NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
407909 |
1yjv   |
6480 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1yjv
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 1895
_Distance_constraint_stats_list.Viol_count 726
_Distance_constraint_stats_list.Viol_total 795.005
_Distance_constraint_stats_list.Viol_max 0.249
_Distance_constraint_stats_list.Viol_rms 0.0053
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0005
_Distance_constraint_stats_list.Viol_average_violations_only 0.0365
_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 3 ASP 0.152 0.124 1 0 "[ . 1 . 2 . 3]"
1 4 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 5 VAL 0.250 0.075 18 0 "[ . 1 . 2 . 3]"
1 6 LEU 0.515 0.116 29 0 "[ . 1 . 2 . 3]"
1 7 GLU 2.774 0.149 28 0 "[ . 1 . 2 . 3]"
1 8 LEU 0.242 0.069 2 0 "[ . 1 . 2 . 3]"
1 9 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 10 VAL 0.141 0.050 4 0 "[ . 1 . 2 . 3]"
1 11 ARG 0.785 0.072 5 0 "[ . 1 . 2 . 3]"
1 12 GLY 0.037 0.019 3 0 "[ . 1 . 2 . 3]"
1 13 MET 0.459 0.048 16 0 "[ . 1 . 2 . 3]"
1 14 THR 0.955 0.059 21 0 "[ . 1 . 2 . 3]"
1 15 CYS 0.094 0.048 16 0 "[ . 1 . 2 . 3]"
1 16 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 17 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 18 CYS 0.064 0.033 17 0 "[ . 1 . 2 . 3]"
1 19 VAL 0.134 0.037 28 0 "[ . 1 . 2 . 3]"
1 20 HIS 0.301 0.049 14 0 "[ . 1 . 2 . 3]"
1 21 LYS 0.007 0.007 4 0 "[ . 1 . 2 . 3]"
1 22 ILE 0.537 0.050 2 0 "[ . 1 . 2 . 3]"
1 23 GLU 0.343 0.062 23 0 "[ . 1 . 2 . 3]"
1 24 SER 0.323 0.052 10 0 "[ . 1 . 2 . 3]"
1 25 SER 2.329 0.154 25 0 "[ . 1 . 2 . 3]"
1 26 LEU 4.669 0.156 2 0 "[ . 1 . 2 . 3]"
1 27 THR 1.166 0.249 13 0 "[ . 1 . 2 . 3]"
1 28 LYS 1.533 0.100 9 0 "[ . 1 . 2 . 3]"
1 29 HIS 1.859 0.156 2 0 "[ . 1 . 2 . 3]"
1 30 ARG 0.845 0.089 14 0 "[ . 1 . 2 . 3]"
1 31 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 32 ILE 2.013 0.097 30 0 "[ . 1 . 2 . 3]"
1 33 LEU 0.111 0.053 17 0 "[ . 1 . 2 . 3]"
1 34 TYR 0.354 0.249 13 0 "[ . 1 . 2 . 3]"
1 35 CYS 1.227 0.075 26 0 "[ . 1 . 2 . 3]"
1 36 SER 0.935 0.075 11 0 "[ . 1 . 2 . 3]"
1 37 VAL 0.822 0.050 2 0 "[ . 1 . 2 . 3]"
1 38 ALA 0.551 0.130 14 0 "[ . 1 . 2 . 3]"
1 39 LEU 0.115 0.061 25 0 "[ . 1 . 2 . 3]"
1 40 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 41 THR 2.841 0.130 14 0 "[ . 1 . 2 . 3]"
1 42 ASN 0.849 0.060 24 0 "[ . 1 . 2 . 3]"
1 43 LYS 2.683 0.077 3 0 "[ . 1 . 2 . 3]"
1 44 ALA 1.920 0.125 19 0 "[ . 1 . 2 . 3]"
1 45 HIS 3.222 0.149 28 0 "[ . 1 . 2 . 3]"
1 46 ILE 0.030 0.030 23 0 "[ . 1 . 2 . 3]"
1 47 LYS 0.089 0.053 17 0 "[ . 1 . 2 . 3]"
1 48 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 49 ASP 0.218 0.124 1 0 "[ . 1 . 2 . 3]"
1 50 PRO 0.084 0.035 25 0 "[ . 1 . 2 . 3]"
1 51 GLU 0.053 0.035 10 0 "[ . 1 . 2 . 3]"
1 52 ILE 0.084 0.040 19 0 "[ . 1 . 2 . 3]"
1 53 ILE 2.718 0.182 1 0 "[ . 1 . 2 . 3]"
1 54 GLY 2.050 0.182 1 0 "[ . 1 . 2 . 3]"
1 55 PRO 0.012 0.012 22 0 "[ . 1 . 2 . 3]"
1 56 ARG 0.443 0.103 2 0 "[ . 1 . 2 . 3]"
1 57 ASP 0.080 0.035 15 0 "[ . 1 . 2 . 3]"
1 58 ILE 0.475 0.072 23 0 "[ . 1 . 2 . 3]"
1 59 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 60 HIS 0.640 0.103 2 0 "[ . 1 . 2 . 3]"
1 61 THR 1.166 0.069 25 0 "[ . 1 . 2 . 3]"
1 62 ILE 1.345 0.069 25 0 "[ . 1 . 2 . 3]"
1 63 GLU 0.403 0.066 2 0 "[ . 1 . 2 . 3]"
1 64 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 65 LEU 0.710 0.074 7 0 "[ . 1 . 2 . 3]"
1 66 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 67 PHE 1.504 0.059 21 0 "[ . 1 . 2 . 3]"
1 68 GLU 0.030 0.022 16 0 "[ . 1 . 2 . 3]"
1 69 ALA 0.750 0.072 5 0 "[ . 1 . 2 . 3]"
1 70 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 71 LEU 0.076 0.070 27 0 "[ . 1 . 2 . 3]"
1 72 VAL 0.033 0.030 8 0 "[ . 1 . 2 . 3]"
1 73 LYS 0.020 0.017 10 0 "[ . 1 . 2 . 3]"
1 74 ILE 0.020 0.017 10 0 "[ . 1 . 2 . 3]"
1 75 GLU 0.088 0.088 19 0 "[ . 1 . 2 . 3]"
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 3 ASP H 1 49 ASP HA . . 6.600 5.156 2.797 6.724 0.124 1 0 "[ . 1 . 2 . 3]" 1
2 1 3 ASP QB 1 48 TYR QD . . 9.600 6.237 3.409 7.626 . 0 0 "[ . 1 . 2 . 3]" 1
3 1 3 ASP QB 1 49 ASP HA . . 7.600 5.197 2.807 6.843 . 0 0 "[ . 1 . 2 . 3]" 1
4 1 4 GLY H 1 5 VAL H . . 5.700 3.855 1.995 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
5 1 4 GLY H 1 5 VAL QG . . 9.160 4.296 3.019 5.390 . 0 0 "[ . 1 . 2 . 3]" 1
6 1 4 GLY H 1 33 LEU QD . . 9.170 4.206 2.995 5.977 . 0 0 "[ . 1 . 2 . 3]" 1
7 1 4 GLY H 1 47 LYS QB . . 7.480 4.795 3.388 5.969 . 0 0 "[ . 1 . 2 . 3]" 1
8 1 4 GLY H 1 47 LYS QD . . 7.600 5.229 3.076 6.820 . 0 0 "[ . 1 . 2 . 3]" 1
9 1 4 GLY H 1 48 TYR H . . 6.600 3.695 2.571 5.382 . 0 0 "[ . 1 . 2 . 3]" 1
10 1 4 GLY H 1 48 TYR QD . . 8.600 4.702 3.066 6.798 . 0 0 "[ . 1 . 2 . 3]" 1
11 1 4 GLY H 1 48 TYR QE . . 8.600 5.110 3.087 7.555 . 0 0 "[ . 1 . 2 . 3]" 1
12 1 4 GLY H 1 49 ASP HA . . 6.600 4.170 2.342 5.625 . 0 0 "[ . 1 . 2 . 3]" 1
13 1 4 GLY H 1 49 ASP QB . . 7.480 5.709 3.925 6.717 . 0 0 "[ . 1 . 2 . 3]" 1
14 1 4 GLY H 1 50 PRO HD2 . . 6.600 4.787 3.004 6.217 . 0 0 "[ . 1 . 2 . 3]" 1
15 1 4 GLY H 1 50 PRO HD3 . . 6.600 3.635 2.057 5.180 . 0 0 "[ . 1 . 2 . 3]" 1
16 1 4 GLY H 1 50 PRO QG . . 7.480 4.855 2.832 6.525 . 0 0 "[ . 1 . 2 . 3]" 1
17 1 4 GLY HA2 1 48 TYR H . . 6.600 4.643 3.173 6.494 . 0 0 "[ . 1 . 2 . 3]" 1
18 1 4 GLY HA2 1 48 TYR QD . . 8.600 4.834 2.548 6.221 . 0 0 "[ . 1 . 2 . 3]" 1
19 1 4 GLY HA2 1 48 TYR QE . . 8.600 4.271 2.835 6.020 . 0 0 "[ . 1 . 2 . 3]" 1
20 1 5 VAL H 1 6 LEU H . . 6.400 4.248 3.332 4.635 . 0 0 "[ . 1 . 2 . 3]" 1
21 1 5 VAL H 1 47 LYS HA . . 6.600 4.698 4.182 5.089 . 0 0 "[ . 1 . 2 . 3]" 1
22 1 5 VAL H 1 48 TYR H . . 6.600 4.822 4.073 5.174 . 0 0 "[ . 1 . 2 . 3]" 1
23 1 5 VAL H 1 48 TYR QD . . 8.600 4.894 3.146 6.591 . 0 0 "[ . 1 . 2 . 3]" 1
24 1 5 VAL H 1 48 TYR QE . . 8.600 4.145 2.217 6.853 . 0 0 "[ . 1 . 2 . 3]" 1
25 1 5 VAL HA 1 6 LEU HA . . 6.600 4.469 4.392 4.560 . 0 0 "[ . 1 . 2 . 3]" 1
26 1 5 VAL HA 1 46 ILE H . . 6.600 4.963 4.305 5.834 . 0 0 "[ . 1 . 2 . 3]" 1
27 1 5 VAL HA 1 47 LYS HA . . 6.600 2.417 2.154 2.956 . 0 0 "[ . 1 . 2 . 3]" 1
28 1 5 VAL HA 1 47 LYS QG . . 7.600 3.132 2.178 4.384 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 5 VAL HA 1 48 TYR H . . 6.600 3.724 3.278 4.665 . 0 0 "[ . 1 . 2 . 3]" 1
30 1 5 VAL HA 1 48 TYR QD . . 8.600 3.991 2.915 5.476 . 0 0 "[ . 1 . 2 . 3]" 1
31 1 5 VAL HA 1 48 TYR QE . . 8.600 4.479 3.061 6.296 . 0 0 "[ . 1 . 2 . 3]" 1
32 1 5 VAL HB 1 6 LEU H . . 6.300 4.103 2.748 4.529 . 0 0 "[ . 1 . 2 . 3]" 1
33 1 5 VAL HB 1 45 HIS HD2 . . 6.600 5.780 4.741 6.675 0.075 18 0 "[ . 1 . 2 . 3]" 1
34 1 5 VAL HB 1 47 LYS HA . . 6.600 4.540 3.398 5.939 . 0 0 "[ . 1 . 2 . 3]" 1
35 1 5 VAL QG 1 46 ILE H . . 9.160 4.536 3.190 5.681 . 0 0 "[ . 1 . 2 . 3]" 1
36 1 5 VAL QG 1 48 TYR QD . . 11.160 4.916 4.176 5.998 . 0 0 "[ . 1 . 2 . 3]" 1
37 1 5 VAL MG1 1 6 LEU H . . 7.600 3.834 2.397 4.464 . 0 0 "[ . 1 . 2 . 3]" 1
38 1 5 VAL MG1 1 6 LEU HA . . 7.600 4.401 2.920 5.752 . 0 0 "[ . 1 . 2 . 3]" 1
39 1 5 VAL MG1 1 45 HIS HD2 . . 7.600 5.188 3.411 6.357 . 0 0 "[ . 1 . 2 . 3]" 1
40 1 5 VAL MG1 1 45 HIS HE1 . . 7.600 3.764 2.401 5.374 . 0 0 "[ . 1 . 2 . 3]" 1
41 1 5 VAL MG1 1 47 LYS HA . . 7.600 4.373 3.098 5.336 . 0 0 "[ . 1 . 2 . 3]" 1
42 1 5 VAL MG1 1 48 TYR QE . . 9.600 5.417 4.278 7.133 . 0 0 "[ . 1 . 2 . 3]" 1
43 1 5 VAL MG2 1 6 LEU H . . 7.600 3.525 2.023 4.446 . 0 0 "[ . 1 . 2 . 3]" 1
44 1 5 VAL MG2 1 6 LEU HA . . 7.600 4.269 3.101 5.712 . 0 0 "[ . 1 . 2 . 3]" 1
45 1 5 VAL MG2 1 45 HIS HD2 . . 7.600 4.607 3.253 6.359 . 0 0 "[ . 1 . 2 . 3]" 1
46 1 5 VAL MG2 1 45 HIS HE1 . . 7.600 3.318 2.359 4.975 . 0 0 "[ . 1 . 2 . 3]" 1
47 1 5 VAL MG2 1 47 LYS HA . . 7.600 4.109 2.937 5.411 . 0 0 "[ . 1 . 2 . 3]" 1
48 1 5 VAL MG2 1 48 TYR QE . . 9.600 5.375 3.946 6.919 . 0 0 "[ . 1 . 2 . 3]" 1
49 1 6 LEU H 1 6 LEU HG . . 4.800 4.520 3.540 4.916 0.116 29 0 "[ . 1 . 2 . 3]" 1
50 1 6 LEU H 1 7 GLU H . . 6.600 4.002 3.464 4.475 . 0 0 "[ . 1 . 2 . 3]" 1
51 1 6 LEU H 1 45 HIS HA . . 6.600 4.611 3.983 5.662 . 0 0 "[ . 1 . 2 . 3]" 1
52 1 6 LEU H 1 46 ILE H . . 6.600 3.409 2.860 4.512 . 0 0 "[ . 1 . 2 . 3]" 1
53 1 6 LEU H 1 46 ILE HB . . 6.600 3.980 2.962 5.663 . 0 0 "[ . 1 . 2 . 3]" 1
54 1 6 LEU H 1 46 ILE QG . . 7.600 4.929 2.627 5.905 . 0 0 "[ . 1 . 2 . 3]" 1
55 1 6 LEU H 1 46 ILE MG . . 7.600 4.238 3.442 5.317 . 0 0 "[ . 1 . 2 . 3]" 1
56 1 6 LEU H 1 47 LYS H . . 6.600 4.885 4.701 5.595 . 0 0 "[ . 1 . 2 . 3]" 1
57 1 6 LEU H 1 47 LYS HA . . 6.600 3.299 2.922 3.776 . 0 0 "[ . 1 . 2 . 3]" 1
58 1 6 LEU H 1 48 TYR QD . . 8.600 3.535 2.202 4.636 . 0 0 "[ . 1 . 2 . 3]" 1
59 1 6 LEU H 1 48 TYR QE . . 8.600 3.865 2.314 5.107 . 0 0 "[ . 1 . 2 . 3]" 1
60 1 6 LEU HA 1 7 GLU HA . . 6.600 4.467 4.282 4.562 . 0 0 "[ . 1 . 2 . 3]" 1
61 1 6 LEU HA 1 7 GLU QB . . 7.600 4.325 3.748 4.938 . 0 0 "[ . 1 . 2 . 3]" 1
62 1 6 LEU HA 1 7 GLU QG . . 7.480 4.990 3.571 6.006 . 0 0 "[ . 1 . 2 . 3]" 1
63 1 6 LEU HA 1 46 ILE MD . . 7.600 6.008 4.841 6.430 . 0 0 "[ . 1 . 2 . 3]" 1
64 1 6 LEU HA 1 46 ILE MG . . 7.600 5.918 5.143 6.382 . 0 0 "[ . 1 . 2 . 3]" 1
65 1 6 LEU HA 1 47 LYS HA . . 6.600 6.099 5.685 6.535 . 0 0 "[ . 1 . 2 . 3]" 1
66 1 6 LEU HA 1 48 TYR QD . . 8.600 5.279 4.294 6.109 . 0 0 "[ . 1 . 2 . 3]" 1
67 1 6 LEU HA 1 48 TYR QE . . 8.600 4.238 3.318 4.989 . 0 0 "[ . 1 . 2 . 3]" 1
68 1 6 LEU HA 1 73 LYS QD . . 7.600 5.661 3.888 6.809 . 0 0 "[ . 1 . 2 . 3]" 1
69 1 6 LEU QB 1 7 GLU H . . 5.490 3.773 2.518 4.097 . 0 0 "[ . 1 . 2 . 3]" 1
70 1 6 LEU QB 1 7 GLU HA . . 7.480 4.549 4.033 4.853 . 0 0 "[ . 1 . 2 . 3]" 1
71 1 6 LEU QB 1 46 ILE H . . 6.440 3.672 3.170 4.892 . 0 0 "[ . 1 . 2 . 3]" 1
72 1 6 LEU QB 1 55 PRO HA . . 7.480 4.649 3.884 5.829 . 0 0 "[ . 1 . 2 . 3]" 1
73 1 6 LEU HB2 1 7 GLU H . . 5.800 4.429 2.740 4.684 . 0 0 "[ . 1 . 2 . 3]" 1
74 1 6 LEU HB2 1 46 ILE H . . 6.600 4.926 3.891 6.109 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 6 LEU HB2 1 48 TYR QD . . 8.600 3.391 2.442 6.485 . 0 0 "[ . 1 . 2 . 3]" 1
76 1 6 LEU HB2 1 48 TYR QE . . 8.600 2.653 2.189 4.945 . 0 0 "[ . 1 . 2 . 3]" 1
77 1 6 LEU HB3 1 7 GLU H . . 5.800 4.145 2.552 4.574 . 0 0 "[ . 1 . 2 . 3]" 1
78 1 6 LEU HB3 1 46 ILE H . . 6.600 3.854 3.238 5.605 . 0 0 "[ . 1 . 2 . 3]" 1
79 1 6 LEU HB3 1 48 TYR QD . . 8.600 3.876 2.482 5.862 . 0 0 "[ . 1 . 2 . 3]" 1
80 1 6 LEU HB3 1 48 TYR QE . . 8.600 3.614 2.181 5.268 . 0 0 "[ . 1 . 2 . 3]" 1
81 1 6 LEU QD 1 50 PRO QG . . 10.050 6.366 4.423 6.676 . 0 0 "[ . 1 . 2 . 3]" 1
82 1 6 LEU QD 1 55 PRO HA . . 9.170 3.053 2.047 4.898 . 0 0 "[ . 1 . 2 . 3]" 1
83 1 6 LEU QD 1 55 PRO QB . . 7.870 2.398 1.972 3.728 . 0 0 "[ . 1 . 2 . 3]" 1
84 1 6 LEU QD 1 55 PRO QG . . 10.050 3.700 3.173 5.223 . 0 0 "[ . 1 . 2 . 3]" 1
85 1 6 LEU MD1 1 7 GLU H . . 7.600 3.512 2.014 5.361 . 0 0 "[ . 1 . 2 . 3]" 1
86 1 6 LEU MD1 1 48 TYR QD . . 9.600 4.788 3.093 5.893 . 0 0 "[ . 1 . 2 . 3]" 1
87 1 6 LEU MD1 1 48 TYR QE . . 9.600 3.717 2.423 4.856 . 0 0 "[ . 1 . 2 . 3]" 1
88 1 6 LEU MD1 1 55 PRO HB2 . . 9.350 3.754 2.454 6.039 . 0 0 "[ . 1 . 2 . 3]" 1
89 1 6 LEU MD1 1 55 PRO HB3 . . 9.350 3.296 2.175 5.467 . 0 0 "[ . 1 . 2 . 3]" 1
90 1 6 LEU MD2 1 7 GLU H . . 7.600 4.188 2.834 5.434 . 0 0 "[ . 1 . 2 . 3]" 1
91 1 6 LEU MD2 1 48 TYR QD . . 9.600 4.240 2.804 5.684 . 0 0 "[ . 1 . 2 . 3]" 1
92 1 6 LEU MD2 1 48 TYR QE . . 9.600 3.270 2.203 5.285 . 0 0 "[ . 1 . 2 . 3]" 1
93 1 6 LEU MD2 1 55 PRO HB2 . . 9.350 3.537 2.507 5.935 . 0 0 "[ . 1 . 2 . 3]" 1
94 1 6 LEU MD2 1 55 PRO HB3 . . 9.350 2.986 2.070 4.488 . 0 0 "[ . 1 . 2 . 3]" 1
95 1 6 LEU HG 1 7 GLU H . . 5.600 4.178 2.235 5.672 0.072 10 0 "[ . 1 . 2 . 3]" 1
96 1 6 LEU HG 1 8 LEU QB . . 7.600 4.546 2.432 6.792 . 0 0 "[ . 1 . 2 . 3]" 1
97 1 6 LEU HG 1 55 PRO QB . . 7.480 3.988 2.315 6.672 . 0 0 "[ . 1 . 2 . 3]" 1
98 1 7 GLU H 1 7 GLU HG2 . . 5.600 4.138 2.259 4.697 . 0 0 "[ . 1 . 2 . 3]" 1
99 1 7 GLU H 1 7 GLU HG3 . . 5.600 3.919 2.034 5.120 . 0 0 "[ . 1 . 2 . 3]" 1
100 1 7 GLU H 1 8 LEU H . . 4.900 4.192 3.612 4.513 . 0 0 "[ . 1 . 2 . 3]" 1
101 1 7 GLU HA 1 8 LEU H . . 3.600 2.155 2.036 2.418 . 0 0 "[ . 1 . 2 . 3]" 1
102 1 7 GLU HA 1 8 LEU QB . . 7.600 4.513 4.151 4.895 . 0 0 "[ . 1 . 2 . 3]" 1
103 1 7 GLU HA 1 8 LEU MD1 . . 7.600 4.330 2.755 5.778 . 0 0 "[ . 1 . 2 . 3]" 1
104 1 7 GLU HA 1 8 LEU MD2 . . 7.600 4.737 3.234 5.854 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 7 GLU HA 1 8 LEU HG . . 6.600 4.624 3.608 6.304 . 0 0 "[ . 1 . 2 . 3]" 1
106 1 7 GLU HA 1 43 LYS HB2 . . 6.600 5.096 4.020 5.878 . 0 0 "[ . 1 . 2 . 3]" 1
107 1 7 GLU HA 1 43 LYS HB3 . . 6.600 6.504 5.711 6.677 0.077 3 0 "[ . 1 . 2 . 3]" 1
108 1 7 GLU HA 1 43 LYS QD . . 7.600 5.182 3.801 6.604 . 0 0 "[ . 1 . 2 . 3]" 1
109 1 7 GLU HA 1 44 ALA H . . 6.600 4.092 3.616 4.399 . 0 0 "[ . 1 . 2 . 3]" 1
110 1 7 GLU HA 1 44 ALA HA . . 6.600 5.312 4.924 5.563 . 0 0 "[ . 1 . 2 . 3]" 1
111 1 7 GLU HA 1 44 ALA MB . . 7.600 4.475 4.050 4.748 . 0 0 "[ . 1 . 2 . 3]" 1
112 1 7 GLU HA 1 45 HIS H . . 6.600 4.569 4.032 4.975 . 0 0 "[ . 1 . 2 . 3]" 1
113 1 7 GLU HA 1 45 HIS HA . . 6.600 2.350 2.055 2.902 . 0 0 "[ . 1 . 2 . 3]" 1
114 1 7 GLU HA 1 45 HIS QB . . 7.480 3.946 3.409 4.506 . 0 0 "[ . 1 . 2 . 3]" 1
115 1 7 GLU HA 1 45 HIS HD2 . . 6.600 5.612 5.057 6.608 0.008 13 0 "[ . 1 . 2 . 3]" 1
116 1 7 GLU HA 1 46 ILE H . . 6.600 3.243 2.801 3.651 . 0 0 "[ . 1 . 2 . 3]" 1
117 1 7 GLU HA 1 46 ILE HB . . 6.600 5.399 4.621 6.630 0.030 23 0 "[ . 1 . 2 . 3]" 1
118 1 7 GLU HA 1 46 ILE MD . . 7.600 4.684 3.843 5.749 . 0 0 "[ . 1 . 2 . 3]" 1
119 1 7 GLU HA 1 72 VAL QG . . 9.160 5.695 3.647 6.861 . 0 0 "[ . 1 . 2 . 3]" 1
120 1 7 GLU QB 1 8 LEU HA . . 7.600 4.448 3.917 4.901 . 0 0 "[ . 1 . 2 . 3]" 1
121 1 7 GLU QB 1 44 ALA H . . 7.600 5.009 3.715 5.754 . 0 0 "[ . 1 . 2 . 3]" 1
122 1 7 GLU QB 1 45 HIS H . . 7.600 5.472 3.911 6.417 . 0 0 "[ . 1 . 2 . 3]" 1
123 1 7 GLU QB 1 45 HIS HA . . 7.600 3.440 2.310 4.511 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 7 GLU QB 1 71 LEU HA . . 7.600 5.730 4.769 6.777 . 0 0 "[ . 1 . 2 . 3]" 1
125 1 7 GLU QG 1 8 LEU H . . 6.190 3.656 2.805 4.831 . 0 0 "[ . 1 . 2 . 3]" 1
126 1 7 GLU QG 1 45 HIS H . . 7.480 4.335 3.231 6.044 . 0 0 "[ . 1 . 2 . 3]" 1
127 1 7 GLU QG 1 46 ILE H . . 7.480 4.206 3.344 5.648 . 0 0 "[ . 1 . 2 . 3]" 1
128 1 7 GLU QG 1 71 LEU HA . . 7.480 6.650 5.987 6.783 . 0 0 "[ . 1 . 2 . 3]" 1
129 1 7 GLU HG2 1 8 LEU H . . 6.400 3.936 2.901 5.679 . 0 0 "[ . 1 . 2 . 3]" 1
130 1 7 GLU HG2 1 44 ALA H . . 6.600 4.754 3.268 6.624 0.024 11 0 "[ . 1 . 2 . 3]" 1
131 1 7 GLU HG2 1 45 HIS HA . . 6.600 3.204 2.260 4.868 . 0 0 "[ . 1 . 2 . 3]" 1
132 1 7 GLU HG2 1 45 HIS HD2 . . 6.600 5.884 4.639 6.749 0.149 28 0 "[ . 1 . 2 . 3]" 1
133 1 7 GLU HG3 1 8 LEU H . . 6.400 4.532 3.021 5.826 . 0 0 "[ . 1 . 2 . 3]" 1
134 1 7 GLU HG3 1 44 ALA H . . 6.600 5.510 3.118 6.725 0.125 19 0 "[ . 1 . 2 . 3]" 1
135 1 7 GLU HG3 1 45 HIS HA . . 6.600 3.326 2.145 4.920 . 0 0 "[ . 1 . 2 . 3]" 1
136 1 7 GLU HG3 1 45 HIS HD2 . . 6.600 5.670 4.362 6.735 0.135 11 0 "[ . 1 . 2 . 3]" 1
137 1 8 LEU H 1 8 LEU MD1 . . 5.300 2.969 1.827 4.261 . 0 0 "[ . 1 . 2 . 3]" 1
138 1 8 LEU H 1 8 LEU QD . . 4.910 2.568 1.815 3.406 . 0 0 "[ . 1 . 2 . 3]" 1
139 1 8 LEU H 1 8 LEU MD2 . . 5.300 3.457 1.871 4.421 . 0 0 "[ . 1 . 2 . 3]" 1
140 1 8 LEU H 1 8 LEU HG . . 5.500 3.122 2.085 4.641 . 0 0 "[ . 1 . 2 . 3]" 1
141 1 8 LEU H 1 9 VAL H . . 6.600 4.467 4.256 4.684 . 0 0 "[ . 1 . 2 . 3]" 1
142 1 8 LEU H 1 9 VAL HA . . 6.600 4.992 4.490 5.559 . 0 0 "[ . 1 . 2 . 3]" 1
143 1 8 LEU H 1 9 VAL QG . . 9.160 5.323 4.877 5.764 . 0 0 "[ . 1 . 2 . 3]" 1
144 1 8 LEU H 1 43 LYS HA . . 6.600 4.726 3.933 5.605 . 0 0 "[ . 1 . 2 . 3]" 1
145 1 8 LEU H 1 44 ALA H . . 4.800 3.015 2.491 3.885 . 0 0 "[ . 1 . 2 . 3]" 1
146 1 8 LEU H 1 44 ALA MB . . 7.600 3.492 2.968 3.947 . 0 0 "[ . 1 . 2 . 3]" 1
147 1 8 LEU H 1 45 HIS HA . . 6.600 3.891 3.565 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
148 1 8 LEU H 1 46 ILE H . . 6.600 4.321 3.543 5.101 . 0 0 "[ . 1 . 2 . 3]" 1
149 1 8 LEU H 1 46 ILE MD . . 7.600 4.373 3.589 5.180 . 0 0 "[ . 1 . 2 . 3]" 1
150 1 8 LEU H 1 46 ILE QG . . 7.600 5.205 3.332 6.803 . 0 0 "[ . 1 . 2 . 3]" 1
151 1 8 LEU H 1 58 ILE MG . . 7.600 5.891 5.287 6.373 . 0 0 "[ . 1 . 2 . 3]" 1
152 1 8 LEU H 1 71 LEU HA . . 6.600 4.922 4.430 5.460 . 0 0 "[ . 1 . 2 . 3]" 1
153 1 8 LEU HA 1 9 VAL H . . 3.600 2.323 2.206 2.496 . 0 0 "[ . 1 . 2 . 3]" 1
154 1 8 LEU HA 1 9 VAL HB . . 6.600 4.362 4.239 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
155 1 8 LEU HA 1 10 VAL QG . . 9.160 5.178 4.259 6.245 . 0 0 "[ . 1 . 2 . 3]" 1
156 1 8 LEU HA 1 70 SER H . . 6.400 4.599 3.938 5.292 . 0 0 "[ . 1 . 2 . 3]" 1
157 1 8 LEU HA 1 71 LEU HA . . 6.600 2.378 2.124 2.930 . 0 0 "[ . 1 . 2 . 3]" 1
158 1 8 LEU HA 1 71 LEU QB . . 7.600 4.101 3.214 4.839 . 0 0 "[ . 1 . 2 . 3]" 1
159 1 8 LEU HA 1 71 LEU QD . . 9.170 4.426 3.008 5.288 . 0 0 "[ . 1 . 2 . 3]" 1
160 1 8 LEU HA 1 72 VAL H . . 5.400 3.057 2.216 5.111 . 0 0 "[ . 1 . 2 . 3]" 1
161 1 8 LEU HA 1 72 VAL HA . . 6.600 5.498 4.530 6.630 0.030 8 0 "[ . 1 . 2 . 3]" 1
162 1 8 LEU QB 1 9 VAL H . . 5.500 2.663 2.285 3.172 . 0 0 "[ . 1 . 2 . 3]" 1
163 1 8 LEU QB 1 9 VAL HA . . 7.600 4.483 3.903 4.824 . 0 0 "[ . 1 . 2 . 3]" 1
164 1 8 LEU QB 1 10 VAL QG . . 10.160 3.825 2.060 5.222 . 0 0 "[ . 1 . 2 . 3]" 1
165 1 8 LEU QB 1 44 ALA H . . 7.300 4.505 3.268 5.235 . 0 0 "[ . 1 . 2 . 3]" 1
166 1 8 LEU QB 1 44 ALA MB . . 8.600 3.977 2.167 4.942 . 0 0 "[ . 1 . 2 . 3]" 1
167 1 8 LEU QB 1 45 HIS HA . . 7.600 6.163 5.372 6.781 . 0 0 "[ . 1 . 2 . 3]" 1
168 1 8 LEU QB 1 58 ILE MG . . 8.600 4.925 3.998 6.015 . 0 0 "[ . 1 . 2 . 3]" 1
169 1 8 LEU QB 1 69 ALA HA . . 7.600 4.327 3.353 5.192 . 0 0 "[ . 1 . 2 . 3]" 1
170 1 8 LEU QB 1 70 SER H . . 7.400 2.988 2.581 3.658 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 8 LEU QB 1 71 LEU H . . 7.600 3.974 3.186 5.707 . 0 0 "[ . 1 . 2 . 3]" 1
172 1 8 LEU QB 1 71 LEU HA . . 7.600 2.645 2.030 4.216 . 0 0 "[ . 1 . 2 . 3]" 1
173 1 8 LEU QD 1 43 LYS HA . . 9.170 4.469 3.365 5.912 . 0 0 "[ . 1 . 2 . 3]" 1
174 1 8 LEU QD 1 44 ALA MB . . 10.170 2.347 1.862 3.298 . 0 0 "[ . 1 . 2 . 3]" 1
175 1 8 LEU QD 1 46 ILE HB . . 9.170 4.072 2.804 5.446 . 0 0 "[ . 1 . 2 . 3]" 1
176 1 8 LEU QD 1 58 ILE H . . 9.170 5.644 4.638 6.672 . 0 0 "[ . 1 . 2 . 3]" 1
177 1 8 LEU QD 1 69 ALA HA . . 9.170 3.548 2.323 5.179 . 0 0 "[ . 1 . 2 . 3]" 1
178 1 8 LEU QD 1 70 SER H . . 9.170 3.147 2.119 4.031 . 0 0 "[ . 1 . 2 . 3]" 1
179 1 8 LEU QD 1 71 LEU HA . . 9.170 3.432 2.157 4.202 . 0 0 "[ . 1 . 2 . 3]" 1
180 1 8 LEU MD1 1 9 VAL H . . 7.600 4.256 3.233 5.143 . 0 0 "[ . 1 . 2 . 3]" 1
181 1 8 LEU MD1 1 44 ALA H . . 7.600 3.880 2.395 5.620 . 0 0 "[ . 1 . 2 . 3]" 1
182 1 8 LEU MD2 1 9 VAL H . . 7.600 4.129 2.954 5.034 . 0 0 "[ . 1 . 2 . 3]" 1
183 1 8 LEU MD2 1 44 ALA H . . 7.600 4.669 2.627 5.991 . 0 0 "[ . 1 . 2 . 3]" 1
184 1 8 LEU HG 1 9 VAL H . . 6.400 4.824 3.624 5.288 . 0 0 "[ . 1 . 2 . 3]" 1
185 1 8 LEU HG 1 58 ILE HB . . 6.600 6.048 4.661 6.669 0.069 2 0 "[ . 1 . 2 . 3]" 1
186 1 8 LEU HG 1 58 ILE MG . . 7.600 4.203 3.531 5.050 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 8 LEU HG 1 59 ILE MD . . 7.600 4.530 2.174 5.770 . 0 0 "[ . 1 . 2 . 3]" 1
188 1 8 LEU HG 1 71 LEU HA . . 6.600 4.566 2.398 5.392 . 0 0 "[ . 1 . 2 . 3]" 1
189 1 8 LEU HG 1 71 LEU QD . . 9.170 4.842 2.701 6.673 . 0 0 "[ . 1 . 2 . 3]" 1
190 1 9 VAL H 1 9 VAL HB . . 4.000 2.203 2.072 2.356 . 0 0 "[ . 1 . 2 . 3]" 1
191 1 9 VAL H 1 9 VAL MG1 . . 4.100 3.432 3.172 3.544 . 0 0 "[ . 1 . 2 . 3]" 1
192 1 9 VAL H 1 9 VAL MG2 . . 4.100 3.212 2.674 3.444 . 0 0 "[ . 1 . 2 . 3]" 1
193 1 9 VAL H 1 10 VAL QG . . 9.160 4.571 3.980 5.405 . 0 0 "[ . 1 . 2 . 3]" 1
194 1 9 VAL H 1 43 LYS HA . . 6.600 4.654 4.505 4.828 . 0 0 "[ . 1 . 2 . 3]" 1
195 1 9 VAL H 1 44 ALA MB . . 7.600 5.662 5.021 6.179 . 0 0 "[ . 1 . 2 . 3]" 1
196 1 9 VAL H 1 69 ALA HA . . 6.600 4.918 4.460 5.271 . 0 0 "[ . 1 . 2 . 3]" 1
197 1 9 VAL H 1 69 ALA MB . . 7.600 4.726 4.132 5.379 . 0 0 "[ . 1 . 2 . 3]" 1
198 1 9 VAL H 1 70 SER H . . 4.600 3.085 2.836 3.386 . 0 0 "[ . 1 . 2 . 3]" 1
199 1 9 VAL H 1 70 SER HB2 . . 6.600 4.409 3.423 5.568 . 0 0 "[ . 1 . 2 . 3]" 1
200 1 9 VAL H 1 70 SER HB3 . . 6.600 4.625 3.328 5.438 . 0 0 "[ . 1 . 2 . 3]" 1
