NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
373808 |
1e0h   |
4115 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1e0h
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 2061
_Distance_constraint_stats_list.Viol_count 1947
_Distance_constraint_stats_list.Viol_total 2087.486
_Distance_constraint_stats_list.Viol_max 0.906
_Distance_constraint_stats_list.Viol_rms 0.0153
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0025
_Distance_constraint_stats_list.Viol_average_violations_only 0.0536
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 GLU 1.028 0.107 10 0 "[ . 1 . 2]"
1 3 LEU 2.009 0.107 10 0 "[ . 1 . 2]"
1 4 LYS 3.551 0.111 20 0 "[ . 1 . 2]"
1 5 HIS 3.988 0.104 12 0 "[ . 1 . 2]"
1 6 SER 7.192 0.111 20 0 "[ . 1 . 2]"
1 7 ILE 1.139 0.094 10 0 "[ . 1 . 2]"
1 8 SER 6.236 0.125 19 0 "[ . 1 . 2]"
1 9 ASP 2.164 0.103 8 0 "[ . 1 . 2]"
1 10 TYR 0.323 0.065 19 0 "[ . 1 . 2]"
1 11 THR 3.721 0.091 20 0 "[ . 1 . 2]"
1 12 GLU 1.165 0.088 11 0 "[ . 1 . 2]"
1 13 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 PHE 0.407 0.050 13 0 "[ . 1 . 2]"
1 16 LEU 0.715 0.088 11 0 "[ . 1 . 2]"
1 17 GLN 0.730 0.056 10 0 "[ . 1 . 2]"
1 18 LEU 3.141 0.110 4 0 "[ . 1 . 2]"
1 19 VAL 0.054 0.031 17 0 "[ . 1 . 2]"
1 20 THR 2.420 0.073 20 0 "[ . 1 . 2]"
1 21 THR 1.881 0.072 7 0 "[ . 1 . 2]"
1 22 ILE 3.477 0.155 9 0 "[ . 1 . 2]"
1 23 CYS 3.115 0.100 15 0 "[ . 1 . 2]"
1 24 ASN 0.475 0.029 13 0 "[ . 1 . 2]"
1 25 ALA 0.066 0.023 15 0 "[ . 1 . 2]"
1 26 ASP 1.529 0.078 11 0 "[ . 1 . 2]"
1 27 THR 1.480 0.078 11 0 "[ . 1 . 2]"
1 28 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 SER 1.040 0.090 15 0 "[ . 1 . 2]"
1 30 GLU 0.050 0.014 19 0 "[ . 1 . 2]"
1 31 GLU 3.395 0.091 8 0 "[ . 1 . 2]"
1 32 GLU 1.166 0.067 1 0 "[ . 1 . 2]"
1 33 LEU 0.951 0.067 12 0 "[ . 1 . 2]"
1 34 VAL 2.828 0.086 8 0 "[ . 1 . 2]"
1 35 LYS 3.645 0.103 13 0 "[ . 1 . 2]"
1 36 LEU 3.679 0.110 4 0 "[ . 1 . 2]"
1 37 VAL 2.566 0.906 3 2 "[ + - 1 . 2]"
1 38 THR 3.814 0.103 13 0 "[ . 1 . 2]"
1 39 HIS 2.489 0.086 16 0 "[ . 1 . 2]"
1 40 PHE 0.076 0.047 7 0 "[ . 1 . 2]"
1 41 GLU 2.403 0.079 9 0 "[ . 1 . 2]"
1 42 GLU 2.954 0.095 12 0 "[ . 1 . 2]"
1 43 MET 2.892 0.095 12 0 "[ . 1 . 2]"
1 44 THR 0.115 0.030 6 0 "[ . 1 . 2]"
1 45 GLU 0.696 0.053 9 0 "[ . 1 . 2]"
1 46 HIS 3.728 0.095 5 0 "[ . 1 . 2]"
1 47 PRO 5.026 0.110 15 0 "[ . 1 . 2]"
1 48 SER 1.368 0.057 7 0 "[ . 1 . 2]"
1 49 GLY 0.016 0.016 9 0 "[ . 1 . 2]"
1 50 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 ASP 0.291 0.056 20 0 "[ . 1 . 2]"
1 52 LEU 3.412 0.098 7 0 "[ . 1 . 2]"
1 53 ILE 1.323 0.501 5 1 "[ + 1 . 2]"
1 54 TYR 4.888 0.906 3 2 "[ + - 1 . 2]"
1 55 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 PRO 0.511 0.043 10 0 "[ . 1 . 2]"
1 57 LYS 0.637 0.042 10 0 "[ . 1 . 2]"
1 58 GLU 3.619 0.088 19 0 "[ . 1 . 2]"
1 59 GLY 1.093 0.088 19 0 "[ . 1 . 2]"
1 60 ASP 2.436 0.052 18 0 "[ . 1 . 2]"
1 61 ASP 3.156 0.084 18 0 "[ . 1 . 2]"
1 62 ASP 2.656 0.081 19 0 "[ . 1 . 2]"
1 63 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 PRO 3.185 0.100 15 0 "[ . 1 . 2]"
1 65 SER 1.278 0.110 1 0 "[ . 1 . 2]"
1 66 GLY 1.140 0.070 9 0 "[ . 1 . 2]"
1 67 ILE 4.029 0.155 9 0 "[ . 1 . 2]"
1 68 VAL 2.979 0.105 19 0 "[ . 1 . 2]"
1 69 ASN 3.143 0.075 2 0 "[ . 1 . 2]"
1 70 THR 0.578 0.039 19 0 "[ . 1 . 2]"
1 71 VAL 0.603 0.073 8 0 "[ . 1 . 2]"
1 72 LYS 2.916 0.079 4 0 "[ . 1 . 2]"
1 73 GLN 0.470 0.019 11 0 "[ . 1 . 2]"
1 74 TRP 3.992 0.110 15 0 "[ . 1 . 2]"
1 75 ARG 1.161 0.059 7 0 "[ . 1 . 2]"
1 76 ALA 1.869 0.098 5 0 "[ . 1 . 2]"
1 77 ALA 3.094 0.098 5 0 "[ . 1 . 2]"
1 78 ASN 0.822 0.056 6 0 "[ . 1 . 2]"
1 79 GLY 0.635 0.023 4 0 "[ . 1 . 2]"
1 80 LYS 5.032 0.117 6 0 "[ . 1 . 2]"
1 81 SER 1.546 0.089 14 0 "[ . 1 . 2]"
1 82 GLY 0.039 0.009 7 0 "[ . 1 . 2]"
1 83 PHE 3.129 0.105 19 0 "[ . 1 . 2]"
1 84 LYS 2.918 0.077 7 0 "[ . 1 . 2]"
1 85 GLN 5.644 0.123 12 0 "[ . 1 . 2]"
1 86 GLY 0.215 0.051 13 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET HA 1 1 MET ME . . 5.010 3.830 2.432 4.233 . 0 0 "[ . 1 . 2]" 1
2 1 1 MET HA 1 2 GLU HA . . 5.500 4.595 3.759 5.357 . 0 0 "[ . 1 . 2]" 1
3 1 1 MET HA 1 2 GLU QB . . 6.040 4.716 1.759 5.518 . 0 0 "[ . 1 . 2]" 1
4 1 1 MET QB 1 3 LEU QB . . 7.250 5.413 3.957 5.885 . 0 0 "[ . 1 . 2]" 1
5 1 1 MET QB 1 3 LEU QD . . 8.970 4.697 3.171 6.069 . 0 0 "[ . 1 . 2]" 1
6 1 1 MET QG 1 3 LEU QB . . 7.130 4.710 3.181 5.713 . 0 0 "[ . 1 . 2]" 1
7 1 1 MET QG 1 3 LEU MD1 . . 7.400 4.776 3.400 5.606 . 0 0 "[ . 1 . 2]" 1
8 1 1 MET QG 1 3 LEU QD . . 6.660 4.042 2.335 4.557 . 0 0 "[ . 1 . 2]" 1
9 1 1 MET QG 1 3 LEU MD2 . . 7.400 4.650 2.348 5.560 . 0 0 "[ . 1 . 2]" 1
10 1 1 MET HG2 1 3 LEU MD1 . . 9.670 5.647 3.905 6.663 . 0 0 "[ . 1 . 2]" 1
11 1 1 MET HG2 1 3 LEU MD2 . . 9.670 5.466 2.808 6.924 . 0 0 "[ . 1 . 2]" 1
12 1 1 MET HG3 1 3 LEU MD1 . . 9.670 5.241 3.740 6.138 . 0 0 "[ . 1 . 2]" 1
13 1 1 MET HG3 1 3 LEU MD2 . . 9.670 5.153 2.517 6.697 . 0 0 "[ . 1 . 2]" 1
14 1 2 GLU HA 1 2 GLU HB2 . . 2.960 2.885 2.417 3.033 0.073 3 0 "[ . 1 . 2]" 1
15 1 2 GLU HA 1 2 GLU QB . . 2.710 2.311 2.092 2.575 . 0 0 "[ . 1 . 2]" 1
16 1 2 GLU HA 1 2 GLU HB3 . . 2.960 2.468 2.150 3.018 0.058 11 0 "[ . 1 . 2]" 1
17 1 2 GLU HA 1 2 GLU HG2 . . 4.260 3.468 2.157 4.088 . 0 0 "[ . 1 . 2]" 1
18 1 2 GLU HA 1 2 GLU QG . . 3.860 2.764 2.131 3.539 . 0 0 "[ . 1 . 2]" 1
19 1 2 GLU HA 1 2 GLU HG3 . . 4.260 3.162 2.356 4.275 0.015 7 0 "[ . 1 . 2]" 1
20 1 2 GLU HA 1 3 LEU QB . . 5.630 4.135 3.445 4.975 . 0 0 "[ . 1 . 2]" 1
21 1 2 GLU HA 1 3 LEU QD . . 8.100 4.666 4.054 5.138 . 0 0 "[ . 1 . 2]" 1
22 1 2 GLU HA 1 3 LEU HG . . 5.100 4.642 4.057 5.207 0.107 10 0 "[ . 1 . 2]" 1
23 1 2 GLU QB 1 4 LYS QD . . 5.420 3.766 2.779 4.359 . 0 0 "[ . 1 . 2]" 1
24 1 2 GLU QB 1 4 LYS QE . . 7.250 4.688 3.603 5.558 . 0 0 "[ . 1 . 2]" 1
25 1 2 GLU QG 1 3 LEU H . . 4.740 3.875 3.058 4.251 . 0 0 "[ . 1 . 2]" 1
26 1 2 GLU HG2 1 3 LEU H . . 4.880 4.427 3.178 4.852 . 0 0 "[ . 1 . 2]" 1
27 1 2 GLU HG3 1 3 LEU H . . 4.880 4.390 3.512 4.836 . 0 0 "[ . 1 . 2]" 1
28 1 3 LEU H 1 3 LEU HA . . 2.620 2.616 2.171 2.702 0.082 10 0 "[ . 1 . 2]" 1
29 1 3 LEU H 1 3 LEU HB2 . . 3.760 2.860 2.211 3.298 . 0 0 "[ . 1 . 2]" 1
30 1 3 LEU H 1 3 LEU QB . . 3.410 2.748 2.134 3.095 . 0 0 "[ . 1 . 2]" 1
31 1 3 LEU H 1 3 LEU HB3 . . 3.760 3.579 2.806 3.764 0.004 13 0 "[ . 1 . 2]" 1
32 1 3 LEU H 1 3 LEU HG . . 3.950 3.922 3.904 3.937 . 0 0 "[ . 1 . 2]" 1
33 1 3 LEU H 1 4 LYS H . . 4.760 3.414 2.103 3.980 . 0 0 "[ . 1 . 2]" 1
34 1 3 LEU H 1 4 LYS HA . . 4.040 3.977 3.242 4.093 0.053 2 0 "[ . 1 . 2]" 1
35 1 3 LEU H 1 4 LYS QB . . 4.920 4.213 4.008 4.413 . 0 0 "[ . 1 . 2]" 1
36 1 3 LEU HA 1 3 LEU HG . . 3.670 2.716 2.088 3.475 . 0 0 "[ . 1 . 2]" 1
37 1 3 LEU HA 1 4 LYS H . . 3.270 2.940 2.258 3.304 0.034 20 0 "[ . 1 . 2]" 1
38 1 3 LEU HA 1 10 TYR QE . . 7.630 4.553 3.275 5.819 . 0 0 "[ . 1 . 2]" 1
39 1 3 LEU HA 1 18 LEU MD2 . . 7.500 4.212 3.147 5.564 . 0 0 "[ . 1 . 2]" 1
40 1 3 LEU HA 1 39 HIS HE1 . . 5.500 4.826 3.946 5.586 0.086 16 0 "[ . 1 . 2]" 1
41 1 3 LEU QB 1 4 LYS H . . 3.750 1.989 1.650 2.512 . 0 0 "[ . 1 . 2]" 1
42 1 3 LEU QB 1 4 LYS HA . . 4.390 3.978 3.687 4.071 . 0 0 "[ . 1 . 2]" 1
43 1 3 LEU HB2 1 4 LYS H . . 4.170 3.005 2.095 3.857 . 0 0 "[ . 1 . 2]" 1
44 1 3 LEU HB3 1 4 LYS H . . 4.170 2.037 1.670 2.547 . 0 0 "[ . 1 . 2]" 1
45 1 3 LEU QD 1 4 LYS H . . 4.610 3.037 2.525 3.584 . 0 0 "[ . 1 . 2]" 1
46 1 3 LEU QD 1 5 HIS H . . 8.100 6.033 5.854 6.153 . 0 0 "[ . 1 . 2]" 1
47 1 3 LEU QD 1 18 LEU QD . . 8.990 2.313 1.708 3.102 . 0 0 "[ . 1 . 2]" 1
48 1 3 LEU QD 1 35 LYS QB . . 8.970 4.234 3.369 5.223 . 0 0 "[ . 1 . 2]" 1
49 1 3 LEU QD 1 35 LYS QD . . 8.970 3.314 1.971 5.345 . 0 0 "[ . 1 . 2]" 1
50 1 3 LEU QD 1 35 LYS QE . . 8.970 3.196 1.889 5.314 . 0 0 "[ . 1 . 2]" 1
51 1 3 LEU QD 1 35 LYS QG . . 7.110 2.930 2.209 3.945 . 0 0 "[ . 1 . 2]" 1
52 1 3 LEU QD 1 36 LEU HA . . 8.100 2.869 2.321 3.255 . 0 0 "[ . 1 . 2]" 1
53 1 3 LEU QD 1 36 LEU QB . . 6.340 3.931 3.674 4.136 . 0 0 "[ . 1 . 2]" 1
54 1 3 LEU QD 1 36 LEU QD . . 10.690 1.801 1.665 1.923 . 0 0 "[ . 1 . 2]" 1
55 1 3 LEU QD 1 36 LEU HG . . 8.100 3.524 2.350 4.299 . 0 0 "[ . 1 . 2]" 1
56 1 3 LEU QD 1 39 HIS H . . 6.090 4.059 3.704 4.330 . 0 0 "[ . 1 . 2]" 1
57 1 3 LEU QD 1 39 HIS HA . . 8.100 4.028 3.659 4.359 . 0 0 "[ . 1 . 2]" 1
58 1 3 LEU QD 1 43 MET ME . . 9.130 4.252 2.724 5.159 . 0 0 "[ . 1 . 2]" 1
59 1 3 LEU MD1 1 4 LYS H . . 5.010 3.900 3.594 4.094 . 0 0 "[ . 1 . 2]" 1
60 1 3 LEU MD1 1 18 LEU MD1 . . 10.690 4.504 3.742 5.318 . 0 0 "[ . 1 . 2]" 1
