NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
407827 |
1yjr   |
6483 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1yjr
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 1848
_Distance_constraint_stats_list.Viol_count 1054
_Distance_constraint_stats_list.Viol_total 1177.761
_Distance_constraint_stats_list.Viol_max 0.248
_Distance_constraint_stats_list.Viol_rms 0.0065
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0007
_Distance_constraint_stats_list.Viol_average_violations_only 0.0372
_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 0.014 0.008 27 0 "[ . 1 . 2 . 3]"
1 4 GLY 0.005 0.005 23 0 "[ . 1 . 2 . 3]"
1 5 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 6 LEU 0.304 0.060 5 0 "[ . 1 . 2 . 3]"
1 7 GLU 1.406 0.130 21 0 "[ . 1 . 2 . 3]"
1 8 LEU 1.326 0.130 21 0 "[ . 1 . 2 . 3]"
1 9 VAL 0.127 0.071 28 0 "[ . 1 . 2 . 3]"
1 10 VAL 0.326 0.089 28 0 "[ . 1 . 2 . 3]"
1 11 ARG 0.087 0.043 18 0 "[ . 1 . 2 . 3]"
1 12 GLY 0.061 0.049 26 0 "[ . 1 . 2 . 3]"
1 13 MET 1.061 0.105 18 0 "[ . 1 . 2 . 3]"
1 14 THR 0.002 0.002 26 0 "[ . 1 . 2 . 3]"
1 15 CYS 0.183 0.092 6 0 "[ . 1 . 2 . 3]"
1 16 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 17 SER 0.364 0.051 9 0 "[ . 1 . 2 . 3]"
1 18 CYS 0.421 0.092 6 0 "[ . 1 . 2 . 3]"
1 19 VAL 0.196 0.053 15 0 "[ . 1 . 2 . 3]"
1 20 HIS 4.294 0.162 16 0 "[ . 1 . 2 . 3]"
1 21 LYS 0.310 0.063 21 0 "[ . 1 . 2 . 3]"
1 22 ILE 2.431 0.118 26 0 "[ . 1 . 2 . 3]"
1 23 GLU 2.125 0.139 23 0 "[ . 1 . 2 . 3]"
1 24 SER 2.464 0.118 26 0 "[ . 1 . 2 . 3]"
1 25 SER 1.606 0.078 11 0 "[ . 1 . 2 . 3]"
1 26 LEU 3.117 0.109 20 0 "[ . 1 . 2 . 3]"
1 27 THR 0.795 0.081 18 0 "[ . 1 . 2 . 3]"
1 28 LYS 0.125 0.049 29 0 "[ . 1 . 2 . 3]"
1 29 HIS 2.454 0.109 20 0 "[ . 1 . 2 . 3]"
1 30 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 31 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 32 ILE 1.844 0.096 15 0 "[ . 1 . 2 . 3]"
1 33 LEU 0.852 0.077 26 0 "[ . 1 . 2 . 3]"
1 34 TYR 1.448 0.102 13 0 "[ . 1 . 2 . 3]"
1 35 CYS 0.477 0.050 11 0 "[ . 1 . 2 . 3]"
1 36 SER 0.104 0.048 23 0 "[ . 1 . 2 . 3]"
1 37 VAL 0.144 0.039 10 0 "[ . 1 . 2 . 3]"
1 38 ALA 0.748 0.104 16 0 "[ . 1 . 2 . 3]"
1 39 LEU 0.087 0.028 6 0 "[ . 1 . 2 . 3]"
1 40 ALA 1.124 0.093 23 0 "[ . 1 . 2 . 3]"
1 41 THR 3.376 0.104 16 0 "[ . 1 . 2 . 3]"
1 42 ASN 0.616 0.089 28 0 "[ . 1 . 2 . 3]"
1 43 LYS 2.068 0.089 3 0 "[ . 1 . 2 . 3]"
1 44 ALA 0.814 0.087 19 0 "[ . 1 . 2 . 3]"
1 45 HIS 1.889 0.248 18 0 "[ . 1 . 2 . 3]"
1 46 ILE 1.873 0.190 13 0 "[ . 1 . 2 . 3]"
1 47 LYS 3.174 0.190 13 0 "[ . 1 . 2 . 3]"
1 48 TYR 0.117 0.048 14 0 "[ . 1 . 2 . 3]"
1 49 ASP 1.257 0.106 23 0 "[ . 1 . 2 . 3]"
1 50 PRO 0.175 0.049 7 0 "[ . 1 . 2 . 3]"
1 51 GLU 0.426 0.079 26 0 "[ . 1 . 2 . 3]"
1 52 ILE 3.568 0.106 23 0 "[ . 1 . 2 . 3]"
1 53 ILE 3.382 0.101 23 0 "[ . 1 . 2 . 3]"
1 54 GLY 1.521 0.101 23 0 "[ . 1 . 2 . 3]"
1 55 PRO 0.210 0.060 5 0 "[ . 1 . 2 . 3]"
1 56 ARG 0.078 0.045 15 0 "[ . 1 . 2 . 3]"
1 57 ASP 0.449 0.044 4 0 "[ . 1 . 2 . 3]"
1 58 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 59 ILE 0.767 0.067 25 0 "[ . 1 . 2 . 3]"
1 60 HIS 0.078 0.045 15 0 "[ . 1 . 2 . 3]"
1 61 THR 0.767 0.067 25 0 "[ . 1 . 2 . 3]"
1 62 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 63 GLU 3.564 0.099 13 0 "[ . 1 . 2 . 3]"
1 64 SER 0.702 0.066 10 0 "[ . 1 . 2 . 3]"
1 65 LEU 0.648 0.076 30 0 "[ . 1 . 2 . 3]"
1 66 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 67 PHE 1.958 0.105 18 0 "[ . 1 . 2 . 3]"
1 68 GLU 0.058 0.054 12 0 "[ . 1 . 2 . 3]"
1 69 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]"
1 70 SER 0.867 0.103 21 0 "[ . 1 . 2 . 3]"
1 71 LEU 2.581 0.150 21 0 "[ . 1 . 2 . 3]"
1 72 VAL 0.934 0.122 14 0 "[ . 1 . 2 . 3]"
1 73 LYS 0.694 0.094 28 0 "[ . 1 . 2 . 3]"
1 74 ILE 0.312 0.064 30 0 "[ . 1 . 2 . 3]"
1 75 GLU 0.000 0.000 . 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 50 PRO HD2 . . 6.600 4.336 2.316 6.522 . 0 0 "[ . 1 . 2 . 3]" 1
2 1 3 ASP H 1 50 PRO HD3 . . 6.600 5.119 2.611 6.608 0.008 27 0 "[ . 1 . 2 . 3]" 1
3 1 3 ASP HA 1 50 PRO HD2 . . 6.600 3.902 2.224 6.606 0.006 23 0 "[ . 1 . 2 . 3]" 1
4 1 3 ASP HA 1 50 PRO HD3 . . 6.600 4.094 2.656 6.586 . 0 0 "[ . 1 . 2 . 3]" 1
5 1 3 ASP QB 1 33 LEU QD . . 10.170 3.547 2.069 6.738 . 0 0 "[ . 1 . 2 . 3]" 1
6 1 3 ASP QB 1 49 ASP QB . . 7.480 5.212 2.677 5.992 . 0 0 "[ . 1 . 2 . 3]" 1
7 1 4 GLY H 1 5 VAL H . . 5.300 3.734 1.909 4.489 . 0 0 "[ . 1 . 2 . 3]" 1
8 1 4 GLY H 1 47 LYS HA . . 6.600 4.574 3.050 5.576 . 0 0 "[ . 1 . 2 . 3]" 1
9 1 4 GLY H 1 47 LYS QG . . 7.480 5.883 4.451 6.711 . 0 0 "[ . 1 . 2 . 3]" 1
10 1 4 GLY H 1 48 TYR H . . 6.600 3.796 2.510 5.731 . 0 0 "[ . 1 . 2 . 3]" 1
11 1 4 GLY H 1 48 TYR QE . . 8.600 5.579 3.531 7.677 . 0 0 "[ . 1 . 2 . 3]" 1
12 1 4 GLY H 1 49 ASP HA . . 6.600 4.138 2.869 5.630 . 0 0 "[ . 1 . 2 . 3]" 1
13 1 4 GLY H 1 50 PRO HD2 . . 6.600 4.324 2.667 5.888 . 0 0 "[ . 1 . 2 . 3]" 1
14 1 4 GLY H 1 50 PRO HD3 . . 6.600 3.645 2.142 5.474 . 0 0 "[ . 1 . 2 . 3]" 1
15 1 4 GLY HA2 1 48 TYR H . . 6.600 5.268 2.751 6.605 0.005 23 0 "[ . 1 . 2 . 3]" 1
16 1 4 GLY HA2 1 48 TYR QD . . 8.600 5.905 3.896 7.545 . 0 0 "[ . 1 . 2 . 3]" 1
17 1 4 GLY HA2 1 48 TYR QE . . 8.600 5.692 3.954 7.710 . 0 0 "[ . 1 . 2 . 3]" 1
18 1 5 VAL H 1 6 LEU H . . 6.600 4.105 3.174 4.682 . 0 0 "[ . 1 . 2 . 3]" 1
19 1 5 VAL H 1 47 LYS QE . . 7.600 6.141 4.395 6.789 . 0 0 "[ . 1 . 2 . 3]" 1
20 1 5 VAL H 1 48 TYR QD . . 8.600 5.290 2.924 6.341 . 0 0 "[ . 1 . 2 . 3]" 1
21 1 5 VAL H 1 48 TYR QE . . 8.600 4.952 3.111 6.512 . 0 0 "[ . 1 . 2 . 3]" 1
22 1 5 VAL HA 1 46 ILE H . . 6.100 4.424 3.798 4.856 . 0 0 "[ . 1 . 2 . 3]" 1
23 1 5 VAL HA 1 47 LYS HA . . 6.600 2.579 2.072 3.520 . 0 0 "[ . 1 . 2 . 3]" 1
24 1 5 VAL HA 1 48 TYR H . . 6.300 3.548 2.762 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
25 1 5 VAL HA 1 48 TYR QD . . 8.600 3.650 2.458 5.100 . 0 0 "[ . 1 . 2 . 3]" 1
26 1 5 VAL HA 1 48 TYR QE . . 8.600 4.049 2.586 5.894 . 0 0 "[ . 1 . 2 . 3]" 1
27 1 5 VAL HB 1 6 LEU H . . 6.100 3.555 2.423 4.553 . 0 0 "[ . 1 . 2 . 3]" 1
28 1 5 VAL HB 1 7 GLU QG . . 5.480 4.433 2.728 4.947 . 0 0 "[ . 1 . 2 . 3]" 1
29 1 5 VAL QG 1 46 ILE H . . 9.160 4.091 3.341 4.613 . 0 0 "[ . 1 . 2 . 3]" 1
30 1 5 VAL MG1 1 6 LEU H . . 7.600 3.811 2.390 4.447 . 0 0 "[ . 1 . 2 . 3]" 1
31 1 5 VAL MG1 1 45 HIS HD2 . . 7.600 3.772 2.368 5.533 . 0 0 "[ . 1 . 2 . 3]" 1
32 1 5 VAL MG1 1 45 HIS HE1 . . 7.600 5.266 3.421 6.317 . 0 0 "[ . 1 . 2 . 3]" 1
33 1 5 VAL MG1 1 46 ILE HA . . 7.600 5.489 4.485 6.335 . 0 0 "[ . 1 . 2 . 3]" 1
34 1 5 VAL MG1 1 47 LYS HA . . 7.600 3.138 2.247 4.794 . 0 0 "[ . 1 . 2 . 3]" 1
35 1 5 VAL MG1 1 48 TYR QD . . 9.600 5.131 4.116 6.600 . 0 0 "[ . 1 . 2 . 3]" 1
36 1 5 VAL MG1 1 48 TYR QE . . 9.600 5.547 4.570 7.156 . 0 0 "[ . 1 . 2 . 3]" 1
37 1 5 VAL MG2 1 6 LEU H . . 7.600 3.753 2.985 4.387 . 0 0 "[ . 1 . 2 . 3]" 1
38 1 5 VAL MG2 1 45 HIS HD2 . . 7.600 4.730 3.730 5.981 . 0 0 "[ . 1 . 2 . 3]" 1
39 1 5 VAL MG2 1 45 HIS HE1 . . 7.600 6.014 3.156 6.358 . 0 0 "[ . 1 . 2 . 3]" 1
40 1 5 VAL MG2 1 46 ILE HA . . 7.600 6.310 5.840 6.387 . 0 0 "[ . 1 . 2 . 3]" 1
41 1 5 VAL MG2 1 47 LYS HA . . 7.600 3.898 2.620 5.354 . 0 0 "[ . 1 . 2 . 3]" 1
42 1 5 VAL MG2 1 48 TYR QD . . 9.600 5.519 4.699 7.056 . 0 0 "[ . 1 . 2 . 3]" 1
43 1 5 VAL MG2 1 48 TYR QE . . 9.600 5.560 4.618 7.046 . 0 0 "[ . 1 . 2 . 3]" 1
44 1 6 LEU H 1 6 LEU HG . . 5.400 4.636 4.353 5.011 . 0 0 "[ . 1 . 2 . 3]" 1
45 1 6 LEU H 1 7 GLU H . . 6.600 4.195 3.276 4.682 . 0 0 "[ . 1 . 2 . 3]" 1
46 1 6 LEU H 1 45 HIS HA . . 6.600 4.782 4.123 5.821 . 0 0 "[ . 1 . 2 . 3]" 1
47 1 6 LEU H 1 46 ILE H . . 4.200 3.179 2.721 4.164 . 0 0 "[ . 1 . 2 . 3]" 1
48 1 6 LEU H 1 46 ILE HB . . 6.500 3.563 3.041 4.525 . 0 0 "[ . 1 . 2 . 3]" 1
49 1 6 LEU H 1 46 ILE MD . . 7.600 4.600 3.646 5.635 . 0 0 "[ . 1 . 2 . 3]" 1
50 1 6 LEU H 1 46 ILE QG . . 7.600 5.426 5.071 6.389 . 0 0 "[ . 1 . 2 . 3]" 1
51 1 6 LEU H 1 47 LYS H . . 6.100 5.210 4.838 6.134 0.034 2 0 "[ . 1 . 2 . 3]" 1
52 1 6 LEU H 1 47 LYS HA . . 6.600 3.953 3.555 5.205 . 0 0 "[ . 1 . 2 . 3]" 1
53 1 6 LEU H 1 48 TYR QD . . 8.600 3.477 2.628 4.186 . 0 0 "[ . 1 . 2 . 3]" 1
54 1 6 LEU H 1 48 TYR QE . . 8.600 3.067 2.303 4.043 . 0 0 "[ . 1 . 2 . 3]" 1
55 1 6 LEU HA 1 6 LEU HG . . 4.100 3.166 2.348 3.772 . 0 0 "[ . 1 . 2 . 3]" 1
56 1 6 LEU HA 1 7 GLU QB . . 6.700 4.477 4.193 4.844 . 0 0 "[ . 1 . 2 . 3]" 1
57 1 6 LEU HA 1 7 GLU QG . . 6.780 4.023 3.496 4.777 . 0 0 "[ . 1 . 2 . 3]" 1
58 1 6 LEU HA 1 48 TYR QD . . 8.600 5.793 5.098 6.555 . 0 0 "[ . 1 . 2 . 3]" 1
59 1 6 LEU HA 1 48 TYR QE . . 8.600 4.296 3.624 4.909 . 0 0 "[ . 1 . 2 . 3]" 1
60 1 6 LEU QB 1 7 GLU H . . 5.380 3.818 3.481 4.126 . 0 0 "[ . 1 . 2 . 3]" 1
61 1 6 LEU QB 1 46 ILE H . . 6.340 3.910 3.027 5.307 . 0 0 "[ . 1 . 2 . 3]" 1
62 1 6 LEU QB 1 48 TYR QD . . 7.960 3.671 2.604 4.414 . 0 0 "[ . 1 . 2 . 3]" 1
63 1 6 LEU QB 1 48 TYR QE . . 7.680 2.189 1.935 2.621 . 0 0 "[ . 1 . 2 . 3]" 1
64 1 6 LEU QB 1 55 PRO HA . . 7.480 4.715 3.885 5.513 . 0 0 "[ . 1 . 2 . 3]" 1
65 1 6 LEU HB2 1 7 GLU H . . 5.600 4.373 3.894 4.680 . 0 0 "[ . 1 . 2 . 3]" 1
66 1 6 LEU HB2 1 46 ILE H . . 6.500 5.292 4.168 6.515 0.015 11 0 "[ . 1 . 2 . 3]" 1
67 1 6 LEU HB2 1 48 TYR QD . . 8.300 4.320 2.633 5.342 . 0 0 "[ . 1 . 2 . 3]" 1
68 1 6 LEU HB3 1 7 GLU H . . 5.600 4.218 3.771 4.600 . 0 0 "[ . 1 . 2 . 3]" 1
69 1 6 LEU HB3 1 46 ILE H . . 6.500 4.037 3.077 5.622 . 0 0 "[ . 1 . 2 . 3]" 1
70 1 6 LEU HB3 1 48 TYR QD . . 8.300 4.073 3.418 4.812 . 0 0 "[ . 1 . 2 . 3]" 1
71 1 6 LEU QD 1 48 TYR QD . . 11.170 4.611 3.711 5.555 . 0 0 "[ . 1 . 2 . 3]" 1
72 1 6 LEU QD 1 48 TYR QE . . 11.170 3.187 2.133 4.065 . 0 0 "[ . 1 . 2 . 3]" 1
73 1 6 LEU QD 1 55 PRO HA . . 7.270 3.579 2.505 4.402 . 0 0 "[ . 1 . 2 . 3]" 1
74 1 6 LEU QD 1 55 PRO QB . . 8.330 2.433 2.015 3.102 . 0 0 "[ . 1 . 2 . 3]" 1
75 1 6 LEU QD 1 55 PRO QG . . 7.870 3.585 2.608 4.170 . 0 0 "[ . 1 . 2 . 3]" 1
76 1 6 LEU QD 1 58 ILE H . . 9.170 6.043 4.733 6.823 . 0 0 "[ . 1 . 2 . 3]" 1
77 1 6 LEU MD1 1 7 GLU H . . 7.600 3.191 2.021 5.484 . 0 0 "[ . 1 . 2 . 3]" 1
78 1 6 LEU MD1 1 55 PRO HB2 . . 9.350 4.136 2.505 5.696 . 0 0 "[ . 1 . 2 . 3]" 1
79 1 6 LEU MD1 1 55 PRO HB3 . . 9.350 3.597 2.131 4.913 . 0 0 "[ . 1 . 2 . 3]" 1
80 1 6 LEU MD1 1 55 PRO HG2 . . 9.350 5.607 3.985 7.009 . 0 0 "[ . 1 . 2 . 3]" 1
81 1 6 LEU MD1 1 55 PRO HG3 . . 9.350 4.742 2.679 6.142 . 0 0 "[ . 1 . 2 . 3]" 1
82 1 6 LEU MD2 1 7 GLU H . . 7.600 3.775 2.054 4.976 . 0 0 "[ . 1 . 2 . 3]" 1
83 1 6 LEU MD2 1 55 PRO HB2 . . 9.350 3.622 2.445 5.768 . 0 0 "[ . 1 . 2 . 3]" 1
84 1 6 LEU MD2 1 55 PRO HB3 . . 9.350 2.989 2.173 4.959 . 0 0 "[ . 1 . 2 . 3]" 1
85 1 6 LEU MD2 1 55 PRO HG2 . . 9.350 5.162 4.035 6.921 . 0 0 "[ . 1 . 2 . 3]" 1
86 1 6 LEU MD2 1 55 PRO HG3 . . 9.350 4.381 3.187 6.475 . 0 0 "[ . 1 . 2 . 3]" 1
87 1 6 LEU HG 1 7 GLU H . . 6.300 3.803 2.171 5.650 . 0 0 "[ . 1 . 2 . 3]" 1
88 1 6 LEU HG 1 55 PRO HA . . 6.600 5.585 3.574 6.660 0.060 5 0 "[ . 1 . 2 . 3]" 1
89 1 7 GLU H 1 71 LEU HA . . 6.400 5.973 5.163 6.417 0.017 2 0 "[ . 1 . 2 . 3]" 1
90 1 7 GLU H 1 73 LYS H . . 6.600 5.591 3.102 6.646 0.046 29 0 "[ . 1 . 2 . 3]" 1
91 1 7 GLU HA 1 8 LEU QB . . 6.500 4.700 4.283 4.991 . 0 0 "[ . 1 . 2 . 3]" 1
92 1 7 GLU HA 1 8 LEU MD1 . . 7.600 4.859 2.723 5.622 . 0 0 "[ . 1 . 2 . 3]" 1
93 1 7 GLU HA 1 8 LEU MD2 . . 7.600 4.190 2.800 5.542 . 0 0 "[ . 1 . 2 . 3]" 1
94 1 7 GLU HA 1 8 LEU HG . . 6.600 4.241 3.464 5.845 . 0 0 "[ . 1 . 2 . 3]" 1
95 1 7 GLU HA 1 44 ALA H . . 6.600 4.664 4.274 5.028 . 0 0 "[ . 1 . 2 . 3]" 1
96 1 7 GLU HA 1 44 ALA HA . . 6.600 5.597 5.339 5.802 . 0 0 "[ . 1 . 2 . 3]" 1
97 1 7 GLU HA 1 44 ALA MB . . 7.600 4.678 4.212 5.111 . 0 0 "[ . 1 . 2 . 3]" 1
98 1 7 GLU HA 1 45 HIS H . . 6.600 4.750 4.490 5.133 . 0 0 "[ . 1 . 2 . 3]" 1
99 1 7 GLU HA 1 45 HIS HA . . 6.600 2.267 2.103 2.899 . 0 0 "[ . 1 . 2 . 3]" 1
100 1 7 GLU HA 1 45 HIS HB2 . . 6.600 3.564 2.710 4.670 . 0 0 "[ . 1 . 2 . 3]" 1
101 1 7 GLU HA 1 45 HIS HB3 . . 6.600 4.050 2.522 5.685 . 0 0 "[ . 1 . 2 . 3]" 1
102 1 7 GLU HA 1 45 HIS HD2 . . 6.600 5.677 5.111 6.294 . 0 0 "[ . 1 . 2 . 3]" 1
103 1 7 GLU HA 1 46 ILE H . . 3.800 3.461 3.147 3.773 . 0 0 "[ . 1 . 2 . 3]" 1
104 1 7 GLU HA 1 46 ILE MD . . 7.600 3.906 2.237 6.094 . 0 0 "[ . 1 . 2 . 3]" 1
105 1 7 GLU QB 1 43 LYS HE2 . . 7.600 3.548 2.716 4.584 . 0 0 "[ . 1 . 2 . 3]" 1
106 1 7 GLU QB 1 43 LYS HE3 . . 7.600 4.494 4.097 4.970 . 0 0 "[ . 1 . 2 . 3]" 1
107 1 7 GLU QB 1 44 ALA H . . 7.600 4.746 3.549 5.314 . 0 0 "[ . 1 . 2 . 3]" 1
108 1 7 GLU QB 1 45 HIS H . . 7.600 5.549 4.166 6.212 . 0 0 "[ . 1 . 2 . 3]" 1
109 1 7 GLU QB 1 45 HIS HA . . 7.300 3.835 2.498 4.282 . 0 0 "[ . 1 . 2 . 3]" 1
110 1 7 GLU QB 1 45 HIS HD2 . . 7.600 6.654 5.533 6.848 . 0 0 "[ . 1 . 2 . 3]" 1
111 1 7 GLU QG 1 45 HIS HA . . 5.590 2.940 2.242 3.720 . 0 0 "[ . 1 . 2 . 3]" 1
112 1 7 GLU HG2 1 8 LEU H . . 6.600 4.513 4.096 5.982 . 0 0 "[ . 1 . 2 . 3]" 1
113 1 7 GLU HG2 1 8 LEU HA . . 6.600 6.454 6.100 6.730 0.130 21 0 "[ . 1 . 2 . 3]" 1
114 1 7 GLU HG2 1 45 HIS HA . . 6.000 3.054 2.254 5.063 . 0 0 "[ . 1 . 2 . 3]" 1
115 1 7 GLU HG2 1 45 HIS HD2 . . 6.600 5.208 3.714 6.537 . 0 0 "[ . 1 . 2 . 3]" 1
116 1 7 GLU HG2 1 46 ILE H . . 6.600 4.366 3.250 6.148 . 0 0 "[ . 1 . 2 . 3]" 1
117 1 7 GLU HG3 1 8 LEU H . . 6.600 5.227 4.611 5.498 . 0 0 "[ . 1 . 2 . 3]" 1
118 1 7 GLU HG3 1 8 LEU HA . . 6.600 6.609 6.412 6.671 0.071 5 0 "[ . 1 . 2 . 3]" 1
119 1 7 GLU HG3 1 45 HIS HA . . 6.000 4.284 2.556 5.237 . 0 0 "[ . 1 . 2 . 3]" 1
120 1 7 GLU HG3 1 45 HIS HD2 . . 6.600 6.120 4.893 6.666 0.066 16 0 "[ . 1 . 2 . 3]" 1
121 1 7 GLU HG3 1 46 ILE H . . 6.600 5.096 3.297 5.800 . 0 0 "[ . 1 . 2 . 3]" 1
122 1 8 LEU H 1 8 LEU MD1 . . 5.600 3.420 2.189 4.227 . 0 0 "[ . 1 . 2 . 3]" 1
123 1 8 LEU H 1 8 LEU MD2 . . 5.600 3.210 1.997 4.216 . 0 0 "[ . 1 . 2 . 3]" 1
124 1 8 LEU H 1 8 LEU HG . . 5.200 2.593 2.046 4.438 . 0 0 "[ . 1 . 2 . 3]" 1
125 1 8 LEU H 1 9 VAL H . . 5.000 4.338 4.093 4.759 . 0 0 "[ . 1 . 2 . 3]" 1
126 1 8 LEU H 1 43 LYS HA . . 5.600 4.736 4.248 5.638 0.038 21 0 "[ . 1 . 2 . 3]" 1
127 1 8 LEU H 1 44 ALA H . . 4.700 3.166 2.918 3.898 . 0 0 "[ . 1 . 2 . 3]" 1
128 1 8 LEU H 1 44 ALA MB . . 7.600 3.503 2.973 3.963 . 0 0 "[ . 1 . 2 . 3]" 1
129 1 8 LEU H 1 45 HIS HA . . 6.600 3.502 3.006 4.235 . 0 0 "[ . 1 . 2 . 3]" 1
130 1 8 LEU H 1 46 ILE H . . 6.600 4.720 3.939 5.426 . 0 0 "[ . 1 . 2 . 3]" 1
131 1 8 LEU H 1 46 ILE QG . . 7.600 5.575 4.778 6.649 . 0 0 "[ . 1 . 2 . 3]" 1
132 1 8 LEU HA 1 9 VAL HB . . 4.700 4.386 4.205 4.540 . 0 0 "[ . 1 . 2 . 3]" 1
133 1 8 LEU HA 1 9 VAL QG . . 9.160 4.021 3.636 4.462 . 0 0 "[ . 1 . 2 . 3]" 1
134 1 8 LEU HA 1 10 VAL MG1 . . 7.600 5.240 4.201 6.391 . 0 0 "[ . 1 . 2 . 3]" 1
135 1 8 LEU HA 1 10 VAL MG2 . . 7.600 5.739 4.653 6.409 . 0 0 "[ . 1 . 2 . 3]" 1
136 1 8 LEU HA 1 43 LYS QD . . 7.600 5.681 4.405 6.775 . 0 0 "[ . 1 . 2 . 3]" 1
137 1 8 LEU HA 1 70 SER H . . 6.600 4.820 3.876 5.993 . 0 0 "[ . 1 . 2 . 3]" 1
138 1 8 LEU HA 1 71 LEU HA . . 5.700 2.651 2.262 3.759 . 0 0 "[ . 1 . 2 . 3]" 1
139 1 8 LEU HA 1 71 LEU QB . . 7.600 4.487 3.936 5.139 . 0 0 "[ . 1 . 2 . 3]" 1
140 1 8 LEU HA 1 71 LEU HG . . 6.600 5.118 3.293 6.586 . 0 0 "[ . 1 . 2 . 3]" 1
141 1 8 LEU HA 1 72 VAL H . . 5.200 3.185 2.092 5.007 . 0 0 "[ . 1 . 2 . 3]" 1
142 1 8 LEU HA 1 72 VAL HA . . 6.600 5.206 3.264 6.582 . 0 0 "[ . 1 . 2 . 3]" 1
143 1 8 LEU HA 1 73 LYS H . . 6.600 4.584 2.921 6.108 . 0 0 "[ . 1 . 2 . 3]" 1
144 1 8 LEU QB 1 9 VAL H . . 4.700 2.961 2.533 3.411 . 0 0 "[ . 1 . 2 . 3]" 1
145 1 8 LEU QB 1 10 VAL MG1 . . 8.600 3.524 2.025 4.929 . 0 0 "[ . 1 . 2 . 3]" 1
146 1 8 LEU QB 1 10 VAL QG . . 7.730 3.273 2.021 4.049 . 0 0 "[ . 1 . 2 . 3]" 1
147 1 8 LEU QB 1 10 VAL MG2 . . 8.600 4.466 3.396 5.412 . 0 0 "[ . 1 . 2 . 3]" 1
148 1 8 LEU QB 1 43 LYS HA . . 7.600 5.597 4.939 6.162 . 0 0 "[ . 1 . 2 . 3]" 1
149 1 8 LEU QB 1 44 ALA H . . 7.600 4.609 3.568 4.975 . 0 0 "[ . 1 . 2 . 3]" 1
150 1 8 LEU QB 1 44 ALA MB . . 7.400 4.104 2.573 4.704 . 0 0 "[ . 1 . 2 . 3]" 1
151 1 8 LEU QB 1 45 HIS HA . . 7.600 5.961 5.319 6.787 . 0 0 "[ . 1 . 2 . 3]" 1
152 1 8 LEU QB 1 59 ILE HB . . 7.000 6.265 5.817 6.372 . 0 0 "[ . 1 . 2 . 3]" 1
153 1 8 LEU QB 1 69 PRO HA . . 7.400 3.220 2.448 3.935 . 0 0 "[ . 1 . 2 . 3]" 1
154 1 8 LEU QB 1 70 SER H . . 7.600 3.449 2.436 4.410 . 0 0 "[ . 1 . 2 . 3]" 1
155 1 8 LEU QB 1 71 LEU HA . . 7.600 2.948 2.149 4.735 . 0 0 "[ . 1 . 2 . 3]" 1
156 1 8 LEU QB 1 72 VAL H . . 7.600 4.333 3.384 6.696 . 0 0 "[ . 1 . 2 . 3]" 1
157 1 8 LEU QD 1 9 VAL H . . 6.570 3.957 3.058 4.523 . 0 0 "[ . 1 . 2 . 3]" 1
158 1 8 LEU QD 1 11 ARG H . . 9.170 5.932 5.307 6.832 . 0 0 "[ . 1 . 2 . 3]" 1
159 1 8 LEU QD 1 44 ALA MB . . 8.110 2.286 1.870 3.147 . 0 0 "[ . 1 . 2 . 3]" 1
160 1 8 LEU QD 1 55 PRO HA . . 9.170 4.912 4.050 5.920 . 0 0 "[ . 1 . 2 . 3]" 1
161 1 8 LEU QD 1 59 ILE HA . . 9.170 3.055 2.471 4.374 . 0 0 "[ . 1 . 2 . 3]" 1
162 1 8 LEU QD 1 69 PRO QB . . 10.070 2.028 1.892 2.300 . 0 0 "[ . 1 . 2 . 3]" 1
163 1 8 LEU QD 1 69 PRO QG . . 10.050 3.489 3.108 3.918 . 0 0 "[ . 1 . 2 . 3]" 1
164 1 8 LEU QD 1 71 LEU HA . . 6.800 4.128 3.370 4.683 . 0 0 "[ . 1 . 2 . 3]" 1
165 1 8 LEU MD1 1 9 VAL H . . 6.900 4.392 3.103 5.262 . 0 0 "[ . 1 . 2 . 3]" 1
166 1 8 LEU MD1 1 9 VAL HA . . 7.600 4.865 3.197 6.354 . 0 0 "[ . 1 . 2 . 3]" 1
167 1 8 LEU MD1 1 44 ALA H . . 7.600 3.744 2.549 5.379 . 0 0 "[ . 1 . 2 . 3]" 1
168 1 8 LEU MD1 1 44 ALA MB . . 8.600 2.477 1.924 4.000 . 0 0 "[ . 1 . 2 . 3]" 1
169 1 8 LEU MD1 1 69 PRO HA . . 7.600 3.161 2.142 5.179 . 0 0 "[ . 1 . 2 . 3]" 1
170 1 8 LEU MD1 1 70 SER H . . 7.600 4.357 2.813 6.343 . 0 0 "[ . 1 . 2 . 3]" 1
171 1 8 LEU MD1 1 71 LEU HA . . 7.600 5.045 4.113 5.856 . 0 0 "[ . 1 . 2 . 3]" 1
172 1 8 LEU MD2 1 9 VAL H . . 6.900 4.809 3.564 5.430 . 0 0 "[ . 1 . 2 . 3]" 1
173 1 8 LEU MD2 1 9 VAL HA . . 7.600 5.883 3.856 6.367 . 0 0 "[ . 1 . 2 . 3]" 1
174 1 8 LEU MD2 1 44 ALA H . . 7.600 4.746 2.538 5.764 . 0 0 "[ . 1 . 2 . 3]" 1
175 1 8 LEU MD2 1 44 ALA MB . . 8.600 3.368 1.999 4.855 . 0 0 "[ . 1 . 2 . 3]" 1
176 1 8 LEU MD2 1 69 PRO HA . . 7.600 4.410 2.230 5.630 . 0 0 "[ . 1 . 2 . 3]" 1
177 1 8 LEU MD2 1 70 SER H . . 7.600 5.200 3.289 6.348 . 0 0 "[ . 1 . 2 . 3]" 1
178 1 8 LEU MD2 1 71 LEU HA . . 7.600 4.472 3.391 5.453 . 0 0 "[ . 1 . 2 . 3]" 1
179 1 8 LEU HG 1 9 VAL H . . 5.700 4.931 4.089 5.305 . 0 0 "[ . 1 . 2 . 3]" 1
180 1 8 LEU HG 1 10 VAL QG . . 9.160 3.674 2.192 4.494 . 0 0 "[ . 1 . 2 . 3]" 1
181 1 8 LEU HG 1 45 HIS HA . . 6.600 4.905 3.657 6.656 0.056 17 0 "[ . 1 . 2 . 3]" 1
182 1 9 VAL H 1 9 VAL MG1 . . 4.800 3.650 3.354 3.781 . 0 0 "[ . 1 . 2 . 3]" 1
183 1 9 VAL H 1 9 VAL MG2 . . 4.800 2.997 2.631 3.425 . 0 0 "[ . 1 . 2 . 3]" 1
184 1 9 VAL H 1 10 VAL HA . . 6.600 5.114 4.771 5.510 . 0 0 "[ . 1 . 2 . 3]" 1
185 1 9 VAL H 1 10 VAL QG . . 9.160 4.176 3.731 5.214 . 0 0 "[ . 1 . 2 . 3]" 1
186 1 9 VAL H 1 43 LYS HA . . 5.600 4.780 4.558 5.126 . 0 0 "[ . 1 . 2 . 3]" 1
187 1 9 VAL H 1 44 ALA MB . . 7.600 5.663 5.222 6.180 . 0 0 "[ . 1 . 2 . 3]" 1
188 1 9 VAL H 1 69 PRO HA . . 6.600 4.500 3.669 5.287 . 0 0 "[ . 1 . 2 . 3]" 1
189 1 9 VAL H 1 69 PRO QB . . 7.600 5.264 4.641 5.733 . 0 0 "[ . 1 . 2 . 3]" 1
190 1 9 VAL H 1 70 SER H . . 4.800 3.477 2.863 4.297 . 0 0 "[ . 1 . 2 . 3]" 1
191 1 9 VAL H 1 70 SER HB2 . . 6.600 4.272 3.153 5.606 . 0 0 "[ . 1 . 2 . 3]" 1
192 1 9 VAL H 1 70 SER HB3 . . 6.600 4.576 2.661 5.283 . 0 0 "[ . 1 . 2 . 3]" 1
193 1 9 VAL H 1 71 LEU HA . . 6.600 3.654 2.929 5.017 . 0 0 "[ . 1 . 2 . 3]" 1
194 1 9 VAL H 1 71 LEU QB . . 7.600 5.306 4.636 5.996 . 0 0 "[ . 1 . 2 . 3]" 1
195 1 9 VAL H 1 71 LEU HG . . 6.600 5.921 4.940 6.616 0.016 17 0 "[ . 1 . 2 . 3]" 1