201 1 9 VAL H 1 71 LEU HA . . 6.300 3.394 2.652 3.809 . 0 0 "[ . 1 . 2 . 3]" 1
202 1 9 VAL H 1 72 VAL H . . 6.600 3.631 2.458 5.240 . 0 0 "[ . 1 . 2 . 3]" 1
203 1 9 VAL H 1 72 VAL HA . . 6.600 5.392 4.061 6.337 . 0 0 "[ . 1 . 2 . 3]" 1
204 1 9 VAL H 1 72 VAL HB . . 6.600 4.413 2.725 5.682 . 0 0 "[ . 1 . 2 . 3]" 1
205 1 9 VAL HA 1 10 VAL H . . 3.600 2.260 2.148 2.403 . 0 0 "[ . 1 . 2 . 3]" 1
206 1 9 VAL HA 1 10 VAL HB . . 6.600 4.713 4.317 5.718 . 0 0 "[ . 1 . 2 . 3]" 1
207 1 9 VAL HA 1 10 VAL QG . . 9.160 3.542 3.210 3.966 . 0 0 "[ . 1 . 2 . 3]" 1
208 1 9 VAL HA 1 42 ASN QB . . 7.480 4.117 3.410 4.764 . 0 0 "[ . 1 . 2 . 3]" 1
209 1 9 VAL HA 1 43 LYS H . . 6.600 4.611 4.372 4.773 . 0 0 "[ . 1 . 2 . 3]" 1
210 1 9 VAL HA 1 43 LYS HA . . 6.600 2.182 2.062 2.494 . 0 0 "[ . 1 . 2 . 3]" 1
211 1 9 VAL HA 1 43 LYS QG . . 7.600 4.786 3.930 5.489 . 0 0 "[ . 1 . 2 . 3]" 1
212 1 9 VAL HA 1 44 ALA H . . 4.600 3.683 3.411 4.210 . 0 0 "[ . 1 . 2 . 3]" 1
213 1 9 VAL HB 1 10 VAL H . . 5.500 4.440 4.267 4.725 . 0 0 "[ . 1 . 2 . 3]" 1
214 1 9 VAL HB 1 70 SER H . . 5.700 3.791 3.348 4.366 . 0 0 "[ . 1 . 2 . 3]" 1
215 1 9 VAL HB 1 70 SER HB2 . . 6.600 3.791 2.338 5.408 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 9 VAL HB 1 70 SER HB3 . . 6.600 4.097 2.511 5.242 . 0 0 "[ . 1 . 2 . 3]" 1
217 1 9 VAL HB 1 72 VAL HA . . 6.600 5.309 3.858 6.268 . 0 0 "[ . 1 . 2 . 3]" 1
218 1 9 VAL QG 1 11 ARG QD . . 8.330 3.250 1.990 4.751 . 0 0 "[ . 1 . 2 . 3]" 1
219 1 9 VAL QG 1 11 ARG QG . . 10.040 2.526 2.008 4.073 . 0 0 "[ . 1 . 2 . 3]" 1
220 1 9 VAL QG 1 42 ASN H . . 9.160 5.005 4.738 5.368 . 0 0 "[ . 1 . 2 . 3]" 1
221 1 9 VAL QG 1 42 ASN QB . . 10.040 2.552 2.118 3.322 . 0 0 "[ . 1 . 2 . 3]" 1
222 1 9 VAL QG 1 43 LYS QB . . 9.120 3.145 2.327 3.879 . 0 0 "[ . 1 . 2 . 3]" 1
223 1 9 VAL QG 1 43 LYS QD . . 10.160 5.234 4.355 5.790 . 0 0 "[ . 1 . 2 . 3]" 1
224 1 9 VAL QG 1 69 ALA HA . . 9.160 3.786 2.958 4.481 . 0 0 "[ . 1 . 2 . 3]" 1
225 1 9 VAL QG 1 72 VAL H . . 9.160 4.576 3.634 5.720 . 0 0 "[ . 1 . 2 . 3]" 1
226 1 9 VAL QG 1 72 VAL HA . . 9.160 4.955 3.490 5.745 . 0 0 "[ . 1 . 2 . 3]" 1
227 1 9 VAL MG1 1 10 VAL H . . 7.000 2.815 2.504 3.686 . 0 0 "[ . 1 . 2 . 3]" 1
228 1 9 VAL MG1 1 11 ARG H . . 7.600 3.773 2.671 4.301 . 0 0 "[ . 1 . 2 . 3]" 1
229 1 9 VAL MG1 1 11 ARG HD2 . . 9.350 3.794 2.017 5.554 . 0 0 "[ . 1 . 2 . 3]" 1
230 1 9 VAL MG1 1 11 ARG HD3 . . 9.350 3.921 2.380 5.539 . 0 0 "[ . 1 . 2 . 3]" 1
231 1 9 VAL MG1 1 42 ASN HD21 . . 7.600 5.338 4.035 6.287 . 0 0 "[ . 1 . 2 . 3]" 1
232 1 9 VAL MG1 1 42 ASN HD22 . . 7.600 6.071 5.184 6.364 . 0 0 "[ . 1 . 2 . 3]" 1
233 1 9 VAL MG1 1 43 LYS H . . 7.600 5.529 5.194 6.126 . 0 0 "[ . 1 . 2 . 3]" 1
234 1 9 VAL MG1 1 43 LYS HA . . 7.600 4.317 4.031 4.688 . 0 0 "[ . 1 . 2 . 3]" 1
235 1 9 VAL MG1 1 43 LYS HB2 . . 10.720 5.648 4.152 6.537 . 0 0 "[ . 1 . 2 . 3]" 1
236 1 9 VAL MG1 1 43 LYS HB3 . . 10.720 5.417 4.549 6.409 . 0 0 "[ . 1 . 2 . 3]" 1
237 1 9 VAL MG1 1 43 LYS QG . . 8.600 6.117 5.374 6.414 . 0 0 "[ . 1 . 2 . 3]" 1
238 1 9 VAL MG1 1 44 ALA H . . 7.600 5.782 5.504 6.159 . 0 0 "[ . 1 . 2 . 3]" 1
239 1 9 VAL MG1 1 70 SER H . . 7.600 3.286 2.462 3.752 . 0 0 "[ . 1 . 2 . 3]" 1
240 1 9 VAL MG1 1 70 SER HB2 . . 7.600 3.391 2.263 4.716 . 0 0 "[ . 1 . 2 . 3]" 1
241 1 9 VAL MG1 1 70 SER HB3 . . 7.600 3.847 2.592 4.702 . 0 0 "[ . 1 . 2 . 3]" 1
242 1 9 VAL MG2 1 10 VAL H . . 7.000 3.488 3.094 4.077 . 0 0 "[ . 1 . 2 . 3]" 1
243 1 9 VAL MG2 1 11 ARG H . . 7.600 5.989 5.022 6.396 . 0 0 "[ . 1 . 2 . 3]" 1
244 1 9 VAL MG2 1 11 ARG HD2 . . 9.350 5.813 4.008 7.798 . 0 0 "[ . 1 . 2 . 3]" 1
245 1 9 VAL MG2 1 11 ARG HD3 . . 9.350 5.986 4.199 7.402 . 0 0 "[ . 1 . 2 . 3]" 1
246 1 9 VAL MG2 1 42 ASN HD21 . . 7.600 5.628 4.914 6.348 . 0 0 "[ . 1 . 2 . 3]" 1
247 1 9 VAL MG2 1 42 ASN HD22 . . 7.600 6.343 5.864 6.411 . 0 0 "[ . 1 . 2 . 3]" 1
248 1 9 VAL MG2 1 43 LYS H . . 7.600 4.795 4.324 5.092 . 0 0 "[ . 1 . 2 . 3]" 1
249 1 9 VAL MG2 1 43 LYS HA . . 7.600 3.420 2.990 3.691 . 0 0 "[ . 1 . 2 . 3]" 1
250 1 9 VAL MG2 1 43 LYS HB2 . . 10.720 3.850 2.451 5.121 . 0 0 "[ . 1 . 2 . 3]" 1
251 1 9 VAL MG2 1 43 LYS HB3 . . 10.720 3.587 2.912 4.454 . 0 0 "[ . 1 . 2 . 3]" 1
252 1 9 VAL MG2 1 43 LYS QG . . 8.600 4.616 3.533 5.363 . 0 0 "[ . 1 . 2 . 3]" 1
253 1 9 VAL MG2 1 44 ALA H . . 7.600 4.860 4.568 5.186 . 0 0 "[ . 1 . 2 . 3]" 1
254 1 9 VAL MG2 1 70 SER H . . 7.600 5.047 4.767 5.402 . 0 0 "[ . 1 . 2 . 3]" 1
255 1 9 VAL MG2 1 70 SER HB2 . . 7.600 5.063 3.821 6.335 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 9 VAL MG2 1 70 SER HB3 . . 7.600 5.318 4.092 6.347 . 0 0 "[ . 1 . 2 . 3]" 1
257 1 10 VAL H 1 10 VAL MG1 . . 4.400 3.146 1.927 3.799 . 0 0 "[ . 1 . 2 . 3]" 1
258 1 10 VAL H 1 10 VAL MG2 . . 4.400 3.064 1.897 3.811 . 0 0 "[ . 1 . 2 . 3]" 1
259 1 10 VAL H 1 11 ARG H . . 5.800 4.163 3.680 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
260 1 10 VAL H 1 13 MET ME . . 7.600 4.003 3.206 5.614 . 0 0 "[ . 1 . 2 . 3]" 1
261 1 10 VAL H 1 22 ILE MD . . 7.600 6.038 5.028 6.372 . 0 0 "[ . 1 . 2 . 3]" 1
262 1 10 VAL H 1 42 ASN HA . . 6.600 4.045 3.556 4.586 . 0 0 "[ . 1 . 2 . 3]" 1
263 1 10 VAL H 1 42 ASN HB2 . . 6.500 4.435 3.390 6.295 . 0 0 "[ . 1 . 2 . 3]" 1
264 1 10 VAL H 1 42 ASN QB . . 6.150 3.419 2.916 4.661 . 0 0 "[ . 1 . 2 . 3]" 1
265 1 10 VAL H 1 42 ASN HB3 . . 6.500 3.675 2.964 4.905 . 0 0 "[ . 1 . 2 . 3]" 1
266 1 10 VAL H 1 42 ASN QD . . 7.470 5.258 3.794 6.185 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 10 VAL H 1 43 LYS H . . 6.600 4.083 3.567 4.572 . 0 0 "[ . 1 . 2 . 3]" 1
268 1 10 VAL H 1 43 LYS HA . . 5.300 2.665 2.065 3.317 . 0 0 "[ . 1 . 2 . 3]" 1
269 1 10 VAL H 1 43 LYS HB2 . . 6.600 4.838 3.637 5.714 . 0 0 "[ . 1 . 2 . 3]" 1
270 1 10 VAL H 1 43 LYS HB3 . . 6.600 4.843 4.124 5.668 . 0 0 "[ . 1 . 2 . 3]" 1
271 1 10 VAL H 1 44 ALA H . . 5.800 4.202 3.415 4.839 . 0 0 "[ . 1 . 2 . 3]" 1
272 1 10 VAL H 1 62 ILE MG . . 7.600 5.803 5.170 6.333 . 0 0 "[ . 1 . 2 . 3]" 1
273 1 10 VAL H 1 69 ALA HA . . 6.600 4.752 4.401 5.112 . 0 0 "[ . 1 . 2 . 3]" 1
274 1 10 VAL HA 1 22 ILE MD . . 7.600 5.360 4.280 5.822 . 0 0 "[ . 1 . 2 . 3]" 1
275 1 10 VAL HA 1 69 ALA HA . . 6.600 2.327 2.138 2.730 . 0 0 "[ . 1 . 2 . 3]" 1
276 1 10 VAL HA 1 69 ALA MB . . 7.600 3.253 2.396 3.996 . 0 0 "[ . 1 . 2 . 3]" 1
277 1 10 VAL HA 1 70 SER H . . 5.200 3.735 3.495 3.928 . 0 0 "[ . 1 . 2 . 3]" 1
278 1 10 VAL HB 1 11 ARG H . . 5.200 4.160 2.963 4.574 . 0 0 "[ . 1 . 2 . 3]" 1
279 1 10 VAL HB 1 42 ASN HA . . 6.600 5.225 3.850 6.650 0.050 4 0 "[ . 1 . 2 . 3]" 1
280 1 10 VAL HB 1 69 ALA HA . . 6.600 4.743 3.384 5.506 . 0 0 "[ . 1 . 2 . 3]" 1
281 1 10 VAL HB 1 70 SER H . . 6.600 5.766 4.459 6.362 . 0 0 "[ . 1 . 2 . 3]" 1
282 1 10 VAL QG 1 11 ARG H . . 7.140 2.885 2.372 3.759 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 10 VAL QG 1 12 GLY H . . 9.160 4.731 2.498 5.912 . 0 0 "[ . 1 . 2 . 3]" 1
284 1 10 VAL QG 1 13 MET H . . 9.160 3.632 2.126 5.666 . 0 0 "[ . 1 . 2 . 3]" 1
285 1 10 VAL QG 1 13 MET ME . . 10.160 2.547 1.861 3.783 . 0 0 "[ . 1 . 2 . 3]" 1
286 1 10 VAL QG 1 13 MET QG . . 10.040 2.509 1.872 3.740 . 0 0 "[ . 1 . 2 . 3]" 1
287 1 10 VAL QG 1 42 ASN QB . . 10.040 4.208 3.499 4.948 . 0 0 "[ . 1 . 2 . 3]" 1
288 1 10 VAL QG 1 42 ASN QD . . 10.030 4.845 3.170 6.480 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 10 VAL QG 1 43 LYS HA . . 9.160 3.064 2.134 4.054 . 0 0 "[ . 1 . 2 . 3]" 1
290 1 10 VAL QG 1 44 ALA MB . . 10.160 2.081 1.853 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 10 VAL QG 1 67 PHE QD . . 11.160 3.751 3.102 4.720 . 0 0 "[ . 1 . 2 . 3]" 1
292 1 10 VAL QG 1 67 PHE QE . . 11.160 4.848 4.125 5.706 . 0 0 "[ . 1 . 2 . 3]" 1
293 1 10 VAL QG 1 69 ALA H . . 9.160 4.812 4.002 5.672 . 0 0 "[ . 1 . 2 . 3]" 1
294 1 10 VAL QG 1 70 SER H . . 9.160 4.230 3.573 5.100 . 0 0 "[ . 1 . 2 . 3]" 1
295 1 10 VAL MG1 1 11 ARG H . . 7.600 3.413 2.448 4.427 . 0 0 "[ . 1 . 2 . 3]" 1
296 1 10 VAL MG1 1 44 ALA H . . 7.600 4.541 2.709 6.340 . 0 0 "[ . 1 . 2 . 3]" 1
297 1 10 VAL MG1 1 68 GLU H . . 7.600 4.581 2.982 6.270 . 0 0 "[ . 1 . 2 . 3]" 1
298 1 10 VAL MG1 1 69 ALA HA . . 7.600 4.084 2.787 5.499 . 0 0 "[ . 1 . 2 . 3]" 1
299 1 10 VAL MG1 1 69 ALA MB . . 8.600 3.733 2.091 5.793 . 0 0 "[ . 1 . 2 . 3]" 1
300 1 10 VAL MG2 1 11 ARG H . . 7.600 3.686 2.393 4.308 . 0 0 "[ . 1 . 2 . 3]" 1
301 1 10 VAL MG2 1 44 ALA H . . 7.600 3.920 2.549 5.877 . 0 0 "[ . 1 . 2 . 3]" 1
302 1 10 VAL MG2 1 68 GLU H . . 7.600 4.964 3.108 6.333 . 0 0 "[ . 1 . 2 . 3]" 1
303 1 10 VAL MG2 1 69 ALA HA . . 7.600 3.653 2.633 5.293 . 0 0 "[ . 1 . 2 . 3]" 1
304 1 10 VAL MG2 1 69 ALA MB . . 8.600 3.158 2.122 5.264 . 0 0 "[ . 1 . 2 . 3]" 1
305 1 11 ARG H 1 11 ARG HD2 . . 6.300 4.956 3.361 5.864 . 0 0 "[ . 1 . 2 . 3]" 1
306 1 11 ARG H 1 11 ARG QD . . 6.040 4.324 3.268 5.050 . 0 0 "[ . 1 . 2 . 3]" 1
307 1 11 ARG H 1 11 ARG HD3 . . 6.300 4.869 3.895 6.039 . 0 0 "[ . 1 . 2 . 3]" 1
308 1 11 ARG H 1 11 ARG HG2 . . 5.100 3.351 1.972 4.462 . 0 0 "[ . 1 . 2 . 3]" 1
309 1 11 ARG H 1 11 ARG QG . . 4.920 2.760 1.910 3.764 . 0 0 "[ . 1 . 2 . 3]" 1
310 1 11 ARG H 1 11 ARG HG3 . . 5.100 3.212 2.108 4.652 . 0 0 "[ . 1 . 2 . 3]" 1
311 1 11 ARG H 1 12 GLY H . . 6.600 4.370 3.439 4.609 . 0 0 "[ . 1 . 2 . 3]" 1
312 1 11 ARG H 1 13 MET H . . 6.600 4.738 3.856 5.984 . 0 0 "[ . 1 . 2 . 3]" 1
313 1 11 ARG H 1 22 ILE MD . . 7.600 5.714 5.014 6.356 . 0 0 "[ . 1 . 2 . 3]" 1
314 1 11 ARG H 1 67 PHE HA . . 6.600 5.227 4.494 6.611 0.011 28 0 "[ . 1 . 2 . 3]" 1
315 1 11 ARG H 1 67 PHE HB2 . . 6.600 5.271 4.222 6.603 0.003 28 0 "[ . 1 . 2 . 3]" 1
316 1 11 ARG H 1 67 PHE HB3 . . 6.600 3.988 3.204 5.252 . 0 0 "[ . 1 . 2 . 3]" 1
317 1 11 ARG H 1 67 PHE QD . . 8.600 5.678 4.785 6.816 . 0 0 "[ . 1 . 2 . 3]" 1
318 1 11 ARG H 1 68 GLU H . . 5.000 3.136 2.716 4.391 . 0 0 "[ . 1 . 2 . 3]" 1
319 1 11 ARG H 1 68 GLU HB2 . . 6.600 3.987 2.660 5.556 . 0 0 "[ . 1 . 2 . 3]" 1
320 1 11 ARG H 1 68 GLU HB3 . . 6.600 4.127 2.330 6.589 . 0 0 "[ . 1 . 2 . 3]" 1
321 1 11 ARG H 1 68 GLU HG2 . . 6.600 5.208 3.572 6.622 0.022 16 0 "[ . 1 . 2 . 3]" 1
322 1 11 ARG H 1 68 GLU HG3 . . 6.600 4.941 2.389 6.375 . 0 0 "[ . 1 . 2 . 3]" 1
323 1 11 ARG H 1 69 ALA HA . . 5.800 3.279 2.343 3.630 . 0 0 "[ . 1 . 2 . 3]" 1
324 1 11 ARG H 1 69 ALA MB . . 7.600 4.324 3.692 4.801 . 0 0 "[ . 1 . 2 . 3]" 1
325 1 11 ARG HA 1 13 MET H . . 5.800 3.474 2.587 5.508 . 0 0 "[ . 1 . 2 . 3]" 1
326 1 11 ARG HA 1 13 MET ME . . 7.600 4.399 2.858 6.333 . 0 0 "[ . 1 . 2 . 3]" 1
327 1 11 ARG HA 1 42 ASN HB2 . . 6.600 4.993 2.443 6.335 . 0 0 "[ . 1 . 2 . 3]" 1
328 1 11 ARG HA 1 42 ASN HB3 . . 6.600 3.679 2.690 5.102 . 0 0 "[ . 1 . 2 . 3]" 1
329 1 11 ARG HA 1 42 ASN HD21 . . 6.600 4.609 2.465 6.250 . 0 0 "[ . 1 . 2 . 3]" 1
330 1 11 ARG HA 1 42 ASN HD22 . . 6.600 5.205 3.257 6.635 0.035 16 0 "[ . 1 . 2 . 3]" 1
331 1 11 ARG QB 1 13 MET H . . 7.480 4.715 3.997 6.049 . 0 0 "[ . 1 . 2 . 3]" 1
332 1 11 ARG QB 1 42 ASN QB . . 8.350 4.369 3.090 5.459 . 0 0 "[ . 1 . 2 . 3]" 1
333 1 11 ARG QB 1 42 ASN QD . . 8.340 5.317 3.277 6.641 . 0 0 "[ . 1 . 2 . 3]" 1
334 1 11 ARG QB 1 68 GLU H . . 6.100 3.903 2.924 5.152 . 0 0 "[ . 1 . 2 . 3]" 1
335 1 11 ARG QB 1 68 GLU QB . . 7.420 2.790 2.042 5.313 . 0 0 "[ . 1 . 2 . 3]" 1
336 1 11 ARG HB2 1 12 GLY H . . 6.400 3.592 2.265 4.774 . 0 0 "[ . 1 . 2 . 3]" 1
337 1 11 ARG HB2 1 68 GLU H . . 6.600 4.175 3.092 5.547 . 0 0 "[ . 1 . 2 . 3]" 1
338 1 11 ARG HB2 1 68 GLU HB2 . . 8.350 3.610 2.114 6.027 . 0 0 "[ . 1 . 2 . 3]" 1
339 1 11 ARG HB2 1 68 GLU HB3 . . 8.350 3.865 2.138 6.855 . 0 0 "[ . 1 . 2 . 3]" 1
340 1 11 ARG HB2 1 69 ALA HA . . 6.600 5.306 4.272 6.659 0.059 30 0 "[ . 1 . 2 . 3]" 1
341 1 11 ARG HB3 1 12 GLY H . . 6.400 3.131 2.230 4.702 . 0 0 "[ . 1 . 2 . 3]" 1
342 1 11 ARG HB3 1 68 GLU H . . 6.600 4.916 3.050 6.276 . 0 0 "[ . 1 . 2 . 3]" 1
343 1 11 ARG HB3 1 68 GLU HB2 . . 8.350 4.568 2.173 6.830 . 0 0 "[ . 1 . 2 . 3]" 1
344 1 11 ARG HB3 1 68 GLU HB3 . . 8.350 4.788 2.480 7.908 . 0 0 "[ . 1 . 2 . 3]" 1
345 1 11 ARG HB3 1 69 ALA HA . . 6.600 6.115 4.544 6.672 0.072 5 0 "[ . 1 . 2 . 3]" 1
346 1 11 ARG QD 1 12 GLY H . . 7.480 4.593 1.940 6.031 . 0 0 "[ . 1 . 2 . 3]" 1
347 1 11 ARG QD 1 68 GLU QB . . 7.420 3.860 2.154 5.913 . 0 0 "[ . 1 . 2 . 3]" 1
348 1 11 ARG QD 1 68 GLU QG . . 8.350 4.326 2.399 5.913 . 0 0 "[ . 1 . 2 . 3]" 1
349 1 11 ARG HD2 1 68 GLU HB2 . . 8.350 5.319 2.421 7.714 . 0 0 "[ . 1 . 2 . 3]" 1
350 1 11 ARG HD2 1 68 GLU HB3 . . 8.350 5.377 2.257 8.162 . 0 0 "[ . 1 . 2 . 3]" 1
351 1 11 ARG HD3 1 68 GLU HB2 . . 8.350 5.109 3.163 7.884 . 0 0 "[ . 1 . 2 . 3]" 1
352 1 11 ARG HD3 1 68 GLU HB3 . . 8.350 5.185 2.363 7.791 . 0 0 "[ . 1 . 2 . 3]" 1
353 1 11 ARG HG2 1 12 GLY H . . 6.600 4.484 3.517 5.225 . 0 0 "[ . 1 . 2 . 3]" 1
354 1 11 ARG HG2 1 68 GLU H . . 6.600 5.536 2.875 6.595 . 0 0 "[ . 1 . 2 . 3]" 1
355 1 11 ARG HG2 1 69 ALA HA . . 6.600 5.279 2.551 6.646 0.046 3 0 "[ . 1 . 2 . 3]" 1
356 1 11 ARG HG3 1 12 GLY H . . 6.600 4.722 3.379 6.027 . 0 0 "[ . 1 . 2 . 3]" 1
357 1 11 ARG HG3 1 68 GLU H . . 6.600 5.014 3.294 6.567 . 0 0 "[ . 1 . 2 . 3]" 1
358 1 11 ARG HG3 1 69 ALA HA . . 6.600 4.916 3.412 6.527 . 0 0 "[ . 1 . 2 . 3]" 1
359 1 12 GLY H 1 13 MET H . . 5.100 2.745 1.919 4.312 . 0 0 "[ . 1 . 2 . 3]" 1
360 1 12 GLY H 1 13 MET HA . . 6.600 5.135 4.444 5.982 . 0 0 "[ . 1 . 2 . 3]" 1
361 1 12 GLY H 1 13 MET HG2 . . 6.600 5.507 3.242 6.606 0.006 25 0 "[ . 1 . 2 . 3]" 1
362 1 12 GLY H 1 13 MET HG3 . . 6.600 4.904 3.206 6.619 0.019 3 0 "[ . 1 . 2 . 3]" 1
363 1 12 GLY H 1 14 THR MG . . 7.600 6.096 4.764 6.370 . 0 0 "[ . 1 . 2 . 3]" 1
364 1 12 GLY H 1 67 PHE QD . . 8.600 4.932 4.594 5.860 . 0 0 "[ . 1 . 2 . 3]" 1
365 1 12 GLY QA 1 67 PHE QD . . 9.600 2.523 2.194 3.468 . 0 0 "[ . 1 . 2 . 3]" 1
366 1 12 GLY QA 1 67 PHE QE . . 9.600 4.185 3.668 5.267 . 0 0 "[ . 1 . 2 . 3]" 1
367 1 12 GLY QA 1 68 GLU H . . 7.600 3.377 2.323 4.019 . 0 0 "[ . 1 . 2 . 3]" 1
368 1 13 MET H 1 13 MET ME . . 5.400 4.055 2.379 4.560 . 0 0 "[ . 1 . 2 . 3]" 1
369 1 13 MET H 1 13 MET HG2 . . 4.300 3.257 2.028 4.315 0.015 30 0 "[ . 1 . 2 . 3]" 1
370 1 13 MET H 1 13 MET QG . . 4.110 2.519 1.977 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
371 1 13 MET H 1 13 MET HG3 . . 4.300 2.852 1.988 4.234 . 0 0 "[ . 1 . 2 . 3]" 1
372 1 13 MET H 1 14 THR H . . 6.600 3.869 2.857 4.596 . 0 0 "[ . 1 . 2 . 3]" 1
373 1 13 MET H 1 14 THR HA . . 6.600 5.042 4.680 5.558 . 0 0 "[ . 1 . 2 . 3]" 1
374 1 13 MET H 1 14 THR MG . . 7.600 5.353 4.370 5.674 . 0 0 "[ . 1 . 2 . 3]" 1
375 1 13 MET H 1 15 CYS H . . 6.600 5.875 5.225 6.648 0.048 16 0 "[ . 1 . 2 . 3]" 1
376 1 13 MET H 1 18 CYS QB . . 7.480 4.478 3.135 5.128 . 0 0 "[ . 1 . 2 . 3]" 1
377 1 13 MET H 1 22 ILE MD . . 7.600 4.363 3.349 5.301 . 0 0 "[ . 1 . 2 . 3]" 1
378 1 13 MET H 1 42 ASN QD . . 7.470 5.298 3.586 6.701 . 0 0 "[ . 1 . 2 . 3]" 1
379 1 13 MET H 1 67 PHE HB2 . . 6.600 5.610 4.550 6.615 0.015 14 0 "[ . 1 . 2 . 3]" 1
380 1 13 MET H 1 67 PHE HB3 . . 6.600 4.009 2.930 4.956 . 0 0 "[ . 1 . 2 . 3]" 1
381 1 13 MET H 1 67 PHE QD . . 8.600 3.519 2.062 4.801 . 0 0 "[ . 1 . 2 . 3]" 1
382 1 13 MET H 1 67 PHE QE . . 8.600 4.512 2.893 5.316 . 0 0 "[ . 1 . 2 . 3]" 1
383 1 13 MET HA 1 14 THR MG . . 7.600 3.956 3.266 4.522 . 0 0 "[ . 1 . 2 . 3]" 1
384 1 13 MET HA 1 15 CYS H . . 5.800 3.764 3.293 4.422 . 0 0 "[ . 1 . 2 . 3]" 1
385 1 13 MET HA 1 18 CYS HB2 . . 6.600 2.749 2.237 4.149 . 0 0 "[ . 1 . 2 . 3]" 1
386 1 13 MET HA 1 18 CYS HB3 . . 6.600 2.452 2.159 3.774 . 0 0 "[ . 1 . 2 . 3]" 1
387 1 13 MET HA 1 67 PHE QE . . 8.600 2.877 2.415 3.927 . 0 0 "[ . 1 . 2 . 3]" 1
388 1 13 MET HA 1 67 PHE HZ . . 6.600 4.132 3.253 4.878 . 0 0 "[ . 1 . 2 . 3]" 1
389 1 13 MET QB 1 18 CYS QB . . 8.350 2.585 1.964 3.672 . 0 0 "[ . 1 . 2 . 3]" 1
390 1 13 MET QB 1 22 ILE MD . . 8.480 3.008 1.943 4.171 . 0 0 "[ . 1 . 2 . 3]" 1
391 1 13 MET QB 1 67 PHE QE . . 9.480 4.305 2.979 5.489 . 0 0 "[ . 1 . 2 . 3]" 1
392 1 13 MET QB 1 67 PHE HZ . . 7.480 5.006 3.412 6.431 . 0 0 "[ . 1 . 2 . 3]" 1
393 1 13 MET HB2 1 14 THR H . . 6.600 4.287 3.284 4.661 . 0 0 "[ . 1 . 2 . 3]" 1
394 1 13 MET HB2 1 67 PHE QD . . 8.600 5.045 3.410 6.483 . 0 0 "[ . 1 . 2 . 3]" 1
395 1 13 MET HB3 1 14 THR H . . 6.600 4.324 3.767 4.633 . 0 0 "[ . 1 . 2 . 3]" 1
396 1 13 MET HB3 1 67 PHE QD . . 8.600 4.831 2.790 6.464 . 0 0 "[ . 1 . 2 . 3]" 1
397 1 13 MET ME 1 15 CYS H . . 7.600 5.831 4.712 6.363 . 0 0 "[ . 1 . 2 . 3]" 1
398 1 13 MET ME 1 19 VAL QG . . 10.160 2.821 1.988 3.785 . 0 0 "[ . 1 . 2 . 3]" 1
399 1 13 MET ME 1 22 ILE MD . . 8.600 3.358 2.132 4.450 . 0 0 "[ . 1 . 2 . 3]" 1
400 1 13 MET ME 1 22 ILE QG . . 8.480 5.187 4.121 6.302 . 0 0 "[ . 1 . 2 . 3]" 1
401 1 13 MET ME 1 37 VAL HA . . 7.600 4.124 3.271 6.358 . 0 0 "[ . 1 . 2 . 3]" 1
402 1 13 MET ME 1 37 VAL QG . . 10.160 2.850 1.918 4.914 . 0 0 "[ . 1 . 2 . 3]" 1
403 1 13 MET ME 1 38 ALA H . . 7.600 2.851 2.121 4.892 . 0 0 "[ . 1 . 2 . 3]" 1
404 1 13 MET ME 1 39 LEU H . . 7.600 3.408 2.332 4.374 . 0 0 "[ . 1 . 2 . 3]" 1
405 1 13 MET ME 1 39 LEU HA . . 7.600 2.397 2.022 3.630 . 0 0 "[ . 1 . 2 . 3]" 1
406 1 13 MET ME 1 41 THR H . . 7.600 5.156 4.319 5.883 . 0 0 "[ . 1 . 2 . 3]" 1
407 1 13 MET ME 1 42 ASN H . . 7.600 3.998 3.417 4.576 . 0 0 "[ . 1 . 2 . 3]" 1
408 1 13 MET ME 1 42 ASN HA . . 7.600 2.682 2.090 3.770 . 0 0 "[ . 1 . 2 . 3]" 1
409 1 13 MET ME 1 42 ASN HB2 . . 7.600 4.937 3.850 6.344 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 13 MET ME 1 42 ASN HB3 . . 7.600 4.043 2.890 5.558 . 0 0 "[ . 1 . 2 . 3]" 1
411 1 13 MET ME 1 42 ASN HD21 . . 7.600 3.639 2.254 6.225 . 0 0 "[ . 1 . 2 . 3]" 1
412 1 13 MET ME 1 42 ASN HD22 . . 7.600 4.412 2.689 6.375 . 0 0 "[ . 1 . 2 . 3]" 1
413 1 13 MET ME 1 43 LYS H . . 7.600 3.103 2.258 4.220 . 0 0 "[ . 1 . 2 . 3]" 1
414 1 13 MET ME 1 43 LYS HA . . 7.600 4.534 3.507 5.765 . 0 0 "[ . 1 . 2 . 3]" 1
415 1 13 MET ME 1 44 ALA MB . . 8.600 4.120 2.718 5.671 . 0 0 "[ . 1 . 2 . 3]" 1
416 1 13 MET ME 1 67 PHE QD . . 9.600 5.756 5.026 6.602 . 0 0 "[ . 1 . 2 . 3]" 1
417 1 13 MET ME 1 67 PHE QE . . 9.600 6.053 5.118 6.603 . 0 0 "[ . 1 . 2 . 3]" 1
418 1 13 MET QG 1 15 CYS H . . 7.380 4.878 3.514 5.624 . 0 0 "[ . 1 . 2 . 3]" 1
419 1 13 MET QG 1 18 CYS H . . 7.480 5.691 4.278 6.398 . 0 0 "[ . 1 . 2 . 3]" 1
420 1 13 MET QG 1 19 VAL H . . 7.480 4.514 3.068 5.621 . 0 0 "[ . 1 . 2 . 3]" 1
421 1 13 MET QG 1 37 VAL QG . . 10.040 3.911 2.757 4.747 . 0 0 "[ . 1 . 2 . 3]" 1
422 1 13 MET QG 1 39 LEU QD . . 8.330 4.282 2.132 5.519 . 0 0 "[ . 1 . 2 . 3]" 1
423 1 13 MET HG2 1 14 THR H . . 6.600 4.866 2.354 5.984 . 0 0 "[ . 1 . 2 . 3]" 1
424 1 13 MET HG2 1 22 ILE MD . . 7.600 2.739 2.019 3.785 . 0 0 "[ . 1 . 2 . 3]" 1
425 1 13 MET HG2 1 39 LEU MD1 . . 9.350 6.636 5.201 7.615 . 0 0 "[ . 1 . 2 . 3]" 1
426 1 13 MET HG2 1 39 LEU MD2 . . 9.350 5.078 3.145 6.991 . 0 0 "[ . 1 . 2 . 3]" 1
427 1 13 MET HG2 1 67 PHE QD . . 8.600 4.689 3.346 6.183 . 0 0 "[ . 1 . 2 . 3]" 1
428 1 13 MET HG2 1 67 PHE QE . . 8.600 4.809 3.344 5.923 . 0 0 "[ . 1 . 2 . 3]" 1
429 1 13 MET HG2 1 67 PHE HZ . . 6.600 5.536 3.830 6.639 0.039 7 0 "[ . 1 . 2 . 3]" 1
430 1 13 MET HG3 1 14 THR H . . 6.600 4.941 2.403 5.909 . 0 0 "[ . 1 . 2 . 3]" 1
431 1 13 MET HG3 1 22 ILE MD . . 7.600 3.097 2.055 4.186 . 0 0 "[ . 1 . 2 . 3]" 1
432 1 13 MET HG3 1 39 LEU MD1 . . 9.350 6.650 4.216 7.787 . 0 0 "[ . 1 . 2 . 3]" 1
433 1 13 MET HG3 1 39 LEU MD2 . . 9.350 5.240 2.166 7.311 . 0 0 "[ . 1 . 2 . 3]" 1
434 1 13 MET HG3 1 67 PHE QD . . 8.600 4.670 3.377 6.236 . 0 0 "[ . 1 . 2 . 3]" 1
435 1 13 MET HG3 1 67 PHE QE . . 8.600 5.099 3.840 5.956 . 0 0 "[ . 1 . 2 . 3]" 1
436 1 13 MET HG3 1 67 PHE HZ . . 6.600 6.049 4.587 6.648 0.048 29 0 "[ . 1 . 2 . 3]" 1
437 1 14 THR H 1 15 CYS H . . 4.000 2.953 2.445 3.890 . 0 0 "[ . 1 . 2 . 3]" 1
438 1 14 THR H 1 15 CYS QB . . 7.080 5.235 4.622 5.892 . 0 0 "[ . 1 . 2 . 3]" 1
439 1 14 THR H 1 18 CYS H . . 6.600 5.278 4.562 6.633 0.033 17 0 "[ . 1 . 2 . 3]" 1
440 1 14 THR H 1 18 CYS HB2 . . 6.600 3.591 2.578 4.620 . 0 0 "[ . 1 . 2 . 3]" 1
441 1 14 THR H 1 18 CYS HB3 . . 6.600 3.946 3.003 5.363 . 0 0 "[ . 1 . 2 . 3]" 1
442 1 14 THR H 1 39 LEU QD . . 9.170 4.930 4.033 6.503 . 0 0 "[ . 1 . 2 . 3]" 1