61 1 3 LEU MD1 1 18 LEU MD2 . . 10.690 4.621 3.012 5.907 . 0 0 "[ . 1 . 2]" 1
62 1 3 LEU MD1 1 35 LYS HG2 . . 9.290 3.186 2.308 4.269 . 0 0 "[ . 1 . 2]" 1
63 1 3 LEU MD1 1 35 LYS HG3 . . 9.290 4.080 2.684 5.169 . 0 0 "[ . 1 . 2]" 1
64 1 3 LEU MD1 1 39 HIS H . . 6.530 5.132 4.083 5.382 . 0 0 "[ . 1 . 2]" 1
65 1 3 LEU MD1 1 39 HIS HB2 . . 6.530 3.455 2.153 3.965 . 0 0 "[ . 1 . 2]" 1
66 1 3 LEU MD1 1 39 HIS HB3 . . 6.530 4.334 3.130 5.062 . 0 0 "[ . 1 . 2]" 1
67 1 3 LEU MD1 1 39 HIS HD2 . . 6.530 4.480 1.940 5.462 . 0 0 "[ . 1 . 2]" 1
68 1 3 LEU MD2 1 4 LYS H . . 5.010 3.235 2.549 4.056 . 0 0 "[ . 1 . 2]" 1
69 1 3 LEU MD2 1 18 LEU MD1 . . 10.690 2.523 1.896 3.588 . 0 0 "[ . 1 . 2]" 1
70 1 3 LEU MD2 1 18 LEU MD2 . . 10.690 2.916 1.950 3.722 . 0 0 "[ . 1 . 2]" 1
71 1 3 LEU MD2 1 35 LYS HG2 . . 9.670 4.017 2.536 6.055 . 0 0 "[ . 1 . 2]" 1
72 1 3 LEU MD2 1 35 LYS HG3 . . 9.670 5.102 3.592 7.134 . 0 0 "[ . 1 . 2]" 1
73 1 3 LEU MD2 1 39 HIS H . . 6.530 4.337 3.846 5.151 . 0 0 "[ . 1 . 2]" 1
74 1 3 LEU MD2 1 39 HIS HB2 . . 6.530 2.549 1.975 3.583 . 0 0 "[ . 1 . 2]" 1
75 1 3 LEU MD2 1 39 HIS HB3 . . 6.530 2.781 2.349 3.056 . 0 0 "[ . 1 . 2]" 1
76 1 3 LEU MD2 1 39 HIS HD2 . . 6.530 2.414 1.972 3.008 . 0 0 "[ . 1 . 2]" 1
77 1 3 LEU HG 1 36 LEU QB . . 6.380 5.696 5.351 5.797 . 0 0 "[ . 1 . 2]" 1
78 1 4 LYS H 1 4 LYS HA . . 2.830 2.734 2.401 2.870 0.040 12 0 "[ . 1 . 2]" 1
79 1 4 LYS H 1 4 LYS HB2 . . 4.200 3.213 2.510 3.841 . 0 0 "[ . 1 . 2]" 1
80 1 4 LYS H 1 4 LYS HB3 . . 4.200 3.715 3.229 4.221 0.021 3 0 "[ . 1 . 2]" 1
81 1 4 LYS H 1 4 LYS QE . . 6.380 5.642 4.728 5.810 . 0 0 "[ . 1 . 2]" 1
82 1 4 LYS H 1 5 HIS H . . 4.380 4.248 4.020 4.368 . 0 0 "[ . 1 . 2]" 1
83 1 4 LYS HA 1 4 LYS HD2 . . 4.720 2.559 2.011 4.665 . 0 0 "[ . 1 . 2]" 1
84 1 4 LYS HA 1 4 LYS QD . . 4.340 2.407 1.991 3.985 . 0 0 "[ . 1 . 2]" 1
85 1 4 LYS HA 1 4 LYS HD3 . . 4.720 3.468 2.331 4.415 . 0 0 "[ . 1 . 2]" 1
86 1 4 LYS HA 1 4 LYS HE2 . . 5.500 4.406 3.670 5.110 . 0 0 "[ . 1 . 2]" 1
87 1 4 LYS HA 1 4 LYS QE . . 5.180 3.768 3.019 4.404 . 0 0 "[ . 1 . 2]" 1
88 1 4 LYS HA 1 4 LYS HE3 . . 5.500 4.177 3.094 5.021 . 0 0 "[ . 1 . 2]" 1
89 1 4 LYS HA 1 5 HIS H . . 3.110 2.470 2.328 2.702 . 0 0 "[ . 1 . 2]" 1
90 1 4 LYS HA 1 5 HIS HA . . 4.820 4.310 3.863 4.432 . 0 0 "[ . 1 . 2]" 1
91 1 4 LYS HA 1 5 HIS HD1 . . 5.500 4.159 2.913 4.585 . 0 0 "[ . 1 . 2]" 1
92 1 4 LYS HA 1 5 HIS HD2 . . 5.500 4.450 3.521 5.581 0.081 1 0 "[ . 1 . 2]" 1
93 1 4 LYS HA 1 6 SER H . . 3.950 4.039 3.916 4.061 0.111 20 0 "[ . 1 . 2]" 1
94 1 4 LYS HA 1 9 ASP QB . . 4.240 3.838 3.566 3.917 . 0 0 "[ . 1 . 2]" 1
95 1 4 LYS HA 1 10 TYR QE . . 7.630 6.349 5.467 7.062 . 0 0 "[ . 1 . 2]" 1
96 1 4 LYS QB 1 5 HIS H . . 4.700 2.134 1.748 2.406 . 0 0 "[ . 1 . 2]" 1
97 1 4 LYS QB 1 5 HIS HD1 . . 6.380 5.428 4.280 5.664 . 0 0 "[ . 1 . 2]" 1
98 1 4 LYS QB 1 6 SER H . . 3.540 2.388 2.193 3.097 . 0 0 "[ . 1 . 2]" 1
99 1 4 LYS QB 1 9 ASP QB . . 5.820 2.892 1.852 3.549 . 0 0 "[ . 1 . 2]" 1
100 1 4 LYS QB 1 10 TYR QE . . 6.880 3.748 2.576 4.361 . 0 0 "[ . 1 . 2]" 1
101 1 4 LYS HB2 1 4 LYS HE2 . . 5.500 4.583 2.837 4.961 . 0 0 "[ . 1 . 2]" 1
102 1 4 LYS HB2 1 4 LYS HE3 . . 5.500 4.778 3.907 5.554 0.054 3 0 "[ . 1 . 2]" 1
103 1 4 LYS HB2 1 5 HIS H . . 5.470 3.493 3.009 3.869 . 0 0 "[ . 1 . 2]" 1
104 1 4 LYS HB2 1 6 SER H . . 4.010 3.961 3.808 3.998 . 0 0 "[ . 1 . 2]" 1
105 1 4 LYS HB2 1 9 ASP HB2 . . 7.250 4.377 2.224 5.729 . 0 0 "[ . 1 . 2]" 1
106 1 4 LYS HB2 1 9 ASP HB3 . . 7.250 4.591 3.312 5.187 . 0 0 "[ . 1 . 2]" 1
107 1 4 LYS HB2 1 10 TYR QE . . 7.320 3.915 2.624 4.621 . 0 0 "[ . 1 . 2]" 1
108 1 4 LYS HB3 1 4 LYS HE2 . . 5.500 4.758 3.058 5.567 0.067 9 0 "[ . 1 . 2]" 1
109 1 4 LYS HB3 1 4 LYS HE3 . . 5.500 4.979 3.630 5.547 0.047 17 0 "[ . 1 . 2]" 1
110 1 4 LYS HB3 1 5 HIS H . . 5.470 2.153 1.755 2.431 . 0 0 "[ . 1 . 2]" 1
111 1 4 LYS HB3 1 6 SER H . . 4.010 2.417 2.204 3.278 . 0 0 "[ . 1 . 2]" 1
112 1 4 LYS HB3 1 9 ASP HB2 . . 7.250 3.280 1.972 4.545 . 0 0 "[ . 1 . 2]" 1
113 1 4 LYS HB3 1 9 ASP HB3 . . 7.250 3.881 2.399 4.592 . 0 0 "[ . 1 . 2]" 1
114 1 4 LYS HB3 1 10 TYR QE . . 7.320 4.849 3.130 5.441 . 0 0 "[ . 1 . 2]" 1
115 1 4 LYS QD 1 9 ASP QB . . 4.290 3.091 2.071 3.381 . 0 0 "[ . 1 . 2]" 1
116 1 4 LYS QD 1 10 TYR HA . . 4.940 3.768 2.488 4.192 . 0 0 "[ . 1 . 2]" 1
117 1 4 LYS QD 1 10 TYR QD . . 8.520 3.246 2.328 4.199 . 0 0 "[ . 1 . 2]" 1
118 1 4 LYS QD 1 10 TYR QE . . 7.030 5.012 4.224 5.510 . 0 0 "[ . 1 . 2]" 1
119 1 4 LYS HD2 1 9 ASP HB2 . . 5.360 4.463 3.714 5.068 . 0 0 "[ . 1 . 2]" 1
120 1 4 LYS HD2 1 9 ASP HB3 . . 5.360 3.776 2.106 4.703 . 0 0 "[ . 1 . 2]" 1
121 1 4 LYS HD2 1 10 TYR HA . . 5.500 5.129 4.041 5.528 0.028 10 0 "[ . 1 . 2]" 1
122 1 4 LYS HD2 1 10 TYR QE . . 7.630 6.152 5.332 6.743 . 0 0 "[ . 1 . 2]" 1
123 1 4 LYS HD3 1 9 ASP HB2 . . 5.360 4.475 2.976 4.974 . 0 0 "[ . 1 . 2]" 1
124 1 4 LYS HD3 1 9 ASP HB3 . . 5.360 3.806 3.129 4.418 . 0 0 "[ . 1 . 2]" 1
125 1 4 LYS HD3 1 10 TYR HA . . 5.500 4.012 2.509 5.510 0.010 1 0 "[ . 1 . 2]" 1
126 1 4 LYS HD3 1 10 TYR QE . . 7.630 5.401 4.407 6.518 . 0 0 "[ . 1 . 2]" 1
127 1 4 LYS QE 1 5 HIS H . . 6.380 4.606 3.670 5.429 . 0 0 "[ . 1 . 2]" 1
128 1 4 LYS QE 1 10 TYR HA . . 5.080 3.615 2.408 4.523 . 0 0 "[ . 1 . 2]" 1
129 1 4 LYS HE2 1 10 TYR HA . . 5.500 3.923 2.426 5.044 . 0 0 "[ . 1 . 2]" 1
130 1 4 LYS HE2 1 10 TYR QB . . 6.380 3.338 1.940 4.608 . 0 0 "[ . 1 . 2]" 1
131 1 4 LYS HE3 1 10 TYR HA . . 5.500 4.675 2.656 5.565 0.065 19 0 "[ . 1 . 2]" 1
132 1 4 LYS HE3 1 10 TYR QB . . 6.380 3.917 2.608 4.845 . 0 0 "[ . 1 . 2]" 1
133 1 4 LYS QG 1 9 ASP QB . . 6.030 2.067 1.714 3.986 . 0 0 "[ . 1 . 2]" 1
134 1 4 LYS QG 1 10 TYR QE . . 8.510 4.980 3.666 6.074 . 0 0 "[ . 1 . 2]" 1
135 1 4 LYS HG2 1 9 ASP HB2 . . 7.250 2.903 1.972 6.386 . 0 0 "[ . 1 . 2]" 1
136 1 4 LYS HG2 1 9 ASP HB3 . . 7.250 2.676 2.069 4.886 . 0 0 "[ . 1 . 2]" 1
137 1 4 LYS HG3 1 9 ASP HB2 . . 7.250 2.804 2.025 5.903 . 0 0 "[ . 1 . 2]" 1
138 1 4 LYS HG3 1 9 ASP HB3 . . 7.250 2.618 2.011 4.456 . 0 0 "[ . 1 . 2]" 1
139 1 5 HIS H 1 5 HIS HB2 . . 3.670 3.067 2.915 3.675 0.005 1 0 "[ . 1 . 2]" 1
140 1 5 HIS H 1 5 HIS QB . . 3.450 2.909 2.791 3.145 . 0 0 "[ . 1 . 2]" 1
141 1 5 HIS H 1 5 HIS HB3 . . 3.670 3.657 3.417 3.698 0.028 10 0 "[ . 1 . 2]" 1
142 1 5 HIS H 1 6 SER H . . 2.770 1.793 1.616 2.022 . 0 0 "[ . 1 . 2]" 1
143 1 5 HIS H 1 6 SER HA . . 5.500 4.524 4.242 4.813 . 0 0 "[ . 1 . 2]" 1
144 1 5 HIS H 1 9 ASP H . . 4.380 4.325 4.043 4.355 . 0 0 "[ . 1 . 2]" 1
145 1 5 HIS HA 1 6 SER H . . 3.300 3.276 3.269 3.285 . 0 0 "[ . 1 . 2]" 1
146 1 5 HIS QB 1 6 SER H . . 3.750 2.871 2.811 3.290 . 0 0 "[ . 1 . 2]" 1
147 1 5 HIS QB 1 6 SER QB . . 5.860 3.825 3.464 4.453 . 0 0 "[ . 1 . 2]" 1
148 1 5 HIS HB2 1 6 SER H . . 3.550 2.944 2.871 3.496 . 0 0 "[ . 1 . 2]" 1
149 1 5 HIS HB2 1 6 SER HB2 . . 7.250 4.802 4.166 5.966 . 0 0 "[ . 1 . 2]" 1
150 1 5 HIS HB2 1 6 SER HB3 . . 7.250 4.225 3.673 4.812 . 0 0 "[ . 1 . 2]" 1
151 1 5 HIS HB3 1 6 SER H . . 3.920 4.012 4.000 4.024 0.104 12 0 "[ . 1 . 2]" 1
152 1 5 HIS HB3 1 6 SER HB2 . . 7.250 6.317 5.700 7.069 . 0 0 "[ . 1 . 2]" 1
153 1 5 HIS HB3 1 6 SER HB3 . . 7.250 5.607 5.098 6.205 . 0 0 "[ . 1 . 2]" 1
154 1 5 HIS HD2 1 6 SER HA . . 5.500 5.551 4.817 5.602 0.102 7 0 "[ . 1 . 2]" 1
155 1 5 HIS HD2 1 6 SER QB . . 6.380 4.381 3.631 4.709 . 0 0 "[ . 1 . 2]" 1
156 1 6 SER H 1 6 SER HB2 . . 3.390 3.134 2.377 3.369 . 0 0 "[ . 1 . 2]" 1
157 1 6 SER H 1 6 SER QB . . 3.180 2.861 2.332 2.948 . 0 0 "[ . 1 . 2]" 1
158 1 6 SER H 1 6 SER HB3 . . 3.390 3.353 3.255 3.399 0.009 13 0 "[ . 1 . 2]" 1
159 1 6 SER H 1 7 ILE H . . 4.390 4.213 3.935 4.389 . 0 0 "[ . 1 . 2]" 1
160 1 6 SER H 1 7 ILE MG . . 7.030 5.597 5.108 5.877 . 0 0 "[ . 1 . 2]" 1
161 1 6 SER H 1 8 SER H . . 3.860 3.944 3.837 3.961 0.101 6 0 "[ . 1 . 2]" 1
162 1 6 SER H 1 9 ASP QB . . 4.050 2.953 2.627 3.334 . 0 0 "[ . 1 . 2]" 1
163 1 6 SER H 1 43 MET ME . . 4.760 3.142 2.602 3.550 . 0 0 "[ . 1 . 2]" 1
164 1 6 SER HA 1 6 SER HB2 . . 2.870 2.737 2.476 2.907 0.037 13 0 "[ . 1 . 2]" 1
165 1 6 SER HA 1 6 SER HB3 . . 2.870 2.040 1.859 2.210 . 0 0 "[ . 1 . 2]" 1
166 1 6 SER HA 1 7 ILE H . . 2.930 2.126 1.889 2.398 . 0 0 "[ . 1 . 2]" 1
167 1 6 SER HA 1 7 ILE MG . . 6.530 3.787 2.986 4.624 . 0 0 "[ . 1 . 2]" 1
168 1 6 SER HA 1 8 SER H . . 4.070 3.559 3.412 3.815 . 0 0 "[ . 1 . 2]" 1
169 1 6 SER HA 1 9 ASP H . . 4.420 4.377 4.365 4.396 . 0 0 "[ . 1 . 2]" 1