196 1 9 VAL H 1 72 VAL H . . 6.600 3.684 2.438 5.525 . 0 0 "[ . 1 . 2 . 3]" 1
197 1 9 VAL H 1 72 VAL HA . . 6.600 4.901 3.039 6.140 . 0 0 "[ . 1 . 2 . 3]" 1
198 1 9 VAL H 1 72 VAL HB . . 6.400 4.443 2.747 6.471 0.071 28 0 "[ . 1 . 2 . 3]" 1
199 1 9 VAL HA 1 10 VAL HA . . 5.100 4.472 4.382 4.583 . 0 0 "[ . 1 . 2 . 3]" 1
200 1 9 VAL HA 1 10 VAL HB . . 6.600 5.417 4.074 5.752 . 0 0 "[ . 1 . 2 . 3]" 1
201 1 9 VAL HA 1 10 VAL MG1 . . 7.600 4.131 3.203 5.220 . 0 0 "[ . 1 . 2 . 3]" 1
202 1 9 VAL HA 1 10 VAL MG2 . . 7.600 3.601 2.904 5.510 . 0 0 "[ . 1 . 2 . 3]" 1
203 1 9 VAL HA 1 43 LYS H . . 6.600 4.749 4.540 4.936 . 0 0 "[ . 1 . 2 . 3]" 1
204 1 9 VAL HA 1 43 LYS HA . . 6.600 2.190 2.082 2.549 . 0 0 "[ . 1 . 2 . 3]" 1
205 1 9 VAL HA 1 43 LYS HB2 . . 6.600 3.779 2.830 4.698 . 0 0 "[ . 1 . 2 . 3]" 1
206 1 9 VAL HA 1 43 LYS HB3 . . 6.600 4.608 2.408 5.548 . 0 0 "[ . 1 . 2 . 3]" 1
207 1 9 VAL HA 1 43 LYS QD . . 7.600 4.958 3.466 6.061 . 0 0 "[ . 1 . 2 . 3]" 1
208 1 9 VAL HA 1 43 LYS QG . . 7.600 3.620 2.438 5.120 . 0 0 "[ . 1 . 2 . 3]" 1
209 1 9 VAL HA 1 44 ALA H . . 6.600 3.345 2.913 3.601 . 0 0 "[ . 1 . 2 . 3]" 1
210 1 9 VAL HB 1 10 VAL H . . 6.400 4.318 4.073 4.567 . 0 0 "[ . 1 . 2 . 3]" 1
211 1 9 VAL HB 1 44 ALA H . . 6.600 6.055 5.667 6.315 . 0 0 "[ . 1 . 2 . 3]" 1
212 1 9 VAL HB 1 70 SER H . . 6.100 4.101 3.574 4.596 . 0 0 "[ . 1 . 2 . 3]" 1
213 1 9 VAL HB 1 70 SER HB2 . . 6.600 3.759 2.500 5.808 . 0 0 "[ . 1 . 2 . 3]" 1
214 1 9 VAL HB 1 70 SER QB . . 6.100 3.226 2.462 4.327 . 0 0 "[ . 1 . 2 . 3]" 1
215 1 9 VAL HB 1 70 SER HB3 . . 6.600 4.140 2.501 5.186 . 0 0 "[ . 1 . 2 . 3]" 1
216 1 9 VAL QG 1 11 ARG H . . 9.160 3.684 2.375 4.885 . 0 0 "[ . 1 . 2 . 3]" 1
217 1 9 VAL QG 1 43 LYS H . . 9.160 4.364 3.642 4.705 . 0 0 "[ . 1 . 2 . 3]" 1
218 1 9 VAL QG 1 43 LYS HA . . 7.140 3.019 2.375 3.360 . 0 0 "[ . 1 . 2 . 3]" 1
219 1 9 VAL QG 1 43 LYS QE . . 7.240 2.888 2.169 3.521 . 0 0 "[ . 1 . 2 . 3]" 1
220 1 9 VAL QG 1 43 LYS QG . . 10.160 3.257 2.199 4.699 . 0 0 "[ . 1 . 2 . 3]" 1
221 1 9 VAL QG 1 69 PRO HA . . 9.160 4.690 4.147 5.082 . 0 0 "[ . 1 . 2 . 3]" 1
222 1 9 VAL QG 1 70 SER QB . . 10.040 3.239 2.340 4.428 . 0 0 "[ . 1 . 2 . 3]" 1
223 1 9 VAL MG1 1 10 VAL H . . 5.500 2.672 2.286 3.245 . 0 0 "[ . 1 . 2 . 3]" 1
224 1 9 VAL MG1 1 13 MET ME . . 8.600 4.991 4.327 5.924 . 0 0 "[ . 1 . 2 . 3]" 1
225 1 9 VAL MG1 1 42 ASN HD21 . . 7.600 4.936 3.410 5.689 . 0 0 "[ . 1 . 2 . 3]" 1
226 1 9 VAL MG1 1 42 ASN HD22 . . 7.600 5.175 4.257 6.305 . 0 0 "[ . 1 . 2 . 3]" 1
227 1 9 VAL MG1 1 43 LYS HA . . 7.600 3.975 3.472 4.308 . 0 0 "[ . 1 . 2 . 3]" 1
228 1 9 VAL MG1 1 43 LYS HE2 . . 7.600 5.414 4.480 6.175 . 0 0 "[ . 1 . 2 . 3]" 1
229 1 9 VAL MG1 1 43 LYS HE3 . . 7.600 6.087 4.672 6.377 . 0 0 "[ . 1 . 2 . 3]" 1
230 1 9 VAL MG1 1 44 ALA H . . 7.600 5.371 4.876 5.686 . 0 0 "[ . 1 . 2 . 3]" 1
231 1 9 VAL MG1 1 70 SER H . . 7.600 3.864 3.107 4.566 . 0 0 "[ . 1 . 2 . 3]" 1
232 1 9 VAL MG2 1 10 VAL H . . 5.500 3.611 3.127 4.013 . 0 0 "[ . 1 . 2 . 3]" 1
233 1 9 VAL MG2 1 13 MET ME . . 8.600 5.512 4.928 6.005 . 0 0 "[ . 1 . 2 . 3]" 1
234 1 9 VAL MG2 1 42 ASN HD21 . . 7.600 5.747 4.955 6.362 . 0 0 "[ . 1 . 2 . 3]" 1
235 1 9 VAL MG2 1 42 ASN HD22 . . 7.600 6.260 5.904 6.396 . 0 0 "[ . 1 . 2 . 3]" 1
236 1 9 VAL MG2 1 43 LYS HA . . 7.600 3.142 2.418 3.580 . 0 0 "[ . 1 . 2 . 3]" 1
237 1 9 VAL MG2 1 43 LYS HE2 . . 7.600 3.021 2.325 3.763 . 0 0 "[ . 1 . 2 . 3]" 1
238 1 9 VAL MG2 1 43 LYS HE3 . . 7.600 3.899 2.592 4.690 . 0 0 "[ . 1 . 2 . 3]" 1
239 1 9 VAL MG2 1 44 ALA H . . 7.600 4.480 3.802 4.909 . 0 0 "[ . 1 . 2 . 3]" 1
240 1 9 VAL MG2 1 70 SER H . . 7.600 5.282 4.975 5.609 . 0 0 "[ . 1 . 2 . 3]" 1
241 1 10 VAL H 1 11 ARG H . . 6.600 3.968 2.713 4.412 . 0 0 "[ . 1 . 2 . 3]" 1
242 1 10 VAL H 1 13 MET ME . . 7.600 3.759 2.983 5.129 . 0 0 "[ . 1 . 2 . 3]" 1
243 1 10 VAL H 1 42 ASN HA . . 6.600 4.246 3.955 4.770 . 0 0 "[ . 1 . 2 . 3]" 1
244 1 10 VAL H 1 42 ASN HB2 . . 6.600 4.515 3.046 5.520 . 0 0 "[ . 1 . 2 . 3]" 1
245 1 10 VAL H 1 42 ASN QB . . 6.440 3.546 3.005 4.334 . 0 0 "[ . 1 . 2 . 3]" 1
246 1 10 VAL H 1 42 ASN HB3 . . 6.600 3.926 3.186 5.134 . 0 0 "[ . 1 . 2 . 3]" 1
247 1 10 VAL H 1 42 ASN QD . . 7.470 4.892 2.552 6.390 . 0 0 "[ . 1 . 2 . 3]" 1
248 1 10 VAL H 1 43 LYS H . . 6.600 4.490 4.056 4.939 . 0 0 "[ . 1 . 2 . 3]" 1
249 1 10 VAL H 1 43 LYS HA . . 5.700 2.893 2.053 3.661 . 0 0 "[ . 1 . 2 . 3]" 1
250 1 10 VAL H 1 43 LYS HB2 . . 6.600 4.967 4.262 5.786 . 0 0 "[ . 1 . 2 . 3]" 1
251 1 10 VAL H 1 43 LYS QB . . 6.100 4.595 3.567 5.324 . 0 0 "[ . 1 . 2 . 3]" 1
252 1 10 VAL H 1 43 LYS HB3 . . 6.600 5.521 3.826 6.220 . 0 0 "[ . 1 . 2 . 3]" 1
253 1 10 VAL H 1 43 LYS QG . . 7.600 4.954 3.884 6.239 . 0 0 "[ . 1 . 2 . 3]" 1
254 1 10 VAL H 1 44 ALA H . . 6.600 4.003 3.262 4.510 . 0 0 "[ . 1 . 2 . 3]" 1
255 1 10 VAL H 1 44 ALA MB . . 7.600 4.755 3.831 5.420 . 0 0 "[ . 1 . 2 . 3]" 1
256 1 10 VAL H 1 69 PRO HA . . 6.600 4.735 4.400 5.008 . 0 0 "[ . 1 . 2 . 3]" 1
257 1 10 VAL HA 1 22 ILE MD . . 7.600 5.519 4.943 6.335 . 0 0 "[ . 1 . 2 . 3]" 1
258 1 10 VAL HA 1 67 PHE QD . . 8.600 5.736 4.772 6.667 . 0 0 "[ . 1 . 2 . 3]" 1
259 1 10 VAL HA 1 68 GLU H . . 6.600 3.491 2.517 4.448 . 0 0 "[ . 1 . 2 . 3]" 1
260 1 10 VAL HA 1 69 PRO HA . . 5.800 2.659 2.137 3.295 . 0 0 "[ . 1 . 2 . 3]" 1
261 1 10 VAL HA 1 69 PRO QB . . 6.700 4.173 3.643 4.630 . 0 0 "[ . 1 . 2 . 3]" 1
262 1 10 VAL HA 1 69 PRO QD . . 7.600 4.290 3.852 4.810 . 0 0 "[ . 1 . 2 . 3]" 1
263 1 10 VAL HA 1 69 PRO HG2 . . 6.600 6.029 5.574 6.233 . 0 0 "[ . 1 . 2 . 3]" 1
264 1 10 VAL HA 1 69 PRO QG . . 6.060 5.368 4.911 5.505 . 0 0 "[ . 1 . 2 . 3]" 1
265 1 10 VAL HA 1 69 PRO HG3 . . 6.600 6.025 5.456 6.218 . 0 0 "[ . 1 . 2 . 3]" 1
266 1 10 VAL HA 1 70 SER H . . 6.200 3.404 2.653 3.961 . 0 0 "[ . 1 . 2 . 3]" 1
267 1 10 VAL HB 1 11 ARG H . . 6.400 3.736 2.192 4.433 . 0 0 "[ . 1 . 2 . 3]" 1
268 1 10 VAL HB 1 42 ASN HA . . 6.600 6.017 4.813 6.689 0.089 28 0 "[ . 1 . 2 . 3]" 1
269 1 10 VAL HB 1 43 LYS HA . . 6.600 5.599 3.801 6.618 0.018 12 0 "[ . 1 . 2 . 3]" 1
270 1 10 VAL HB 1 44 ALA MB . . 7.600 4.377 2.876 5.235 . 0 0 "[ . 1 . 2 . 3]" 1
271 1 10 VAL HB 1 69 PRO HA . . 6.500 4.096 2.210 4.920 . 0 0 "[ . 1 . 2 . 3]" 1
272 1 10 VAL HB 1 70 SER H . . 6.600 5.556 3.465 6.290 . 0 0 "[ . 1 . 2 . 3]" 1
273 1 10 VAL QG 1 11 ARG H . . 7.240 3.439 2.403 3.832 . 0 0 "[ . 1 . 2 . 3]" 1
274 1 10 VAL QG 1 11 ARG HA . . 9.160 4.281 3.476 4.826 . 0 0 "[ . 1 . 2 . 3]" 1
275 1 10 VAL QG 1 13 MET ME . . 10.160 2.233 1.872 3.444 . 0 0 "[ . 1 . 2 . 3]" 1
276 1 10 VAL QG 1 43 LYS H . . 9.160 3.884 3.380 4.486 . 0 0 "[ . 1 . 2 . 3]" 1
277 1 10 VAL QG 1 44 ALA MB . . 6.980 2.226 1.844 2.718 . 0 0 "[ . 1 . 2 . 3]" 1
278 1 10 VAL QG 1 67 PHE HA . . 9.160 4.334 3.756 5.058 . 0 0 "[ . 1 . 2 . 3]" 1
279 1 10 VAL QG 1 67 PHE QB . . 7.260 2.400 1.889 3.087 . 0 0 "[ . 1 . 2 . 3]" 1
280 1 10 VAL QG 1 67 PHE QD . . 9.320 3.580 3.150 4.130 . 0 0 "[ . 1 . 2 . 3]" 1
281 1 10 VAL QG 1 67 PHE QE . . 11.160 4.774 4.370 5.376 . 0 0 "[ . 1 . 2 . 3]" 1
282 1 10 VAL QG 1 67 PHE HZ . . 9.160 5.916 5.440 6.630 . 0 0 "[ . 1 . 2 . 3]" 1
283 1 10 VAL QG 1 68 GLU H . . 9.160 3.342 2.402 4.563 . 0 0 "[ . 1 . 2 . 3]" 1
284 1 10 VAL QG 1 69 PRO QB . . 10.160 2.364 2.128 2.659 . 0 0 "[ . 1 . 2 . 3]" 1
285 1 10 VAL QG 1 69 PRO QD . . 10.160 2.970 2.373 4.104 . 0 0 "[ . 1 . 2 . 3]" 1
286 1 10 VAL QG 1 69 PRO QG . . 9.540 3.716 3.458 4.120 . 0 0 "[ . 1 . 2 . 3]" 1
287 1 10 VAL MG1 1 11 ARG H . . 7.600 3.854 2.428 4.372 . 0 0 "[ . 1 . 2 . 3]" 1
288 1 10 VAL MG1 1 13 MET H . . 7.600 5.570 3.014 6.377 . 0 0 "[ . 1 . 2 . 3]" 1
289 1 10 VAL MG1 1 43 LYS HA . . 7.600 4.402 2.579 5.712 . 0 0 "[ . 1 . 2 . 3]" 1
290 1 10 VAL MG1 1 44 ALA H . . 7.600 3.828 2.481 5.218 . 0 0 "[ . 1 . 2 . 3]" 1
291 1 10 VAL MG1 1 44 ALA MB . . 7.300 2.885 2.083 3.940 . 0 0 "[ . 1 . 2 . 3]" 1
292 1 10 VAL MG1 1 67 PHE HB2 . . 9.350 3.210 2.089 4.608 . 0 0 "[ . 1 . 2 . 3]" 1
293 1 10 VAL MG1 1 67 PHE HB3 . . 9.350 3.120 2.038 4.463 . 0 0 "[ . 1 . 2 . 3]" 1
294 1 10 VAL MG1 1 67 PHE QD . . 9.600 4.112 3.224 5.125 . 0 0 "[ . 1 . 2 . 3]" 1
295 1 10 VAL MG1 1 68 GLU HA . . 7.600 4.711 3.811 6.448 . 0 0 "[ . 1 . 2 . 3]" 1
296 1 10 VAL MG1 1 69 PRO HA . . 7.600 2.341 1.951 4.307 . 0 0 "[ . 1 . 2 . 3]" 1
297 1 10 VAL MG1 1 70 SER H . . 7.600 3.814 3.047 5.313 . 0 0 "[ . 1 . 2 . 3]" 1
298 1 10 VAL MG2 1 11 ARG H . . 7.600 4.072 2.496 4.549 . 0 0 "[ . 1 . 2 . 3]" 1
299 1 10 VAL MG2 1 13 MET H . . 7.600 4.617 3.484 5.549 . 0 0 "[ . 1 . 2 . 3]" 1
300 1 10 VAL MG2 1 43 LYS HA . . 7.600 3.282 2.255 5.584 . 0 0 "[ . 1 . 2 . 3]" 1
301 1 10 VAL MG2 1 44 ALA H . . 7.600 3.122 2.371 5.252 . 0 0 "[ . 1 . 2 . 3]" 1
302 1 10 VAL MG2 1 44 ALA MB . . 7.300 2.532 2.026 3.947 . 0 0 "[ . 1 . 2 . 3]" 1
303 1 10 VAL MG2 1 67 PHE HB2 . . 9.350 4.124 2.707 4.869 . 0 0 "[ . 1 . 2 . 3]" 1
304 1 10 VAL MG2 1 67 PHE HB3 . . 9.350 3.575 2.067 4.937 . 0 0 "[ . 1 . 2 . 3]" 1
305 1 10 VAL MG2 1 67 PHE QD . . 9.600 4.304 3.263 5.182 . 0 0 "[ . 1 . 2 . 3]" 1
306 1 10 VAL MG2 1 68 GLU HA . . 7.600 6.168 3.787 6.516 . 0 0 "[ . 1 . 2 . 3]" 1
307 1 10 VAL MG2 1 69 PRO HA . . 7.600 3.846 2.153 4.608 . 0 0 "[ . 1 . 2 . 3]" 1
308 1 10 VAL MG2 1 70 SER H . . 7.600 4.990 3.864 5.612 . 0 0 "[ . 1 . 2 . 3]" 1
309 1 11 ARG H 1 11 ARG HG2 . . 5.200 3.433 1.956 4.511 . 0 0 "[ . 1 . 2 . 3]" 1
310 1 11 ARG H 1 11 ARG HG3 . . 5.200 3.216 2.083 4.714 . 0 0 "[ . 1 . 2 . 3]" 1
311 1 11 ARG H 1 12 GLY H . . 6.600 4.537 4.238 4.699 . 0 0 "[ . 1 . 2 . 3]" 1
312 1 11 ARG H 1 22 ILE MD . . 7.600 6.275 5.798 6.408 . 0 0 "[ . 1 . 2 . 3]" 1
313 1 11 ARG H 1 67 PHE QB . . 7.480 4.059 2.794 4.503 . 0 0 "[ . 1 . 2 . 3]" 1
314 1 11 ARG H 1 68 GLU HB2 . . 5.500 3.432 2.141 4.882 . 0 0 "[ . 1 . 2 . 3]" 1
315 1 11 ARG H 1 68 GLU QB . . 5.280 2.732 1.954 4.363 . 0 0 "[ . 1 . 2 . 3]" 1
316 1 11 ARG H 1 68 GLU HB3 . . 5.500 3.552 1.963 5.059 . 0 0 "[ . 1 . 2 . 3]" 1
317 1 11 ARG H 1 69 PRO HA . . 5.800 4.457 3.768 5.580 . 0 0 "[ . 1 . 2 . 3]" 1
318 1 11 ARG H 1 70 SER H . . 6.600 4.632 3.058 6.060 . 0 0 "[ . 1 . 2 . 3]" 1
319 1 11 ARG HA 1 12 GLY H . . 3.500 2.383 2.173 2.612 . 0 0 "[ . 1 . 2 . 3]" 1
320 1 11 ARG HA 1 13 MET H . . 5.600 3.451 2.841 4.692 . 0 0 "[ . 1 . 2 . 3]" 1
321 1 11 ARG HA 1 42 ASN HB2 . . 6.400 4.685 2.843 5.871 . 0 0 "[ . 1 . 2 . 3]" 1
322 1 11 ARG HA 1 42 ASN QB . . 6.090 3.643 2.149 4.898 . 0 0 "[ . 1 . 2 . 3]" 1
323 1 11 ARG HA 1 42 ASN HB3 . . 6.400 3.937 2.175 5.615 . 0 0 "[ . 1 . 2 . 3]" 1
324 1 11 ARG HA 1 42 ASN HD21 . . 6.600 4.761 2.480 6.643 0.043 18 0 "[ . 1 . 2 . 3]" 1
325 1 11 ARG HA 1 42 ASN HD22 . . 6.600 4.392 1.986 6.627 0.027 3 0 "[ . 1 . 2 . 3]" 1
326 1 11 ARG HA 1 68 GLU H . . 6.600 4.592 4.273 5.025 . 0 0 "[ . 1 . 2 . 3]" 1
327 1 11 ARG HA 1 68 GLU QG . . 7.600 5.599 4.001 6.785 . 0 0 "[ . 1 . 2 . 3]" 1
328 1 11 ARG QB 1 13 MET H . . 7.600 4.662 4.147 5.713 . 0 0 "[ . 1 . 2 . 3]" 1
329 1 11 ARG QB 1 42 ASN QB . . 7.580 4.721 2.605 6.027 . 0 0 "[ . 1 . 2 . 3]" 1
330 1 11 ARG QG 1 42 ASN QB . . 6.550 3.952 2.050 5.247 . 0 0 "[ . 1 . 2 . 3]" 1
331 1 11 ARG QG 1 68 GLU H . . 7.480 4.658 3.345 5.468 . 0 0 "[ . 1 . 2 . 3]" 1
332 1 11 ARG QG 1 70 SER QB . . 8.350 5.224 3.205 6.640 . 0 0 "[ . 1 . 2 . 3]" 1
333 1 11 ARG HG2 1 12 GLY H . . 6.600 4.302 2.246 5.154 . 0 0 "[ . 1 . 2 . 3]" 1
334 1 11 ARG HG3 1 12 GLY H . . 6.600 4.662 3.302 5.740 . 0 0 "[ . 1 . 2 . 3]" 1
335 1 12 GLY H 1 13 MET H . . 5.800 2.655 2.219 3.693 . 0 0 "[ . 1 . 2 . 3]" 1
336 1 12 GLY H 1 13 MET HA . . 5.400 5.050 4.654 5.449 0.049 26 0 "[ . 1 . 2 . 3]" 1
337 1 12 GLY H 1 13 MET QB . . 6.180 4.418 3.865 5.007 . 0 0 "[ . 1 . 2 . 3]" 1
338 1 12 GLY H 1 42 ASN QB . . 7.480 5.294 3.408 6.679 . 0 0 "[ . 1 . 2 . 3]" 1
339 1 12 GLY QA 1 13 MET QG . . 8.480 4.457 4.131 5.636 . 0 0 "[ . 1 . 2 . 3]" 1
340 1 12 GLY QA 1 67 PHE HA . . 7.600 2.829 2.205 4.186 . 0 0 "[ . 1 . 2 . 3]" 1
341 1 12 GLY QA 1 67 PHE QD . . 9.600 2.509 2.228 3.738 . 0 0 "[ . 1 . 2 . 3]" 1
342 1 12 GLY QA 1 67 PHE QE . . 9.600 3.927 3.121 4.668 . 0 0 "[ . 1 . 2 . 3]" 1
343 1 12 GLY QA 1 67 PHE HZ . . 7.600 5.977 4.220 6.772 . 0 0 "[ . 1 . 2 . 3]" 1
344 1 12 GLY QA 1 68 GLU H . . 7.600 3.825 3.180 5.565 . 0 0 "[ . 1 . 2 . 3]" 1
345 1 13 MET H 1 13 MET ME . . 6.300 3.669 2.797 4.738 . 0 0 "[ . 1 . 2 . 3]" 1
346 1 13 MET H 1 13 MET HG2 . . 4.700 3.724 2.541 4.394 . 0 0 "[ . 1 . 2 . 3]" 1
347 1 13 MET H 1 13 MET HG3 . . 4.700 2.839 2.189 4.516 . 0 0 "[ . 1 . 2 . 3]" 1
348 1 13 MET H 1 14 THR H . . 6.100 4.246 3.613 4.697 . 0 0 "[ . 1 . 2 . 3]" 1
349 1 13 MET H 1 14 THR MG . . 7.600 5.159 4.319 6.087 . 0 0 "[ . 1 . 2 . 3]" 1
350 1 13 MET H 1 18 CYS HB2 . . 6.600 5.534 4.794 6.112 . 0 0 "[ . 1 . 2 . 3]" 1
351 1 13 MET H 1 18 CYS HB3 . . 6.600 4.877 4.132 5.533 . 0 0 "[ . 1 . 2 . 3]" 1
352 1 13 MET H 1 22 ILE MD . . 7.600 4.666 3.843 5.222 . 0 0 "[ . 1 . 2 . 3]" 1
353 1 13 MET H 1 39 LEU QD . . 9.170 5.860 4.674 6.822 . 0 0 "[ . 1 . 2 . 3]" 1
354 1 13 MET H 1 42 ASN QB . . 7.480 5.494 3.813 6.685 . 0 0 "[ . 1 . 2 . 3]" 1
355 1 13 MET H 1 67 PHE QD . . 8.600 3.193 2.447 5.025 . 0 0 "[ . 1 . 2 . 3]" 1
356 1 13 MET H 1 67 PHE QE . . 8.600 4.087 2.445 4.975 . 0 0 "[ . 1 . 2 . 3]" 1
357 1 13 MET HA 1 13 MET ME . . 5.900 4.431 4.135 4.671 . 0 0 "[ . 1 . 2 . 3]" 1
358 1 13 MET HA 1 14 THR MG . . 7.600 3.779 3.110 4.320 . 0 0 "[ . 1 . 2 . 3]" 1
359 1 13 MET HA 1 18 CYS HB2 . . 6.600 3.011 2.181 3.850 . 0 0 "[ . 1 . 2 . 3]" 1
360 1 13 MET HA 1 18 CYS QB . . 6.290 2.424 2.015 3.202 . 0 0 "[ . 1 . 2 . 3]" 1
361 1 13 MET HA 1 18 CYS HB3 . . 6.600 2.578 2.126 3.450 . 0 0 "[ . 1 . 2 . 3]" 1
362 1 13 MET QB 1 18 CYS H . . 7.480 5.186 4.025 6.419 . 0 0 "[ . 1 . 2 . 3]" 1
363 1 13 MET QB 1 18 CYS QB . . 7.420 2.641 1.969 3.412 . 0 0 "[ . 1 . 2 . 3]" 1
364 1 13 MET QB 1 22 ILE MD . . 8.480 3.804 2.257 4.680 . 0 0 "[ . 1 . 2 . 3]" 1
365 1 13 MET QB 1 67 PHE QD . . 9.480 4.477 3.149 6.293 . 0 0 "[ . 1 . 2 . 3]" 1
366 1 13 MET HB2 1 18 CYS HB2 . . 8.350 4.390 2.253 5.135 . 0 0 "[ . 1 . 2 . 3]" 1
367 1 13 MET HB2 1 18 CYS HB3 . . 8.350 4.270 2.248 4.750 . 0 0 "[ . 1 . 2 . 3]" 1
368 1 13 MET HB2 1 67 PHE QE . . 8.600 4.966 4.098 6.407 . 0 0 "[ . 1 . 2 . 3]" 1
369 1 13 MET HB2 1 67 PHE HZ . . 6.600 6.464 4.764 6.705 0.105 18 0 "[ . 1 . 2 . 3]" 1
370 1 13 MET HB3 1 18 CYS HB2 . . 8.350 3.091 2.297 4.995 . 0 0 "[ . 1 . 2 . 3]" 1
371 1 13 MET HB3 1 18 CYS HB3 . . 8.350 3.300 2.392 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
372 1 13 MET HB3 1 67 PHE QE . . 8.600 4.691 4.042 6.122 . 0 0 "[ . 1 . 2 . 3]" 1
373 1 13 MET HB3 1 67 PHE HZ . . 6.600 5.838 4.661 6.627 0.027 13 0 "[ . 1 . 2 . 3]" 1
374 1 13 MET ME 1 22 ILE HB . . 7.600 5.240 4.188 6.336 . 0 0 "[ . 1 . 2 . 3]" 1
375 1 13 MET ME 1 22 ILE MD . . 8.600 3.066 2.233 3.701 . 0 0 "[ . 1 . 2 . 3]" 1
376 1 13 MET ME 1 37 VAL HA . . 7.600 4.308 3.353 5.807 . 0 0 "[ . 1 . 2 . 3]" 1
377 1 13 MET ME 1 37 VAL QG . . 10.160 2.714 2.001 4.062 . 0 0 "[ . 1 . 2 . 3]" 1
378 1 13 MET ME 1 39 LEU HA . . 7.600 2.325 2.019 3.112 . 0 0 "[ . 1 . 2 . 3]" 1
379 1 13 MET ME 1 39 LEU MD1 . . 8.000 4.910 4.241 5.558 . 0 0 "[ . 1 . 2 . 3]" 1
380 1 13 MET ME 1 39 LEU QD . . 7.740 4.004 2.046 4.787 . 0 0 "[ . 1 . 2 . 3]" 1
381 1 13 MET ME 1 39 LEU MD2 . . 8.000 4.384 2.051 5.349 . 0 0 "[ . 1 . 2 . 3]" 1
382 1 13 MET ME 1 41 THR H . . 7.600 5.147 4.707 5.823 . 0 0 "[ . 1 . 2 . 3]" 1
383 1 13 MET ME 1 42 ASN H . . 7.600 3.724 3.145 4.259 . 0 0 "[ . 1 . 2 . 3]" 1
384 1 13 MET ME 1 42 ASN HA . . 5.800 2.330 2.033 3.147 . 0 0 "[ . 1 . 2 . 3]" 1
385 1 13 MET ME 1 42 ASN HB2 . . 7.600 4.350 3.433 5.273 . 0 0 "[ . 1 . 2 . 3]" 1
386 1 13 MET ME 1 42 ASN QB . . 7.060 3.655 2.570 4.765 . 0 0 "[ . 1 . 2 . 3]" 1
387 1 13 MET ME 1 42 ASN HB3 . . 7.600 4.026 2.627 5.604 . 0 0 "[ . 1 . 2 . 3]" 1
388 1 13 MET ME 1 42 ASN HD21 . . 7.600 3.914 2.208 5.524 . 0 0 "[ . 1 . 2 . 3]" 1
389 1 13 MET ME 1 42 ASN HD22 . . 7.600 4.593 2.471 6.363 . 0 0 "[ . 1 . 2 . 3]" 1
390 1 13 MET ME 1 43 LYS H . . 7.600 2.893 2.344 3.940 . 0 0 "[ . 1 . 2 . 3]" 1
391 1 13 MET ME 1 43 LYS HA . . 7.600 4.084 3.325 5.166 . 0 0 "[ . 1 . 2 . 3]" 1
392 1 13 MET ME 1 44 ALA HA . . 7.600 4.678 3.841 5.754 . 0 0 "[ . 1 . 2 . 3]" 1
393 1 13 MET ME 1 44 ALA MB . . 8.600 3.990 3.336 4.786 . 0 0 "[ . 1 . 2 . 3]" 1
394 1 13 MET QG 1 18 CYS QB . . 6.970 2.287 1.943 3.674 . 0 0 "[ . 1 . 2 . 3]" 1
395 1 13 MET QG 1 22 ILE MD . . 8.480 2.407 2.070 3.847 . 0 0 "[ . 1 . 2 . 3]" 1
396 1 13 MET QG 1 22 ILE MG . . 8.480 4.976 4.423 6.306 . 0 0 "[ . 1 . 2 . 3]" 1
397 1 13 MET QG 1 39 LEU QD . . 10.050 4.515 3.416 5.830 . 0 0 "[ . 1 . 2 . 3]" 1
398 1 13 MET QG 1 67 PHE QD . . 9.480 3.335 2.691 5.208 . 0 0 "[ . 1 . 2 . 3]" 1
399 1 13 MET QG 1 67 PHE QE . . 9.480 3.234 2.546 5.339 . 0 0 "[ . 1 . 2 . 3]" 1
400 1 13 MET QG 1 67 PHE HZ . . 7.480 4.089 3.702 6.293 . 0 0 "[ . 1 . 2 . 3]" 1
401 1 13 MET HG2 1 18 CYS HB2 . . 8.350 3.400 2.171 5.203 . 0 0 "[ . 1 . 2 . 3]" 1
402 1 13 MET HG2 1 18 CYS HB3 . . 8.350 2.686 2.167 5.106 . 0 0 "[ . 1 . 2 . 3]" 1
403 1 13 MET HG3 1 18 CYS HB2 . . 8.350 4.244 2.209 5.341 . 0 0 "[ . 1 . 2 . 3]" 1
404 1 13 MET HG3 1 18 CYS HB3 . . 8.350 3.334 2.197 4.633 . 0 0 "[ . 1 . 2 . 3]" 1
405 1 14 THR H 1 15 CYS H . . 5.600 2.842 2.136 4.492 . 0 0 "[ . 1 . 2 . 3]" 1
406 1 14 THR H 1 18 CYS HB2 . . 6.600 3.557 2.313 5.134 . 0 0 "[ . 1 . 2 . 3]" 1
407 1 14 THR H 1 18 CYS HB3 . . 6.600 3.977 3.217 5.018 . 0 0 "[ . 1 . 2 . 3]" 1
408 1 14 THR H 1 39 LEU QD . . 9.170 4.868 3.022 6.527 . 0 0 "[ . 1 . 2 . 3]" 1
409 1 14 THR H 1 67 PHE QE . . 8.600 3.982 3.416 4.967 . 0 0 "[ . 1 . 2 . 3]" 1
410 1 14 THR H 1 67 PHE HZ . . 6.600 5.646 5.056 6.392 . 0 0 "[ . 1 . 2 . 3]" 1
411 1 14 THR HA 1 39 LEU MD1 . . 7.600 4.776 3.439 6.301 . 0 0 "[ . 1 . 2 . 3]" 1
412 1 14 THR HA 1 39 LEU MD2 . . 7.600 4.939 3.266 6.331 . 0 0 "[ . 1 . 2 . 3]" 1
413 1 14 THR HB 1 15 CYS H . . 6.600 4.113 2.567 4.725 . 0 0 "[ . 1 . 2 . 3]" 1
414 1 14 THR HB 1 15 CYS HA . . 6.600 5.824 3.817 6.602 0.002 26 0 "[ . 1 . 2 . 3]" 1
415 1 14 THR HB 1 15 CYS QB . . 7.480 5.114 3.219 5.917 . 0 0 "[ . 1 . 2 . 3]" 1
416 1 14 THR MG 1 15 CYS H . . 7.600 3.125 1.907 4.354 . 0 0 "[ . 1 . 2 . 3]" 1
417 1 14 THR MG 1 15 CYS HA . . 7.600 4.582 3.748 5.915 . 0 0 "[ . 1 . 2 . 3]" 1
418 1 14 THR MG 1 15 CYS QB . . 8.480 3.403 2.279 5.240 . 0 0 "[ . 1 . 2 . 3]" 1
419 1 14 THR MG 1 67 PHE QD . . 9.600 5.533 4.826 6.635 . 0 0 "[ . 1 . 2 . 3]" 1
420 1 14 THR MG 1 67 PHE QE . . 9.600 4.430 3.864 5.033 . 0 0 "[ . 1 . 2 . 3]" 1
421 1 14 THR MG 1 67 PHE HZ . . 7.600 5.906 4.934 6.742 . 0 0 "[ . 1 . 2 . 3]" 1
422 1 15 CYS H 1 18 CYS H . . 6.600 4.312 2.908 6.295 . 0 0 "[ . 1 . 2 . 3]" 1
423 1 15 CYS H 1 18 CYS HB2 . . 6.600 3.710 2.237 5.124 . 0 0 "[ . 1 . 2 . 3]" 1
424 1 15 CYS H 1 18 CYS HB3 . . 6.600 4.948 3.808 6.627 0.027 1 0 "[ . 1 . 2 . 3]" 1
425 1 15 CYS H 1 19 VAL H . . 6.600 5.595 3.534 6.634 0.034 1 0 "[ . 1 . 2 . 3]" 1
426 1 15 CYS HA 1 16 ALA HA . . 6.600 4.489 4.302 4.899 . 0 0 "[ . 1 . 2 . 3]" 1
427 1 15 CYS HA 1 16 ALA MB . . 6.100 4.235 3.863 4.966 . 0 0 "[ . 1 . 2 . 3]" 1
428 1 15 CYS HA 1 18 CYS H . . 6.600 5.346 4.498 6.692 0.092 6 0 "[ . 1 . 2 . 3]" 1
429 1 15 CYS HA 1 39 LEU MD1 . . 7.600 4.399 2.338 6.330 . 0 0 "[ . 1 . 2 . 3]" 1
430 1 15 CYS HA 1 39 LEU QD . . 7.280 3.543 2.135 5.084 . 0 0 "[ . 1 . 2 . 3]" 1
431 1 15 CYS HA 1 39 LEU MD2 . . 7.600 3.886 2.230 6.253 . 0 0 "[ . 1 . 2 . 3]" 1
432 1 15 CYS QB 1 16 ALA MB . . 7.250 4.067 3.225 4.746 . 0 0 "[ . 1 . 2 . 3]" 1
433 1 15 CYS QB 1 18 CYS H . . 6.480 3.874 2.454 5.813 . 0 0 "[ . 1 . 2 . 3]" 1