443 1 14 THR H 1 67 PHE HA . . 6.600 6.621 6.519 6.659 0.059 21 0 "[ . 1 . 2 . 3]" 1
444 1 14 THR H 1 67 PHE QE . . 8.600 3.579 3.010 5.552 . 0 0 "[ . 1 . 2 . 3]" 1
445 1 14 THR H 1 67 PHE HZ . . 6.600 5.335 4.620 6.655 0.055 17 0 "[ . 1 . 2 . 3]" 1
446 1 14 THR HA 1 39 LEU QD . . 9.170 3.928 2.909 5.402 . 0 0 "[ . 1 . 2 . 3]" 1
447 1 14 THR HA 1 42 ASN QD . . 7.470 5.807 3.911 6.686 . 0 0 "[ . 1 . 2 . 3]" 1
448 1 14 THR HB 1 15 CYS H . . 5.700 4.308 3.203 4.686 . 0 0 "[ . 1 . 2 . 3]" 1
449 1 14 THR MG 1 15 CYS H . . 7.600 3.033 2.195 4.313 . 0 0 "[ . 1 . 2 . 3]" 1
450 1 14 THR MG 1 15 CYS QB . . 8.480 3.222 2.423 5.068 . 0 0 "[ . 1 . 2 . 3]" 1
451 1 14 THR MG 1 67 PHE QE . . 9.600 3.992 3.233 4.731 . 0 0 "[ . 1 . 2 . 3]" 1
452 1 14 THR MG 1 67 PHE HZ . . 7.600 5.447 4.625 6.613 . 0 0 "[ . 1 . 2 . 3]" 1
453 1 15 CYS H 1 17 SER H . . 6.600 4.686 4.514 5.075 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 15 CYS H 1 18 CYS H . . 6.100 3.144 2.993 3.622 . 0 0 "[ . 1 . 2 . 3]" 1
455 1 15 CYS H 1 18 CYS HA . . 6.600 4.999 4.737 5.680 . 0 0 "[ . 1 . 2 . 3]" 1
456 1 15 CYS H 1 18 CYS HB2 . . 6.200 2.535 2.188 3.239 . 0 0 "[ . 1 . 2 . 3]" 1
457 1 15 CYS H 1 18 CYS QB . . 5.790 2.507 2.175 3.157 . 0 0 "[ . 1 . 2 . 3]" 1
458 1 15 CYS H 1 18 CYS HB3 . . 6.200 4.016 3.779 4.608 . 0 0 "[ . 1 . 2 . 3]" 1
459 1 15 CYS H 1 19 VAL H . . 6.600 3.987 3.467 5.415 . 0 0 "[ . 1 . 2 . 3]" 1
460 1 15 CYS H 1 39 LEU QD . . 8.470 3.442 2.800 5.419 . 0 0 "[ . 1 . 2 . 3]" 1
461 1 15 CYS H 1 39 LEU HG . . 6.600 6.102 5.384 6.646 0.046 17 0 "[ . 1 . 2 . 3]" 1
462 1 15 CYS H 1 67 PHE QE . . 8.600 5.261 4.981 5.853 . 0 0 "[ . 1 . 2 . 3]" 1
463 1 15 CYS HA 1 16 ALA HA . . 6.600 4.345 4.289 4.393 . 0 0 "[ . 1 . 2 . 3]" 1
464 1 15 CYS HA 1 16 ALA MB . . 7.600 4.224 4.104 4.300 . 0 0 "[ . 1 . 2 . 3]" 1
465 1 15 CYS HA 1 17 SER H . . 6.600 4.448 4.211 4.592 . 0 0 "[ . 1 . 2 . 3]" 1
466 1 15 CYS HA 1 18 CYS H . . 6.600 4.601 4.437 4.864 . 0 0 "[ . 1 . 2 . 3]" 1
467 1 15 CYS HA 1 39 LEU MD1 . . 7.600 4.171 2.586 5.657 . 0 0 "[ . 1 . 2 . 3]" 1
468 1 15 CYS HA 1 39 LEU MD2 . . 7.600 2.556 2.123 4.837 . 0 0 "[ . 1 . 2 . 3]" 1
469 1 15 CYS QB 1 16 ALA MB . . 8.480 3.621 3.527 3.749 . 0 0 "[ . 1 . 2 . 3]" 1
470 1 15 CYS QB 1 18 CYS H . . 6.150 4.149 3.538 4.508 . 0 0 "[ . 1 . 2 . 3]" 1
471 1 15 CYS HB2 1 17 SER H . . 6.600 3.205 2.415 3.568 . 0 0 "[ . 1 . 2 . 3]" 1
472 1 15 CYS HB2 1 18 CYS H . . 6.600 4.491 3.640 4.841 . 0 0 "[ . 1 . 2 . 3]" 1
473 1 15 CYS HB3 1 17 SER H . . 6.600 4.472 4.155 4.769 . 0 0 "[ . 1 . 2 . 3]" 1
474 1 15 CYS HB3 1 18 CYS H . . 6.600 4.909 4.703 5.373 . 0 0 "[ . 1 . 2 . 3]" 1
475 1 16 ALA HA 1 19 VAL H . . 5.600 3.296 3.034 3.673 . 0 0 "[ . 1 . 2 . 3]" 1
476 1 16 ALA HA 1 19 VAL HB . . 6.600 2.378 2.171 3.978 . 0 0 "[ . 1 . 2 . 3]" 1
477 1 16 ALA HA 1 19 VAL MG1 . . 7.600 3.694 3.375 4.935 . 0 0 "[ . 1 . 2 . 3]" 1
478 1 16 ALA HA 1 19 VAL MG2 . . 7.600 2.725 2.432 3.080 . 0 0 "[ . 1 . 2 . 3]" 1
479 1 16 ALA HA 1 20 HIS H . . 6.500 3.812 3.554 5.451 . 0 0 "[ . 1 . 2 . 3]" 1
480 1 16 ALA MB 1 17 SER H . . 4.300 2.550 2.399 2.691 . 0 0 "[ . 1 . 2 . 3]" 1
481 1 16 ALA MB 1 18 CYS H . . 5.900 4.458 4.332 4.590 . 0 0 "[ . 1 . 2 . 3]" 1
482 1 16 ALA MB 1 19 VAL H . . 5.800 4.547 4.387 4.729 . 0 0 "[ . 1 . 2 . 3]" 1
483 1 16 ALA MB 1 19 VAL QG . . 10.160 3.670 3.438 3.868 . 0 0 "[ . 1 . 2 . 3]" 1
484 1 16 ALA MB 1 20 HIS H . . 6.400 4.199 3.883 5.184 . 0 0 "[ . 1 . 2 . 3]" 1
485 1 16 ALA MB 1 20 HIS HD2 . . 7.600 4.594 4.136 5.841 . 0 0 "[ . 1 . 2 . 3]" 1
486 1 16 ALA MB 1 20 HIS HE1 . . 7.600 6.311 5.657 6.367 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 17 SER H 1 18 CYS H . . 4.600 2.803 2.698 2.970 . 0 0 "[ . 1 . 2 . 3]" 1
488 1 17 SER H 1 18 CYS QB . . 7.480 4.922 4.807 5.072 . 0 0 "[ . 1 . 2 . 3]" 1
489 1 17 SER H 1 19 VAL H . . 6.600 4.314 4.092 4.566 . 0 0 "[ . 1 . 2 . 3]" 1
490 1 17 SER H 1 19 VAL HB . . 6.600 5.098 4.873 5.699 . 0 0 "[ . 1 . 2 . 3]" 1
491 1 17 SER H 1 19 VAL QG . . 9.160 4.790 4.629 4.928 . 0 0 "[ . 1 . 2 . 3]" 1
492 1 17 SER H 1 39 LEU QD . . 9.170 5.010 4.624 6.645 . 0 0 "[ . 1 . 2 . 3]" 1
493 1 17 SER HA 1 19 VAL H . . 6.600 4.733 4.103 4.995 . 0 0 "[ . 1 . 2 . 3]" 1
494 1 17 SER HA 1 19 VAL HB . . 6.600 5.356 4.944 5.782 . 0 0 "[ . 1 . 2 . 3]" 1
495 1 17 SER HA 1 20 HIS H . . 6.600 4.049 3.854 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
496 1 17 SER HA 1 20 HIS QB . . 7.480 4.751 4.510 5.050 . 0 0 "[ . 1 . 2 . 3]" 1
497 1 17 SER HA 1 20 HIS HD2 . . 6.600 2.452 2.174 3.599 . 0 0 "[ . 1 . 2 . 3]" 1
498 1 17 SER HA 1 20 HIS HE1 . . 6.600 4.715 4.112 5.131 . 0 0 "[ . 1 . 2 . 3]" 1
499 1 17 SER QB 1 19 VAL QG . . 10.040 5.594 5.399 5.821 . 0 0 "[ . 1 . 2 . 3]" 1
500 1 17 SER QB 1 20 HIS QB . . 8.350 6.260 6.060 6.561 . 0 0 "[ . 1 . 2 . 3]" 1
501 1 17 SER HB2 1 18 CYS H . . 4.800 3.266 2.608 4.110 . 0 0 "[ . 1 . 2 . 3]" 1
502 1 17 SER HB2 1 20 HIS HD2 . . 6.600 5.028 4.282 5.909 . 0 0 "[ . 1 . 2 . 3]" 1
503 1 17 SER HB3 1 18 CYS H . . 4.800 3.764 2.645 4.279 . 0 0 "[ . 1 . 2 . 3]" 1
504 1 17 SER HB3 1 20 HIS HD2 . . 6.600 4.657 4.276 5.213 . 0 0 "[ . 1 . 2 . 3]" 1
505 1 17 SER HG 1 18 CYS H . . 6.600 4.607 2.901 4.891 . 0 0 "[ . 1 . 2 . 3]" 1
506 1 18 CYS H 1 19 VAL H . . 4.300 2.457 2.336 2.753 . 0 0 "[ . 1 . 2 . 3]" 1
507 1 18 CYS H 1 19 VAL HA . . 6.600 5.085 5.002 5.306 . 0 0 "[ . 1 . 2 . 3]" 1
508 1 18 CYS H 1 19 VAL HB . . 5.700 4.502 4.213 5.009 . 0 0 "[ . 1 . 2 . 3]" 1
509 1 18 CYS H 1 19 VAL MG1 . . 7.600 5.672 5.501 6.014 . 0 0 "[ . 1 . 2 . 3]" 1
510 1 18 CYS H 1 19 VAL MG2 . . 7.600 3.880 3.646 4.099 . 0 0 "[ . 1 . 2 . 3]" 1
511 1 18 CYS H 1 20 HIS H . . 6.300 4.448 4.274 5.067 . 0 0 "[ . 1 . 2 . 3]" 1
512 1 18 CYS H 1 21 LYS H . . 6.600 4.755 4.583 4.960 . 0 0 "[ . 1 . 2 . 3]" 1
513 1 18 CYS H 1 22 ILE QG . . 7.480 5.994 5.746 6.672 . 0 0 "[ . 1 . 2 . 3]" 1
514 1 18 CYS H 1 39 LEU QD . . 9.170 4.659 4.108 6.460 . 0 0 "[ . 1 . 2 . 3]" 1
515 1 18 CYS HA 1 19 VAL MG1 . . 7.600 6.214 6.114 6.270 . 0 0 "[ . 1 . 2 . 3]" 1
516 1 18 CYS HA 1 19 VAL MG2 . . 7.600 5.056 4.831 5.157 . 0 0 "[ . 1 . 2 . 3]" 1
517 1 18 CYS HA 1 20 HIS QB . . 7.480 6.620 6.426 6.713 . 0 0 "[ . 1 . 2 . 3]" 1
518 1 18 CYS HA 1 21 LYS H . . 5.800 3.676 3.304 3.853 . 0 0 "[ . 1 . 2 . 3]" 1
519 1 18 CYS HA 1 21 LYS HB2 . . 6.600 3.580 2.406 4.085 . 0 0 "[ . 1 . 2 . 3]" 1
520 1 18 CYS HA 1 21 LYS HB3 . . 6.600 2.601 2.110 3.280 . 0 0 "[ . 1 . 2 . 3]" 1
521 1 18 CYS HA 1 21 LYS QD . . 7.600 3.364 2.210 5.646 . 0 0 "[ . 1 . 2 . 3]" 1
522 1 18 CYS HA 1 21 LYS HG2 . . 6.600 4.525 3.696 5.226 . 0 0 "[ . 1 . 2 . 3]" 1
523 1 18 CYS HA 1 21 LYS HG3 . . 6.600 5.145 4.324 5.710 . 0 0 "[ . 1 . 2 . 3]" 1
524 1 18 CYS HA 1 22 ILE H . . 6.600 3.952 3.525 4.794 . 0 0 "[ . 1 . 2 . 3]" 1
525 1 18 CYS HA 1 22 ILE HB . . 6.600 5.660 5.047 6.630 0.030 25 0 "[ . 1 . 2 . 3]" 1
526 1 18 CYS HA 1 22 ILE MD . . 7.600 4.355 3.590 5.514 . 0 0 "[ . 1 . 2 . 3]" 1
527 1 18 CYS HA 1 22 ILE QG . . 7.480 3.846 3.372 4.735 . 0 0 "[ . 1 . 2 . 3]" 1
528 1 18 CYS HA 1 67 PHE QD . . 8.600 5.652 5.386 6.058 . 0 0 "[ . 1 . 2 . 3]" 1
529 1 18 CYS HA 1 67 PHE QE . . 8.600 3.772 3.448 4.181 . 0 0 "[ . 1 . 2 . 3]" 1
530 1 18 CYS HA 1 67 PHE HZ . . 6.600 2.679 2.326 3.430 . 0 0 "[ . 1 . 2 . 3]" 1
531 1 18 CYS QB 1 19 VAL H . . 4.980 2.407 2.169 2.862 . 0 0 "[ . 1 . 2 . 3]" 1
532 1 18 CYS QB 1 19 VAL HB . . 7.480 4.675 4.306 5.121 . 0 0 "[ . 1 . 2 . 3]" 1
533 1 18 CYS QB 1 19 VAL QG . . 10.040 3.117 2.592 3.622 . 0 0 "[ . 1 . 2 . 3]" 1
534 1 18 CYS QB 1 20 HIS H . . 7.480 5.034 4.821 5.328 . 0 0 "[ . 1 . 2 . 3]" 1
535 1 18 CYS QB 1 39 LEU QD . . 10.050 4.026 3.375 5.708 . 0 0 "[ . 1 . 2 . 3]" 1
536 1 18 CYS HB2 1 19 VAL H . . 5.300 2.452 2.199 2.942 . 0 0 "[ . 1 . 2 . 3]" 1
537 1 18 CYS HB2 1 22 ILE MD . . 7.600 4.152 3.461 5.287 . 0 0 "[ . 1 . 2 . 3]" 1
538 1 18 CYS HB2 1 67 PHE QD . . 8.600 5.554 5.291 5.921 . 0 0 "[ . 1 . 2 . 3]" 1
539 1 18 CYS HB2 1 67 PHE QE . . 8.600 4.115 3.767 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
540 1 18 CYS HB2 1 67 PHE HZ . . 6.600 4.138 3.861 4.464 . 0 0 "[ . 1 . 2 . 3]" 1
541 1 18 CYS HB3 1 19 VAL H . . 5.300 3.530 3.309 3.915 . 0 0 "[ . 1 . 2 . 3]" 1
542 1 18 CYS HB3 1 22 ILE MD . . 7.600 3.177 2.379 4.408 . 0 0 "[ . 1 . 2 . 3]" 1
543 1 18 CYS HB3 1 67 PHE QD . . 8.600 4.328 4.015 4.652 . 0 0 "[ . 1 . 2 . 3]" 1
544 1 18 CYS HB3 1 67 PHE QE . . 8.600 2.904 2.385 3.410 . 0 0 "[ . 1 . 2 . 3]" 1
545 1 18 CYS HB3 1 67 PHE HZ . . 6.600 2.581 2.328 2.908 . 0 0 "[ . 1 . 2 . 3]" 1
546 1 19 VAL H 1 19 VAL HB . . 3.900 2.524 2.378 2.664 . 0 0 "[ . 1 . 2 . 3]" 1
547 1 19 VAL H 1 19 VAL MG1 . . 4.700 3.787 3.726 3.812 . 0 0 "[ . 1 . 2 . 3]" 1
548 1 19 VAL H 1 19 VAL QG . . 3.980 2.044 1.921 2.175 . 0 0 "[ . 1 . 2 . 3]" 1
549 1 19 VAL H 1 19 VAL MG2 . . 4.700 2.053 1.926 2.188 . 0 0 "[ . 1 . 2 . 3]" 1
550 1 19 VAL H 1 20 HIS H . . 4.500 3.137 2.839 3.285 . 0 0 "[ . 1 . 2 . 3]" 1
551 1 19 VAL H 1 21 LYS H . . 6.600 4.155 3.781 4.402 . 0 0 "[ . 1 . 2 . 3]" 1
552 1 19 VAL H 1 22 ILE HB . . 6.600 5.505 5.068 6.298 . 0 0 "[ . 1 . 2 . 3]" 1
553 1 19 VAL H 1 22 ILE MD . . 7.600 4.461 3.750 5.599 . 0 0 "[ . 1 . 2 . 3]" 1
554 1 19 VAL H 1 37 VAL MG1 . . 7.600 5.816 4.298 6.396 . 0 0 "[ . 1 . 2 . 3]" 1
555 1 19 VAL H 1 37 VAL MG2 . . 7.600 5.097 4.195 6.314 . 0 0 "[ . 1 . 2 . 3]" 1
556 1 19 VAL H 1 39 LEU HG . . 6.600 5.652 4.809 6.409 . 0 0 "[ . 1 . 2 . 3]" 1
557 1 19 VAL HA 1 21 LYS H . . 6.600 4.387 3.959 4.664 . 0 0 "[ . 1 . 2 . 3]" 1
558 1 19 VAL HA 1 22 ILE H . . 6.400 3.846 3.640 4.127 . 0 0 "[ . 1 . 2 . 3]" 1
559 1 19 VAL HA 1 22 ILE MD . . 7.600 2.952 2.425 3.854 . 0 0 "[ . 1 . 2 . 3]" 1
560 1 19 VAL HA 1 22 ILE QG . . 7.480 3.965 3.002 4.484 . 0 0 "[ . 1 . 2 . 3]" 1
561 1 19 VAL HA 1 22 ILE MG . . 7.600 4.581 4.257 5.146 . 0 0 "[ . 1 . 2 . 3]" 1
562 1 19 VAL HA 1 23 GLU H . . 6.600 4.259 3.990 5.180 . 0 0 "[ . 1 . 2 . 3]" 1
563 1 19 VAL HA 1 37 VAL H . . 6.600 6.070 5.195 6.637 0.037 28 0 "[ . 1 . 2 . 3]" 1
564 1 19 VAL HA 1 37 VAL HB . . 6.600 4.167 3.185 5.699 . 0 0 "[ . 1 . 2 . 3]" 1
565 1 19 VAL HA 1 37 VAL QG . . 9.160 2.574 2.052 3.148 . 0 0 "[ . 1 . 2 . 3]" 1
566 1 19 VAL HA 1 67 PHE QE . . 8.600 5.942 5.380 6.433 . 0 0 "[ . 1 . 2 . 3]" 1
567 1 19 VAL HA 1 67 PHE HZ . . 6.600 6.258 5.568 6.624 0.024 3 0 "[ . 1 . 2 . 3]" 1
568 1 19 VAL HB 1 20 HIS H . . 4.000 2.361 2.104 2.513 . 0 0 "[ . 1 . 2 . 3]" 1
569 1 19 VAL HB 1 20 HIS HA . . 6.600 4.414 4.248 4.561 . 0 0 "[ . 1 . 2 . 3]" 1
570 1 19 VAL HB 1 20 HIS HD2 . . 6.600 4.494 3.196 5.510 . 0 0 "[ . 1 . 2 . 3]" 1
571 1 19 VAL HB 1 39 LEU H . . 6.600 5.493 4.718 6.608 0.008 16 0 "[ . 1 . 2 . 3]" 1
572 1 19 VAL QG 1 20 HIS H . . 7.340 2.939 2.730 3.105 . 0 0 "[ . 1 . 2 . 3]" 1
573 1 19 VAL QG 1 20 HIS QB . . 10.040 3.463 3.165 3.859 . 0 0 "[ . 1 . 2 . 3]" 1
574 1 19 VAL QG 1 21 LYS H . . 9.160 4.469 4.279 4.596 . 0 0 "[ . 1 . 2 . 3]" 1
575 1 19 VAL QG 1 22 ILE H . . 9.160 4.660 4.515 4.882 . 0 0 "[ . 1 . 2 . 3]" 1
576 1 19 VAL QG 1 23 GLU H . . 9.160 4.202 3.900 4.650 . 0 0 "[ . 1 . 2 . 3]" 1
577 1 19 VAL QG 1 37 VAL HA . . 9.160 4.385 3.962 4.881 . 0 0 "[ . 1 . 2 . 3]" 1
578 1 19 VAL QG 1 37 VAL HB . . 9.160 3.251 2.242 4.353 . 0 0 "[ . 1 . 2 . 3]" 1
579 1 19 VAL QG 1 38 ALA HA . . 9.160 2.900 2.322 3.810 . 0 0 "[ . 1 . 2 . 3]" 1
580 1 19 VAL QG 1 38 ALA MB . . 10.160 3.902 3.330 4.636 . 0 0 "[ . 1 . 2 . 3]" 1
581 1 19 VAL QG 1 39 LEU H . . 9.160 2.736 2.043 3.708 . 0 0 "[ . 1 . 2 . 3]" 1
582 1 19 VAL MG1 1 20 HIS H . . 7.600 3.050 2.790 3.279 . 0 0 "[ . 1 . 2 . 3]" 1
583 1 19 VAL MG1 1 20 HIS HA . . 7.600 3.180 2.912 3.423 . 0 0 "[ . 1 . 2 . 3]" 1
584 1 19 VAL MG1 1 20 HIS HD2 . . 7.600 5.078 4.242 5.608 . 0 0 "[ . 1 . 2 . 3]" 1
585 1 19 VAL MG1 1 37 VAL H . . 7.600 3.989 3.418 4.413 . 0 0 "[ . 1 . 2 . 3]" 1
586 1 19 VAL MG1 1 38 ALA H . . 7.600 4.361 3.623 5.186 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 19 VAL MG2 1 20 HIS H . . 7.600 3.874 3.686 3.972 . 0 0 "[ . 1 . 2 . 3]" 1
588 1 19 VAL MG2 1 20 HIS HA . . 7.600 5.368 5.272 5.475 . 0 0 "[ . 1 . 2 . 3]" 1
589 1 19 VAL MG2 1 20 HIS HD2 . . 7.600 5.478 4.533 6.336 . 0 0 "[ . 1 . 2 . 3]" 1
590 1 19 VAL MG2 1 37 VAL H . . 7.600 5.835 5.071 6.359 . 0 0 "[ . 1 . 2 . 3]" 1
591 1 19 VAL MG2 1 38 ALA H . . 7.600 4.552 4.064 5.404 . 0 0 "[ . 1 . 2 . 3]" 1
592 1 20 HIS H 1 20 HIS HD2 . . 6.000 2.420 2.012 3.166 . 0 0 "[ . 1 . 2 . 3]" 1
593 1 20 HIS H 1 21 LYS H . . 4.400 2.687 2.561 2.830 . 0 0 "[ . 1 . 2 . 3]" 1
594 1 20 HIS H 1 21 LYS QB . . 6.880 4.358 4.249 4.464 . 0 0 "[ . 1 . 2 . 3]" 1
595 1 20 HIS H 1 22 ILE H . . 5.000 4.419 4.242 4.665 . 0 0 "[ . 1 . 2 . 3]" 1
596 1 20 HIS H 1 22 ILE HB . . 6.600 5.482 5.304 5.903 . 0 0 "[ . 1 . 2 . 3]" 1
597 1 20 HIS H 1 22 ILE MD . . 7.600 5.673 5.136 6.347 . 0 0 "[ . 1 . 2 . 3]" 1
598 1 20 HIS H 1 23 GLU H . . 6.600 4.948 4.721 5.588 . 0 0 "[ . 1 . 2 . 3]" 1
599 1 20 HIS H 1 23 GLU QB . . 7.480 5.012 4.504 6.413 . 0 0 "[ . 1 . 2 . 3]" 1
600 1 20 HIS H 1 23 GLU QG . . 7.600 5.918 4.285 6.821 . 0 0 "[ . 1 . 2 . 3]" 1
601 1 20 HIS H 1 37 VAL QG . . 9.160 4.466 4.133 4.831 . 0 0 "[ . 1 . 2 . 3]" 1
602 1 20 HIS HA 1 20 HIS HE1 . . 6.600 6.553 6.498 6.615 0.015 25 0 "[ . 1 . 2 . 3]" 1
603 1 20 HIS HA 1 21 LYS HA . . 6.600 4.833 4.760 4.896 . 0 0 "[ . 1 . 2 . 3]" 1
604 1 20 HIS HA 1 22 ILE H . . 6.600 4.388 4.026 4.686 . 0 0 "[ . 1 . 2 . 3]" 1
605 1 20 HIS HA 1 23 GLU H . . 6.300 3.304 2.866 3.886 . 0 0 "[ . 1 . 2 . 3]" 1
606 1 20 HIS HA 1 23 GLU HA . . 6.600 5.212 4.758 5.970 . 0 0 "[ . 1 . 2 . 3]" 1
607 1 20 HIS HA 1 23 GLU HB2 . . 6.600 3.170 2.323 4.792 . 0 0 "[ . 1 . 2 . 3]" 1
608 1 20 HIS HA 1 23 GLU HB3 . . 6.600 3.282 2.310 4.536 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 20 HIS HA 1 24 SER H . . 6.500 3.474 2.456 3.877 . 0 0 "[ . 1 . 2 . 3]" 1
610 1 20 HIS QB 1 21 LYS H . . 5.180 3.759 3.687 3.978 . 0 0 "[ . 1 . 2 . 3]" 1
611 1 20 HIS QB 1 22 ILE H . . 7.480 5.370 5.165 5.538 . 0 0 "[ . 1 . 2 . 3]" 1
612 1 20 HIS QB 1 24 SER H . . 7.480 4.171 3.244 4.485 . 0 0 "[ . 1 . 2 . 3]" 1
613 1 20 HIS HD2 1 21 LYS H . . 6.600 2.316 2.082 3.562 . 0 0 "[ . 1 . 2 . 3]" 1
614 1 20 HIS HD2 1 21 LYS HA . . 6.600 4.225 2.953 5.924 . 0 0 "[ . 1 . 2 . 3]" 1
615 1 20 HIS HD2 1 21 LYS QG . . 7.480 5.266 3.866 6.692 . 0 0 "[ . 1 . 2 . 3]" 1
616 1 20 HIS HD2 1 23 GLU QB . . 7.480 6.150 5.642 6.860 . 0 0 "[ . 1 . 2 . 3]" 1
617 1 20 HIS HD2 1 24 SER H . . 6.600 6.087 5.252 6.542 . 0 0 "[ . 1 . 2 . 3]" 1
618 1 20 HIS HD2 1 24 SER HB2 . . 6.600 6.219 4.488 6.605 0.005 14 0 "[ . 1 . 2 . 3]" 1
619 1 20 HIS HD2 1 24 SER HB3 . . 6.600 6.210 5.024 6.649 0.049 14 0 "[ . 1 . 2 . 3]" 1
620 1 20 HIS HE1 1 21 LYS HA . . 6.600 5.709 5.169 6.323 . 0 0 "[ . 1 . 2 . 3]" 1
621 1 20 HIS HE1 1 24 SER HB2 . . 6.600 6.202 5.467 6.573 . 0 0 "[ . 1 . 2 . 3]" 1
622 1 20 HIS HE1 1 24 SER HB3 . . 6.600 6.502 5.880 6.627 0.027 17 0 "[ . 1 . 2 . 3]" 1
623 1 21 LYS H 1 21 LYS HG2 . . 4.900 4.421 4.303 4.607 . 0 0 "[ . 1 . 2 . 3]" 1
624 1 21 LYS H 1 21 LYS QG . . 4.620 3.964 3.844 4.039 . 0 0 "[ . 1 . 2 . 3]" 1
625 1 21 LYS H 1 21 LYS HG3 . . 4.900 4.492 4.148 4.645 . 0 0 "[ . 1 . 2 . 3]" 1
626 1 21 LYS H 1 22 ILE H . . 4.400 2.609 2.354 2.898 . 0 0 "[ . 1 . 2 . 3]" 1
627 1 21 LYS H 1 22 ILE HA . . 6.300 5.250 5.060 5.476 . 0 0 "[ . 1 . 2 . 3]" 1
628 1 21 LYS H 1 22 ILE MD . . 7.600 5.163 4.541 5.897 . 0 0 "[ . 1 . 2 . 3]" 1
629 1 21 LYS H 1 22 ILE HG12 . . 6.600 6.014 5.096 6.586 . 0 0 "[ . 1 . 2 . 3]" 1
630 1 21 LYS H 1 22 ILE HG13 . . 6.600 4.479 3.844 4.998 . 0 0 "[ . 1 . 2 . 3]" 1
631 1 21 LYS H 1 22 ILE MG . . 7.600 5.827 5.590 6.114 . 0 0 "[ . 1 . 2 . 3]" 1
632 1 21 LYS H 1 23 GLU H . . 6.600 4.237 3.904 4.623 . 0 0 "[ . 1 . 2 . 3]" 1
633 1 21 LYS H 1 23 GLU QB . . 7.480 5.080 4.476 6.068 . 0 0 "[ . 1 . 2 . 3]" 1
634 1 21 LYS H 1 24 SER H . . 6.600 4.724 4.530 4.984 . 0 0 "[ . 1 . 2 . 3]" 1
635 1 21 LYS H 1 67 PHE QE . . 8.600 5.768 4.658 6.401 . 0 0 "[ . 1 . 2 . 3]" 1
636 1 21 LYS HA 1 22 ILE HA . . 6.600 4.850 4.747 4.910 . 0 0 "[ . 1 . 2 . 3]" 1
637 1 21 LYS HA 1 22 ILE HB . . 6.600 5.845 5.690 5.991 . 0 0 "[ . 1 . 2 . 3]" 1
638 1 21 LYS HA 1 23 GLU H . . 6.600 4.869 4.644 5.389 . 0 0 "[ . 1 . 2 . 3]" 1
639 1 21 LYS HA 1 24 SER H . . 6.400 3.878 3.513 4.667 . 0 0 "[ . 1 . 2 . 3]" 1
640 1 21 LYS HA 1 24 SER HB2 . . 6.600 4.034 2.938 5.475 . 0 0 "[ . 1 . 2 . 3]" 1
641 1 21 LYS HA 1 24 SER HB3 . . 6.600 2.957 2.367 4.566 . 0 0 "[ . 1 . 2 . 3]" 1
642 1 21 LYS HA 1 67 PHE QE . . 8.600 6.239 5.224 6.896 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 21 LYS QB 1 22 ILE H . . 5.480 2.511 2.391 2.702 . 0 0 "[ . 1 . 2 . 3]" 1
644 1 21 LYS QB 1 22 ILE HA . . 7.480 4.318 3.913 4.519 . 0 0 "[ . 1 . 2 . 3]" 1
645 1 21 LYS QB 1 22 ILE MD . . 8.480 4.601 4.263 5.098 . 0 0 "[ . 1 . 2 . 3]" 1
646 1 21 LYS QB 1 67 PHE QD . . 9.480 5.868 4.678 6.397 . 0 0 "[ . 1 . 2 . 3]" 1
647 1 21 LYS QB 1 67 PHE QE . . 9.480 3.867 2.483 4.513 . 0 0 "[ . 1 . 2 . 3]" 1
648 1 21 LYS QB 1 67 PHE HZ . . 7.480 3.819 2.605 4.766 . 0 0 "[ . 1 . 2 . 3]" 1
649 1 21 LYS QD 1 22 ILE MD . . 8.600 5.505 4.280 6.416 . 0 0 "[ . 1 . 2 . 3]" 1
650 1 21 LYS QD 1 22 ILE QG . . 8.480 4.462 3.091 5.421 . 0 0 "[ . 1 . 2 . 3]" 1
651 1 21 LYS QD 1 67 PHE QD . . 9.600 5.746 4.354 7.623 . 0 0 "[ . 1 . 2 . 3]" 1
652 1 21 LYS QD 1 67 PHE QE . . 9.600 3.796 2.550 5.879 . 0 0 "[ . 1 . 2 . 3]" 1
653 1 21 LYS QD 1 67 PHE HZ . . 7.600 3.517 2.258 6.513 . 0 0 "[ . 1 . 2 . 3]" 1
654 1 21 LYS QE 1 65 LEU HA . . 7.600 4.756 3.058 6.794 . 0 0 "[ . 1 . 2 . 3]" 1
655 1 21 LYS QE 1 65 LEU MD1 . . 8.600 3.624 2.106 6.111 . 0 0 "[ . 1 . 2 . 3]" 1
656 1 21 LYS QE 1 65 LEU MD2 . . 8.600 3.577 2.147 5.899 . 0 0 "[ . 1 . 2 . 3]" 1
657 1 21 LYS QE 1 65 LEU HG . . 7.600 4.697 2.792 6.810 . 0 0 "[ . 1 . 2 . 3]" 1
658 1 21 LYS QE 1 67 PHE QE . . 9.600 4.008 2.709 5.846 . 0 0 "[ . 1 . 2 . 3]" 1
659 1 21 LYS QE 1 67 PHE HZ . . 7.600 4.082 2.263 6.426 . 0 0 "[ . 1 . 2 . 3]" 1
660 1 21 LYS QG 1 22 ILE H . . 5.340 3.540 3.160 4.226 . 0 0 "[ . 1 . 2 . 3]" 1
661 1 21 LYS QG 1 22 ILE HA . . 7.480 3.805 3.379 4.698 . 0 0 "[ . 1 . 2 . 3]" 1
662 1 21 LYS QG 1 25 SER H . . 7.480 4.475 4.159 5.434 . 0 0 "[ . 1 . 2 . 3]" 1
663 1 21 LYS QG 1 25 SER HA . . 7.480 5.488 5.091 6.460 . 0 0 "[ . 1 . 2 . 3]" 1
664 1 21 LYS HG2 1 22 ILE H . . 5.800 3.731 3.239 4.867 . 0 0 "[ . 1 . 2 . 3]" 1
665 1 21 LYS HG2 1 67 PHE QD . . 8.600 5.929 5.288 6.894 . 0 0 "[ . 1 . 2 . 3]" 1
666 1 21 LYS HG2 1 67 PHE QE . . 8.600 3.841 3.118 4.713 . 0 0 "[ . 1 . 2 . 3]" 1
667 1 21 LYS HG2 1 67 PHE HZ . . 6.600 4.641 3.257 5.504 . 0 0 "[ . 1 . 2 . 3]" 1
668 1 21 LYS HG3 1 22 ILE H . . 5.800 4.606 3.574 5.063 . 0 0 "[ . 1 . 2 . 3]" 1
669 1 21 LYS HG3 1 67 PHE QD . . 8.600 7.318 5.988 7.693 . 0 0 "[ . 1 . 2 . 3]" 1
670 1 21 LYS HG3 1 67 PHE QE . . 8.600 5.246 3.824 5.738 . 0 0 "[ . 1 . 2 . 3]" 1
671 1 21 LYS HG3 1 67 PHE HZ . . 6.600 5.729 4.567 6.607 0.007 4 0 "[ . 1 . 2 . 3]" 1
672 1 22 ILE H 1 22 ILE MD . . 4.700 3.476 3.118 3.843 . 0 0 "[ . 1 . 2 . 3]" 1
673 1 22 ILE H 1 22 ILE HG12 . . 4.300 3.524 2.993 3.746 . 0 0 "[ . 1 . 2 . 3]" 1
674 1 22 ILE H 1 22 ILE QG . . 4.010 2.201 2.007 2.342 . 0 0 "[ . 1 . 2 . 3]" 1
675 1 22 ILE H 1 22 ILE HG13 . . 4.300 2.225 2.039 2.367 . 0 0 "[ . 1 . 2 . 3]" 1
676 1 22 ILE H 1 22 ILE MG . . 4.700 3.800 3.735 3.849 . 0 0 "[ . 1 . 2 . 3]" 1
677 1 22 ILE H 1 23 GLU H . . 4.400 2.884 2.754 3.010 . 0 0 "[ . 1 . 2 . 3]" 1
678 1 22 ILE H 1 23 GLU HA . . 6.500 5.415 5.344 5.528 . 0 0 "[ . 1 . 2 . 3]" 1
679 1 22 ILE H 1 23 GLU QB . . 6.680 4.676 4.336 5.333 . 0 0 "[ . 1 . 2 . 3]" 1
680 1 22 ILE H 1 23 GLU QG . . 7.600 5.564 3.731 6.453 . 0 0 "[ . 1 . 2 . 3]" 1
681 1 22 ILE H 1 25 SER H . . 6.600 4.713 4.605 4.949 . 0 0 "[ . 1 . 2 . 3]" 1
682 1 22 ILE H 1 37 VAL MG1 . . 7.600 4.641 3.986 5.257 . 0 0 "[ . 1 . 2 . 3]" 1
683 1 22 ILE H 1 37 VAL MG2 . . 7.600 4.614 3.976 5.475 . 0 0 "[ . 1 . 2 . 3]" 1
684 1 22 ILE H 1 62 ILE QG . . 7.600 6.428 5.630 6.782 . 0 0 "[ . 1 . 2 . 3]" 1
685 1 22 ILE H 1 65 LEU QB . . 7.480 5.620 4.810 6.179 . 0 0 "[ . 1 . 2 . 3]" 1
686 1 22 ILE H 1 65 LEU MD1 . . 7.600 4.868 3.605 6.303 . 0 0 "[ . 1 . 2 . 3]" 1