170 1 6 SER HA 1 43 MET ME . . 5.910 2.693 2.076 4.161 . 0 0 "[ . 1 . 2]" 1
171 1 6 SER QB 1 7 ILE H . . 3.070 2.642 2.319 2.831 . 0 0 "[ . 1 . 2]" 1
172 1 6 SER QB 1 7 ILE MD . . 7.400 5.529 5.419 5.604 . 0 0 "[ . 1 . 2]" 1
173 1 6 SER QB 1 8 SER H . . 4.610 1.611 1.446 2.123 . 0 0 "[ . 1 . 2]" 1
174 1 6 SER QB 1 9 ASP H . . 6.250 2.239 1.551 2.731 . 0 0 "[ . 1 . 2]" 1
175 1 6 SER HB2 1 7 ILE H . . 3.300 2.996 2.444 3.267 . 0 0 "[ . 1 . 2]" 1
176 1 6 SER HB2 1 7 ILE MG . . 6.530 3.634 3.013 4.638 . 0 0 "[ . 1 . 2]" 1
177 1 6 SER HB2 1 43 MET ME . . 6.530 4.426 3.888 4.769 . 0 0 "[ . 1 . 2]" 1
178 1 6 SER HB3 1 7 ILE H . . 3.300 3.070 2.373 3.260 . 0 0 "[ . 1 . 2]" 1
179 1 6 SER HB3 1 7 ILE MG . . 6.530 3.871 3.456 4.406 . 0 0 "[ . 1 . 2]" 1
180 1 6 SER HB3 1 43 MET ME . . 6.530 4.268 3.729 5.216 . 0 0 "[ . 1 . 2]" 1
181 1 7 ILE H 1 7 ILE HB . . 3.520 2.308 1.851 3.197 . 0 0 "[ . 1 . 2]" 1
182 1 7 ILE H 1 7 ILE MG . . 4.420 2.226 1.684 3.054 . 0 0 "[ . 1 . 2]" 1
183 1 7 ILE H 1 8 SER H . . 3.210 2.841 2.364 3.137 . 0 0 "[ . 1 . 2]" 1
184 1 7 ILE H 1 9 ASP H . . 5.040 4.391 4.158 4.535 . 0 0 "[ . 1 . 2]" 1
185 1 7 ILE H 1 43 MET HB2 . . 5.500 5.531 5.277 5.594 0.094 10 0 "[ . 1 . 2]" 1
186 1 7 ILE H 1 43 MET QB . . 5.180 4.109 3.789 4.627 . 0 0 "[ . 1 . 2]" 1
187 1 7 ILE H 1 43 MET HB3 . . 5.500 4.253 3.880 5.119 . 0 0 "[ . 1 . 2]" 1
188 1 7 ILE HA 1 7 ILE QG . . 3.970 2.412 1.916 3.282 . 0 0 "[ . 1 . 2]" 1
189 1 7 ILE HA 1 9 ASP H . . 5.310 4.360 4.059 4.560 . 0 0 "[ . 1 . 2]" 1
190 1 7 ILE HA 1 10 TYR H . . 4.290 4.192 4.019 4.237 . 0 0 "[ . 1 . 2]" 1
191 1 7 ILE HA 1 10 TYR QB . . 5.910 4.933 3.774 5.286 . 0 0 "[ . 1 . 2]" 1
192 1 7 ILE HA 1 10 TYR QE . . 6.800 2.267 2.001 2.472 . 0 0 "[ . 1 . 2]" 1
193 1 7 ILE HA 1 15 PHE QE . . 7.620 5.555 5.187 6.213 . 0 0 "[ . 1 . 2]" 1
194 1 7 ILE HA 1 83 PHE QD . . 6.720 4.263 3.552 4.822 . 0 0 "[ . 1 . 2]" 1
195 1 7 ILE HA 1 83 PHE QE . . 7.620 4.239 3.651 4.666 . 0 0 "[ . 1 . 2]" 1
196 1 7 ILE HB 1 15 PHE QE . . 7.620 5.510 4.337 6.633 . 0 0 "[ . 1 . 2]" 1
197 1 7 ILE HB 1 43 MET HA . . 4.380 3.534 2.887 4.082 . 0 0 "[ . 1 . 2]" 1
198 1 7 ILE HB 1 43 MET QB . . 5.820 2.727 2.083 3.778 . 0 0 "[ . 1 . 2]" 1
199 1 7 ILE HB 1 43 MET ME . . 6.530 3.875 3.185 4.525 . 0 0 "[ . 1 . 2]" 1
200 1 7 ILE HB 1 44 THR HA . . 4.230 3.520 2.681 4.084 . 0 0 "[ . 1 . 2]" 1
201 1 7 ILE HB 1 44 THR MG . . 6.530 5.036 4.733 5.481 . 0 0 "[ . 1 . 2]" 1
202 1 7 ILE HB 1 71 VAL QG . . 8.090 5.735 5.511 5.912 . 0 0 "[ . 1 . 2]" 1
203 1 7 ILE HB 1 83 PHE QD . . 7.620 5.649 5.100 6.048 . 0 0 "[ . 1 . 2]" 1
204 1 7 ILE MD 1 8 SER HB2 . . 6.530 5.425 5.322 5.584 . 0 0 "[ . 1 . 2]" 1
205 1 7 ILE MD 1 8 SER HB3 . . 6.530 5.019 4.463 5.562 . 0 0 "[ . 1 . 2]" 1
206 1 7 ILE MD 1 15 PHE QD . . 8.650 3.621 2.704 4.545 . 0 0 "[ . 1 . 2]" 1
207 1 7 ILE MD 1 15 PHE QR . . 9.010 2.965 2.203 3.849 . 0 0 "[ . 1 . 2]" 1
208 1 7 ILE MD 1 15 PHE QE . . 8.650 3.158 2.308 4.156 . 0 0 "[ . 1 . 2]" 1
209 1 7 ILE MD 1 43 MET HA . . 6.530 4.614 4.100 5.352 . 0 0 "[ . 1 . 2]" 1
210 1 7 ILE MD 1 43 MET HB2 . . 6.530 4.237 3.406 5.366 . 0 0 "[ . 1 . 2]" 1
211 1 7 ILE MD 1 43 MET HB3 . . 6.530 3.031 2.230 4.062 . 0 0 "[ . 1 . 2]" 1
212 1 7 ILE MD 1 43 MET ME . . 7.560 4.981 4.159 5.232 . 0 0 "[ . 1 . 2]" 1
213 1 7 ILE MD 1 43 MET HG2 . . 6.530 5.034 4.021 5.515 . 0 0 "[ . 1 . 2]" 1
214 1 7 ILE MD 1 43 MET HG3 . . 6.530 4.598 3.746 5.390 . 0 0 "[ . 1 . 2]" 1
215 1 7 ILE MD 1 44 THR H . . 6.220 3.996 3.271 4.465 . 0 0 "[ . 1 . 2]" 1
216 1 7 ILE MD 1 44 THR HA . . 6.530 2.293 1.986 2.773 . 0 0 "[ . 1 . 2]" 1
217 1 7 ILE MD 1 44 THR HB . . 6.530 2.321 1.973 3.708 . 0 0 "[ . 1 . 2]" 1
218 1 7 ILE MD 1 44 THR MG . . 7.560 3.537 3.060 4.454 . 0 0 "[ . 1 . 2]" 1
219 1 7 ILE MD 1 45 GLU H . . 6.530 5.014 4.598 5.415 . 0 0 "[ . 1 . 2]" 1
220 1 7 ILE MD 1 71 VAL HB . . 6.530 5.412 5.301 5.537 . 0 0 "[ . 1 . 2]" 1
221 1 7 ILE MD 1 71 VAL MG1 . . 7.560 3.143 2.946 3.398 . 0 0 "[ . 1 . 2]" 1
222 1 7 ILE MD 1 71 VAL MG2 . . 7.560 4.213 3.783 4.913 . 0 0 "[ . 1 . 2]" 1
223 1 7 ILE MD 1 75 ARG HD2 . . 6.530 2.337 1.990 2.829 . 0 0 "[ . 1 . 2]" 1
224 1 7 ILE MD 1 75 ARG HD3 . . 6.530 2.777 2.218 3.746 . 0 0 "[ . 1 . 2]" 1
225 1 7 ILE MD 1 82 GLY QA . . 7.190 4.677 3.686 5.224 . 0 0 "[ . 1 . 2]" 1
226 1 7 ILE MD 1 83 PHE QD . . 8.650 3.671 2.970 4.292 . 0 0 "[ . 1 . 2]" 1
227 1 7 ILE MD 1 83 PHE QE . . 8.650 2.910 2.231 3.836 . 0 0 "[ . 1 . 2]" 1
228 1 7 ILE MD 1 83 PHE HZ . . 6.530 2.962 2.365 4.570 . 0 0 "[ . 1 . 2]" 1
229 1 7 ILE QG 1 8 SER H . . 5.570 4.336 3.817 4.658 . 0 0 "[ . 1 . 2]" 1
230 1 7 ILE QG 1 9 ASP H . . 6.380 5.677 5.222 5.803 . 0 0 "[ . 1 . 2]" 1
231 1 7 ILE QG 1 10 TYR H . . 6.380 5.226 4.390 5.566 . 0 0 "[ . 1 . 2]" 1
232 1 7 ILE QG 1 83 PHE H . . 6.380 4.560 3.534 5.799 . 0 0 "[ . 1 . 2]" 1
233 1 7 ILE QG 1 83 PHE QD . . 7.150 3.368 2.686 4.534 . 0 0 "[ . 1 . 2]" 1
234 1 7 ILE QG 1 83 PHE QE . . 7.100 2.976 2.210 4.102 . 0 0 "[ . 1 . 2]" 1
235 1 7 ILE HG12 1 83 PHE QD . . 7.620 3.813 2.947 5.252 . 0 0 "[ . 1 . 2]" 1
236 1 7 ILE HG13 1 83 PHE QD . . 7.620 4.225 2.934 5.813 . 0 0 "[ . 1 . 2]" 1
237 1 7 ILE MG 1 8 SER HA . . 6.530 3.739 3.367 4.718 . 0 0 "[ . 1 . 2]" 1
238 1 7 ILE MG 1 8 SER HB2 . . 6.530 3.317 2.926 4.347 . 0 0 "[ . 1 . 2]" 1
239 1 7 ILE MG 1 8 SER HB3 . . 6.530 2.455 2.085 3.403 . 0 0 "[ . 1 . 2]" 1
240 1 7 ILE MG 1 43 MET HA . . 6.530 4.345 3.081 5.398 . 0 0 "[ . 1 . 2]" 1
241 1 7 ILE MG 1 43 MET QB . . 7.400 4.038 3.591 4.955 . 0 0 "[ . 1 . 2]" 1
242 1 7 ILE MG 1 43 MET ME . . 7.560 4.277 3.360 5.008 . 0 0 "[ . 1 . 2]" 1
243 1 7 ILE MG 1 44 THR HA . . 6.530 3.378 2.891 4.166 . 0 0 "[ . 1 . 2]" 1
244 1 7 ILE MG 1 44 THR MG . . 7.560 5.192 4.953 5.240 . 0 0 "[ . 1 . 2]" 1
245 1 7 ILE MG 1 71 VAL QG . . 9.120 5.132 4.660 5.530 . 0 0 "[ . 1 . 2]" 1
246 1 7 ILE MG 1 82 GLY HA2 . . 6.530 4.462 2.580 5.484 . 0 0 "[ . 1 . 2]" 1
247 1 7 ILE MG 1 82 GLY HA3 . . 6.530 4.781 3.149 5.387 . 0 0 "[ . 1 . 2]" 1
248 1 7 ILE MG 1 83 PHE HA . . 6.530 3.850 2.665 5.270 . 0 0 "[ . 1 . 2]" 1
249 1 7 ILE MG 1 83 PHE QD . . 8.650 4.546 3.671 5.519 . 0 0 "[ . 1 . 2]" 1
250 1 7 ILE MG 1 83 PHE QE . . 8.650 4.740 3.959 5.617 . 0 0 "[ . 1 . 2]" 1
251 1 8 SER H 1 8 SER HB2 . . 3.300 3.312 3.302 3.320 0.020 4 0 "[ . 1 . 2]" 1
252 1 8 SER H 1 8 SER HB3 . . 3.300 2.163 2.005 2.310 . 0 0 "[ . 1 . 2]" 1
253 1 8 SER H 1 9 ASP H . . 3.450 1.988 1.732 2.247 . 0 0 "[ . 1 . 2]" 1
254 1 8 SER H 1 10 TYR H . . 5.470 3.228 2.653 3.582 . 0 0 "[ . 1 . 2]" 1
255 1 8 SER HA 1 8 SER HB2 . . 2.460 1.983 1.847 2.156 . 0 0 "[ . 1 . 2]" 1
256 1 8 SER HA 1 8 SER HB3 . . 2.460 2.566 2.540 2.585 0.125 19 0 "[ . 1 . 2]" 1
257 1 8 SER HA 1 10 TYR H . . 3.450 3.061 2.893 3.433 . 0 0 "[ . 1 . 2]" 1
258 1 8 SER HA 1 83 PHE HA . . 3.270 2.116 1.908 2.479 . 0 0 "[ . 1 . 2]" 1
259 1 8 SER HA 1 84 LYS H . . 4.140 3.962 3.108 4.107 . 0 0 "[ . 1 . 2]" 1
260 1 8 SER QB 1 9 ASP H . . 4.390 3.512 3.076 3.608 . 0 0 "[ . 1 . 2]" 1
261 1 8 SER QB 1 10 TYR H . . 4.730 4.215 4.090 4.239 . 0 0 "[ . 1 . 2]" 1
262 1 8 SER QB 1 83 PHE HA . . 4.190 2.968 2.296 3.665 . 0 0 "[ . 1 . 2]" 1
263 1 8 SER HB2 1 9 ASP HA . . 5.500 5.452 5.058 5.603 0.103 8 0 "[ . 1 . 2]" 1
264 1 8 SER HB2 1 83 PHE HA . . 4.820 3.090 2.338 3.859 . 0 0 "[ . 1 . 2]" 1
265 1 8 SER HB3 1 9 ASP HA . . 5.500 5.518 5.100 5.595 0.095 4 0 "[ . 1 . 2]" 1
266 1 8 SER HB3 1 83 PHE HA . . 4.820 3.927 3.331 4.811 . 0 0 "[ . 1 . 2]" 1
267 1 9 ASP H 1 9 ASP QB . . 3.600 2.331 2.122 2.649 . 0 0 "[ . 1 . 2]" 1
268 1 9 ASP H 1 10 TYR H . . 2.990 2.379 2.088 2.704 . 0 0 "[ . 1 . 2]" 1
269 1 9 ASP HA 1 10 TYR H . . 3.450 3.337 3.152 3.410 . 0 0 "[ . 1 . 2]" 1
270 1 9 ASP HA 1 84 LYS QB . . 4.760 4.105 3.797 4.247 . 0 0 "[ . 1 . 2]" 1
271 1 9 ASP HA 1 84 LYS QD . . 4.390 2.803 2.384 3.295 . 0 0 "[ . 1 . 2]" 1
272 1 9 ASP HA 1 84 LYS QE . . 5.660 3.836 2.529 4.746 . 0 0 "[ . 1 . 2]" 1
273 1 9 ASP HA 1 84 LYS QG . . 6.380 4.644 3.628 5.086 . 0 0 "[ . 1 . 2]" 1
274 1 9 ASP QB 1 10 TYR H . . 4.240 3.425 3.043 3.744 . 0 0 "[ . 1 . 2]" 1
275 1 9 ASP QB 1 10 TYR HA . . 5.910 4.253 3.879 4.745 . 0 0 "[ . 1 . 2]" 1
276 1 9 ASP QB 1 43 MET ME . . 7.400 5.058 4.515 5.422 . 0 0 "[ . 1 . 2]" 1
277 1 10 TYR H 1 11 THR H . . 4.660 4.428 3.820 4.558 . 0 0 "[ . 1 . 2]" 1
278 1 10 TYR H 1 11 THR MG . . 6.530 5.210 4.833 5.369 . 0 0 "[ . 1 . 2]" 1
279 1 10 TYR H 1 84 LYS QD . . 6.380 3.627 3.018 4.229 . 0 0 "[ . 1 . 2]" 1
280 1 10 TYR H 1 84 LYS QG . . 6.380 5.123 3.313 5.614 . 0 0 "[ . 1 . 2]" 1