434 1 15 CYS HB2 1 16 ALA MB . . 7.600 5.021 3.873 5.470 . 0 0 "[ . 1 . 2 . 3]" 1
435 1 15 CYS HB3 1 16 ALA MB . . 7.600 4.356 3.368 5.339 . 0 0 "[ . 1 . 2 . 3]" 1
436 1 16 ALA HA 1 18 CYS H . . 6.600 4.221 3.843 4.886 . 0 0 "[ . 1 . 2 . 3]" 1
437 1 16 ALA HA 1 19 VAL H . . 4.600 3.642 3.076 4.134 . 0 0 "[ . 1 . 2 . 3]" 1
438 1 16 ALA HA 1 19 VAL HB . . 5.100 3.756 2.259 4.945 . 0 0 "[ . 1 . 2 . 3]" 1
439 1 16 ALA HA 1 19 VAL QG . . 9.160 2.834 2.170 3.898 . 0 0 "[ . 1 . 2 . 3]" 1
440 1 16 ALA HA 1 20 HIS H . . 6.500 5.161 3.760 6.115 . 0 0 "[ . 1 . 2 . 3]" 1
441 1 16 ALA MB 1 17 SER QB . . 8.480 4.199 3.546 4.626 . 0 0 "[ . 1 . 2 . 3]" 1
442 1 16 ALA MB 1 18 CYS H . . 5.900 4.501 4.321 4.920 . 0 0 "[ . 1 . 2 . 3]" 1
443 1 16 ALA MB 1 19 VAL H . . 6.700 4.638 4.379 5.211 . 0 0 "[ . 1 . 2 . 3]" 1
444 1 16 ALA MB 1 19 VAL HB . . 7.600 4.298 3.440 5.553 . 0 0 "[ . 1 . 2 . 3]" 1
445 1 16 ALA MB 1 20 HIS H . . 7.400 5.065 4.157 6.140 . 0 0 "[ . 1 . 2 . 3]" 1
446 1 16 ALA MB 1 20 HIS HD2 . . 7.600 6.285 5.911 6.397 . 0 0 "[ . 1 . 2 . 3]" 1
447 1 17 SER HA 1 19 VAL H . . 6.600 4.316 3.849 4.735 . 0 0 "[ . 1 . 2 . 3]" 1
448 1 17 SER HA 1 20 HIS H . . 6.600 3.609 3.274 3.881 . 0 0 "[ . 1 . 2 . 3]" 1
449 1 17 SER HA 1 20 HIS QB . . 6.580 3.775 2.846 4.295 . 0 0 "[ . 1 . 2 . 3]" 1
450 1 17 SER HA 1 20 HIS HD2 . . 6.600 3.183 2.650 3.465 . 0 0 "[ . 1 . 2 . 3]" 1
451 1 17 SER HA 1 20 HIS HE1 . . 6.600 6.157 4.051 6.651 0.051 9 0 "[ . 1 . 2 . 3]" 1
452 1 17 SER QB 1 20 HIS QB . . 7.420 5.251 4.447 5.787 . 0 0 "[ . 1 . 2 . 3]" 1
453 1 17 SER QB 1 20 HIS HD2 . . 7.480 3.831 2.961 4.554 . 0 0 "[ . 1 . 2 . 3]" 1
454 1 17 SER QB 1 20 HIS HE1 . . 7.480 6.387 4.406 6.682 . 0 0 "[ . 1 . 2 . 3]" 1
455 1 17 SER HB2 1 18 CYS H . . 4.000 2.858 2.120 4.011 0.011 21 0 "[ . 1 . 2 . 3]" 1
456 1 17 SER HB2 1 20 HIS HB2 . . 8.350 7.951 6.801 8.371 0.021 3 0 "[ . 1 . 2 . 3]" 1
457 1 17 SER HB2 1 20 HIS HB3 . . 8.350 6.460 5.640 7.033 . 0 0 "[ . 1 . 2 . 3]" 1
458 1 17 SER HB3 1 18 CYS H . . 4.000 3.648 2.518 4.038 0.038 15 0 "[ . 1 . 2 . 3]" 1
459 1 17 SER HB3 1 20 HIS HB2 . . 8.350 7.402 6.413 8.126 . 0 0 "[ . 1 . 2 . 3]" 1
460 1 17 SER HB3 1 20 HIS HB3 . . 8.350 5.990 4.827 7.377 . 0 0 "[ . 1 . 2 . 3]" 1
461 1 18 CYS H 1 19 VAL H . . 4.600 2.883 2.526 3.354 . 0 0 "[ . 1 . 2 . 3]" 1
462 1 18 CYS H 1 19 VAL HA . . 6.600 5.452 5.153 5.840 . 0 0 "[ . 1 . 2 . 3]" 1
463 1 18 CYS H 1 19 VAL HB . . 5.800 4.980 4.707 5.308 . 0 0 "[ . 1 . 2 . 3]" 1
464 1 18 CYS H 1 19 VAL MG1 . . 7.600 6.038 5.779 6.333 . 0 0 "[ . 1 . 2 . 3]" 1
465 1 18 CYS H 1 19 VAL MG2 . . 7.600 4.201 3.707 4.776 . 0 0 "[ . 1 . 2 . 3]" 1
466 1 18 CYS H 1 21 LYS H . . 5.500 4.602 4.460 4.728 . 0 0 "[ . 1 . 2 . 3]" 1
467 1 18 CYS H 1 21 LYS HB2 . . 6.600 4.265 3.632 4.711 . 0 0 "[ . 1 . 2 . 3]" 1
468 1 18 CYS H 1 21 LYS HB3 . . 6.600 5.228 4.742 5.693 . 0 0 "[ . 1 . 2 . 3]" 1
469 1 18 CYS H 1 22 ILE MD . . 7.600 6.052 5.392 6.392 . 0 0 "[ . 1 . 2 . 3]" 1
470 1 18 CYS H 1 39 LEU QD . . 9.170 5.070 3.717 5.986 . 0 0 "[ . 1 . 2 . 3]" 1
471 1 18 CYS H 1 67 PHE QE . . 8.600 5.473 5.174 6.076 . 0 0 "[ . 1 . 2 . 3]" 1
472 1 18 CYS H 1 67 PHE HZ . . 6.600 5.091 4.676 5.843 . 0 0 "[ . 1 . 2 . 3]" 1
473 1 18 CYS HA 1 19 VAL QG . . 9.160 4.830 4.734 4.912 . 0 0 "[ . 1 . 2 . 3]" 1
474 1 18 CYS HA 1 20 HIS H . . 5.800 4.794 4.534 5.007 . 0 0 "[ . 1 . 2 . 3]" 1
475 1 18 CYS HA 1 20 HIS HD2 . . 6.600 4.887 4.514 5.194 . 0 0 "[ . 1 . 2 . 3]" 1
476 1 18 CYS HA 1 21 LYS H . . 6.600 3.386 3.091 3.591 . 0 0 "[ . 1 . 2 . 3]" 1
477 1 18 CYS HA 1 21 LYS HA . . 5.000 4.908 4.676 5.033 0.033 28 0 "[ . 1 . 2 . 3]" 1
478 1 18 CYS HA 1 21 LYS HB2 . . 5.800 2.348 2.167 2.611 . 0 0 "[ . 1 . 2 . 3]" 1
479 1 18 CYS HA 1 21 LYS QB . . 5.490 2.180 2.023 2.358 . 0 0 "[ . 1 . 2 . 3]" 1
480 1 18 CYS HA 1 21 LYS HB3 . . 5.800 2.609 2.383 2.983 . 0 0 "[ . 1 . 2 . 3]" 1
481 1 18 CYS HA 1 21 LYS QD . . 7.500 4.429 3.121 4.992 . 0 0 "[ . 1 . 2 . 3]" 1
482 1 18 CYS HA 1 21 LYS QE . . 7.600 5.352 2.703 5.958 . 0 0 "[ . 1 . 2 . 3]" 1
483 1 18 CYS HA 1 21 LYS QG . . 7.480 3.430 2.959 4.175 . 0 0 "[ . 1 . 2 . 3]" 1
484 1 18 CYS HA 1 22 ILE H . . 6.600 4.004 3.750 4.266 . 0 0 "[ . 1 . 2 . 3]" 1
485 1 18 CYS HA 1 22 ILE HB . . 6.000 5.669 5.087 5.969 . 0 0 "[ . 1 . 2 . 3]" 1
486 1 18 CYS HA 1 22 ILE MD . . 7.600 4.427 3.824 4.679 . 0 0 "[ . 1 . 2 . 3]" 1
487 1 18 CYS HA 1 22 ILE MG . . 7.600 6.348 6.046 6.429 . 0 0 "[ . 1 . 2 . 3]" 1
488 1 18 CYS HA 1 67 PHE QD . . 8.600 5.749 5.353 6.447 . 0 0 "[ . 1 . 2 . 3]" 1
489 1 18 CYS HA 1 67 PHE QE . . 8.600 3.836 3.596 4.407 . 0 0 "[ . 1 . 2 . 3]" 1
490 1 18 CYS HA 1 67 PHE HZ . . 6.600 2.732 2.368 3.511 . 0 0 "[ . 1 . 2 . 3]" 1
491 1 18 CYS QB 1 19 VAL H . . 3.500 2.612 2.289 3.039 . 0 0 "[ . 1 . 2 . 3]" 1
492 1 18 CYS QB 1 19 VAL HB . . 7.480 4.840 4.559 5.302 . 0 0 "[ . 1 . 2 . 3]" 1
493 1 18 CYS QB 1 19 VAL QG . . 10.040 3.278 3.054 3.640 . 0 0 "[ . 1 . 2 . 3]" 1
494 1 18 CYS QB 1 22 ILE QG . . 8.350 3.738 3.460 4.193 . 0 0 "[ . 1 . 2 . 3]" 1
495 1 18 CYS QB 1 39 LEU QD . . 10.050 4.039 2.233 5.033 . 0 0 "[ . 1 . 2 . 3]" 1
496 1 18 CYS QB 1 67 PHE HZ . . 6.340 2.855 2.385 3.448 . 0 0 "[ . 1 . 2 . 3]" 1
497 1 18 CYS HB2 1 19 VAL H . . 3.900 2.687 2.323 3.191 . 0 0 "[ . 1 . 2 . 3]" 1
498 1 18 CYS HB2 1 22 ILE MD . . 7.600 4.556 3.773 5.060 . 0 0 "[ . 1 . 2 . 3]" 1
499 1 18 CYS HB2 1 67 PHE QD . . 8.600 5.872 5.472 6.311 . 0 0 "[ . 1 . 2 . 3]" 1
500 1 18 CYS HB2 1 67 PHE QE . . 8.600 4.209 3.517 4.911 . 0 0 "[ . 1 . 2 . 3]" 1
501 1 18 CYS HB2 1 67 PHE HZ . . 6.600 4.404 3.912 4.989 . 0 0 "[ . 1 . 2 . 3]" 1
502 1 18 CYS HB3 1 19 VAL H . . 3.900 3.609 3.358 3.953 0.053 15 0 "[ . 1 . 2 . 3]" 1
503 1 18 CYS HB3 1 22 ILE MD . . 7.600 3.382 2.653 3.721 . 0 0 "[ . 1 . 2 . 3]" 1
504 1 18 CYS HB3 1 67 PHE QD . . 8.600 4.532 4.153 4.894 . 0 0 "[ . 1 . 2 . 3]" 1
505 1 18 CYS HB3 1 67 PHE QE . . 8.600 2.917 2.274 3.734 . 0 0 "[ . 1 . 2 . 3]" 1
506 1 18 CYS HB3 1 67 PHE HZ . . 6.600 2.895 2.406 3.519 . 0 0 "[ . 1 . 2 . 3]" 1
507 1 19 VAL H 1 19 VAL HB . . 4.000 2.504 2.386 2.686 . 0 0 "[ . 1 . 2 . 3]" 1
508 1 19 VAL H 1 19 VAL MG1 . . 4.500 3.759 3.728 3.776 . 0 0 "[ . 1 . 2 . 3]" 1
509 1 19 VAL H 1 19 VAL MG2 . . 4.500 2.033 1.882 2.186 . 0 0 "[ . 1 . 2 . 3]" 1
510 1 19 VAL H 1 20 HIS H . . 4.400 2.995 2.723 3.303 . 0 0 "[ . 1 . 2 . 3]" 1
511 1 19 VAL H 1 20 HIS HA . . 6.600 5.488 5.292 5.671 . 0 0 "[ . 1 . 2 . 3]" 1
512 1 19 VAL H 1 21 LYS H . . 6.600 3.914 3.672 4.148 . 0 0 "[ . 1 . 2 . 3]" 1
513 1 19 VAL H 1 22 ILE MD . . 7.600 4.846 4.374 5.634 . 0 0 "[ . 1 . 2 . 3]" 1
514 1 19 VAL H 1 37 VAL MG1 . . 7.600 5.427 4.054 6.387 . 0 0 "[ . 1 . 2 . 3]" 1
515 1 19 VAL H 1 37 VAL MG2 . . 7.600 4.871 4.093 6.288 . 0 0 "[ . 1 . 2 . 3]" 1
516 1 19 VAL H 1 39 LEU QD . . 9.170 4.085 3.017 4.773 . 0 0 "[ . 1 . 2 . 3]" 1
517 1 19 VAL HA 1 21 LYS H . . 5.300 4.391 4.194 4.537 . 0 0 "[ . 1 . 2 . 3]" 1
518 1 19 VAL HA 1 22 ILE H . . 6.600 3.852 3.636 4.079 . 0 0 "[ . 1 . 2 . 3]" 1
519 1 19 VAL HA 1 22 ILE MG . . 7.600 4.883 4.216 5.337 . 0 0 "[ . 1 . 2 . 3]" 1
520 1 19 VAL HA 1 37 VAL H . . 6.600 5.113 4.406 5.672 . 0 0 "[ . 1 . 2 . 3]" 1
521 1 19 VAL HA 1 37 VAL MG1 . . 7.600 3.168 1.955 4.187 . 0 0 "[ . 1 . 2 . 3]" 1
522 1 19 VAL HA 1 37 VAL MG2 . . 7.600 2.676 1.934 3.983 . 0 0 "[ . 1 . 2 . 3]" 1
523 1 19 VAL HB 1 20 HIS H . . 4.600 2.319 2.192 2.449 . 0 0 "[ . 1 . 2 . 3]" 1
524 1 19 VAL HB 1 20 HIS HA . . 6.600 4.382 4.141 4.560 . 0 0 "[ . 1 . 2 . 3]" 1
525 1 19 VAL HB 1 20 HIS QB . . 7.080 3.680 3.535 3.952 . 0 0 "[ . 1 . 2 . 3]" 1
526 1 19 VAL HB 1 20 HIS HD2 . . 6.600 5.539 5.053 5.912 . 0 0 "[ . 1 . 2 . 3]" 1
527 1 19 VAL HB 1 37 VAL QG . . 9.160 4.048 3.846 4.725 . 0 0 "[ . 1 . 2 . 3]" 1
528 1 19 VAL HB 1 39 LEU H . . 6.600 6.007 5.080 6.628 0.028 6 0 "[ . 1 . 2 . 3]" 1
529 1 19 VAL QG 1 20 HIS HA . . 9.160 3.268 3.089 3.547 . 0 0 "[ . 1 . 2 . 3]" 1
530 1 19 VAL QG 1 20 HIS QB . . 10.040 3.519 3.127 3.894 . 0 0 "[ . 1 . 2 . 3]" 1
531 1 19 VAL QG 1 21 LYS H . . 9.160 4.424 4.306 4.555 . 0 0 "[ . 1 . 2 . 3]" 1
532 1 19 VAL QG 1 23 GLU H . . 9.160 4.123 3.905 4.552 . 0 0 "[ . 1 . 2 . 3]" 1
533 1 19 VAL QG 1 38 ALA MB . . 10.160 3.895 3.398 4.491 . 0 0 "[ . 1 . 2 . 3]" 1
534 1 19 VAL QG 1 39 LEU H . . 9.160 2.997 2.398 3.562 . 0 0 "[ . 1 . 2 . 3]" 1
535 1 19 VAL MG1 1 20 HIS H . . 7.600 3.107 2.824 3.475 . 0 0 "[ . 1 . 2 . 3]" 1
536 1 19 VAL MG1 1 20 HIS HD2 . . 7.600 5.842 5.415 6.343 . 0 0 "[ . 1 . 2 . 3]" 1
537 1 19 VAL MG1 1 37 VAL H . . 7.600 3.553 3.133 4.486 . 0 0 "[ . 1 . 2 . 3]" 1
538 1 19 VAL MG1 1 38 ALA H . . 7.600 4.694 3.490 5.423 . 0 0 "[ . 1 . 2 . 3]" 1
539 1 19 VAL MG1 1 38 ALA HA . . 7.600 3.472 2.490 4.402 . 0 0 "[ . 1 . 2 . 3]" 1
540 1 19 VAL MG2 1 20 HIS H . . 7.600 3.800 3.634 3.916 . 0 0 "[ . 1 . 2 . 3]" 1
541 1 19 VAL MG2 1 20 HIS HD2 . . 7.600 6.321 6.060 6.431 . 0 0 "[ . 1 . 2 . 3]" 1
542 1 19 VAL MG2 1 37 VAL H . . 7.600 5.323 4.705 6.075 . 0 0 "[ . 1 . 2 . 3]" 1
543 1 19 VAL MG2 1 38 ALA H . . 7.600 4.693 4.039 5.307 . 0 0 "[ . 1 . 2 . 3]" 1
544 1 19 VAL MG2 1 38 ALA HA . . 7.600 3.209 2.655 3.999 . 0 0 "[ . 1 . 2 . 3]" 1
545 1 20 HIS H 1 20 HIS HD2 . . 6.600 3.330 3.037 3.665 . 0 0 "[ . 1 . 2 . 3]" 1
546 1 20 HIS H 1 20 HIS HE1 . . 6.600 6.637 5.836 6.762 0.162 16 0 "[ . 1 . 2 . 3]" 1
547 1 20 HIS H 1 21 LYS H . . 3.300 2.548 2.350 2.740 . 0 0 "[ . 1 . 2 . 3]" 1
548 1 20 HIS H 1 22 ILE H . . 4.500 4.302 4.062 4.517 0.017 28 0 "[ . 1 . 2 . 3]" 1
549 1 20 HIS H 1 22 ILE QG . . 7.480 5.770 5.296 6.095 . 0 0 "[ . 1 . 2 . 3]" 1
550 1 20 HIS H 1 23 GLU H . . 6.600 4.837 4.620 5.318 . 0 0 "[ . 1 . 2 . 3]" 1
551 1 20 HIS H 1 23 GLU QG . . 7.600 6.198 4.334 6.682 . 0 0 "[ . 1 . 2 . 3]" 1
552 1 20 HIS HA 1 20 HIS HE1 . . 6.600 6.236 5.522 6.651 0.051 21 0 "[ . 1 . 2 . 3]" 1
553 1 20 HIS HA 1 21 LYS HA . . 6.600 4.861 4.746 4.977 . 0 0 "[ . 1 . 2 . 3]" 1
554 1 20 HIS HA 1 22 ILE H . . 6.600 4.157 3.617 4.520 . 0 0 "[ . 1 . 2 . 3]" 1
555 1 20 HIS HA 1 23 GLU H . . 6.300 3.301 2.878 3.778 . 0 0 "[ . 1 . 2 . 3]" 1
556 1 20 HIS HA 1 23 GLU HA . . 6.600 4.912 4.487 5.296 . 0 0 "[ . 1 . 2 . 3]" 1
557 1 20 HIS HA 1 23 GLU HB2 . . 6.600 2.564 2.076 2.924 . 0 0 "[ . 1 . 2 . 3]" 1
558 1 20 HIS HA 1 23 GLU QB . . 5.830 2.269 2.061 2.501 . 0 0 "[ . 1 . 2 . 3]" 1
559 1 20 HIS HA 1 23 GLU HB3 . . 6.600 2.668 2.201 3.482 . 0 0 "[ . 1 . 2 . 3]" 1
560 1 20 HIS HA 1 23 GLU QG . . 7.600 4.125 2.450 4.589 . 0 0 "[ . 1 . 2 . 3]" 1
561 1 20 HIS HA 1 24 SER H . . 5.200 3.101 2.360 3.634 . 0 0 "[ . 1 . 2 . 3]" 1
562 1 20 HIS HA 1 24 SER HA . . 6.600 5.410 4.685 5.847 . 0 0 "[ . 1 . 2 . 3]" 1
563 1 20 HIS QB 1 21 LYS H . . 4.180 3.515 3.128 3.770 . 0 0 "[ . 1 . 2 . 3]" 1
564 1 20 HIS QB 1 21 LYS HA . . 7.480 4.918 4.619 5.041 . 0 0 "[ . 1 . 2 . 3]" 1
565 1 20 HIS QB 1 21 LYS QB . . 7.420 4.964 4.547 5.210 . 0 0 "[ . 1 . 2 . 3]" 1
566 1 20 HIS QB 1 22 ILE H . . 7.480 5.187 4.862 5.408 . 0 0 "[ . 1 . 2 . 3]" 1
567 1 20 HIS QB 1 24 SER H . . 7.480 4.184 3.242 4.878 . 0 0 "[ . 1 . 2 . 3]" 1
568 1 20 HIS HB2 1 21 LYS HB2 . . 8.350 6.365 6.019 6.539 . 0 0 "[ . 1 . 2 . 3]" 1
569 1 20 HIS HB2 1 21 LYS HB3 . . 8.350 7.229 6.937 7.402 . 0 0 "[ . 1 . 2 . 3]" 1
570 1 20 HIS HB3 1 21 LYS HB2 . . 8.350 5.586 4.904 6.167 . 0 0 "[ . 1 . 2 . 3]" 1
571 1 20 HIS HB3 1 21 LYS HB3 . . 8.350 6.679 6.285 7.200 . 0 0 "[ . 1 . 2 . 3]" 1
572 1 20 HIS HD2 1 21 LYS H . . 6.600 2.351 2.213 2.513 . 0 0 "[ . 1 . 2 . 3]" 1
573 1 20 HIS HD2 1 21 LYS QB . . 7.480 3.138 2.905 3.479 . 0 0 "[ . 1 . 2 . 3]" 1
574 1 20 HIS HD2 1 21 LYS QG . . 7.480 3.875 3.104 4.378 . 0 0 "[ . 1 . 2 . 3]" 1
575 1 20 HIS HD2 1 23 GLU HB2 . . 6.600 6.447 5.215 6.692 0.092 3 0 "[ . 1 . 2 . 3]" 1
576 1 20 HIS HD2 1 23 GLU HB3 . . 6.600 6.508 5.821 6.739 0.139 23 0 "[ . 1 . 2 . 3]" 1
577 1 20 HIS HD2 1 24 SER HB2 . . 6.600 5.225 4.575 6.606 0.006 29 0 "[ . 1 . 2 . 3]" 1
578 1 20 HIS HD2 1 24 SER HB3 . . 6.600 5.388 4.499 6.628 0.028 13 0 "[ . 1 . 2 . 3]" 1
579 1 20 HIS HD2 1 25 SER QB . . 7.480 6.723 6.686 6.765 . 0 0 "[ . 1 . 2 . 3]" 1
580 1 20 HIS HE1 1 21 LYS H . . 6.600 6.215 5.648 6.561 . 0 0 "[ . 1 . 2 . 3]" 1
581 1 20 HIS HE1 1 21 LYS HA . . 6.600 5.631 4.411 6.663 0.063 21 0 "[ . 1 . 2 . 3]" 1
582 1 20 HIS HE1 1 24 SER QB . . 7.480 4.455 3.088 6.504 . 0 0 "[ . 1 . 2 . 3]" 1
583 1 21 LYS H 1 21 LYS QB . . 3.910 2.108 1.997 2.234 . 0 0 "[ . 1 . 2 . 3]" 1
584 1 21 LYS H 1 21 LYS HG2 . . 5.600 4.068 3.797 4.495 . 0 0 "[ . 1 . 2 . 3]" 1
585 1 21 LYS H 1 21 LYS HG3 . . 5.600 4.409 4.157 4.674 . 0 0 "[ . 1 . 2 . 3]" 1
586 1 21 LYS H 1 22 ILE H . . 3.400 2.702 2.589 2.818 . 0 0 "[ . 1 . 2 . 3]" 1
587 1 21 LYS H 1 22 ILE HA . . 6.600 5.365 5.273 5.464 . 0 0 "[ . 1 . 2 . 3]" 1
588 1 21 LYS H 1 22 ILE MD . . 7.600 5.308 4.885 5.703 . 0 0 "[ . 1 . 2 . 3]" 1
589 1 21 LYS H 1 22 ILE MG . . 7.600 5.949 5.815 6.096 . 0 0 "[ . 1 . 2 . 3]" 1
590 1 21 LYS H 1 23 GLU H . . 6.400 4.293 4.142 4.494 . 0 0 "[ . 1 . 2 . 3]" 1
591 1 21 LYS H 1 23 GLU QB . . 7.180 4.730 4.389 4.946 . 0 0 "[ . 1 . 2 . 3]" 1
592 1 21 LYS H 1 24 SER H . . 6.200 4.672 4.524 4.794 . 0 0 "[ . 1 . 2 . 3]" 1
593 1 21 LYS HA 1 22 ILE HA . . 6.500 4.767 4.672 4.878 . 0 0 "[ . 1 . 2 . 3]" 1
594 1 21 LYS HA 1 22 ILE MD . . 7.600 6.322 6.159 6.425 . 0 0 "[ . 1 . 2 . 3]" 1
595 1 21 LYS HA 1 24 SER H . . 6.600 4.167 3.503 4.805 . 0 0 "[ . 1 . 2 . 3]" 1
596 1 21 LYS HA 1 24 SER HB2 . . 6.000 4.399 3.016 5.565 . 0 0 "[ . 1 . 2 . 3]" 1
597 1 21 LYS HA 1 24 SER QB . . 5.840 3.453 2.472 4.445 . 0 0 "[ . 1 . 2 . 3]" 1
598 1 21 LYS HA 1 24 SER HB3 . . 6.000 3.950 2.514 6.017 0.017 15 0 "[ . 1 . 2 . 3]" 1
599 1 21 LYS HA 1 67 PHE QE . . 8.600 5.721 4.868 6.549 . 0 0 "[ . 1 . 2 . 3]" 1
600 1 21 LYS HA 1 67 PHE HZ . . 6.600 6.079 5.160 6.628 0.028 20 0 "[ . 1 . 2 . 3]" 1
601 1 21 LYS QB 1 22 ILE H . . 4.180 2.536 2.318 2.738 . 0 0 "[ . 1 . 2 . 3]" 1
602 1 21 LYS QB 1 22 ILE HA . . 7.480 3.912 3.665 4.133 . 0 0 "[ . 1 . 2 . 3]" 1
603 1 21 LYS QB 1 65 LEU QD . . 8.330 3.696 2.883 4.360 . 0 0 "[ . 1 . 2 . 3]" 1
604 1 21 LYS QB 1 67 PHE HZ . . 6.390 3.039 2.223 3.550 . 0 0 "[ . 1 . 2 . 3]" 1
605 1 21 LYS HB2 1 22 ILE H . . 5.000 3.441 3.350 3.571 . 0 0 "[ . 1 . 2 . 3]" 1
606 1 21 LYS HB2 1 22 ILE MD . . 7.600 5.404 5.115 5.570 . 0 0 "[ . 1 . 2 . 3]" 1
607 1 21 LYS HB2 1 22 ILE MG . . 7.600 6.372 6.283 6.422 . 0 0 "[ . 1 . 2 . 3]" 1
608 1 21 LYS HB2 1 65 LEU MD1 . . 9.350 5.593 4.246 6.605 . 0 0 "[ . 1 . 2 . 3]" 1
609 1 21 LYS HB2 1 65 LEU MD2 . . 9.350 5.704 4.425 7.240 . 0 0 "[ . 1 . 2 . 3]" 1
610 1 21 LYS HB2 1 67 PHE QD . . 8.600 6.776 6.195 7.528 . 0 0 "[ . 1 . 2 . 3]" 1
611 1 21 LYS HB2 1 67 PHE QE . . 8.600 4.655 4.008 5.402 . 0 0 "[ . 1 . 2 . 3]" 1
612 1 21 LYS HB2 1 67 PHE HZ . . 6.600 4.059 3.455 4.690 . 0 0 "[ . 1 . 2 . 3]" 1
613 1 21 LYS HB3 1 22 ILE H . . 5.000 2.615 2.355 2.850 . 0 0 "[ . 1 . 2 . 3]" 1
614 1 21 LYS HB3 1 22 ILE MD . . 7.600 4.345 4.062 4.607 . 0 0 "[ . 1 . 2 . 3]" 1
615 1 21 LYS HB3 1 22 ILE MG . . 7.600 5.186 5.013 5.344 . 0 0 "[ . 1 . 2 . 3]" 1
616 1 21 LYS HB3 1 65 LEU MD1 . . 9.350 4.383 3.138 5.323 . 0 0 "[ . 1 . 2 . 3]" 1
617 1 21 LYS HB3 1 65 LEU MD2 . . 9.350 4.578 2.938 6.080 . 0 0 "[ . 1 . 2 . 3]" 1
618 1 21 LYS HB3 1 67 PHE QD . . 8.600 5.398 4.713 6.183 . 0 0 "[ . 1 . 2 . 3]" 1
619 1 21 LYS HB3 1 67 PHE QE . . 8.600 3.206 2.394 4.011 . 0 0 "[ . 1 . 2 . 3]" 1
620 1 21 LYS HB3 1 67 PHE HZ . . 6.600 3.150 2.250 3.693 . 0 0 "[ . 1 . 2 . 3]" 1
621 1 21 LYS QD 1 22 ILE H . . 7.600 4.038 3.629 4.375 . 0 0 "[ . 1 . 2 . 3]" 1
622 1 21 LYS QD 1 22 ILE MD . . 8.600 5.101 4.444 5.729 . 0 0 "[ . 1 . 2 . 3]" 1
623 1 21 LYS QD 1 22 ILE QG . . 8.480 3.780 3.149 4.391 . 0 0 "[ . 1 . 2 . 3]" 1
624 1 21 LYS QD 1 22 ILE MG . . 7.500 5.191 4.647 5.597 . 0 0 "[ . 1 . 2 . 3]" 1
625 1 21 LYS QD 1 67 PHE QD . . 9.600 4.989 4.154 6.131 . 0 0 "[ . 1 . 2 . 3]" 1
626 1 21 LYS QD 1 67 PHE QE . . 9.600 3.028 2.219 4.233 . 0 0 "[ . 1 . 2 . 3]" 1
627 1 21 LYS QD 1 67 PHE HZ . . 7.600 3.899 2.648 5.177 . 0 0 "[ . 1 . 2 . 3]" 1
628 1 21 LYS QE 1 65 LEU HA . . 7.600 4.058 2.720 5.603 . 0 0 "[ . 1 . 2 . 3]" 1
629 1 21 LYS QE 1 65 LEU QD . . 10.170 2.435 2.057 3.661 . 0 0 "[ . 1 . 2 . 3]" 1
630 1 21 LYS QE 1 67 PHE QE . . 9.600 4.329 2.413 5.454 . 0 0 "[ . 1 . 2 . 3]" 1
631 1 21 LYS QE 1 67 PHE HZ . . 7.600 4.765 2.267 6.055 . 0 0 "[ . 1 . 2 . 3]" 1
632 1 21 LYS QG 1 25 SER H . . 7.480 5.592 4.338 6.641 . 0 0 "[ . 1 . 2 . 3]" 1
633 1 21 LYS HG2 1 22 ILE H . . 6.600 4.973 4.396 5.173 . 0 0 "[ . 1 . 2 . 3]" 1
634 1 21 LYS HG2 1 22 ILE HA . . 6.600 5.957 4.582 6.343 . 0 0 "[ . 1 . 2 . 3]" 1
635 1 21 LYS HG2 1 67 PHE QE . . 8.600 5.326 4.174 6.303 . 0 0 "[ . 1 . 2 . 3]" 1
636 1 21 LYS HG2 1 67 PHE HZ . . 6.600 5.273 4.419 6.170 . 0 0 "[ . 1 . 2 . 3]" 1
637 1 21 LYS HG3 1 22 ILE H . . 6.600 5.011 4.645 5.254 . 0 0 "[ . 1 . 2 . 3]" 1
638 1 21 LYS HG3 1 22 ILE HA . . 6.600 6.015 5.214 6.472 . 0 0 "[ . 1 . 2 . 3]" 1
639 1 21 LYS HG3 1 67 PHE QE . . 8.600 4.346 3.594 5.367 . 0 0 "[ . 1 . 2 . 3]" 1
640 1 21 LYS HG3 1 67 PHE HZ . . 6.600 3.875 2.776 5.140 . 0 0 "[ . 1 . 2 . 3]" 1
641 1 22 ILE H 1 22 ILE MD . . 5.300 3.577 3.326 3.814 . 0 0 "[ . 1 . 2 . 3]" 1
642 1 22 ILE H 1 22 ILE HG12 . . 5.300 3.576 3.088 3.858 . 0 0 "[ . 1 . 2 . 3]" 1
643 1 22 ILE H 1 22 ILE QG . . 4.440 2.288 2.053 2.532 . 0 0 "[ . 1 . 2 . 3]" 1
644 1 22 ILE H 1 22 ILE HG13 . . 5.300 2.316 2.085 2.568 . 0 0 "[ . 1 . 2 . 3]" 1
645 1 22 ILE H 1 23 GLU H . . 3.300 2.563 2.257 2.736 . 0 0 "[ . 1 . 2 . 3]" 1
646 1 22 ILE H 1 23 GLU HA . . 6.300 5.150 4.857 5.361 . 0 0 "[ . 1 . 2 . 3]" 1
647 1 22 ILE H 1 23 GLU QB . . 7.480 4.092 3.838 4.296 . 0 0 "[ . 1 . 2 . 3]" 1
648 1 22 ILE H 1 24 SER H . . 4.100 4.179 4.124 4.218 0.118 26 0 "[ . 1 . 2 . 3]" 1
649 1 22 ILE H 1 25 SER H . . 6.600 4.644 4.397 4.825 . 0 0 "[ . 1 . 2 . 3]" 1
650 1 22 ILE H 1 37 VAL QG . . 9.160 3.497 3.183 3.709 . 0 0 "[ . 1 . 2 . 3]" 1
651 1 22 ILE H 1 65 LEU MD1 . . 7.600 5.015 4.039 6.174 . 0 0 "[ . 1 . 2 . 3]" 1
652 1 22 ILE H 1 65 LEU MD2 . . 7.600 5.404 3.698 6.342 . 0 0 "[ . 1 . 2 . 3]" 1
653 1 22 ILE H 1 67 PHE QD . . 8.600 5.941 5.393 6.496 . 0 0 "[ . 1 . 2 . 3]" 1
654 1 22 ILE H 1 67 PHE QE . . 8.600 4.352 3.874 4.811 . 0 0 "[ . 1 . 2 . 3]" 1
655 1 22 ILE H 1 67 PHE HZ . . 6.600 4.878 4.072 5.345 . 0 0 "[ . 1 . 2 . 3]" 1
656 1 22 ILE HA 1 25 SER H . . 4.700 3.803 3.516 4.262 . 0 0 "[ . 1 . 2 . 3]" 1
657 1 22 ILE HA 1 25 SER HA . . 6.600 5.678 5.295 6.067 . 0 0 "[ . 1 . 2 . 3]" 1
658 1 22 ILE HA 1 25 SER HB2 . . 6.000 3.904 3.217 4.437 . 0 0 "[ . 1 . 2 . 3]" 1
659 1 22 ILE HA 1 25 SER QB . . 5.360 2.806 2.355 3.181 . 0 0 "[ . 1 . 2 . 3]" 1
660 1 22 ILE HA 1 25 SER HB3 . . 6.000 2.888 2.392 3.479 . 0 0 "[ . 1 . 2 . 3]" 1
661 1 22 ILE HA 1 26 LEU H . . 6.600 4.057 3.835 4.352 . 0 0 "[ . 1 . 2 . 3]" 1
662 1 22 ILE HA 1 26 LEU QB . . 7.480 4.789 4.164 5.411 . 0 0 "[ . 1 . 2 . 3]" 1
663 1 22 ILE HA 1 26 LEU QD . . 9.170 3.294 2.451 4.134 . 0 0 "[ . 1 . 2 . 3]" 1
664 1 22 ILE HA 1 65 LEU MD1 . . 7.600 3.306 2.119 4.894 . 0 0 "[ . 1 . 2 . 3]" 1
665 1 22 ILE HA 1 65 LEU MD2 . . 7.600 3.826 2.089 5.126 . 0 0 "[ . 1 . 2 . 3]" 1
666 1 22 ILE HA 1 67 PHE QD . . 8.600 4.942 4.384 5.422 . 0 0 "[ . 1 . 2 . 3]" 1
667 1 22 ILE HA 1 67 PHE QE . . 8.600 3.990 3.527 4.392 . 0 0 "[ . 1 . 2 . 3]" 1
668 1 22 ILE HA 1 67 PHE HZ . . 6.600 5.773 4.914 6.393 . 0 0 "[ . 1 . 2 . 3]" 1
669 1 22 ILE HB 1 23 GLU H . . 6.500 2.306 2.095 2.527 . 0 0 "[ . 1 . 2 . 3]" 1
670 1 22 ILE HB 1 25 SER H . . 6.600 5.655 5.454 5.860 . 0 0 "[ . 1 . 2 . 3]" 1