687 1 22 ILE H 1 65 LEU MD2 . . 7.600 5.248 3.497 6.353 . 0 0 "[ . 1 . 2 . 3]" 1
688 1 22 ILE H 1 67 PHE QD . . 8.600 5.719 5.137 6.118 . 0 0 "[ . 1 . 2 . 3]" 1
689 1 22 ILE H 1 67 PHE QE . . 8.600 4.120 3.502 4.552 . 0 0 "[ . 1 . 2 . 3]" 1
690 1 22 ILE H 1 67 PHE HZ . . 6.600 4.951 3.945 5.719 . 0 0 "[ . 1 . 2 . 3]" 1
691 1 22 ILE HA 1 24 SER H . . 6.600 4.939 4.755 5.415 . 0 0 "[ . 1 . 2 . 3]" 1
692 1 22 ILE HA 1 25 SER H . . 5.900 3.682 3.376 3.933 . 0 0 "[ . 1 . 2 . 3]" 1
693 1 22 ILE HA 1 25 SER HB2 . . 6.600 3.763 2.555 4.635 . 0 0 "[ . 1 . 2 . 3]" 1
694 1 22 ILE HA 1 25 SER HB3 . . 6.600 3.314 2.593 4.790 . 0 0 "[ . 1 . 2 . 3]" 1
695 1 22 ILE HA 1 26 LEU H . . 6.600 3.856 3.543 4.080 . 0 0 "[ . 1 . 2 . 3]" 1
696 1 22 ILE HA 1 26 LEU QB . . 7.480 4.516 3.733 5.070 . 0 0 "[ . 1 . 2 . 3]" 1
697 1 22 ILE HA 1 65 LEU MD1 . . 7.600 3.394 2.127 5.137 . 0 0 "[ . 1 . 2 . 3]" 1
698 1 22 ILE HA 1 65 LEU MD2 . . 7.600 3.805 2.146 4.794 . 0 0 "[ . 1 . 2 . 3]" 1
699 1 22 ILE HA 1 65 LEU HG . . 6.600 4.636 2.641 5.570 . 0 0 "[ . 1 . 2 . 3]" 1
700 1 22 ILE HA 1 67 PHE QD . . 8.600 4.844 4.252 5.254 . 0 0 "[ . 1 . 2 . 3]" 1
701 1 22 ILE HA 1 67 PHE QE . . 8.600 3.975 3.386 4.495 . 0 0 "[ . 1 . 2 . 3]" 1
702 1 22 ILE HA 1 67 PHE HZ . . 6.600 5.969 4.901 6.609 0.009 17 0 "[ . 1 . 2 . 3]" 1
703 1 22 ILE HB 1 23 GLU H . . 5.900 2.355 2.192 2.544 . 0 0 "[ . 1 . 2 . 3]" 1
704 1 22 ILE HB 1 24 SER H . . 6.600 5.171 5.003 5.379 . 0 0 "[ . 1 . 2 . 3]" 1
705 1 22 ILE HB 1 67 PHE QE . . 8.600 4.894 4.557 5.167 . 0 0 "[ . 1 . 2 . 3]" 1
706 1 22 ILE HB 1 67 PHE HZ . . 6.600 6.155 5.242 6.633 0.033 23 0 "[ . 1 . 2 . 3]" 1
707 1 22 ILE MD 1 23 GLU H . . 7.600 4.320 4.064 4.638 . 0 0 "[ . 1 . 2 . 3]" 1
708 1 22 ILE MD 1 25 SER QB . . 8.480 5.825 5.357 6.330 . 0 0 "[ . 1 . 2 . 3]" 1
709 1 22 ILE MD 1 37 VAL HB . . 7.600 4.017 3.442 4.635 . 0 0 "[ . 1 . 2 . 3]" 1
710 1 22 ILE MD 1 37 VAL MG1 . . 8.600 3.042 2.054 4.297 . 0 0 "[ . 1 . 2 . 3]" 1
711 1 22 ILE MD 1 37 VAL MG2 . . 8.600 3.196 2.108 4.440 . 0 0 "[ . 1 . 2 . 3]" 1
712 1 22 ILE MD 1 44 ALA MB . . 8.600 4.071 3.153 4.842 . 0 0 "[ . 1 . 2 . 3]" 1
713 1 22 ILE MD 1 62 ILE HA . . 7.600 4.314 3.243 5.031 . 0 0 "[ . 1 . 2 . 3]" 1
714 1 22 ILE MD 1 62 ILE MG . . 8.600 3.453 2.291 4.436 . 0 0 "[ . 1 . 2 . 3]" 1
715 1 22 ILE MD 1 65 LEU QD . . 10.170 4.149 3.393 5.037 . 0 0 "[ . 1 . 2 . 3]" 1
716 1 22 ILE MD 1 67 PHE H . . 7.600 5.648 4.583 6.333 . 0 0 "[ . 1 . 2 . 3]" 1
717 1 22 ILE MD 1 67 PHE HA . . 7.600 5.388 4.868 5.752 . 0 0 "[ . 1 . 2 . 3]" 1
718 1 22 ILE MD 1 67 PHE QB . . 8.480 3.392 2.712 3.937 . 0 0 "[ . 1 . 2 . 3]" 1
719 1 22 ILE MD 1 67 PHE QD . . 9.600 2.889 2.441 3.327 . 0 0 "[ . 1 . 2 . 3]" 1
720 1 22 ILE MD 1 67 PHE QE . . 9.600 3.044 2.645 3.478 . 0 0 "[ . 1 . 2 . 3]" 1
721 1 22 ILE MD 1 67 PHE HZ . . 7.600 3.825 3.213 4.419 . 0 0 "[ . 1 . 2 . 3]" 1
722 1 22 ILE MD 1 68 GLU H . . 7.600 5.676 5.014 6.343 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 22 ILE QG 1 23 GLU H . . 5.440 4.041 3.763 4.219 . 0 0 "[ . 1 . 2 . 3]" 1
724 1 22 ILE QG 1 23 GLU HA . . 7.480 5.712 5.477 5.908 . 0 0 "[ . 1 . 2 . 3]" 1
725 1 22 ILE QG 1 23 GLU QG . . 8.480 6.127 4.894 6.845 . 0 0 "[ . 1 . 2 . 3]" 1
726 1 22 ILE QG 1 24 SER H . . 7.480 5.963 5.661 6.222 . 0 0 "[ . 1 . 2 . 3]" 1
727 1 22 ILE QG 1 25 SER QB . . 8.350 4.553 4.178 5.080 . 0 0 "[ . 1 . 2 . 3]" 1
728 1 22 ILE QG 1 44 ALA MB . . 8.480 5.509 4.599 6.180 . 0 0 "[ . 1 . 2 . 3]" 1
729 1 22 ILE QG 1 62 ILE HB . . 7.480 5.970 4.992 6.524 . 0 0 "[ . 1 . 2 . 3]" 1
730 1 22 ILE QG 1 62 ILE MD . . 8.480 4.503 3.500 5.235 . 0 0 "[ . 1 . 2 . 3]" 1
731 1 22 ILE QG 1 65 LEU QD . . 10.050 2.960 2.239 3.995 . 0 0 "[ . 1 . 2 . 3]" 1
732 1 22 ILE HG12 1 23 GLU H . . 5.800 4.920 4.651 5.110 . 0 0 "[ . 1 . 2 . 3]" 1
733 1 22 ILE HG12 1 25 SER H . . 6.600 6.192 5.775 6.535 . 0 0 "[ . 1 . 2 . 3]" 1
734 1 22 ILE HG12 1 37 VAL HB . . 6.600 6.497 5.957 6.640 0.040 15 0 "[ . 1 . 2 . 3]" 1
735 1 22 ILE HG12 1 67 PHE QD . . 8.600 2.739 2.446 3.160 . 0 0 "[ . 1 . 2 . 3]" 1
736 1 22 ILE HG12 1 67 PHE QE . . 8.600 2.582 2.352 2.914 . 0 0 "[ . 1 . 2 . 3]" 1
737 1 22 ILE HG12 1 67 PHE HZ . . 6.600 4.605 4.124 5.013 . 0 0 "[ . 1 . 2 . 3]" 1
738 1 22 ILE HG13 1 23 GLU H . . 5.800 4.297 3.975 4.495 . 0 0 "[ . 1 . 2 . 3]" 1
739 1 22 ILE HG13 1 25 SER H . . 6.600 6.096 5.780 6.433 . 0 0 "[ . 1 . 2 . 3]" 1
740 1 22 ILE HG13 1 37 VAL HB . . 6.600 6.241 5.542 6.650 0.050 2 0 "[ . 1 . 2 . 3]" 1
741 1 22 ILE HG13 1 67 PHE QD . . 8.600 3.761 3.273 4.094 . 0 0 "[ . 1 . 2 . 3]" 1
742 1 22 ILE HG13 1 67 PHE QE . . 8.600 2.540 2.279 3.114 . 0 0 "[ . 1 . 2 . 3]" 1
743 1 22 ILE HG13 1 67 PHE HZ . . 6.600 3.764 2.870 4.313 . 0 0 "[ . 1 . 2 . 3]" 1
744 1 22 ILE MG 1 23 GLU H . . 7.600 3.068 2.770 3.256 . 0 0 "[ . 1 . 2 . 3]" 1
745 1 22 ILE MG 1 61 THR MG . . 8.600 4.285 3.425 4.871 . 0 0 "[ . 1 . 2 . 3]" 1
746 1 22 ILE MG 1 62 ILE HA . . 7.600 3.783 2.895 4.529 . 0 0 "[ . 1 . 2 . 3]" 1
747 1 22 ILE MG 1 65 LEU HG . . 7.600 5.423 4.179 6.343 . 0 0 "[ . 1 . 2 . 3]" 1
748 1 22 ILE MG 1 67 PHE QD . . 9.600 4.152 3.699 4.632 . 0 0 "[ . 1 . 2 . 3]" 1
749 1 22 ILE MG 1 67 PHE QE . . 9.600 4.452 4.234 4.612 . 0 0 "[ . 1 . 2 . 3]" 1
750 1 22 ILE MG 1 67 PHE HZ . . 7.600 6.105 5.545 6.348 . 0 0 "[ . 1 . 2 . 3]" 1
751 1 23 GLU H 1 26 LEU H . . 6.600 4.802 4.692 4.907 . 0 0 "[ . 1 . 2 . 3]" 1
752 1 23 GLU H 1 35 CYS HG . . 6.600 5.447 3.468 6.646 0.046 15 0 "[ . 1 . 2 . 3]" 1
753 1 23 GLU H 1 37 VAL MG1 . . 7.600 3.319 2.339 4.367 . 0 0 "[ . 1 . 2 . 3]" 1
754 1 23 GLU H 1 37 VAL MG2 . . 7.600 3.440 2.382 5.034 . 0 0 "[ . 1 . 2 . 3]" 1
755 1 23 GLU HA 1 24 SER HA . . 6.600 4.832 4.728 4.895 . 0 0 "[ . 1 . 2 . 3]" 1
756 1 23 GLU HA 1 26 LEU QD . . 9.170 3.397 2.210 4.465 . 0 0 "[ . 1 . 2 . 3]" 1
757 1 23 GLU HA 1 26 LEU HG . . 6.600 4.871 3.944 6.176 . 0 0 "[ . 1 . 2 . 3]" 1
758 1 23 GLU HA 1 27 THR H . . 6.600 3.883 3.099 4.248 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 23 GLU HA 1 27 THR MG . . 7.600 4.615 3.297 6.283 . 0 0 "[ . 1 . 2 . 3]" 1
760 1 23 GLU HA 1 35 CYS HB2 . . 6.600 3.654 2.174 4.624 . 0 0 "[ . 1 . 2 . 3]" 1
761 1 23 GLU HA 1 35 CYS HB3 . . 6.600 3.426 2.280 4.779 . 0 0 "[ . 1 . 2 . 3]" 1
762 1 23 GLU HA 1 35 CYS HG . . 6.600 3.099 2.080 4.191 . 0 0 "[ . 1 . 2 . 3]" 1
763 1 23 GLU HA 1 37 VAL QG . . 9.160 3.308 2.578 4.165 . 0 0 "[ . 1 . 2 . 3]" 1
764 1 23 GLU QB 1 24 SER HA . . 7.480 4.067 3.772 4.838 . 0 0 "[ . 1 . 2 . 3]" 1
765 1 23 GLU QB 1 27 THR MG . . 8.480 4.565 3.082 6.081 . 0 0 "[ . 1 . 2 . 3]" 1
766 1 23 GLU QB 1 35 CYS H . . 7.480 5.712 3.905 6.723 . 0 0 "[ . 1 . 2 . 3]" 1
767 1 23 GLU QB 1 35 CYS QB . . 8.350 3.817 2.214 5.177 . 0 0 "[ . 1 . 2 . 3]" 1
768 1 23 GLU QB 1 37 VAL H . . 7.480 4.099 3.337 4.861 . 0 0 "[ . 1 . 2 . 3]" 1
769 1 23 GLU QB 1 37 VAL QG . . 10.040 2.608 1.921 3.730 . 0 0 "[ . 1 . 2 . 3]" 1
770 1 23 GLU HB2 1 24 SER H . . 4.900 3.259 2.342 4.107 . 0 0 "[ . 1 . 2 . 3]" 1
771 1 23 GLU HB2 1 35 CYS HG . . 6.600 4.953 2.714 6.103 . 0 0 "[ . 1 . 2 . 3]" 1
772 1 23 GLU HB2 1 36 SER HA . . 6.600 5.359 4.237 6.622 0.022 12 0 "[ . 1 . 2 . 3]" 1
773 1 23 GLU HB3 1 24 SER H . . 4.900 2.875 2.067 4.033 . 0 0 "[ . 1 . 2 . 3]" 1
774 1 23 GLU HB3 1 35 CYS HG . . 6.600 4.926 2.935 6.662 0.062 23 0 "[ . 1 . 2 . 3]" 1
775 1 23 GLU HB3 1 36 SER HA . . 6.600 5.645 3.301 6.628 0.028 8 0 "[ . 1 . 2 . 3]" 1
776 1 23 GLU QG 1 24 SER H . . 7.600 3.737 2.182 4.226 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 23 GLU QG 1 27 THR MG . . 8.600 4.489 2.130 6.698 . 0 0 "[ . 1 . 2 . 3]" 1
778 1 23 GLU QG 1 35 CYS HG . . 7.600 3.825 2.635 6.253 . 0 0 "[ . 1 . 2 . 3]" 1
779 1 23 GLU QG 1 36 SER H . . 7.600 4.942 3.860 6.841 . 0 0 "[ . 1 . 2 . 3]" 1
780 1 23 GLU QG 1 36 SER HA . . 7.600 3.932 2.082 5.738 . 0 0 "[ . 1 . 2 . 3]" 1
781 1 23 GLU QG 1 37 VAL H . . 7.600 3.560 2.725 5.528 . 0 0 "[ . 1 . 2 . 3]" 1
782 1 23 GLU QG 1 37 VAL QG . . 10.160 2.520 1.840 4.423 . 0 0 "[ . 1 . 2 . 3]" 1
783 1 24 SER H 1 25 SER H . . 4.200 2.848 2.611 3.122 . 0 0 "[ . 1 . 2 . 3]" 1
784 1 24 SER H 1 26 LEU H . . 6.600 4.418 4.099 4.818 . 0 0 "[ . 1 . 2 . 3]" 1
785 1 24 SER H 1 27 THR MG . . 7.600 5.254 4.071 6.364 . 0 0 "[ . 1 . 2 . 3]" 1
786 1 24 SER HA 1 27 THR HB . . 6.600 3.981 2.426 5.069 . 0 0 "[ . 1 . 2 . 3]" 1
787 1 24 SER HA 1 27 THR MG . . 7.600 3.736 2.181 5.104 . 0 0 "[ . 1 . 2 . 3]" 1
788 1 24 SER HA 1 28 LYS H . . 6.600 5.074 3.860 6.652 0.052 10 0 "[ . 1 . 2 . 3]" 1
789 1 24 SER HB2 1 25 SER H . . 4.800 3.980 2.933 4.201 . 0 0 "[ . 1 . 2 . 3]" 1
790 1 24 SER HB3 1 25 SER H . . 4.800 2.828 2.558 3.807 . 0 0 "[ . 1 . 2 . 3]" 1
791 1 25 SER H 1 25 SER HB2 . . 4.200 2.599 2.414 3.621 . 0 0 "[ . 1 . 2 . 3]" 1
792 1 25 SER H 1 25 SER HB3 . . 4.200 2.756 2.479 3.645 . 0 0 "[ . 1 . 2 . 3]" 1
793 1 25 SER H 1 26 LEU H . . 4.000 2.525 2.322 2.700 . 0 0 "[ . 1 . 2 . 3]" 1
794 1 25 SER H 1 26 LEU HA . . 6.600 5.148 4.988 5.276 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 25 SER H 1 26 LEU HB2 . . 5.700 4.403 4.261 4.985 . 0 0 "[ . 1 . 2 . 3]" 1
796 1 25 SER H 1 26 LEU QB . . 5.340 4.197 4.105 4.304 . 0 0 "[ . 1 . 2 . 3]" 1
797 1 25 SER H 1 26 LEU HB3 . . 5.700 5.575 4.396 5.854 0.154 25 0 "[ . 1 . 2 . 3]" 1
798 1 25 SER H 1 26 LEU MD1 . . 7.600 5.261 3.834 6.374 . 0 0 "[ . 1 . 2 . 3]" 1
799 1 25 SER H 1 26 LEU MD2 . . 7.600 5.376 4.011 6.385 . 0 0 "[ . 1 . 2 . 3]" 1
800 1 25 SER H 1 26 LEU HG . . 6.600 5.972 4.410 6.652 0.052 23 0 "[ . 1 . 2 . 3]" 1
801 1 25 SER H 1 27 THR H . . 6.500 4.142 3.836 4.374 . 0 0 "[ . 1 . 2 . 3]" 1
802 1 25 SER H 1 27 THR MG . . 7.600 5.674 4.281 6.814 . 0 0 "[ . 1 . 2 . 3]" 1
803 1 25 SER H 1 65 LEU MD1 . . 7.600 4.832 3.974 6.166 . 0 0 "[ . 1 . 2 . 3]" 1
804 1 25 SER H 1 65 LEU MD2 . . 7.600 4.979 3.830 5.773 . 0 0 "[ . 1 . 2 . 3]" 1
805 1 25 SER HA 1 28 LYS HB2 . . 6.600 4.659 3.239 6.131 . 0 0 "[ . 1 . 2 . 3]" 1
806 1 25 SER HA 1 28 LYS HB3 . . 6.600 4.140 2.306 5.494 . 0 0 "[ . 1 . 2 . 3]" 1
807 1 25 SER HA 1 28 LYS QD . . 7.600 4.354 2.304 5.397 . 0 0 "[ . 1 . 2 . 3]" 1
808 1 25 SER HA 1 28 LYS QE . . 7.600 4.672 2.203 6.589 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 25 SER HA 1 28 LYS HG2 . . 6.600 3.371 2.347 4.984 . 0 0 "[ . 1 . 2 . 3]" 1
810 1 25 SER HA 1 28 LYS HG3 . . 6.600 4.167 2.443 6.195 . 0 0 "[ . 1 . 2 . 3]" 1
811 1 25 SER QB 1 26 LEU QD . . 10.050 3.516 2.405 4.723 . 0 0 "[ . 1 . 2 . 3]" 1
812 1 25 SER QB 1 27 THR H . . 7.480 4.890 4.635 5.383 . 0 0 "[ . 1 . 2 . 3]" 1
813 1 25 SER QB 1 28 LYS H . . 7.480 5.309 4.717 6.713 . 0 0 "[ . 1 . 2 . 3]" 1
814 1 25 SER QB 1 28 LYS QB . . 8.350 5.154 4.212 6.271 . 0 0 "[ . 1 . 2 . 3]" 1
815 1 25 SER QB 1 29 HIS HD2 . . 7.480 5.628 4.368 6.475 . 0 0 "[ . 1 . 2 . 3]" 1
816 1 25 SER QB 1 61 THR MG . . 8.480 3.361 2.334 4.233 . 0 0 "[ . 1 . 2 . 3]" 1
817 1 25 SER QB 1 65 LEU QD . . 7.870 2.392 1.901 3.178 . 0 0 "[ . 1 . 2 . 3]" 1
818 1 25 SER HB2 1 26 LEU H . . 4.900 3.549 2.306 4.120 . 0 0 "[ . 1 . 2 . 3]" 1
819 1 25 SER HB2 1 65 LEU MD1 . . 9.350 3.144 2.127 4.701 . 0 0 "[ . 1 . 2 . 3]" 1
820 1 25 SER HB2 1 65 LEU MD2 . . 9.350 3.294 2.559 4.224 . 0 0 "[ . 1 . 2 . 3]" 1
821 1 25 SER HB3 1 26 LEU H . . 4.900 2.777 2.254 3.930 . 0 0 "[ . 1 . 2 . 3]" 1
822 1 25 SER HB3 1 65 LEU MD1 . . 9.350 3.115 2.108 4.681 . 0 0 "[ . 1 . 2 . 3]" 1
823 1 25 SER HB3 1 65 LEU MD2 . . 9.350 3.174 2.424 4.028 . 0 0 "[ . 1 . 2 . 3]" 1
824 1 26 LEU H 1 26 LEU MD1 . . 5.300 3.467 2.364 4.227 . 0 0 "[ . 1 . 2 . 3]" 1
825 1 26 LEU H 1 26 LEU QD . . 4.760 2.916 2.325 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
826 1 26 LEU H 1 26 LEU MD2 . . 5.300 3.547 2.342 4.263 . 0 0 "[ . 1 . 2 . 3]" 1
827 1 26 LEU H 1 26 LEU HG . . 4.200 3.668 2.370 4.263 0.063 24 0 "[ . 1 . 2 . 3]" 1
828 1 26 LEU H 1 27 THR H . . 4.700 2.830 2.646 3.071 . 0 0 "[ . 1 . 2 . 3]" 1
829 1 26 LEU H 1 27 THR MG . . 7.600 5.084 4.066 6.186 . 0 0 "[ . 1 . 2 . 3]" 1
830 1 26 LEU H 1 28 LYS H . . 6.600 4.353 3.819 5.370 . 0 0 "[ . 1 . 2 . 3]" 1
831 1 26 LEU H 1 29 HIS H . . 5.800 5.601 5.112 5.895 0.095 10 0 "[ . 1 . 2 . 3]" 1
832 1 26 LEU H 1 29 HIS HD2 . . 6.600 5.038 4.591 5.776 . 0 0 "[ . 1 . 2 . 3]" 1
833 1 26 LEU H 1 35 CYS HG . . 6.600 4.979 3.807 6.201 . 0 0 "[ . 1 . 2 . 3]" 1
834 1 26 LEU HA 1 27 THR MG . . 7.600 5.575 4.901 6.218 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 26 LEU HA 1 28 LYS H . . 6.600 3.895 3.587 4.382 . 0 0 "[ . 1 . 2 . 3]" 1
836 1 26 LEU HA 1 28 LYS HB2 . . 6.600 5.888 4.437 6.700 0.100 9 0 "[ . 1 . 2 . 3]" 1
837 1 26 LEU HA 1 28 LYS HB3 . . 6.600 5.642 4.055 6.618 0.018 17 0 "[ . 1 . 2 . 3]" 1
838 1 26 LEU HA 1 28 LYS QG . . 7.480 4.317 3.119 5.631 . 0 0 "[ . 1 . 2 . 3]" 1
839 1 26 LEU HA 1 29 HIS H . . 6.000 3.704 3.471 3.957 . 0 0 "[ . 1 . 2 . 3]" 1
840 1 26 LEU HA 1 29 HIS HD2 . . 6.600 2.488 2.166 3.853 . 0 0 "[ . 1 . 2 . 3]" 1
841 1 26 LEU HA 1 35 CYS HG . . 6.600 5.655 4.422 6.655 0.055 12 0 "[ . 1 . 2 . 3]" 1
842 1 26 LEU HA 1 58 ILE QG . . 7.600 5.295 4.674 6.207 . 0 0 "[ . 1 . 2 . 3]" 1
843 1 26 LEU HA 1 61 THR MG . . 7.600 3.136 2.251 4.304 . 0 0 "[ . 1 . 2 . 3]" 1
844 1 26 LEU HA 1 62 ILE QG . . 7.600 6.319 5.521 6.831 . 0 0 "[ . 1 . 2 . 3]" 1
845 1 26 LEU QB 1 27 THR H . . 5.690 2.593 2.241 2.895 . 0 0 "[ . 1 . 2 . 3]" 1
846 1 26 LEU QB 1 29 HIS HE1 . . 7.480 6.552 4.468 6.775 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 26 LEU HB2 1 27 THR H . . 6.500 2.998 2.343 4.188 . 0 0 "[ . 1 . 2 . 3]" 1
848 1 26 LEU HB2 1 29 HIS HD2 . . 6.600 5.095 4.195 6.618 0.018 26 0 "[ . 1 . 2 . 3]" 1
849 1 26 LEU HB3 1 27 THR H . . 6.500 3.048 2.439 3.487 . 0 0 "[ . 1 . 2 . 3]" 1
850 1 26 LEU HB3 1 29 HIS HD2 . . 6.600 4.459 3.113 6.607 0.007 26 0 "[ . 1 . 2 . 3]" 1
851 1 26 LEU QD 1 28 LYS QG . . 8.330 5.058 4.023 5.563 . 0 0 "[ . 1 . 2 . 3]" 1
852 1 26 LEU QD 1 29 HIS H . . 9.170 4.538 3.523 5.370 . 0 0 "[ . 1 . 2 . 3]" 1
853 1 26 LEU QD 1 29 HIS QB . . 10.050 3.954 2.283 5.314 . 0 0 "[ . 1 . 2 . 3]" 1
854 1 26 LEU QD 1 29 HIS HD2 . . 9.170 3.154 2.060 4.867 . 0 0 "[ . 1 . 2 . 3]" 1
855 1 26 LEU QD 1 32 ILE QG . . 7.870 3.321 2.205 5.188 . 0 0 "[ . 1 . 2 . 3]" 1
856 1 26 LEU QD 1 35 CYS QB . . 9.130 3.053 1.999 4.843 . 0 0 "[ . 1 . 2 . 3]" 1
857 1 26 LEU QD 1 58 ILE HA . . 9.170 3.001 2.113 4.230 . 0 0 "[ . 1 . 2 . 3]" 1
858 1 26 LEU QD 1 61 THR H . . 9.170 4.553 3.818 5.713 . 0 0 "[ . 1 . 2 . 3]" 1
859 1 26 LEU QD 1 61 THR HB . . 9.170 2.763 2.149 4.352 . 0 0 "[ . 1 . 2 . 3]" 1
860 1 26 LEU MD1 1 27 THR H . . 7.600 4.435 4.128 4.729 . 0 0 "[ . 1 . 2 . 3]" 1
861 1 26 LEU MD1 1 28 LYS HG2 . . 9.350 6.614 4.269 7.811 . 0 0 "[ . 1 . 2 . 3]" 1
862 1 26 LEU MD1 1 28 LYS HG3 . . 9.350 6.579 5.019 7.855 . 0 0 "[ . 1 . 2 . 3]" 1
863 1 26 LEU MD1 1 32 ILE HG12 . . 9.350 4.707 3.033 7.092 . 0 0 "[ . 1 . 2 . 3]" 1
864 1 26 LEU MD1 1 32 ILE HG13 . . 9.350 5.063 2.264 7.795 . 0 0 "[ . 1 . 2 . 3]" 1
865 1 26 LEU MD1 1 35 CYS HB2 . . 10.740 4.409 2.096 6.471 . 0 0 "[ . 1 . 2 . 3]" 1
866 1 26 LEU MD1 1 35 CYS HB3 . . 10.740 4.560 2.565 6.452 . 0 0 "[ . 1 . 2 . 3]" 1
867 1 26 LEU MD1 1 62 ILE HB . . 7.600 5.388 4.582 6.351 . 0 0 "[ . 1 . 2 . 3]" 1
868 1 26 LEU MD2 1 27 THR H . . 7.600 4.544 3.946 4.904 . 0 0 "[ . 1 . 2 . 3]" 1
869 1 26 LEU MD2 1 28 LYS HG2 . . 9.350 6.823 5.856 7.801 . 0 0 "[ . 1 . 2 . 3]" 1
870 1 26 LEU MD2 1 28 LYS HG3 . . 9.350 6.751 5.183 7.815 . 0 0 "[ . 1 . 2 . 3]" 1
871 1 26 LEU MD2 1 32 ILE HG12 . . 9.350 4.644 2.453 7.341 . 0 0 "[ . 1 . 2 . 3]" 1
872 1 26 LEU MD2 1 32 ILE HG13 . . 9.350 5.090 2.861 7.790 . 0 0 "[ . 1 . 2 . 3]" 1
873 1 26 LEU MD2 1 35 CYS HB2 . . 10.740 4.360 2.359 6.435 . 0 0 "[ . 1 . 2 . 3]" 1
874 1 26 LEU MD2 1 35 CYS HB3 . . 10.740 4.354 2.686 6.510 . 0 0 "[ . 1 . 2 . 3]" 1
875 1 26 LEU MD2 1 62 ILE HB . . 7.600 5.079 4.379 6.343 . 0 0 "[ . 1 . 2 . 3]" 1
876 1 26 LEU HG 1 27 THR H . . 5.900 4.731 3.182 5.194 . 0 0 "[ . 1 . 2 . 3]" 1
877 1 26 LEU HG 1 27 THR HA . . 6.600 5.920 3.463 6.606 0.006 12 0 "[ . 1 . 2 . 3]" 1
878 1 26 LEU HG 1 29 HIS H . . 6.600 6.032 4.603 6.756 0.156 2 0 "[ . 1 . 2 . 3]" 1
879 1 26 LEU HG 1 29 HIS HD2 . . 6.600 4.674 2.747 6.436 . 0 0 "[ . 1 . 2 . 3]" 1
880 1 26 LEU HG 1 32 ILE HB . . 6.600 5.933 3.933 6.697 0.097 30 0 "[ . 1 . 2 . 3]" 1
881 1 26 LEU HG 1 32 ILE MD . . 7.600 4.924 2.133 6.360 . 0 0 "[ . 1 . 2 . 3]" 1
882 1 26 LEU HG 1 35 CYS HB2 . . 6.600 5.073 2.920 6.640 0.040 19 0 "[ . 1 . 2 . 3]" 1
883 1 26 LEU HG 1 35 CYS HB3 . . 6.600 5.280 3.308 6.607 0.007 9 0 "[ . 1 . 2 . 3]" 1
884 1 26 LEU HG 1 62 ILE QG . . 7.600 4.643 3.470 6.734 . 0 0 "[ . 1 . 2 . 3]" 1
885 1 27 THR H 1 27 THR MG . . 4.500 2.890 2.193 3.782 . 0 0 "[ . 1 . 2 . 3]" 1
886 1 27 THR H 1 28 LYS H . . 4.500 3.019 2.683 3.713 . 0 0 "[ . 1 . 2 . 3]" 1
887 1 27 THR H 1 28 LYS QB . . 7.480 4.879 3.466 5.497 . 0 0 "[ . 1 . 2 . 3]" 1
888 1 27 THR H 1 32 ILE MG . . 7.600 4.983 3.645 6.337 . 0 0 "[ . 1 . 2 . 3]" 1
889 1 27 THR H 1 35 CYS HG . . 6.600 4.171 2.408 5.839 . 0 0 "[ . 1 . 2 . 3]" 1
890 1 27 THR HA 1 29 HIS H . . 6.300 3.699 3.392 4.152 . 0 0 "[ . 1 . 2 . 3]" 1
891 1 27 THR HA 1 30 ARG HA . . 6.600 5.801 4.736 6.606 0.006 2 0 "[ . 1 . 2 . 3]" 1
892 1 27 THR HA 1 32 ILE H . . 6.600 5.404 4.434 6.260 . 0 0 "[ . 1 . 2 . 3]" 1
893 1 27 THR HA 1 32 ILE HB . . 6.600 4.424 2.169 6.028 . 0 0 "[ . 1 . 2 . 3]" 1
894 1 27 THR HA 1 32 ILE MD . . 7.600 2.738 2.053 5.085 . 0 0 "[ . 1 . 2 . 3]" 1
895 1 27 THR HA 1 32 ILE MG . . 7.600 3.945 2.142 5.660 . 0 0 "[ . 1 . 2 . 3]" 1
896 1 27 THR HA 1 34 TYR H . . 6.600 6.362 5.244 6.633 0.033 20 0 "[ . 1 . 2 . 3]" 1
897 1 27 THR HA 1 34 TYR HA . . 6.600 5.630 5.076 6.040 . 0 0 "[ . 1 . 2 . 3]" 1
898 1 27 THR HA 1 35 CYS HB2 . . 6.600 5.389 4.378 6.638 0.038 12 0 "[ . 1 . 2 . 3]" 1
899 1 27 THR HA 1 35 CYS HB3 . . 6.600 5.311 4.344 6.618 0.018 16 0 "[ . 1 . 2 . 3]" 1
900 1 27 THR HA 1 35 CYS HG . . 6.600 5.057 2.856 6.642 0.042 2 0 "[ . 1 . 2 . 3]" 1
901 1 27 THR HB 1 28 LYS H . . 4.700 3.874 2.989 4.532 . 0 0 "[ . 1 . 2 . 3]" 1
902 1 27 THR HB 1 28 LYS QG . . 7.480 5.737 4.099 6.712 . 0 0 "[ . 1 . 2 . 3]" 1
903 1 27 THR HB 1 32 ILE MD . . 7.600 4.551 3.114 6.381 . 0 0 "[ . 1 . 2 . 3]" 1
904 1 27 THR HB 1 32 ILE QG . . 7.480 5.338 4.175 6.689 . 0 0 "[ . 1 . 2 . 3]" 1
905 1 27 THR HB 1 35 CYS H . . 6.600 6.248 4.050 6.675 0.075 26 0 "[ . 1 . 2 . 3]" 1
906 1 27 THR MG 1 28 LYS H . . 7.600 4.090 2.707 4.417 . 0 0 "[ . 1 . 2 . 3]" 1
907 1 27 THR MG 1 29 HIS H . . 7.600 5.125 4.672 5.704 . 0 0 "[ . 1 . 2 . 3]" 1
908 1 27 THR MG 1 34 TYR H . . 7.600 5.841 3.678 7.849 0.249 13 0 "[ . 1 . 2 . 3]" 1
909 1 27 THR MG 1 34 TYR HA . . 7.600 4.320 2.529 6.468 . 0 0 "[ . 1 . 2 . 3]" 1
910 1 27 THR MG 1 34 TYR QD . . 9.600 4.981 3.748 6.802 . 0 0 "[ . 1 . 2 . 3]" 1
911 1 27 THR MG 1 35 CYS H . . 7.600 4.369 3.461 6.483 . 0 0 "[ . 1 . 2 . 3]" 1
912 1 27 THR MG 1 35 CYS HB2 . . 7.600 4.513 2.407 6.499 . 0 0 "[ . 1 . 2 . 3]" 1
913 1 27 THR MG 1 35 CYS HB3 . . 7.600 4.379 2.456 6.766 . 0 0 "[ . 1 . 2 . 3]" 1
914 1 28 LYS H 1 28 LYS HG2 . . 4.600 3.142 2.106 4.674 0.074 12 0 "[ . 1 . 2 . 3]" 1
915 1 28 LYS H 1 28 LYS HG3 . . 4.600 3.328 2.249 4.472 . 0 0 "[ . 1 . 2 . 3]" 1
916 1 28 LYS H 1 29 HIS H . . 4.200 2.612 1.847 3.005 . 0 0 "[ . 1 . 2 . 3]" 1
917 1 28 LYS H 1 29 HIS HA . . 6.600 5.199 4.406 5.533 . 0 0 "[ . 1 . 2 . 3]" 1
918 1 28 LYS H 1 29 HIS HB2 . . 6.600 5.002 3.694 5.568 . 0 0 "[ . 1 . 2 . 3]" 1
919 1 28 LYS H 1 29 HIS HB3 . . 6.600 6.179 5.159 6.600 . 0 0 "[ . 1 . 2 . 3]" 1
920 1 28 LYS H 1 29 HIS HD2 . . 6.600 4.163 2.912 5.094 . 0 0 "[ . 1 . 2 . 3]" 1
921 1 28 LYS H 1 32 ILE MD . . 7.600 5.002 3.384 6.354 . 0 0 "[ . 1 . 2 . 3]" 1
922 1 28 LYS HA 1 29 HIS HD2 . . 6.600 5.852 4.615 6.648 0.048 15 0 "[ . 1 . 2 . 3]" 1
923 1 28 LYS QB 1 29 HIS H . . 5.230 3.359 2.306 3.985 . 0 0 "[ . 1 . 2 . 3]" 1
924 1 28 LYS QB 1 29 HIS HA . . 7.480 4.401 3.488 5.074 . 0 0 "[ . 1 . 2 . 3]" 1
925 1 28 LYS HB2 1 29 HIS H . . 5.400 3.872 2.336 4.704 . 0 0 "[ . 1 . 2 . 3]" 1
926 1 28 LYS HB2 1 29 HIS HD2 . . 6.600 5.323 2.419 6.699 0.099 11 0 "[ . 1 . 2 . 3]" 1
927 1 28 LYS HB3 1 29 HIS H . . 5.400 3.925 2.524 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