281 1 10 TYR HA 1 11 THR HA . . 5.500 4.396 4.148 4.858 . 0 0 "[ . 1 . 2]" 1
282 1 10 TYR HA 1 11 THR MG . . 6.530 3.387 2.937 3.669 . 0 0 "[ . 1 . 2]" 1
283 1 10 TYR HA 1 84 LYS QD . . 6.380 3.188 2.089 4.123 . 0 0 "[ . 1 . 2]" 1
284 1 10 TYR HA 1 84 LYS QE . . 6.380 3.282 2.010 5.749 . 0 0 "[ . 1 . 2]" 1
285 1 10 TYR QB 1 15 PHE QB . . 7.250 4.605 4.089 5.527 . 0 0 "[ . 1 . 2]" 1
286 1 10 TYR QB 1 83 PHE QD . . 8.500 4.637 4.306 5.033 . 0 0 "[ . 1 . 2]" 1
287 1 10 TYR QD 1 11 THR HA . . 7.640 4.199 3.455 4.623 . 0 0 "[ . 1 . 2]" 1
288 1 10 TYR QD 1 12 GLU HA . . 6.830 4.857 4.213 5.195 . 0 0 "[ . 1 . 2]" 1
289 1 10 TYR QD 1 12 GLU QG . . 8.520 5.984 5.064 6.482 . 0 0 "[ . 1 . 2]" 1
290 1 10 TYR QD 1 14 GLU HA . . 7.640 5.042 4.272 5.729 . 0 0 "[ . 1 . 2]" 1
291 1 10 TYR QD 1 14 GLU HB2 . . 7.640 4.274 3.030 4.937 . 0 0 "[ . 1 . 2]" 1
292 1 10 TYR QD 1 14 GLU HB3 . . 7.640 3.043 1.961 3.639 . 0 0 "[ . 1 . 2]" 1
293 1 10 TYR QD 1 14 GLU HG2 . . 7.640 4.031 2.318 5.412 . 0 0 "[ . 1 . 2]" 1
294 1 10 TYR QD 1 14 GLU HG3 . . 7.640 4.827 3.475 5.873 . 0 0 "[ . 1 . 2]" 1
295 1 10 TYR QD 1 15 PHE HA . . 7.610 3.787 3.197 4.550 . 0 0 "[ . 1 . 2]" 1
296 1 10 TYR QD 1 15 PHE QD . . 9.760 4.350 3.948 4.992 . 0 0 "[ . 1 . 2]" 1
297 1 10 TYR QD 1 15 PHE QE . . 9.760 5.694 5.215 6.100 . 0 0 "[ . 1 . 2]" 1
298 1 10 TYR QD 1 18 LEU QD . . 10.240 3.835 2.642 4.955 . 0 0 "[ . 1 . 2]" 1
299 1 10 TYR QD 1 43 MET ME . . 8.670 4.867 3.026 6.031 . 0 0 "[ . 1 . 2]" 1
300 1 10 TYR QE 1 12 GLU HG2 . . 7.630 6.505 5.602 7.000 . 0 0 "[ . 1 . 2]" 1
301 1 10 TYR QE 1 12 GLU HG3 . . 7.630 5.949 5.361 6.620 . 0 0 "[ . 1 . 2]" 1
302 1 10 TYR QE 1 14 GLU HB2 . . 7.630 5.720 5.051 6.417 . 0 0 "[ . 1 . 2]" 1
303 1 10 TYR QE 1 14 GLU HB3 . . 7.630 4.452 3.642 5.036 . 0 0 "[ . 1 . 2]" 1
304 1 10 TYR QE 1 18 LEU QD . . 10.230 2.837 1.977 4.196 . 0 0 "[ . 1 . 2]" 1
305 1 10 TYR QE 1 43 MET ME . . 8.660 4.182 2.541 5.349 . 0 0 "[ . 1 . 2]" 1
306 1 10 TYR QE 1 43 MET HG2 . . 7.630 4.157 2.452 5.355 . 0 0 "[ . 1 . 2]" 1
307 1 10 TYR QE 1 43 MET HG3 . . 7.630 3.739 2.250 5.849 . 0 0 "[ . 1 . 2]" 1
308 1 11 THR H 1 11 THR MG . . 4.670 2.122 1.864 3.218 . 0 0 "[ . 1 . 2]" 1
309 1 11 THR H 1 12 GLU H . . 5.130 4.548 4.234 4.712 . 0 0 "[ . 1 . 2]" 1
310 1 11 THR H 1 14 GLU H . . 5.310 3.575 3.436 3.862 . 0 0 "[ . 1 . 2]" 1
311 1 11 THR H 1 14 GLU QB . . 4.800 1.881 1.678 2.153 . 0 0 "[ . 1 . 2]" 1
312 1 11 THR H 1 14 GLU QG . . 6.380 3.022 2.309 3.480 . 0 0 "[ . 1 . 2]" 1
313 1 11 THR H 1 84 LYS QG . . 6.380 4.580 2.873 5.277 . 0 0 "[ . 1 . 2]" 1
314 1 11 THR HA 1 11 THR HB . . 2.650 2.123 1.863 2.276 . 0 0 "[ . 1 . 2]" 1
315 1 11 THR HA 1 12 GLU H . . 3.480 2.567 2.394 2.739 . 0 0 "[ . 1 . 2]" 1
316 1 11 THR HA 1 12 GLU QB . . 5.480 4.241 3.774 4.724 . 0 0 "[ . 1 . 2]" 1
317 1 11 THR HA 1 13 ALA H . . 4.570 4.248 4.054 4.434 . 0 0 "[ . 1 . 2]" 1
318 1 11 THR HA 1 83 PHE HA . . 4.170 4.061 3.648 4.241 0.071 20 0 "[ . 1 . 2]" 1
319 1 11 THR HA 1 83 PHE HB2 . . 3.420 3.299 2.868 3.489 0.069 5 0 "[ . 1 . 2]" 1
320 1 11 THR HA 1 83 PHE HB3 . . 3.420 2.207 2.031 2.634 . 0 0 "[ . 1 . 2]" 1
321 1 11 THR HA 1 84 LYS H . . 3.890 2.213 1.811 2.636 . 0 0 "[ . 1 . 2]" 1
322 1 11 THR HA 1 84 LYS HA . . 3.860 3.891 3.435 3.937 0.077 7 0 "[ . 1 . 2]" 1
323 1 11 THR HA 1 84 LYS HB2 . . 3.270 3.138 2.900 3.312 0.042 7 0 "[ . 1 . 2]" 1
324 1 11 THR HA 1 84 LYS QB . . 2.960 1.948 1.852 2.095 . 0 0 "[ . 1 . 2]" 1
325 1 11 THR HA 1 84 LYS HB3 . . 3.270 1.969 1.862 2.121 . 0 0 "[ . 1 . 2]" 1
326 1 11 THR HA 1 84 LYS QD . . 5.450 4.308 3.875 4.649 . 0 0 "[ . 1 . 2]" 1
327 1 11 THR HA 1 84 LYS QE . . 6.380 4.539 3.247 5.810 . 0 0 "[ . 1 . 2]" 1
328 1 11 THR HA 1 84 LYS QG . . 6.310 3.878 3.010 4.212 . 0 0 "[ . 1 . 2]" 1
329 1 11 THR HA 1 85 GLN HA . . 4.540 4.469 4.103 4.631 0.091 20 0 "[ . 1 . 2]" 1
330 1 11 THR HB 1 12 GLU H . . 3.210 2.658 2.293 2.858 . 0 0 "[ . 1 . 2]" 1
331 1 11 THR HB 1 13 ALA H . . 3.790 3.753 3.662 3.773 . 0 0 "[ . 1 . 2]" 1
332 1 11 THR HB 1 13 ALA MB . . 6.530 4.636 4.469 4.781 . 0 0 "[ . 1 . 2]" 1
333 1 11 THR HB 1 84 LYS HA . . 4.200 4.244 4.235 4.260 0.060 20 0 "[ . 1 . 2]" 1
334 1 11 THR HB 1 84 LYS HB2 . . 5.500 4.416 4.246 4.778 . 0 0 "[ . 1 . 2]" 1
335 1 11 THR HB 1 84 LYS QB . . 4.950 2.785 2.550 3.416 . 0 0 "[ . 1 . 2]" 1
336 1 11 THR HB 1 84 LYS HB3 . . 5.500 2.817 2.570 3.499 . 0 0 "[ . 1 . 2]" 1
337 1 11 THR HB 1 84 LYS QD . . 6.380 4.905 4.259 5.264 . 0 0 "[ . 1 . 2]" 1
338 1 11 THR HB 1 84 LYS QG . . 5.730 3.710 3.408 4.324 . 0 0 "[ . 1 . 2]" 1
339 1 11 THR HB 1 85 GLN HA . . 4.070 2.840 2.480 3.842 . 0 0 "[ . 1 . 2]" 1
340 1 11 THR HB 1 86 GLY QA . . 4.890 4.123 3.592 4.213 . 0 0 "[ . 1 . 2]" 1
341 1 11 THR MG 1 12 GLU H . . 4.920 3.996 3.841 4.090 . 0 0 "[ . 1 . 2]" 1
342 1 11 THR MG 1 12 GLU QB . . 7.400 5.218 5.007 5.431 . 0 0 "[ . 1 . 2]" 1
343 1 11 THR MG 1 13 ALA MB . . 7.560 3.936 3.521 4.666 . 0 0 "[ . 1 . 2]" 1
344 1 11 THR MG 1 14 GLU H . . 5.540 3.474 2.987 4.207 . 0 0 "[ . 1 . 2]" 1
345 1 11 THR MG 1 14 GLU HG2 . . 6.530 4.025 3.042 4.547 . 0 0 "[ . 1 . 2]" 1
346 1 11 THR MG 1 14 GLU HG3 . . 6.530 3.225 2.084 4.689 . 0 0 "[ . 1 . 2]" 1
347 1 11 THR MG 1 84 LYS H . . 5.500 4.281 3.976 4.449 . 0 0 "[ . 1 . 2]" 1
348 1 11 THR MG 1 84 LYS HA . . 6.530 4.213 3.485 4.786 . 0 0 "[ . 1 . 2]" 1
349 1 11 THR MG 1 84 LYS HB2 . . 6.530 3.795 3.497 4.644 . 0 0 "[ . 1 . 2]" 1
350 1 11 THR MG 1 84 LYS HB3 . . 6.530 2.354 2.073 3.535 . 0 0 "[ . 1 . 2]" 1
351 1 11 THR MG 1 84 LYS QD . . 7.160 3.239 2.535 4.094 . 0 0 "[ . 1 . 2]" 1
352 1 11 THR MG 1 84 LYS QE . . 7.400 2.807 1.806 4.699 . 0 0 "[ . 1 . 2]" 1
353 1 11 THR MG 1 84 LYS QG . . 7.400 2.501 2.154 3.616 . 0 0 "[ . 1 . 2]" 1
354 1 11 THR MG 1 85 GLN H . . 5.440 2.956 2.195 3.411 . 0 0 "[ . 1 . 2]" 1
355 1 11 THR MG 1 85 GLN HA . . 6.530 3.644 3.331 4.139 . 0 0 "[ . 1 . 2]" 1
356 1 11 THR MG 1 85 GLN QG . . 7.400 4.670 3.398 5.207 . 0 0 "[ . 1 . 2]" 1
357 1 11 THR MG 1 86 GLY H . . 4.330 3.254 2.845 3.379 . 0 0 "[ . 1 . 2]" 1
358 1 11 THR MG 1 86 GLY QA . . 7.400 2.330 2.050 4.413 . 0 0 "[ . 1 . 2]" 1
359 1 12 GLU H 1 12 GLU QG . . 4.520 3.702 2.785 3.979 . 0 0 "[ . 1 . 2]" 1
360 1 12 GLU H 1 13 ALA H . . 3.390 2.584 2.471 2.684 . 0 0 "[ . 1 . 2]" 1
361 1 12 GLU H 1 13 ALA MB . . 5.750 4.322 4.190 4.452 . 0 0 "[ . 1 . 2]" 1
362 1 12 GLU H 1 83 PHE QB . . 6.380 2.804 2.521 3.126 . 0 0 "[ . 1 . 2]" 1
363 1 12 GLU H 1 84 LYS H . . 5.250 3.591 2.857 4.494 . 0 0 "[ . 1 . 2]" 1
364 1 12 GLU HA 1 12 GLU HB2 . . 3.020 2.670 2.520 3.028 0.008 7 0 "[ . 1 . 2]" 1
365 1 12 GLU HA 1 12 GLU HB3 . . 3.020 2.989 2.595 3.051 0.031 17 0 "[ . 1 . 2]" 1
366 1 12 GLU HA 1 12 GLU HG2 . . 4.170 2.566 2.287 2.836 . 0 0 "[ . 1 . 2]" 1
367 1 12 GLU HA 1 12 GLU QG . . 3.510 2.151 1.962 2.293 . 0 0 "[ . 1 . 2]" 1
368 1 12 GLU HA 1 12 GLU HG3 . . 4.170 2.348 2.114 2.687 . 0 0 "[ . 1 . 2]" 1
369 1 12 GLU HA 1 13 ALA H . . 3.420 3.386 3.332 3.407 . 0 0 "[ . 1 . 2]" 1
370 1 12 GLU HA 1 15 PHE H . . 3.640 3.269 2.797 3.493 . 0 0 "[ . 1 . 2]" 1
371 1 12 GLU HA 1 15 PHE HB2 . . 3.670 3.514 2.600 3.720 0.050 13 0 "[ . 1 . 2]" 1
372 1 12 GLU HA 1 15 PHE HB3 . . 3.670 3.029 2.371 3.505 . 0 0 "[ . 1 . 2]" 1
373 1 12 GLU HA 1 15 PHE QE . . 7.620 6.188 5.393 6.487 . 0 0 "[ . 1 . 2]" 1
374 1 12 GLU HA 1 68 VAL QG . . 8.090 4.348 3.812 4.731 . 0 0 "[ . 1 . 2]" 1
375 1 12 GLU HA 1 83 PHE QD . . 7.620 2.982 2.611 3.719 . 0 0 "[ . 1 . 2]" 1
376 1 12 GLU QG 1 13 ALA H . . 5.230 4.126 3.787 4.519 . 0 0 "[ . 1 . 2]" 1
377 1 12 GLU QG 1 14 GLU H . . 6.380 5.259 4.727 5.651 . 0 0 "[ . 1 . 2]" 1
378 1 12 GLU QG 1 68 VAL QG . . 6.770 3.334 2.924 3.796 . 0 0 "[ . 1 . 2]" 1
379 1 12 GLU QG 1 83 PHE QD . . 8.500 2.989 2.426 3.799 . 0 0 "[ . 1 . 2]" 1
380 1 12 GLU HG2 1 68 VAL MG1 . . 8.280 3.588 3.264 4.193 . 0 0 "[ . 1 . 2]" 1
381 1 12 GLU HG2 1 68 VAL MG2 . . 8.280 5.848 5.252 6.556 . 0 0 "[ . 1 . 2]" 1
382 1 12 GLU HG3 1 68 VAL MG1 . . 8.280 4.172 3.222 4.569 . 0 0 "[ . 1 . 2]" 1
383 1 12 GLU HG3 1 68 VAL MG2 . . 8.280 6.639 5.531 6.969 . 0 0 "[ . 1 . 2]" 1
384 1 12 GLU O 1 16 LEU H . . 2.300 2.129 1.687 2.388 0.088 11 0 "[ . 1 . 2]" 1
385 1 13 ALA H 1 14 GLU H . . 3.300 2.027 1.947 2.133 . 0 0 "[ . 1 . 2]" 1
386 1 13 ALA H 1 14 GLU QB . . 4.860 3.410 3.175 3.593 . 0 0 "[ . 1 . 2]" 1
387 1 13 ALA H 1 15 PHE H . . 3.760 3.674 3.539 3.721 . 0 0 "[ . 1 . 2]" 1
388 1 13 ALA H 1 16 LEU H . . 4.260 4.235 4.219 4.252 . 0 0 "[ . 1 . 2]" 1