671 1 22 ILE HB 1 37 VAL QG . . 9.160 1.999 1.887 2.142 . 0 0 "[ . 1 . 2 . 3]" 1
672 1 22 ILE HB 1 44 ALA MB . . 5.700 4.426 3.743 4.781 . 0 0 "[ . 1 . 2 . 3]" 1
673 1 22 ILE HB 1 67 PHE QD . . 8.600 5.690 5.236 6.110 . 0 0 "[ . 1 . 2 . 3]" 1
674 1 22 ILE HB 1 67 PHE QE . . 8.600 4.998 4.640 5.318 . 0 0 "[ . 1 . 2 . 3]" 1
675 1 22 ILE HB 1 67 PHE HZ . . 6.600 5.965 4.948 6.612 0.012 23 0 "[ . 1 . 2 . 3]" 1
676 1 22 ILE MD 1 23 GLU H . . 7.600 4.327 4.130 4.594 . 0 0 "[ . 1 . 2 . 3]" 1
677 1 22 ILE MD 1 25 SER QB . . 8.480 5.769 5.325 6.110 . 0 0 "[ . 1 . 2 . 3]" 1
678 1 22 ILE MD 1 37 VAL HB . . 7.600 3.518 2.900 4.452 . 0 0 "[ . 1 . 2 . 3]" 1
679 1 22 ILE MD 1 37 VAL QG . . 8.460 2.077 1.886 2.555 . 0 0 "[ . 1 . 2 . 3]" 1
680 1 22 ILE MD 1 44 ALA MB . . 8.600 3.161 2.558 3.721 . 0 0 "[ . 1 . 2 . 3]" 1
681 1 22 ILE MD 1 62 ILE HA . . 7.600 5.039 4.394 5.603 . 0 0 "[ . 1 . 2 . 3]" 1
682 1 22 ILE MD 1 62 ILE MD . . 8.600 3.693 2.686 4.585 . 0 0 "[ . 1 . 2 . 3]" 1
683 1 22 ILE MD 1 62 ILE MG . . 8.600 3.002 2.103 3.499 . 0 0 "[ . 1 . 2 . 3]" 1
684 1 22 ILE MD 1 65 LEU QB . . 8.480 4.619 3.916 5.192 . 0 0 "[ . 1 . 2 . 3]" 1
685 1 22 ILE MD 1 65 LEU QD . . 10.170 4.155 3.322 5.184 . 0 0 "[ . 1 . 2 . 3]" 1
686 1 22 ILE MD 1 67 PHE H . . 7.600 5.797 5.177 6.338 . 0 0 "[ . 1 . 2 . 3]" 1
687 1 22 ILE MD 1 67 PHE HA . . 7.600 5.330 4.973 5.868 . 0 0 "[ . 1 . 2 . 3]" 1
688 1 22 ILE MD 1 67 PHE HB2 . . 7.600 3.792 3.084 4.576 . 0 0 "[ . 1 . 2 . 3]" 1
689 1 22 ILE MD 1 67 PHE HB3 . . 7.600 3.717 3.311 4.307 . 0 0 "[ . 1 . 2 . 3]" 1
690 1 22 ILE MD 1 67 PHE QD . . 9.600 2.982 2.526 3.431 . 0 0 "[ . 1 . 2 . 3]" 1
691 1 22 ILE MD 1 67 PHE QE . . 9.600 3.115 2.582 3.388 . 0 0 "[ . 1 . 2 . 3]" 1
692 1 22 ILE MD 1 67 PHE HZ . . 7.600 3.732 3.052 4.356 . 0 0 "[ . 1 . 2 . 3]" 1
693 1 22 ILE MD 1 68 GLU H . . 7.600 5.743 5.371 6.301 . 0 0 "[ . 1 . 2 . 3]" 1
694 1 22 ILE QG 1 23 GLU HA . . 7.480 5.708 5.522 5.987 . 0 0 "[ . 1 . 2 . 3]" 1
695 1 22 ILE QG 1 23 GLU QG . . 8.480 6.318 5.077 6.796 . 0 0 "[ . 1 . 2 . 3]" 1
696 1 22 ILE QG 1 24 SER H . . 6.780 5.812 5.616 6.036 . 0 0 "[ . 1 . 2 . 3]" 1
697 1 22 ILE QG 1 25 SER H . . 7.480 5.536 5.289 5.874 . 0 0 "[ . 1 . 2 . 3]" 1
698 1 22 ILE QG 1 25 SER QB . . 7.420 4.487 4.123 4.946 . 0 0 "[ . 1 . 2 . 3]" 1
699 1 22 ILE QG 1 26 LEU H . . 7.480 5.868 5.632 6.099 . 0 0 "[ . 1 . 2 . 3]" 1
700 1 22 ILE QG 1 37 VAL H . . 7.480 6.795 6.725 6.911 . 0 0 "[ . 1 . 2 . 3]" 1
701 1 22 ILE QG 1 37 VAL HB . . 7.480 5.008 4.711 5.247 . 0 0 "[ . 1 . 2 . 3]" 1
702 1 22 ILE QG 1 62 ILE H . . 7.480 6.645 6.411 6.726 . 0 0 "[ . 1 . 2 . 3]" 1
703 1 22 ILE QG 1 62 ILE HA . . 7.080 4.355 4.024 4.518 . 0 0 "[ . 1 . 2 . 3]" 1
704 1 22 ILE QG 1 65 LEU QD . . 10.050 2.948 2.192 4.188 . 0 0 "[ . 1 . 2 . 3]" 1
705 1 22 ILE QG 1 67 PHE QE . . 9.480 2.391 2.029 2.792 . 0 0 "[ . 1 . 2 . 3]" 1
706 1 22 ILE HG12 1 23 GLU H . . 5.400 4.828 4.618 5.060 . 0 0 "[ . 1 . 2 . 3]" 1
707 1 22 ILE HG12 1 25 SER HB2 . . 8.350 6.088 5.380 6.612 . 0 0 "[ . 1 . 2 . 3]" 1
708 1 22 ILE HG12 1 25 SER HB3 . . 8.350 5.142 4.554 5.619 . 0 0 "[ . 1 . 2 . 3]" 1
709 1 22 ILE HG12 1 67 PHE QD . . 8.600 2.960 2.317 3.551 . 0 0 "[ . 1 . 2 . 3]" 1
710 1 22 ILE HG13 1 23 GLU H . . 5.400 4.122 3.805 4.463 . 0 0 "[ . 1 . 2 . 3]" 1
711 1 22 ILE HG13 1 25 SER HB2 . . 8.350 6.264 5.392 7.189 . 0 0 "[ . 1 . 2 . 3]" 1
712 1 22 ILE HG13 1 25 SER HB3 . . 8.350 5.677 5.121 6.408 . 0 0 "[ . 1 . 2 . 3]" 1
713 1 22 ILE HG13 1 67 PHE QD . . 8.600 3.987 3.372 4.444 . 0 0 "[ . 1 . 2 . 3]" 1
714 1 22 ILE MG 1 23 GLU H . . 7.600 3.158 2.792 3.440 . 0 0 "[ . 1 . 2 . 3]" 1
715 1 22 ILE MG 1 25 SER QB . . 8.480 4.044 3.508 4.512 . 0 0 "[ . 1 . 2 . 3]" 1
716 1 22 ILE MG 1 37 VAL QG . . 10.160 2.055 1.878 2.377 . 0 0 "[ . 1 . 2 . 3]" 1
717 1 22 ILE MG 1 44 ALA MB . . 8.600 2.642 2.220 2.959 . 0 0 "[ . 1 . 2 . 3]" 1
718 1 22 ILE MG 1 62 ILE HA . . 7.600 4.262 3.697 5.019 . 0 0 "[ . 1 . 2 . 3]" 1
719 1 22 ILE MG 1 62 ILE MG . . 8.600 3.057 2.331 3.694 . 0 0 "[ . 1 . 2 . 3]" 1
720 1 22 ILE MG 1 65 LEU QD . . 10.170 3.329 2.729 4.555 . 0 0 "[ . 1 . 2 . 3]" 1
721 1 22 ILE MG 1 67 PHE QB . . 8.480 4.869 4.347 5.289 . 0 0 "[ . 1 . 2 . 3]" 1
722 1 22 ILE MG 1 67 PHE QD . . 9.600 4.251 3.868 4.876 . 0 0 "[ . 1 . 2 . 3]" 1
723 1 22 ILE MG 1 67 PHE QE . . 9.600 4.432 4.158 4.832 . 0 0 "[ . 1 . 2 . 3]" 1
724 1 22 ILE MG 1 67 PHE HZ . . 7.600 5.899 5.267 6.359 . 0 0 "[ . 1 . 2 . 3]" 1
725 1 23 GLU H 1 23 GLU QB . . 3.810 2.054 1.991 2.351 . 0 0 "[ . 1 . 2 . 3]" 1
726 1 23 GLU H 1 26 LEU H . . 6.600 4.744 4.623 4.866 . 0 0 "[ . 1 . 2 . 3]" 1
727 1 23 GLU H 1 27 THR MG . . 7.600 5.917 5.540 6.523 . 0 0 "[ . 1 . 2 . 3]" 1
728 1 23 GLU H 1 35 CYS HB2 . . 6.600 5.815 5.071 6.650 0.050 11 0 "[ . 1 . 2 . 3]" 1
729 1 23 GLU H 1 35 CYS HB3 . . 6.600 5.513 4.706 6.633 0.033 30 0 "[ . 1 . 2 . 3]" 1
730 1 23 GLU H 1 37 VAL MG1 . . 7.600 3.093 2.187 3.834 . 0 0 "[ . 1 . 2 . 3]" 1
731 1 23 GLU H 1 37 VAL MG2 . . 7.600 3.375 2.224 4.775 . 0 0 "[ . 1 . 2 . 3]" 1
732 1 23 GLU HA 1 26 LEU MD1 . . 7.600 4.600 2.642 5.870 . 0 0 "[ . 1 . 2 . 3]" 1
733 1 23 GLU HA 1 26 LEU MD2 . . 7.600 4.585 2.890 5.717 . 0 0 "[ . 1 . 2 . 3]" 1
734 1 23 GLU HA 1 26 LEU HG . . 6.600 4.904 4.028 6.056 . 0 0 "[ . 1 . 2 . 3]" 1
735 1 23 GLU HA 1 27 THR H . . 6.600 4.081 3.783 4.482 . 0 0 "[ . 1 . 2 . 3]" 1
736 1 23 GLU HA 1 27 THR MG . . 7.600 3.783 3.274 4.350 . 0 0 "[ . 1 . 2 . 3]" 1
737 1 23 GLU HA 1 35 CYS HB2 . . 6.600 3.286 2.565 4.117 . 0 0 "[ . 1 . 2 . 3]" 1
738 1 23 GLU HA 1 35 CYS QB . . 6.390 2.678 2.170 3.168 . 0 0 "[ . 1 . 2 . 3]" 1
739 1 23 GLU HA 1 35 CYS HB3 . . 6.600 3.066 2.216 4.245 . 0 0 "[ . 1 . 2 . 3]" 1
740 1 23 GLU HA 1 35 CYS HG . . 6.600 3.080 2.115 4.249 . 0 0 "[ . 1 . 2 . 3]" 1
741 1 23 GLU HA 1 37 VAL H . . 6.600 4.687 4.232 5.193 . 0 0 "[ . 1 . 2 . 3]" 1
742 1 23 GLU QB 1 24 SER H . . 4.420 2.361 2.019 2.642 . 0 0 "[ . 1 . 2 . 3]" 1
743 1 23 GLU QB 1 24 SER HA . . 7.480 3.808 3.593 4.011 . 0 0 "[ . 1 . 2 . 3]" 1
744 1 23 GLU QB 1 35 CYS QB . . 7.950 4.040 3.541 4.764 . 0 0 "[ . 1 . 2 . 3]" 1
745 1 23 GLU QB 1 35 CYS HG . . 6.280 4.925 3.722 5.661 . 0 0 "[ . 1 . 2 . 3]" 1
746 1 23 GLU QB 1 37 VAL H . . 7.480 3.937 3.420 4.764 . 0 0 "[ . 1 . 2 . 3]" 1
747 1 23 GLU QB 1 37 VAL QG . . 10.040 2.774 2.302 3.769 . 0 0 "[ . 1 . 2 . 3]" 1
748 1 23 GLU HB2 1 24 SER H . . 4.600 3.190 2.061 3.529 . 0 0 "[ . 1 . 2 . 3]" 1
749 1 23 GLU HB2 1 27 THR MG . . 7.600 5.340 4.934 5.826 . 0 0 "[ . 1 . 2 . 3]" 1
750 1 23 GLU HB2 1 36 SER HA . . 6.600 5.005 4.441 6.648 0.048 23 0 "[ . 1 . 2 . 3]" 1
751 1 23 GLU HB3 1 24 SER H . . 4.600 2.492 2.129 3.071 . 0 0 "[ . 1 . 2 . 3]" 1
752 1 23 GLU HB3 1 27 THR MG . . 7.600 4.437 3.727 5.330 . 0 0 "[ . 1 . 2 . 3]" 1
753 1 23 GLU HB3 1 36 SER HA . . 6.600 5.666 4.846 6.609 0.009 13 0 "[ . 1 . 2 . 3]" 1
754 1 23 GLU QG 1 24 SER H . . 7.200 4.172 3.866 4.391 . 0 0 "[ . 1 . 2 . 3]" 1
755 1 23 GLU QG 1 27 THR MG . . 8.600 3.587 2.837 5.041 . 0 0 "[ . 1 . 2 . 3]" 1
756 1 23 GLU QG 1 35 CYS HG . . 7.600 3.898 2.897 5.870 . 0 0 "[ . 1 . 2 . 3]" 1
757 1 23 GLU QG 1 36 SER H . . 7.600 4.177 3.582 5.289 . 0 0 "[ . 1 . 2 . 3]" 1
758 1 23 GLU QG 1 36 SER HA . . 7.600 3.023 2.338 4.258 . 0 0 "[ . 1 . 2 . 3]" 1
759 1 23 GLU QG 1 37 VAL H . . 7.600 3.057 2.556 4.336 . 0 0 "[ . 1 . 2 . 3]" 1
760 1 24 SER H 1 25 SER H . . 4.400 2.664 2.545 2.812 . 0 0 "[ . 1 . 2 . 3]" 1
761 1 24 SER H 1 26 LEU H . . 5.800 4.079 3.904 4.373 . 0 0 "[ . 1 . 2 . 3]" 1
762 1 24 SER H 1 27 THR H . . 6.600 4.775 4.629 5.102 . 0 0 "[ . 1 . 2 . 3]" 1
763 1 24 SER HA 1 26 LEU QB . . 7.480 5.243 4.999 5.612 . 0 0 "[ . 1 . 2 . 3]" 1
764 1 24 SER HA 1 27 THR MG . . 7.600 3.732 3.114 4.500 . 0 0 "[ . 1 . 2 . 3]" 1
765 1 24 SER HB2 1 25 SER H . . 6.600 3.594 2.434 4.421 . 0 0 "[ . 1 . 2 . 3]" 1
766 1 24 SER HB3 1 25 SER H . . 6.600 2.963 2.373 4.280 . 0 0 "[ . 1 . 2 . 3]" 1
767 1 25 SER H 1 26 LEU H . . 4.200 2.638 2.125 2.768 . 0 0 "[ . 1 . 2 . 3]" 1
768 1 25 SER H 1 26 LEU HA . . 6.600 5.271 4.844 5.418 . 0 0 "[ . 1 . 2 . 3]" 1
769 1 25 SER H 1 26 LEU HB2 . . 6.600 4.669 4.163 4.872 . 0 0 "[ . 1 . 2 . 3]" 1
770 1 25 SER H 1 26 LEU QB . . 6.010 4.531 4.058 4.720 . 0 0 "[ . 1 . 2 . 3]" 1
771 1 25 SER H 1 26 LEU HB3 . . 6.600 6.121 5.610 6.318 . 0 0 "[ . 1 . 2 . 3]" 1
772 1 25 SER H 1 26 LEU QD . . 9.170 4.453 3.528 5.252 . 0 0 "[ . 1 . 2 . 3]" 1
773 1 25 SER H 1 26 LEU HG . . 6.600 5.948 4.816 6.658 0.058 22 0 "[ . 1 . 2 . 3]" 1
774 1 25 SER H 1 27 THR H . . 6.600 4.304 3.641 4.675 . 0 0 "[ . 1 . 2 . 3]" 1
775 1 25 SER H 1 65 LEU MD1 . . 7.600 4.688 4.012 5.829 . 0 0 "[ . 1 . 2 . 3]" 1
776 1 25 SER H 1 65 LEU MD2 . . 7.600 4.906 3.810 5.797 . 0 0 "[ . 1 . 2 . 3]" 1
777 1 25 SER HA 1 28 LYS QE . . 7.600 3.941 2.406 6.015 . 0 0 "[ . 1 . 2 . 3]" 1
778 1 25 SER HA 1 29 HIS HD2 . . 6.600 5.066 4.572 5.404 . 0 0 "[ . 1 . 2 . 3]" 1
779 1 25 SER QB 1 26 LEU QB . . 8.350 4.400 4.160 4.735 . 0 0 "[ . 1 . 2 . 3]" 1
780 1 25 SER QB 1 26 LEU QD . . 8.330 3.377 2.553 4.429 . 0 0 "[ . 1 . 2 . 3]" 1
781 1 25 SER QB 1 61 THR MG . . 8.480 3.944 3.460 4.444 . 0 0 "[ . 1 . 2 . 3]" 1
782 1 25 SER QB 1 65 LEU QB . . 7.420 4.518 4.042 5.065 . 0 0 "[ . 1 . 2 . 3]" 1
783 1 25 SER HB2 1 26 LEU H . . 4.000 3.978 3.671 4.078 0.078 11 0 "[ . 1 . 2 . 3]" 1
784 1 25 SER HB2 1 26 LEU MD1 . . 9.350 6.069 4.214 6.756 . 0 0 "[ . 1 . 2 . 3]" 1
785 1 25 SER HB2 1 26 LEU MD2 . . 9.350 5.379 4.057 7.007 . 0 0 "[ . 1 . 2 . 3]" 1
786 1 25 SER HB2 1 29 HIS HD2 . . 6.600 6.562 6.029 6.667 0.067 15 0 "[ . 1 . 2 . 3]" 1
787 1 25 SER HB2 1 65 LEU HB2 . . 8.350 6.211 5.285 6.786 . 0 0 "[ . 1 . 2 . 3]" 1
788 1 25 SER HB2 1 65 LEU HB3 . . 8.350 5.861 5.222 6.855 . 0 0 "[ . 1 . 2 . 3]" 1
789 1 25 SER HB2 1 65 LEU MD1 . . 7.600 3.155 2.455 4.306 . 0 0 "[ . 1 . 2 . 3]" 1
790 1 25 SER HB2 1 65 LEU MD2 . . 7.600 3.200 2.640 3.991 . 0 0 "[ . 1 . 2 . 3]" 1
791 1 25 SER HB3 1 26 LEU H . . 4.000 2.891 2.571 3.283 . 0 0 "[ . 1 . 2 . 3]" 1
792 1 25 SER HB3 1 26 LEU MD1 . . 9.350 4.668 2.707 5.401 . 0 0 "[ . 1 . 2 . 3]" 1
793 1 25 SER HB3 1 26 LEU MD2 . . 9.350 3.968 2.589 5.642 . 0 0 "[ . 1 . 2 . 3]" 1
794 1 25 SER HB3 1 29 HIS HD2 . . 6.600 5.604 5.150 5.879 . 0 0 "[ . 1 . 2 . 3]" 1
795 1 25 SER HB3 1 65 LEU HB2 . . 8.350 5.560 4.558 6.099 . 0 0 "[ . 1 . 2 . 3]" 1
796 1 25 SER HB3 1 65 LEU HB3 . . 8.350 5.520 4.786 6.509 . 0 0 "[ . 1 . 2 . 3]" 1
797 1 25 SER HB3 1 65 LEU MD1 . . 7.600 2.867 2.153 4.603 . 0 0 "[ . 1 . 2 . 3]" 1
798 1 25 SER HB3 1 65 LEU MD2 . . 7.600 3.159 2.072 4.579 . 0 0 "[ . 1 . 2 . 3]" 1
799 1 26 LEU H 1 26 LEU MD1 . . 5.600 3.750 2.602 4.258 . 0 0 "[ . 1 . 2 . 3]" 1
800 1 26 LEU H 1 26 LEU MD2 . . 5.600 3.297 2.225 4.380 . 0 0 "[ . 1 . 2 . 3]" 1
801 1 26 LEU H 1 26 LEU HG . . 4.800 3.662 2.628 4.311 . 0 0 "[ . 1 . 2 . 3]" 1
802 1 26 LEU H 1 27 THR H . . 3.400 2.651 2.448 2.946 . 0 0 "[ . 1 . 2 . 3]" 1
803 1 26 LEU H 1 28 LYS H . . 6.600 4.870 3.794 5.837 . 0 0 "[ . 1 . 2 . 3]" 1
804 1 26 LEU H 1 29 HIS H . . 5.700 5.571 4.839 5.785 0.085 30 0 "[ . 1 . 2 . 3]" 1
805 1 26 LEU H 1 29 HIS HD2 . . 6.600 4.773 4.489 5.018 . 0 0 "[ . 1 . 2 . 3]" 1
806 1 26 LEU HA 1 26 LEU MD1 . . 4.300 2.783 2.021 3.706 . 0 0 "[ . 1 . 2 . 3]" 1
807 1 26 LEU HA 1 26 LEU QD . . 3.690 2.074 1.911 2.745 . 0 0 "[ . 1 . 2 . 3]" 1
808 1 26 LEU HA 1 26 LEU MD2 . . 4.300 2.409 2.036 3.608 . 0 0 "[ . 1 . 2 . 3]" 1
809 1 26 LEU HA 1 27 THR MG . . 7.600 5.109 4.818 5.377 . 0 0 "[ . 1 . 2 . 3]" 1
810 1 26 LEU HA 1 28 LYS H . . 6.600 4.102 3.533 4.385 . 0 0 "[ . 1 . 2 . 3]" 1
811 1 26 LEU HA 1 28 LYS QB . . 6.580 5.080 3.535 5.905 . 0 0 "[ . 1 . 2 . 3]" 1
812 1 26 LEU HA 1 29 HIS H . . 5.100 3.565 3.126 3.889 . 0 0 "[ . 1 . 2 . 3]" 1
813 1 26 LEU HA 1 29 HIS HB2 . . 6.600 4.096 2.825 5.766 . 0 0 "[ . 1 . 2 . 3]" 1
814 1 26 LEU HA 1 29 HIS HB3 . . 6.600 5.127 4.341 5.694 . 0 0 "[ . 1 . 2 . 3]" 1
815 1 26 LEU HA 1 29 HIS HD2 . . 6.600 2.316 2.120 3.005 . 0 0 "[ . 1 . 2 . 3]" 1
816 1 26 LEU HA 1 32 ILE QG . . 7.480 4.012 3.439 4.605 . 0 0 "[ . 1 . 2 . 3]" 1
817 1 26 LEU HA 1 32 ILE MG . . 7.600 4.195 3.089 5.413 . 0 0 "[ . 1 . 2 . 3]" 1
818 1 26 LEU HA 1 62 ILE QG . . 7.600 5.674 4.893 6.763 . 0 0 "[ . 1 . 2 . 3]" 1
819 1 26 LEU QB 1 27 THR H . . 4.180 2.702 2.322 2.970 . 0 0 "[ . 1 . 2 . 3]" 1
820 1 26 LEU QB 1 27 THR HA . . 7.480 3.844 3.555 4.018 . 0 0 "[ . 1 . 2 . 3]" 1
821 1 26 LEU QB 1 32 ILE H . . 7.480 6.217 5.563 6.740 . 0 0 "[ . 1 . 2 . 3]" 1
822 1 26 LEU HB2 1 29 HIS HD2 . . 6.600 5.236 5.010 5.799 . 0 0 "[ . 1 . 2 . 3]" 1
823 1 26 LEU HB3 1 29 HIS HD2 . . 6.600 4.610 4.324 5.233 . 0 0 "[ . 1 . 2 . 3]" 1
824 1 26 LEU QD 1 28 LYS QG . . 7.740 4.783 4.066 5.157 . 0 0 "[ . 1 . 2 . 3]" 1
825 1 26 LEU QD 1 29 HIS H . . 8.570 4.269 3.610 5.302 . 0 0 "[ . 1 . 2 . 3]" 1
826 1 26 LEU QD 1 29 HIS QB . . 8.930 3.453 2.410 5.220 . 0 0 "[ . 1 . 2 . 3]" 1
827 1 26 LEU QD 1 29 HIS HD2 . . 9.170 3.087 2.587 3.903 . 0 0 "[ . 1 . 2 . 3]" 1
828 1 26 LEU QD 1 29 HIS HE1 . . 9.170 4.283 2.902 5.281 . 0 0 "[ . 1 . 2 . 3]" 1
829 1 26 LEU QD 1 32 ILE HB . . 9.170 3.944 3.220 4.921 . 0 0 "[ . 1 . 2 . 3]" 1
830 1 26 LEU QD 1 32 ILE QG . . 7.790 2.703 1.987 3.324 . 0 0 "[ . 1 . 2 . 3]" 1
831 1 26 LEU QD 1 35 CYS H . . 9.170 5.864 4.836 6.814 . 0 0 "[ . 1 . 2 . 3]" 1
832 1 26 LEU QD 1 61 THR H . . 9.170 5.134 4.259 5.936 . 0 0 "[ . 1 . 2 . 3]" 1
833 1 26 LEU QD 1 61 THR HB . . 7.230 3.488 2.482 4.358 . 0 0 "[ . 1 . 2 . 3]" 1
834 1 26 LEU QD 1 62 ILE HA . . 9.170 4.263 3.008 5.000 . 0 0 "[ . 1 . 2 . 3]" 1
835 1 26 LEU MD1 1 27 THR H . . 7.600 4.684 4.187 4.903 . 0 0 "[ . 1 . 2 . 3]" 1
836 1 26 LEU MD1 1 28 LYS HG2 . . 9.350 6.865 4.950 7.779 . 0 0 "[ . 1 . 2 . 3]" 1
837 1 26 LEU MD1 1 28 LYS HG3 . . 9.350 6.189 4.832 6.683 . 0 0 "[ . 1 . 2 . 3]" 1
838 1 26 LEU MD1 1 29 HIS HB2 . . 10.740 4.815 2.953 8.117 . 0 0 "[ . 1 . 2 . 3]" 1
839 1 26 LEU MD1 1 29 HIS HB3 . . 10.740 5.539 3.810 7.676 . 0 0 "[ . 1 . 2 . 3]" 1
840 1 26 LEU MD1 1 32 ILE HG12 . . 9.350 3.922 2.646 5.981 . 0 0 "[ . 1 . 2 . 3]" 1
841 1 26 LEU MD1 1 32 ILE HG13 . . 9.350 3.602 2.150 4.989 . 0 0 "[ . 1 . 2 . 3]" 1
842 1 26 LEU MD1 1 61 THR HB . . 7.600 4.264 2.650 5.609 . 0 0 "[ . 1 . 2 . 3]" 1
843 1 26 LEU MD2 1 27 THR H . . 7.600 4.537 4.065 4.876 . 0 0 "[ . 1 . 2 . 3]" 1
844 1 26 LEU MD2 1 28 LYS HG2 . . 9.350 6.391 5.141 7.410 . 0 0 "[ . 1 . 2 . 3]" 1
845 1 26 LEU MD2 1 28 LYS HG3 . . 9.350 5.669 4.660 6.951 . 0 0 "[ . 1 . 2 . 3]" 1
846 1 26 LEU MD2 1 29 HIS HB2 . . 10.740 4.825 2.471 7.393 . 0 0 "[ . 1 . 2 . 3]" 1
847 1 26 LEU MD2 1 29 HIS HB3 . . 10.740 5.581 3.406 7.007 . 0 0 "[ . 1 . 2 . 3]" 1
848 1 26 LEU MD2 1 32 ILE HG12 . . 9.350 4.631 2.446 6.940 . 0 0 "[ . 1 . 2 . 3]" 1
849 1 26 LEU MD2 1 32 ILE HG13 . . 9.350 4.239 2.136 6.070 . 0 0 "[ . 1 . 2 . 3]" 1
850 1 26 LEU MD2 1 61 THR HB . . 7.600 3.959 2.993 5.306 . 0 0 "[ . 1 . 2 . 3]" 1
851 1 26 LEU HG 1 27 THR H . . 6.600 4.982 4.487 5.375 . 0 0 "[ . 1 . 2 . 3]" 1
852 1 26 LEU HG 1 27 THR HA . . 6.500 6.411 5.886 6.581 0.081 18 0 "[ . 1 . 2 . 3]" 1
853 1 26 LEU HG 1 29 HIS H . . 6.600 6.286 5.509 6.709 0.109 20 0 "[ . 1 . 2 . 3]" 1
854 1 26 LEU HG 1 29 HIS HD2 . . 6.600 4.993 3.381 6.071 . 0 0 "[ . 1 . 2 . 3]" 1
855 1 26 LEU HG 1 32 ILE HB . . 6.600 6.250 4.700 6.696 0.096 15 0 "[ . 1 . 2 . 3]" 1
856 1 26 LEU HG 1 32 ILE MD . . 7.600 4.949 3.332 6.124 . 0 0 "[ . 1 . 2 . 3]" 1
857 1 26 LEU HG 1 35 CYS HB2 . . 6.600 4.941 2.803 6.604 0.004 17 0 "[ . 1 . 2 . 3]" 1
858 1 26 LEU HG 1 35 CYS HB3 . . 6.600 5.008 2.709 6.537 . 0 0 "[ . 1 . 2 . 3]" 1
859 1 26 LEU HG 1 62 ILE QG . . 7.600 4.044 3.020 5.271 . 0 0 "[ . 1 . 2 . 3]" 1
860 1 27 THR H 1 27 THR MG . . 4.700 2.363 2.143 2.717 . 0 0 "[ . 1 . 2 . 3]" 1
861 1 27 THR H 1 28 LYS H . . 4.200 3.386 2.674 3.972 . 0 0 "[ . 1 . 2 . 3]" 1
862 1 27 THR H 1 29 HIS H . . 6.600 4.661 4.072 4.964 . 0 0 "[ . 1 . 2 . 3]" 1
863 1 27 THR H 1 35 CYS QB . . 7.480 4.143 3.531 4.935 . 0 0 "[ . 1 . 2 . 3]" 1
864 1 27 THR HA 1 29 HIS H . . 5.600 3.906 3.630 4.203 . 0 0 "[ . 1 . 2 . 3]" 1
865 1 27 THR HA 1 32 ILE H . . 6.600 5.635 4.387 6.431 . 0 0 "[ . 1 . 2 . 3]" 1
866 1 27 THR HA 1 32 ILE HB . . 5.800 4.626 2.725 5.849 0.049 16 0 "[ . 1 . 2 . 3]" 1
867 1 27 THR HA 1 32 ILE MD . . 6.200 3.487 2.104 4.587 . 0 0 "[ . 1 . 2 . 3]" 1
868 1 27 THR HA 1 32 ILE HG12 . . 6.600 4.864 3.047 5.854 . 0 0 "[ . 1 . 2 . 3]" 1
869 1 27 THR HA 1 32 ILE HG13 . . 6.600 3.738 2.247 4.865 . 0 0 "[ . 1 . 2 . 3]" 1
870 1 27 THR HA 1 35 CYS HB2 . . 6.600 5.306 4.443 6.641 0.041 30 0 "[ . 1 . 2 . 3]" 1
871 1 27 THR HA 1 35 CYS HB3 . . 6.600 5.790 4.570 6.628 0.028 9 0 "[ . 1 . 2 . 3]" 1
872 1 27 THR HB 1 28 LYS H . . 6.300 4.043 3.490 4.300 . 0 0 "[ . 1 . 2 . 3]" 1
873 1 27 THR HB 1 28 LYS QG . . 7.480 5.552 4.644 6.760 . 0 0 "[ . 1 . 2 . 3]" 1
874 1 27 THR HB 1 32 ILE MD . . 7.600 5.181 3.848 6.353 . 0 0 "[ . 1 . 2 . 3]" 1
875 1 27 THR MG 1 28 LYS H . . 7.600 4.234 4.096 4.442 . 0 0 "[ . 1 . 2 . 3]" 1
876 1 27 THR MG 1 29 HIS H . . 7.600 5.430 5.155 5.669 . 0 0 "[ . 1 . 2 . 3]" 1
877 1 27 THR MG 1 32 ILE MD . . 8.600 3.328 2.092 4.881 . 0 0 "[ . 1 . 2 . 3]" 1
878 1 27 THR MG 1 34 TYR H . . 7.600 5.011 3.540 5.711 . 0 0 "[ . 1 . 2 . 3]" 1
879 1 27 THR MG 1 34 TYR HA . . 7.600 3.395 2.253 4.083 . 0 0 "[ . 1 . 2 . 3]" 1
880 1 27 THR MG 1 34 TYR QD . . 9.600 4.358 2.870 5.261 . 0 0 "[ . 1 . 2 . 3]" 1
881 1 27 THR MG 1 35 CYS H . . 7.600 3.202 2.141 3.888 . 0 0 "[ . 1 . 2 . 3]" 1
882 1 27 THR MG 1 35 CYS HA . . 7.600 4.818 4.117 5.402 . 0 0 "[ . 1 . 2 . 3]" 1
883 1 27 THR MG 1 35 CYS HB2 . . 7.600 3.244 2.212 4.557 . 0 0 "[ . 1 . 2 . 3]" 1
884 1 27 THR MG 1 35 CYS HB3 . . 7.600 3.564 2.327 4.730 . 0 0 "[ . 1 . 2 . 3]" 1
885 1 27 THR MG 1 35 CYS HG . . 7.600 3.643 2.119 5.732 . 0 0 "[ . 1 . 2 . 3]" 1
886 1 27 THR MG 1 36 SER H . . 7.600 5.956 5.228 6.235 . 0 0 "[ . 1 . 2 . 3]" 1
887 1 28 LYS H 1 28 LYS HG2 . . 5.600 3.814 2.141 4.459 . 0 0 "[ . 1 . 2 . 3]" 1
888 1 28 LYS H 1 28 LYS HG3 . . 5.600 3.062 2.113 4.391 . 0 0 "[ . 1 . 2 . 3]" 1
889 1 28 LYS H 1 29 HIS H . . 3.200 2.359 1.898 3.203 0.003 29 0 "[ . 1 . 2 . 3]" 1
890 1 28 LYS H 1 29 HIS HD2 . . 6.600 3.969 2.996 5.584 . 0 0 "[ . 1 . 2 . 3]" 1
891 1 28 LYS HA 1 29 HIS QB . . 6.880 5.400 5.182 5.598 . 0 0 "[ . 1 . 2 . 3]" 1
892 1 28 LYS HA 1 29 HIS HD2 . . 6.600 5.556 4.677 6.649 0.049 29 0 "[ . 1 . 2 . 3]" 1
893 1 28 LYS QB 1 29 HIS H . . 4.640 3.399 2.571 4.058 . 0 0 "[ . 1 . 2 . 3]" 1
894 1 28 LYS QB 1 29 HIS HA . . 7.480 4.407 3.601 4.867 . 0 0 "[ . 1 . 2 . 3]" 1
895 1 28 LYS QB 1 32 ILE QG . . 8.350 6.604 6.223 6.725 . 0 0 "[ . 1 . 2 . 3]" 1
896 1 28 LYS HB2 1 29 HIS H . . 5.200 3.906 2.815 4.525 . 0 0 "[ . 1 . 2 . 3]" 1
897 1 28 LYS HB2 1 29 HIS HD2 . . 6.600 4.870 2.396 6.333 . 0 0 "[ . 1 . 2 . 3]" 1
898 1 28 LYS HB3 1 29 HIS H . . 5.200 3.955 2.602 4.586 . 0 0 "[ . 1 . 2 . 3]" 1
899 1 28 LYS HB3 1 29 HIS HD2 . . 6.600 4.914 2.783 6.510 . 0 0 "[ . 1 . 2 . 3]" 1
900 1 28 LYS QD 1 29 HIS H . . 7.600 3.970 2.322 5.561 . 0 0 "[ . 1 . 2 . 3]" 1
901 1 28 LYS QE 1 29 HIS HD2 . . 7.600 4.082 2.528 6.016 . 0 0 "[ . 1 . 2 . 3]" 1
902 1 28 LYS QE 1 61 THR MG . . 8.600 4.804 3.386 6.204 . 0 0 "[ . 1 . 2 . 3]" 1
903 1 28 LYS QG 1 29 HIS HD2 . . 7.480 3.136 2.131 4.632 . 0 0 "[ . 1 . 2 . 3]" 1
904 1 28 LYS HG2 1 29 HIS H . . 6.600 4.224 2.416 5.185 . 0 0 "[ . 1 . 2 . 3]" 1
905 1 28 LYS HG3 1 29 HIS H . . 6.600 3.042 2.136 4.896 . 0 0 "[ . 1 . 2 . 3]" 1
906 1 29 HIS H 1 29 HIS HD2 . . 5.700 2.492 2.060 3.429 . 0 0 "[ . 1 . 2 . 3]" 1
907 1 29 HIS H 1 32 ILE HB . . 6.400 4.689 3.392 6.412 0.012 3 0 "[ . 1 . 2 . 3]" 1