928 1 28 LYS HB3 1 29 HIS HD2 . . 6.600 5.319 2.328 6.651 0.051 15 0 "[ . 1 . 2 . 3]" 1
929 1 28 LYS QD 1 29 HIS H . . 7.600 4.592 3.357 5.604 . 0 0 "[ . 1 . 2 . 3]" 1
930 1 28 LYS QG 1 29 HIS H . . 6.390 3.150 2.117 4.261 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 28 LYS QG 1 29 HIS HD2 . . 7.480 3.849 2.068 6.164 . 0 0 "[ . 1 . 2 . 3]" 1
932 1 28 LYS HG2 1 29 HIS H . . 6.600 4.137 2.181 5.245 . 0 0 "[ . 1 . 2 . 3]" 1
933 1 28 LYS HG3 1 29 HIS H . . 6.600 3.501 2.241 5.365 . 0 0 "[ . 1 . 2 . 3]" 1
934 1 29 HIS H 1 29 HIS HD2 . . 5.400 2.728 2.033 3.214 . 0 0 "[ . 1 . 2 . 3]" 1
935 1 29 HIS H 1 32 ILE HB . . 6.300 5.631 3.642 6.355 0.055 28 0 "[ . 1 . 2 . 3]" 1
936 1 29 HIS H 1 32 ILE MD . . 7.600 4.415 2.717 5.048 . 0 0 "[ . 1 . 2 . 3]" 1
937 1 29 HIS H 1 32 ILE MG . . 7.600 4.245 2.953 5.025 . 0 0 "[ . 1 . 2 . 3]" 1
938 1 29 HIS HA 1 29 HIS HE1 . . 6.600 5.428 4.999 5.893 . 0 0 "[ . 1 . 2 . 3]" 1
939 1 29 HIS QB 1 53 ILE MD . . 8.480 2.464 2.018 3.324 . 0 0 "[ . 1 . 2 . 3]" 1
940 1 29 HIS QB 1 53 ILE QG . . 7.420 3.430 2.147 4.642 . 0 0 "[ . 1 . 2 . 3]" 1
941 1 29 HIS HB2 1 30 ARG H . . 6.600 4.006 2.129 4.514 . 0 0 "[ . 1 . 2 . 3]" 1
942 1 29 HIS HB2 1 30 ARG HA . . 6.600 5.052 4.505 5.670 . 0 0 "[ . 1 . 2 . 3]" 1
943 1 29 HIS HB2 1 32 ILE H . . 6.600 3.503 2.608 5.359 . 0 0 "[ . 1 . 2 . 3]" 1
944 1 29 HIS HB2 1 32 ILE HB . . 6.600 4.526 2.740 5.298 . 0 0 "[ . 1 . 2 . 3]" 1
945 1 29 HIS HB2 1 32 ILE MG . . 7.600 2.885 2.100 4.888 . 0 0 "[ . 1 . 2 . 3]" 1
946 1 29 HIS HB2 1 53 ILE HG12 . . 8.350 5.235 3.186 6.386 . 0 0 "[ . 1 . 2 . 3]" 1
947 1 29 HIS HB2 1 53 ILE HG13 . . 8.350 4.579 2.603 6.301 . 0 0 "[ . 1 . 2 . 3]" 1
948 1 29 HIS HB3 1 30 ARG H . . 6.600 3.546 2.115 4.558 . 0 0 "[ . 1 . 2 . 3]" 1
949 1 29 HIS HB3 1 30 ARG HA . . 6.600 5.227 4.540 6.142 . 0 0 "[ . 1 . 2 . 3]" 1
950 1 29 HIS HB3 1 32 ILE H . . 6.600 4.113 2.853 5.886 . 0 0 "[ . 1 . 2 . 3]" 1
951 1 29 HIS HB3 1 32 ILE HB . . 6.600 5.887 4.316 6.616 0.016 27 0 "[ . 1 . 2 . 3]" 1
952 1 29 HIS HB3 1 32 ILE MG . . 7.600 3.899 2.474 6.336 . 0 0 "[ . 1 . 2 . 3]" 1
953 1 29 HIS HB3 1 53 ILE HG12 . . 8.350 4.517 2.360 5.859 . 0 0 "[ . 1 . 2 . 3]" 1
954 1 29 HIS HB3 1 53 ILE HG13 . . 8.350 3.908 2.691 5.313 . 0 0 "[ . 1 . 2 . 3]" 1
955 1 29 HIS HD2 1 32 ILE QG . . 7.480 3.999 2.247 5.742 . 0 0 "[ . 1 . 2 . 3]" 1
956 1 29 HIS HD2 1 32 ILE MG . . 7.600 3.981 2.353 6.007 . 0 0 "[ . 1 . 2 . 3]" 1
957 1 29 HIS HD2 1 53 ILE QG . . 7.480 5.665 4.014 6.691 . 0 0 "[ . 1 . 2 . 3]" 1
958 1 29 HIS HD2 1 58 ILE QG . . 7.600 5.139 3.232 6.749 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 29 HIS HD2 1 61 THR HB . . 6.600 5.415 3.793 6.536 . 0 0 "[ . 1 . 2 . 3]" 1
960 1 29 HIS HD2 1 61 THR MG . . 7.600 3.743 2.696 4.437 . 0 0 "[ . 1 . 2 . 3]" 1
961 1 29 HIS HE1 1 61 THR HA . . 6.600 5.192 3.896 6.605 0.005 3 0 "[ . 1 . 2 . 3]" 1
962 1 29 HIS HE1 1 61 THR HB . . 6.600 4.816 2.726 6.600 . 0 0 "[ . 1 . 2 . 3]" 1
963 1 30 ARG H 1 32 ILE H . . 6.600 4.387 3.518 5.695 . 0 0 "[ . 1 . 2 . 3]" 1
964 1 30 ARG H 1 52 ILE MD . . 7.600 6.090 5.061 6.365 . 0 0 "[ . 1 . 2 . 3]" 1
965 1 30 ARG HA 1 32 ILE H . . 6.600 3.650 3.226 4.137 . 0 0 "[ . 1 . 2 . 3]" 1
966 1 30 ARG HA 1 32 ILE HA . . 6.600 6.180 5.628 6.611 0.011 7 0 "[ . 1 . 2 . 3]" 1
967 1 30 ARG HA 1 32 ILE HB . . 6.600 6.199 4.754 6.689 0.089 14 0 "[ . 1 . 2 . 3]" 1
968 1 30 ARG HA 1 32 ILE MG . . 7.600 5.341 3.947 6.274 . 0 0 "[ . 1 . 2 . 3]" 1
969 1 31 GLY QA 1 48 TYR HA . . 7.480 4.738 4.334 5.507 . 0 0 "[ . 1 . 2 . 3]" 1
970 1 31 GLY QA 1 49 ASP H . . 7.480 3.532 2.882 4.634 . 0 0 "[ . 1 . 2 . 3]" 1
971 1 31 GLY QA 1 49 ASP QB . . 7.420 3.179 1.998 5.274 . 0 0 "[ . 1 . 2 . 3]" 1
972 1 31 GLY QA 1 52 ILE HB . . 7.480 3.158 2.056 4.488 . 0 0 "[ . 1 . 2 . 3]" 1
973 1 31 GLY QA 1 52 ILE MD . . 8.480 3.224 2.034 4.444 . 0 0 "[ . 1 . 2 . 3]" 1
974 1 31 GLY QA 1 53 ILE MD . . 8.480 3.701 2.332 4.739 . 0 0 "[ . 1 . 2 . 3]" 1
975 1 31 GLY HA2 1 49 ASP HB2 . . 8.350 4.184 2.506 6.640 . 0 0 "[ . 1 . 2 . 3]" 1
976 1 31 GLY HA2 1 49 ASP HB3 . . 8.350 3.891 2.114 5.946 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 31 GLY HA2 1 53 ILE MG . . 7.600 4.443 3.413 6.073 . 0 0 "[ . 1 . 2 . 3]" 1
978 1 32 ILE H 1 32 ILE HB . . 3.900 3.409 2.414 3.919 0.019 1 0 "[ . 1 . 2 . 3]" 1
979 1 32 ILE H 1 32 ILE MD . . 4.400 3.490 2.004 3.748 . 0 0 "[ . 1 . 2 . 3]" 1
980 1 32 ILE H 1 32 ILE HG12 . . 4.900 3.505 2.126 4.509 . 0 0 "[ . 1 . 2 . 3]" 1
981 1 32 ILE H 1 32 ILE HG13 . . 4.900 2.919 1.987 4.834 . 0 0 "[ . 1 . 2 . 3]" 1
982 1 32 ILE H 1 32 ILE MG . . 4.500 2.856 1.979 3.783 . 0 0 "[ . 1 . 2 . 3]" 1
983 1 32 ILE H 1 33 LEU H . . 6.200 4.411 4.092 4.590 . 0 0 "[ . 1 . 2 . 3]" 1
984 1 32 ILE H 1 48 TYR HA . . 6.600 4.826 4.485 5.245 . 0 0 "[ . 1 . 2 . 3]" 1
985 1 32 ILE H 1 48 TYR QB . . 7.480 4.696 4.076 5.840 . 0 0 "[ . 1 . 2 . 3]" 1
986 1 32 ILE H 1 53 ILE QG . . 6.880 4.612 2.709 6.165 . 0 0 "[ . 1 . 2 . 3]" 1
987 1 32 ILE HA 1 33 LEU HA . . 6.600 4.467 4.364 4.547 . 0 0 "[ . 1 . 2 . 3]" 1
988 1 32 ILE HA 1 33 LEU QB . . 7.600 4.370 3.910 4.603 . 0 0 "[ . 1 . 2 . 3]" 1
989 1 32 ILE HA 1 33 LEU QD . . 9.170 3.999 3.026 5.160 . 0 0 "[ . 1 . 2 . 3]" 1
990 1 32 ILE HA 1 33 LEU HG . . 6.600 4.298 3.130 6.540 . 0 0 "[ . 1 . 2 . 3]" 1
991 1 32 ILE HA 1 34 TYR H . . 5.700 3.926 3.395 4.385 . 0 0 "[ . 1 . 2 . 3]" 1
992 1 32 ILE HA 1 46 ILE MG . . 7.600 3.958 3.036 6.345 . 0 0 "[ . 1 . 2 . 3]" 1
993 1 32 ILE HA 1 48 TYR HA . . 6.600 2.269 2.087 2.777 . 0 0 "[ . 1 . 2 . 3]" 1
994 1 32 ILE HA 1 48 TYR HB2 . . 6.600 2.993 2.353 4.270 . 0 0 "[ . 1 . 2 . 3]" 1
995 1 32 ILE HA 1 48 TYR HB3 . . 6.600 3.040 2.289 4.577 . 0 0 "[ . 1 . 2 . 3]" 1
996 1 32 ILE HA 1 48 TYR QD . . 8.600 4.736 4.258 5.813 . 0 0 "[ . 1 . 2 . 3]" 1
997 1 32 ILE HA 1 49 ASP H . . 6.600 3.497 2.365 4.010 . 0 0 "[ . 1 . 2 . 3]" 1
998 1 32 ILE HA 1 53 ILE MD . . 7.600 5.093 4.221 6.329 . 0 0 "[ . 1 . 2 . 3]" 1
999 1 32 ILE HA 1 58 ILE MD . . 7.600 4.301 3.362 5.166 . 0 0 "[ . 1 . 2 . 3]" 1
1000 1 32 ILE HB 1 33 LEU H . . 5.500 3.316 2.288 4.494 . 0 0 "[ . 1 . 2 . 3]" 1
1001 1 32 ILE HB 1 33 LEU HA . . 6.600 5.083 4.481 6.006 . 0 0 "[ . 1 . 2 . 3]" 1
1002 1 32 ILE HB 1 33 LEU QB . . 7.600 5.331 4.614 6.226 . 0 0 "[ . 1 . 2 . 3]" 1
1003 1 32 ILE HB 1 53 ILE HB . . 6.600 6.344 5.180 6.666 0.066 27 0 "[ . 1 . 2 . 3]" 1
1004 1 32 ILE HB 1 58 ILE MD . . 7.600 4.668 2.271 6.264 . 0 0 "[ . 1 . 2 . 3]" 1
1005 1 32 ILE HB 1 58 ILE QG . . 7.600 4.820 2.855 5.896 . 0 0 "[ . 1 . 2 . 3]" 1
1006 1 32 ILE MD 1 33 LEU H . . 7.600 3.575 2.851 5.406 . 0 0 "[ . 1 . 2 . 3]" 1
1007 1 32 ILE MD 1 34 TYR H . . 6.300 3.584 2.619 5.307 . 0 0 "[ . 1 . 2 . 3]" 1
1008 1 32 ILE MD 1 46 ILE MG . . 8.600 3.612 2.178 5.540 . 0 0 "[ . 1 . 2 . 3]" 1
1009 1 32 ILE MD 1 48 TYR HA . . 7.600 4.727 3.262 5.309 . 0 0 "[ . 1 . 2 . 3]" 1
1010 1 32 ILE MD 1 48 TYR QB . . 8.480 4.423 2.075 5.762 . 0 0 "[ . 1 . 2 . 3]" 1
1011 1 32 ILE MD 1 49 ASP H . . 7.600 5.890 4.277 6.357 . 0 0 "[ . 1 . 2 . 3]" 1
1012 1 32 ILE QG 1 33 LEU H . . 6.390 4.202 2.317 4.970 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 32 ILE QG 1 49 ASP H . . 7.480 5.982 4.767 6.686 . 0 0 "[ . 1 . 2 . 3]" 1
1014 1 32 ILE HG12 1 33 LEU H . . 6.600 4.792 2.331 5.502 . 0 0 "[ . 1 . 2 . 3]" 1
1015 1 32 ILE HG12 1 48 TYR HA . . 6.600 5.697 3.556 6.399 . 0 0 "[ . 1 . 2 . 3]" 1
1016 1 32 ILE HG13 1 33 LEU H . . 6.600 4.846 4.047 5.907 . 0 0 "[ . 1 . 2 . 3]" 1
1017 1 32 ILE HG13 1 48 TYR HA . . 6.600 5.817 4.609 6.600 . 0 0 "[ . 1 . 2 . 3]" 1
1018 1 32 ILE MG 1 33 LEU H . . 7.600 3.747 2.266 4.374 . 0 0 "[ . 1 . 2 . 3]" 1
1019 1 32 ILE MG 1 46 ILE MD . . 8.600 4.441 3.338 5.607 . 0 0 "[ . 1 . 2 . 3]" 1
1020 1 32 ILE MG 1 48 TYR HA . . 7.600 3.883 2.326 5.046 . 0 0 "[ . 1 . 2 . 3]" 1
1021 1 32 ILE MG 1 48 TYR QB . . 8.480 2.995 2.203 4.429 . 0 0 "[ . 1 . 2 . 3]" 1
1022 1 32 ILE MG 1 53 ILE MD . . 8.600 3.328 2.152 5.425 . 0 0 "[ . 1 . 2 . 3]" 1
1023 1 32 ILE MG 1 58 ILE HB . . 7.600 5.558 4.469 6.407 . 0 0 "[ . 1 . 2 . 3]" 1
1024 1 32 ILE MG 1 58 ILE MD . . 8.600 3.092 2.167 4.313 . 0 0 "[ . 1 . 2 . 3]" 1
1025 1 33 LEU H 1 33 LEU HG . . 4.700 3.033 2.083 4.607 . 0 0 "[ . 1 . 2 . 3]" 1
1026 1 33 LEU H 1 34 TYR H . . 3.900 2.173 1.983 2.449 . 0 0 "[ . 1 . 2 . 3]" 1
1027 1 33 LEU H 1 34 TYR HA . . 6.600 4.732 4.444 5.034 . 0 0 "[ . 1 . 2 . 3]" 1
1028 1 33 LEU H 1 34 TYR QD . . 8.600 6.255 6.076 6.505 . 0 0 "[ . 1 . 2 . 3]" 1
1029 1 33 LEU H 1 35 CYS H . . 6.600 6.291 5.853 6.616 0.016 6 0 "[ . 1 . 2 . 3]" 1
1030 1 33 LEU H 1 35 CYS QB . . 7.480 6.210 5.571 6.698 . 0 0 "[ . 1 . 2 . 3]" 1
1031 1 33 LEU H 1 47 LYS HA . . 6.600 4.904 4.641 5.110 . 0 0 "[ . 1 . 2 . 3]" 1
1032 1 33 LEU H 1 47 LYS QB . . 7.480 3.690 2.984 4.646 . 0 0 "[ . 1 . 2 . 3]" 1
1033 1 33 LEU H 1 47 LYS QG . . 7.600 5.423 3.829 5.912 . 0 0 "[ . 1 . 2 . 3]" 1
1034 1 33 LEU H 1 48 TYR HA . . 5.100 2.476 2.058 3.504 . 0 0 "[ . 1 . 2 . 3]" 1
1035 1 33 LEU H 1 48 TYR HB2 . . 6.600 4.406 3.929 5.742 . 0 0 "[ . 1 . 2 . 3]" 1
1036 1 33 LEU H 1 48 TYR HB3 . . 6.600 3.989 3.323 5.720 . 0 0 "[ . 1 . 2 . 3]" 1
1037 1 33 LEU H 1 58 ILE MD . . 7.600 5.653 4.981 6.375 . 0 0 "[ . 1 . 2 . 3]" 1
1038 1 33 LEU HA 1 48 TYR HA . . 6.600 4.929 4.389 6.331 . 0 0 "[ . 1 . 2 . 3]" 1
1039 1 33 LEU QB 1 34 TYR H . . 6.400 2.682 2.491 3.081 . 0 0 "[ . 1 . 2 . 3]" 1
1040 1 33 LEU QB 1 47 LYS QB . . 8.480 2.482 2.068 3.735 . 0 0 "[ . 1 . 2 . 3]" 1
1041 1 33 LEU QB 1 48 TYR H . . 7.600 4.362 3.609 5.736 . 0 0 "[ . 1 . 2 . 3]" 1
1042 1 33 LEU QB 1 48 TYR HA . . 7.600 3.683 2.878 5.509 . 0 0 "[ . 1 . 2 . 3]" 1
1043 1 33 LEU QB 1 49 ASP H . . 7.600 5.005 3.640 6.133 . 0 0 "[ . 1 . 2 . 3]" 1
1044 1 33 LEU QD 1 47 LYS HA . . 9.170 4.522 3.770 5.741 . 0 0 "[ . 1 . 2 . 3]" 1
1045 1 33 LEU QD 1 48 TYR H . . 9.170 3.816 2.808 5.973 . 0 0 "[ . 1 . 2 . 3]" 1
1046 1 33 LEU QD 1 48 TYR HA . . 9.170 3.289 2.133 5.413 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 33 LEU MD1 1 34 TYR H . . 7.600 4.585 4.169 5.094 . 0 0 "[ . 1 . 2 . 3]" 1
1048 1 33 LEU MD1 1 49 ASP H . . 7.600 4.189 2.662 6.062 . 0 0 "[ . 1 . 2 . 3]" 1
1049 1 33 LEU MD1 1 49 ASP HB2 . . 7.600 3.996 2.403 6.030 . 0 0 "[ . 1 . 2 . 3]" 1
1050 1 33 LEU MD1 1 49 ASP HB3 . . 7.600 4.759 2.725 6.338 . 0 0 "[ . 1 . 2 . 3]" 1
1051 1 33 LEU MD2 1 34 TYR H . . 7.600 4.613 3.852 4.882 . 0 0 "[ . 1 . 2 . 3]" 1
1052 1 33 LEU MD2 1 49 ASP H . . 7.600 3.922 2.312 5.325 . 0 0 "[ . 1 . 2 . 3]" 1
1053 1 33 LEU MD2 1 49 ASP HB2 . . 7.600 3.722 2.190 5.601 . 0 0 "[ . 1 . 2 . 3]" 1
1054 1 33 LEU MD2 1 49 ASP HB3 . . 7.600 4.325 2.554 6.341 . 0 0 "[ . 1 . 2 . 3]" 1
1055 1 33 LEU HG 1 34 TYR H . . 5.300 4.442 3.935 5.306 0.006 8 0 "[ . 1 . 2 . 3]" 1
1056 1 33 LEU HG 1 34 TYR QB . . 7.480 5.489 3.066 5.860 . 0 0 "[ . 1 . 2 . 3]" 1
1057 1 33 LEU HG 1 34 TYR QD . . 8.600 7.457 5.080 7.698 . 0 0 "[ . 1 . 2 . 3]" 1
1058 1 33 LEU HG 1 47 LYS HA . . 6.600 5.859 5.281 6.653 0.053 17 0 "[ . 1 . 2 . 3]" 1
1059 1 33 LEU HG 1 47 LYS QB . . 7.480 4.190 3.504 4.834 . 0 0 "[ . 1 . 2 . 3]" 1
1060 1 33 LEU HG 1 48 TYR HA . . 6.600 3.380 2.247 5.839 . 0 0 "[ . 1 . 2 . 3]" 1
1061 1 34 TYR H 1 35 CYS H . . 5.700 4.328 4.224 4.379 . 0 0 "[ . 1 . 2 . 3]" 1
1062 1 34 TYR H 1 35 CYS QB . . 7.480 4.981 4.568 5.524 . 0 0 "[ . 1 . 2 . 3]" 1
1063 1 34 TYR H 1 46 ILE HA . . 6.300 4.426 4.161 4.710 . 0 0 "[ . 1 . 2 . 3]" 1
1064 1 34 TYR H 1 46 ILE MD . . 7.600 6.215 5.604 6.396 . 0 0 "[ . 1 . 2 . 3]" 1
1065 1 34 TYR H 1 46 ILE MG . . 7.600 3.994 3.424 5.714 . 0 0 "[ . 1 . 2 . 3]" 1
1066 1 34 TYR H 1 47 LYS H . . 4.400 2.762 2.548 2.998 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 34 TYR H 1 47 LYS HA . . 6.600 4.641 4.461 4.859 . 0 0 "[ . 1 . 2 . 3]" 1
1068 1 34 TYR H 1 47 LYS HB2 . . 6.000 2.793 2.324 4.640 . 0 0 "[ . 1 . 2 . 3]" 1
1069 1 34 TYR H 1 47 LYS QB . . 5.790 2.731 2.290 4.339 . 0 0 "[ . 1 . 2 . 3]" 1
1070 1 34 TYR H 1 47 LYS HB3 . . 6.000 3.969 3.425 5.344 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 34 TYR H 1 47 LYS QG . . 7.600 4.266 2.549 4.819 . 0 0 "[ . 1 . 2 . 3]" 1
1072 1 34 TYR H 1 48 TYR HA . . 6.400 4.221 3.907 4.987 . 0 0 "[ . 1 . 2 . 3]" 1
1073 1 34 TYR HA 1 35 CYS H . . 3.600 2.336 2.216 2.432 . 0 0 "[ . 1 . 2 . 3]" 1
1074 1 34 TYR HA 1 35 CYS QB . . 7.480 4.249 3.986 4.514 . 0 0 "[ . 1 . 2 . 3]" 1
1075 1 34 TYR QB 1 46 ILE H . . 7.280 6.523 6.448 6.567 . 0 0 "[ . 1 . 2 . 3]" 1
1076 1 34 TYR QB 1 47 LYS H . . 7.280 3.197 2.892 3.741 . 0 0 "[ . 1 . 2 . 3]" 1
1077 1 34 TYR QB 1 47 LYS HA . . 7.480 4.806 4.599 5.339 . 0 0 "[ . 1 . 2 . 3]" 1
1078 1 34 TYR HB2 1 35 CYS H . . 5.100 4.060 3.902 4.257 . 0 0 "[ . 1 . 2 . 3]" 1
1079 1 34 TYR HB2 1 35 CYS HA . . 6.600 5.744 5.522 5.895 . 0 0 "[ . 1 . 2 . 3]" 1
1080 1 34 TYR HB2 1 47 LYS HB2 . . 6.600 3.500 3.051 5.758 . 0 0 "[ . 1 . 2 . 3]" 1
1081 1 34 TYR HB2 1 47 LYS HB3 . . 6.600 4.754 4.160 6.330 . 0 0 "[ . 1 . 2 . 3]" 1
1082 1 34 TYR HB2 1 47 LYS QD . . 7.600 4.580 2.926 6.362 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 34 TYR HB2 1 47 LYS QG . . 7.600 4.084 3.149 5.288 . 0 0 "[ . 1 . 2 . 3]" 1
1084 1 34 TYR HB3 1 35 CYS H . . 5.100 3.794 3.539 4.121 . 0 0 "[ . 1 . 2 . 3]" 1
1085 1 34 TYR HB3 1 35 CYS HA . . 6.600 4.551 4.318 4.778 . 0 0 "[ . 1 . 2 . 3]" 1
1086 1 34 TYR HB3 1 47 LYS HB2 . . 6.600 2.380 2.050 4.801 . 0 0 "[ . 1 . 2 . 3]" 1
1087 1 34 TYR HB3 1 47 LYS HB3 . . 6.600 3.875 3.134 4.977 . 0 0 "[ . 1 . 2 . 3]" 1
1088 1 34 TYR HB3 1 47 LYS QD . . 7.600 3.813 2.448 5.348 . 0 0 "[ . 1 . 2 . 3]" 1
1089 1 34 TYR HB3 1 47 LYS QG . . 7.600 2.792 2.064 3.788 . 0 0 "[ . 1 . 2 . 3]" 1
1090 1 34 TYR QD 1 35 CYS H . . 8.600 2.867 2.171 3.267 . 0 0 "[ . 1 . 2 . 3]" 1
1091 1 34 TYR QD 1 36 SER H . . 8.600 4.428 3.004 5.323 . 0 0 "[ . 1 . 2 . 3]" 1
1092 1 34 TYR QD 1 45 HIS H . . 8.600 6.426 5.899 7.148 . 0 0 "[ . 1 . 2 . 3]" 1
1093 1 34 TYR QD 1 46 ILE H . . 8.600 6.398 5.548 7.438 . 0 0 "[ . 1 . 2 . 3]" 1
1094 1 34 TYR QD 1 46 ILE HA . . 8.600 4.765 3.964 5.806 . 0 0 "[ . 1 . 2 . 3]" 1
1095 1 34 TYR QD 1 46 ILE MG . . 9.600 5.761 5.209 6.405 . 0 0 "[ . 1 . 2 . 3]" 1
1096 1 34 TYR QD 1 47 LYS H . . 8.600 4.325 3.602 5.017 . 0 0 "[ . 1 . 2 . 3]" 1
1097 1 34 TYR QD 1 47 LYS HA . . 8.600 5.951 5.377 6.609 . 0 0 "[ . 1 . 2 . 3]" 1
1098 1 34 TYR QD 1 47 LYS HB2 . . 8.600 4.028 3.108 6.018 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 34 TYR QD 1 47 LYS HB3 . . 8.600 5.250 4.463 5.789 . 0 0 "[ . 1 . 2 . 3]" 1
1100 1 34 TYR QD 1 47 LYS QD . . 9.600 4.224 2.398 6.192 . 0 0 "[ . 1 . 2 . 3]" 1
1101 1 34 TYR QD 1 47 LYS QE . . 9.600 4.509 2.469 5.975 . 0 0 "[ . 1 . 2 . 3]" 1
1102 1 34 TYR QD 1 47 LYS QG . . 9.600 3.101 2.452 4.207 . 0 0 "[ . 1 . 2 . 3]" 1
1103 1 34 TYR QE 1 35 CYS H . . 8.600 3.760 3.167 4.334 . 0 0 "[ . 1 . 2 . 3]" 1
1104 1 34 TYR QE 1 36 SER H . . 8.600 4.532 3.626 5.422 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 34 TYR QE 1 36 SER QB . . 9.600 2.419 2.104 3.478 . 0 0 "[ . 1 . 2 . 3]" 1
1106 1 34 TYR QE 1 45 HIS H . . 8.600 6.250 5.552 6.943 . 0 0 "[ . 1 . 2 . 3]" 1
1107 1 34 TYR QE 1 45 HIS HA . . 8.600 7.081 5.652 7.737 . 0 0 "[ . 1 . 2 . 3]" 1
1108 1 34 TYR QE 1 46 ILE HA . . 8.600 6.193 5.598 6.952 . 0 0 "[ . 1 . 2 . 3]" 1
1109 1 34 TYR QE 1 47 LYS QB . . 9.480 5.892 5.183 6.972 . 0 0 "[ . 1 . 2 . 3]" 1
1110 1 34 TYR QE 1 47 LYS QE . . 9.600 5.950 3.610 7.637 . 0 0 "[ . 1 . 2 . 3]" 1
1111 1 34 TYR QE 1 47 LYS QG . . 9.600 5.025 4.414 6.155 . 0 0 "[ . 1 . 2 . 3]" 1
1112 1 35 CYS H 1 35 CYS HG . . 5.800 4.348 2.397 5.255 . 0 0 "[ . 1 . 2 . 3]" 1
1113 1 35 CYS H 1 36 SER H . . 5.600 4.153 3.598 4.362 . 0 0 "[ . 1 . 2 . 3]" 1
1114 1 35 CYS H 1 36 SER QB . . 7.600 4.631 4.175 5.236 . 0 0 "[ . 1 . 2 . 3]" 1
1115 1 35 CYS H 1 37 VAL QG . . 9.160 5.764 4.816 6.805 . 0 0 "[ . 1 . 2 . 3]" 1
1116 1 35 CYS HA 1 36 SER QB . . 7.600 4.241 3.601 5.031 . 0 0 "[ . 1 . 2 . 3]" 1
1117 1 35 CYS HA 1 37 VAL MG1 . . 7.600 5.042 4.082 6.393 . 0 0 "[ . 1 . 2 . 3]" 1
1118 1 35 CYS HA 1 37 VAL MG2 . . 7.600 5.916 3.689 6.408 . 0 0 "[ . 1 . 2 . 3]" 1
1119 1 35 CYS HA 1 44 ALA MB . . 7.600 4.763 3.806 5.411 . 0 0 "[ . 1 . 2 . 3]" 1
1120 1 35 CYS HA 1 45 HIS H . . 6.600 4.848 4.069 5.405 . 0 0 "[ . 1 . 2 . 3]" 1
1121 1 35 CYS HA 1 45 HIS HD2 . . 6.600 4.618 4.009 5.831 . 0 0 "[ . 1 . 2 . 3]" 1
1122 1 35 CYS HA 1 46 ILE HB . . 6.600 4.787 2.869 5.415 . 0 0 "[ . 1 . 2 . 3]" 1
1123 1 35 CYS HA 1 46 ILE MG . . 7.600 3.444 2.186 4.158 . 0 0 "[ . 1 . 2 . 3]" 1
1124 1 35 CYS HA 1 47 LYS H . . 6.600 3.615 3.381 3.851 . 0 0 "[ . 1 . 2 . 3]" 1
1125 1 35 CYS HA 1 47 LYS QG . . 7.600 5.202 4.521 5.907 . 0 0 "[ . 1 . 2 . 3]" 1
1126 1 35 CYS QB 1 36 SER H . . 5.380 3.423 2.693 4.129 . 0 0 "[ . 1 . 2 . 3]" 1
1127 1 35 CYS HB2 1 36 SER H . . 5.700 3.922 2.736 4.698 . 0 0 "[ . 1 . 2 . 3]" 1
1128 1 35 CYS HB2 1 44 ALA MB . . 7.600 5.203 3.899 6.355 . 0 0 "[ . 1 . 2 . 3]" 1
1129 1 35 CYS HB2 1 46 ILE HA . . 6.600 4.306 3.215 5.373 . 0 0 "[ . 1 . 2 . 3]" 1
1130 1 35 CYS HB2 1 46 ILE MD . . 7.600 4.254 2.795 6.268 . 0 0 "[ . 1 . 2 . 3]" 1
1131 1 35 CYS HB2 1 46 ILE QG . . 7.600 4.199 2.287 6.819 . 0 0 "[ . 1 . 2 . 3]" 1
1132 1 35 CYS HB2 1 46 ILE MG . . 7.600 4.077 2.549 5.594 . 0 0 "[ . 1 . 2 . 3]" 1
1133 1 35 CYS HB3 1 36 SER H . . 5.700 4.015 2.996 4.576 . 0 0 "[ . 1 . 2 . 3]" 1
1134 1 35 CYS HB3 1 44 ALA MB . . 7.600 5.291 4.064 6.355 . 0 0 "[ . 1 . 2 . 3]" 1
1135 1 35 CYS HB3 1 46 ILE HA . . 6.600 4.523 3.542 5.340 . 0 0 "[ . 1 . 2 . 3]" 1
1136 1 35 CYS HB3 1 46 ILE MD . . 7.600 4.407 2.723 6.374 . 0 0 "[ . 1 . 2 . 3]" 1
1137 1 35 CYS HB3 1 46 ILE QG . . 7.600 4.404 2.295 6.800 . 0 0 "[ . 1 . 2 . 3]" 1
1138 1 35 CYS HB3 1 46 ILE MG . . 7.600 4.355 2.498 5.529 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 35 CYS HG 1 36 SER H . . 6.500 5.015 3.394 6.269 . 0 0 "[ . 1 . 2 . 3]" 1
1140 1 36 SER H 1 37 VAL H . . 6.000 3.842 3.166 4.294 . 0 0 "[ . 1 . 2 . 3]" 1
1141 1 36 SER H 1 37 VAL HB . . 6.400 5.759 4.184 6.450 0.050 11 0 "[ . 1 . 2 . 3]" 1
1142 1 36 SER H 1 37 VAL QG . . 9.160 3.951 3.072 4.856 . 0 0 "[ . 1 . 2 . 3]" 1
1143 1 36 SER H 1 44 ALA HA . . 6.600 4.178 3.821 4.698 . 0 0 "[ . 1 . 2 . 3]" 1
1144 1 36 SER H 1 44 ALA MB . . 7.600 4.232 3.818 4.804 . 0 0 "[ . 1 . 2 . 3]" 1
1145 1 36 SER H 1 45 HIS H . . 5.100 3.127 2.806 4.017 . 0 0 "[ . 1 . 2 . 3]" 1
1146 1 36 SER H 1 45 HIS HA . . 6.600 4.738 4.415 5.006 . 0 0 "[ . 1 . 2 . 3]" 1
1147 1 36 SER H 1 45 HIS HB2 . . 6.600 4.888 4.344 5.597 . 0 0 "[ . 1 . 2 . 3]" 1
1148 1 36 SER H 1 45 HIS QB . . 6.440 3.371 2.682 4.041 . 0 0 "[ . 1 . 2 . 3]" 1
1149 1 36 SER H 1 45 HIS HB3 . . 6.600 3.437 2.708 4.146 . 0 0 "[ . 1 . 2 . 3]" 1
1150 1 36 SER H 1 45 HIS HD2 . . 6.600 4.256 3.277 4.574 . 0 0 "[ . 1 . 2 . 3]" 1
1151 1 36 SER H 1 46 ILE H . . 6.600 4.763 4.326 4.994 . 0 0 "[ . 1 . 2 . 3]" 1
1152 1 36 SER H 1 46 ILE HA . . 4.200 3.508 2.448 3.901 . 0 0 "[ . 1 . 2 . 3]" 1
1153 1 36 SER H 1 46 ILE HB . . 6.600 5.812 4.548 6.509 . 0 0 "[ . 1 . 2 . 3]" 1
1154 1 36 SER H 1 46 ILE MD . . 7.600 4.022 2.726 6.364 . 0 0 "[ . 1 . 2 . 3]" 1
1155 1 36 SER HA 1 37 VAL QG . . 9.160 3.511 2.979 4.047 . 0 0 "[ . 1 . 2 . 3]" 1
1156 1 36 SER HA 1 45 HIS H . . 6.600 4.767 4.247 5.022 . 0 0 "[ . 1 . 2 . 3]" 1
1157 1 36 SER HA 1 45 HIS HD2 . . 6.600 6.489 5.604 6.675 0.075 11 0 "[ . 1 . 2 . 3]" 1
1158 1 36 SER QB 1 45 HIS H . . 7.600 3.480 2.814 4.396 . 0 0 "[ . 1 . 2 . 3]" 1
1159 1 36 SER QB 1 45 HIS HD2 . . 7.600 4.030 3.206 4.816 . 0 0 "[ . 1 . 2 . 3]" 1
1160 1 37 VAL H 1 37 VAL MG1 . . 4.800 2.665 1.895 3.708 . 0 0 "[ . 1 . 2 . 3]" 1
1161 1 37 VAL H 1 37 VAL MG2 . . 4.800 2.594 1.863 3.901 . 0 0 "[ . 1 . 2 . 3]" 1
1162 1 37 VAL H 1 38 ALA H . . 6.400 4.582 4.312 4.714 . 0 0 "[ . 1 . 2 . 3]" 1
1163 1 37 VAL H 1 38 ALA MB . . 6.100 4.927 4.499 5.108 . 0 0 "[ . 1 . 2 . 3]" 1
1164 1 37 VAL H 1 44 ALA HA . . 6.600 4.399 4.004 4.728 . 0 0 "[ . 1 . 2 . 3]" 1
1165 1 37 VAL H 1 44 ALA MB . . 7.600 4.771 4.147 5.410 . 0 0 "[ . 1 . 2 . 3]" 1
1166 1 37 VAL H 1 45 HIS H . . 6.600 4.723 4.111 4.960 . 0 0 "[ . 1 . 2 . 3]" 1
1167 1 37 VAL HA 1 38 ALA MB . . 7.600 4.005 3.761 4.302 . 0 0 "[ . 1 . 2 . 3]" 1
1168 1 37 VAL HA 1 43 LYS H . . 6.600 4.550 4.204 4.813 . 0 0 "[ . 1 . 2 . 3]" 1