389 1 13 ALA H 1 16 LEU QB . . 5.320 4.497 4.412 4.595 . 0 0 "[ . 1 . 2]" 1
390 1 13 ALA H 1 16 LEU QD . . 7.660 5.338 5.181 5.476 . 0 0 "[ . 1 . 2]" 1
391 1 13 ALA HA 1 16 LEU H . . 3.240 2.961 2.738 3.216 . 0 0 "[ . 1 . 2]" 1
392 1 13 ALA HA 1 16 LEU HB2 . . 3.450 2.894 2.641 3.376 . 0 0 "[ . 1 . 2]" 1
393 1 13 ALA HA 1 16 LEU QB . . 3.150 2.175 2.052 2.386 . 0 0 "[ . 1 . 2]" 1
394 1 13 ALA HA 1 16 LEU HB3 . . 3.450 2.251 2.137 2.440 . 0 0 "[ . 1 . 2]" 1
395 1 13 ALA HA 1 16 LEU MD1 . . 6.530 4.885 4.709 5.136 . 0 0 "[ . 1 . 2]" 1
396 1 13 ALA HA 1 16 LEU QD . . 6.050 3.214 3.004 3.490 . 0 0 "[ . 1 . 2]" 1
397 1 13 ALA HA 1 16 LEU MD2 . . 6.530 3.260 3.039 3.553 . 0 0 "[ . 1 . 2]" 1
398 1 13 ALA HA 1 17 GLN H . . 3.950 3.902 3.872 3.920 . 0 0 "[ . 1 . 2]" 1
399 1 13 ALA MB 1 14 GLU H . . 4.200 2.671 2.431 2.818 . 0 0 "[ . 1 . 2]" 1
400 1 13 ALA MB 1 16 LEU QB . . 7.400 3.524 3.319 3.848 . 0 0 "[ . 1 . 2]" 1
401 1 13 ALA MB 1 16 LEU QD . . 9.130 3.925 3.653 4.362 . 0 0 "[ . 1 . 2]" 1
402 1 13 ALA MB 1 17 GLN QB . . 7.400 4.190 4.007 4.662 . 0 0 "[ . 1 . 2]" 1
403 1 13 ALA O 1 17 GLN H . . 2.300 2.014 1.906 2.154 . 0 0 "[ . 1 . 2]" 1
404 1 14 GLU H 1 14 GLU HG2 . . 5.500 4.045 3.354 4.423 . 0 0 "[ . 1 . 2]" 1
405 1 14 GLU H 1 14 GLU QG . . 4.970 3.345 2.699 3.706 . 0 0 "[ . 1 . 2]" 1
406 1 14 GLU H 1 14 GLU HG3 . . 5.500 3.641 2.776 4.367 . 0 0 "[ . 1 . 2]" 1
407 1 14 GLU H 1 15 PHE H . . 3.300 2.703 2.531 2.950 . 0 0 "[ . 1 . 2]" 1
408 1 14 GLU H 1 16 LEU H . . 5.040 3.787 3.539 3.930 . 0 0 "[ . 1 . 2]" 1
409 1 14 GLU H 1 16 LEU QD . . 8.100 5.825 5.659 5.973 . 0 0 "[ . 1 . 2]" 1
410 1 14 GLU HA 1 14 GLU QB . . 2.730 2.552 2.485 2.602 . 0 0 "[ . 1 . 2]" 1
411 1 14 GLU HA 1 14 GLU HG2 . . 3.390 2.540 1.956 3.197 . 0 0 "[ . 1 . 2]" 1
412 1 14 GLU HA 1 14 GLU QG . . 3.170 2.101 1.939 2.439 . 0 0 "[ . 1 . 2]" 1
413 1 14 GLU HA 1 14 GLU HG3 . . 3.390 2.519 2.074 3.194 . 0 0 "[ . 1 . 2]" 1
414 1 14 GLU HA 1 16 LEU H . . 4.450 4.347 4.284 4.374 . 0 0 "[ . 1 . 2]" 1
415 1 14 GLU HA 1 17 GLN QB . . 4.520 3.017 2.474 4.025 . 0 0 "[ . 1 . 2]" 1
416 1 14 GLU QB 1 15 PHE H . . 4.520 2.519 2.297 2.800 . 0 0 "[ . 1 . 2]" 1
417 1 14 GLU QB 1 83 PHE QD . . 6.760 4.216 3.888 4.625 . 0 0 "[ . 1 . 2]" 1
418 1 14 GLU HB2 1 83 PHE QD . . 6.880 5.002 4.626 5.638 . 0 0 "[ . 1 . 2]" 1
419 1 14 GLU HB3 1 83 PHE QD . . 6.880 4.564 4.110 5.161 . 0 0 "[ . 1 . 2]" 1
420 1 14 GLU QG 1 83 PHE QD . . 8.500 6.076 5.740 6.593 . 0 0 "[ . 1 . 2]" 1
421 1 15 PHE H 1 16 LEU H . . 3.640 2.429 2.234 2.599 . 0 0 "[ . 1 . 2]" 1
422 1 15 PHE H 1 17 GLN H . . 4.110 4.054 4.031 4.067 . 0 0 "[ . 1 . 2]" 1
423 1 15 PHE H 1 68 VAL QG . . 8.090 4.575 4.409 4.768 . 0 0 "[ . 1 . 2]" 1
424 1 15 PHE HA 1 18 LEU H . . 3.860 2.976 2.747 3.339 . 0 0 "[ . 1 . 2]" 1
425 1 15 PHE HA 1 18 LEU HB2 . . 4.200 2.653 2.252 3.287 . 0 0 "[ . 1 . 2]" 1
426 1 15 PHE HA 1 18 LEU QB . . 3.730 2.223 1.959 2.631 . 0 0 "[ . 1 . 2]" 1
427 1 15 PHE HA 1 18 LEU HB3 . . 4.200 2.401 2.048 2.836 . 0 0 "[ . 1 . 2]" 1
428 1 15 PHE HA 1 18 LEU MD1 . . 6.530 3.814 2.809 4.571 . 0 0 "[ . 1 . 2]" 1
429 1 15 PHE HA 1 18 LEU MD2 . . 6.530 4.069 3.021 5.254 . 0 0 "[ . 1 . 2]" 1
430 1 15 PHE HA 1 18 LEU HG . . 5.040 4.541 3.971 4.697 . 0 0 "[ . 1 . 2]" 1
431 1 15 PHE HA 1 19 VAL H . . 4.420 4.025 3.859 4.267 . 0 0 "[ . 1 . 2]" 1
432 1 15 PHE QB 1 18 LEU QD . . 8.970 4.439 3.946 5.314 . 0 0 "[ . 1 . 2]" 1
433 1 15 PHE QR 1 18 LEU QB . . 8.860 2.336 2.114 3.076 . 0 0 "[ . 1 . 2]" 1
434 1 15 PHE QD 1 68 VAL MG1 . . 8.650 2.489 2.042 3.272 . 0 0 "[ . 1 . 2]" 1
435 1 15 PHE QD 1 68 VAL MG2 . . 8.650 4.324 3.984 4.637 . 0 0 "[ . 1 . 2]" 1
436 1 15 PHE QD 1 71 VAL MG1 . . 8.650 3.402 2.704 3.938 . 0 0 "[ . 1 . 2]" 1
437 1 15 PHE QD 1 71 VAL MG2 . . 8.650 4.692 4.165 5.365 . 0 0 "[ . 1 . 2]" 1
438 1 15 PHE QE 1 18 LEU QB . . 8.500 3.982 3.644 4.801 . 0 0 "[ . 1 . 2]" 1
439 1 15 PHE QE 1 18 LEU QD . . 10.220 2.762 2.269 4.640 . 0 0 "[ . 1 . 2]" 1
440 1 15 PHE QE 1 43 MET HG2 . . 7.620 4.563 3.506 5.720 . 0 0 "[ . 1 . 2]" 1
441 1 15 PHE QE 1 43 MET HG3 . . 7.620 4.356 2.905 6.373 . 0 0 "[ . 1 . 2]" 1
442 1 15 PHE QE 1 68 VAL HA . . 7.620 4.273 3.230 5.334 . 0 0 "[ . 1 . 2]" 1
443 1 15 PHE QE 1 68 VAL MG1 . . 8.650 3.320 2.494 3.990 . 0 0 "[ . 1 . 2]" 1
444 1 15 PHE QE 1 68 VAL MG2 . . 8.650 4.711 4.254 5.119 . 0 0 "[ . 1 . 2]" 1
445 1 15 PHE QE 1 71 VAL HB . . 7.620 3.695 2.307 4.785 . 0 0 "[ . 1 . 2]" 1
446 1 15 PHE QE 1 71 VAL QG . . 10.210 2.265 2.009 2.883 . 0 0 "[ . 1 . 2]" 1
447 1 15 PHE O 1 19 VAL H . . 2.300 1.994 1.918 2.123 . 0 0 "[ . 1 . 2]" 1
448 1 16 LEU H 1 16 LEU HB2 . . 3.360 2.447 2.377 2.549 . 0 0 "[ . 1 . 2]" 1
449 1 16 LEU H 1 16 LEU HB3 . . 3.360 2.448 2.370 2.528 . 0 0 "[ . 1 . 2]" 1
450 1 16 LEU H 1 16 LEU MD1 . . 5.290 4.229 4.179 4.252 . 0 0 "[ . 1 . 2]" 1
451 1 16 LEU H 1 16 LEU QD . . 4.950 3.754 3.703 3.772 . 0 0 "[ . 1 . 2]" 1
452 1 16 LEU H 1 16 LEU MD2 . . 5.290 4.199 4.111 4.232 . 0 0 "[ . 1 . 2]" 1
453 1 16 LEU H 1 16 LEU HG . . 4.500 4.464 4.419 4.510 0.010 20 0 "[ . 1 . 2]" 1
454 1 16 LEU H 1 17 GLN H . . 2.930 2.527 2.429 2.664 . 0 0 "[ . 1 . 2]" 1
455 1 16 LEU H 1 17 GLN QB . . 6.040 4.150 3.796 5.057 . 0 0 "[ . 1 . 2]" 1
456 1 16 LEU H 1 17 GLN QG . . 6.380 5.367 3.708 5.791 . 0 0 "[ . 1 . 2]" 1
457 1 16 LEU H 1 18 LEU QD . . 8.100 5.722 5.476 6.049 . 0 0 "[ . 1 . 2]" 1
458 1 16 LEU H 1 19 VAL HB . . 5.500 5.332 5.081 5.531 0.031 17 0 "[ . 1 . 2]" 1
459 1 16 LEU H 1 68 VAL QG . . 6.410 3.305 3.169 3.511 . 0 0 "[ . 1 . 2]" 1
460 1 16 LEU HA 1 19 VAL H . . 3.450 3.395 3.239 3.438 . 0 0 "[ . 1 . 2]" 1
461 1 16 LEU HA 1 19 VAL HB . . 3.790 2.796 2.606 2.999 . 0 0 "[ . 1 . 2]" 1
462 1 16 LEU HA 1 19 VAL MG1 . . 6.530 4.059 3.361 4.342 . 0 0 "[ . 1 . 2]" 1
463 1 16 LEU HA 1 19 VAL MG2 . . 6.530 3.034 2.715 4.301 . 0 0 "[ . 1 . 2]" 1
464 1 16 LEU HA 1 68 VAL H . . 5.500 5.391 5.317 5.556 0.056 15 0 "[ . 1 . 2]" 1
465 1 16 LEU HA 1 68 VAL MG1 . . 6.530 2.164 2.005 2.292 . 0 0 "[ . 1 . 2]" 1
466 1 16 LEU HA 1 68 VAL MG2 . . 6.530 2.052 1.918 2.214 . 0 0 "[ . 1 . 2]" 1
467 1 16 LEU QB 1 17 GLN H . . 3.660 2.634 2.546 2.679 . 0 0 "[ . 1 . 2]" 1
468 1 16 LEU QB 1 17 GLN HA . . 5.260 4.065 3.953 4.154 . 0 0 "[ . 1 . 2]" 1
469 1 16 LEU QB 1 18 LEU H . . 5.110 4.482 4.463 4.497 . 0 0 "[ . 1 . 2]" 1
470 1 16 LEU QB 1 19 VAL QG . . 8.960 4.390 4.271 4.628 . 0 0 "[ . 1 . 2]" 1
471 1 16 LEU HB2 1 17 GLN H . . 3.920 3.866 3.832 3.877 . 0 0 "[ . 1 . 2]" 1
472 1 16 LEU HB2 1 68 VAL MG1 . . 6.530 2.598 2.251 2.852 . 0 0 "[ . 1 . 2]" 1
473 1 16 LEU HB2 1 68 VAL MG2 . . 6.530 3.725 3.562 3.858 . 0 0 "[ . 1 . 2]" 1
474 1 16 LEU HB3 1 17 GLN H . . 3.920 2.681 2.584 2.732 . 0 0 "[ . 1 . 2]" 1
475 1 16 LEU HB3 1 68 VAL MG1 . . 6.530 3.989 3.730 4.231 . 0 0 "[ . 1 . 2]" 1
476 1 16 LEU HB3 1 68 VAL MG2 . . 6.530 4.559 4.452 4.691 . 0 0 "[ . 1 . 2]" 1
477 1 16 LEU QD 1 17 GLN H . . 5.180 4.012 3.936 4.057 . 0 0 "[ . 1 . 2]" 1
478 1 16 LEU QD 1 17 GLN QB . . 8.970 4.737 4.580 4.913 . 0 0 "[ . 1 . 2]" 1
479 1 16 LEU QD 1 64 PRO HA . . 7.290 4.384 3.920 4.624 . 0 0 "[ . 1 . 2]" 1
480 1 16 LEU QD 1 65 SER HA . . 6.260 1.822 1.751 1.881 . 0 0 "[ . 1 . 2]" 1
481 1 16 LEU QD 1 69 ASN H . . 5.630 3.950 3.903 4.021 . 0 0 "[ . 1 . 2]" 1
482 1 16 LEU MD1 1 17 GLN H . . 5.470 4.296 4.186 4.361 . 0 0 "[ . 1 . 2]" 1
483 1 16 LEU MD1 1 19 VAL HB . . 6.530 2.818 2.619 3.105 . 0 0 "[ . 1 . 2]" 1
484 1 16 LEU MD1 1 65 SER HA . . 6.530 1.839 1.780 1.943 . 0 0 "[ . 1 . 2]" 1
485 1 16 LEU MD1 1 65 SER HB2 . . 6.530 3.260 2.868 3.746 . 0 0 "[ . 1 . 2]" 1
486 1 16 LEU MD1 1 65 SER HB3 . . 6.530 2.414 2.082 3.663 . 0 0 "[ . 1 . 2]" 1
487 1 16 LEU MD1 1 68 VAL HB . . 6.530 2.096 2.019 2.204 . 0 0 "[ . 1 . 2]" 1
488 1 16 LEU MD1 1 68 VAL MG1 . . 7.560 2.719 2.514 2.952 . 0 0 "[ . 1 . 2]" 1
489 1 16 LEU MD1 1 68 VAL MG2 . . 7.560 1.915 1.865 1.993 . 0 0 "[ . 1 . 2]" 1
490 1 16 LEU MD1 1 69 ASN H . . 6.530 4.172 4.063 4.405 . 0 0 "[ . 1 . 2]" 1
491 1 16 LEU MD2 1 19 VAL HB . . 6.530 5.379 5.160 5.522 . 0 0 "[ . 1 . 2]" 1
492 1 16 LEU MD2 1 65 SER HA . . 6.530 3.041 2.455 3.394 . 0 0 "[ . 1 . 2]" 1
493 1 16 LEU MD2 1 65 SER HB2 . . 6.530 3.250 2.869 4.020 . 0 0 "[ . 1 . 2]" 1
494 1 16 LEU MD2 1 65 SER HB3 . . 6.530 3.007 2.361 3.935 . 0 0 "[ . 1 . 2]" 1
495 1 16 LEU MD2 1 68 VAL HB . . 6.530 3.153 2.802 3.421 . 0 0 "[ . 1 . 2]" 1
496 1 16 LEU MD2 1 68 VAL MG1 . . 7.560 3.342 3.045 3.578 . 0 0 "[ . 1 . 2]" 1