908 1 29 HIS H 1 32 ILE MD . . 7.600 5.146 2.388 6.346 . 0 0 "[ . 1 . 2 . 3]" 1
909 1 29 HIS H 1 32 ILE QG . . 7.480 4.528 3.535 5.017 . 0 0 "[ . 1 . 2 . 3]" 1
910 1 29 HIS H 1 32 ILE MG . . 7.600 3.438 2.586 4.906 . 0 0 "[ . 1 . 2 . 3]" 1
911 1 29 HIS HA 1 29 HIS HE1 . . 6.600 5.345 4.707 6.435 . 0 0 "[ . 1 . 2 . 3]" 1
912 1 29 HIS HA 1 30 ARG QB . . 7.600 4.239 3.794 4.598 . 0 0 "[ . 1 . 2 . 3]" 1
913 1 29 HIS HA 1 32 ILE H . . 6.600 5.463 4.717 6.620 0.020 7 0 "[ . 1 . 2 . 3]" 1
914 1 29 HIS QB 1 32 ILE QG . . 6.760 3.928 2.480 5.415 . 0 0 "[ . 1 . 2 . 3]" 1
915 1 29 HIS QB 1 53 ILE MD . . 8.480 2.244 1.942 3.630 . 0 0 "[ . 1 . 2 . 3]" 1
916 1 29 HIS QB 1 53 ILE QG . . 8.350 3.993 3.136 5.614 . 0 0 "[ . 1 . 2 . 3]" 1
917 1 29 HIS QB 1 61 THR MG . . 8.480 5.127 4.340 5.634 . 0 0 "[ . 1 . 2 . 3]" 1
918 1 29 HIS HB2 1 30 ARG H . . 6.600 3.751 2.062 4.618 . 0 0 "[ . 1 . 2 . 3]" 1
919 1 29 HIS HB2 1 32 ILE H . . 6.600 4.135 2.945 5.841 . 0 0 "[ . 1 . 2 . 3]" 1
920 1 29 HIS HB2 1 32 ILE HB . . 6.600 3.779 2.144 5.329 . 0 0 "[ . 1 . 2 . 3]" 1
921 1 29 HIS HB2 1 32 ILE HG12 . . 7.950 4.982 3.493 7.420 . 0 0 "[ . 1 . 2 . 3]" 1
922 1 29 HIS HB2 1 32 ILE HG13 . . 7.950 4.507 2.568 6.811 . 0 0 "[ . 1 . 2 . 3]" 1
923 1 29 HIS HB3 1 30 ARG H . . 6.600 3.589 1.978 4.422 . 0 0 "[ . 1 . 2 . 3]" 1
924 1 29 HIS HB3 1 32 ILE H . . 6.600 4.486 3.203 6.629 0.029 29 0 "[ . 1 . 2 . 3]" 1
925 1 29 HIS HB3 1 32 ILE HB . . 6.600 4.647 2.919 6.268 . 0 0 "[ . 1 . 2 . 3]" 1
926 1 29 HIS HB3 1 32 ILE HG12 . . 7.950 5.999 4.494 7.720 . 0 0 "[ . 1 . 2 . 3]" 1
927 1 29 HIS HB3 1 32 ILE HG13 . . 7.950 5.687 4.022 7.115 . 0 0 "[ . 1 . 2 . 3]" 1
928 1 29 HIS HD2 1 32 ILE HG12 . . 6.600 6.203 5.031 6.687 0.087 2 0 "[ . 1 . 2 . 3]" 1
929 1 29 HIS HD2 1 32 ILE HG13 . . 6.600 5.378 4.370 6.643 0.043 5 0 "[ . 1 . 2 . 3]" 1
930 1 29 HIS HD2 1 32 ILE MG . . 7.600 4.593 3.249 6.002 . 0 0 "[ . 1 . 2 . 3]" 1
931 1 29 HIS HD2 1 53 ILE MD . . 7.600 4.736 3.828 5.487 . 0 0 "[ . 1 . 2 . 3]" 1
932 1 29 HIS HD2 1 58 ILE MD . . 7.600 6.112 5.484 6.347 . 0 0 "[ . 1 . 2 . 3]" 1
933 1 29 HIS HD2 1 58 ILE MG . . 7.600 6.145 5.572 6.357 . 0 0 "[ . 1 . 2 . 3]" 1
934 1 29 HIS HD2 1 61 THR MG . . 7.600 3.843 2.792 4.666 . 0 0 "[ . 1 . 2 . 3]" 1
935 1 29 HIS HD2 1 62 ILE QG . . 7.600 6.725 6.133 6.841 . 0 0 "[ . 1 . 2 . 3]" 1
936 1 29 HIS HE1 1 57 ASP HB2 . . 6.600 5.582 4.932 6.610 0.010 6 0 "[ . 1 . 2 . 3]" 1
937 1 29 HIS HE1 1 57 ASP HB3 . . 6.600 5.282 4.212 6.615 0.015 29 0 "[ . 1 . 2 . 3]" 1
938 1 29 HIS HE1 1 58 ILE MD . . 7.600 5.711 2.817 6.386 . 0 0 "[ . 1 . 2 . 3]" 1
939 1 29 HIS HE1 1 58 ILE QG . . 7.480 4.467 2.405 5.271 . 0 0 "[ . 1 . 2 . 3]" 1
940 1 30 ARG HA 1 52 ILE MD . . 7.500 5.468 4.206 6.271 . 0 0 "[ . 1 . 2 . 3]" 1
941 1 30 ARG QB 1 31 GLY QA . . 8.480 3.961 3.436 4.491 . 0 0 "[ . 1 . 2 . 3]" 1
942 1 31 GLY QA 1 33 LEU QB . . 8.480 5.649 4.319 6.632 . 0 0 "[ . 1 . 2 . 3]" 1
943 1 31 GLY QA 1 49 ASP QB . . 7.020 3.293 2.420 4.474 . 0 0 "[ . 1 . 2 . 3]" 1
944 1 31 GLY QA 1 52 ILE MG . . 8.480 4.794 4.447 5.746 . 0 0 "[ . 1 . 2 . 3]" 1
945 1 31 GLY QA 1 53 ILE MG . . 8.480 2.520 2.128 4.403 . 0 0 "[ . 1 . 2 . 3]" 1
946 1 31 GLY HA2 1 49 ASP H . . 6.600 3.830 2.700 5.162 . 0 0 "[ . 1 . 2 . 3]" 1
947 1 31 GLY HA2 1 49 ASP HB2 . . 7.950 4.280 2.590 6.432 . 0 0 "[ . 1 . 2 . 3]" 1
948 1 31 GLY HA2 1 49 ASP HB3 . . 7.950 4.560 3.314 6.080 . 0 0 "[ . 1 . 2 . 3]" 1
949 1 31 GLY HA2 1 53 ILE MD . . 7.600 4.792 3.572 5.989 . 0 0 "[ . 1 . 2 . 3]" 1
950 1 32 ILE H 1 32 ILE HB . . 4.000 2.534 1.986 3.729 . 0 0 "[ . 1 . 2 . 3]" 1
951 1 32 ILE H 1 32 ILE MD . . 5.000 3.958 2.004 4.296 . 0 0 "[ . 1 . 2 . 3]" 1
952 1 32 ILE H 1 33 LEU H . . 6.600 4.417 3.952 4.644 . 0 0 "[ . 1 . 2 . 3]" 1
953 1 32 ILE H 1 33 LEU QD . . 9.170 5.289 4.134 6.467 . 0 0 "[ . 1 . 2 . 3]" 1
954 1 32 ILE H 1 46 ILE MG . . 7.600 5.167 4.360 6.330 . 0 0 "[ . 1 . 2 . 3]" 1
955 1 32 ILE H 1 48 TYR HA . . 6.600 4.548 3.513 5.143 . 0 0 "[ . 1 . 2 . 3]" 1
956 1 32 ILE H 1 53 ILE MD . . 7.600 3.694 2.659 5.828 . 0 0 "[ . 1 . 2 . 3]" 1
957 1 32 ILE HA 1 33 LEU H . . 3.200 2.189 2.040 2.356 . 0 0 "[ . 1 . 2 . 3]" 1
958 1 32 ILE HA 1 33 LEU HA . . 5.200 4.489 4.385 4.576 . 0 0 "[ . 1 . 2 . 3]" 1
959 1 32 ILE HA 1 33 LEU HG . . 6.600 4.839 3.654 6.608 0.008 27 0 "[ . 1 . 2 . 3]" 1
960 1 32 ILE HA 1 34 TYR H . . 6.000 3.855 3.420 4.241 . 0 0 "[ . 1 . 2 . 3]" 1
961 1 32 ILE HA 1 46 ILE QG . . 7.600 5.937 5.369 6.767 . 0 0 "[ . 1 . 2 . 3]" 1
962 1 32 ILE HA 1 46 ILE MG . . 6.900 3.443 3.017 3.976 . 0 0 "[ . 1 . 2 . 3]" 1
963 1 32 ILE HA 1 47 LYS H . . 5.900 4.883 4.210 5.412 . 0 0 "[ . 1 . 2 . 3]" 1
964 1 32 ILE HA 1 48 TYR HA . . 3.200 2.304 2.007 2.993 . 0 0 "[ . 1 . 2 . 3]" 1
965 1 32 ILE HA 1 48 TYR HB2 . . 6.600 2.722 2.311 3.337 . 0 0 "[ . 1 . 2 . 3]" 1
966 1 32 ILE HA 1 48 TYR QB . . 6.150 2.243 2.052 2.847 . 0 0 "[ . 1 . 2 . 3]" 1
967 1 32 ILE HA 1 48 TYR HB3 . . 6.600 2.412 2.127 3.137 . 0 0 "[ . 1 . 2 . 3]" 1
968 1 32 ILE HA 1 49 ASP H . . 4.500 3.892 3.169 4.557 0.057 5 0 "[ . 1 . 2 . 3]" 1
969 1 32 ILE HA 1 53 ILE MD . . 7.600 4.930 3.926 5.800 . 0 0 "[ . 1 . 2 . 3]" 1
970 1 32 ILE HA 1 58 ILE MD . . 7.600 4.374 3.613 5.038 . 0 0 "[ . 1 . 2 . 3]" 1
971 1 32 ILE HB 1 33 LEU H . . 4.400 4.226 2.617 4.477 0.077 26 0 "[ . 1 . 2 . 3]" 1
972 1 32 ILE HB 1 46 ILE MG . . 7.600 3.597 2.018 5.045 . 0 0 "[ . 1 . 2 . 3]" 1
973 1 32 ILE HB 1 58 ILE MD . . 7.600 4.114 2.153 5.614 . 0 0 "[ . 1 . 2 . 3]" 1
974 1 32 ILE MD 1 33 LEU H . . 7.200 2.684 1.856 4.449 . 0 0 "[ . 1 . 2 . 3]" 1
975 1 32 ILE MD 1 33 LEU HA . . 7.600 4.165 3.188 6.005 . 0 0 "[ . 1 . 2 . 3]" 1
976 1 32 ILE MD 1 34 TYR H . . 7.300 2.575 1.942 4.801 . 0 0 "[ . 1 . 2 . 3]" 1
977 1 32 ILE MD 1 34 TYR QD . . 9.600 5.012 4.405 7.159 . 0 0 "[ . 1 . 2 . 3]" 1
978 1 32 ILE MD 1 35 CYS H . . 7.600 3.840 2.852 6.349 . 0 0 "[ . 1 . 2 . 3]" 1
979 1 32 ILE MD 1 35 CYS HB2 . . 7.100 3.634 2.100 5.937 . 0 0 "[ . 1 . 2 . 3]" 1
980 1 32 ILE MD 1 35 CYS QB . . 6.560 3.196 2.081 4.870 . 0 0 "[ . 1 . 2 . 3]" 1
981 1 32 ILE MD 1 35 CYS HB3 . . 7.100 3.980 2.414 5.582 . 0 0 "[ . 1 . 2 . 3]" 1
982 1 32 ILE MD 1 46 ILE HA . . 7.600 3.485 2.251 6.345 . 0 0 "[ . 1 . 2 . 3]" 1
983 1 32 ILE MD 1 48 TYR HA . . 6.700 3.861 2.823 5.441 . 0 0 "[ . 1 . 2 . 3]" 1
984 1 32 ILE MD 1 49 ASP H . . 7.600 5.566 4.234 6.379 . 0 0 "[ . 1 . 2 . 3]" 1
985 1 32 ILE QG 1 33 LEU H . . 6.100 3.710 3.023 4.341 . 0 0 "[ . 1 . 2 . 3]" 1
986 1 32 ILE QG 1 45 HIS HD2 . . 7.480 6.739 6.686 6.794 . 0 0 "[ . 1 . 2 . 3]" 1
987 1 32 ILE QG 1 46 ILE MD . . 8.480 4.873 3.078 5.661 . 0 0 "[ . 1 . 2 . 3]" 1
988 1 32 ILE QG 1 46 ILE MG . . 8.480 2.253 1.917 3.356 . 0 0 "[ . 1 . 2 . 3]" 1
989 1 32 ILE QG 1 48 TYR HA . . 7.480 4.384 3.396 5.624 . 0 0 "[ . 1 . 2 . 3]" 1
990 1 32 ILE QG 1 48 TYR QB . . 8.350 2.945 2.158 4.341 . 0 0 "[ . 1 . 2 . 3]" 1
991 1 32 ILE QG 1 58 ILE MD . . 8.480 3.554 2.439 4.994 . 0 0 "[ . 1 . 2 . 3]" 1
992 1 32 ILE HG12 1 33 LEU H . . 6.600 4.093 3.072 5.437 . 0 0 "[ . 1 . 2 . 3]" 1
993 1 32 ILE HG13 1 33 LEU H . . 6.600 4.611 3.071 5.320 . 0 0 "[ . 1 . 2 . 3]" 1
994 1 32 ILE MG 1 33 LEU H . . 7.600 3.643 2.939 4.496 . 0 0 "[ . 1 . 2 . 3]" 1
995 1 32 ILE MG 1 35 CYS HA . . 7.600 5.541 4.002 6.431 . 0 0 "[ . 1 . 2 . 3]" 1
996 1 32 ILE MG 1 35 CYS HG . . 6.200 4.902 3.118 5.242 . 0 0 "[ . 1 . 2 . 3]" 1
997 1 32 ILE MG 1 48 TYR H . . 7.600 6.316 5.146 6.537 . 0 0 "[ . 1 . 2 . 3]" 1
998 1 33 LEU H 1 33 LEU MD1 . . 5.400 3.887 3.500 4.381 . 0 0 "[ . 1 . 2 . 3]" 1
999 1 33 LEU H 1 33 LEU QD . . 5.060 3.092 2.058 3.817 . 0 0 "[ . 1 . 2 . 3]" 1
1000 1 33 LEU H 1 33 LEU MD2 . . 5.400 3.344 2.066 4.289 . 0 0 "[ . 1 . 2 . 3]" 1
1001 1 33 LEU H 1 33 LEU HG . . 4.800 3.096 2.101 4.373 . 0 0 "[ . 1 . 2 . 3]" 1
1002 1 33 LEU H 1 34 TYR H . . 3.900 2.207 1.977 2.719 . 0 0 "[ . 1 . 2 . 3]" 1
1003 1 33 LEU H 1 35 CYS H . . 6.600 6.195 5.576 6.615 0.015 9 0 "[ . 1 . 2 . 3]" 1
1004 1 33 LEU H 1 47 LYS QD . . 7.600 5.522 5.121 6.171 . 0 0 "[ . 1 . 2 . 3]" 1
1005 1 33 LEU H 1 48 TYR H . . 6.600 4.411 3.729 5.125 . 0 0 "[ . 1 . 2 . 3]" 1
1006 1 33 LEU H 1 48 TYR HA . . 4.200 2.537 2.070 3.125 . 0 0 "[ . 1 . 2 . 3]" 1
1007 1 33 LEU H 1 48 TYR HB2 . . 6.600 4.310 3.887 4.847 . 0 0 "[ . 1 . 2 . 3]" 1
1008 1 33 LEU H 1 48 TYR HB3 . . 6.600 3.764 3.087 4.507 . 0 0 "[ . 1 . 2 . 3]" 1
1009 1 33 LEU HA 1 48 TYR HA . . 6.100 5.026 4.330 5.852 . 0 0 "[ . 1 . 2 . 3]" 1
1010 1 33 LEU QB 1 34 TYR H . . 5.300 2.849 2.213 3.788 . 0 0 "[ . 1 . 2 . 3]" 1
1011 1 33 LEU QB 1 48 TYR HA . . 7.600 3.823 2.797 4.770 . 0 0 "[ . 1 . 2 . 3]" 1
1012 1 33 LEU QB 1 49 ASP H . . 7.200 5.303 4.103 6.430 . 0 0 "[ . 1 . 2 . 3]" 1
1013 1 33 LEU QD 1 47 LYS HA . . 9.170 4.299 3.730 5.230 . 0 0 "[ . 1 . 2 . 3]" 1
1014 1 33 LEU QD 1 47 LYS QB . . 8.330 2.734 2.049 3.828 . 0 0 "[ . 1 . 2 . 3]" 1
1015 1 33 LEU QD 1 47 LYS QE . . 10.170 4.961 3.867 6.326 . 0 0 "[ . 1 . 2 . 3]" 1
1016 1 33 LEU MD1 1 34 TYR H . . 7.600 4.106 2.966 4.642 . 0 0 "[ . 1 . 2 . 3]" 1
1017 1 33 LEU MD1 1 34 TYR QD . . 9.600 5.529 4.047 6.699 . 0 0 "[ . 1 . 2 . 3]" 1
1018 1 33 LEU MD1 1 47 LYS HB2 . . 9.350 4.218 2.554 6.941 . 0 0 "[ . 1 . 2 . 3]" 1
1019 1 33 LEU MD1 1 47 LYS HB3 . . 9.350 3.783 2.363 5.678 . 0 0 "[ . 1 . 2 . 3]" 1
1020 1 33 LEU MD1 1 48 TYR HA . . 7.600 4.631 3.170 6.340 . 0 0 "[ . 1 . 2 . 3]" 1
1021 1 33 LEU MD2 1 34 TYR H . . 7.600 4.220 3.531 4.786 . 0 0 "[ . 1 . 2 . 3]" 1
1022 1 33 LEU MD2 1 34 TYR QD . . 9.600 6.213 5.056 6.965 . 0 0 "[ . 1 . 2 . 3]" 1
1023 1 33 LEU MD2 1 47 LYS HB2 . . 9.350 4.331 3.042 6.434 . 0 0 "[ . 1 . 2 . 3]" 1
1024 1 33 LEU MD2 1 47 LYS HB3 . . 9.350 3.713 2.344 6.026 . 0 0 "[ . 1 . 2 . 3]" 1
1025 1 33 LEU MD2 1 48 TYR HA . . 7.600 3.675 2.133 5.232 . 0 0 "[ . 1 . 2 . 3]" 1
1026 1 33 LEU HG 1 34 TYR H . . 4.600 3.566 2.144 4.671 0.071 26 0 "[ . 1 . 2 . 3]" 1
1027 1 33 LEU HG 1 34 TYR QB . . 7.480 4.188 2.445 5.760 . 0 0 "[ . 1 . 2 . 3]" 1
1028 1 33 LEU HG 1 34 TYR QD . . 8.600 6.243 4.611 7.677 . 0 0 "[ . 1 . 2 . 3]" 1
1029 1 33 LEU HG 1 47 LYS HA . . 6.600 5.429 4.031 6.600 0.000 10 0 "[ . 1 . 2 . 3]" 1
1030 1 33 LEU HG 1 47 LYS QB . . 7.480 3.401 2.137 4.813 . 0 0 "[ . 1 . 2 . 3]" 1
1031 1 33 LEU HG 1 48 TYR H . . 6.600 5.266 3.489 6.648 0.048 14 0 "[ . 1 . 2 . 3]" 1
1032 1 33 LEU HG 1 48 TYR HA . . 6.600 4.079 2.299 6.114 . 0 0 "[ . 1 . 2 . 3]" 1
1033 1 34 TYR H 1 34 TYR QB . . 3.700 2.730 2.532 2.884 . 0 0 "[ . 1 . 2 . 3]" 1
1034 1 34 TYR H 1 35 CYS H . . 5.400 4.289 3.878 4.465 . 0 0 "[ . 1 . 2 . 3]" 1
1035 1 34 TYR H 1 35 CYS HA . . 6.600 4.727 4.592 4.960 . 0 0 "[ . 1 . 2 . 3]" 1
1036 1 34 TYR H 1 46 ILE HA . . 6.600 4.902 4.390 5.206 . 0 0 "[ . 1 . 2 . 3]" 1
1037 1 34 TYR H 1 46 ILE QG . . 7.600 6.215 5.573 6.777 . 0 0 "[ . 1 . 2 . 3]" 1
1038 1 34 TYR H 1 46 ILE MG . . 7.600 4.197 3.291 4.823 . 0 0 "[ . 1 . 2 . 3]" 1
1039 1 34 TYR H 1 47 LYS H . . 3.700 3.159 2.745 3.480 . 0 0 "[ . 1 . 2 . 3]" 1
1040 1 34 TYR H 1 47 LYS HA . . 6.200 4.624 4.399 4.988 . 0 0 "[ . 1 . 2 . 3]" 1
1041 1 34 TYR H 1 47 LYS HB2 . . 6.600 2.377 2.050 3.287 . 0 0 "[ . 1 . 2 . 3]" 1
1042 1 34 TYR H 1 47 LYS QB . . 6.250 2.315 2.037 2.720 . 0 0 "[ . 1 . 2 . 3]" 1
1043 1 34 TYR H 1 47 LYS HB3 . . 6.600 3.623 2.596 4.270 . 0 0 "[ . 1 . 2 . 3]" 1
1044 1 34 TYR H 1 47 LYS QG . . 7.480 4.111 3.750 4.564 . 0 0 "[ . 1 . 2 . 3]" 1
1045 1 34 TYR H 1 48 TYR HA . . 5.200 4.330 3.925 5.007 . 0 0 "[ . 1 . 2 . 3]" 1
1046 1 34 TYR HA 1 36 SER H . . 6.600 6.311 4.910 6.579 . 0 0 "[ . 1 . 2 . 3]" 1
1047 1 34 TYR QB 1 35 CYS HA . . 7.480 4.582 4.385 4.854 . 0 0 "[ . 1 . 2 . 3]" 1
1048 1 34 TYR QB 1 45 HIS HD2 . . 7.480 4.975 4.223 6.042 . 0 0 "[ . 1 . 2 . 3]" 1
1049 1 34 TYR QB 1 46 ILE HA . . 7.480 5.337 4.821 5.705 . 0 0 "[ . 1 . 2 . 3]" 1
1050 1 34 TYR QB 1 47 LYS QB . . 6.090 2.230 2.079 2.424 . 0 0 "[ . 1 . 2 . 3]" 1
1051 1 34 TYR QB 1 47 LYS QG . . 6.310 2.772 2.316 3.243 . 0 0 "[ . 1 . 2 . 3]" 1
1052 1 34 TYR HB2 1 35 CYS H . . 5.800 4.166 3.899 4.554 . 0 0 "[ . 1 . 2 . 3]" 1
1053 1 34 TYR HB2 1 47 LYS H . . 6.600 5.367 4.965 5.603 . 0 0 "[ . 1 . 2 . 3]" 1
1054 1 34 TYR HB2 1 47 LYS HA . . 6.600 6.641 6.611 6.702 0.102 13 0 "[ . 1 . 2 . 3]" 1
1055 1 34 TYR HB2 1 47 LYS HB2 . . 6.600 3.677 3.596 4.264 . 0 0 "[ . 1 . 2 . 3]" 1
1056 1 34 TYR HB2 1 47 LYS HB3 . . 6.600 4.805 3.803 5.102 . 0 0 "[ . 1 . 2 . 3]" 1
1057 1 34 TYR HB2 1 47 LYS QD . . 7.600 3.942 3.317 5.722 . 0 0 "[ . 1 . 2 . 3]" 1
1058 1 34 TYR HB2 1 47 LYS HG2 . . 6.600 5.892 4.947 6.248 . 0 0 "[ . 1 . 2 . 3]" 1
1059 1 34 TYR HB2 1 47 LYS HG3 . . 6.600 4.550 3.947 5.118 . 0 0 "[ . 1 . 2 . 3]" 1
1060 1 34 TYR HB3 1 35 CYS H . . 5.800 4.029 3.570 4.482 . 0 0 "[ . 1 . 2 . 3]" 1
1061 1 34 TYR HB3 1 47 LYS H . . 6.600 3.925 3.548 4.235 . 0 0 "[ . 1 . 2 . 3]" 1
1062 1 34 TYR HB3 1 47 LYS HA . . 6.600 5.140 5.023 5.283 . 0 0 "[ . 1 . 2 . 3]" 1
1063 1 34 TYR HB3 1 47 LYS HB2 . . 6.600 2.292 2.113 2.532 . 0 0 "[ . 1 . 2 . 3]" 1
1064 1 34 TYR HB3 1 47 LYS HB3 . . 6.600 3.567 2.342 4.106 . 0 0 "[ . 1 . 2 . 3]" 1
1065 1 34 TYR HB3 1 47 LYS QD . . 7.600 2.820 2.197 4.398 . 0 0 "[ . 1 . 2 . 3]" 1
1066 1 34 TYR HB3 1 47 LYS HG2 . . 6.600 4.222 3.198 4.574 . 0 0 "[ . 1 . 2 . 3]" 1
1067 1 34 TYR HB3 1 47 LYS HG3 . . 6.600 2.848 2.352 3.391 . 0 0 "[ . 1 . 2 . 3]" 1
1068 1 34 TYR QD 1 35 CYS H . . 8.600 3.173 2.345 3.922 . 0 0 "[ . 1 . 2 . 3]" 1
1069 1 34 TYR QD 1 35 CYS HA . . 8.600 4.204 3.395 4.967 . 0 0 "[ . 1 . 2 . 3]" 1
1070 1 34 TYR QD 1 35 CYS QB . . 9.480 4.934 4.546 5.345 . 0 0 "[ . 1 . 2 . 3]" 1
1071 1 34 TYR QD 1 36 SER H . . 8.600 4.876 3.590 5.518 . 0 0 "[ . 1 . 2 . 3]" 1
1072 1 34 TYR QD 1 36 SER QB . . 9.600 4.018 3.015 5.396 . 0 0 "[ . 1 . 2 . 3]" 1
1073 1 34 TYR QD 1 45 HIS H . . 8.600 7.015 6.397 7.532 . 0 0 "[ . 1 . 2 . 3]" 1
1074 1 34 TYR QD 1 46 ILE HA . . 8.600 5.299 4.321 6.057 . 0 0 "[ . 1 . 2 . 3]" 1
1075 1 34 TYR QD 1 46 ILE QG . . 9.600 6.796 5.907 7.453 . 0 0 "[ . 1 . 2 . 3]" 1
1076 1 34 TYR QD 1 47 LYS H . . 8.600 4.399 3.674 5.091 . 0 0 "[ . 1 . 2 . 3]" 1
1077 1 34 TYR QD 1 47 LYS HA . . 8.600 5.785 5.210 6.545 . 0 0 "[ . 1 . 2 . 3]" 1
1078 1 34 TYR QD 1 47 LYS HB2 . . 8.600 3.694 2.757 4.281 . 0 0 "[ . 1 . 2 . 3]" 1
1079 1 34 TYR QD 1 47 LYS HB3 . . 8.600 4.840 3.660 5.490 . 0 0 "[ . 1 . 2 . 3]" 1
1080 1 34 TYR QD 1 47 LYS QD . . 9.600 3.402 2.308 4.704 . 0 0 "[ . 1 . 2 . 3]" 1
1081 1 34 TYR QD 1 47 LYS QE . . 9.600 3.393 2.303 4.641 . 0 0 "[ . 1 . 2 . 3]" 1
1082 1 34 TYR QD 1 47 LYS HG2 . . 8.600 4.155 3.236 5.142 . 0 0 "[ . 1 . 2 . 3]" 1
1083 1 34 TYR QD 1 47 LYS HG3 . . 8.600 2.667 2.258 3.527 . 0 0 "[ . 1 . 2 . 3]" 1
1084 1 34 TYR QE 1 35 CYS H . . 8.600 4.048 3.142 5.224 . 0 0 "[ . 1 . 2 . 3]" 1
1085 1 34 TYR QE 1 35 CYS HA . . 8.600 5.090 4.457 5.679 . 0 0 "[ . 1 . 2 . 3]" 1
1086 1 34 TYR QE 1 36 SER H . . 8.600 4.843 3.796 5.554 . 0 0 "[ . 1 . 2 . 3]" 1
1087 1 34 TYR QE 1 36 SER QB . . 9.600 2.763 2.214 4.100 . 0 0 "[ . 1 . 2 . 3]" 1
1088 1 34 TYR QE 1 45 HIS H . . 8.600 6.729 5.941 7.304 . 0 0 "[ . 1 . 2 . 3]" 1
1089 1 34 TYR QE 1 45 HIS QB . . 8.880 5.908 4.076 7.067 . 0 0 "[ . 1 . 2 . 3]" 1
1090 1 34 TYR QE 1 46 ILE HA . . 8.600 6.581 5.862 7.204 . 0 0 "[ . 1 . 2 . 3]" 1
1091 1 34 TYR QE 1 47 LYS HB2 . . 8.600 5.902 4.977 6.381 . 0 0 "[ . 1 . 2 . 3]" 1
1092 1 34 TYR QE 1 47 LYS HB3 . . 8.600 7.000 5.932 7.605 . 0 0 "[ . 1 . 2 . 3]" 1
1093 1 34 TYR QE 1 47 LYS QD . . 9.600 5.214 3.985 6.462 . 0 0 "[ . 1 . 2 . 3]" 1
1094 1 34 TYR QE 1 47 LYS QE . . 9.600 4.547 2.915 5.988 . 0 0 "[ . 1 . 2 . 3]" 1
1095 1 34 TYR QE 1 47 LYS HG2 . . 8.600 5.977 5.054 6.923 . 0 0 "[ . 1 . 2 . 3]" 1
1096 1 34 TYR QE 1 47 LYS HG3 . . 8.600 4.717 4.074 5.402 . 0 0 "[ . 1 . 2 . 3]" 1
1097 1 35 CYS H 1 36 SER H . . 5.200 4.364 2.961 4.626 . 0 0 "[ . 1 . 2 . 3]" 1
1098 1 35 CYS H 1 46 ILE QG . . 7.600 5.904 4.844 6.636 . 0 0 "[ . 1 . 2 . 3]" 1
1099 1 35 CYS HA 1 36 SER QB . . 7.600 4.346 3.901 4.963 . 0 0 "[ . 1 . 2 . 3]" 1
1100 1 35 CYS HA 1 45 HIS H . . 6.600 4.967 4.248 5.289 . 0 0 "[ . 1 . 2 . 3]" 1
1101 1 35 CYS HA 1 45 HIS HD2 . . 6.600 3.754 2.937 4.801 . 0 0 "[ . 1 . 2 . 3]" 1
1102 1 35 CYS HA 1 46 ILE MD . . 7.600 4.771 3.968 5.296 . 0 0 "[ . 1 . 2 . 3]" 1
1103 1 35 CYS HA 1 46 ILE QG . . 7.600 3.508 2.424 4.313 . 0 0 "[ . 1 . 2 . 3]" 1
1104 1 35 CYS HA 1 46 ILE MG . . 5.900 3.764 2.352 4.429 . 0 0 "[ . 1 . 2 . 3]" 1
1105 1 35 CYS HA 1 47 LYS H . . 5.800 3.167 2.818 3.497 . 0 0 "[ . 1 . 2 . 3]" 1
1106 1 35 CYS QB 1 36 SER H . . 6.150 3.045 2.335 3.977 . 0 0 "[ . 1 . 2 . 3]" 1
1107 1 35 CYS QB 1 46 ILE MD . . 8.480 4.664 3.519 5.577 . 0 0 "[ . 1 . 2 . 3]" 1
1108 1 35 CYS HB2 1 36 SER H . . 6.600 3.766 2.523 4.345 . 0 0 "[ . 1 . 2 . 3]" 1
1109 1 35 CYS HB2 1 37 VAL MG1 . . 7.600 4.984 3.327 6.405 . 0 0 "[ . 1 . 2 . 3]" 1
1110 1 35 CYS HB2 1 37 VAL MG2 . . 7.600 5.774 3.645 6.418 . 0 0 "[ . 1 . 2 . 3]" 1
1111 1 35 CYS HB2 1 46 ILE HA . . 6.600 4.463 3.440 5.536 . 0 0 "[ . 1 . 2 . 3]" 1
1112 1 35 CYS HB2 1 46 ILE QG . . 7.600 4.182 2.696 5.709 . 0 0 "[ . 1 . 2 . 3]" 1
1113 1 35 CYS HB3 1 36 SER H . . 6.600 3.349 2.379 4.612 . 0 0 "[ . 1 . 2 . 3]" 1
1114 1 35 CYS HB3 1 37 VAL MG1 . . 7.600 4.675 3.106 6.345 . 0 0 "[ . 1 . 2 . 3]" 1
1115 1 35 CYS HB3 1 37 VAL MG2 . . 7.600 5.232 2.540 6.440 . 0 0 "[ . 1 . 2 . 3]" 1
1116 1 35 CYS HB3 1 46 ILE HA . . 6.600 4.431 2.935 5.444 . 0 0 "[ . 1 . 2 . 3]" 1
1117 1 35 CYS HB3 1 46 ILE QG . . 7.600 4.058 2.135 5.547 . 0 0 "[ . 1 . 2 . 3]" 1
1118 1 35 CYS HG 1 36 SER H . . 6.600 4.451 2.915 5.323 . 0 0 "[ . 1 . 2 . 3]" 1
1119 1 35 CYS HG 1 36 SER HA . . 6.600 5.591 4.696 6.612 0.012 10 0 "[ . 1 . 2 . 3]" 1
1120 1 35 CYS HG 1 37 VAL H . . 6.600 5.786 3.923 6.639 0.039 10 0 "[ . 1 . 2 . 3]" 1
1121 1 35 CYS HG 1 37 VAL QG . . 7.960 4.176 2.761 5.699 . 0 0 "[ . 1 . 2 . 3]" 1
1122 1 35 CYS HG 1 46 ILE HA . . 6.600 4.776 2.947 6.227 . 0 0 "[ . 1 . 2 . 3]" 1
1123 1 35 CYS HG 1 46 ILE MD . . 7.600 4.931 2.769 6.365 . 0 0 "[ . 1 . 2 . 3]" 1
1124 1 36 SER H 1 37 VAL H . . 5.200 3.820 2.844 4.174 . 0 0 "[ . 1 . 2 . 3]" 1
1125 1 36 SER H 1 45 HIS H . . 3.900 3.153 2.817 3.935 0.035 16 0 "[ . 1 . 2 . 3]" 1
1126 1 36 SER H 1 45 HIS HB2 . . 6.600 5.200 4.598 5.634 . 0 0 "[ . 1 . 2 . 3]" 1
1127 1 36 SER H 1 45 HIS HB3 . . 6.600 4.699 3.170 5.755 . 0 0 "[ . 1 . 2 . 3]" 1
1128 1 36 SER H 1 45 HIS HD2 . . 6.600 3.890 2.784 4.921 . 0 0 "[ . 1 . 2 . 3]" 1
1129 1 36 SER H 1 46 ILE HA . . 6.600 3.710 3.315 4.030 . 0 0 "[ . 1 . 2 . 3]" 1
1130 1 36 SER H 1 46 ILE MD . . 7.600 4.810 3.791 5.549 . 0 0 "[ . 1 . 2 . 3]" 1
1131 1 36 SER HA 1 37 VAL H . . 3.200 2.276 2.141 2.500 . 0 0 "[ . 1 . 2 . 3]" 1
1132 1 36 SER HA 1 37 VAL MG1 . . 7.600 4.069 3.396 5.605 . 0 0 "[ . 1 . 2 . 3]" 1
1133 1 36 SER HA 1 37 VAL MG2 . . 7.600 4.432 3.230 5.571 . 0 0 "[ . 1 . 2 . 3]" 1
1134 1 36 SER HA 1 45 HIS H . . 6.600 4.857 4.670 5.064 . 0 0 "[ . 1 . 2 . 3]" 1
1135 1 36 SER QB 1 45 HIS H . . 7.600 3.812 2.713 4.669 . 0 0 "[ . 1 . 2 . 3]" 1
1136 1 36 SER QB 1 45 HIS QB . . 8.480 3.873 2.583 4.693 . 0 0 "[ . 1 . 2 . 3]" 1
1137 1 36 SER QB 1 45 HIS HD2 . . 7.600 4.305 3.346 6.268 . 0 0 "[ . 1 . 2 . 3]" 1
1138 1 37 VAL H 1 38 ALA H . . 6.600 4.523 4.102 4.617 . 0 0 "[ . 1 . 2 . 3]" 1
1139 1 37 VAL H 1 38 ALA MB . . 7.600 4.998 4.770 5.285 . 0 0 "[ . 1 . 2 . 3]" 1
1140 1 37 VAL H 1 44 ALA HA . . 6.600 4.416 3.816 4.767 . 0 0 "[ . 1 . 2 . 3]" 1
1141 1 37 VAL H 1 44 ALA MB . . 7.600 4.803 3.134 5.423 . 0 0 "[ . 1 . 2 . 3]" 1
1142 1 37 VAL H 1 45 HIS H . . 6.600 4.668 4.301 4.883 . 0 0 "[ . 1 . 2 . 3]" 1