1169 1 37 VAL HA 1 43 LYS HA . . 6.600 5.372 5.199 5.523 . 0 0 "[ . 1 . 2 . 3]" 1
1170 1 37 VAL HA 1 43 LYS HE2 . . 6.600 5.735 4.384 6.646 0.046 25 0 "[ . 1 . 2 . 3]" 1
1171 1 37 VAL HA 1 43 LYS HE3 . . 6.600 4.700 3.304 6.055 . 0 0 "[ . 1 . 2 . 3]" 1
1172 1 37 VAL HA 1 44 ALA HA . . 6.600 2.122 2.021 2.252 . 0 0 "[ . 1 . 2 . 3]" 1
1173 1 37 VAL HA 1 44 ALA MB . . 7.600 3.179 2.659 3.651 . 0 0 "[ . 1 . 2 . 3]" 1
1174 1 37 VAL HA 1 45 HIS H . . 4.600 3.376 2.732 3.891 . 0 0 "[ . 1 . 2 . 3]" 1
1175 1 37 VAL HB 1 38 ALA H . . 6.400 3.266 2.383 4.382 . 0 0 "[ . 1 . 2 . 3]" 1
1176 1 37 VAL HB 1 44 ALA HA . . 6.600 3.849 2.773 4.953 . 0 0 "[ . 1 . 2 . 3]" 1
1177 1 37 VAL HB 1 44 ALA MB . . 7.600 3.486 2.167 4.581 . 0 0 "[ . 1 . 2 . 3]" 1
1178 1 37 VAL QG 1 38 ALA H . . 7.340 2.972 2.207 3.472 . 0 0 "[ . 1 . 2 . 3]" 1
1179 1 37 VAL QG 1 42 ASN HA . . 9.160 5.449 4.132 6.452 . 0 0 "[ . 1 . 2 . 3]" 1
1180 1 37 VAL QG 1 43 LYS HA . . 9.160 5.072 4.260 5.746 . 0 0 "[ . 1 . 2 . 3]" 1
1181 1 37 VAL QG 1 44 ALA H . . 9.160 4.475 3.864 5.112 . 0 0 "[ . 1 . 2 . 3]" 1
1182 1 37 VAL MG1 1 38 ALA H . . 7.600 3.665 2.614 4.203 . 0 0 "[ . 1 . 2 . 3]" 1
1183 1 37 VAL MG1 1 43 LYS H . . 7.600 5.416 4.355 6.357 . 0 0 "[ . 1 . 2 . 3]" 1
1184 1 37 VAL MG1 1 44 ALA HA . . 7.600 3.237 2.125 4.732 . 0 0 "[ . 1 . 2 . 3]" 1
1185 1 37 VAL MG1 1 44 ALA MB . . 8.600 2.651 1.917 4.406 . 0 0 "[ . 1 . 2 . 3]" 1
1186 1 37 VAL MG1 1 45 HIS H . . 7.600 4.459 3.255 5.797 . 0 0 "[ . 1 . 2 . 3]" 1
1187 1 37 VAL MG2 1 38 ALA H . . 7.600 3.416 2.234 4.294 . 0 0 "[ . 1 . 2 . 3]" 1
1188 1 37 VAL MG2 1 43 LYS H . . 7.600 5.352 3.427 6.370 . 0 0 "[ . 1 . 2 . 3]" 1
1189 1 37 VAL MG2 1 44 ALA HA . . 7.600 4.026 2.332 4.895 . 0 0 "[ . 1 . 2 . 3]" 1
1190 1 37 VAL MG2 1 44 ALA MB . . 8.600 3.521 2.055 4.602 . 0 0 "[ . 1 . 2 . 3]" 1
1191 1 37 VAL MG2 1 45 HIS H . . 7.600 5.187 4.166 5.718 . 0 0 "[ . 1 . 2 . 3]" 1
1192 1 38 ALA H 1 39 LEU H . . 5.400 4.132 3.857 4.348 . 0 0 "[ . 1 . 2 . 3]" 1
1193 1 38 ALA H 1 41 THR H . . 6.600 5.050 4.406 5.848 . 0 0 "[ . 1 . 2 . 3]" 1
1194 1 38 ALA H 1 41 THR HB . . 6.600 5.632 4.475 6.730 0.130 14 0 "[ . 1 . 2 . 3]" 1
1195 1 38 ALA H 1 42 ASN H . . 6.600 4.822 4.089 5.573 . 0 0 "[ . 1 . 2 . 3]" 1
1196 1 38 ALA H 1 42 ASN HA . . 6.600 4.579 4.112 4.756 . 0 0 "[ . 1 . 2 . 3]" 1
1197 1 38 ALA H 1 43 LYS H . . 6.000 2.790 2.553 3.011 . 0 0 "[ . 1 . 2 . 3]" 1
1198 1 38 ALA H 1 43 LYS HA . . 6.600 4.763 4.614 5.122 . 0 0 "[ . 1 . 2 . 3]" 1
1199 1 38 ALA H 1 43 LYS HB2 . . 6.600 5.295 4.723 5.814 . 0 0 "[ . 1 . 2 . 3]" 1
1200 1 38 ALA H 1 43 LYS HB3 . . 6.600 5.089 4.189 5.533 . 0 0 "[ . 1 . 2 . 3]" 1
1201 1 38 ALA H 1 43 LYS QD . . 7.600 3.233 2.284 4.941 . 0 0 "[ . 1 . 2 . 3]" 1
1202 1 38 ALA H 1 44 ALA H . . 6.600 4.993 4.883 5.382 . 0 0 "[ . 1 . 2 . 3]" 1
1203 1 38 ALA H 1 44 ALA HA . . 5.900 3.738 3.456 4.075 . 0 0 "[ . 1 . 2 . 3]" 1
1204 1 38 ALA H 1 44 ALA MB . . 7.600 4.276 3.834 4.941 . 0 0 "[ . 1 . 2 . 3]" 1
1205 1 38 ALA H 1 45 HIS H . . 6.600 5.091 4.543 5.471 . 0 0 "[ . 1 . 2 . 3]" 1
1206 1 38 ALA HA 1 39 LEU HA . . 6.600 4.456 4.293 4.549 . 0 0 "[ . 1 . 2 . 3]" 1
1207 1 38 ALA HA 1 40 ALA H . . 6.000 3.658 3.088 4.562 . 0 0 "[ . 1 . 2 . 3]" 1
1208 1 38 ALA HA 1 41 THR H . . 6.600 4.708 4.253 5.649 . 0 0 "[ . 1 . 2 . 3]" 1
1209 1 38 ALA MB 1 42 ASN H . . 4.900 3.702 3.175 4.100 . 0 0 "[ . 1 . 2 . 3]" 1
1210 1 38 ALA MB 1 42 ASN HD21 . . 7.600 5.902 5.063 6.334 . 0 0 "[ . 1 . 2 . 3]" 1
1211 1 38 ALA MB 1 42 ASN HD22 . . 7.600 6.382 6.339 6.418 . 0 0 "[ . 1 . 2 . 3]" 1
1212 1 38 ALA MB 1 43 LYS H . . 6.800 3.337 2.968 4.026 . 0 0 "[ . 1 . 2 . 3]" 1
1213 1 38 ALA MB 1 45 HIS H . . 7.600 5.566 5.208 5.983 . 0 0 "[ . 1 . 2 . 3]" 1
1214 1 39 LEU H 1 39 LEU MD1 . . 4.800 3.189 1.853 3.877 . 0 0 "[ . 1 . 2 . 3]" 1
1215 1 39 LEU H 1 39 LEU QD . . 4.380 2.848 1.849 3.270 . 0 0 "[ . 1 . 2 . 3]" 1
1216 1 39 LEU H 1 39 LEU MD2 . . 4.800 3.542 3.178 4.022 . 0 0 "[ . 1 . 2 . 3]" 1
1217 1 39 LEU H 1 39 LEU HG . . 3.500 2.285 2.005 3.561 0.061 25 0 "[ . 1 . 2 . 3]" 1
1218 1 39 LEU H 1 40 ALA H . . 3.900 2.496 2.125 2.875 . 0 0 "[ . 1 . 2 . 3]" 1
1219 1 39 LEU H 1 40 ALA HA . . 6.600 5.099 4.781 5.442 . 0 0 "[ . 1 . 2 . 3]" 1
1220 1 39 LEU H 1 41 THR H . . 6.600 4.391 3.812 4.982 . 0 0 "[ . 1 . 2 . 3]" 1
1221 1 39 LEU H 1 41 THR MG . . 7.600 6.556 4.749 7.335 . 0 0 "[ . 1 . 2 . 3]" 1
1222 1 39 LEU H 1 42 ASN H . . 6.600 4.516 4.163 4.959 . 0 0 "[ . 1 . 2 . 3]" 1
1223 1 39 LEU H 1 42 ASN QB . . 7.480 6.598 5.974 6.739 . 0 0 "[ . 1 . 2 . 3]" 1
1224 1 39 LEU H 1 43 LYS H . . 6.600 5.015 4.772 5.554 . 0 0 "[ . 1 . 2 . 3]" 1
1225 1 39 LEU H 1 43 LYS QD . . 7.300 6.290 5.448 6.630 . 0 0 "[ . 1 . 2 . 3]" 1
1226 1 39 LEU HA 1 42 ASN HA . . 6.600 2.593 2.205 3.448 . 0 0 "[ . 1 . 2 . 3]" 1
1227 1 39 LEU QB 1 40 ALA H . . 6.400 3.487 2.153 3.882 . 0 0 "[ . 1 . 2 . 3]" 1
1228 1 39 LEU QB 1 42 ASN QD . . 8.470 3.238 2.635 4.329 . 0 0 "[ . 1 . 2 . 3]" 1
1229 1 39 LEU QD 1 41 THR H . . 9.170 4.707 4.168 5.777 . 0 0 "[ . 1 . 2 . 3]" 1
1230 1 39 LEU QD 1 42 ASN H . . 9.170 4.677 4.334 5.308 . 0 0 "[ . 1 . 2 . 3]" 1
1231 1 39 LEU QD 1 42 ASN HA . . 9.170 5.038 3.860 5.507 . 0 0 "[ . 1 . 2 . 3]" 1
1232 1 39 LEU QD 1 42 ASN QB . . 10.050 5.658 4.662 6.019 . 0 0 "[ . 1 . 2 . 3]" 1
1233 1 39 LEU QD 1 42 ASN QD . . 9.130 3.896 2.869 5.210 . 0 0 "[ . 1 . 2 . 3]" 1
1234 1 39 LEU QD 1 43 LYS H . . 9.170 5.923 5.135 6.429 . 0 0 "[ . 1 . 2 . 3]" 1
1235 1 39 LEU MD1 1 40 ALA H . . 7.600 2.816 1.930 4.342 . 0 0 "[ . 1 . 2 . 3]" 1
1236 1 39 LEU MD1 1 42 ASN HD21 . . 10.740 5.236 4.323 6.530 . 0 0 "[ . 1 . 2 . 3]" 1
1237 1 39 LEU MD1 1 42 ASN HD22 . . 10.740 4.778 3.865 7.514 . 0 0 "[ . 1 . 2 . 3]" 1
1238 1 39 LEU MD2 1 40 ALA H . . 7.600 4.423 2.832 4.846 . 0 0 "[ . 1 . 2 . 3]" 1
1239 1 39 LEU MD2 1 42 ASN HD21 . . 10.740 5.506 2.997 7.012 . 0 0 "[ . 1 . 2 . 3]" 1
1240 1 39 LEU MD2 1 42 ASN HD22 . . 10.740 5.283 3.426 7.344 . 0 0 "[ . 1 . 2 . 3]" 1
1241 1 39 LEU HG 1 40 ALA H . . 4.800 3.321 2.222 4.565 . 0 0 "[ . 1 . 2 . 3]" 1
1242 1 40 ALA H 1 40 ALA MB . . 3.600 2.226 2.181 2.254 . 0 0 "[ . 1 . 2 . 3]" 1
1243 1 40 ALA H 1 41 THR H . . 5.300 2.805 2.484 3.104 . 0 0 "[ . 1 . 2 . 3]" 1
1244 1 40 ALA H 1 41 THR HB . . 6.600 5.491 4.720 6.415 . 0 0 "[ . 1 . 2 . 3]" 1
1245 1 40 ALA H 1 41 THR MG . . 7.600 5.452 3.701 6.329 . 0 0 "[ . 1 . 2 . 3]" 1
1246 1 40 ALA H 1 42 ASN H . . 6.600 3.718 3.158 4.133 . 0 0 "[ . 1 . 2 . 3]" 1
1247 1 40 ALA H 1 43 LYS QD . . 7.600 6.489 5.408 6.820 . 0 0 "[ . 1 . 2 . 3]" 1
1248 1 40 ALA HA 1 41 THR HA . . 6.600 4.669 4.420 4.783 . 0 0 "[ . 1 . 2 . 3]" 1
1249 1 40 ALA HA 1 41 THR MG . . 7.600 5.608 4.509 6.103 . 0 0 "[ . 1 . 2 . 3]" 1
1250 1 40 ALA MB 1 41 THR H . . 3.600 2.517 2.159 3.023 . 0 0 "[ . 1 . 2 . 3]" 1
1251 1 40 ALA MB 1 41 THR HA . . 7.600 4.106 3.922 4.382 . 0 0 "[ . 1 . 2 . 3]" 1
1252 1 40 ALA MB 1 41 THR MG . . 8.600 4.046 2.518 4.795 . 0 0 "[ . 1 . 2 . 3]" 1
1253 1 40 ALA MB 1 42 ASN H . . 7.600 4.235 3.907 4.543 . 0 0 "[ . 1 . 2 . 3]" 1
1254 1 41 THR H 1 41 THR MG . . 4.500 3.259 1.952 4.045 . 0 0 "[ . 1 . 2 . 3]" 1
1255 1 41 THR H 1 42 ASN H . . 3.900 2.304 1.976 2.564 . 0 0 "[ . 1 . 2 . 3]" 1
1256 1 41 THR H 1 42 ASN QB . . 7.480 5.156 4.738 5.545 . 0 0 "[ . 1 . 2 . 3]" 1
1257 1 41 THR H 1 43 LYS H . . 6.000 3.993 3.409 4.703 . 0 0 "[ . 1 . 2 . 3]" 1
1258 1 41 THR H 1 43 LYS HB2 . . 6.600 6.449 6.003 6.658 0.058 23 0 "[ . 1 . 2 . 3]" 1
1259 1 41 THR H 1 43 LYS HB3 . . 6.600 5.158 4.622 6.313 . 0 0 "[ . 1 . 2 . 3]" 1
1260 1 41 THR H 1 43 LYS QD . . 7.600 4.907 3.590 5.662 . 0 0 "[ . 1 . 2 . 3]" 1
1261 1 41 THR HA 1 42 ASN HD21 . . 6.600 5.479 3.462 6.660 0.060 24 0 "[ . 1 . 2 . 3]" 1
1262 1 41 THR HA 1 42 ASN HD22 . . 6.600 5.629 3.166 6.660 0.060 28 0 "[ . 1 . 2 . 3]" 1
1263 1 41 THR HA 1 43 LYS H . . 5.800 5.225 4.691 5.849 0.049 29 0 "[ . 1 . 2 . 3]" 1
1264 1 41 THR HA 1 43 LYS HE2 . . 6.600 6.152 4.937 6.648 0.048 15 0 "[ . 1 . 2 . 3]" 1
1265 1 41 THR HA 1 43 LYS HE3 . . 6.600 6.564 5.919 6.673 0.073 28 0 "[ . 1 . 2 . 3]" 1
1266 1 41 THR HB 1 42 ASN H . . 4.900 3.742 2.691 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
1267 1 41 THR HB 1 43 LYS H . . 6.600 4.096 2.869 5.963 . 0 0 "[ . 1 . 2 . 3]" 1
1268 1 41 THR HB 1 43 LYS HB2 . . 6.600 4.748 3.539 6.643 0.043 12 0 "[ . 1 . 2 . 3]" 1
1269 1 41 THR HB 1 43 LYS HB3 . . 6.600 3.409 2.116 5.084 . 0 0 "[ . 1 . 2 . 3]" 1
1270 1 41 THR HB 1 43 LYS QD . . 7.600 3.864 2.138 5.744 . 0 0 "[ . 1 . 2 . 3]" 1
1271 1 41 THR MG 1 42 ASN H . . 7.600 3.978 2.151 4.549 . 0 0 "[ . 1 . 2 . 3]" 1
1272 1 41 THR MG 1 42 ASN HA . . 7.600 5.243 3.849 6.074 . 0 0 "[ . 1 . 2 . 3]" 1
1273 1 41 THR MG 1 43 LYS H . . 7.600 4.227 2.314 5.427 . 0 0 "[ . 1 . 2 . 3]" 1
1274 1 41 THR MG 1 43 LYS HE2 . . 7.600 3.248 2.107 4.237 . 0 0 "[ . 1 . 2 . 3]" 1
1275 1 41 THR MG 1 43 LYS HE3 . . 7.600 3.897 2.365 4.842 . 0 0 "[ . 1 . 2 . 3]" 1
1276 1 41 THR MG 1 44 ALA H . . 7.600 6.018 5.131 7.300 . 0 0 "[ . 1 . 2 . 3]" 1
1277 1 42 ASN H 1 42 ASN HD21 . . 5.500 3.227 2.166 3.986 . 0 0 "[ . 1 . 2 . 3]" 1
1278 1 42 ASN H 1 42 ASN QD . . 4.860 2.991 2.146 3.543 . 0 0 "[ . 1 . 2 . 3]" 1
1279 1 42 ASN H 1 42 ASN HD22 . . 5.500 3.778 3.131 4.263 . 0 0 "[ . 1 . 2 . 3]" 1
1280 1 42 ASN H 1 43 LYS H . . 4.100 2.921 2.261 3.589 . 0 0 "[ . 1 . 2 . 3]" 1
1281 1 42 ASN H 1 43 LYS HA . . 6.600 5.337 4.825 5.795 . 0 0 "[ . 1 . 2 . 3]" 1
1282 1 42 ASN H 1 43 LYS HB2 . . 6.600 5.982 5.090 6.606 0.006 22 0 "[ . 1 . 2 . 3]" 1
1283 1 42 ASN H 1 43 LYS QB . . 6.060 4.523 3.809 5.198 . 0 0 "[ . 1 . 2 . 3]" 1
1284 1 42 ASN H 1 43 LYS HB3 . . 6.600 4.687 3.893 5.556 . 0 0 "[ . 1 . 2 . 3]" 1
1285 1 42 ASN H 1 43 LYS QD . . 7.600 5.216 3.497 6.120 . 0 0 "[ . 1 . 2 . 3]" 1
1286 1 42 ASN HA 1 43 LYS HA . . 6.600 4.421 4.091 4.601 . 0 0 "[ . 1 . 2 . 3]" 1
1287 1 42 ASN HB2 1 43 LYS H . . 5.800 4.513 4.225 4.754 . 0 0 "[ . 1 . 2 . 3]" 1
1288 1 42 ASN HB2 1 43 LYS HA . . 6.600 5.054 4.510 5.737 . 0 0 "[ . 1 . 2 . 3]" 1
1289 1 42 ASN HB3 1 43 LYS H . . 5.800 4.419 4.186 4.560 . 0 0 "[ . 1 . 2 . 3]" 1
1290 1 42 ASN HB3 1 43 LYS HA . . 6.600 4.937 4.431 5.766 . 0 0 "[ . 1 . 2 . 3]" 1
1291 1 43 LYS H 1 43 LYS HB2 . . 4.200 3.866 3.503 4.023 . 0 0 "[ . 1 . 2 . 3]" 1
1292 1 43 LYS H 1 43 LYS QB . . 3.910 2.995 2.455 3.394 . 0 0 "[ . 1 . 2 . 3]" 1
1293 1 43 LYS H 1 43 LYS HB3 . . 4.200 3.130 2.507 3.747 . 0 0 "[ . 1 . 2 . 3]" 1
1294 1 43 LYS H 1 43 LYS QD . . 5.700 3.400 2.417 4.388 . 0 0 "[ . 1 . 2 . 3]" 1
1295 1 43 LYS H 1 43 LYS HE2 . . 6.600 5.119 4.176 6.231 . 0 0 "[ . 1 . 2 . 3]" 1
1296 1 43 LYS H 1 43 LYS QE . . 6.390 4.330 3.407 4.883 . 0 0 "[ . 1 . 2 . 3]" 1
1297 1 43 LYS H 1 43 LYS HE3 . . 6.600 4.794 3.483 5.487 . 0 0 "[ . 1 . 2 . 3]" 1
1298 1 43 LYS H 1 44 ALA H . . 5.500 4.395 4.230 4.496 . 0 0 "[ . 1 . 2 . 3]" 1
1299 1 43 LYS H 1 44 ALA HA . . 6.400 4.919 4.735 5.162 . 0 0 "[ . 1 . 2 . 3]" 1
1300 1 43 LYS H 1 44 ALA MB . . 5.900 4.890 4.611 4.997 . 0 0 "[ . 1 . 2 . 3]" 1
1301 1 43 LYS HA 1 43 LYS HE2 . . 6.600 5.896 4.964 6.662 0.062 10 0 "[ . 1 . 2 . 3]" 1
1302 1 43 LYS HA 1 43 LYS HE3 . . 6.600 6.026 4.224 6.420 . 0 0 "[ . 1 . 2 . 3]" 1
1303 1 43 LYS HA 1 44 ALA HA . . 6.600 4.491 4.400 4.567 . 0 0 "[ . 1 . 2 . 3]" 1
1304 1 43 LYS HA 1 44 ALA MB . . 7.600 3.969 3.775 4.208 . 0 0 "[ . 1 . 2 . 3]" 1
1305 1 43 LYS HA 1 45 HIS H . . 6.600 5.714 5.241 6.082 . 0 0 "[ . 1 . 2 . 3]" 1
1306 1 43 LYS QB 1 44 ALA HA . . 7.480 4.366 3.689 4.993 . 0 0 "[ . 1 . 2 . 3]" 1
1307 1 43 LYS QB 1 45 HIS H . . 6.580 4.726 3.879 5.869 . 0 0 "[ . 1 . 2 . 3]" 1
1308 1 43 LYS HB2 1 44 ALA H . . 4.800 2.706 2.198 3.713 . 0 0 "[ . 1 . 2 . 3]" 1
1309 1 43 LYS HB3 1 44 ALA H . . 4.800 3.842 3.253 4.264 . 0 0 "[ . 1 . 2 . 3]" 1
1310 1 43 LYS QD 1 44 ALA H . . 7.600 3.530 2.824 4.678 . 0 0 "[ . 1 . 2 . 3]" 1
1311 1 43 LYS QD 1 44 ALA HA . . 7.600 3.238 2.286 5.357 . 0 0 "[ . 1 . 2 . 3]" 1
1312 1 43 LYS HE2 1 44 ALA H . . 6.600 5.939 5.412 6.666 0.066 29 0 "[ . 1 . 2 . 3]" 1
1313 1 43 LYS HE3 1 44 ALA H . . 6.600 5.971 3.985 6.621 0.021 24 0 "[ . 1 . 2 . 3]" 1
1314 1 43 LYS QG 1 44 ALA H . . 7.600 3.442 2.086 4.270 . 0 0 "[ . 1 . 2 . 3]" 1
1315 1 44 ALA H 1 44 ALA MB . . 3.600 2.678 2.461 2.821 . 0 0 "[ . 1 . 2 . 3]" 1
1316 1 44 ALA H 1 45 HIS H . . 6.600 3.907 3.431 4.306 . 0 0 "[ . 1 . 2 . 3]" 1
1317 1 44 ALA H 1 45 HIS HA . . 6.600 4.660 4.437 4.917 . 0 0 "[ . 1 . 2 . 3]" 1
1318 1 44 ALA H 1 46 ILE MD . . 7.600 4.933 4.148 6.342 . 0 0 "[ . 1 . 2 . 3]" 1
1319 1 44 ALA HA 1 45 HIS HA . . 6.600 4.488 4.394 4.578 . 0 0 "[ . 1 . 2 . 3]" 1
1320 1 44 ALA HA 1 45 HIS HB2 . . 6.600 4.627 4.288 4.889 . 0 0 "[ . 1 . 2 . 3]" 1
1321 1 44 ALA HA 1 45 HIS HB3 . . 6.600 4.578 4.317 4.810 . 0 0 "[ . 1 . 2 . 3]" 1
1322 1 44 ALA HA 1 45 HIS HD2 . . 6.600 6.631 6.486 6.692 0.092 25 0 "[ . 1 . 2 . 3]" 1
1323 1 44 ALA HA 1 46 ILE MD . . 7.600 4.113 3.171 6.258 . 0 0 "[ . 1 . 2 . 3]" 1
1324 1 44 ALA MB 1 45 HIS HA . . 7.600 4.381 4.158 4.507 . 0 0 "[ . 1 . 2 . 3]" 1
1325 1 44 ALA MB 1 45 HIS HD2 . . 7.600 6.346 6.153 6.444 . 0 0 "[ . 1 . 2 . 3]" 1
1326 1 44 ALA MB 1 58 ILE QG . . 8.600 6.160 5.373 6.422 . 0 0 "[ . 1 . 2 . 3]" 1
1327 1 44 ALA MB 1 58 ILE MG . . 8.600 4.090 3.420 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
1328 1 45 HIS H 1 45 HIS HD2 . . 5.800 4.694 4.512 4.828 . 0 0 "[ . 1 . 2 . 3]" 1
1329 1 45 HIS H 1 46 ILE H . . 6.600 4.131 3.806 4.445 . 0 0 "[ . 1 . 2 . 3]" 1
1330 1 45 HIS H 1 46 ILE MD . . 7.600 4.201 2.834 6.346 . 0 0 "[ . 1 . 2 . 3]" 1
1331 1 45 HIS H 1 47 LYS QG . . 7.600 6.660 6.079 6.863 . 0 0 "[ . 1 . 2 . 3]" 1
1332 1 45 HIS HA 1 46 ILE HB . . 6.600 4.833 4.359 5.796 . 0 0 "[ . 1 . 2 . 3]" 1
1333 1 45 HIS HA 1 46 ILE MD . . 7.600 4.235 3.434 5.449 . 0 0 "[ . 1 . 2 . 3]" 1
1334 1 45 HIS HA 1 46 ILE QG . . 7.600 4.603 3.472 5.471 . 0 0 "[ . 1 . 2 . 3]" 1
1335 1 45 HIS HA 1 46 ILE MG . . 7.600 5.195 3.588 5.560 . 0 0 "[ . 1 . 2 . 3]" 1
1336 1 45 HIS HA 1 47 LYS QB . . 7.480 6.723 6.264 6.805 . 0 0 "[ . 1 . 2 . 3]" 1
1337 1 45 HIS HA 1 47 LYS QG . . 7.600 5.250 4.683 6.193 . 0 0 "[ . 1 . 2 . 3]" 1
1338 1 45 HIS QB 1 46 ILE H . . 5.800 3.976 3.704 4.055 . 0 0 "[ . 1 . 2 . 3]" 1
1339 1 45 HIS HB2 1 46 ILE H . . 6.300 4.503 4.184 4.596 . 0 0 "[ . 1 . 2 . 3]" 1
1340 1 45 HIS HB3 1 46 ILE H . . 6.300 4.428 4.028 4.514 . 0 0 "[ . 1 . 2 . 3]" 1
1341 1 45 HIS HD2 1 46 ILE H . . 6.600 3.696 2.573 4.385 . 0 0 "[ . 1 . 2 . 3]" 1
1342 1 45 HIS HD2 1 46 ILE MG . . 7.600 5.144 4.595 5.691 . 0 0 "[ . 1 . 2 . 3]" 1
1343 1 45 HIS HD2 1 47 LYS H . . 6.600 3.898 3.232 4.681 . 0 0 "[ . 1 . 2 . 3]" 1
1344 1 45 HIS HD2 1 47 LYS QD . . 7.600 4.187 2.879 5.100 . 0 0 "[ . 1 . 2 . 3]" 1
1345 1 45 HIS HD2 1 47 LYS QG . . 7.600 2.555 2.211 3.044 . 0 0 "[ . 1 . 2 . 3]" 1
1346 1 45 HIS HE1 1 47 LYS QE . . 7.600 4.477 3.014 6.180 . 0 0 "[ . 1 . 2 . 3]" 1
1347 1 45 HIS HE1 1 47 LYS QG . . 7.600 4.522 3.880 5.328 . 0 0 "[ . 1 . 2 . 3]" 1
1348 1 46 ILE H 1 46 ILE MD . . 5.600 3.130 2.416 4.151 . 0 0 "[ . 1 . 2 . 3]" 1
1349 1 46 ILE H 1 47 LYS H . . 4.700 4.347 4.087 4.519 . 0 0 "[ . 1 . 2 . 3]" 1
1350 1 46 ILE H 1 47 LYS HA . . 5.400 4.954 4.674 5.254 . 0 0 "[ . 1 . 2 . 3]" 1
1351 1 46 ILE H 1 48 TYR QD . . 8.600 5.418 4.893 6.532 . 0 0 "[ . 1 . 2 . 3]" 1
1352 1 46 ILE H 1 48 TYR QE . . 8.600 6.287 5.225 7.667 . 0 0 "[ . 1 . 2 . 3]" 1
1353 1 46 ILE HA 1 47 LYS HA . . 6.600 4.482 4.416 4.524 . 0 0 "[ . 1 . 2 . 3]" 1
1354 1 46 ILE HB 1 47 LYS H . . 4.800 3.919 2.496 4.534 . 0 0 "[ . 1 . 2 . 3]" 1
1355 1 46 ILE HB 1 48 TYR QE . . 8.600 5.257 2.931 7.119 . 0 0 "[ . 1 . 2 . 3]" 1
1356 1 46 ILE MD 1 47 LYS H . . 7.600 4.631 4.209 5.400 . 0 0 "[ . 1 . 2 . 3]" 1
1357 1 46 ILE QG 1 47 LYS H . . 7.600 4.061 3.045 5.008 . 0 0 "[ . 1 . 2 . 3]" 1
1358 1 46 ILE MG 1 47 LYS H . . 7.600 2.816 2.156 4.035 . 0 0 "[ . 1 . 2 . 3]" 1
1359 1 46 ILE MG 1 47 LYS HA . . 7.600 3.945 2.857 5.605 . 0 0 "[ . 1 . 2 . 3]" 1
1360 1 46 ILE MG 1 48 TYR H . . 7.600 4.080 2.340 6.321 . 0 0 "[ . 1 . 2 . 3]" 1
1361 1 46 ILE MG 1 48 TYR HA . . 7.600 4.186 2.845 6.372 . 0 0 "[ . 1 . 2 . 3]" 1
1362 1 46 ILE MG 1 48 TYR HB2 . . 7.600 4.063 3.355 6.054 . 0 0 "[ . 1 . 2 . 3]" 1
1363 1 46 ILE MG 1 48 TYR HB3 . . 7.600 2.706 2.025 4.776 . 0 0 "[ . 1 . 2 . 3]" 1
1364 1 46 ILE MG 1 48 TYR QD . . 9.600 3.199 2.071 5.670 . 0 0 "[ . 1 . 2 . 3]" 1
1365 1 46 ILE MG 1 48 TYR QE . . 9.600 4.777 3.529 6.890 . 0 0 "[ . 1 . 2 . 3]" 1
1366 1 46 ILE MG 1 53 ILE MG . . 8.600 4.207 3.426 5.941 . 0 0 "[ . 1 . 2 . 3]" 1
1367 1 46 ILE MG 1 58 ILE MD . . 8.600 2.451 2.006 4.063 . 0 0 "[ . 1 . 2 . 3]" 1
1368 1 47 LYS H 1 48 TYR H . . 6.600 4.235 3.703 4.582 . 0 0 "[ . 1 . 2 . 3]" 1
1369 1 47 LYS H 1 58 ILE MD . . 7.600 5.514 4.864 6.332 . 0 0 "[ . 1 . 2 . 3]" 1
1370 1 47 LYS HA 1 48 TYR HA . . 6.600 4.495 4.409 4.562 . 0 0 "[ . 1 . 2 . 3]" 1
1371 1 47 LYS HA 1 48 TYR QD . . 8.600 3.357 2.241 4.722 . 0 0 "[ . 1 . 2 . 3]" 1
1372 1 47 LYS HA 1 48 TYR QE . . 8.600 5.015 4.068 6.226 . 0 0 "[ . 1 . 2 . 3]" 1
1373 1 47 LYS QB 1 48 TYR H . . 6.090 3.295 2.801 3.923 . 0 0 "[ . 1 . 2 . 3]" 1
1374 1 47 LYS HB2 1 48 TYR H . . 6.400 4.215 2.882 4.574 . 0 0 "[ . 1 . 2 . 3]" 1
1375 1 47 LYS HB3 1 48 TYR H . . 6.400 3.496 2.856 4.275 . 0 0 "[ . 1 . 2 . 3]" 1
1376 1 47 LYS QD 1 48 TYR H . . 7.600 4.687 3.134 5.975 . 0 0 "[ . 1 . 2 . 3]" 1
1377 1 47 LYS QG 1 48 TYR H . . 7.600 4.375 3.975 4.871 . 0 0 "[ . 1 . 2 . 3]" 1
1378 1 48 TYR H 1 49 ASP H . . 6.400 4.424 4.287 4.711 . 0 0 "[ . 1 . 2 . 3]" 1
1379 1 48 TYR H 1 53 ILE MG . . 7.600 5.433 4.900 6.026 . 0 0 "[ . 1 . 2 . 3]" 1
1380 1 48 TYR HA 1 49 ASP HA . . 6.600 4.446 4.320 4.599 . 0 0 "[ . 1 . 2 . 3]" 1
1381 1 48 TYR HA 1 49 ASP QB . . 7.480 4.287 3.969 4.640 . 0 0 "[ . 1 . 2 . 3]" 1
1382 1 48 TYR HA 1 53 ILE MD . . 7.600 6.169 5.173 6.377 . 0 0 "[ . 1 . 2 . 3]" 1
1383 1 48 TYR HA 1 58 ILE MD . . 7.600 4.525 3.108 5.281 . 0 0 "[ . 1 . 2 . 3]" 1
1384 1 48 TYR QB 1 50 PRO HA . . 7.480 4.643 3.785 5.280 . 0 0 "[ . 1 . 2 . 3]" 1
1385 1 48 TYR QB 1 53 ILE H . . 7.480 4.683 3.945 5.362 . 0 0 "[ . 1 . 2 . 3]" 1
1386 1 48 TYR QB 1 53 ILE MG . . 8.480 2.294 1.978 3.051 . 0 0 "[ . 1 . 2 . 3]" 1
1387 1 48 TYR HB2 1 49 ASP H . . 4.800 2.701 2.288 3.067 . 0 0 "[ . 1 . 2 . 3]" 1
1388 1 48 TYR HB2 1 58 ILE MD . . 7.600 2.947 2.071 3.610 . 0 0 "[ . 1 . 2 . 3]" 1
1389 1 48 TYR HB3 1 49 ASP H . . 4.800 3.998 3.674 4.206 . 0 0 "[ . 1 . 2 . 3]" 1
1390 1 48 TYR HB3 1 58 ILE MD . . 7.600 2.611 2.103 3.228 . 0 0 "[ . 1 . 2 . 3]" 1
1391 1 48 TYR QD 1 49 ASP H . . 8.600 3.660 3.244 4.321 . 0 0 "[ . 1 . 2 . 3]" 1
1392 1 48 TYR QD 1 49 ASP HA . . 8.600 4.354 3.148 4.993 . 0 0 "[ . 1 . 2 . 3]" 1
1393 1 48 TYR QD 1 50 PRO HA . . 8.600 2.779 2.409 3.456 . 0 0 "[ . 1 . 2 . 3]" 1
1394 1 48 TYR QD 1 50 PRO QB . . 9.480 3.882 3.268 4.317 . 0 0 "[ . 1 . 2 . 3]" 1
1395 1 48 TYR QD 1 50 PRO HD2 . . 8.600 5.199 4.113 5.631 . 0 0 "[ . 1 . 2 . 3]" 1
1396 1 48 TYR QD 1 50 PRO HD3 . . 8.600 4.124 2.792 4.688 . 0 0 "[ . 1 . 2 . 3]" 1
1397 1 48 TYR QD 1 53 ILE H . . 8.600 3.985 3.245 4.918 . 0 0 "[ . 1 . 2 . 3]" 1
1398 1 48 TYR QD 1 53 ILE HB . . 8.600 4.294 3.050 5.890 . 0 0 "[ . 1 . 2 . 3]" 1
1399 1 48 TYR QD 1 53 ILE HG12 . . 8.600 5.431 4.403 6.707 . 0 0 "[ . 1 . 2 . 3]" 1
1400 1 48 TYR QD 1 53 ILE HG13 . . 8.600 5.658 4.672 6.416 . 0 0 "[ . 1 . 2 . 3]" 1
1401 1 48 TYR QD 1 53 ILE MG . . 9.600 2.358 2.014 3.094 . 0 0 "[ . 1 . 2 . 3]" 1
1402 1 48 TYR QD 1 54 GLY HA2 . . 8.600 4.400 3.327 5.192 . 0 0 "[ . 1 . 2 . 3]" 1
1403 1 48 TYR QD 1 55 PRO HA . . 8.600 4.446 2.827 5.817 . 0 0 "[ . 1 . 2 . 3]" 1
1404 1 48 TYR QD 1 55 PRO HD2 . . 8.600 5.978 4.774 7.164 . 0 0 "[ . 1 . 2 . 3]" 1
1405 1 48 TYR QD 1 55 PRO HD3 . . 8.600 4.799 3.372 6.217 . 0 0 "[ . 1 . 2 . 3]" 1
1406 1 48 TYR QD 1 58 ILE HB . . 8.600 5.428 4.538 6.300 . 0 0 "[ . 1 . 2 . 3]" 1
1407 1 48 TYR QD 1 58 ILE MD . . 9.600 2.768 2.015 3.490 . 0 0 "[ . 1 . 2 . 3]" 1
1408 1 48 TYR QD 1 58 ILE QG . . 9.600 4.430 3.688 5.102 . 0 0 "[ . 1 . 2 . 3]" 1
1409 1 48 TYR QE 1 49 ASP H . . 8.600 5.639 5.314 5.964 . 0 0 "[ . 1 . 2 . 3]" 1
1410 1 48 TYR QE 1 49 ASP HA . . 8.600 5.470 4.750 5.786 . 0 0 "[ . 1 . 2 . 3]" 1