497 1 16 LEU MD2 1 68 VAL MG2 . . 7.560 3.649 3.505 3.767 . 0 0 "[ . 1 . 2]" 1
498 1 16 LEU MD2 1 69 ASN H . . 6.530 4.904 4.642 5.043 . 0 0 "[ . 1 . 2]" 1
499 1 16 LEU HG 1 17 GLN H . . 4.350 3.998 3.893 4.125 . 0 0 "[ . 1 . 2]" 1
500 1 16 LEU HG 1 17 GLN HA . . 4.320 4.039 4.032 4.047 . 0 0 "[ . 1 . 2]" 1
501 1 16 LEU HG 1 68 VAL MG1 . . 6.530 4.582 4.315 4.815 . 0 0 "[ . 1 . 2]" 1
502 1 16 LEU HG 1 68 VAL MG2 . . 6.530 4.187 4.090 4.371 . 0 0 "[ . 1 . 2]" 1
503 1 16 LEU O 1 20 THR H . . 2.300 2.067 1.890 2.373 0.073 20 0 "[ . 1 . 2]" 1
504 1 17 GLN H 1 17 GLN HA . . 2.650 2.659 2.653 2.665 0.015 10 0 "[ . 1 . 2]" 1
505 1 17 GLN H 1 17 GLN QB . . 3.680 2.131 1.864 2.738 . 0 0 "[ . 1 . 2]" 1
506 1 17 GLN H 1 17 GLN QG . . 4.110 3.343 1.970 3.693 . 0 0 "[ . 1 . 2]" 1
507 1 17 GLN H 1 18 LEU H . . 3.140 2.405 2.359 2.498 . 0 0 "[ . 1 . 2]" 1
508 1 17 GLN H 1 18 LEU QB . . 4.640 4.156 4.135 4.174 . 0 0 "[ . 1 . 2]" 1
509 1 17 GLN H 1 19 VAL H . . 4.070 4.017 3.998 4.024 . 0 0 "[ . 1 . 2]" 1
510 1 17 GLN H 1 20 THR H . . 4.880 4.458 4.362 4.550 . 0 0 "[ . 1 . 2]" 1
511 1 17 GLN H 1 20 THR MG . . 5.600 4.408 4.394 4.421 . 0 0 "[ . 1 . 2]" 1
512 1 17 GLN HA 1 17 GLN QG . . 3.560 2.791 2.515 3.147 . 0 0 "[ . 1 . 2]" 1
513 1 17 GLN HA 1 18 LEU H . . 3.520 3.475 3.441 3.491 . 0 0 "[ . 1 . 2]" 1
514 1 17 GLN HA 1 20 THR H . . 3.450 3.235 3.053 3.399 . 0 0 "[ . 1 . 2]" 1
515 1 17 GLN HA 1 20 THR HB . . 2.430 2.290 2.008 2.486 0.056 10 0 "[ . 1 . 2]" 1
516 1 17 GLN HA 1 20 THR MG . . 6.530 2.163 2.144 2.199 . 0 0 "[ . 1 . 2]" 1
517 1 17 GLN HA 1 21 THR H . . 5.070 4.311 4.117 4.628 . 0 0 "[ . 1 . 2]" 1
518 1 17 GLN QB 1 18 LEU H . . 4.390 2.967 2.713 3.718 . 0 0 "[ . 1 . 2]" 1
519 1 17 GLN QB 1 18 LEU HA . . 4.920 4.278 4.227 4.390 . 0 0 "[ . 1 . 2]" 1
520 1 17 GLN QB 1 20 THR HB . . 5.660 4.238 3.583 4.527 . 0 0 "[ . 1 . 2]" 1
521 1 17 GLN QB 1 20 THR MG . . 7.400 3.319 2.653 3.523 . 0 0 "[ . 1 . 2]" 1
522 1 17 GLN QG 1 18 LEU H . . 5.420 3.156 2.356 3.498 . 0 0 "[ . 1 . 2]" 1
523 1 17 GLN QG 1 18 LEU HA . . 4.080 3.178 2.738 3.365 . 0 0 "[ . 1 . 2]" 1
524 1 17 GLN QG 1 20 THR HB . . 5.660 4.332 3.701 4.822 . 0 0 "[ . 1 . 2]" 1
525 1 17 GLN QG 1 20 THR MG . . 7.400 2.978 2.338 4.217 . 0 0 "[ . 1 . 2]" 1
526 1 18 LEU H 1 18 LEU HA . . 2.930 2.803 2.725 2.848 . 0 0 "[ . 1 . 2]" 1
527 1 18 LEU H 1 18 LEU MD1 . . 5.350 4.157 4.021 4.275 . 0 0 "[ . 1 . 2]" 1
528 1 18 LEU H 1 18 LEU QD . . 4.830 3.698 3.579 3.752 . 0 0 "[ . 1 . 2]" 1
529 1 18 LEU H 1 18 LEU MD2 . . 5.350 4.162 3.870 4.302 . 0 0 "[ . 1 . 2]" 1
530 1 18 LEU H 1 18 LEU HG . . 4.570 4.402 4.344 4.432 . 0 0 "[ . 1 . 2]" 1
531 1 18 LEU H 1 19 VAL H . . 3.270 2.467 2.264 2.665 . 0 0 "[ . 1 . 2]" 1
532 1 18 LEU H 1 19 VAL QG . . 8.090 4.125 3.875 4.572 . 0 0 "[ . 1 . 2]" 1
533 1 18 LEU H 1 20 THR H . . 4.570 3.701 3.456 3.889 . 0 0 "[ . 1 . 2]" 1
534 1 18 LEU HA 1 18 LEU HG . . 3.450 2.904 2.413 3.253 . 0 0 "[ . 1 . 2]" 1
535 1 18 LEU HA 1 21 THR H . . 5.070 3.076 2.943 3.299 . 0 0 "[ . 1 . 2]" 1
536 1 18 LEU HA 1 21 THR HB . . 4.000 2.340 2.104 2.581 . 0 0 "[ . 1 . 2]" 1
537 1 18 LEU HA 1 21 THR MG . . 6.530 3.434 3.058 3.872 . 0 0 "[ . 1 . 2]" 1
538 1 18 LEU HA 1 36 LEU QD . . 8.100 3.785 3.343 4.102 . 0 0 "[ . 1 . 2]" 1
539 1 18 LEU QB 1 19 VAL H . . 5.170 2.561 2.399 2.659 . 0 0 "[ . 1 . 2]" 1
540 1 18 LEU QB 1 19 VAL HA . . 5.630 4.313 4.119 4.433 . 0 0 "[ . 1 . 2]" 1
541 1 18 LEU QB 1 19 VAL QG . . 8.960 3.239 2.924 4.289 . 0 0 "[ . 1 . 2]" 1
542 1 18 LEU HB2 1 19 VAL H . . 5.500 3.766 3.625 3.881 . 0 0 "[ . 1 . 2]" 1
543 1 18 LEU HB3 1 19 VAL H . . 5.500 2.606 2.434 2.714 . 0 0 "[ . 1 . 2]" 1
544 1 18 LEU QD 1 19 VAL H . . 8.100 3.499 3.194 4.106 . 0 0 "[ . 1 . 2]" 1
545 1 18 LEU QD 1 19 VAL HA . . 8.100 3.582 3.000 4.695 . 0 0 "[ . 1 . 2]" 1
546 1 18 LEU QD 1 19 VAL HB . . 8.100 4.864 4.464 5.408 . 0 0 "[ . 1 . 2]" 1
547 1 18 LEU QD 1 19 VAL QG . . 10.470 3.106 2.451 4.596 . 0 0 "[ . 1 . 2]" 1
548 1 18 LEU QD 1 21 THR HB . . 5.450 3.100 2.268 4.026 . 0 0 "[ . 1 . 2]" 1
549 1 18 LEU QD 1 22 ILE H . . 8.100 4.279 3.617 5.315 . 0 0 "[ . 1 . 2]" 1
550 1 18 LEU QD 1 22 ILE MD . . 9.130 2.563 1.982 3.605 . 0 0 "[ . 1 . 2]" 1
551 1 18 LEU QD 1 36 LEU HA . . 8.100 3.012 2.578 3.702 . 0 0 "[ . 1 . 2]" 1
552 1 18 LEU QD 1 36 LEU QB . . 6.770 2.615 1.927 3.660 . 0 0 "[ . 1 . 2]" 1
553 1 18 LEU QD 1 36 LEU QD . . 8.150 1.843 1.606 2.105 . 0 0 "[ . 1 . 2]" 1
554 1 18 LEU QD 1 36 LEU HG . . 8.100 3.894 3.389 4.402 . 0 0 "[ . 1 . 2]" 1
555 1 18 LEU QD 1 39 HIS QB . . 8.970 2.987 2.458 3.683 . 0 0 "[ . 1 . 2]" 1
556 1 18 LEU QD 1 39 HIS HD2 . . 5.860 2.419 1.893 4.014 . 0 0 "[ . 1 . 2]" 1
557 1 18 LEU QD 1 40 PHE H . . 6.360 4.040 3.581 4.322 . 0 0 "[ . 1 . 2]" 1
558 1 18 LEU QD 1 40 PHE QB . . 8.050 3.502 3.005 4.174 . 0 0 "[ . 1 . 2]" 1
559 1 18 LEU MD1 1 21 THR HB . . 6.530 4.134 2.733 5.552 . 0 0 "[ . 1 . 2]" 1
560 1 18 LEU MD1 1 36 LEU HB2 . . 8.280 4.794 3.382 6.103 . 0 0 "[ . 1 . 2]" 1
561 1 18 LEU MD1 1 36 LEU HB3 . . 8.280 3.490 1.957 4.898 . 0 0 "[ . 1 . 2]" 1
562 1 18 LEU MD1 1 36 LEU MD1 . . 10.690 3.114 1.946 5.036 . 0 0 "[ . 1 . 2]" 1
563 1 18 LEU MD1 1 36 LEU MD2 . . 10.690 2.534 1.957 4.079 . 0 0 "[ . 1 . 2]" 1
564 1 18 LEU MD1 1 39 HIS HD2 . . 6.530 3.038 1.963 4.303 . 0 0 "[ . 1 . 2]" 1
565 1 18 LEU MD1 1 40 PHE HB2 . . 9.670 4.846 3.445 6.139 . 0 0 "[ . 1 . 2]" 1
566 1 18 LEU MD1 1 40 PHE HB3 . . 9.670 6.227 4.836 7.543 . 0 0 "[ . 1 . 2]" 1
567 1 18 LEU MD2 1 21 THR HB . . 6.530 3.800 2.277 5.534 . 0 0 "[ . 1 . 2]" 1
568 1 18 LEU MD2 1 36 LEU HB2 . . 8.280 4.417 3.572 5.799 . 0 0 "[ . 1 . 2]" 1
569 1 18 LEU MD2 1 36 LEU HB3 . . 8.280 3.096 2.154 4.463 . 0 0 "[ . 1 . 2]" 1
570 1 18 LEU MD2 1 36 LEU MD1 . . 10.690 2.824 1.878 5.186 . 0 0 "[ . 1 . 2]" 1
571 1 18 LEU MD2 1 36 LEU MD2 . . 10.690 2.566 1.862 4.040 . 0 0 "[ . 1 . 2]" 1
572 1 18 LEU MD2 1 39 HIS HD2 . . 6.530 3.092 1.898 5.118 . 0 0 "[ . 1 . 2]" 1
573 1 18 LEU MD2 1 40 PHE HB2 . . 9.670 4.533 3.075 6.636 . 0 0 "[ . 1 . 2]" 1
574 1 18 LEU MD2 1 40 PHE HB3 . . 9.670 5.936 4.489 7.971 . 0 0 "[ . 1 . 2]" 1
575 1 18 LEU HG 1 19 VAL H . . 5.500 4.544 3.843 5.026 . 0 0 "[ . 1 . 2]" 1
576 1 18 LEU HG 1 22 ILE MD . . 6.530 4.140 3.006 4.808 . 0 0 "[ . 1 . 2]" 1
577 1 18 LEU HG 1 36 LEU QD . . 8.100 2.616 2.115 2.927 . 0 0 "[ . 1 . 2]" 1
578 1 18 LEU HG 1 36 LEU HG . . 5.500 5.473 4.940 5.610 0.110 4 0 "[ . 1 . 2]" 1
579 1 18 LEU HG 1 39 HIS HD2 . . 4.510 4.094 2.783 4.221 . 0 0 "[ . 1 . 2]" 1
580 1 18 LEU O 1 22 ILE H . . 2.300 2.396 2.387 2.407 0.107 1 0 "[ . 1 . 2]" 1
581 1 19 VAL H 1 19 VAL HB . . 3.270 2.281 2.138 2.442 . 0 0 "[ . 1 . 2]" 1
582 1 19 VAL H 1 19 VAL QG . . 4.070 2.466 2.292 3.022 . 0 0 "[ . 1 . 2]" 1
583 1 19 VAL H 1 20 THR H . . 3.300 2.371 2.256 2.494 . 0 0 "[ . 1 . 2]" 1
584 1 19 VAL H 1 20 THR MG . . 6.030 4.807 4.747 4.870 . 0 0 "[ . 1 . 2]" 1
585 1 19 VAL H 1 21 THR H . . 4.720 3.883 3.651 3.993 . 0 0 "[ . 1 . 2]" 1
586 1 19 VAL HA 1 22 ILE H . . 4.110 3.698 3.475 3.863 . 0 0 "[ . 1 . 2]" 1
587 1 19 VAL HA 1 22 ILE HB . . 3.640 3.375 3.149 3.561 . 0 0 "[ . 1 . 2]" 1
588 1 19 VAL HA 1 22 ILE MD . . 6.530 2.883 2.627 3.076 . 0 0 "[ . 1 . 2]" 1
589 1 19 VAL HA 1 22 ILE MG . . 6.530 4.415 4.270 4.582 . 0 0 "[ . 1 . 2]" 1
590 1 19 VAL HA 1 23 CYS H . . 5.500 4.183 3.999 4.296 . 0 0 "[ . 1 . 2]" 1
591 1 19 VAL HA 1 40 PHE QD . . 7.620 3.784 3.434 4.227 . 0 0 "[ . 1 . 2]" 1
592 1 19 VAL HA 1 53 ILE QG . . 6.350 5.275 4.975 5.367 . 0 0 "[ . 1 . 2]" 1
593 1 19 VAL HA 1 68 VAL MG1 . . 6.530 5.333 5.263 5.400 . 0 0 "[ . 1 . 2]" 1
594 1 19 VAL HA 1 68 VAL MG2 . . 6.530 4.125 3.914 4.195 . 0 0 "[ . 1 . 2]" 1
595 1 19 VAL HB 1 68 VAL MG1 . . 6.530 3.616 3.337 3.763 . 0 0 "[ . 1 . 2]" 1
596 1 19 VAL HB 1 68 VAL MG2 . . 6.530 2.158 1.936 2.236 . 0 0 "[ . 1 . 2]" 1
597 1 19 VAL QG 1 20 THR H . . 6.380 3.118 2.456 3.333 . 0 0 "[ . 1 . 2]" 1
598 1 19 VAL QG 1 22 ILE MD . . 9.120 3.284 3.029 3.462 . 0 0 "[ . 1 . 2]" 1
599 1 19 VAL QG 1 23 CYS H . . 8.090 3.635 3.527 3.732 . 0 0 "[ . 1 . 2]" 1
600 1 19 VAL QG 1 40 PHE HA . . 8.030 4.738 4.399 5.348 . 0 0 "[ . 1 . 2]" 1
601 1 19 VAL QG 1 40 PHE QB . . 8.900 3.503 3.206 3.700 . 0 0 "[ . 1 . 2]" 1
602 1 19 VAL QG 1 52 LEU QD . . 10.690 4.013 3.700 4.488 . 0 0 "[ . 1 . 2]" 1
603 1 19 VAL QG 1 53 ILE MD . . 9.120 2.327 1.960 3.214 . 0 0 "[ . 1 . 2]" 1
604 1 19 VAL QG 1 53 ILE MG . . 9.120 3.406 2.773 3.830 . 0 0 "[ . 1 . 2]" 1
605 1 19 VAL QG 1 65 SER H . . 6.760 4.417 4.231 4.505 . 0 0 "[ . 1 . 2]" 1