1143 1 37 VAL HA 1 43 LYS H . . 6.600 4.779 4.564 4.976 . 0 0 "[ . 1 . 2 . 3]" 1
1144 1 37 VAL HA 1 44 ALA H . . 6.600 4.595 4.226 4.771 . 0 0 "[ . 1 . 2 . 3]" 1
1145 1 37 VAL HA 1 44 ALA HA . . 3.200 2.100 2.009 2.334 . 0 0 "[ . 1 . 2 . 3]" 1
1146 1 37 VAL HA 1 44 ALA MB . . 7.600 3.431 2.312 3.813 . 0 0 "[ . 1 . 2 . 3]" 1
1147 1 37 VAL HA 1 45 HIS H . . 3.700 3.147 2.652 3.731 0.031 13 0 "[ . 1 . 2 . 3]" 1
1148 1 37 VAL HB 1 38 ALA H . . 6.400 3.456 2.503 4.556 . 0 0 "[ . 1 . 2 . 3]" 1
1149 1 37 VAL HB 1 44 ALA HA . . 6.500 3.250 2.303 5.046 . 0 0 "[ . 1 . 2 . 3]" 1
1150 1 37 VAL HB 1 44 ALA MB . . 7.600 3.134 2.140 4.750 . 0 0 "[ . 1 . 2 . 3]" 1
1151 1 37 VAL QG 1 43 LYS HA . . 9.160 4.915 4.097 5.561 . 0 0 "[ . 1 . 2 . 3]" 1
1152 1 37 VAL QG 1 44 ALA HA . . 7.240 2.395 2.043 3.538 . 0 0 "[ . 1 . 2 . 3]" 1
1153 1 37 VAL QG 1 44 ALA MB . . 7.900 2.104 1.942 2.654 . 0 0 "[ . 1 . 2 . 3]" 1
1154 1 37 VAL QG 1 45 HIS H . . 7.340 3.574 2.538 4.829 . 0 0 "[ . 1 . 2 . 3]" 1
1155 1 37 VAL QG 1 67 PHE QD . . 11.160 5.267 5.010 5.549 . 0 0 "[ . 1 . 2 . 3]" 1
1156 1 37 VAL QG 1 67 PHE QE . . 11.160 5.121 4.812 5.357 . 0 0 "[ . 1 . 2 . 3]" 1
1157 1 37 VAL QG 1 67 PHE HZ . . 9.160 5.792 5.326 6.335 . 0 0 "[ . 1 . 2 . 3]" 1
1158 1 37 VAL MG1 1 38 ALA H . . 7.600 3.723 2.364 4.206 . 0 0 "[ . 1 . 2 . 3]" 1
1159 1 37 VAL MG1 1 43 LYS H . . 7.600 5.582 3.986 6.343 . 0 0 "[ . 1 . 2 . 3]" 1
1160 1 37 VAL MG1 1 44 ALA H . . 7.600 5.036 3.605 6.399 . 0 0 "[ . 1 . 2 . 3]" 1
1161 1 37 VAL MG1 1 44 ALA HA . . 7.600 3.045 2.047 4.653 . 0 0 "[ . 1 . 2 . 3]" 1
1162 1 37 VAL MG1 1 44 ALA MB . . 8.300 2.722 1.956 4.220 . 0 0 "[ . 1 . 2 . 3]" 1
1163 1 37 VAL MG1 1 45 HIS H . . 7.600 4.129 2.547 5.650 . 0 0 "[ . 1 . 2 . 3]" 1
1164 1 37 VAL MG2 1 38 ALA H . . 7.600 3.223 2.223 4.372 . 0 0 "[ . 1 . 2 . 3]" 1
1165 1 37 VAL MG2 1 43 LYS H . . 7.600 5.080 3.638 6.347 . 0 0 "[ . 1 . 2 . 3]" 1
1166 1 37 VAL MG2 1 44 ALA H . . 7.600 5.127 3.469 6.307 . 0 0 "[ . 1 . 2 . 3]" 1
1167 1 37 VAL MG2 1 44 ALA HA . . 7.600 3.454 2.247 4.311 . 0 0 "[ . 1 . 2 . 3]" 1
1168 1 37 VAL MG2 1 44 ALA MB . . 8.300 3.042 2.018 4.193 . 0 0 "[ . 1 . 2 . 3]" 1
1169 1 37 VAL MG2 1 45 HIS H . . 7.600 4.764 3.400 5.412 . 0 0 "[ . 1 . 2 . 3]" 1
1170 1 38 ALA H 1 39 LEU H . . 5.700 4.256 4.136 4.484 . 0 0 "[ . 1 . 2 . 3]" 1
1171 1 38 ALA H 1 39 LEU HA . . 6.600 4.698 4.467 5.188 . 0 0 "[ . 1 . 2 . 3]" 1
1172 1 38 ALA H 1 41 THR H . . 6.600 5.184 4.867 5.636 . 0 0 "[ . 1 . 2 . 3]" 1
1173 1 38 ALA H 1 43 LYS H . . 3.600 3.025 2.758 3.500 . 0 0 "[ . 1 . 2 . 3]" 1
1174 1 38 ALA H 1 43 LYS HA . . 6.600 4.791 4.628 5.003 . 0 0 "[ . 1 . 2 . 3]" 1
1175 1 38 ALA H 1 43 LYS HB2 . . 6.600 5.101 4.708 5.419 . 0 0 "[ . 1 . 2 . 3]" 1
1176 1 38 ALA H 1 43 LYS HB3 . . 6.600 4.001 3.111 5.755 . 0 0 "[ . 1 . 2 . 3]" 1
1177 1 38 ALA H 1 44 ALA H . . 6.600 4.945 4.859 5.007 . 0 0 "[ . 1 . 2 . 3]" 1
1178 1 38 ALA H 1 44 ALA HA . . 5.300 3.610 3.264 3.803 . 0 0 "[ . 1 . 2 . 3]" 1
1179 1 38 ALA H 1 44 ALA MB . . 7.600 4.492 3.825 4.938 . 0 0 "[ . 1 . 2 . 3]" 1
1180 1 38 ALA H 1 45 HIS H . . 6.600 4.914 4.090 5.381 . 0 0 "[ . 1 . 2 . 3]" 1
1181 1 38 ALA HA 1 39 LEU H . . 2.700 2.108 2.039 2.163 . 0 0 "[ . 1 . 2 . 3]" 1
1182 1 38 ALA HA 1 39 LEU HA . . 5.800 4.310 4.208 4.360 . 0 0 "[ . 1 . 2 . 3]" 1
1183 1 38 ALA HA 1 39 LEU QB . . 7.300 4.232 4.106 4.420 . 0 0 "[ . 1 . 2 . 3]" 1
1184 1 38 ALA HA 1 40 ALA H . . 4.600 4.175 3.858 4.442 . 0 0 "[ . 1 . 2 . 3]" 1
1185 1 38 ALA HA 1 41 THR H . . 4.900 4.875 4.669 5.004 0.104 16 0 "[ . 1 . 2 . 3]" 1
1186 1 38 ALA MB 1 39 LEU H . . 3.400 2.882 2.854 2.918 . 0 0 "[ . 1 . 2 . 3]" 1
1187 1 38 ALA MB 1 42 ASN H . . 4.900 4.064 3.656 4.147 . 0 0 "[ . 1 . 2 . 3]" 1
1188 1 38 ALA MB 1 43 LYS H . . 5.300 3.490 2.994 3.999 . 0 0 "[ . 1 . 2 . 3]" 1
1189 1 39 LEU H 1 39 LEU MD1 . . 5.100 3.784 3.408 4.020 . 0 0 "[ . 1 . 2 . 3]" 1
1190 1 39 LEU H 1 39 LEU MD2 . . 5.100 2.988 1.896 3.757 . 0 0 "[ . 1 . 2 . 3]" 1
1191 1 39 LEU H 1 39 LEU HG . . 2.800 2.345 2.111 2.801 0.001 13 0 "[ . 1 . 2 . 3]" 1
1192 1 39 LEU H 1 40 ALA H . . 3.000 2.641 2.490 2.874 . 0 0 "[ . 1 . 2 . 3]" 1
1193 1 39 LEU H 1 40 ALA HA . . 6.000 5.247 5.125 5.409 . 0 0 "[ . 1 . 2 . 3]" 1
1194 1 39 LEU H 1 41 THR MG . . 7.600 5.746 4.197 7.162 . 0 0 "[ . 1 . 2 . 3]" 1
1195 1 39 LEU H 1 43 LYS H . . 6.600 5.107 4.985 5.699 . 0 0 "[ . 1 . 2 . 3]" 1
1196 1 39 LEU HA 1 42 ASN HA . . 5.600 2.880 2.274 3.592 . 0 0 "[ . 1 . 2 . 3]" 1
1197 1 39 LEU HA 1 42 ASN QD . . 7.470 4.142 2.932 5.089 . 0 0 "[ . 1 . 2 . 3]" 1
1198 1 39 LEU QB 1 40 ALA H . . 4.700 3.361 2.266 3.771 . 0 0 "[ . 1 . 2 . 3]" 1
1199 1 39 LEU QB 1 41 THR H . . 7.600 5.143 4.545 5.460 . 0 0 "[ . 1 . 2 . 3]" 1
1200 1 39 LEU QB 1 42 ASN QD . . 8.470 4.773 3.654 6.134 . 0 0 "[ . 1 . 2 . 3]" 1
1201 1 39 LEU QD 1 42 ASN H . . 9.170 4.688 4.420 5.046 . 0 0 "[ . 1 . 2 . 3]" 1
1202 1 39 LEU QD 1 42 ASN QD . . 7.870 4.628 3.946 5.214 . 0 0 "[ . 1 . 2 . 3]" 1
1203 1 39 LEU MD1 1 40 ALA H . . 7.600 3.167 2.461 4.421 . 0 0 "[ . 1 . 2 . 3]" 1
1204 1 39 LEU MD1 1 42 ASN HD21 . . 9.330 5.700 4.364 7.809 . 0 0 "[ . 1 . 2 . 3]" 1
1205 1 39 LEU MD1 1 42 ASN HD22 . . 9.330 6.090 5.025 7.791 . 0 0 "[ . 1 . 2 . 3]" 1
1206 1 39 LEU MD2 1 40 ALA H . . 7.600 4.016 3.348 4.796 . 0 0 "[ . 1 . 2 . 3]" 1
1207 1 39 LEU MD2 1 42 ASN HD21 . . 9.330 6.564 4.140 7.793 . 0 0 "[ . 1 . 2 . 3]" 1
1208 1 39 LEU MD2 1 42 ASN HD22 . . 9.330 7.035 5.050 7.784 . 0 0 "[ . 1 . 2 . 3]" 1
1209 1 39 LEU HG 1 40 ALA H . . 5.900 2.618 2.074 4.462 . 0 0 "[ . 1 . 2 . 3]" 1
1210 1 40 ALA H 1 41 THR H . . 4.100 2.760 2.553 2.928 . 0 0 "[ . 1 . 2 . 3]" 1
1211 1 40 ALA H 1 41 THR HB . . 5.200 5.234 5.147 5.293 0.093 23 0 "[ . 1 . 2 . 3]" 1
1212 1 40 ALA H 1 41 THR MG . . 7.600 5.023 3.648 6.201 . 0 0 "[ . 1 . 2 . 3]" 1
1213 1 40 ALA H 1 42 ASN H . . 6.600 3.716 3.483 3.911 . 0 0 "[ . 1 . 2 . 3]" 1
1214 1 40 ALA HA 1 41 THR HA . . 6.000 4.745 4.648 4.866 . 0 0 "[ . 1 . 2 . 3]" 1
1215 1 40 ALA HA 1 41 THR MG . . 7.600 5.610 4.792 6.130 . 0 0 "[ . 1 . 2 . 3]" 1
1216 1 40 ALA MB 1 41 THR H . . 3.400 2.527 2.307 2.834 . 0 0 "[ . 1 . 2 . 3]" 1
1217 1 40 ALA MB 1 41 THR HA . . 5.100 4.012 3.888 4.222 . 0 0 "[ . 1 . 2 . 3]" 1
1218 1 40 ALA MB 1 41 THR MG . . 7.600 4.043 3.049 4.732 . 0 0 "[ . 1 . 2 . 3]" 1
1219 1 40 ALA MB 1 42 ASN H . . 5.500 4.172 4.086 4.341 . 0 0 "[ . 1 . 2 . 3]" 1
1220 1 41 THR H 1 41 THR MG . . 4.800 2.938 1.960 3.850 . 0 0 "[ . 1 . 2 . 3]" 1
1221 1 41 THR H 1 42 ASN H . . 2.800 2.431 2.078 2.715 . 0 0 "[ . 1 . 2 . 3]" 1
1222 1 41 THR H 1 43 LYS H . . 5.000 3.939 3.601 4.193 . 0 0 "[ . 1 . 2 . 3]" 1
1223 1 41 THR H 1 43 LYS HA . . 6.600 6.612 6.245 6.689 0.089 3 0 "[ . 1 . 2 . 3]" 1
1224 1 41 THR HA 1 42 ASN QD . . 7.470 4.895 3.184 6.695 . 0 0 "[ . 1 . 2 . 3]" 1
1225 1 41 THR HA 1 43 LYS H . . 5.400 4.832 4.469 5.222 . 0 0 "[ . 1 . 2 . 3]" 1
1226 1 41 THR HA 1 43 LYS HE2 . . 6.600 6.311 5.043 6.657 0.057 15 0 "[ . 1 . 2 . 3]" 1
1227 1 41 THR HA 1 43 LYS HE3 . . 6.600 5.431 4.855 6.605 0.005 12 0 "[ . 1 . 2 . 3]" 1
1228 1 41 THR HB 1 42 ASN H . . 5.100 3.829 2.806 4.503 . 0 0 "[ . 1 . 2 . 3]" 1
1229 1 41 THR HB 1 43 LYS H . . 6.600 3.847 2.526 5.552 . 0 0 "[ . 1 . 2 . 3]" 1
1230 1 41 THR MG 1 42 ASN H . . 7.600 3.744 2.403 4.381 . 0 0 "[ . 1 . 2 . 3]" 1
1231 1 41 THR MG 1 43 LYS H . . 7.600 3.296 2.008 4.236 . 0 0 "[ . 1 . 2 . 3]" 1
1232 1 41 THR MG 1 43 LYS QB . . 8.480 2.369 1.988 3.791 . 0 0 "[ . 1 . 2 . 3]" 1
1233 1 41 THR MG 1 43 LYS HE2 . . 7.600 3.847 2.462 4.713 . 0 0 "[ . 1 . 2 . 3]" 1
1234 1 41 THR MG 1 43 LYS HE3 . . 7.600 2.842 2.130 4.456 . 0 0 "[ . 1 . 2 . 3]" 1
1235 1 42 ASN H 1 42 ASN HD21 . . 5.600 3.367 2.300 4.737 . 0 0 "[ . 1 . 2 . 3]" 1
1236 1 42 ASN H 1 42 ASN QD . . 4.870 3.264 2.269 4.381 . 0 0 "[ . 1 . 2 . 3]" 1
1237 1 42 ASN H 1 42 ASN HD22 . . 5.600 4.570 3.478 5.610 0.010 29 0 "[ . 1 . 2 . 3]" 1
1238 1 42 ASN H 1 43 LYS H . . 3.000 2.840 2.301 3.030 0.030 2 0 "[ . 1 . 2 . 3]" 1
1239 1 42 ASN H 1 43 LYS HA . . 6.500 5.356 4.929 5.546 . 0 0 "[ . 1 . 2 . 3]" 1
1240 1 42 ASN H 1 43 LYS HB2 . . 6.500 5.029 4.071 6.534 0.034 17 0 "[ . 1 . 2 . 3]" 1
1241 1 42 ASN H 1 43 LYS QB . . 6.290 4.411 3.789 5.154 . 0 0 "[ . 1 . 2 . 3]" 1
1242 1 42 ASN H 1 43 LYS HB3 . . 6.500 4.961 4.513 5.397 . 0 0 "[ . 1 . 2 . 3]" 1
1243 1 42 ASN HA 1 43 LYS H . . 3.100 2.708 2.346 2.940 . 0 0 "[ . 1 . 2 . 3]" 1
1244 1 42 ASN HA 1 43 LYS HA . . 6.100 4.526 4.316 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
1245 1 42 ASN QB 1 43 LYS HA . . 6.440 4.487 4.189 4.778 . 0 0 "[ . 1 . 2 . 3]" 1
1246 1 42 ASN HB2 1 43 LYS H . . 6.300 4.487 4.321 4.703 . 0 0 "[ . 1 . 2 . 3]" 1
1247 1 42 ASN HB2 1 43 LYS HA . . 6.600 5.291 4.664 5.992 . 0 0 "[ . 1 . 2 . 3]" 1
1248 1 42 ASN HB3 1 43 LYS H . . 6.300 4.447 4.178 4.615 . 0 0 "[ . 1 . 2 . 3]" 1
1249 1 42 ASN HB3 1 43 LYS HA . . 6.600 5.013 4.610 5.909 . 0 0 "[ . 1 . 2 . 3]" 1
1250 1 42 ASN QD 1 43 LYS H . . 7.470 4.662 3.860 5.028 . 0 0 "[ . 1 . 2 . 3]" 1
1251 1 43 LYS H 1 43 LYS QD . . 5.900 4.866 4.335 5.239 . 0 0 "[ . 1 . 2 . 3]" 1
1252 1 43 LYS H 1 43 LYS HE2 . . 6.600 5.698 4.781 6.331 . 0 0 "[ . 1 . 2 . 3]" 1
1253 1 43 LYS H 1 43 LYS HE3 . . 6.600 5.428 4.921 6.388 . 0 0 "[ . 1 . 2 . 3]" 1
1254 1 43 LYS H 1 44 ALA H . . 4.700 4.437 4.319 4.566 . 0 0 "[ . 1 . 2 . 3]" 1
1255 1 43 LYS H 1 44 ALA HA . . 6.600 5.037 4.768 5.258 . 0 0 "[ . 1 . 2 . 3]" 1
1256 1 43 LYS H 1 44 ALA MB . . 7.000 5.220 4.940 5.553 . 0 0 "[ . 1 . 2 . 3]" 1
1257 1 43 LYS HA 1 43 LYS HE2 . . 6.600 4.257 2.637 5.066 . 0 0 "[ . 1 . 2 . 3]" 1
1258 1 43 LYS HA 1 43 LYS HE3 . . 6.600 4.784 3.736 5.700 . 0 0 "[ . 1 . 2 . 3]" 1
1259 1 43 LYS HA 1 44 ALA H . . 2.900 2.202 2.113 2.375 . 0 0 "[ . 1 . 2 . 3]" 1
1260 1 43 LYS HA 1 44 ALA HA . . 5.800 4.469 4.350 4.513 . 0 0 "[ . 1 . 2 . 3]" 1
1261 1 43 LYS HA 1 44 ALA MB . . 6.800 4.118 3.907 4.364 . 0 0 "[ . 1 . 2 . 3]" 1
1262 1 43 LYS HA 1 45 HIS H . . 6.600 5.796 5.523 6.095 . 0 0 "[ . 1 . 2 . 3]" 1
1263 1 43 LYS QB 1 44 ALA HA . . 6.280 4.336 3.962 4.743 . 0 0 "[ . 1 . 2 . 3]" 1
1264 1 43 LYS QB 1 45 HIS H . . 7.480 4.875 4.454 5.405 . 0 0 "[ . 1 . 2 . 3]" 1
1265 1 43 LYS HB2 1 44 ALA H . . 4.200 3.884 2.342 4.276 0.076 12 0 "[ . 1 . 2 . 3]" 1
1266 1 43 LYS HB3 1 44 ALA H . . 4.200 3.946 3.483 4.238 0.038 11 0 "[ . 1 . 2 . 3]" 1
1267 1 43 LYS QD 1 44 ALA H . . 7.500 4.018 2.248 4.914 . 0 0 "[ . 1 . 2 . 3]" 1
1268 1 43 LYS QD 1 45 HIS HA . . 7.600 4.254 3.650 5.017 . 0 0 "[ . 1 . 2 . 3]" 1
1269 1 43 LYS QD 1 45 HIS HD2 . . 7.600 6.669 6.236 6.814 . 0 0 "[ . 1 . 2 . 3]" 1
1270 1 43 LYS HE2 1 44 ALA H . . 6.600 5.153 4.062 5.915 . 0 0 "[ . 1 . 2 . 3]" 1
1271 1 43 LYS HE3 1 44 ALA H . . 6.600 5.830 5.096 6.601 0.001 7 0 "[ . 1 . 2 . 3]" 1
1272 1 43 LYS QG 1 44 ALA H . . 7.600 2.697 2.096 4.016 . 0 0 "[ . 1 . 2 . 3]" 1
1273 1 43 LYS QG 1 44 ALA HA . . 7.600 3.646 2.933 4.332 . 0 0 "[ . 1 . 2 . 3]" 1
1274 1 44 ALA H 1 45 HIS H . . 6.600 4.240 3.978 4.397 . 0 0 "[ . 1 . 2 . 3]" 1
1275 1 44 ALA H 1 45 HIS HA . . 6.600 4.783 4.532 5.163 . 0 0 "[ . 1 . 2 . 3]" 1
1276 1 44 ALA HA 1 45 HIS H . . 2.900 2.187 2.046 2.293 . 0 0 "[ . 1 . 2 . 3]" 1
1277 1 44 ALA HA 1 45 HIS HA . . 6.600 4.418 4.327 4.486 . 0 0 "[ . 1 . 2 . 3]" 1
1278 1 44 ALA HA 1 45 HIS HB2 . . 6.600 5.638 4.616 5.889 . 0 0 "[ . 1 . 2 . 3]" 1
1279 1 44 ALA HA 1 45 HIS HB3 . . 6.600 4.605 4.031 4.910 . 0 0 "[ . 1 . 2 . 3]" 1
1280 1 44 ALA HA 1 45 HIS HD2 . . 6.600 6.559 6.077 6.687 0.087 19 0 "[ . 1 . 2 . 3]" 1
1281 1 44 ALA MB 1 45 HIS HA . . 5.300 4.094 3.642 4.418 . 0 0 "[ . 1 . 2 . 3]" 1
1282 1 44 ALA MB 1 45 HIS QB . . 8.480 4.809 4.618 4.984 . 0 0 "[ . 1 . 2 . 3]" 1
1283 1 45 HIS H 1 45 HIS HD2 . . 6.600 4.502 3.850 4.784 . 0 0 "[ . 1 . 2 . 3]" 1
1284 1 45 HIS H 1 45 HIS HE1 . . 6.600 6.008 5.282 6.848 0.248 18 0 "[ . 1 . 2 . 3]" 1
1285 1 45 HIS H 1 46 ILE H . . 5.200 4.390 4.129 4.493 . 0 0 "[ . 1 . 2 . 3]" 1
1286 1 45 HIS H 1 46 ILE HB . . 6.600 6.264 5.892 6.522 . 0 0 "[ . 1 . 2 . 3]" 1
1287 1 45 HIS H 1 46 ILE MD . . 7.600 4.149 3.368 5.675 . 0 0 "[ . 1 . 2 . 3]" 1
1288 1 45 HIS H 1 47 LYS QG . . 7.480 6.536 5.998 6.761 . 0 0 "[ . 1 . 2 . 3]" 1
1289 1 45 HIS HA 1 45 HIS HE1 . . 6.600 6.532 5.111 6.657 0.057 22 0 "[ . 1 . 2 . 3]" 1
1290 1 45 HIS HA 1 46 ILE H . . 3.000 2.179 2.111 2.268 . 0 0 "[ . 1 . 2 . 3]" 1
1291 1 45 HIS HA 1 46 ILE HB . . 5.000 4.533 4.099 4.807 . 0 0 "[ . 1 . 2 . 3]" 1
1292 1 45 HIS HA 1 46 ILE MD . . 7.600 3.229 2.274 5.288 . 0 0 "[ . 1 . 2 . 3]" 1
1293 1 45 HIS HA 1 46 ILE QG . . 7.600 4.367 3.377 4.825 . 0 0 "[ . 1 . 2 . 3]" 1
1294 1 45 HIS QB 1 46 ILE H . . 5.920 3.140 2.464 4.000 . 0 0 "[ . 1 . 2 . 3]" 1
1295 1 45 HIS HB2 1 46 ILE H . . 6.600 3.256 2.495 4.416 . 0 0 "[ . 1 . 2 . 3]" 1
1296 1 45 HIS HB3 1 46 ILE H . . 6.600 4.286 3.823 4.625 . 0 0 "[ . 1 . 2 . 3]" 1
1297 1 45 HIS HD2 1 46 ILE H . . 6.600 3.186 2.663 3.879 . 0 0 "[ . 1 . 2 . 3]" 1
1298 1 45 HIS HD2 1 47 LYS QE . . 7.600 4.178 3.414 4.974 . 0 0 "[ . 1 . 2 . 3]" 1
1299 1 45 HIS HD2 1 47 LYS QG . . 7.480 2.593 2.421 3.041 . 0 0 "[ . 1 . 2 . 3]" 1
1300 1 45 HIS HE1 1 47 LYS QE . . 7.600 3.862 2.936 5.815 . 0 0 "[ . 1 . 2 . 3]" 1
1301 1 46 ILE H 1 47 LYS H . . 4.500 4.248 4.034 4.455 . 0 0 "[ . 1 . 2 . 3]" 1
1302 1 46 ILE H 1 58 ILE MD . . 7.600 5.671 5.073 6.347 . 0 0 "[ . 1 . 2 . 3]" 1
1303 1 46 ILE HA 1 47 LYS H . . 2.800 2.112 2.007 2.226 . 0 0 "[ . 1 . 2 . 3]" 1
1304 1 46 ILE HA 1 47 LYS HA . . 6.600 4.486 4.387 4.535 . 0 0 "[ . 1 . 2 . 3]" 1
1305 1 46 ILE HA 1 47 LYS QG . . 7.480 4.069 3.732 4.674 . 0 0 "[ . 1 . 2 . 3]" 1
1306 1 46 ILE HA 1 48 TYR QD . . 8.600 4.679 4.063 5.817 . 0 0 "[ . 1 . 2 . 3]" 1
1307 1 46 ILE HA 1 48 TYR QE . . 8.600 6.114 5.090 7.077 . 0 0 "[ . 1 . 2 . 3]" 1
1308 1 46 ILE HB 1 47 LYS H . . 4.100 4.156 4.004 4.290 0.190 13 0 "[ . 1 . 2 . 3]" 1
1309 1 46 ILE HB 1 48 TYR QD . . 8.600 3.183 2.209 4.402 . 0 0 "[ . 1 . 2 . 3]" 1
1310 1 46 ILE HB 1 48 TYR QE . . 8.600 3.789 2.530 5.183 . 0 0 "[ . 1 . 2 . 3]" 1
1311 1 46 ILE MD 1 47 LYS H . . 6.100 5.041 4.703 5.109 . 0 0 "[ . 1 . 2 . 3]" 1
1312 1 46 ILE QG 1 47 LYS H . . 6.900 4.174 3.470 4.437 . 0 0 "[ . 1 . 2 . 3]" 1
1313 1 46 ILE QG 1 47 LYS HA . . 7.600 6.024 5.771 6.184 . 0 0 "[ . 1 . 2 . 3]" 1
1314 1 46 ILE QG 1 48 TYR HA . . 7.600 6.788 6.691 6.846 . 0 0 "[ . 1 . 2 . 3]" 1
1315 1 46 ILE QG 1 48 TYR HB2 . . 7.600 6.150 5.911 6.739 . 0 0 "[ . 1 . 2 . 3]" 1
1316 1 46 ILE QG 1 48 TYR HB3 . . 7.600 4.799 4.608 5.243 . 0 0 "[ . 1 . 2 . 3]" 1
1317 1 46 ILE QG 1 48 TYR QD . . 9.600 4.685 4.094 5.372 . 0 0 "[ . 1 . 2 . 3]" 1
1318 1 46 ILE QG 1 48 TYR QE . . 9.600 5.375 4.368 6.521 . 0 0 "[ . 1 . 2 . 3]" 1
1319 1 46 ILE QG 1 58 ILE MD . . 8.500 3.233 2.437 4.552 . 0 0 "[ . 1 . 2 . 3]" 1
1320 1 46 ILE MG 1 47 LYS H . . 6.500 2.674 2.361 3.145 . 0 0 "[ . 1 . 2 . 3]" 1
1321 1 46 ILE MG 1 48 TYR HA . . 7.600 3.896 3.567 4.131 . 0 0 "[ . 1 . 2 . 3]" 1
1322 1 46 ILE MG 1 48 TYR HB2 . . 7.600 3.518 3.373 3.950 . 0 0 "[ . 1 . 2 . 3]" 1
1323 1 46 ILE MG 1 48 TYR HB3 . . 7.600 2.125 2.010 2.476 . 0 0 "[ . 1 . 2 . 3]" 1
1324 1 46 ILE MG 1 48 TYR QD . . 9.600 2.358 2.053 3.235 . 0 0 "[ . 1 . 2 . 3]" 1
1325 1 46 ILE MG 1 48 TYR QE . . 9.600 3.815 3.259 4.532 . 0 0 "[ . 1 . 2 . 3]" 1
1326 1 46 ILE MG 1 50 PRO QD . . 8.480 6.101 4.831 6.361 . 0 0 "[ . 1 . 2 . 3]" 1
1327 1 46 ILE MG 1 58 ILE MD . . 8.600 2.151 1.915 2.395 . 0 0 "[ . 1 . 2 . 3]" 1
1328 1 46 ILE MG 1 58 ILE QG . . 8.480 3.358 2.292 3.990 . 0 0 "[ . 1 . 2 . 3]" 1
1329 1 46 ILE MG 1 58 ILE MG . . 8.600 2.966 2.212 3.774 . 0 0 "[ . 1 . 2 . 3]" 1
1330 1 47 LYS H 1 48 TYR H . . 4.900 4.121 3.608 4.442 . 0 0 "[ . 1 . 2 . 3]" 1
1331 1 47 LYS H 1 58 ILE MD . . 7.600 5.671 5.191 5.985 . 0 0 "[ . 1 . 2 . 3]" 1
1332 1 47 LYS HA 1 48 TYR H . . 3.400 2.281 2.186 2.434 . 0 0 "[ . 1 . 2 . 3]" 1
1333 1 47 LYS HA 1 48 TYR HA . . 5.200 4.469 4.322 4.554 . 0 0 "[ . 1 . 2 . 3]" 1
1334 1 47 LYS HA 1 48 TYR QB . . 7.480 4.449 4.041 4.787 . 0 0 "[ . 1 . 2 . 3]" 1
1335 1 47 LYS HA 1 48 TYR QD . . 8.600 3.372 2.447 4.180 . 0 0 "[ . 1 . 2 . 3]" 1
1336 1 47 LYS HA 1 48 TYR QE . . 8.600 5.031 4.102 5.919 . 0 0 "[ . 1 . 2 . 3]" 1
1337 1 47 LYS QB 1 48 TYR H . . 5.900 3.474 2.882 3.896 . 0 0 "[ . 1 . 2 . 3]" 1
1338 1 47 LYS QB 1 48 TYR HA . . 6.440 4.265 4.104 4.592 . 0 0 "[ . 1 . 2 . 3]" 1
1339 1 47 LYS HB2 1 48 TYR H . . 6.300 4.327 3.827 4.695 . 0 0 "[ . 1 . 2 . 3]" 1
1340 1 47 LYS HB2 1 48 TYR HA . . 6.600 4.908 4.590 5.782 . 0 0 "[ . 1 . 2 . 3]" 1
1341 1 47 LYS HB3 1 48 TYR H . . 6.300 3.675 2.981 4.266 . 0 0 "[ . 1 . 2 . 3]" 1
1342 1 47 LYS HB3 1 48 TYR HA . . 6.600 4.701 4.512 4.887 . 0 0 "[ . 1 . 2 . 3]" 1
1343 1 47 LYS QD 1 48 TYR HA . . 7.000 6.127 5.017 6.354 . 0 0 "[ . 1 . 2 . 3]" 1
1344 1 47 LYS QG 1 48 TYR H . . 5.680 4.431 4.163 4.850 . 0 0 "[ . 1 . 2 . 3]" 1
1345 1 47 LYS QG 1 48 TYR HA . . 6.880 5.975 5.843 6.152 . 0 0 "[ . 1 . 2 . 3]" 1
1346 1 47 LYS HG2 1 48 TYR H . . 5.900 4.684 4.346 5.149 . 0 0 "[ . 1 . 2 . 3]" 1
1347 1 47 LYS HG3 1 48 TYR H . . 5.900 5.483 5.233 5.922 0.022 25 0 "[ . 1 . 2 . 3]" 1
1348 1 48 TYR H 1 48 TYR QE . . 7.300 4.161 3.628 4.885 . 0 0 "[ . 1 . 2 . 3]" 1
1349 1 48 TYR H 1 49 ASP H . . 4.900 4.389 4.172 4.546 . 0 0 "[ . 1 . 2 . 3]" 1
1350 1 48 TYR HA 1 49 ASP H . . 2.900 2.447 2.288 2.659 . 0 0 "[ . 1 . 2 . 3]" 1
1351 1 48 TYR HA 1 49 ASP HA . . 6.600 4.448 4.336 4.511 . 0 0 "[ . 1 . 2 . 3]" 1
1352 1 48 TYR HA 1 49 ASP QB . . 6.780 4.386 4.034 5.000 . 0 0 "[ . 1 . 2 . 3]" 1
1353 1 48 TYR HA 1 53 ILE MD . . 7.600 5.929 4.819 6.371 . 0 0 "[ . 1 . 2 . 3]" 1
1354 1 48 TYR HA 1 58 ILE MD . . 7.600 4.948 4.300 5.557 . 0 0 "[ . 1 . 2 . 3]" 1
1355 1 48 TYR QB 1 49 ASP H . . 3.990 2.531 2.055 3.079 . 0 0 "[ . 1 . 2 . 3]" 1
1356 1 48 TYR QB 1 50 PRO HA . . 7.480 4.824 4.259 5.433 . 0 0 "[ . 1 . 2 . 3]" 1
1357 1 48 TYR QB 1 52 ILE QG . . 8.480 4.927 4.448 5.506 . 0 0 "[ . 1 . 2 . 3]" 1
1358 1 48 TYR QB 1 53 ILE H . . 7.480 5.300 4.693 6.022 . 0 0 "[ . 1 . 2 . 3]" 1
1359 1 48 TYR QB 1 53 ILE MD . . 8.480 3.968 2.901 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
1360 1 48 TYR QB 1 53 ILE QG . . 7.750 4.881 3.920 5.635 . 0 0 "[ . 1 . 2 . 3]" 1
1361 1 48 TYR QB 1 53 ILE MG . . 8.480 2.661 2.042 3.205 . 0 0 "[ . 1 . 2 . 3]" 1
1362 1 48 TYR HB2 1 49 ASP H . . 4.600 2.565 2.068 3.149 . 0 0 "[ . 1 . 2 . 3]" 1
1363 1 48 TYR HB2 1 58 ILE MD . . 7.600 3.181 2.402 3.872 . 0 0 "[ . 1 . 2 . 3]" 1
1364 1 48 TYR HB3 1 49 ASP H . . 4.600 3.930 3.561 4.350 . 0 0 "[ . 1 . 2 . 3]" 1
1365 1 48 TYR HB3 1 58 ILE MD . . 7.600 3.012 2.515 3.593 . 0 0 "[ . 1 . 2 . 3]" 1
1366 1 48 TYR QD 1 49 ASP H . . 8.600 3.555 2.748 4.367 . 0 0 "[ . 1 . 2 . 3]" 1
1367 1 48 TYR QD 1 49 ASP HA . . 8.600 4.556 4.092 4.923 . 0 0 "[ . 1 . 2 . 3]" 1
1368 1 48 TYR QD 1 49 ASP QB . . 9.480 4.642 4.190 5.300 . 0 0 "[ . 1 . 2 . 3]" 1
1369 1 48 TYR QD 1 50 PRO HA . . 7.600 3.086 2.326 4.285 . 0 0 "[ . 1 . 2 . 3]" 1
1370 1 48 TYR QD 1 50 PRO HB2 . . 8.600 5.448 4.789 6.075 . 0 0 "[ . 1 . 2 . 3]" 1
1371 1 48 TYR QD 1 50 PRO QB . . 8.410 4.144 3.482 4.631 . 0 0 "[ . 1 . 2 . 3]" 1
1372 1 48 TYR QD 1 50 PRO HB3 . . 8.600 4.298 3.576 4.825 . 0 0 "[ . 1 . 2 . 3]" 1
1373 1 48 TYR QD 1 50 PRO HD2 . . 8.600 5.190 4.112 5.910 . 0 0 "[ . 1 . 2 . 3]" 1
1374 1 48 TYR QD 1 50 PRO HD3 . . 8.600 4.051 2.822 4.708 . 0 0 "[ . 1 . 2 . 3]" 1
1375 1 48 TYR QD 1 50 PRO QG . . 9.480 5.138 4.315 5.633 . 0 0 "[ . 1 . 2 . 3]" 1
1376 1 48 TYR QD 1 52 ILE QG . . 9.600 4.702 3.793 5.556 . 0 0 "[ . 1 . 2 . 3]" 1
1377 1 48 TYR QD 1 53 ILE H . . 8.600 4.404 3.782 5.195 . 0 0 "[ . 1 . 2 . 3]" 1