1411 1 48 TYR QE 1 50 PRO HA . . 8.600 2.416 2.193 2.955 . 0 0 "[ . 1 . 2 . 3]" 1
1412 1 48 TYR QE 1 50 PRO HB2 . . 8.600 3.856 3.473 4.315 . 0 0 "[ . 1 . 2 . 3]" 1
1413 1 48 TYR QE 1 50 PRO HB3 . . 8.600 2.752 2.238 3.231 . 0 0 "[ . 1 . 2 . 3]" 1
1414 1 48 TYR QE 1 50 PRO HD2 . . 8.600 5.487 5.004 5.897 . 0 0 "[ . 1 . 2 . 3]" 1
1415 1 48 TYR QE 1 50 PRO HD3 . . 8.600 4.256 3.427 4.889 . 0 0 "[ . 1 . 2 . 3]" 1
1416 1 48 TYR QE 1 50 PRO QG . . 9.480 4.464 3.773 4.934 . 0 0 "[ . 1 . 2 . 3]" 1
1417 1 48 TYR QE 1 53 ILE H . . 8.600 5.179 4.354 6.171 . 0 0 "[ . 1 . 2 . 3]" 1
1418 1 48 TYR QE 1 53 ILE QG . . 9.480 6.054 5.098 7.440 . 0 0 "[ . 1 . 2 . 3]" 1
1419 1 48 TYR QE 1 53 ILE MG . . 9.600 3.796 2.961 5.006 . 0 0 "[ . 1 . 2 . 3]" 1
1420 1 48 TYR QE 1 54 GLY H . . 8.600 5.410 3.945 6.402 . 0 0 "[ . 1 . 2 . 3]" 1
1421 1 48 TYR QE 1 54 GLY HA2 . . 8.600 3.392 2.415 4.626 . 0 0 "[ . 1 . 2 . 3]" 1
1422 1 48 TYR QE 1 55 PRO HA . . 8.600 3.574 2.669 5.208 . 0 0 "[ . 1 . 2 . 3]" 1
1423 1 48 TYR QE 1 55 PRO QB . . 9.480 3.443 2.284 5.313 . 0 0 "[ . 1 . 2 . 3]" 1
1424 1 48 TYR QE 1 55 PRO HD2 . . 8.600 4.331 3.783 5.612 . 0 0 "[ . 1 . 2 . 3]" 1
1425 1 48 TYR QE 1 55 PRO HD3 . . 8.600 2.888 2.210 4.411 . 0 0 "[ . 1 . 2 . 3]" 1
1426 1 48 TYR QE 1 55 PRO QG . . 9.480 4.273 3.214 5.399 . 0 0 "[ . 1 . 2 . 3]" 1
1427 1 48 TYR QE 1 58 ILE MD . . 9.600 3.509 2.339 4.569 . 0 0 "[ . 1 . 2 . 3]" 1
1428 1 48 TYR QE 1 58 ILE QG . . 9.600 5.400 4.435 6.597 . 0 0 "[ . 1 . 2 . 3]" 1
1429 1 49 ASP H 1 50 PRO QD . . 7.480 4.281 4.133 4.347 . 0 0 "[ . 1 . 2 . 3]" 1
1430 1 49 ASP H 1 51 GLU H . . 6.600 5.166 4.565 6.205 . 0 0 "[ . 1 . 2 . 3]" 1
1431 1 49 ASP H 1 52 ILE H . . 6.600 5.160 4.706 6.300 . 0 0 "[ . 1 . 2 . 3]" 1
1432 1 49 ASP H 1 52 ILE HB . . 6.600 5.228 3.755 6.640 0.040 19 0 "[ . 1 . 2 . 3]" 1
1433 1 49 ASP H 1 53 ILE H . . 6.600 4.530 3.892 5.159 . 0 0 "[ . 1 . 2 . 3]" 1
1434 1 49 ASP H 1 53 ILE HB . . 6.600 4.498 3.212 5.933 . 0 0 "[ . 1 . 2 . 3]" 1
1435 1 49 ASP H 1 58 ILE MD . . 7.600 5.222 4.130 5.914 . 0 0 "[ . 1 . 2 . 3]" 1
1436 1 49 ASP HA 1 51 GLU H . . 6.600 4.178 3.727 4.684 . 0 0 "[ . 1 . 2 . 3]" 1
1437 1 49 ASP HA 1 53 ILE H . . 6.600 5.497 5.091 6.104 . 0 0 "[ . 1 . 2 . 3]" 1
1438 1 49 ASP HA 1 53 ILE MG . . 7.600 5.417 4.589 6.330 . 0 0 "[ . 1 . 2 . 3]" 1
1439 1 49 ASP QB 1 51 GLU QB . . 8.350 4.484 2.741 5.895 . 0 0 "[ . 1 . 2 . 3]" 1
1440 1 49 ASP QB 1 52 ILE HB . . 7.480 3.477 2.208 4.976 . 0 0 "[ . 1 . 2 . 3]" 1
1441 1 49 ASP QB 1 52 ILE QG . . 8.480 3.649 2.118 6.197 . 0 0 "[ . 1 . 2 . 3]" 1
1442 1 49 ASP QB 1 52 ILE MG . . 8.480 3.134 1.977 5.501 . 0 0 "[ . 1 . 2 . 3]" 1
1443 1 49 ASP HB2 1 51 GLU H . . 6.600 4.551 3.386 5.600 . 0 0 "[ . 1 . 2 . 3]" 1
1444 1 49 ASP HB2 1 52 ILE H . . 6.600 4.517 2.989 6.544 . 0 0 "[ . 1 . 2 . 3]" 1
1445 1 49 ASP HB2 1 53 ILE H . . 6.600 5.213 3.325 6.444 . 0 0 "[ . 1 . 2 . 3]" 1
1446 1 49 ASP HB3 1 51 GLU H . . 6.600 3.992 3.039 4.795 . 0 0 "[ . 1 . 2 . 3]" 1
1447 1 49 ASP HB3 1 52 ILE H . . 6.600 3.650 2.943 5.792 . 0 0 "[ . 1 . 2 . 3]" 1
1448 1 49 ASP HB3 1 53 ILE H . . 6.600 4.427 3.293 6.115 . 0 0 "[ . 1 . 2 . 3]" 1
1449 1 50 PRO HA 1 51 GLU HA . . 6.600 4.609 4.202 4.858 . 0 0 "[ . 1 . 2 . 3]" 1
1450 1 50 PRO HA 1 52 ILE H . . 6.600 4.460 3.417 4.958 . 0 0 "[ . 1 . 2 . 3]" 1
1451 1 50 PRO HA 1 53 ILE H . . 5.800 3.692 3.321 4.893 . 0 0 "[ . 1 . 2 . 3]" 1
1452 1 50 PRO HA 1 53 ILE MG . . 7.600 3.999 2.750 4.618 . 0 0 "[ . 1 . 2 . 3]" 1
1453 1 50 PRO HA 1 54 GLY QA . . 7.480 3.578 2.221 4.281 . 0 0 "[ . 1 . 2 . 3]" 1
1454 1 50 PRO HA 1 55 PRO QD . . 7.480 4.136 3.068 5.462 . 0 0 "[ . 1 . 2 . 3]" 1
1455 1 50 PRO HA 1 58 ILE MD . . 7.600 5.338 4.520 6.198 . 0 0 "[ . 1 . 2 . 3]" 1
1456 1 50 PRO QB 1 53 ILE H . . 7.480 5.298 4.914 6.311 . 0 0 "[ . 1 . 2 . 3]" 1
1457 1 50 PRO HD2 1 53 ILE H . . 6.600 5.963 5.381 6.635 0.035 25 0 "[ . 1 . 2 . 3]" 1
1458 1 50 PRO HD3 1 53 ILE H . . 6.600 6.113 5.700 6.615 0.015 8 0 "[ . 1 . 2 . 3]" 1
1459 1 51 GLU H 1 51 GLU HG2 . . 4.600 3.401 2.009 4.416 . 0 0 "[ . 1 . 2 . 3]" 1
1460 1 51 GLU H 1 51 GLU QG . . 4.420 2.798 1.994 3.996 . 0 0 "[ . 1 . 2 . 3]" 1
1461 1 51 GLU H 1 51 GLU HG3 . . 4.600 3.303 2.386 4.635 0.035 10 0 "[ . 1 . 2 . 3]" 1
1462 1 51 GLU H 1 52 ILE H . . 4.100 2.280 1.977 3.453 . 0 0 "[ . 1 . 2 . 3]" 1
1463 1 51 GLU H 1 52 ILE QG . . 7.600 4.751 3.340 6.465 . 0 0 "[ . 1 . 2 . 3]" 1
1464 1 51 GLU H 1 52 ILE MG . . 7.600 4.361 2.229 5.723 . 0 0 "[ . 1 . 2 . 3]" 1
1465 1 51 GLU H 1 53 ILE MG . . 7.600 5.193 3.844 6.339 . 0 0 "[ . 1 . 2 . 3]" 1
1466 1 51 GLU HA 1 52 ILE HB . . 6.600 5.782 4.948 6.617 0.017 10 0 "[ . 1 . 2 . 3]" 1
1467 1 51 GLU QB 1 53 ILE H . . 7.480 4.906 4.218 6.167 . 0 0 "[ . 1 . 2 . 3]" 1
1468 1 51 GLU QG 1 53 ILE H . . 7.480 5.202 4.174 6.117 . 0 0 "[ . 1 . 2 . 3]" 1
1469 1 51 GLU HG2 1 52 ILE H . . 6.600 4.107 2.357 5.736 . 0 0 "[ . 1 . 2 . 3]" 1
1470 1 51 GLU HG3 1 52 ILE H . . 6.600 3.856 2.108 6.020 . 0 0 "[ . 1 . 2 . 3]" 1
1471 1 52 ILE H 1 52 ILE MD . . 5.200 3.933 3.124 4.392 . 0 0 "[ . 1 . 2 . 3]" 1
1472 1 52 ILE H 1 53 ILE H . . 3.900 2.543 1.936 2.778 . 0 0 "[ . 1 . 2 . 3]" 1
1473 1 52 ILE H 1 53 ILE HA . . 6.500 5.072 4.087 5.411 . 0 0 "[ . 1 . 2 . 3]" 1
1474 1 52 ILE H 1 53 ILE QG . . 7.480 5.759 4.682 6.477 . 0 0 "[ . 1 . 2 . 3]" 1
1475 1 52 ILE HA 1 53 ILE HA . . 6.600 4.554 4.319 4.682 . 0 0 "[ . 1 . 2 . 3]" 1
1476 1 52 ILE HA 1 53 ILE MD . . 7.600 6.003 5.224 6.392 . 0 0 "[ . 1 . 2 . 3]" 1
1477 1 52 ILE HA 1 53 ILE MG . . 7.600 5.676 5.049 6.152 . 0 0 "[ . 1 . 2 . 3]" 1
1478 1 52 ILE HB 1 53 ILE H . . 4.500 3.562 2.789 4.469 . 0 0 "[ . 1 . 2 . 3]" 1
1479 1 52 ILE HB 1 53 ILE MG . . 7.600 5.150 3.342 6.441 . 0 0 "[ . 1 . 2 . 3]" 1
1480 1 52 ILE MD 1 53 ILE H . . 7.600 4.725 4.158 5.175 . 0 0 "[ . 1 . 2 . 3]" 1
1481 1 52 ILE QG 1 53 ILE H . . 7.600 3.936 2.924 4.647 . 0 0 "[ . 1 . 2 . 3]" 1
1482 1 52 ILE QG 1 53 ILE HB . . 7.600 4.579 3.007 5.822 . 0 0 "[ . 1 . 2 . 3]" 1
1483 1 52 ILE QG 1 53 ILE QG . . 8.480 4.907 2.165 6.799 . 0 0 "[ . 1 . 2 . 3]" 1
1484 1 52 ILE QG 1 53 ILE MG . . 8.600 5.064 2.949 6.400 . 0 0 "[ . 1 . 2 . 3]" 1
1485 1 52 ILE MG 1 53 ILE H . . 7.600 3.120 1.937 4.376 . 0 0 "[ . 1 . 2 . 3]" 1
1486 1 52 ILE MG 1 53 ILE MG . . 8.600 4.015 2.759 5.925 . 0 0 "[ . 1 . 2 . 3]" 1
1487 1 53 ILE H 1 53 ILE HG12 . . 5.600 4.229 3.332 4.781 . 0 0 "[ . 1 . 2 . 3]" 1
1488 1 53 ILE H 1 53 ILE HG13 . . 5.600 4.568 3.992 5.098 . 0 0 "[ . 1 . 2 . 3]" 1
1489 1 53 ILE H 1 53 ILE MG . . 4.200 2.991 2.441 3.567 . 0 0 "[ . 1 . 2 . 3]" 1
1490 1 53 ILE H 1 54 GLY H . . 4.100 4.052 2.361 4.282 0.182 1 0 "[ . 1 . 2 . 3]" 1
1491 1 53 ILE HA 1 57 ASP H . . 6.600 5.431 4.797 6.330 . 0 0 "[ . 1 . 2 . 3]" 1
1492 1 53 ILE HA 1 57 ASP QB . . 7.480 3.586 3.125 4.386 . 0 0 "[ . 1 . 2 . 3]" 1
1493 1 53 ILE HA 1 58 ILE H . . 6.600 5.806 5.299 6.514 . 0 0 "[ . 1 . 2 . 3]" 1
1494 1 53 ILE HB 1 54 GLY H . . 4.800 4.381 3.713 4.683 . 0 0 "[ . 1 . 2 . 3]" 1
1495 1 53 ILE HB 1 57 ASP QB . . 7.480 4.735 4.299 5.585 . 0 0 "[ . 1 . 2 . 3]" 1
1496 1 53 ILE HB 1 58 ILE H . . 6.500 6.321 5.950 6.572 0.072 23 0 "[ . 1 . 2 . 3]" 1
1497 1 53 ILE HB 1 58 ILE MD . . 7.600 4.486 3.895 5.233 . 0 0 "[ . 1 . 2 . 3]" 1
1498 1 53 ILE HB 1 58 ILE QG . . 7.600 4.861 4.452 5.566 . 0 0 "[ . 1 . 2 . 3]" 1
1499 1 53 ILE MD 1 54 GLY H . . 7.600 3.877 2.641 4.802 . 0 0 "[ . 1 . 2 . 3]" 1
1500 1 53 ILE MD 1 57 ASP H . . 7.600 4.753 3.703 5.560 . 0 0 "[ . 1 . 2 . 3]" 1
1501 1 53 ILE MD 1 57 ASP HB2 . . 7.600 2.822 2.080 4.230 . 0 0 "[ . 1 . 2 . 3]" 1
1502 1 53 ILE MD 1 57 ASP HB3 . . 7.600 2.731 1.989 3.518 . 0 0 "[ . 1 . 2 . 3]" 1
1503 1 53 ILE MD 1 58 ILE H . . 7.300 3.790 2.740 4.209 . 0 0 "[ . 1 . 2 . 3]" 1
1504 1 53 ILE MD 1 58 ILE MD . . 8.600 3.494 2.258 4.129 . 0 0 "[ . 1 . 2 . 3]" 1
1505 1 53 ILE MD 1 59 ILE H . . 7.400 5.983 5.090 6.218 . 0 0 "[ . 1 . 2 . 3]" 1
1506 1 53 ILE QG 1 57 ASP H . . 7.480 5.209 3.688 6.475 . 0 0 "[ . 1 . 2 . 3]" 1
1507 1 53 ILE QG 1 57 ASP QB . . 7.420 3.019 1.886 4.329 . 0 0 "[ . 1 . 2 . 3]" 1
1508 1 53 ILE QG 1 58 ILE H . . 7.480 4.493 2.875 5.847 . 0 0 "[ . 1 . 2 . 3]" 1
1509 1 53 ILE QG 1 58 ILE HA . . 7.480 5.216 3.838 6.324 . 0 0 "[ . 1 . 2 . 3]" 1
1510 1 53 ILE QG 1 58 ILE HB . . 7.480 5.743 4.231 6.726 . 0 0 "[ . 1 . 2 . 3]" 1
1511 1 53 ILE QG 1 58 ILE QG . . 8.480 3.481 2.288 4.343 . 0 0 "[ . 1 . 2 . 3]" 1
1512 1 53 ILE HG12 1 54 GLY H . . 5.800 3.914 2.319 5.190 . 0 0 "[ . 1 . 2 . 3]" 1
1513 1 53 ILE HG12 1 57 ASP HB2 . . 8.350 3.665 2.089 5.896 . 0 0 "[ . 1 . 2 . 3]" 1
1514 1 53 ILE HG12 1 57 ASP HB3 . . 8.350 4.091 2.194 5.670 . 0 0 "[ . 1 . 2 . 3]" 1
1515 1 53 ILE HG12 1 58 ILE MD . . 7.600 4.454 2.388 5.738 . 0 0 "[ . 1 . 2 . 3]" 1
1516 1 53 ILE HG13 1 54 GLY H . . 5.800 4.291 2.611 5.626 . 0 0 "[ . 1 . 2 . 3]" 1
1517 1 53 ILE HG13 1 57 ASP HB2 . . 8.350 4.006 2.250 6.461 . 0 0 "[ . 1 . 2 . 3]" 1
1518 1 53 ILE HG13 1 57 ASP HB3 . . 8.350 4.135 2.521 5.885 . 0 0 "[ . 1 . 2 . 3]" 1
1519 1 53 ILE HG13 1 58 ILE MD . . 7.600 4.593 3.675 5.802 . 0 0 "[ . 1 . 2 . 3]" 1
1520 1 53 ILE MG 1 54 GLY H . . 7.600 3.325 2.161 4.190 . 0 0 "[ . 1 . 2 . 3]" 1
1521 1 53 ILE MG 1 57 ASP H . . 7.600 4.639 3.475 5.662 . 0 0 "[ . 1 . 2 . 3]" 1
1522 1 53 ILE MG 1 58 ILE H . . 7.600 3.728 2.977 4.442 . 0 0 "[ . 1 . 2 . 3]" 1
1523 1 53 ILE MG 1 58 ILE HA . . 7.600 4.710 3.936 5.588 . 0 0 "[ . 1 . 2 . 3]" 1
1524 1 53 ILE MG 1 58 ILE HB . . 7.600 4.386 3.771 5.036 . 0 0 "[ . 1 . 2 . 3]" 1
1525 1 53 ILE MG 1 58 ILE MD . . 8.600 2.191 1.885 2.665 . 0 0 "[ . 1 . 2 . 3]" 1
1526 1 53 ILE MG 1 58 ILE QG . . 8.600 2.607 2.068 3.561 . 0 0 "[ . 1 . 2 . 3]" 1
1527 1 53 ILE MG 1 59 ILE H . . 7.600 5.949 5.203 6.403 . 0 0 "[ . 1 . 2 . 3]" 1
1528 1 54 GLY H 1 55 PRO QD . . 7.480 4.347 3.313 4.481 . 0 0 "[ . 1 . 2 . 3]" 1
1529 1 54 GLY H 1 56 ARG H . . 6.600 5.265 4.715 6.567 . 0 0 "[ . 1 . 2 . 3]" 1
1530 1 54 GLY H 1 57 ASP H . . 6.300 3.764 3.110 5.894 . 0 0 "[ . 1 . 2 . 3]" 1
1531 1 54 GLY H 1 57 ASP HB2 . . 6.400 3.136 2.387 6.329 . 0 0 "[ . 1 . 2 . 3]" 1
1532 1 54 GLY H 1 57 ASP QB . . 6.190 3.003 2.354 5.142 . 0 0 "[ . 1 . 2 . 3]" 1
1533 1 54 GLY H 1 57 ASP HB3 . . 6.400 4.122 3.587 6.435 0.035 15 0 "[ . 1 . 2 . 3]" 1
1534 1 54 GLY H 1 58 ILE H . . 6.600 4.846 4.193 6.209 . 0 0 "[ . 1 . 2 . 3]" 1
1535 1 54 GLY H 1 58 ILE MD . . 7.600 4.936 3.810 5.756 . 0 0 "[ . 1 . 2 . 3]" 1
1536 1 54 GLY H 1 58 ILE QG . . 7.600 5.330 4.532 5.946 . 0 0 "[ . 1 . 2 . 3]" 1
1537 1 54 GLY QA 1 57 ASP H . . 6.580 3.337 2.658 4.017 . 0 0 "[ . 1 . 2 . 3]" 1
1538 1 54 GLY QA 1 58 ILE MD . . 8.480 4.517 3.931 5.205 . 0 0 "[ . 1 . 2 . 3]" 1
1539 1 55 PRO HA 1 57 ASP H . . 6.400 4.219 3.877 4.767 . 0 0 "[ . 1 . 2 . 3]" 1
1540 1 55 PRO HA 1 58 ILE H . . 6.100 3.652 3.127 4.465 . 0 0 "[ . 1 . 2 . 3]" 1
1541 1 55 PRO HA 1 58 ILE HB . . 6.600 3.145 2.537 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
1542 1 55 PRO HA 1 58 ILE MD . . 7.600 2.562 2.169 3.416 . 0 0 "[ . 1 . 2 . 3]" 1
1543 1 55 PRO HA 1 58 ILE QG . . 7.600 4.237 3.405 4.928 . 0 0 "[ . 1 . 2 . 3]" 1
1544 1 55 PRO HA 1 59 ILE H . . 6.500 4.303 3.814 5.707 . 0 0 "[ . 1 . 2 . 3]" 1
1545 1 55 PRO HA 1 59 ILE MD . . 7.600 4.314 3.462 5.457 . 0 0 "[ . 1 . 2 . 3]" 1
1546 1 55 PRO QB 1 57 ASP H . . 7.480 4.980 4.806 5.301 . 0 0 "[ . 1 . 2 . 3]" 1
1547 1 55 PRO QB 1 58 ILE MD . . 8.480 3.981 3.514 4.786 . 0 0 "[ . 1 . 2 . 3]" 1
1548 1 55 PRO QB 1 59 ILE MD . . 8.480 3.141 2.227 5.039 . 0 0 "[ . 1 . 2 . 3]" 1
1549 1 55 PRO QD 1 57 ASP H . . 7.480 4.306 3.977 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
1550 1 55 PRO QD 1 58 ILE H . . 7.480 5.480 5.053 6.068 . 0 0 "[ . 1 . 2 . 3]" 1
1551 1 55 PRO QD 1 58 ILE MD . . 8.480 4.582 4.083 5.420 . 0 0 "[ . 1 . 2 . 3]" 1
1552 1 55 PRO HG2 1 57 ASP H . . 6.600 4.971 4.632 5.217 . 0 0 "[ . 1 . 2 . 3]" 1
1553 1 55 PRO HG3 1 57 ASP H . . 6.600 6.265 6.052 6.612 0.012 22 0 "[ . 1 . 2 . 3]" 1
1554 1 56 ARG H 1 57 ASP H . . 4.600 2.898 2.706 3.172 . 0 0 "[ . 1 . 2 . 3]" 1
1555 1 56 ARG H 1 58 ILE H . . 6.600 4.577 4.392 4.956 . 0 0 "[ . 1 . 2 . 3]" 1
1556 1 56 ARG H 1 58 ILE QG . . 7.600 6.286 5.865 6.788 . 0 0 "[ . 1 . 2 . 3]" 1
1557 1 56 ARG H 1 59 ILE H . . 6.600 4.859 4.665 5.401 . 0 0 "[ . 1 . 2 . 3]" 1
1558 1 56 ARG H 1 59 ILE MD . . 7.600 4.219 3.458 6.013 . 0 0 "[ . 1 . 2 . 3]" 1
1559 1 56 ARG H 1 59 ILE MG . . 7.600 5.927 5.629 6.344 . 0 0 "[ . 1 . 2 . 3]" 1
1560 1 56 ARG HA 1 57 ASP HA . . 6.600 4.800 4.679 5.058 . 0 0 "[ . 1 . 2 . 3]" 1
1561 1 56 ARG HA 1 58 ILE H . . 6.600 4.595 3.995 4.876 . 0 0 "[ . 1 . 2 . 3]" 1
1562 1 56 ARG HA 1 59 ILE H . . 5.400 3.453 2.873 4.010 . 0 0 "[ . 1 . 2 . 3]" 1
1563 1 56 ARG HA 1 59 ILE HB . . 6.600 2.446 2.073 2.886 . 0 0 "[ . 1 . 2 . 3]" 1
1564 1 56 ARG HA 1 59 ILE MD . . 7.600 2.843 2.183 4.713 . 0 0 "[ . 1 . 2 . 3]" 1
1565 1 56 ARG HA 1 59 ILE QG . . 7.600 3.680 2.331 4.550 . 0 0 "[ . 1 . 2 . 3]" 1
1566 1 56 ARG HA 1 59 ILE MG . . 7.600 3.733 3.418 4.052 . 0 0 "[ . 1 . 2 . 3]" 1
1567 1 56 ARG HA 1 60 HIS H . . 6.000 3.805 3.528 4.228 . 0 0 "[ . 1 . 2 . 3]" 1
1568 1 56 ARG HA 1 60 HIS QB . . 7.600 5.117 3.864 6.176 . 0 0 "[ . 1 . 2 . 3]" 1
1569 1 56 ARG HA 1 60 HIS HD2 . . 6.600 5.808 4.002 6.703 0.103 2 0 "[ . 1 . 2 . 3]" 1
1570 1 56 ARG HA 1 71 LEU QD . . 9.170 5.798 4.043 6.814 . 0 0 "[ . 1 . 2 . 3]" 1
1571 1 56 ARG HB2 1 57 ASP H . . 6.000 3.796 2.581 4.450 . 0 0 "[ . 1 . 2 . 3]" 1
1572 1 56 ARG HB3 1 57 ASP H . . 6.000 3.290 2.314 4.271 . 0 0 "[ . 1 . 2 . 3]" 1
1573 1 56 ARG QD 1 60 HIS H . . 7.600 5.200 3.283 6.546 . 0 0 "[ . 1 . 2 . 3]" 1
1574 1 56 ARG QG 1 57 ASP H . . 7.000 3.824 1.977 4.856 . 0 0 "[ . 1 . 2 . 3]" 1
1575 1 57 ASP H 1 58 ILE H . . 4.000 2.682 2.452 3.199 . 0 0 "[ . 1 . 2 . 3]" 1
1576 1 57 ASP H 1 58 ILE HA . . 5.700 5.331 5.138 5.734 0.034 14 0 "[ . 1 . 2 . 3]" 1
1577 1 57 ASP H 1 58 ILE MD . . 7.600 4.588 3.631 5.746 . 0 0 "[ . 1 . 2 . 3]" 1
1578 1 57 ASP H 1 58 ILE QG . . 7.400 4.715 4.375 5.434 . 0 0 "[ . 1 . 2 . 3]" 1
1579 1 57 ASP H 1 58 ILE MG . . 7.600 5.810 5.484 6.152 . 0 0 "[ . 1 . 2 . 3]" 1
1580 1 57 ASP H 1 59 ILE H . . 6.400 4.148 3.899 4.597 . 0 0 "[ . 1 . 2 . 3]" 1
1581 1 57 ASP H 1 59 ILE MD . . 7.600 5.279 4.829 6.352 . 0 0 "[ . 1 . 2 . 3]" 1
1582 1 57 ASP H 1 59 ILE QG . . 7.600 5.533 4.744 6.213 . 0 0 "[ . 1 . 2 . 3]" 1
1583 1 57 ASP H 1 59 ILE MG . . 7.600 6.133 5.904 6.339 . 0 0 "[ . 1 . 2 . 3]" 1
1584 1 57 ASP H 1 60 HIS H . . 6.600 4.601 4.298 4.843 . 0 0 "[ . 1 . 2 . 3]" 1
1585 1 57 ASP H 1 60 HIS QB . . 7.600 4.888 4.346 5.221 . 0 0 "[ . 1 . 2 . 3]" 1
1586 1 57 ASP HA 1 58 ILE QG . . 7.600 5.277 4.999 5.744 . 0 0 "[ . 1 . 2 . 3]" 1
1587 1 57 ASP HA 1 59 ILE H . . 6.600 4.604 4.031 5.001 . 0 0 "[ . 1 . 2 . 3]" 1
1588 1 57 ASP HA 1 60 HIS H . . 5.700 3.441 2.637 4.095 . 0 0 "[ . 1 . 2 . 3]" 1
1589 1 57 ASP HA 1 60 HIS QB . . 7.600 2.637 2.196 3.151 . 0 0 "[ . 1 . 2 . 3]" 1
1590 1 57 ASP HA 1 60 HIS HD2 . . 6.600 4.843 2.340 6.258 . 0 0 "[ . 1 . 2 . 3]" 1
1591 1 57 ASP HA 1 61 THR H . . 6.500 4.169 3.842 5.118 . 0 0 "[ . 1 . 2 . 3]" 1
1592 1 57 ASP QB 1 58 ILE HB . . 7.480 4.532 4.163 5.228 . 0 0 "[ . 1 . 2 . 3]" 1
1593 1 57 ASP QB 1 58 ILE MG . . 8.480 5.189 4.851 5.618 . 0 0 "[ . 1 . 2 . 3]" 1
1594 1 57 ASP HB2 1 58 ILE H . . 5.300 2.612 2.091 4.047 . 0 0 "[ . 1 . 2 . 3]" 1
1595 1 57 ASP HB2 1 59 ILE H . . 6.600 5.138 4.757 5.990 . 0 0 "[ . 1 . 2 . 3]" 1
1596 1 57 ASP HB3 1 58 ILE H . . 5.300 3.508 2.302 3.875 . 0 0 "[ . 1 . 2 . 3]" 1
1597 1 57 ASP HB3 1 59 ILE H . . 6.600 5.726 5.001 6.012 . 0 0 "[ . 1 . 2 . 3]" 1
1598 1 58 ILE H 1 58 ILE HB . . 4.100 2.369 2.222 2.608 . 0 0 "[ . 1 . 2 . 3]" 1
1599 1 58 ILE H 1 58 ILE MD . . 5.000 2.959 1.948 3.637 . 0 0 "[ . 1 . 2 . 3]" 1
1600 1 58 ILE H 1 58 ILE MG . . 4.700 3.755 3.703 3.805 . 0 0 "[ . 1 . 2 . 3]" 1
1601 1 58 ILE H 1 59 ILE H . . 4.300 2.802 2.588 3.026 . 0 0 "[ . 1 . 2 . 3]" 1
1602 1 58 ILE H 1 59 ILE HA . . 6.600 5.396 5.210 5.594 . 0 0 "[ . 1 . 2 . 3]" 1
1603 1 58 ILE H 1 59 ILE HB . . 6.600 4.775 4.499 5.211 . 0 0 "[ . 1 . 2 . 3]" 1
1604 1 58 ILE H 1 59 ILE MD . . 7.600 5.018 4.733 5.434 . 0 0 "[ . 1 . 2 . 3]" 1
1605 1 58 ILE H 1 60 HIS H . . 6.400 4.284 4.018 4.607 . 0 0 "[ . 1 . 2 . 3]" 1
1606 1 58 ILE HA 1 60 HIS H . . 6.600 4.678 4.362 5.063 . 0 0 "[ . 1 . 2 . 3]" 1
1607 1 58 ILE HA 1 61 THR H . . 5.600 3.386 3.162 3.589 . 0 0 "[ . 1 . 2 . 3]" 1
1608 1 58 ILE HA 1 61 THR HB . . 6.600 2.884 2.652 3.398 . 0 0 "[ . 1 . 2 . 3]" 1
1609 1 58 ILE HA 1 61 THR MG . . 7.600 4.126 2.975 4.558 . 0 0 "[ . 1 . 2 . 3]" 1
1610 1 58 ILE HA 1 62 ILE H . . 6.600 4.132 3.902 4.599 . 0 0 "[ . 1 . 2 . 3]" 1
1611 1 58 ILE HB 1 59 ILE H . . 4.100 2.549 2.304 2.772 . 0 0 "[ . 1 . 2 . 3]" 1
1612 1 58 ILE MD 1 59 ILE H . . 7.600 4.249 3.711 4.725 . 0 0 "[ . 1 . 2 . 3]" 1
1613 1 58 ILE MD 1 61 THR H . . 7.600 6.309 5.534 6.402 . 0 0 "[ . 1 . 2 . 3]" 1
1614 1 58 ILE MD 1 62 ILE QG . . 8.600 6.174 5.705 6.411 . 0 0 "[ . 1 . 2 . 3]" 1
1615 1 58 ILE QG 1 59 ILE H . . 7.600 4.241 4.094 4.428 . 0 0 "[ . 1 . 2 . 3]" 1
1616 1 58 ILE QG 1 60 HIS H . . 7.600 5.875 5.627 6.083 . 0 0 "[ . 1 . 2 . 3]" 1
1617 1 58 ILE QG 1 61 THR H . . 7.600 5.233 5.058 5.401 . 0 0 "[ . 1 . 2 . 3]" 1
1618 1 58 ILE QG 1 61 THR HB . . 7.600 4.611 4.228 5.124 . 0 0 "[ . 1 . 2 . 3]" 1
1619 1 58 ILE QG 1 62 ILE HB . . 7.600 6.579 6.107 6.837 . 0 0 "[ . 1 . 2 . 3]" 1
1620 1 58 ILE QG 1 62 ILE QG . . 8.600 5.573 4.855 6.457 . 0 0 "[ . 1 . 2 . 3]" 1
1621 1 58 ILE MG 1 59 ILE H . . 7.600 3.094 2.760 3.348 . 0 0 "[ . 1 . 2 . 3]" 1
1622 1 58 ILE MG 1 59 ILE HA . . 7.600 3.304 3.073 3.537 . 0 0 "[ . 1 . 2 . 3]" 1
1623 1 58 ILE MG 1 60 HIS H . . 7.600 5.071 4.884 5.257 . 0 0 "[ . 1 . 2 . 3]" 1
1624 1 58 ILE MG 1 61 THR H . . 7.600 4.587 4.234 4.865 . 0 0 "[ . 1 . 2 . 3]" 1
1625 1 58 ILE MG 1 61 THR HB . . 7.600 3.877 3.312 4.948 . 0 0 "[ . 1 . 2 . 3]" 1
1626 1 58 ILE MG 1 62 ILE H . . 7.600 4.007 3.669 4.256 . 0 0 "[ . 1 . 2 . 3]" 1
1627 1 58 ILE MG 1 62 ILE HA . . 7.600 5.421 5.055 5.781 . 0 0 "[ . 1 . 2 . 3]" 1
1628 1 58 ILE MG 1 62 ILE HB . . 7.600 4.020 3.481 4.336 . 0 0 "[ . 1 . 2 . 3]" 1
1629 1 58 ILE MG 1 62 ILE MG . . 8.600 4.604 4.229 4.959 . 0 0 "[ . 1 . 2 . 3]" 1
1630 1 58 ILE MG 1 63 GLU H . . 7.600 5.910 5.707 6.094 . 0 0 "[ . 1 . 2 . 3]" 1
1631 1 59 ILE H 1 59 ILE HB . . 3.700 2.376 2.256 2.641 . 0 0 "[ . 1 . 2 . 3]" 1
1632 1 59 ILE H 1 59 ILE MD . . 3.800 3.171 2.903 3.211 . 0 0 "[ . 1 . 2 . 3]" 1
1633 1 59 ILE H 1 59 ILE MG . . 4.400 3.715 3.686 3.775 . 0 0 "[ . 1 . 2 . 3]" 1
1634 1 59 ILE H 1 60 HIS H . . 3.600 2.891 2.683 3.006 . 0 0 "[ . 1 . 2 . 3]" 1
1635 1 59 ILE H 1 60 HIS HA . . 6.600 5.467 5.290 5.573 . 0 0 "[ . 1 . 2 . 3]" 1
1636 1 59 ILE H 1 61 THR H . . 5.500 4.132 3.935 4.304 . 0 0 "[ . 1 . 2 . 3]" 1
1637 1 59 ILE H 1 62 ILE H . . 6.600 4.809 4.728 5.017 . 0 0 "[ . 1 . 2 . 3]" 1
1638 1 59 ILE H 1 62 ILE MD . . 7.600 4.308 3.863 4.961 . 0 0 "[ . 1 . 2 . 3]" 1
1639 1 59 ILE H 1 69 ALA MB . . 7.600 5.135 4.715 5.783 . 0 0 "[ . 1 . 2 . 3]" 1
1640 1 59 ILE HA 1 61 THR H . . 5.400 4.249 4.032 4.425 . 0 0 "[ . 1 . 2 . 3]" 1
1641 1 59 ILE HA 1 62 ILE H . . 5.800 3.433 3.149 3.719 . 0 0 "[ . 1 . 2 . 3]" 1
1642 1 59 ILE HA 1 62 ILE HA . . 6.600 5.403 5.098 5.782 . 0 0 "[ . 1 . 2 . 3]" 1
1643 1 59 ILE HA 1 62 ILE HB . . 6.600 2.516 2.212 2.914 . 0 0 "[ . 1 . 2 . 3]" 1
1644 1 59 ILE HA 1 62 ILE MD . . 7.600 2.892 2.326 4.115 . 0 0 "[ . 1 . 2 . 3]" 1
1645 1 59 ILE HA 1 62 ILE QG . . 7.600 3.995 3.529 4.482 . 0 0 "[ . 1 . 2 . 3]" 1
1646 1 59 ILE HA 1 62 ILE MG . . 7.600 3.663 3.134 4.152 . 0 0 "[ . 1 . 2 . 3]" 1
1647 1 59 ILE HA 1 63 GLU H . . 6.400 3.897 3.656 4.175 . 0 0 "[ . 1 . 2 . 3]" 1
1648 1 59 ILE HA 1 69 ALA MB . . 7.600 3.134 2.430 3.770 . 0 0 "[ . 1 . 2 . 3]" 1
1649 1 59 ILE HB 1 60 HIS H . . 4.100 2.611 2.145 2.974 . 0 0 "[ . 1 . 2 . 3]" 1
1650 1 59 ILE HB 1 60 HIS HA . . 6.600 4.607 4.262 4.924 . 0 0 "[ . 1 . 2 . 3]" 1
1651 1 59 ILE HB 1 61 THR H . . 5.700 5.020 4.742 5.195 . 0 0 "[ . 1 . 2 . 3]" 1
1652 1 59 ILE MD 1 60 HIS H . . 7.600 4.520 4.329 4.875 . 0 0 "[ . 1 . 2 . 3]" 1
1653 1 59 ILE MD 1 61 THR H . . 7.600 6.203 5.512 6.388 . 0 0 "[ . 1 . 2 . 3]" 1