606 1 19 VAL QG 1 67 ILE HB . . 8.090 3.405 3.197 3.535 . 0 0 "[ . 1 . 2]" 1
607 1 19 VAL QG 1 68 VAL HA . . 8.090 3.431 3.073 3.668 . 0 0 "[ . 1 . 2]" 1
608 1 19 VAL QG 1 68 VAL HB . . 8.090 3.763 3.703 3.876 . 0 0 "[ . 1 . 2]" 1
609 1 19 VAL QG 1 68 VAL QG . . 10.680 1.665 1.636 1.741 . 0 0 "[ . 1 . 2]" 1
610 1 19 VAL MG1 1 40 PHE QD . . 8.650 4.095 3.583 4.894 . 0 0 "[ . 1 . 2]" 1
611 1 19 VAL MG1 1 40 PHE QE . . 8.650 3.674 2.426 4.156 . 0 0 "[ . 1 . 2]" 1
612 1 19 VAL MG1 1 64 PRO HA . . 6.530 2.664 2.466 2.796 . 0 0 "[ . 1 . 2]" 1
613 1 19 VAL MG1 1 67 ILE MD . . 7.560 1.872 1.829 1.958 . 0 0 "[ . 1 . 2]" 1
614 1 19 VAL MG2 1 40 PHE QD . . 8.650 2.076 1.990 2.191 . 0 0 "[ . 1 . 2]" 1
615 1 19 VAL MG2 1 40 PHE QE . . 8.650 2.044 1.927 2.264 . 0 0 "[ . 1 . 2]" 1
616 1 19 VAL MG2 1 64 PRO HA . . 6.530 5.178 3.961 5.480 . 0 0 "[ . 1 . 2]" 1
617 1 19 VAL MG2 1 67 ILE MD . . 7.560 3.406 2.161 3.789 . 0 0 "[ . 1 . 2]" 1
618 1 19 VAL O 1 23 CYS H . . 2.300 1.789 1.763 1.865 . 0 0 "[ . 1 . 2]" 1
619 1 20 THR H 1 20 THR HB . . 3.210 1.987 1.776 2.203 . 0 0 "[ . 1 . 2]" 1
620 1 20 THR H 1 21 THR H . . 3.640 2.691 2.599 2.781 . 0 0 "[ . 1 . 2]" 1
621 1 20 THR H 1 21 THR HB . . 4.260 4.307 4.300 4.314 0.054 20 0 "[ . 1 . 2]" 1
622 1 20 THR H 1 68 VAL QG . . 6.880 4.115 3.821 4.339 . 0 0 "[ . 1 . 2]" 1
623 1 20 THR HA 1 23 CYS HB2 . . 3.950 2.321 2.187 3.511 . 0 0 "[ . 1 . 2]" 1
624 1 20 THR HA 1 23 CYS QB . . 3.670 2.257 2.176 2.455 . 0 0 "[ . 1 . 2]" 1
625 1 20 THR HA 1 23 CYS HB3 . . 3.950 3.909 2.507 3.996 0.046 16 0 "[ . 1 . 2]" 1
626 1 20 THR HA 1 24 ASN H . . 4.380 3.996 3.845 4.183 . 0 0 "[ . 1 . 2]" 1
627 1 20 THR HA 1 64 PRO HB2 . . 4.140 3.652 2.329 4.180 0.040 9 0 "[ . 1 . 2]" 1
628 1 20 THR HA 1 64 PRO QB . . 3.920 2.637 2.253 2.954 . 0 0 "[ . 1 . 2]" 1
629 1 20 THR HA 1 64 PRO HB3 . . 4.140 2.803 2.386 3.056 . 0 0 "[ . 1 . 2]" 1
630 1 20 THR HA 1 64 PRO QG . . 5.230 4.016 3.586 4.303 . 0 0 "[ . 1 . 2]" 1
631 1 20 THR HB 1 21 THR H . . 4.230 3.597 2.989 4.018 . 0 0 "[ . 1 . 2]" 1
632 1 20 THR HB 1 23 CYS QB . . 6.380 4.877 4.630 5.091 . 0 0 "[ . 1 . 2]" 1
633 1 20 THR MG 1 21 THR H . . 4.540 3.061 2.739 3.499 . 0 0 "[ . 1 . 2]" 1
634 1 20 THR MG 1 21 THR HA . . 6.530 3.791 3.631 3.983 . 0 0 "[ . 1 . 2]" 1
635 1 20 THR MG 1 21 THR HB . . 6.530 4.218 3.890 4.610 . 0 0 "[ . 1 . 2]" 1
636 1 20 THR MG 1 23 CYS QB . . 7.400 4.444 4.227 4.614 . 0 0 "[ . 1 . 2]" 1
637 1 20 THR MG 1 24 ASN QB . . 7.400 3.653 3.414 3.993 . 0 0 "[ . 1 . 2]" 1
638 1 20 THR MG 1 64 PRO HB2 . . 6.530 4.665 3.976 5.200 . 0 0 "[ . 1 . 2]" 1
639 1 20 THR MG 1 64 PRO HB3 . . 6.530 4.720 4.225 5.046 . 0 0 "[ . 1 . 2]" 1
640 1 20 THR MG 1 64 PRO QG . . 7.400 4.929 3.982 5.534 . 0 0 "[ . 1 . 2]" 1
641 1 21 THR H 1 21 THR HB . . 3.760 1.904 1.840 2.023 . 0 0 "[ . 1 . 2]" 1
642 1 21 THR H 1 22 ILE H . . 3.300 2.489 2.231 2.699 . 0 0 "[ . 1 . 2]" 1
643 1 21 THR H 1 23 CYS H . . 5.000 4.258 3.983 4.497 . 0 0 "[ . 1 . 2]" 1
644 1 21 THR H 1 26 ASP HB2 . . 5.500 5.380 5.096 5.572 0.072 7 0 "[ . 1 . 2]" 1
645 1 21 THR H 1 26 ASP HB3 . . 5.500 5.080 4.734 5.199 . 0 0 "[ . 1 . 2]" 1
646 1 21 THR H 1 36 LEU QD . . 6.890 4.631 4.241 4.910 . 0 0 "[ . 1 . 2]" 1
647 1 21 THR HA 1 24 ASN HB2 . . 3.920 3.438 2.024 3.747 . 0 0 "[ . 1 . 2]" 1
648 1 21 THR HA 1 24 ASN QB . . 3.760 2.293 2.001 2.852 . 0 0 "[ . 1 . 2]" 1
649 1 21 THR HA 1 24 ASN HB3 . . 3.920 2.441 2.167 3.351 . 0 0 "[ . 1 . 2]" 1
650 1 21 THR HA 1 26 ASP HB2 . . 2.680 2.540 2.251 2.730 0.050 13 0 "[ . 1 . 2]" 1
651 1 21 THR HA 1 26 ASP HB3 . . 2.680 2.638 2.202 2.732 0.052 6 0 "[ . 1 . 2]" 1
652 1 21 THR HB 1 22 ILE H . . 3.450 3.194 3.053 3.415 . 0 0 "[ . 1 . 2]" 1
653 1 21 THR HB 1 22 ILE MD . . 6.530 4.981 4.836 5.294 . 0 0 "[ . 1 . 2]" 1
654 1 21 THR HB 1 22 ILE QG . . 6.380 3.647 3.483 3.927 . 0 0 "[ . 1 . 2]" 1
655 1 21 THR HB 1 24 ASN QB . . 6.380 4.970 4.607 5.465 . 0 0 "[ . 1 . 2]" 1
656 1 21 THR HB 1 26 ASP QB . . 6.380 3.998 3.864 4.162 . 0 0 "[ . 1 . 2]" 1
657 1 21 THR HB 1 36 LEU QD . . 8.100 3.378 2.706 3.705 . 0 0 "[ . 1 . 2]" 1
658 1 21 THR MG 1 22 ILE H . . 4.820 3.011 2.769 3.396 . 0 0 "[ . 1 . 2]" 1
659 1 21 THR MG 1 22 ILE HA . . 6.530 3.306 3.166 3.503 . 0 0 "[ . 1 . 2]" 1
660 1 21 THR MG 1 22 ILE MD . . 7.560 3.768 3.474 4.133 . 0 0 "[ . 1 . 2]" 1
661 1 21 THR MG 1 22 ILE QG . . 7.400 2.450 2.106 2.921 . 0 0 "[ . 1 . 2]" 1
662 1 21 THR MG 1 22 ILE MG . . 7.560 4.162 3.894 4.610 . 0 0 "[ . 1 . 2]" 1
663 1 21 THR MG 1 23 CYS H . . 6.530 4.984 4.731 5.294 . 0 0 "[ . 1 . 2]" 1
664 1 21 THR MG 1 25 ALA H . . 5.230 4.080 4.039 4.118 . 0 0 "[ . 1 . 2]" 1
665 1 21 THR MG 1 26 ASP H . . 4.790 3.421 3.036 3.600 . 0 0 "[ . 1 . 2]" 1
666 1 21 THR MG 1 26 ASP HA . . 6.530 4.774 4.233 5.121 . 0 0 "[ . 1 . 2]" 1
667 1 21 THR MG 1 26 ASP HB2 . . 6.530 3.571 3.409 4.007 . 0 0 "[ . 1 . 2]" 1
668 1 21 THR MG 1 26 ASP HB3 . . 6.530 2.205 1.977 2.669 . 0 0 "[ . 1 . 2]" 1
669 1 21 THR MG 1 27 THR HA . . 6.530 4.220 3.654 4.591 . 0 0 "[ . 1 . 2]" 1
670 1 21 THR MG 1 27 THR HB . . 6.530 4.266 4.040 4.526 . 0 0 "[ . 1 . 2]" 1
671 1 21 THR MG 1 27 THR MG . . 7.560 2.074 1.961 2.235 . 0 0 "[ . 1 . 2]" 1
672 1 21 THR MG 1 32 GLU QB . . 7.400 4.107 3.842 4.332 . 0 0 "[ . 1 . 2]" 1
673 1 21 THR MG 1 36 LEU H . . 6.340 5.115 5.031 5.172 . 0 0 "[ . 1 . 2]" 1
674 1 21 THR MG 1 36 LEU HA . . 6.530 5.090 4.894 5.192 . 0 0 "[ . 1 . 2]" 1
675 1 21 THR MG 1 36 LEU HB2 . . 6.530 3.623 3.453 3.869 . 0 0 "[ . 1 . 2]" 1
676 1 21 THR MG 1 36 LEU HB3 . . 6.530 3.122 2.947 3.416 . 0 0 "[ . 1 . 2]" 1
677 1 21 THR MG 1 36 LEU MD1 . . 7.560 1.781 1.718 1.887 . 0 0 "[ . 1 . 2]" 1
678 1 21 THR MG 1 36 LEU MD2 . . 7.560 3.267 2.233 3.575 . 0 0 "[ . 1 . 2]" 1
679 1 21 THR MG 1 36 LEU HG . . 6.530 3.731 2.877 4.185 . 0 0 "[ . 1 . 2]" 1
680 1 21 THR O 1 25 ALA H . . 2.300 1.912 1.790 2.009 . 0 0 "[ . 1 . 2]" 1
681 1 22 ILE H 1 22 ILE HB . . 3.360 2.818 2.657 2.935 . 0 0 "[ . 1 . 2]" 1
682 1 22 ILE H 1 22 ILE MD . . 4.540 3.791 3.705 3.806 . 0 0 "[ . 1 . 2]" 1
683 1 22 ILE H 1 22 ILE MG . . 4.730 3.817 3.781 3.862 . 0 0 "[ . 1 . 2]" 1
684 1 22 ILE H 1 23 CYS H . . 2.930 2.411 2.323 2.560 . 0 0 "[ . 1 . 2]" 1
685 1 22 ILE H 1 24 ASN H . . 3.020 3.044 3.041 3.049 0.029 13 0 "[ . 1 . 2]" 1
686 1 22 ILE H 1 26 ASP QB . . 6.380 4.747 4.603 4.939 . 0 0 "[ . 1 . 2]" 1
687 1 22 ILE H 1 36 LEU QD . . 6.420 4.283 3.999 4.534 . 0 0 "[ . 1 . 2]" 1
688 1 22 ILE HA 1 25 ALA HA . . 3.950 3.562 3.351 3.813 . 0 0 "[ . 1 . 2]" 1
689 1 22 ILE HA 1 25 ALA MB . . 6.530 4.486 4.313 4.792 . 0 0 "[ . 1 . 2]" 1
690 1 22 ILE HA 1 27 THR MG . . 6.530 3.513 3.348 3.675 . 0 0 "[ . 1 . 2]" 1
691 1 22 ILE HA 1 33 LEU QB . . 5.200 4.440 4.114 4.625 . 0 0 "[ . 1 . 2]" 1
692 1 22 ILE HA 1 33 LEU QD . . 8.100 1.992 1.832 2.175 . 0 0 "[ . 1 . 2]" 1
693 1 22 ILE HA 1 33 LEU HG . . 4.450 3.607 3.344 3.929 . 0 0 "[ . 1 . 2]" 1
694 1 22 ILE HA 1 36 LEU QD . . 8.100 4.068 3.662 4.423 . 0 0 "[ . 1 . 2]" 1
695 1 22 ILE HB 1 23 CYS H . . 4.230 2.344 2.193 2.471 . 0 0 "[ . 1 . 2]" 1
696 1 22 ILE HB 1 23 CYS QB . . 6.380 4.583 3.989 4.782 . 0 0 "[ . 1 . 2]" 1
697 1 22 ILE HB 1 36 LEU QB . . 6.380 4.591 4.400 4.650 . 0 0 "[ . 1 . 2]" 1
698 1 22 ILE HB 1 53 ILE MD . . 6.530 4.213 3.755 5.310 . 0 0 "[ . 1 . 2]" 1
699 1 22 ILE MD 1 23 CYS H . . 5.570 4.478 4.326 4.541 . 0 0 "[ . 1 . 2]" 1
700 1 22 ILE MD 1 33 LEU QD . . 9.130 3.800 3.302 4.060 . 0 0 "[ . 1 . 2]" 1
701 1 22 ILE MD 1 34 VAL QG . . 9.120 5.516 5.182 5.692 . 0 0 "[ . 1 . 2]" 1
702 1 22 ILE MD 1 36 LEU H . . 4.760 3.688 3.660 3.757 . 0 0 "[ . 1 . 2]" 1
703 1 22 ILE MD 1 36 LEU HA . . 6.530 3.433 3.381 3.511 . 0 0 "[ . 1 . 2]" 1
704 1 22 ILE MD 1 36 LEU HB2 . . 6.530 2.545 2.357 2.718 . 0 0 "[ . 1 . 2]" 1
705 1 22 ILE MD 1 36 LEU HB3 . . 6.530 2.090 1.961 2.222 . 0 0 "[ . 1 . 2]" 1
706 1 22 ILE MD 1 36 LEU MD1 . . 7.560 3.503 3.103 3.840 . 0 0 "[ . 1 . 2]" 1
707 1 22 ILE MD 1 36 LEU MD2 . . 7.560 3.807 3.344 4.255 . 0 0 "[ . 1 . 2]" 1
708 1 22 ILE MD 1 36 LEU HG . . 6.530 4.317 3.978 4.493 . 0 0 "[ . 1 . 2]" 1
709 1 22 ILE MD 1 37 VAL H . . 6.530 2.710 2.532 2.838 . 0 0 "[ . 1 . 2]" 1
710 1 22 ILE MD 1 37 VAL HA . . 6.530 2.392 2.265 2.623 . 0 0 "[ . 1 . 2]" 1
711 1 22 ILE MD 1 37 VAL HB . . 6.530 3.851 3.513 4.071 . 0 0 "[ . 1 . 2]" 1
712 1 22 ILE MD 1 37 VAL MG1 . . 7.560 3.932 2.292 4.310 . 0 0 "[ . 1 . 2]" 1
713 1 22 ILE MD 1 37 VAL MG2 . . 7.560 2.766 2.163 4.352 . 0 0 "[ . 1 . 2]" 1