1378 1 48 TYR QD 1 53 ILE HA . . 8.600 5.877 5.568 6.517 . 0 0 "[ . 1 . 2 . 3]" 1
1379 1 48 TYR QD 1 53 ILE HB . . 8.600 4.872 4.518 5.730 . 0 0 "[ . 1 . 2 . 3]" 1
1380 1 48 TYR QD 1 53 ILE MD . . 9.600 4.191 3.312 4.938 . 0 0 "[ . 1 . 2 . 3]" 1
1381 1 48 TYR QD 1 53 ILE HG12 . . 8.600 4.341 3.460 4.905 . 0 0 "[ . 1 . 2 . 3]" 1
1382 1 48 TYR QD 1 53 ILE QG . . 7.750 4.208 3.403 4.675 . 0 0 "[ . 1 . 2 . 3]" 1
1383 1 48 TYR QD 1 53 ILE HG13 . . 8.600 5.695 5.041 6.021 . 0 0 "[ . 1 . 2 . 3]" 1
1384 1 48 TYR QD 1 53 ILE MG . . 9.600 2.104 1.956 2.653 . 0 0 "[ . 1 . 2 . 3]" 1
1385 1 48 TYR QD 1 54 GLY H . . 8.600 3.294 2.594 4.441 . 0 0 "[ . 1 . 2 . 3]" 1
1386 1 48 TYR QD 1 54 GLY HA2 . . 8.600 4.413 3.536 5.613 . 0 0 "[ . 1 . 2 . 3]" 1
1387 1 48 TYR QD 1 54 GLY QA . . 8.410 4.244 3.463 5.254 . 0 0 "[ . 1 . 2 . 3]" 1
1388 1 48 TYR QD 1 55 PRO HA . . 8.600 4.726 3.872 5.461 . 0 0 "[ . 1 . 2 . 3]" 1
1389 1 48 TYR QD 1 55 PRO QB . . 9.480 5.367 4.618 5.927 . 0 0 "[ . 1 . 2 . 3]" 1
1390 1 48 TYR QD 1 55 PRO HD2 . . 8.600 6.145 5.655 6.973 . 0 0 "[ . 1 . 2 . 3]" 1
1391 1 48 TYR QD 1 55 PRO HD3 . . 8.600 5.063 4.495 5.943 . 0 0 "[ . 1 . 2 . 3]" 1
1392 1 48 TYR QD 1 58 ILE HB . . 8.600 5.324 4.579 6.029 . 0 0 "[ . 1 . 2 . 3]" 1
1393 1 48 TYR QD 1 58 ILE MD . . 9.600 2.668 2.189 3.117 . 0 0 "[ . 1 . 2 . 3]" 1
1394 1 48 TYR QD 1 58 ILE QG . . 9.480 4.342 3.463 4.789 . 0 0 "[ . 1 . 2 . 3]" 1
1395 1 48 TYR QE 1 49 ASP H . . 8.600 5.455 4.863 5.931 . 0 0 "[ . 1 . 2 . 3]" 1
1396 1 48 TYR QE 1 49 ASP HA . . 8.600 5.564 4.958 6.149 . 0 0 "[ . 1 . 2 . 3]" 1
1397 1 48 TYR QE 1 49 ASP QB . . 9.480 5.976 5.548 6.344 . 0 0 "[ . 1 . 2 . 3]" 1
1398 1 48 TYR QE 1 50 PRO HA . . 7.300 2.400 2.123 3.128 . 0 0 "[ . 1 . 2 . 3]" 1
1399 1 48 TYR QE 1 50 PRO HB2 . . 8.600 4.120 3.653 4.506 . 0 0 "[ . 1 . 2 . 3]" 1
1400 1 48 TYR QE 1 50 PRO HB3 . . 8.600 2.982 2.390 3.723 . 0 0 "[ . 1 . 2 . 3]" 1
1401 1 48 TYR QE 1 50 PRO HD2 . . 8.600 5.386 4.533 6.056 . 0 0 "[ . 1 . 2 . 3]" 1
1402 1 48 TYR QE 1 50 PRO HD3 . . 8.600 4.086 3.189 4.933 . 0 0 "[ . 1 . 2 . 3]" 1
1403 1 48 TYR QE 1 50 PRO QG . . 9.480 4.457 3.667 5.071 . 0 0 "[ . 1 . 2 . 3]" 1
1404 1 48 TYR QE 1 52 ILE QG . . 9.600 5.889 5.011 6.564 . 0 0 "[ . 1 . 2 . 3]" 1
1405 1 48 TYR QE 1 53 ILE H . . 8.600 5.297 4.463 6.133 . 0 0 "[ . 1 . 2 . 3]" 1
1406 1 48 TYR QE 1 53 ILE HA . . 8.600 6.437 5.774 7.305 . 0 0 "[ . 1 . 2 . 3]" 1
1407 1 48 TYR QE 1 53 ILE MD . . 9.600 5.351 4.492 6.278 . 0 0 "[ . 1 . 2 . 3]" 1
1408 1 48 TYR QE 1 53 ILE HG12 . . 8.600 4.905 3.551 5.702 . 0 0 "[ . 1 . 2 . 3]" 1
1409 1 48 TYR QE 1 53 ILE HG13 . . 8.600 6.369 5.205 7.152 . 0 0 "[ . 1 . 2 . 3]" 1
1410 1 48 TYR QE 1 53 ILE MG . . 9.600 3.245 2.237 4.158 . 0 0 "[ . 1 . 2 . 3]" 1
1411 1 48 TYR QE 1 54 GLY H . . 8.600 3.246 2.307 4.079 . 0 0 "[ . 1 . 2 . 3]" 1
1412 1 48 TYR QE 1 54 GLY HA2 . . 8.600 2.930 2.306 4.380 . 0 0 "[ . 1 . 2 . 3]" 1
1413 1 48 TYR QE 1 54 GLY QA . . 8.360 2.875 2.290 4.216 . 0 0 "[ . 1 . 2 . 3]" 1
1414 1 48 TYR QE 1 55 PRO HA . . 8.600 3.158 2.556 3.610 . 0 0 "[ . 1 . 2 . 3]" 1
1415 1 48 TYR QE 1 55 PRO QB . . 9.480 3.574 2.935 4.126 . 0 0 "[ . 1 . 2 . 3]" 1
1416 1 48 TYR QE 1 55 PRO HD2 . . 8.600 4.123 3.658 4.779 . 0 0 "[ . 1 . 2 . 3]" 1
1417 1 48 TYR QE 1 55 PRO HD3 . . 8.600 2.835 2.252 3.768 . 0 0 "[ . 1 . 2 . 3]" 1
1418 1 48 TYR QE 1 58 ILE MD . . 9.600 3.002 2.380 3.816 . 0 0 "[ . 1 . 2 . 3]" 1
1419 1 49 ASP H 1 50 PRO HD2 . . 6.600 4.853 4.253 5.067 . 0 0 "[ . 1 . 2 . 3]" 1
1420 1 49 ASP H 1 50 PRO HD3 . . 6.600 4.565 4.007 4.896 . 0 0 "[ . 1 . 2 . 3]" 1
1421 1 49 ASP H 1 51 GLU H . . 6.600 5.530 4.800 6.618 0.018 23 0 "[ . 1 . 2 . 3]" 1
1422 1 49 ASP H 1 52 ILE H . . 6.600 5.460 4.861 6.284 . 0 0 "[ . 1 . 2 . 3]" 1
1423 1 49 ASP H 1 52 ILE HB . . 6.600 6.617 6.319 6.706 0.106 23 0 "[ . 1 . 2 . 3]" 1
1424 1 49 ASP H 1 52 ILE MG . . 7.600 5.999 5.390 6.354 . 0 0 "[ . 1 . 2 . 3]" 1
1425 1 49 ASP H 1 53 ILE H . . 6.600 5.016 4.171 6.372 . 0 0 "[ . 1 . 2 . 3]" 1
1426 1 49 ASP H 1 53 ILE HB . . 6.600 5.654 4.275 6.612 0.012 24 0 "[ . 1 . 2 . 3]" 1
1427 1 49 ASP H 1 53 ILE MD . . 7.600 5.489 4.256 6.282 . 0 0 "[ . 1 . 2 . 3]" 1
1428 1 49 ASP H 1 53 ILE MG . . 7.600 3.316 2.444 4.422 . 0 0 "[ . 1 . 2 . 3]" 1
1429 1 49 ASP H 1 58 ILE MD . . 7.600 5.240 4.212 6.095 . 0 0 "[ . 1 . 2 . 3]" 1
1430 1 49 ASP HA 1 51 GLU H . . 6.600 3.915 3.360 4.835 . 0 0 "[ . 1 . 2 . 3]" 1
1431 1 49 ASP HA 1 53 ILE MG . . 7.600 4.856 4.091 5.378 . 0 0 "[ . 1 . 2 . 3]" 1
1432 1 49 ASP QB 1 50 PRO HA . . 5.660 4.864 4.582 5.057 . 0 0 "[ . 1 . 2 . 3]" 1
1433 1 49 ASP QB 1 51 GLU H . . 6.390 3.682 2.870 4.399 . 0 0 "[ . 1 . 2 . 3]" 1
1434 1 49 ASP QB 1 52 ILE HA . . 6.680 5.485 5.041 5.960 . 0 0 "[ . 1 . 2 . 3]" 1
1435 1 49 ASP QB 1 52 ILE HB . . 5.680 4.665 4.326 5.079 . 0 0 "[ . 1 . 2 . 3]" 1
1436 1 49 ASP QB 1 52 ILE MD . . 8.480 2.248 1.980 3.395 . 0 0 "[ . 1 . 2 . 3]" 1
1437 1 49 ASP QB 1 52 ILE QG . . 8.480 2.136 1.938 2.392 . 0 0 "[ . 1 . 2 . 3]" 1
1438 1 49 ASP QB 1 52 ILE MG . . 8.480 3.703 3.260 4.194 . 0 0 "[ . 1 . 2 . 3]" 1
1439 1 49 ASP QB 1 53 ILE MG . . 6.180 3.542 2.558 4.358 . 0 0 "[ . 1 . 2 . 3]" 1
1440 1 49 ASP QB 1 54 GLY H . . 7.480 5.359 4.416 6.536 . 0 0 "[ . 1 . 2 . 3]" 1
1441 1 49 ASP HB2 1 51 GLU H . . 6.600 4.588 2.910 5.806 . 0 0 "[ . 1 . 2 . 3]" 1
1442 1 49 ASP HB2 1 52 ILE H . . 6.600 4.442 2.360 6.245 . 0 0 "[ . 1 . 2 . 3]" 1
1443 1 49 ASP HB2 1 53 ILE H . . 6.600 4.958 3.478 6.616 0.016 26 0 "[ . 1 . 2 . 3]" 1
1444 1 49 ASP HB3 1 51 GLU H . . 6.600 3.962 3.022 4.946 . 0 0 "[ . 1 . 2 . 3]" 1
1445 1 49 ASP HB3 1 52 ILE H . . 6.600 3.846 2.917 5.025 . 0 0 "[ . 1 . 2 . 3]" 1
1446 1 49 ASP HB3 1 53 ILE H . . 6.600 4.635 3.401 6.102 . 0 0 "[ . 1 . 2 . 3]" 1
1447 1 50 PRO HA 1 51 GLU HA . . 5.200 4.767 4.578 5.038 . 0 0 "[ . 1 . 2 . 3]" 1
1448 1 50 PRO HA 1 52 ILE H . . 6.600 4.195 3.629 5.174 . 0 0 "[ . 1 . 2 . 3]" 1
1449 1 50 PRO HA 1 53 ILE H . . 5.600 4.313 3.584 5.230 . 0 0 "[ . 1 . 2 . 3]" 1
1450 1 50 PRO HA 1 53 ILE HA . . 6.600 6.303 5.509 6.649 0.049 7 0 "[ . 1 . 2 . 3]" 1
1451 1 50 PRO HA 1 53 ILE MG . . 7.600 3.471 2.378 3.970 . 0 0 "[ . 1 . 2 . 3]" 1
1452 1 50 PRO HA 1 54 GLY QA . . 7.080 2.782 2.120 4.051 . 0 0 "[ . 1 . 2 . 3]" 1
1453 1 50 PRO HA 1 55 PRO QD . . 7.480 3.383 2.628 4.446 . 0 0 "[ . 1 . 2 . 3]" 1
1454 1 50 PRO HA 1 58 ILE MD . . 7.600 4.887 4.395 5.420 . 0 0 "[ . 1 . 2 . 3]" 1
1455 1 50 PRO QB 1 53 ILE H . . 7.480 5.803 5.111 6.676 . 0 0 "[ . 1 . 2 . 3]" 1
1456 1 50 PRO QD 1 51 GLU H . . 5.490 2.967 2.670 3.949 . 0 0 "[ . 1 . 2 . 3]" 1
1457 1 50 PRO QG 1 51 GLU H . . 5.370 2.804 2.067 4.280 . 0 0 "[ . 1 . 2 . 3]" 1
1458 1 51 GLU H 1 51 GLU HG2 . . 4.800 3.757 1.979 4.669 . 0 0 "[ . 1 . 2 . 3]" 1
1459 1 51 GLU H 1 51 GLU HG3 . . 4.800 3.223 1.972 4.625 . 0 0 "[ . 1 . 2 . 3]" 1
1460 1 51 GLU H 1 52 ILE H . . 2.900 2.657 2.003 2.979 0.079 26 0 "[ . 1 . 2 . 3]" 1
1461 1 51 GLU H 1 52 ILE QG . . 7.600 3.674 2.908 4.290 . 0 0 "[ . 1 . 2 . 3]" 1
1462 1 51 GLU H 1 52 ILE MG . . 7.600 4.449 3.851 4.984 . 0 0 "[ . 1 . 2 . 3]" 1
1463 1 51 GLU H 1 53 ILE MG . . 7.600 4.861 3.489 5.346 . 0 0 "[ . 1 . 2 . 3]" 1
1464 1 51 GLU QB 1 52 ILE QG . . 8.600 3.715 2.555 4.671 . 0 0 "[ . 1 . 2 . 3]" 1
1465 1 51 GLU QB 1 52 ILE MG . . 8.600 3.167 2.564 3.853 . 0 0 "[ . 1 . 2 . 3]" 1
1466 1 51 GLU QB 1 53 ILE H . . 7.600 5.171 4.351 6.084 . 0 0 "[ . 1 . 2 . 3]" 1
1467 1 51 GLU HG2 1 52 ILE H . . 6.600 4.697 3.191 5.506 . 0 0 "[ . 1 . 2 . 3]" 1
1468 1 51 GLU HG3 1 52 ILE H . . 6.600 4.540 2.304 5.285 . 0 0 "[ . 1 . 2 . 3]" 1
1469 1 52 ILE H 1 52 ILE MD . . 5.600 3.813 3.463 4.243 . 0 0 "[ . 1 . 2 . 3]" 1
1470 1 52 ILE H 1 53 ILE H . . 3.400 2.573 1.950 3.210 . 0 0 "[ . 1 . 2 . 3]" 1
1471 1 52 ILE H 1 53 ILE QG . . 7.480 6.132 5.462 6.670 . 0 0 "[ . 1 . 2 . 3]" 1
1472 1 52 ILE H 1 53 ILE MG . . 7.600 3.799 3.273 4.225 . 0 0 "[ . 1 . 2 . 3]" 1
1473 1 52 ILE HA 1 53 ILE H . . 3.500 3.539 3.503 3.577 0.077 11 0 "[ . 1 . 2 . 3]" 1
1474 1 52 ILE HB 1 53 ILE H . . 3.400 3.219 2.296 3.486 0.086 24 0 "[ . 1 . 2 . 3]" 1
1475 1 52 ILE HB 1 53 ILE MG . . 7.600 4.343 3.919 4.894 . 0 0 "[ . 1 . 2 . 3]" 1
1476 1 52 ILE MD 1 53 ILE H . . 7.500 3.527 2.365 3.881 . 0 0 "[ . 1 . 2 . 3]" 1
1477 1 52 ILE MD 1 53 ILE HA . . 7.600 5.011 4.101 5.483 . 0 0 "[ . 1 . 2 . 3]" 1
1478 1 52 ILE MD 1 53 ILE HB . . 7.600 3.940 3.001 4.542 . 0 0 "[ . 1 . 2 . 3]" 1
1479 1 52 ILE QG 1 53 ILE H . . 7.600 1.956 1.799 2.154 . 0 0 "[ . 1 . 2 . 3]" 1
1480 1 52 ILE QG 1 53 ILE MG . . 8.600 2.505 2.088 2.970 . 0 0 "[ . 1 . 2 . 3]" 1
1481 1 52 ILE QG 1 55 PRO QD . . 8.480 6.759 6.633 6.817 . 0 0 "[ . 1 . 2 . 3]" 1
1482 1 52 ILE MG 1 53 ILE H . . 7.600 4.012 3.784 4.189 . 0 0 "[ . 1 . 2 . 3]" 1
1483 1 53 ILE H 1 53 ILE MG . . 4.300 2.008 1.884 2.127 . 0 0 "[ . 1 . 2 . 3]" 1
1484 1 53 ILE H 1 54 GLY H . . 4.100 2.581 2.094 3.906 . 0 0 "[ . 1 . 2 . 3]" 1
1485 1 53 ILE HA 1 54 GLY QA . . 5.780 4.346 4.147 4.425 . 0 0 "[ . 1 . 2 . 3]" 1
1486 1 53 ILE HA 1 57 ASP H . . 6.600 6.004 5.215 6.626 0.026 22 0 "[ . 1 . 2 . 3]" 1
1487 1 53 ILE HA 1 57 ASP QB . . 6.980 4.224 3.566 4.816 . 0 0 "[ . 1 . 2 . 3]" 1
1488 1 53 ILE HB 1 54 GLY H . . 5.500 3.879 3.690 4.145 . 0 0 "[ . 1 . 2 . 3]" 1
1489 1 53 ILE HB 1 57 ASP QB . . 7.480 4.857 4.400 5.374 . 0 0 "[ . 1 . 2 . 3]" 1
1490 1 53 ILE HB 1 58 ILE MD . . 7.600 5.031 4.343 5.917 . 0 0 "[ . 1 . 2 . 3]" 1
1491 1 53 ILE MD 1 54 GLY H . . 7.600 4.409 3.192 4.794 . 0 0 "[ . 1 . 2 . 3]" 1
1492 1 53 ILE MD 1 57 ASP H . . 7.600 5.353 4.630 5.960 . 0 0 "[ . 1 . 2 . 3]" 1
1493 1 53 ILE MD 1 57 ASP HA . . 7.600 5.394 4.630 5.879 . 0 0 "[ . 1 . 2 . 3]" 1
1494 1 53 ILE MD 1 57 ASP HB2 . . 7.600 3.956 2.399 4.751 . 0 0 "[ . 1 . 2 . 3]" 1
1495 1 53 ILE MD 1 57 ASP HB3 . . 7.600 3.372 2.761 4.371 . 0 0 "[ . 1 . 2 . 3]" 1
1496 1 53 ILE QG 1 54 GLY H . . 3.960 3.272 1.956 3.562 . 0 0 "[ . 1 . 2 . 3]" 1
1497 1 53 ILE QG 1 54 GLY QA . . 8.350 4.001 3.559 4.314 . 0 0 "[ . 1 . 2 . 3]" 1
1498 1 53 ILE QG 1 57 ASP H . . 7.480 4.153 3.652 4.745 . 0 0 "[ . 1 . 2 . 3]" 1
1499 1 53 ILE QG 1 57 ASP QB . . 8.350 2.280 2.009 2.659 . 0 0 "[ . 1 . 2 . 3]" 1
1500 1 53 ILE QG 1 58 ILE H . . 7.480 3.692 3.154 4.393 . 0 0 "[ . 1 . 2 . 3]" 1
1501 1 53 ILE QG 1 58 ILE QG . . 7.850 3.053 2.281 4.003 . 0 0 "[ . 1 . 2 . 3]" 1
1502 1 53 ILE QG 1 58 ILE MG . . 8.480 5.477 4.881 6.298 . 0 0 "[ . 1 . 2 . 3]" 1
1503 1 53 ILE HG12 1 54 GLY H . . 4.300 3.412 1.967 3.789 . 0 0 "[ . 1 . 2 . 3]" 1
1504 1 53 ILE HG12 1 58 ILE MD . . 7.600 3.426 2.638 4.533 . 0 0 "[ . 1 . 2 . 3]" 1
1505 1 53 ILE HG13 1 54 GLY H . . 4.300 4.275 3.451 4.401 0.101 23 0 "[ . 1 . 2 . 3]" 1
1506 1 53 ILE HG13 1 58 ILE MD . . 7.600 4.812 4.053 5.830 . 0 0 "[ . 1 . 2 . 3]" 1
1507 1 53 ILE MG 1 54 GLY H . . 6.200 1.989 1.794 2.241 . 0 0 "[ . 1 . 2 . 3]" 1
1508 1 53 ILE MG 1 57 ASP H . . 7.600 5.503 5.090 5.984 . 0 0 "[ . 1 . 2 . 3]" 1
1509 1 53 ILE MG 1 58 ILE H . . 7.600 4.836 4.473 5.152 . 0 0 "[ . 1 . 2 . 3]" 1
1510 1 53 ILE MG 1 58 ILE HA . . 7.600 6.055 5.466 6.340 . 0 0 "[ . 1 . 2 . 3]" 1
1511 1 53 ILE MG 1 58 ILE MD . . 8.600 2.776 2.210 3.405 . 0 0 "[ . 1 . 2 . 3]" 1
1512 1 53 ILE MG 1 58 ILE MG . . 8.600 5.340 4.853 5.742 . 0 0 "[ . 1 . 2 . 3]" 1
1513 1 54 GLY H 1 55 PRO QD . . 6.880 4.010 3.569 4.154 . 0 0 "[ . 1 . 2 . 3]" 1
1514 1 54 GLY H 1 57 ASP H . . 6.300 5.618 4.338 5.927 . 0 0 "[ . 1 . 2 . 3]" 1
1515 1 54 GLY H 1 57 ASP HB2 . . 6.000 5.603 3.040 6.044 0.044 4 0 "[ . 1 . 2 . 3]" 1
1516 1 54 GLY H 1 57 ASP HB3 . . 6.000 5.217 4.344 6.034 0.034 18 0 "[ . 1 . 2 . 3]" 1
1517 1 54 GLY H 1 58 ILE H . . 6.600 5.837 4.300 6.313 . 0 0 "[ . 1 . 2 . 3]" 1
1518 1 54 GLY H 1 58 ILE MD . . 7.600 4.334 3.723 5.320 . 0 0 "[ . 1 . 2 . 3]" 1
1519 1 54 GLY H 1 58 ILE QG . . 7.480 5.291 3.968 6.268 . 0 0 "[ . 1 . 2 . 3]" 1
1520 1 54 GLY QA 1 57 ASP H . . 6.480 3.917 3.207 4.238 . 0 0 "[ . 1 . 2 . 3]" 1
1521 1 54 GLY QA 1 57 ASP QB . . 8.350 4.162 3.098 4.526 . 0 0 "[ . 1 . 2 . 3]" 1
1522 1 54 GLY HA2 1 58 ILE MD . . 7.600 4.914 4.462 6.046 . 0 0 "[ . 1 . 2 . 3]" 1
1523 1 55 PRO HA 1 57 ASP H . . 6.600 4.599 4.187 5.028 . 0 0 "[ . 1 . 2 . 3]" 1
1524 1 55 PRO HA 1 58 ILE H . . 6.000 3.731 3.418 4.250 . 0 0 "[ . 1 . 2 . 3]" 1
1525 1 55 PRO HA 1 58 ILE HB . . 5.300 2.784 2.602 3.002 . 0 0 "[ . 1 . 2 . 3]" 1
1526 1 55 PRO HA 1 58 ILE MD . . 7.300 2.817 2.399 3.660 . 0 0 "[ . 1 . 2 . 3]" 1
1527 1 55 PRO HA 1 58 ILE QG . . 7.480 4.110 3.536 4.593 . 0 0 "[ . 1 . 2 . 3]" 1
1528 1 55 PRO HA 1 58 ILE MG . . 7.600 3.956 3.742 4.120 . 0 0 "[ . 1 . 2 . 3]" 1
1529 1 55 PRO HA 1 59 ILE QG . . 7.600 4.165 3.693 5.587 . 0 0 "[ . 1 . 2 . 3]" 1
1530 1 55 PRO QD 1 56 ARG H . . 5.490 2.784 2.548 3.023 . 0 0 "[ . 1 . 2 . 3]" 1
1531 1 55 PRO QD 1 57 ASP H . . 7.280 4.773 4.324 4.973 . 0 0 "[ . 1 . 2 . 3]" 1
1532 1 55 PRO QD 1 58 ILE H . . 7.480 5.649 5.137 5.890 . 0 0 "[ . 1 . 2 . 3]" 1
1533 1 55 PRO QD 1 58 ILE HB . . 7.280 5.637 5.336 5.859 . 0 0 "[ . 1 . 2 . 3]" 1
1534 1 55 PRO QD 1 58 ILE MD . . 8.480 4.703 4.277 5.640 . 0 0 "[ . 1 . 2 . 3]" 1
1535 1 55 PRO QD 1 58 ILE QG . . 8.350 5.975 5.300 6.502 . 0 0 "[ . 1 . 2 . 3]" 1
1536 1 55 PRO QD 1 58 ILE MG . . 8.480 6.238 6.014 6.315 . 0 0 "[ . 1 . 2 . 3]" 1
1537 1 55 PRO QG 1 56 ARG HA . . 6.880 4.124 3.840 4.433 . 0 0 "[ . 1 . 2 . 3]" 1
1538 1 56 ARG H 1 57 ASP H . . 4.800 2.949 2.670 3.302 . 0 0 "[ . 1 . 2 . 3]" 1
1539 1 56 ARG H 1 58 ILE MD . . 7.600 5.445 4.755 6.343 . 0 0 "[ . 1 . 2 . 3]" 1
1540 1 56 ARG H 1 59 ILE H . . 6.600 4.801 4.740 4.905 . 0 0 "[ . 1 . 2 . 3]" 1
1541 1 56 ARG H 1 59 ILE MG . . 7.600 5.897 5.249 6.166 . 0 0 "[ . 1 . 2 . 3]" 1
1542 1 56 ARG HA 1 57 ASP HA . . 6.600 4.912 4.795 5.007 . 0 0 "[ . 1 . 2 . 3]" 1
1543 1 56 ARG HA 1 58 ILE H . . 6.200 4.732 4.527 4.989 . 0 0 "[ . 1 . 2 . 3]" 1
1544 1 56 ARG HA 1 58 ILE QG . . 7.480 6.477 6.030 6.681 . 0 0 "[ . 1 . 2 . 3]" 1
1545 1 56 ARG HA 1 59 ILE H . . 5.500 3.676 3.375 4.296 . 0 0 "[ . 1 . 2 . 3]" 1
1546 1 56 ARG HA 1 59 ILE MD . . 7.600 3.192 2.422 5.022 . 0 0 "[ . 1 . 2 . 3]" 1
1547 1 56 ARG HA 1 59 ILE QG . . 7.600 4.144 2.287 5.035 . 0 0 "[ . 1 . 2 . 3]" 1
1548 1 56 ARG HA 1 59 ILE MG . . 7.600 3.899 3.455 4.499 . 0 0 "[ . 1 . 2 . 3]" 1
1549 1 56 ARG HA 1 60 HIS H . . 4.700 3.808 3.509 4.139 . 0 0 "[ . 1 . 2 . 3]" 1
1550 1 56 ARG HA 1 60 HIS QB . . 7.500 4.822 4.018 5.659 . 0 0 "[ . 1 . 2 . 3]" 1
1551 1 56 ARG HA 1 60 HIS HD2 . . 6.600 4.210 3.153 6.606 0.006 10 0 "[ . 1 . 2 . 3]" 1
1552 1 56 ARG QB 1 57 ASP H . . 4.480 2.537 1.956 3.330 . 0 0 "[ . 1 . 2 . 3]" 1
1553 1 56 ARG QB 1 60 HIS HD2 . . 6.100 3.797 2.392 5.501 . 0 0 "[ . 1 . 2 . 3]" 1
1554 1 56 ARG HB2 1 60 HIS HD2 . . 6.600 4.999 3.144 6.619 0.019 10 0 "[ . 1 . 2 . 3]" 1
1555 1 56 ARG HB3 1 60 HIS HD2 . . 6.600 4.106 2.407 6.645 0.045 15 0 "[ . 1 . 2 . 3]" 1
1556 1 56 ARG QG 1 57 ASP H . . 6.100 3.780 1.857 4.508 . 0 0 "[ . 1 . 2 . 3]" 1
1557 1 56 ARG QG 1 58 ILE H . . 7.600 5.678 3.993 6.484 . 0 0 "[ . 1 . 2 . 3]" 1
1558 1 56 ARG QG 1 60 HIS HD2 . . 7.600 4.209 2.165 6.785 . 0 0 "[ . 1 . 2 . 3]" 1
1559 1 57 ASP H 1 58 ILE H . . 4.900 2.839 2.644 3.033 . 0 0 "[ . 1 . 2 . 3]" 1
1560 1 57 ASP H 1 58 ILE QG . . 7.480 4.615 4.089 5.113 . 0 0 "[ . 1 . 2 . 3]" 1
1561 1 57 ASP H 1 58 ILE MG . . 7.600 5.881 5.704 6.113 . 0 0 "[ . 1 . 2 . 3]" 1
1562 1 57 ASP H 1 59 ILE H . . 5.100 4.427 4.191 4.642 . 0 0 "[ . 1 . 2 . 3]" 1
1563 1 57 ASP H 1 59 ILE MG . . 7.600 6.272 5.861 6.366 . 0 0 "[ . 1 . 2 . 3]" 1
1564 1 57 ASP H 1 60 HIS H . . 6.600 4.787 4.601 4.874 . 0 0 "[ . 1 . 2 . 3]" 1
1565 1 57 ASP HA 1 60 HIS H . . 5.000 3.907 3.387 4.208 . 0 0 "[ . 1 . 2 . 3]" 1
1566 1 57 ASP HA 1 60 HIS QB . . 7.600 3.071 2.417 3.651 . 0 0 "[ . 1 . 2 . 3]" 1
1567 1 57 ASP HA 1 60 HIS HD2 . . 6.600 4.393 3.025 6.247 . 0 0 "[ . 1 . 2 . 3]" 1
1568 1 57 ASP HA 1 61 THR H . . 6.600 4.088 3.857 4.364 . 0 0 "[ . 1 . 2 . 3]" 1
1569 1 57 ASP QB 1 58 ILE HB . . 7.480 4.296 3.954 4.644 . 0 0 "[ . 1 . 2 . 3]" 1
1570 1 57 ASP QB 1 58 ILE MG . . 8.480 5.150 4.937 5.338 . 0 0 "[ . 1 . 2 . 3]" 1
1571 1 57 ASP HB2 1 58 ILE H . . 5.000 3.420 2.202 3.842 . 0 0 "[ . 1 . 2 . 3]" 1
1572 1 57 ASP HB3 1 58 ILE H . . 5.000 2.521 2.120 3.654 . 0 0 "[ . 1 . 2 . 3]" 1
1573 1 58 ILE H 1 58 ILE HB . . 4.000 2.323 2.178 2.534 . 0 0 "[ . 1 . 2 . 3]" 1
1574 1 58 ILE H 1 58 ILE MD . . 5.400 3.272 2.396 3.681 . 0 0 "[ . 1 . 2 . 3]" 1
1575 1 58 ILE H 1 58 ILE QG . . 3.680 2.229 1.971 2.463 . 0 0 "[ . 1 . 2 . 3]" 1
1576 1 58 ILE H 1 59 ILE H . . 3.700 2.959 2.823 3.140 . 0 0 "[ . 1 . 2 . 3]" 1
1577 1 58 ILE H 1 59 ILE MG . . 7.600 5.918 4.685 6.175 . 0 0 "[ . 1 . 2 . 3]" 1
1578 1 58 ILE H 1 60 HIS H . . 6.600 4.356 4.103 4.621 . 0 0 "[ . 1 . 2 . 3]" 1
1579 1 58 ILE HA 1 60 HIS H . . 5.100 4.624 4.322 4.881 . 0 0 "[ . 1 . 2 . 3]" 1
1580 1 58 ILE HA 1 61 THR H . . 5.300 3.496 3.211 3.733 . 0 0 "[ . 1 . 2 . 3]" 1
1581 1 58 ILE HA 1 61 THR HB . . 4.400 2.683 2.371 3.034 . 0 0 "[ . 1 . 2 . 3]" 1
1582 1 58 ILE HA 1 62 ILE H . . 6.600 3.889 3.659 4.148 . 0 0 "[ . 1 . 2 . 3]" 1
1583 1 58 ILE HA 1 69 PRO QG . . 7.480 6.719 6.678 6.779 . 0 0 "[ . 1 . 2 . 3]" 1
1584 1 58 ILE HB 1 59 ILE H . . 3.500 2.512 2.251 2.716 . 0 0 "[ . 1 . 2 . 3]" 1
1585 1 58 ILE MD 1 59 ILE H . . 7.600 4.444 4.089 4.767 . 0 0 "[ . 1 . 2 . 3]" 1
1586 1 58 ILE MD 1 62 ILE QG . . 8.600 5.229 4.572 6.004 . 0 0 "[ . 1 . 2 . 3]" 1
1587 1 58 ILE QG 1 59 ILE H . . 5.790 4.188 3.904 4.311 . 0 0 "[ . 1 . 2 . 3]" 1
1588 1 58 ILE QG 1 59 ILE HA . . 7.380 5.782 5.689 5.907 . 0 0 "[ . 1 . 2 . 3]" 1
1589 1 58 ILE QG 1 61 THR H . . 6.150 5.256 5.037 5.491 . 0 0 "[ . 1 . 2 . 3]" 1
1590 1 58 ILE QG 1 62 ILE H . . 7.480 5.598 5.406 5.820 . 0 0 "[ . 1 . 2 . 3]" 1
1591 1 58 ILE HG12 1 59 ILE H . . 6.600 5.020 4.759 5.164 . 0 0 "[ . 1 . 2 . 3]" 1
1592 1 58 ILE HG12 1 61 THR H . . 6.600 6.025 5.536 6.472 . 0 0 "[ . 1 . 2 . 3]" 1
1593 1 58 ILE HG13 1 59 ILE H . . 6.600 4.486 4.148 4.631 . 0 0 "[ . 1 . 2 . 3]" 1
1594 1 58 ILE HG13 1 61 THR H . . 6.600 5.813 5.490 6.299 . 0 0 "[ . 1 . 2 . 3]" 1
1595 1 58 ILE MG 1 59 ILE H . . 7.600 2.941 2.749 3.209 . 0 0 "[ . 1 . 2 . 3]" 1
1596 1 59 ILE H 1 59 ILE HB . . 4.000 2.399 2.173 3.756 . 0 0 "[ . 1 . 2 . 3]" 1
1597 1 59 ILE H 1 59 ILE MD . . 5.200 3.392 2.348 3.826 . 0 0 "[ . 1 . 2 . 3]" 1
1598 1 59 ILE H 1 59 ILE MG . . 4.500 3.644 2.368 3.759 . 0 0 "[ . 1 . 2 . 3]" 1
1599 1 59 ILE H 1 60 HIS H . . 3.900 2.900 2.771 3.040 . 0 0 "[ . 1 . 2 . 3]" 1
1600 1 59 ILE H 1 62 ILE MD . . 7.600 5.576 4.238 6.127 . 0 0 "[ . 1 . 2 . 3]" 1
1601 1 59 ILE HA 1 61 THR H . . 4.400 4.417 4.282 4.467 0.067 25 0 "[ . 1 . 2 . 3]" 1
1602 1 59 ILE HA 1 62 ILE H . . 6.600 3.540 3.070 3.732 . 0 0 "[ . 1 . 2 . 3]" 1
1603 1 59 ILE HA 1 62 ILE MD . . 7.400 4.416 2.481 5.370 . 0 0 "[ . 1 . 2 . 3]" 1
1604 1 59 ILE HA 1 62 ILE QG . . 7.600 3.567 2.683 4.303 . 0 0 "[ . 1 . 2 . 3]" 1
1605 1 59 ILE HA 1 63 GLU H . . 6.600 3.881 3.473 4.088 . 0 0 "[ . 1 . 2 . 3]" 1
1606 1 59 ILE HA 1 69 PRO QB . . 7.600 3.027 2.689 3.457 . 0 0 "[ . 1 . 2 . 3]" 1
1607 1 59 ILE HA 1 69 PRO QG . . 6.980 2.869 2.438 3.137 . 0 0 "[ . 1 . 2 . 3]" 1
1608 1 59 ILE HB 1 60 HIS H . . 4.600 2.838 2.501 4.052 . 0 0 "[ . 1 . 2 . 3]" 1
1609 1 59 ILE HB 1 61 THR H . . 6.600 5.148 4.865 5.879 . 0 0 "[ . 1 . 2 . 3]" 1
1610 1 59 ILE HB 1 69 PRO QG . . 7.480 4.474 2.008 4.810 . 0 0 "[ . 1 . 2 . 3]" 1
1611 1 59 ILE MD 1 60 HIS H . . 6.800 4.524 2.474 4.951 . 0 0 "[ . 1 . 2 . 3]" 1
1612 1 59 ILE MD 1 69 PRO QB . . 8.600 3.940 2.127 4.679 . 0 0 "[ . 1 . 2 . 3]" 1
1613 1 59 ILE MD 1 69 PRO QG . . 8.480 4.318 3.089 4.874 . 0 0 "[ . 1 . 2 . 3]" 1