1654 1 59 ILE MD 1 70 SER H . . 7.600 5.303 3.968 6.331 . 0 0 "[ . 1 . 2 . 3]" 1
1655 1 59 ILE MD 1 70 SER HA . . 7.600 4.615 2.930 6.052 . 0 0 "[ . 1 . 2 . 3]" 1
1656 1 59 ILE MD 1 71 LEU HA . . 7.600 5.147 3.834 5.955 . 0 0 "[ . 1 . 2 . 3]" 1
1657 1 59 ILE QG 1 60 HIS H . . 7.600 4.213 3.762 4.411 . 0 0 "[ . 1 . 2 . 3]" 1
1658 1 59 ILE QG 1 61 THR H . . 7.600 5.576 5.414 5.914 . 0 0 "[ . 1 . 2 . 3]" 1
1659 1 59 ILE QG 1 62 ILE MD . . 8.600 3.944 2.921 5.419 . 0 0 "[ . 1 . 2 . 3]" 1
1660 1 59 ILE MG 1 60 HIS H . . 7.500 3.135 2.900 3.575 . 0 0 "[ . 1 . 2 . 3]" 1
1661 1 59 ILE MG 1 60 HIS HD2 . . 7.600 4.404 2.426 6.435 . 0 0 "[ . 1 . 2 . 3]" 1
1662 1 59 ILE MG 1 61 THR H . . 7.600 4.870 4.757 4.996 . 0 0 "[ . 1 . 2 . 3]" 1
1663 1 59 ILE MG 1 63 GLU HG2 . . 7.600 3.746 3.363 4.651 . 0 0 "[ . 1 . 2 . 3]" 1
1664 1 59 ILE MG 1 63 GLU HG3 . . 7.600 2.954 2.353 5.434 . 0 0 "[ . 1 . 2 . 3]" 1
1665 1 59 ILE MG 1 69 ALA H . . 7.600 3.977 3.316 4.822 . 0 0 "[ . 1 . 2 . 3]" 1
1666 1 60 HIS H 1 60 HIS HD2 . . 6.000 3.785 2.699 4.946 . 0 0 "[ . 1 . 2 . 3]" 1
1667 1 60 HIS H 1 61 THR H . . 4.100 2.837 2.609 2.985 . 0 0 "[ . 1 . 2 . 3]" 1
1668 1 60 HIS H 1 61 THR HB . . 5.900 5.192 4.920 5.371 . 0 0 "[ . 1 . 2 . 3]" 1
1669 1 60 HIS H 1 62 ILE H . . 6.600 4.427 4.142 4.566 . 0 0 "[ . 1 . 2 . 3]" 1
1670 1 60 HIS H 1 63 GLU H . . 6.600 4.759 4.500 4.876 . 0 0 "[ . 1 . 2 . 3]" 1
1671 1 60 HIS H 1 63 GLU QB . . 7.480 4.900 4.691 5.740 . 0 0 "[ . 1 . 2 . 3]" 1
1672 1 60 HIS HA 1 62 ILE H . . 6.600 4.644 4.281 4.891 . 0 0 "[ . 1 . 2 . 3]" 1
1673 1 60 HIS HA 1 63 GLU H . . 5.900 3.532 2.848 3.841 . 0 0 "[ . 1 . 2 . 3]" 1
1674 1 60 HIS HA 1 63 GLU HB2 . . 6.600 2.832 2.234 5.111 . 0 0 "[ . 1 . 2 . 3]" 1
1675 1 60 HIS HA 1 63 GLU HB3 . . 6.600 4.102 2.711 4.741 . 0 0 "[ . 1 . 2 . 3]" 1
1676 1 60 HIS HA 1 63 GLU QG . . 7.480 3.439 2.112 4.220 . 0 0 "[ . 1 . 2 . 3]" 1
1677 1 60 HIS HA 1 64 SER H . . 6.200 3.711 3.470 3.992 . 0 0 "[ . 1 . 2 . 3]" 1
1678 1 60 HIS QB 1 61 THR H . . 5.500 2.768 2.536 3.368 . 0 0 "[ . 1 . 2 . 3]" 1
1679 1 60 HIS QB 1 64 SER H . . 7.600 4.651 4.287 5.105 . 0 0 "[ . 1 . 2 . 3]" 1
1680 1 60 HIS HD2 1 61 THR H . . 6.600 5.130 3.211 6.054 . 0 0 "[ . 1 . 2 . 3]" 1
1681 1 60 HIS HD2 1 63 GLU H . . 6.600 6.056 5.443 6.666 0.066 2 0 "[ . 1 . 2 . 3]" 1
1682 1 60 HIS HD2 1 63 GLU QB . . 7.480 4.739 3.647 6.704 . 0 0 "[ . 1 . 2 . 3]" 1
1683 1 60 HIS HD2 1 64 SER QB . . 7.480 5.711 4.675 6.677 . 0 0 "[ . 1 . 2 . 3]" 1
1684 1 61 THR H 1 61 THR HB . . 3.700 2.567 2.317 2.673 . 0 0 "[ . 1 . 2 . 3]" 1
1685 1 61 THR H 1 61 THR MG . . 4.400 3.763 2.996 3.825 . 0 0 "[ . 1 . 2 . 3]" 1
1686 1 61 THR H 1 62 ILE H . . 4.200 2.629 2.524 2.748 . 0 0 "[ . 1 . 2 . 3]" 1
1687 1 61 THR H 1 62 ILE HA . . 6.400 5.294 5.208 5.390 . 0 0 "[ . 1 . 2 . 3]" 1
1688 1 61 THR H 1 62 ILE HB . . 4.400 4.426 4.192 4.469 0.069 25 0 "[ . 1 . 2 . 3]" 1
1689 1 61 THR H 1 62 ILE MD . . 7.600 4.620 3.628 5.435 . 0 0 "[ . 1 . 2 . 3]" 1
1690 1 61 THR H 1 62 ILE QG . . 7.600 5.005 4.392 5.861 . 0 0 "[ . 1 . 2 . 3]" 1
1691 1 61 THR H 1 63 GLU H . . 6.200 4.185 3.960 4.339 . 0 0 "[ . 1 . 2 . 3]" 1
1692 1 61 THR H 1 64 SER H . . 6.000 4.659 4.506 4.966 . 0 0 "[ . 1 . 2 . 3]" 1
1693 1 61 THR HA 1 63 GLU H . . 6.600 4.686 4.440 4.895 . 0 0 "[ . 1 . 2 . 3]" 1
1694 1 61 THR HA 1 64 SER H . . 5.500 3.584 3.265 3.994 . 0 0 "[ . 1 . 2 . 3]" 1
1695 1 61 THR HA 1 64 SER HA . . 6.600 5.456 5.096 6.062 . 0 0 "[ . 1 . 2 . 3]" 1
1696 1 61 THR HA 1 64 SER QB . . 7.480 2.712 2.348 3.590 . 0 0 "[ . 1 . 2 . 3]" 1
1697 1 61 THR HB 1 62 ILE H . . 4.400 2.567 2.347 3.598 . 0 0 "[ . 1 . 2 . 3]" 1
1698 1 61 THR HB 1 62 ILE HA . . 6.600 4.407 4.060 5.674 . 0 0 "[ . 1 . 2 . 3]" 1
1699 1 61 THR HB 1 63 GLU H . . 6.600 5.218 5.068 5.885 . 0 0 "[ . 1 . 2 . 3]" 1
1700 1 61 THR HB 1 64 SER H . . 6.600 5.679 5.449 6.074 . 0 0 "[ . 1 . 2 . 3]" 1
1701 1 61 THR MG 1 62 ILE H . . 7.500 3.468 2.333 3.711 . 0 0 "[ . 1 . 2 . 3]" 1
1702 1 61 THR MG 1 62 ILE HA . . 7.600 3.741 3.318 4.014 . 0 0 "[ . 1 . 2 . 3]" 1
1703 1 61 THR MG 1 62 ILE HB . . 7.600 5.109 3.744 5.439 . 0 0 "[ . 1 . 2 . 3]" 1
1704 1 61 THR MG 1 64 SER H . . 7.600 4.939 4.647 5.382 . 0 0 "[ . 1 . 2 . 3]" 1
1705 1 61 THR MG 1 65 LEU H . . 6.800 4.355 3.971 5.432 . 0 0 "[ . 1 . 2 . 3]" 1
1706 1 62 ILE H 1 62 ILE HB . . 3.900 2.205 2.030 2.317 . 0 0 "[ . 1 . 2 . 3]" 1
1707 1 62 ILE H 1 62 ILE MD . . 4.700 2.963 2.038 3.587 . 0 0 "[ . 1 . 2 . 3]" 1
1708 1 62 ILE H 1 62 ILE MG . . 4.700 3.673 3.500 3.747 . 0 0 "[ . 1 . 2 . 3]" 1
1709 1 62 ILE H 1 63 GLU H . . 4.400 2.863 2.768 2.957 . 0 0 "[ . 1 . 2 . 3]" 1
1710 1 62 ILE H 1 63 GLU HA . . 6.100 5.449 5.268 5.547 . 0 0 "[ . 1 . 2 . 3]" 1
1711 1 62 ILE H 1 63 GLU HB2 . . 6.400 5.070 4.714 6.448 0.048 20 0 "[ . 1 . 2 . 3]" 1
1712 1 62 ILE H 1 63 GLU QB . . 6.240 4.743 4.577 5.066 . 0 0 "[ . 1 . 2 . 3]" 1
1713 1 62 ILE H 1 63 GLU HB3 . . 6.400 6.158 4.763 6.414 0.014 30 0 "[ . 1 . 2 . 3]" 1
1714 1 62 ILE H 1 63 GLU HG2 . . 6.600 6.037 4.175 6.503 . 0 0 "[ . 1 . 2 . 3]" 1
1715 1 62 ILE H 1 63 GLU HG3 . . 6.600 4.905 4.412 6.639 0.039 5 0 "[ . 1 . 2 . 3]" 1
1716 1 62 ILE H 1 64 SER H . . 6.600 4.296 4.110 4.459 . 0 0 "[ . 1 . 2 . 3]" 1
1717 1 62 ILE H 1 65 LEU H . . 6.600 4.917 4.642 5.532 . 0 0 "[ . 1 . 2 . 3]" 1
1718 1 62 ILE H 1 69 ALA MB . . 7.600 5.053 4.263 5.467 . 0 0 "[ . 1 . 2 . 3]" 1
1719 1 62 ILE HA 1 64 SER H . . 6.600 4.685 4.322 4.911 . 0 0 "[ . 1 . 2 . 3]" 1
1720 1 62 ILE HA 1 65 LEU H . . 5.500 3.713 3.277 4.223 . 0 0 "[ . 1 . 2 . 3]" 1
1721 1 62 ILE HA 1 65 LEU HB2 . . 6.600 3.161 2.676 4.016 . 0 0 "[ . 1 . 2 . 3]" 1
1722 1 62 ILE HA 1 65 LEU HB3 . . 6.600 4.770 4.206 5.673 . 0 0 "[ . 1 . 2 . 3]" 1
1723 1 62 ILE HA 1 65 LEU QD . . 9.170 2.769 2.313 3.701 . 0 0 "[ . 1 . 2 . 3]" 1
1724 1 62 ILE HA 1 65 LEU HG . . 6.600 4.447 3.208 5.982 . 0 0 "[ . 1 . 2 . 3]" 1
1725 1 62 ILE HA 1 67 PHE QD . . 8.600 2.966 2.553 3.417 . 0 0 "[ . 1 . 2 . 3]" 1
1726 1 62 ILE HA 1 67 PHE QE . . 8.600 4.713 4.189 5.153 . 0 0 "[ . 1 . 2 . 3]" 1
1727 1 62 ILE HA 1 69 ALA MB . . 7.600 5.354 4.802 5.612 . 0 0 "[ . 1 . 2 . 3]" 1
1728 1 62 ILE HB 1 63 GLU H . . 4.500 2.679 2.307 3.111 . 0 0 "[ . 1 . 2 . 3]" 1
1729 1 62 ILE HB 1 64 SER H . . 6.600 5.188 4.838 5.451 . 0 0 "[ . 1 . 2 . 3]" 1
1730 1 62 ILE HB 1 65 LEU H . . 6.600 5.768 5.581 6.011 . 0 0 "[ . 1 . 2 . 3]" 1
1731 1 62 ILE HB 1 67 PHE QD . . 8.600 5.234 4.793 5.595 . 0 0 "[ . 1 . 2 . 3]" 1
1732 1 62 ILE HB 1 67 PHE QE . . 8.600 7.270 6.739 7.669 . 0 0 "[ . 1 . 2 . 3]" 1
1733 1 62 ILE HB 1 69 ALA H . . 6.600 5.727 4.663 6.604 0.004 26 0 "[ . 1 . 2 . 3]" 1
1734 1 62 ILE HB 1 69 ALA HA . . 6.600 5.804 5.033 6.605 0.005 22 0 "[ . 1 . 2 . 3]" 1
1735 1 62 ILE HB 1 69 ALA MB . . 7.600 3.279 2.533 3.730 . 0 0 "[ . 1 . 2 . 3]" 1
1736 1 62 ILE MD 1 63 GLU H . . 7.600 4.455 4.131 4.832 . 0 0 "[ . 1 . 2 . 3]" 1
1737 1 62 ILE QG 1 63 GLU H . . 7.600 4.343 4.153 4.661 . 0 0 "[ . 1 . 2 . 3]" 1
1738 1 62 ILE QG 1 65 LEU H . . 7.600 5.549 5.157 5.977 . 0 0 "[ . 1 . 2 . 3]" 1
1739 1 62 ILE QG 1 67 PHE H . . 7.600 5.830 4.402 6.795 . 0 0 "[ . 1 . 2 . 3]" 1
1740 1 62 ILE QG 1 67 PHE HB2 . . 7.600 4.054 3.152 4.730 . 0 0 "[ . 1 . 2 . 3]" 1
1741 1 62 ILE QG 1 67 PHE HB3 . . 7.600 4.854 3.901 5.225 . 0 0 "[ . 1 . 2 . 3]" 1
1742 1 62 ILE QG 1 68 GLU H . . 7.100 6.304 5.918 6.392 . 0 0 "[ . 1 . 2 . 3]" 1
1743 1 62 ILE QG 1 69 ALA H . . 7.600 6.562 5.467 6.809 . 0 0 "[ . 1 . 2 . 3]" 1
1744 1 62 ILE MG 1 63 GLU H . . 7.600 2.885 2.514 3.337 . 0 0 "[ . 1 . 2 . 3]" 1
1745 1 62 ILE MG 1 64 SER H . . 7.600 4.945 4.559 5.238 . 0 0 "[ . 1 . 2 . 3]" 1
1746 1 62 ILE MG 1 65 LEU H . . 7.600 4.898 4.453 5.177 . 0 0 "[ . 1 . 2 . 3]" 1
1747 1 62 ILE MG 1 66 GLY H . . 7.600 4.542 3.893 4.988 . 0 0 "[ . 1 . 2 . 3]" 1
1748 1 62 ILE MG 1 67 PHE H . . 7.600 3.732 2.664 4.390 . 0 0 "[ . 1 . 2 . 3]" 1
1749 1 62 ILE MG 1 67 PHE HB2 . . 7.600 2.101 1.940 2.443 . 0 0 "[ . 1 . 2 . 3]" 1
1750 1 62 ILE MG 1 67 PHE HB3 . . 7.600 2.869 2.543 3.608 . 0 0 "[ . 1 . 2 . 3]" 1
1751 1 62 ILE MG 1 67 PHE QD . . 9.600 2.964 2.303 3.775 . 0 0 "[ . 1 . 2 . 3]" 1
1752 1 62 ILE MG 1 67 PHE QE . . 9.600 4.913 4.270 5.675 . 0 0 "[ . 1 . 2 . 3]" 1
1753 1 62 ILE MG 1 68 GLU H . . 7.600 3.704 3.247 4.275 . 0 0 "[ . 1 . 2 . 3]" 1
1754 1 62 ILE MG 1 69 ALA H . . 7.600 3.815 2.578 4.274 . 0 0 "[ . 1 . 2 . 3]" 1
1755 1 62 ILE MG 1 69 ALA HA . . 7.600 3.627 2.978 4.116 . 0 0 "[ . 1 . 2 . 3]" 1
1756 1 62 ILE MG 1 69 ALA MB . . 8.600 2.119 1.984 2.347 . 0 0 "[ . 1 . 2 . 3]" 1
1757 1 63 GLU H 1 63 GLU HG2 . . 4.200 3.375 2.109 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
1758 1 63 GLU H 1 63 GLU QG . . 3.910 2.243 2.050 3.070 . 0 0 "[ . 1 . 2 . 3]" 1
1759 1 63 GLU H 1 63 GLU HG3 . . 4.200 2.442 2.079 4.201 0.001 5 0 "[ . 1 . 2 . 3]" 1
1760 1 63 GLU H 1 64 SER H . . 4.200 2.817 2.742 2.928 . 0 0 "[ . 1 . 2 . 3]" 1
1761 1 63 GLU H 1 64 SER HB2 . . 6.600 5.192 4.945 6.515 . 0 0 "[ . 1 . 2 . 3]" 1
1762 1 63 GLU H 1 64 SER HB3 . . 6.600 5.274 4.896 6.438 . 0 0 "[ . 1 . 2 . 3]" 1
1763 1 63 GLU H 1 65 LEU H . . 6.600 4.303 4.118 4.498 . 0 0 "[ . 1 . 2 . 3]" 1
1764 1 63 GLU H 1 65 LEU QD . . 9.170 5.077 4.687 5.359 . 0 0 "[ . 1 . 2 . 3]" 1
1765 1 63 GLU H 1 66 GLY H . . 6.600 5.687 4.699 6.382 . 0 0 "[ . 1 . 2 . 3]" 1
1766 1 63 GLU H 1 67 PHE H . . 6.600 4.872 4.329 5.377 . 0 0 "[ . 1 . 2 . 3]" 1
1767 1 63 GLU H 1 69 ALA H . . 6.600 5.893 4.985 6.603 0.003 22 0 "[ . 1 . 2 . 3]" 1
1768 1 63 GLU H 1 69 ALA MB . . 7.600 4.468 3.506 5.335 . 0 0 "[ . 1 . 2 . 3]" 1
1769 1 63 GLU HA 1 65 LEU H . . 6.000 4.360 3.580 4.771 . 0 0 "[ . 1 . 2 . 3]" 1
1770 1 63 GLU HA 1 66 GLY H . . 6.400 4.413 3.592 4.971 . 0 0 "[ . 1 . 2 . 3]" 1
1771 1 63 GLU HA 1 67 PHE H . . 5.200 2.944 2.605 3.307 . 0 0 "[ . 1 . 2 . 3]" 1
1772 1 63 GLU QB 1 64 SER QB . . 8.350 3.966 3.436 5.381 . 0 0 "[ . 1 . 2 . 3]" 1
1773 1 63 GLU QB 1 65 LEU H . . 7.480 4.696 4.516 5.331 . 0 0 "[ . 1 . 2 . 3]" 1
1774 1 63 GLU QB 1 67 PHE H . . 7.480 4.736 3.971 5.156 . 0 0 "[ . 1 . 2 . 3]" 1
1775 1 63 GLU HB2 1 64 SER HA . . 6.600 4.371 4.016 5.064 . 0 0 "[ . 1 . 2 . 3]" 1
1776 1 63 GLU HB3 1 64 SER HA . . 6.600 4.442 4.063 5.847 . 0 0 "[ . 1 . 2 . 3]" 1
1777 1 63 GLU QG 1 64 SER H . . 6.240 3.852 2.147 4.256 . 0 0 "[ . 1 . 2 . 3]" 1
1778 1 63 GLU QG 1 65 LEU H . . 7.480 5.553 4.548 5.912 . 0 0 "[ . 1 . 2 . 3]" 1
1779 1 63 GLU QG 1 66 GLY H . . 7.480 6.191 5.435 6.683 . 0 0 "[ . 1 . 2 . 3]" 1
1780 1 63 GLU QG 1 67 PHE H . . 7.480 4.857 4.244 5.385 . 0 0 "[ . 1 . 2 . 3]" 1
1781 1 63 GLU QG 1 69 ALA H . . 6.440 4.087 2.512 5.774 . 0 0 "[ . 1 . 2 . 3]" 1
1782 1 63 GLU HG2 1 64 SER H . . 6.500 4.617 2.262 5.169 . 0 0 "[ . 1 . 2 . 3]" 1
1783 1 63 GLU HG2 1 69 ALA H . . 6.600 4.530 2.579 6.533 . 0 0 "[ . 1 . 2 . 3]" 1
1784 1 63 GLU HG2 1 69 ALA MB . . 7.600 4.671 2.888 6.007 . 0 0 "[ . 1 . 2 . 3]" 1
1785 1 63 GLU HG3 1 64 SER H . . 6.500 4.161 2.423 4.529 . 0 0 "[ . 1 . 2 . 3]" 1
1786 1 63 GLU HG3 1 69 ALA H . . 6.600 4.701 3.288 6.621 0.021 24 0 "[ . 1 . 2 . 3]" 1
1787 1 63 GLU HG3 1 69 ALA MB . . 7.600 4.124 2.514 6.325 . 0 0 "[ . 1 . 2 . 3]" 1
1788 1 64 SER H 1 64 SER HB2 . . 4.200 2.539 2.361 3.617 . 0 0 "[ . 1 . 2 . 3]" 1
1789 1 64 SER H 1 64 SER HB3 . . 4.200 2.751 2.473 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
1790 1 64 SER H 1 65 LEU H . . 4.200 2.871 2.794 2.957 . 0 0 "[ . 1 . 2 . 3]" 1
1791 1 64 SER H 1 65 LEU QB . . 5.380 4.781 4.585 4.837 . 0 0 "[ . 1 . 2 . 3]" 1
1792 1 64 SER H 1 65 LEU QD . . 9.170 4.524 3.719 5.061 . 0 0 "[ . 1 . 2 . 3]" 1
1793 1 64 SER H 1 66 GLY H . . 6.600 5.298 4.373 5.812 . 0 0 "[ . 1 . 2 . 3]" 1
1794 1 64 SER H 1 67 PHE H . . 6.600 5.114 4.735 5.415 . 0 0 "[ . 1 . 2 . 3]" 1
1795 1 64 SER HA 1 66 GLY H . . 6.500 5.495 4.743 5.966 . 0 0 "[ . 1 . 2 . 3]" 1
1796 1 64 SER HA 1 67 PHE H . . 6.600 5.593 4.688 6.334 . 0 0 "[ . 1 . 2 . 3]" 1
1797 1 64 SER HB2 1 65 LEU H . . 5.500 3.918 2.977 4.380 . 0 0 "[ . 1 . 2 . 3]" 1
1798 1 64 SER HB3 1 65 LEU H . . 5.500 3.154 2.516 4.288 . 0 0 "[ . 1 . 2 . 3]" 1
1799 1 65 LEU H 1 65 LEU HB2 . . 4.000 2.304 2.193 2.424 . 0 0 "[ . 1 . 2 . 3]" 1
1800 1 65 LEU H 1 65 LEU HB3 . . 4.000 3.566 3.494 3.618 . 0 0 "[ . 1 . 2 . 3]" 1
1801 1 65 LEU H 1 65 LEU MD1 . . 4.800 3.454 2.378 4.029 . 0 0 "[ . 1 . 2 . 3]" 1
1802 1 65 LEU H 1 65 LEU QD . . 4.280 2.786 2.257 3.204 . 0 0 "[ . 1 . 2 . 3]" 1
1803 1 65 LEU H 1 65 LEU MD2 . . 4.800 3.304 2.279 4.031 . 0 0 "[ . 1 . 2 . 3]" 1
1804 1 65 LEU H 1 65 LEU HG . . 4.000 3.277 2.405 4.074 0.074 7 0 "[ . 1 . 2 . 3]" 1
1805 1 65 LEU H 1 66 GLY H . . 4.200 3.181 2.802 3.427 . 0 0 "[ . 1 . 2 . 3]" 1
1806 1 65 LEU H 1 67 PHE H . . 5.900 4.071 3.546 4.476 . 0 0 "[ . 1 . 2 . 3]" 1
1807 1 65 LEU H 1 67 PHE QD . . 8.600 4.386 3.806 5.045 . 0 0 "[ . 1 . 2 . 3]" 1
1808 1 65 LEU H 1 67 PHE QE . . 8.600 5.300 4.777 5.804 . 0 0 "[ . 1 . 2 . 3]" 1
1809 1 65 LEU HA 1 67 PHE H . . 6.600 5.341 5.175 5.579 . 0 0 "[ . 1 . 2 . 3]" 1
1810 1 65 LEU HA 1 67 PHE QD . . 8.600 5.331 5.138 5.775 . 0 0 "[ . 1 . 2 . 3]" 1
1811 1 65 LEU HA 1 67 PHE QE . . 8.600 5.017 4.783 5.309 . 0 0 "[ . 1 . 2 . 3]" 1
1812 1 65 LEU HA 1 67 PHE HZ . . 6.600 6.354 5.974 6.610 0.010 4 0 "[ . 1 . 2 . 3]" 1
1813 1 65 LEU QB 1 66 GLY H . . 5.440 2.143 1.944 2.579 . 0 0 "[ . 1 . 2 . 3]" 1
1814 1 65 LEU QB 1 67 PHE H . . 7.480 3.667 3.351 4.225 . 0 0 "[ . 1 . 2 . 3]" 1
1815 1 65 LEU HB2 1 66 GLY H . . 5.800 2.285 2.069 2.677 . 0 0 "[ . 1 . 2 . 3]" 1
1816 1 65 LEU HB3 1 66 GLY H . . 5.800 2.666 2.249 3.372 . 0 0 "[ . 1 . 2 . 3]" 1
1817 1 65 LEU QD 1 67 PHE H . . 9.170 4.964 4.662 5.466 . 0 0 "[ . 1 . 2 . 3]" 1
1818 1 65 LEU QD 1 67 PHE QD . . 11.170 3.322 2.684 4.690 . 0 0 "[ . 1 . 2 . 3]" 1
1819 1 65 LEU QD 1 67 PHE QE . . 11.170 2.888 2.079 3.597 . 0 0 "[ . 1 . 2 . 3]" 1
1820 1 65 LEU QD 1 67 PHE HZ . . 9.170 4.400 3.609 4.933 . 0 0 "[ . 1 . 2 . 3]" 1
1821 1 65 LEU MD1 1 66 GLY H . . 7.600 4.201 3.812 4.626 . 0 0 "[ . 1 . 2 . 3]" 1
1822 1 65 LEU MD2 1 66 GLY H . . 7.600 4.367 3.987 4.812 . 0 0 "[ . 1 . 2 . 3]" 1
1823 1 65 LEU HG 1 66 GLY H . . 6.600 4.480 4.165 4.892 . 0 0 "[ . 1 . 2 . 3]" 1
1824 1 65 LEU HG 1 67 PHE H . . 6.500 6.162 5.653 6.543 0.043 24 0 "[ . 1 . 2 . 3]" 1
1825 1 66 GLY H 1 67 PHE H . . 3.900 2.127 1.926 2.577 . 0 0 "[ . 1 . 2 . 3]" 1
1826 1 66 GLY H 1 67 PHE HA . . 6.400 4.327 4.066 4.675 . 0 0 "[ . 1 . 2 . 3]" 1
1827 1 66 GLY H 1 67 PHE QB . . 7.480 3.424 3.051 4.338 . 0 0 "[ . 1 . 2 . 3]" 1
1828 1 66 GLY H 1 67 PHE QD . . 8.600 2.916 2.594 3.251 . 0 0 "[ . 1 . 2 . 3]" 1
1829 1 66 GLY H 1 67 PHE QE . . 8.600 3.682 3.297 4.050 . 0 0 "[ . 1 . 2 . 3]" 1
1830 1 66 GLY QA 1 67 PHE HA . . 7.480 4.014 3.562 4.147 . 0 0 "[ . 1 . 2 . 3]" 1
1831 1 66 GLY HA2 1 67 PHE QD . . 8.600 4.725 4.356 4.974 . 0 0 "[ . 1 . 2 . 3]" 1
1832 1 67 PHE H 1 67 PHE QE . . 6.800 4.861 4.016 5.130 . 0 0 "[ . 1 . 2 . 3]" 1
1833 1 67 PHE H 1 67 PHE HZ . . 6.600 6.181 5.395 6.541 . 0 0 "[ . 1 . 2 . 3]" 1
1834 1 67 PHE H 1 68 GLU H . . 5.500 4.476 4.342 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
1835 1 67 PHE H 1 68 GLU QB . . 7.480 5.881 5.283 6.325 . 0 0 "[ . 1 . 2 . 3]" 1
1836 1 67 PHE HA 1 68 GLU QB . . 7.480 4.326 3.873 4.883 . 0 0 "[ . 1 . 2 . 3]" 1
1837 1 67 PHE QB 1 68 GLU H . . 4.060 2.369 2.099 3.257 . 0 0 "[ . 1 . 2 . 3]" 1
1838 1 67 PHE QB 1 69 ALA H . . 7.480 5.278 4.304 5.730 . 0 0 "[ . 1 . 2 . 3]" 1
1839 1 67 PHE HB2 1 68 GLU H . . 4.300 3.424 3.095 4.210 . 0 0 "[ . 1 . 2 . 3]" 1
1840 1 67 PHE HB3 1 68 GLU H . . 4.300 2.418 2.127 3.390 . 0 0 "[ . 1 . 2 . 3]" 1
1841 1 67 PHE QD 1 68 GLU H . . 8.300 3.994 3.583 4.258 . 0 0 "[ . 1 . 2 . 3]" 1
1842 1 67 PHE QD 1 68 GLU QB . . 9.480 5.740 5.019 6.228 . 0 0 "[ . 1 . 2 . 3]" 1
1843 1 67 PHE QE 1 68 GLU H . . 8.600 6.152 5.830 6.445 . 0 0 "[ . 1 . 2 . 3]" 1
1844 1 68 GLU H 1 68 GLU HG2 . . 4.800 4.002 2.233 4.668 . 0 0 "[ . 1 . 2 . 3]" 1
1845 1 68 GLU H 1 68 GLU QG . . 4.520 3.205 2.053 4.094 . 0 0 "[ . 1 . 2 . 3]" 1
1846 1 68 GLU H 1 68 GLU HG3 . . 4.800 3.510 2.089 4.808 0.008 21 0 "[ . 1 . 2 . 3]" 1
1847 1 68 GLU H 1 69 ALA H . . 5.600 4.434 4.050 4.665 . 0 0 "[ . 1 . 2 . 3]" 1
1848 1 68 GLU H 1 69 ALA HA . . 6.400 4.857 4.460 5.447 . 0 0 "[ . 1 . 2 . 3]" 1
1849 1 68 GLU QB 1 69 ALA HA . . 7.480 4.209 3.468 4.993 . 0 0 "[ . 1 . 2 . 3]" 1
1850 1 68 GLU HB2 1 69 ALA H . . 5.400 3.740 2.345 4.568 . 0 0 "[ . 1 . 2 . 3]" 1
1851 1 68 GLU HB3 1 69 ALA H . . 5.400 3.409 2.469 4.510 . 0 0 "[ . 1 . 2 . 3]" 1
1852 1 68 GLU HG2 1 69 ALA H . . 6.600 3.968 2.065 5.376 . 0 0 "[ . 1 . 2 . 3]" 1
1853 1 68 GLU HG3 1 69 ALA H . . 6.600 4.335 2.647 5.340 . 0 0 "[ . 1 . 2 . 3]" 1
1854 1 69 ALA H 1 70 SER H . . 5.400 4.394 3.882 4.648 . 0 0 "[ . 1 . 2 . 3]" 1
1855 1 69 ALA HA 1 70 SER H . . 3.400 2.289 2.093 2.417 . 0 0 "[ . 1 . 2 . 3]" 1
1856 1 69 ALA HA 1 70 SER HA . . 6.600 4.530 4.429 4.573 . 0 0 "[ . 1 . 2 . 3]" 1
1857 1 69 ALA HA 1 70 SER HB2 . . 6.600 4.727 4.294 5.820 . 0 0 "[ . 1 . 2 . 3]" 1
1858 1 69 ALA HA 1 70 SER HB3 . . 6.600 5.208 4.204 5.860 . 0 0 "[ . 1 . 2 . 3]" 1
1859 1 69 ALA MB 1 70 SER H . . 3.600 2.687 2.270 3.072 . 0 0 "[ . 1 . 2 . 3]" 1
1860 1 70 SER H 1 71 LEU HA . . 6.600 4.640 4.383 4.831 . 0 0 "[ . 1 . 2 . 3]" 1
1861 1 70 SER H 1 71 LEU QD . . 9.170 5.027 3.815 6.006 . 0 0 "[ . 1 . 2 . 3]" 1
1862 1 70 SER HA 1 71 LEU HA . . 6.600 4.507 4.363 4.626 . 0 0 "[ . 1 . 2 . 3]" 1
1863 1 70 SER HA 1 71 LEU MD1 . . 7.600 4.959 2.785 5.898 . 0 0 "[ . 1 . 2 . 3]" 1
1864 1 70 SER HA 1 71 LEU MD2 . . 7.600 4.346 2.917 5.950 . 0 0 "[ . 1 . 2 . 3]" 1
1865 1 70 SER HB2 1 71 LEU H . . 5.000 4.096 2.258 4.523 . 0 0 "[ . 1 . 2 . 3]" 1
1866 1 70 SER HB3 1 71 LEU H . . 5.000 3.765 2.776 4.471 . 0 0 "[ . 1 . 2 . 3]" 1
1867 1 71 LEU H 1 71 LEU MD1 . . 5.100 3.393 1.979 4.169 . 0 0 "[ . 1 . 2 . 3]" 1
1868 1 71 LEU H 1 71 LEU MD2 . . 5.100 2.895 1.861 4.256 . 0 0 "[ . 1 . 2 . 3]" 1
1869 1 71 LEU H 1 71 LEU HG . . 3.900 2.898 2.126 3.970 0.070 27 0 "[ . 1 . 2 . 3]" 1
1870 1 71 LEU H 1 72 VAL H . . 5.700 4.286 2.995 4.730 . 0 0 "[ . 1 . 2 . 3]" 1
1871 1 71 LEU QB 1 72 VAL H . . 6.700 3.211 2.130 4.050 . 0 0 "[ . 1 . 2 . 3]" 1
1872 1 71 LEU QD 1 72 VAL H . . 7.180 3.967 2.672 4.577 . 0 0 "[ . 1 . 2 . 3]" 1
1873 1 71 LEU MD1 1 72 VAL H . . 7.600 4.608 2.719 5.630 . 0 0 "[ . 1 . 2 . 3]" 1
1874 1 71 LEU MD2 1 72 VAL H . . 7.600 4.611 3.344 5.703 . 0 0 "[ . 1 . 2 . 3]" 1
1875 1 71 LEU HG 1 72 VAL H . . 6.600 4.448 2.205 5.170 . 0 0 "[ . 1 . 2 . 3]" 1
1876 1 72 VAL HA 1 73 LYS HA . . 6.600 4.764 4.351 5.388 . 0 0 "[ . 1 . 2 . 3]" 1
1877 1 72 VAL HB 1 73 LYS H . . 4.900 3.604 1.987 4.581 . 0 0 "[ . 1 . 2 . 3]" 1
1878 1 72 VAL MG1 1 73 LYS H . . 7.600 3.290 1.990 4.414 . 0 0 "[ . 1 . 2 . 3]" 1
1879 1 72 VAL MG2 1 73 LYS H . . 7.600 3.551 2.248 4.380 . 0 0 "[ . 1 . 2 . 3]" 1
1880 1 73 LYS H 1 74 ILE H . . 5.200 3.469 1.959 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
1881 1 73 LYS HA 1 74 ILE H . . 3.600 2.824 2.072 3.617 0.017 10 0 "[ . 1 . 2 . 3]" 1
1882 1 73 LYS QB 1 74 ILE H . . 4.490 3.056 2.093 4.044 . 0 0 "[ . 1 . 2 . 3]" 1
1883 1 73 LYS HB2 1 74 ILE H . . 5.000 3.575 2.108 4.667 . 0 0 "[ . 1 . 2 . 3]" 1
1884 1 73 LYS HB3 1 74 ILE H . . 5.000 3.647 2.197 4.509 . 0 0 "[ . 1 . 2 . 3]" 1
1885 1 73 LYS QD 1 74 ILE H . . 7.600 4.499 2.673 5.636 . 0 0 "[ . 1 . 2 . 3]" 1
1886 1 73 LYS QG 1 74 ILE H . . 7.600 3.625 1.967 4.594 . 0 0 "[ . 1 . 2 . 3]" 1
1887 1 74 ILE H 1 74 ILE MD . . 5.000 3.698 1.961 4.215 . 0 0 "[ . 1 . 2 . 3]" 1
1888 1 74 ILE H 1 74 ILE MG . . 4.600 3.170 1.930 3.895 . 0 0 "[ . 1 . 2 . 3]" 1
1889 1 74 ILE H 1 75 GLU H . . 5.800 3.637 1.998 4.698 . 0 0 "[ . 1 . 2 . 3]" 1
1890 1 74 ILE HB 1 75 GLU H . . 5.600 3.394 2.066 4.600 . 0 0 "[ . 1 . 2 . 3]" 1
1891 1 74 ILE MD 1 75 GLU H . . 7.600 4.235 2.295 5.503 . 0 0 "[ . 1 . 2 . 3]" 1
1892 1 74 ILE QG 1 75 GLU H . . 7.600 3.918 2.442 4.727 . 0 0 "[ . 1 . 2 . 3]" 1
1893 1 74 ILE MG 1 75 GLU H . . 7.600 3.210 1.933 4.310 . 0 0 "[ . 1 . 2 . 3]" 1
1894 1 75 GLU H 1 75 GLU HG2 . . 5.000 4.000 2.593 4.901 . 0 0 "[ . 1 . 2 . 3]" 1
1895 1 75 GLU H 1 75 GLU HG3 . . 5.000 3.631 2.180 5.088 0.088 19 0 "[ . 1 . 2 . 3]" 1
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