 3.670 . 3.670 2.958 2.735 3.135 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1524 1 78 LEU MD2 1 79 ILE H 5.090 . 5.090 3.481 3.231 3.803 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1525 1 79 ILE H 1 79 ILE HB 3.030 . 3.030 2.599 2.541 2.683 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1526 1 79 ILE H 1 79 ILE MD 4.340 . 4.340 3.771 3.634 4.281 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1527 1 79 ILE H 1 79 ILE HG12 4.450 . 4.450 2.592 2.435 2.949 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1528 1 79 ILE H 1 79 ILE QG 3.790 . 3.790 2.555 2.407 2.848 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1529 1 79 ILE H 1 79 ILE HG13 4.450 . 4.450 3.889 3.762 4.115 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1530 1 79 ILE H 1 79 ILE MG 4.020 . 4.020 3.881 3.846 3.919 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1531 1 79 ILE H 1 80 ARG H 4.610 . 4.610 4.385 4.272 4.486 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1532 1 79 ILE HA 1 79 ILE MD 4.330 . 4.330 2.241 2.148 2.649 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1533 1 79 ILE HA 1 79 ILE MG 3.670 . 3.670 2.368 2.332 2.463 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1534 1 79 ILE HA 1 80 ARG H 3.550 . 3.550 2.176 2.125 2.222 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1535 1 79 ILE HB 1 79 ILE MD 3.640 . 3.640 3.268 3.175 3.305 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1536 1 79 ILE MD 1 79 ILE MG 3.080 . 3.080 2.168 1.990 2.228 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1537 1 79 ILE MD 1 80 ARG H 4.080 . 4.080 3.975 3.848 4.115 0.035 37 0 "[ . 1 . 2 . 3 . 4 ]" 1
1538 1 79 ILE QG 1 80 ARG H 4.980 . 4.980 4.800 4.594 4.866 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1539 1 79 ILE MG 1 80 ARG H 3.250 . 3.250 2.882 2.771 3.009 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1540 1 80 ARG H 1 80 ARG HB2 4.020 . 4.020 2.651 2.335 3.039 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1541 1 80 ARG H 1 80 ARG QB 3.260 . 3.260 2.430 2.273 2.555 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1542 1 80 ARG H 1 80 ARG HB3 4.020 . 4.020 2.969 2.442 3.652 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1543 1 80 ARG H 1 80 ARG HD2 5.500 . 5.500 5.004 3.829 5.546 0.046 8 0 "[ . 1 . 2 . 3 . 4 ]" 1
1544 1 80 ARG H 1 80 ARG HD3 5.500 . 5.500 5.122 4.016 5.517 0.017 4 0 "[ . 1 . 2 . 3 . 4 ]" 1
1545 1 80 ARG H 1 80 ARG HG2 5.050 . 5.050 4.635 3.828 4.898 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1546 1 80 ARG H 1 80 ARG QG 4.370 . 4.370 4.043 3.433 4.254 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1547 1 80 ARG H 1 80 ARG HG3 5.050 . 5.050 4.481 3.585 4.919 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1548 1 80 ARG H 1 81 GLY H 4.750 . 4.750 4.504 4.434 4.569 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1549 1 80 ARG HA 1 80 ARG HD2 5.060 . 5.060 3.767 2.144 4.546 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1550 1 80 ARG HA 1 80 ARG QD 4.290 . 4.290 3.271 1.905 4.049 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1551 1 80 ARG HA 1 80 ARG HD3 5.060 . 5.060 3.824 1.918 4.619 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1552 1 80 ARG QB 1 81 GLY H 3.620 . 3.620 3.013 2.144 3.670 0.050 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1553 1 80 ARG HB2 1 81 GLY H 4.170 . 4.170 4.024 3.612 4.226 0.056 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
1554 1 80 ARG HB3 1 81 GLY H 4.170 . 4.170 3.146 2.160 4.054 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1555 1 80 ARG QD 1 81 GLY H 4.130 . 4.130 3.328 2.076 4.159 0.029 28 0 "[ . 1 . 2 . 3 . 4 ]" 1
1556 1 80 ARG HD2 1 81 GLY H 4.830 . 4.830 4.160 2.466 4.867 0.037 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