1614 1 59 ILE MD 1 71 LEU H . . 7.600 4.904 3.998 6.340 . 0 0 "[ . 1 . 2 . 3]" 1
1615 1 59 ILE QG 1 60 HIS H . . 6.900 4.209 2.500 4.601 . 0 0 "[ . 1 . 2 . 3]" 1
1616 1 59 ILE QG 1 61 THR H . . 7.600 5.667 4.952 6.140 . 0 0 "[ . 1 . 2 . 3]" 1
1617 1 59 ILE QG 1 62 ILE MD . . 8.600 5.402 3.467 6.411 . 0 0 "[ . 1 . 2 . 3]" 1
1618 1 59 ILE QG 1 70 SER H . . 7.600 5.983 4.827 6.808 . 0 0 "[ . 1 . 2 . 3]" 1
1619 1 59 ILE MG 1 60 HIS H . . 6.600 3.172 2.763 4.332 . 0 0 "[ . 1 . 2 . 3]" 1
1620 1 59 ILE MG 1 60 HIS HA . . 7.600 3.418 3.064 5.694 . 0 0 "[ . 1 . 2 . 3]" 1
1621 1 59 ILE MG 1 60 HIS QB . . 8.600 4.353 3.478 5.801 . 0 0 "[ . 1 . 2 . 3]" 1
1622 1 59 ILE MG 1 60 HIS HD2 . . 7.600 4.530 2.349 6.351 . 0 0 "[ . 1 . 2 . 3]" 1
1623 1 59 ILE MG 1 61 THR H . . 7.600 4.952 4.744 5.622 . 0 0 "[ . 1 . 2 . 3]" 1
1624 1 59 ILE MG 1 63 GLU H . . 7.600 4.114 3.964 5.060 . 0 0 "[ . 1 . 2 . 3]" 1
1625 1 59 ILE MG 1 63 GLU QG . . 8.480 4.596 4.161 6.292 . 0 0 "[ . 1 . 2 . 3]" 1
1626 1 59 ILE MG 1 68 GLU HA . . 7.600 6.008 5.607 6.415 . 0 0 "[ . 1 . 2 . 3]" 1
1627 1 59 ILE MG 1 69 PRO HG2 . . 7.400 2.319 2.156 2.983 . 0 0 "[ . 1 . 2 . 3]" 1
1628 1 59 ILE MG 1 69 PRO QG . . 6.630 2.220 2.013 2.590 . 0 0 "[ . 1 . 2 . 3]" 1
1629 1 59 ILE MG 1 69 PRO HG3 . . 7.400 2.946 2.404 3.318 . 0 0 "[ . 1 . 2 . 3]" 1
1630 1 59 ILE MG 1 70 SER H . . 7.600 5.630 4.315 6.352 . 0 0 "[ . 1 . 2 . 3]" 1
1631 1 59 ILE MG 1 70 SER HA . . 7.600 5.011 4.004 5.895 . 0 0 "[ . 1 . 2 . 3]" 1
1632 1 60 HIS H 1 60 HIS HD2 . . 6.600 3.557 2.390 5.032 . 0 0 "[ . 1 . 2 . 3]" 1
1633 1 60 HIS H 1 61 THR H . . 4.800 2.675 2.465 2.786 . 0 0 "[ . 1 . 2 . 3]" 1
1634 1 60 HIS H 1 62 ILE H . . 4.700 4.318 4.012 4.545 . 0 0 "[ . 1 . 2 . 3]" 1
1635 1 60 HIS H 1 62 ILE MD . . 7.600 6.198 5.363 6.442 . 0 0 "[ . 1 . 2 . 3]" 1
1636 1 60 HIS HA 1 60 HIS HE1 . . 6.300 4.957 4.470 6.083 . 0 0 "[ . 1 . 2 . 3]" 1
1637 1 60 HIS HA 1 61 THR HA . . 6.600 4.785 4.703 4.820 . 0 0 "[ . 1 . 2 . 3]" 1
1638 1 60 HIS HA 1 63 GLU H . . 6.600 3.434 3.154 3.825 . 0 0 "[ . 1 . 2 . 3]" 1
1639 1 60 HIS HA 1 63 GLU HB2 . . 6.600 3.078 2.591 3.687 . 0 0 "[ . 1 . 2 . 3]" 1
1640 1 60 HIS HA 1 63 GLU QB . . 5.920 2.283 2.088 2.795 . 0 0 "[ . 1 . 2 . 3]" 1
1641 1 60 HIS HA 1 63 GLU HB3 . . 6.600 2.359 2.154 2.933 . 0 0 "[ . 1 . 2 . 3]" 1
1642 1 60 HIS HA 1 63 GLU HG2 . . 6.600 4.672 4.117 5.543 . 0 0 "[ . 1 . 2 . 3]" 1
1643 1 60 HIS HA 1 63 GLU QG . . 5.920 3.964 3.571 4.181 . 0 0 "[ . 1 . 2 . 3]" 1
1644 1 60 HIS HA 1 63 GLU HG3 . . 6.600 4.441 3.670 4.938 . 0 0 "[ . 1 . 2 . 3]" 1
1645 1 60 HIS HA 1 64 SER H . . 6.400 3.744 3.522 4.115 . 0 0 "[ . 1 . 2 . 3]" 1
1646 1 60 HIS QB 1 61 THR H . . 5.900 2.772 2.434 3.029 . 0 0 "[ . 1 . 2 . 3]" 1
1647 1 60 HIS QB 1 61 THR HB . . 7.600 4.961 4.476 5.218 . 0 0 "[ . 1 . 2 . 3]" 1
1648 1 61 THR H 1 61 THR HB . . 4.000 2.531 2.363 2.642 . 0 0 "[ . 1 . 2 . 3]" 1
1649 1 61 THR H 1 62 ILE H . . 3.100 2.741 2.552 2.908 . 0 0 "[ . 1 . 2 . 3]" 1
1650 1 61 THR H 1 62 ILE HA . . 6.600 5.339 5.221 5.470 . 0 0 "[ . 1 . 2 . 3]" 1
1651 1 61 THR H 1 62 ILE HB . . 5.300 4.924 4.553 5.299 . 0 0 "[ . 1 . 2 . 3]" 1
1652 1 61 THR H 1 62 ILE MD . . 7.600 4.975 4.569 5.626 . 0 0 "[ . 1 . 2 . 3]" 1
1653 1 61 THR H 1 63 GLU H . . 4.800 4.168 3.958 4.428 . 0 0 "[ . 1 . 2 . 3]" 1
1654 1 61 THR H 1 64 SER H . . 5.900 4.692 4.550 4.969 . 0 0 "[ . 1 . 2 . 3]" 1
1655 1 61 THR H 1 64 SER QB . . 7.480 4.794 4.622 5.324 . 0 0 "[ . 1 . 2 . 3]" 1
1656 1 61 THR HA 1 62 ILE HA . . 5.600 4.760 4.641 4.877 . 0 0 "[ . 1 . 2 . 3]" 1
1657 1 61 THR HA 1 63 GLU H . . 6.600 4.630 4.450 4.836 . 0 0 "[ . 1 . 2 . 3]" 1
1658 1 61 THR HA 1 64 SER H . . 6.600 3.581 3.396 3.818 . 0 0 "[ . 1 . 2 . 3]" 1
1659 1 61 THR HA 1 64 SER QB . . 5.680 2.646 2.443 3.055 . 0 0 "[ . 1 . 2 . 3]" 1
1660 1 61 THR HB 1 62 ILE H . . 3.400 2.546 2.404 2.686 . 0 0 "[ . 1 . 2 . 3]" 1
1661 1 61 THR HB 1 62 ILE HA . . 5.100 4.372 4.245 4.545 . 0 0 "[ . 1 . 2 . 3]" 1
1662 1 61 THR HB 1 62 ILE QG . . 7.600 3.237 2.833 3.554 . 0 0 "[ . 1 . 2 . 3]" 1
1663 1 61 THR HB 1 62 ILE MG . . 7.600 5.448 5.238 5.670 . 0 0 "[ . 1 . 2 . 3]" 1
1664 1 61 THR HB 1 63 GLU H . . 6.300 5.093 4.911 5.260 . 0 0 "[ . 1 . 2 . 3]" 1
1665 1 61 THR MG 1 62 ILE H . . 5.800 3.401 3.130 3.619 . 0 0 "[ . 1 . 2 . 3]" 1
1666 1 61 THR MG 1 62 ILE HA . . 7.600 3.480 3.122 3.826 . 0 0 "[ . 1 . 2 . 3]" 1
1667 1 61 THR MG 1 62 ILE QG . . 8.600 3.705 3.053 4.246 . 0 0 "[ . 1 . 2 . 3]" 1
1668 1 61 THR MG 1 65 LEU H . . 7.600 4.041 3.758 4.620 . 0 0 "[ . 1 . 2 . 3]" 1
1669 1 62 ILE H 1 62 ILE HB . . 3.700 2.488 2.274 2.645 . 0 0 "[ . 1 . 2 . 3]" 1
1670 1 62 ILE H 1 62 ILE MD . . 5.000 3.042 2.627 3.556 . 0 0 "[ . 1 . 2 . 3]" 1
1671 1 62 ILE H 1 63 GLU H . . 3.100 2.765 2.562 2.926 . 0 0 "[ . 1 . 2 . 3]" 1
1672 1 62 ILE H 1 63 GLU QB . . 7.480 4.249 4.030 4.442 . 0 0 "[ . 1 . 2 . 3]" 1
1673 1 62 ILE H 1 63 GLU QG . . 7.480 6.225 6.034 6.387 . 0 0 "[ . 1 . 2 . 3]" 1
1674 1 62 ILE H 1 64 SER H . . 6.500 4.310 3.985 4.717 . 0 0 "[ . 1 . 2 . 3]" 1
1675 1 62 ILE H 1 65 LEU H . . 5.300 4.618 4.491 4.875 . 0 0 "[ . 1 . 2 . 3]" 1
1676 1 62 ILE H 1 69 PRO QB . . 7.600 4.913 4.542 5.344 . 0 0 "[ . 1 . 2 . 3]" 1
1677 1 62 ILE H 1 69 PRO QG . . 7.480 4.086 3.832 4.512 . 0 0 "[ . 1 . 2 . 3]" 1
1678 1 62 ILE HA 1 63 GLU HA . . 6.300 4.929 4.838 5.026 . 0 0 "[ . 1 . 2 . 3]" 1
1679 1 62 ILE HA 1 64 SER H . . 6.600 4.574 4.164 4.905 . 0 0 "[ . 1 . 2 . 3]" 1
1680 1 62 ILE HA 1 65 LEU H . . 4.200 3.190 2.859 3.687 . 0 0 "[ . 1 . 2 . 3]" 1
1681 1 62 ILE HA 1 65 LEU HB2 . . 5.700 2.598 2.235 3.502 . 0 0 "[ . 1 . 2 . 3]" 1
1682 1 62 ILE HA 1 65 LEU HB3 . . 5.700 3.681 2.198 4.525 . 0 0 "[ . 1 . 2 . 3]" 1
1683 1 62 ILE HA 1 65 LEU MD1 . . 7.600 3.229 2.217 4.950 . 0 0 "[ . 1 . 2 . 3]" 1
1684 1 62 ILE HA 1 65 LEU QD . . 7.140 2.566 2.212 3.670 . 0 0 "[ . 1 . 2 . 3]" 1
1685 1 62 ILE HA 1 65 LEU MD2 . . 7.600 3.892 2.273 5.047 . 0 0 "[ . 1 . 2 . 3]" 1
1686 1 62 ILE HA 1 69 PRO QB . . 6.900 5.270 4.887 5.943 . 0 0 "[ . 1 . 2 . 3]" 1
1687 1 62 ILE HB 1 63 GLU H . . 3.200 2.766 2.458 3.072 . 0 0 "[ . 1 . 2 . 3]" 1
1688 1 62 ILE HB 1 63 GLU HA . . 6.600 4.615 4.395 4.781 . 0 0 "[ . 1 . 2 . 3]" 1
1689 1 62 ILE HB 1 64 SER H . . 6.600 5.331 4.996 5.748 . 0 0 "[ . 1 . 2 . 3]" 1
1690 1 62 ILE HB 1 69 PRO QG . . 7.480 2.500 2.218 3.174 . 0 0 "[ . 1 . 2 . 3]" 1
1691 1 62 ILE MD 1 63 GLU H . . 7.600 4.589 4.205 4.861 . 0 0 "[ . 1 . 2 . 3]" 1
1692 1 62 ILE MD 1 64 SER H . . 7.600 5.959 5.448 6.398 . 0 0 "[ . 1 . 2 . 3]" 1
1693 1 62 ILE MD 1 66 GLY H . . 7.600 6.215 5.762 6.433 . 0 0 "[ . 1 . 2 . 3]" 1
1694 1 62 ILE MD 1 67 PHE H . . 7.600 6.103 5.353 6.345 . 0 0 "[ . 1 . 2 . 3]" 1
1695 1 62 ILE MD 1 69 PRO QB . . 7.900 4.196 2.307 5.334 . 0 0 "[ . 1 . 2 . 3]" 1
1696 1 62 ILE MD 1 69 PRO QG . . 8.480 4.621 3.213 5.508 . 0 0 "[ . 1 . 2 . 3]" 1
1697 1 62 ILE QG 1 63 GLU H . . 7.200 4.183 3.994 4.412 . 0 0 "[ . 1 . 2 . 3]" 1
1698 1 62 ILE MG 1 63 GLU H . . 5.800 3.527 3.190 3.841 . 0 0 "[ . 1 . 2 . 3]" 1
1699 1 62 ILE MG 1 63 GLU HA . . 7.600 3.848 3.475 4.259 . 0 0 "[ . 1 . 2 . 3]" 1
1700 1 62 ILE MG 1 65 LEU H . . 7.600 4.582 4.149 5.001 . 0 0 "[ . 1 . 2 . 3]" 1
1701 1 62 ILE MG 1 66 GLY H . . 7.600 4.673 3.675 5.250 . 0 0 "[ . 1 . 2 . 3]" 1
1702 1 62 ILE MG 1 67 PHE H . . 5.800 3.809 2.941 4.363 . 0 0 "[ . 1 . 2 . 3]" 1
1703 1 62 ILE MG 1 67 PHE HB2 . . 7.600 2.228 2.017 2.485 . 0 0 "[ . 1 . 2 . 3]" 1
1704 1 62 ILE MG 1 67 PHE HB3 . . 7.600 3.346 2.892 3.844 . 0 0 "[ . 1 . 2 . 3]" 1
1705 1 62 ILE MG 1 67 PHE QD . . 9.600 2.487 2.217 3.088 . 0 0 "[ . 1 . 2 . 3]" 1
1706 1 62 ILE MG 1 67 PHE QE . . 9.600 4.204 3.643 4.771 . 0 0 "[ . 1 . 2 . 3]" 1
1707 1 62 ILE MG 1 67 PHE HZ . . 7.600 5.911 5.432 6.342 . 0 0 "[ . 1 . 2 . 3]" 1
1708 1 62 ILE MG 1 68 GLU H . . 7.000 4.502 4.107 4.973 . 0 0 "[ . 1 . 2 . 3]" 1
1709 1 62 ILE MG 1 68 GLU HA . . 7.600 4.809 4.062 5.434 . 0 0 "[ . 1 . 2 . 3]" 1
1710 1 62 ILE MG 1 69 PRO HA . . 7.600 3.822 3.341 4.351 . 0 0 "[ . 1 . 2 . 3]" 1
1711 1 62 ILE MG 1 69 PRO QB . . 8.600 2.492 2.061 3.412 . 0 0 "[ . 1 . 2 . 3]" 1
1712 1 62 ILE MG 1 69 PRO QD . . 8.600 2.483 2.167 3.079 . 0 0 "[ . 1 . 2 . 3]" 1
1713 1 62 ILE MG 1 69 PRO HG2 . . 7.600 4.333 3.865 5.342 . 0 0 "[ . 1 . 2 . 3]" 1
1714 1 62 ILE MG 1 69 PRO QG . . 7.300 2.996 2.505 4.085 . 0 0 "[ . 1 . 2 . 3]" 1
1715 1 62 ILE MG 1 69 PRO HG3 . . 7.600 3.057 2.538 4.240 . 0 0 "[ . 1 . 2 . 3]" 1
1716 1 63 GLU H 1 63 GLU HG2 . . 4.300 4.356 4.305 4.399 0.099 13 0 "[ . 1 . 2 . 3]" 1
1717 1 63 GLU H 1 63 GLU HG3 . . 4.300 4.334 4.193 4.395 0.095 11 0 "[ . 1 . 2 . 3]" 1
1718 1 63 GLU H 1 64 SER H . . 3.000 2.844 2.679 2.988 . 0 0 "[ . 1 . 2 . 3]" 1
1719 1 63 GLU H 1 64 SER HA . . 6.400 5.407 5.309 5.514 . 0 0 "[ . 1 . 2 . 3]" 1
1720 1 63 GLU H 1 64 SER QB . . 7.480 4.570 4.381 5.103 . 0 0 "[ . 1 . 2 . 3]" 1
1721 1 63 GLU H 1 65 LEU H . . 6.600 4.133 3.902 4.373 . 0 0 "[ . 1 . 2 . 3]" 1
1722 1 63 GLU H 1 67 PHE H . . 6.600 5.002 4.656 5.216 . 0 0 "[ . 1 . 2 . 3]" 1
1723 1 63 GLU H 1 69 PRO QB . . 7.600 4.293 4.026 4.755 . 0 0 "[ . 1 . 2 . 3]" 1
1724 1 63 GLU H 1 69 PRO QG . . 7.480 2.584 2.287 3.280 . 0 0 "[ . 1 . 2 . 3]" 1
1725 1 63 GLU HA 1 64 SER HA . . 6.600 4.817 4.679 4.899 . 0 0 "[ . 1 . 2 . 3]" 1
1726 1 63 GLU HA 1 65 LEU H . . 6.600 4.516 4.040 4.790 . 0 0 "[ . 1 . 2 . 3]" 1
1727 1 63 GLU HA 1 66 GLY H . . 6.200 3.853 3.646 4.062 . 0 0 "[ . 1 . 2 . 3]" 1
1728 1 63 GLU HA 1 67 PHE H . . 3.800 3.102 2.888 3.429 . 0 0 "[ . 1 . 2 . 3]" 1
1729 1 63 GLU HA 1 69 PRO QD . . 7.600 2.534 2.249 3.161 . 0 0 "[ . 1 . 2 . 3]" 1
1730 1 63 GLU HA 1 69 PRO QG . . 7.480 3.371 2.882 4.316 . 0 0 "[ . 1 . 2 . 3]" 1
1731 1 63 GLU QB 1 64 SER H . . 3.340 2.191 2.073 2.399 . 0 0 "[ . 1 . 2 . 3]" 1
1732 1 63 GLU QB 1 64 SER QB . . 8.350 3.733 3.564 4.342 . 0 0 "[ . 1 . 2 . 3]" 1
1733 1 63 GLU QB 1 67 PHE H . . 7.480 5.024 4.857 5.253 . 0 0 "[ . 1 . 2 . 3]" 1
1734 1 63 GLU QB 1 69 PRO HA . . 7.480 6.227 5.905 6.700 . 0 0 "[ . 1 . 2 . 3]" 1
1735 1 63 GLU QB 1 69 PRO QD . . 8.480 2.972 2.635 3.253 . 0 0 "[ . 1 . 2 . 3]" 1
1736 1 63 GLU HB2 1 64 SER H . . 3.600 3.623 3.603 3.666 0.066 10 0 "[ . 1 . 2 . 3]" 1
1737 1 63 GLU HB3 1 64 SER H . . 3.600 2.209 2.086 2.434 . 0 0 "[ . 1 . 2 . 3]" 1
1738 1 63 GLU QG 1 64 SER H . . 7.480 3.557 3.104 4.164 . 0 0 "[ . 1 . 2 . 3]" 1
1739 1 63 GLU QG 1 67 PHE H . . 7.480 4.810 4.402 5.275 . 0 0 "[ . 1 . 2 . 3]" 1
1740 1 63 GLU QG 1 68 GLU HA . . 6.440 4.325 3.590 5.105 . 0 0 "[ . 1 . 2 . 3]" 1
1741 1 63 GLU HG2 1 68 GLU HA . . 6.600 5.391 3.676 6.393 . 0 0 "[ . 1 . 2 . 3]" 1
1742 1 63 GLU HG2 1 69 PRO QD . . 7.600 4.239 2.732 5.188 . 0 0 "[ . 1 . 2 . 3]" 1
1743 1 63 GLU HG3 1 68 GLU HA . . 6.600 4.886 3.921 6.229 . 0 0 "[ . 1 . 2 . 3]" 1
1744 1 63 GLU HG3 1 69 PRO QD . . 7.600 3.644 2.887 4.580 . 0 0 "[ . 1 . 2 . 3]" 1
1745 1 64 SER H 1 64 SER HB2 . . 4.000 2.451 2.338 2.636 . 0 0 "[ . 1 . 2 . 3]" 1
1746 1 64 SER H 1 64 SER QB . . 3.800 2.261 2.169 2.575 . 0 0 "[ . 1 . 2 . 3]" 1
1747 1 64 SER H 1 64 SER HB3 . . 4.000 2.689 2.510 3.621 . 0 0 "[ . 1 . 2 . 3]" 1
1748 1 64 SER H 1 65 LEU H . . 3.200 2.865 2.599 3.065 . 0 0 "[ . 1 . 2 . 3]" 1
1749 1 64 SER H 1 65 LEU HA . . 6.600 5.471 5.262 5.625 . 0 0 "[ . 1 . 2 . 3]" 1
1750 1 64 SER H 1 65 LEU MD1 . . 7.600 5.736 4.510 6.352 . 0 0 "[ . 1 . 2 . 3]" 1
1751 1 64 SER H 1 65 LEU MD2 . . 7.600 5.717 4.408 6.331 . 0 0 "[ . 1 . 2 . 3]" 1
1752 1 64 SER H 1 66 GLY H . . 5.300 4.217 3.989 4.371 . 0 0 "[ . 1 . 2 . 3]" 1
1753 1 64 SER HA 1 64 SER QB . . 2.600 2.340 2.321 2.352 . 0 0 "[ . 1 . 2 . 3]" 1
1754 1 64 SER HA 1 66 GLY H . . 6.600 3.844 3.476 4.479 . 0 0 "[ . 1 . 2 . 3]" 1
1755 1 64 SER HA 1 66 GLY QA . . 7.480 4.556 4.245 4.781 . 0 0 "[ . 1 . 2 . 3]" 1
1756 1 64 SER HA 1 67 PHE H . . 6.600 5.456 4.767 5.982 . 0 0 "[ . 1 . 2 . 3]" 1
1757 1 64 SER QB 1 65 LEU H . . 4.210 2.800 2.575 3.427 . 0 0 "[ . 1 . 2 . 3]" 1
1758 1 64 SER QB 1 66 GLY H . . 7.480 4.663 4.464 4.967 . 0 0 "[ . 1 . 2 . 3]" 1
1759 1 64 SER HB2 1 65 LEU H . . 4.500 3.922 2.779 4.453 . 0 0 "[ . 1 . 2 . 3]" 1
1760 1 64 SER HB3 1 65 LEU H . . 4.500 2.962 2.615 4.039 . 0 0 "[ . 1 . 2 . 3]" 1
1761 1 65 LEU H 1 65 LEU HB2 . . 4.100 2.391 2.144 2.587 . 0 0 "[ . 1 . 2 . 3]" 1
1762 1 65 LEU H 1 65 LEU HB3 . . 4.100 3.355 2.486 3.696 . 0 0 "[ . 1 . 2 . 3]" 1
1763 1 65 LEU H 1 65 LEU MD1 . . 5.100 3.697 2.492 4.249 . 0 0 "[ . 1 . 2 . 3]" 1
1764 1 65 LEU H 1 65 LEU MD2 . . 5.100 3.610 2.351 4.190 . 0 0 "[ . 1 . 2 . 3]" 1
1765 1 65 LEU H 1 65 LEU HG . . 4.600 3.231 2.323 4.572 . 0 0 "[ . 1 . 2 . 3]" 1
1766 1 65 LEU H 1 66 GLY H . . 3.200 2.728 2.390 2.917 . 0 0 "[ . 1 . 2 . 3]" 1
1767 1 65 LEU H 1 67 PHE H . . 4.500 4.328 3.437 4.543 0.043 6 0 "[ . 1 . 2 . 3]" 1
1768 1 65 LEU H 1 67 PHE QD . . 8.600 4.594 4.078 5.247 . 0 0 "[ . 1 . 2 . 3]" 1
1769 1 65 LEU HA 1 66 GLY QA . . 5.980 4.196 4.086 4.335 . 0 0 "[ . 1 . 2 . 3]" 1
1770 1 65 LEU HA 1 67 PHE H . . 6.600 5.427 4.938 5.726 . 0 0 "[ . 1 . 2 . 3]" 1
1771 1 65 LEU HA 1 67 PHE QE . . 8.600 4.920 4.482 5.475 . 0 0 "[ . 1 . 2 . 3]" 1
1772 1 65 LEU HA 1 67 PHE HZ . . 6.600 6.535 6.007 6.676 0.076 30 0 "[ . 1 . 2 . 3]" 1
1773 1 65 LEU QB 1 66 GLY H . . 4.700 3.075 2.322 3.526 . 0 0 "[ . 1 . 2 . 3]" 1
1774 1 65 LEU HB2 1 66 GLY H . . 5.300 3.448 2.461 4.273 . 0 0 "[ . 1 . 2 . 3]" 1
1775 1 65 LEU HB3 1 66 GLY H . . 5.300 3.746 2.365 4.357 . 0 0 "[ . 1 . 2 . 3]" 1
1776 1 65 LEU MD1 1 66 GLY H . . 7.600 4.874 3.710 5.284 . 0 0 "[ . 1 . 2 . 3]" 1
1777 1 65 LEU MD1 1 67 PHE QD . . 9.600 3.972 2.397 5.019 . 0 0 "[ . 1 . 2 . 3]" 1
1778 1 65 LEU MD1 1 67 PHE QE . . 9.600 3.470 2.307 4.839 . 0 0 "[ . 1 . 2 . 3]" 1
1779 1 65 LEU MD1 1 67 PHE HZ . . 7.600 5.216 3.078 6.377 . 0 0 "[ . 1 . 2 . 3]" 1
1780 1 65 LEU MD2 1 66 GLY H . . 7.600 4.863 4.324 5.270 . 0 0 "[ . 1 . 2 . 3]" 1
1781 1 65 LEU MD2 1 67 PHE QD . . 9.600 4.381 2.834 5.333 . 0 0 "[ . 1 . 2 . 3]" 1
1782 1 65 LEU MD2 1 67 PHE QE . . 9.600 3.715 2.236 4.555 . 0 0 "[ . 1 . 2 . 3]" 1
1783 1 65 LEU MD2 1 67 PHE HZ . . 7.600 5.392 3.982 6.369 . 0 0 "[ . 1 . 2 . 3]" 1
1784 1 65 LEU HG 1 66 GLY H . . 6.600 4.805 4.099 5.690 . 0 0 "[ . 1 . 2 . 3]" 1
1785 1 65 LEU HG 1 66 GLY QA . . 7.480 5.809 4.582 6.465 . 0 0 "[ . 1 . 2 . 3]" 1
1786 1 65 LEU HG 1 67 PHE H . . 6.600 6.142 5.085 6.625 0.025 15 0 "[ . 1 . 2 . 3]" 1
1787 1 66 GLY H 1 67 PHE H . . 2.900 2.233 2.013 2.429 . 0 0 "[ . 1 . 2 . 3]" 1
1788 1 66 GLY H 1 67 PHE HA . . 6.600 4.942 4.728 5.134 . 0 0 "[ . 1 . 2 . 3]" 1
1789 1 66 GLY H 1 67 PHE QD . . 8.600 3.975 2.888 4.986 . 0 0 "[ . 1 . 2 . 3]" 1
1790 1 66 GLY QA 1 67 PHE QB . . 8.050 4.616 4.514 4.738 . 0 0 "[ . 1 . 2 . 3]" 1
1791 1 66 GLY QA 1 67 PHE QD . . 9.480 4.270 3.959 4.467 . 0 0 "[ . 1 . 2 . 3]" 1
1792 1 66 GLY QA 1 67 PHE QE . . 9.480 4.693 4.152 5.090 . 0 0 "[ . 1 . 2 . 3]" 1
1793 1 66 GLY QA 1 67 PHE HZ . . 7.480 5.569 4.887 6.439 . 0 0 "[ . 1 . 2 . 3]" 1
1794 1 67 PHE H 1 67 PHE QE . . 7.300 5.098 4.840 5.257 . 0 0 "[ . 1 . 2 . 3]" 1
1795 1 67 PHE H 1 67 PHE HZ . . 6.600 6.527 6.357 6.627 0.027 8 0 "[ . 1 . 2 . 3]" 1
1796 1 67 PHE H 1 68 GLU H . . 5.600 4.377 4.224 4.474 . 0 0 "[ . 1 . 2 . 3]" 1
1797 1 67 PHE H 1 69 PRO QB . . 7.600 6.155 5.818 6.657 . 0 0 "[ . 1 . 2 . 3]" 1
1798 1 67 PHE HA 1 67 PHE QE . . 5.800 4.572 4.333 4.954 . 0 0 "[ . 1 . 2 . 3]" 1
1799 1 67 PHE HA 1 67 PHE HZ . . 6.600 6.141 5.848 6.522 . 0 0 "[ . 1 . 2 . 3]" 1
1800 1 67 PHE HA 1 68 GLU H . . 3.000 2.463 2.290 2.578 . 0 0 "[ . 1 . 2 . 3]" 1
1801 1 67 PHE HA 1 68 GLU QB . . 7.480 4.229 3.717 4.789 . 0 0 "[ . 1 . 2 . 3]" 1
1802 1 67 PHE HA 1 68 GLU QG . . 7.600 4.366 2.846 5.874 . 0 0 "[ . 1 . 2 . 3]" 1
1803 1 67 PHE QB 1 68 GLU H . . 3.350 2.448 2.129 2.988 . 0 0 "[ . 1 . 2 . 3]" 1
1804 1 67 PHE QB 1 68 GLU HA . . 5.690 4.266 3.984 4.452 . 0 0 "[ . 1 . 2 . 3]" 1
1805 1 67 PHE HB2 1 68 GLU H . . 3.700 3.480 3.183 3.754 0.054 12 0 "[ . 1 . 2 . 3]" 1
1806 1 67 PHE HB2 1 68 GLU HA . . 6.500 4.770 4.412 4.992 . 0 0 "[ . 1 . 2 . 3]" 1
1807 1 67 PHE HB3 1 68 GLU H . . 3.700 2.504 2.156 3.138 . 0 0 "[ . 1 . 2 . 3]" 1
1808 1 67 PHE HB3 1 68 GLU HA . . 6.500 4.814 4.480 5.209 . 0 0 "[ . 1 . 2 . 3]" 1
1809 1 67 PHE QD 1 68 GLU H . . 8.600 3.994 3.551 4.567 . 0 0 "[ . 1 . 2 . 3]" 1
1810 1 68 GLU H 1 69 PRO QD . . 7.600 3.653 2.991 4.249 . 0 0 "[ . 1 . 2 . 3]" 1
1811 1 68 GLU HA 1 69 PRO QG . . 5.910 4.028 3.907 4.180 . 0 0 "[ . 1 . 2 . 3]" 1
1812 1 69 PRO HA 1 70 SER HA . . 5.200 4.526 4.397 4.660 . 0 0 "[ . 1 . 2 . 3]" 1
1813 1 69 PRO HA 1 70 SER QB . . 7.480 4.458 3.979 4.999 . 0 0 "[ . 1 . 2 . 3]" 1
1814 1 70 SER H 1 71 LEU H . . 5.700 4.389 4.075 4.702 . 0 0 "[ . 1 . 2 . 3]" 1
1815 1 70 SER HA 1 71 LEU H . . 2.800 2.262 2.125 2.782 . 0 0 "[ . 1 . 2 . 3]" 1
1816 1 70 SER HA 1 71 LEU HA . . 6.600 4.451 4.250 4.579 . 0 0 "[ . 1 . 2 . 3]" 1
1817 1 70 SER HA 1 71 LEU HG . . 6.400 5.066 3.241 6.418 0.018 30 0 "[ . 1 . 2 . 3]" 1
1818 1 70 SER QB 1 71 LEU H . . 3.860 3.269 2.612 3.540 . 0 0 "[ . 1 . 2 . 3]" 1
1819 1 70 SER HB2 1 71 LEU H . . 4.200 3.936 3.139 4.303 0.103 21 0 "[ . 1 . 2 . 3]" 1
1820 1 70 SER HB3 1 71 LEU H . . 4.200 3.630 2.694 4.264 0.064 15 0 "[ . 1 . 2 . 3]" 1
1821 1 71 LEU H 1 71 LEU HG . . 4.100 3.146 2.005 4.250 0.150 21 0 "[ . 1 . 2 . 3]" 1
1822 1 71 LEU H 1 72 VAL H . . 5.200 4.301 3.220 4.687 . 0 0 "[ . 1 . 2 . 3]" 1
1823 1 71 LEU QB 1 72 VAL H . . 5.400 3.257 1.930 4.097 . 0 0 "[ . 1 . 2 . 3]" 1
1824 1 71 LEU QB 1 73 LYS H . . 7.600 4.477 2.687 5.978 . 0 0 "[ . 1 . 2 . 3]" 1
1825 1 71 LEU QD 1 72 VAL H . . 6.760 3.347 2.045 4.366 . 0 0 "[ . 1 . 2 . 3]" 1
1826 1 71 LEU MD1 1 72 VAL H . . 7.600 4.143 2.049 5.470 . 0 0 "[ . 1 . 2 . 3]" 1
1827 1 71 LEU MD2 1 72 VAL H . . 7.600 4.294 2.675 5.493 . 0 0 "[ . 1 . 2 . 3]" 1
1828 1 71 LEU HG 1 72 VAL H . . 4.500 4.260 2.870 4.622 0.122 14 0 "[ . 1 . 2 . 3]" 1
1829 1 72 VAL H 1 73 LYS H . . 5.000 2.734 1.985 3.935 . 0 0 "[ . 1 . 2 . 3]" 1
1830 1 72 VAL H 1 73 LYS QD . . 7.600 6.045 3.336 6.810 . 0 0 "[ . 1 . 2 . 3]" 1
1831 1 72 VAL HA 1 73 LYS QD . . 7.600 5.969 3.660 6.851 . 0 0 "[ . 1 . 2 . 3]" 1
1832 1 72 VAL HB 1 73 LYS H . . 4.500 3.235 1.997 4.491 . 0 0 "[ . 1 . 2 . 3]" 1
1833 1 72 VAL MG1 1 73 LYS H . . 7.200 3.158 1.933 4.247 . 0 0 "[ . 1 . 2 . 3]" 1
1834 1 72 VAL MG2 1 73 LYS H . . 7.200 3.680 1.947 4.405 . 0 0 "[ . 1 . 2 . 3]" 1
1835 1 73 LYS H 1 73 LYS HA . . 2.800 2.503 2.199 2.894 0.094 28 0 "[ . 1 . 2 . 3]" 1
1836 1 73 LYS HB2 1 74 ILE H . . 4.100 3.500 2.139 4.145 0.045 7 0 "[ . 1 . 2 . 3]" 1
1837 1 73 LYS HB3 1 74 ILE H . . 4.100 3.159 2.125 4.164 0.064 30 0 "[ . 1 . 2 . 3]" 1
1838 1 73 LYS QD 1 74 ILE H . . 7.600 3.995 1.991 5.335 . 0 0 "[ . 1 . 2 . 3]" 1
1839 1 73 LYS QG 1 74 ILE H . . 7.600 3.231 1.999 4.450 . 0 0 "[ . 1 . 2 . 3]" 1
1840 1 74 ILE H 1 74 ILE MD . . 5.100 3.506 2.013 4.289 . 0 0 "[ . 1 . 2 . 3]" 1
1841 1 74 ILE H 1 74 ILE HG12 . . 4.800 3.445 2.077 4.708 . 0 0 "[ . 1 . 2 . 3]" 1
1842 1 74 ILE H 1 74 ILE HG13 . . 4.800 3.623 2.376 4.825 0.025 15 0 "[ . 1 . 2 . 3]" 1
1843 1 74 ILE H 1 74 ILE MG . . 4.800 3.407 1.974 4.017 . 0 0 "[ . 1 . 2 . 3]" 1
1844 1 74 ILE H 1 75 GLU H . . 5.500 3.688 2.069 4.727 . 0 0 "[ . 1 . 2 . 3]" 1
1845 1 74 ILE HB 1 75 GLU H . . 6.000 3.254 1.995 4.569 . 0 0 "[ . 1 . 2 . 3]" 1
1846 1 74 ILE MD 1 75 GLU H . . 7.600 4.046 2.348 5.617 . 0 0 "[ . 1 . 2 . 3]" 1
1847 1 74 ILE QG 1 75 GLU H . . 7.480 3.835 2.078 4.939 . 0 0 "[ . 1 . 2 . 3]" 1
1848 1 74 ILE MG 1 75 GLU H . . 7.600 3.437 2.240 4.199 . 0 0 "[ . 1 . 2 . 3]" 1
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