1557 1 80 ARG HD3 1 81 GLY H 4.830 . 4.830 3.780 2.085 4.860 0.030 3 0 "[ . 1 . 2 . 3 . 4 ]" 1
1558 1 80 ARG QG 1 81 GLY H 3.810 . 3.810 2.394 1.932 3.799 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1559 1 80 ARG HG2 1 81 GLY H 4.430 . 4.430 2.890 1.951 4.220 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1560 1 80 ARG HG3 1 81 GLY H 4.430 . 4.430 3.290 2.012 4.434 0.004 38 0 "[ . 1 . 2 . 3 . 4 ]" 1
1561 1 81 GLY H 1 82 LYS H 4.450 . 4.450 4.483 4.438 4.559 0.109 43 0 "[ . 1 . 2 . 3 . 4 ]" 1
1562 1 81 GLY HA2 1 82 LYS H 2.980 . 2.980 2.164 2.069 2.242 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1563 1 81 GLY HA3 1 82 LYS H 3.330 . 3.330 2.995 2.837 3.328 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1564 1 82 LYS H 1 82 LYS HB2 3.850 . 3.850 2.981 2.313 3.895 0.045 31 0 "[ . 1 . 2 . 3 . 4 ]" 1
1565 1 82 LYS H 1 82 LYS QB 3.290 . 3.290 2.641 2.286 3.143 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1566 1 82 LYS H 1 82 LYS HB3 3.850 . 3.850 3.442 3.047 3.690 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1567 1 82 LYS H 1 82 LYS QD 4.800 . 4.800 4.038 3.702 4.428 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1568 1 82 LYS H 1 82 LYS QE 5.240 . 5.240 4.563 3.870 5.264 0.024 36 0 "[ . 1 . 2 . 3 . 4 ]" 1
1569 1 82 LYS H 1 82 LYS QG 3.110 . 3.110 2.386 1.969 2.714 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1570 1 82 LYS H 1 83 ILE H 4.640 . 4.640 3.710 1.896 4.661 0.021 27 0 "[ . 1 . 2 . 3 . 4 ]" 1
1571 1 82 LYS HA 1 82 LYS QD 4.470 . 4.470 3.504 2.108 4.287 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1572 1 82 LYS HA 1 82 LYS HG2 4.160 . 4.160 3.142 2.421 3.834 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1573 1 82 LYS HA 1 82 LYS QG 3.620 . 3.620 2.928 2.376 3.396 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1574 1 82 LYS HA 1 82 LYS HG3 4.160 . 4.160 3.655 2.913 3.881 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1575 1 82 LYS HA 1 83 ILE H 3.460 . 3.460 2.727 2.106 3.482 0.022 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
1576 1 82 LYS QB 1 82 LYS QE 4.080 . 4.080 3.433 2.244 3.709 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1577 1 82 LYS QB 1 83 ILE H 3.450 . 3.450 2.734 1.686 3.511 0.061 29 0 "[ . 1 . 2 . 3 . 4 ]" 1
1578 1 82 LYS HB2 1 83 ILE H 4.310 . 4.310 3.146 1.716 4.320 0.010 24 0 "[ . 1 . 2 . 3 . 4 ]" 1
1579 1 82 LYS HB3 1 83 ILE H 4.310 . 4.310 3.516 2.385 4.168 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1580 1 82 LYS QD 1 83 ILE H 4.770 . 4.770 4.415 3.538 4.904 0.134 32 0 "[ . 1 . 2 . 3 . 4 ]" 1
1581 1 82 LYS QE 1 82 LYS QG 3.310 . 3.310 2.168 2.036 2.381 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1582 1 82 LYS QG 1 83 ILE H 4.890 . 4.890 3.825 2.227 4.702 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1583 1 83 ILE H 1 83 ILE HB 3.140 . 3.140 2.593 2.474 2.798 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1584 1 83 ILE H 1 83 ILE MD 4.370 . 4.370 3.146 1.883 4.206 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1585 1 83 ILE H 1 83 ILE QG 3.570 . 3.570 2.608 2.022 3.169 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1586 1 83 ILE H 1 83 ILE MG 4.020 . 4.020 3.859 3.813 3.964 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1587 1 83 ILE HA 1 83 ILE MD 3.890 . 3.890 3.349 2.180 3.935 0.045 1 0 "[ . 1 . 2 . 3 . 4 ]" 1
1588 1 83 ILE HA 1 83 ILE QG 3.740 . 3.740 2.595 2.335 3.089 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1589 1 83 ILE HA 1 83 ILE MG 3.540 . 3.540 2.415 2.341 2.473 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
1590 1 85 ASN H 1 86 SER H 4.770 . 4.770 3.621 1.862 4.649 . 0 0 "[ . 1 . 2 . 3 . 4 ]" 1
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