714 1 22 ILE MD 1 40 PHE H . . 5.040 3.971 3.824 4.100 . 0 0 "[ . 1 . 2]" 1
715 1 22 ILE MD 1 40 PHE HA . . 6.530 5.107 4.714 5.319 . 0 0 "[ . 1 . 2]" 1
716 1 22 ILE MD 1 40 PHE HB2 . . 6.530 3.237 2.816 3.417 . 0 0 "[ . 1 . 2]" 1
717 1 22 ILE MD 1 40 PHE HB3 . . 6.530 4.084 3.667 4.305 . 0 0 "[ . 1 . 2]" 1
718 1 22 ILE MD 1 40 PHE QD . . 8.650 3.850 3.255 4.193 . 0 0 "[ . 1 . 2]" 1
719 1 22 ILE MD 1 41 GLU H . . 6.530 5.408 5.281 5.478 . 0 0 "[ . 1 . 2]" 1
720 1 22 ILE MD 1 53 ILE MD . . 7.560 3.138 2.662 4.056 . 0 0 "[ . 1 . 2]" 1
721 1 22 ILE MD 1 53 ILE MG . . 7.560 3.120 2.741 3.470 . 0 0 "[ . 1 . 2]" 1
722 1 22 ILE MD 1 67 ILE MD . . 8.970 4.920 4.657 5.135 . 0 0 "[ . 1 . 2]" 1
723 1 22 ILE MD 1 67 ILE MG . . 8.970 6.581 6.378 6.759 . 0 0 "[ . 1 . 2]" 1
724 1 22 ILE QG 1 36 LEU QD . . 8.970 2.836 2.553 3.126 . 0 0 "[ . 1 . 2]" 1
725 1 22 ILE MG 1 23 CYS H . . 4.730 3.645 3.421 3.785 . 0 0 "[ . 1 . 2]" 1
726 1 22 ILE MG 1 24 ASN H . . 6.530 4.583 4.487 4.677 . 0 0 "[ . 1 . 2]" 1
727 1 22 ILE MG 1 27 THR MG . . 7.560 4.198 3.966 4.535 . 0 0 "[ . 1 . 2]" 1
728 1 22 ILE MG 1 33 LEU HA . . 6.530 2.850 2.576 3.337 . 0 0 "[ . 1 . 2]" 1
729 1 22 ILE MG 1 33 LEU QD . . 9.130 1.967 1.878 2.026 . 0 0 "[ . 1 . 2]" 1
730 1 22 ILE MG 1 33 LEU HG . . 6.530 3.890 3.514 4.347 . 0 0 "[ . 1 . 2]" 1
731 1 22 ILE MG 1 34 VAL QG . . 9.120 4.827 4.363 5.159 . 0 0 "[ . 1 . 2]" 1
732 1 22 ILE MG 1 36 LEU HB2 . . 6.530 3.203 2.901 3.598 . 0 0 "[ . 1 . 2]" 1
733 1 22 ILE MG 1 36 LEU HB3 . . 6.530 3.707 3.353 3.971 . 0 0 "[ . 1 . 2]" 1
734 1 22 ILE MG 1 36 LEU QD . . 9.130 4.036 3.621 4.503 . 0 0 "[ . 1 . 2]" 1
735 1 22 ILE MG 1 36 LEU HG . . 6.530 5.197 4.695 5.305 . 0 0 "[ . 1 . 2]" 1
736 1 22 ILE MG 1 37 VAL H . . 5.850 3.484 3.219 3.829 . 0 0 "[ . 1 . 2]" 1
737 1 22 ILE MG 1 37 VAL HA . . 6.530 3.392 3.102 3.764 . 0 0 "[ . 1 . 2]" 1
738 1 22 ILE MG 1 37 VAL HB . . 6.530 3.934 3.528 4.282 . 0 0 "[ . 1 . 2]" 1
739 1 22 ILE MG 1 37 VAL MG1 . . 7.560 3.885 1.873 4.430 . 0 0 "[ . 1 . 2]" 1
740 1 22 ILE MG 1 37 VAL MG2 . . 6.480 2.319 1.883 4.308 . 0 0 "[ . 1 . 2]" 1
741 1 22 ILE MG 1 53 ILE MD . . 7.560 3.991 3.497 4.564 . 0 0 "[ . 1 . 2]" 1
742 1 22 ILE MG 1 53 ILE MG . . 7.560 2.803 2.419 3.161 . 0 0 "[ . 1 . 2]" 1
743 1 22 ILE MG 1 54 TYR HE2 . . 6.530 4.083 3.202 4.735 . 0 0 "[ . 1 . 2]" 1
744 1 22 ILE MG 1 67 ILE MD . . 7.560 5.082 4.727 5.218 . 0 0 "[ . 1 . 2]" 1
745 1 22 ILE MG 1 67 ILE HG13 . . 7.500 7.428 7.036 7.655 0.155 9 0 "[ . 1 . 2]" 1
746 1 23 CYS H 1 24 ASN H . . 2.930 2.693 2.636 2.753 . 0 0 "[ . 1 . 2]" 1
747 1 23 CYS H 1 24 ASN QB . . 5.420 4.700 4.536 4.808 . 0 0 "[ . 1 . 2]" 1
748 1 23 CYS H 1 25 ALA H . . 5.500 4.416 4.258 4.514 . 0 0 "[ . 1 . 2]" 1
749 1 23 CYS HA 1 53 ILE MG . . 6.530 5.427 5.287 5.508 . 0 0 "[ . 1 . 2]" 1
750 1 23 CYS QB 1 64 PRO QB . . 6.320 2.486 1.887 3.183 . 0 0 "[ . 1 . 2]" 1
751 1 23 CYS QB 1 64 PRO QD . . 5.860 3.992 3.425 4.365 . 0 0 "[ . 1 . 2]" 1
752 1 23 CYS QB 1 64 PRO QG . . 7.250 2.724 2.191 3.657 . 0 0 "[ . 1 . 2]" 1
753 1 23 CYS HB2 1 64 PRO HB2 . . 5.500 3.974 2.920 4.550 . 0 0 "[ . 1 . 2]" 1
754 1 23 CYS HB2 1 64 PRO HB3 . . 7.250 2.612 1.981 3.400 . 0 0 "[ . 1 . 2]" 1
755 1 23 CYS HB2 1 64 PRO HD2 . . 5.500 5.586 5.577 5.600 0.100 15 0 "[ . 1 . 2]" 1
756 1 23 CYS HB2 1 64 PRO HD3 . . 5.500 5.114 4.098 5.566 0.066 3 0 "[ . 1 . 2]" 1
757 1 23 CYS HB3 1 64 PRO HB2 . . 5.500 4.730 4.143 5.305 . 0 0 "[ . 1 . 2]" 1
758 1 23 CYS HB3 1 64 PRO HB3 . . 7.250 3.387 2.500 4.311 . 0 0 "[ . 1 . 2]" 1
759 1 23 CYS HB3 1 64 PRO HD2 . . 5.500 5.458 5.280 5.577 0.077 20 0 "[ . 1 . 2]" 1
760 1 23 CYS HB3 1 64 PRO HD3 . . 7.250 4.588 3.768 5.675 . 0 0 "[ . 1 . 2]" 1
761 1 24 ASN H 1 24 ASN HB2 . . 3.360 3.019 2.340 3.200 . 0 0 "[ . 1 . 2]" 1
762 1 24 ASN H 1 24 ASN QB . . 3.170 2.602 2.299 2.795 . 0 0 "[ . 1 . 2]" 1
763 1 24 ASN H 1 24 ASN HB3 . . 3.360 2.914 2.764 3.362 0.002 5 0 "[ . 1 . 2]" 1
764 1 24 ASN H 1 25 ALA H . . 2.830 2.321 2.264 2.390 . 0 0 "[ . 1 . 2]" 1
765 1 24 ASN H 1 25 ALA MB . . 5.810 4.637 4.584 4.662 . 0 0 "[ . 1 . 2]" 1
766 1 24 ASN H 1 26 ASP H . . 4.040 3.803 3.661 3.902 . 0 0 "[ . 1 . 2]" 1
767 1 24 ASN H 1 26 ASP QB . . 5.290 3.991 3.750 4.257 . 0 0 "[ . 1 . 2]" 1
768 1 24 ASN H 1 33 LEU QD . . 6.330 3.930 3.730 4.088 . 0 0 "[ . 1 . 2]" 1
769 1 24 ASN HA 1 25 ALA MB . . 6.530 4.066 3.771 4.272 . 0 0 "[ . 1 . 2]" 1
770 1 24 ASN QB 1 26 ASP QB . . 4.700 2.151 1.871 2.327 . 0 0 "[ . 1 . 2]" 1
771 1 24 ASN HB2 1 26 ASP HB2 . . 5.700 3.745 2.291 4.018 . 0 0 "[ . 1 . 2]" 1
772 1 24 ASN HB2 1 26 ASP HB3 . . 5.700 5.057 3.674 5.401 . 0 0 "[ . 1 . 2]" 1
773 1 24 ASN HB3 1 26 ASP HB2 . . 5.700 2.201 2.000 2.447 . 0 0 "[ . 1 . 2]" 1
774 1 24 ASN HB3 1 26 ASP HB3 . . 5.700 3.489 3.186 3.672 . 0 0 "[ . 1 . 2]" 1
775 1 25 ALA H 1 26 ASP H . . 2.490 2.308 2.080 2.457 . 0 0 "[ . 1 . 2]" 1
776 1 25 ALA H 1 26 ASP HB2 . . 4.200 3.799 3.344 4.126 . 0 0 "[ . 1 . 2]" 1
777 1 25 ALA H 1 26 ASP HB3 . . 4.200 4.042 3.728 4.119 . 0 0 "[ . 1 . 2]" 1
778 1 25 ALA HA 1 26 ASP H . . 2.990 2.693 2.550 2.864 . 0 0 "[ . 1 . 2]" 1
779 1 25 ALA HA 1 26 ASP HA . . 4.910 4.877 4.785 4.933 0.023 15 0 "[ . 1 . 2]" 1
780 1 25 ALA HA 1 27 THR H . . 3.860 3.158 2.732 3.607 . 0 0 "[ . 1 . 2]" 1
781 1 25 ALA HA 1 27 THR MG . . 6.530 2.471 2.280 2.650 . 0 0 "[ . 1 . 2]" 1
782 1 25 ALA HA 1 33 LEU MD1 . . 6.530 2.048 1.946 2.166 . 0 0 "[ . 1 . 2]" 1
783 1 25 ALA HA 1 33 LEU MD2 . . 6.530 1.963 1.898 2.088 . 0 0 "[ . 1 . 2]" 1
784 1 25 ALA HA 1 33 LEU HG . . 2.740 2.601 2.594 2.607 . 0 0 "[ . 1 . 2]" 1
785 1 25 ALA MB 1 26 ASP HA . . 6.530 4.733 4.555 4.873 . 0 0 "[ . 1 . 2]" 1
786 1 25 ALA MB 1 27 THR H . . 6.400 3.822 3.763 3.878 . 0 0 "[ . 1 . 2]" 1
787 1 25 ALA MB 1 33 LEU QD . . 9.130 1.881 1.852 1.921 . 0 0 "[ . 1 . 2]" 1
788 1 26 ASP H 1 26 ASP HB2 . . 2.740 1.989 1.767 2.366 . 0 0 "[ . 1 . 2]" 1
789 1 26 ASP H 1 26 ASP HB3 . . 2.740 2.201 1.989 2.467 . 0 0 "[ . 1 . 2]" 1
790 1 26 ASP H 1 27 THR H . . 3.480 2.751 2.511 2.928 . 0 0 "[ . 1 . 2]" 1
791 1 26 ASP H 1 27 THR MG . . 5.750 2.730 2.495 3.009 . 0 0 "[ . 1 . 2]" 1
792 1 26 ASP HA 1 26 ASP HB2 . . 2.710 2.356 2.298 2.414 . 0 0 "[ . 1 . 2]" 1
793 1 26 ASP HA 1 26 ASP QB . . 2.480 2.271 2.229 2.310 . 0 0 "[ . 1 . 2]" 1
794 1 26 ASP HA 1 27 THR H . . 3.100 2.914 2.332 3.178 0.078 11 0 "[ . 1 . 2]" 1
795 1 26 ASP HA 1 27 THR HA . . 4.790 4.778 4.610 4.844 0.054 3 0 "[ . 1 . 2]" 1
796 1 26 ASP QB 1 27 THR H . . 3.680 3.115 2.764 3.322 . 0 0 "[ . 1 . 2]" 1
797 1 26 ASP QB 1 27 THR HB . . 6.380 5.048 4.783 5.591 . 0 0 "[ . 1 . 2]" 1
798 1 26 ASP QB 1 27 THR MG . . 7.400 2.677 2.464 3.121 . 0 0 "[ . 1 . 2]" 1
799 1 26 ASP HB2 1 27 THR H . . 3.950 3.885 3.873 3.892 . 0 0 "[ . 1 . 2]" 1
800 1 26 ASP HB3 1 27 THR H . . 3.950 3.299 2.830 3.608 . 0 0 "[ . 1 . 2]" 1
801 1 27 THR H 1 27 THR MG . . 4.300 2.222 1.867 2.653 . 0 0 "[ . 1 . 2]" 1
802 1 27 THR H 1 29 SER H . . 4.380 4.188 3.943 4.352 . 0 0 "[ . 1 . 2]" 1
803 1 27 THR H 1 33 LEU MD1 . . 6.530 3.584 3.059 4.434 . 0 0 "[ . 1 . 2]" 1
804 1 27 THR H 1 33 LEU MD2 . . 6.530 4.606 4.170 5.094 . 0 0 "[ . 1 . 2]" 1
805 1 27 THR HA 1 27 THR HB . . 2.590 2.244 2.128 2.366 . 0 0 "[ . 1 . 2]" 1
806 1 27 THR HA 1 29 SER H . . 4.070 4.019 4.010 4.027 . 0 0 "[ . 1 . 2]" 1
807 1 27 THR HA 1 32 GLU QB . . 3.930 3.382 2.899 3.592 . 0 0 "[ . 1 . 2]" 1
808 1 27 THR HA 1 36 LEU QD . . 8.100 4.316 3.570 4.936 . 0 0 "[ . 1 . 2]" 1
809 1 27 THR HB 1 28 SER QB . . 5.110 4.154 3.850 4.251 . 0 0 "[ . 1 . 2]" 1
810 1 27 THR HB 1 32 GLU HB2 . . 3.360 1.892 1.768 2.016 . 0 0 "[ . 1 . 2]" 1
811 1 27 THR HB 1 32 GLU QB . . 2.790 1.737 1.699 1.792 . 0 0 "[ . 1 . 2]" 1
812 1 27 THR HB 1 32 GLU HB3 . . 3.360 2.044 1.944 2.245 . 0 0 "[ . 1 . 2]" 1
813 1 27 THR HB 1 32 GLU HG2 . . 4.200 3.865 3.298 3.941 . 0 0 "[ . 1 . 2]" 1
814 1 27 THR HB 1 32 GLU QG . . 3.800 3.008 2.790 3.276 . 0 0 "[ . 1 . 2]" 1
815 1 27 THR HB 1 32 GLU HG3 . . 4.200 3.183 2.855 3.929 . 0 0 "[ . 1 . 2]" 1
816 1 27 THR HB 1 33 LEU HA . . 4.570 4.605 4.351 4.637 0.067 12 0 "[ . 1 . 2]" 1
817 1 27 THR HB 1 36 LEU MD1 . . 6.530 3.819 3.054 5.430 . 0 0 "[ . 1 . 2]" 1
818 1 27 THR HB 1 36 LEU MD2 . . 6.530 5.276 4.431 5.484 . 0 0 "[ . 1 . 2]" 1
819 1 27 THR MG 1 28 SER QB . . 7.400 5.242 5.020 5.344 . 0 0 "[ . 1 . 2]" 1
820 1 27 THR MG 1 29 SER H . . 4.790 3.965 3.918 3.998 . 0 0 "[ . 1 . 2]" 1
821 1 27 THR MG 1 32 GLU HB2 . . 6.530 3.150 2.966 3.228 . 0 0 "[ . 1 . 2]" 1
822 1 27 THR MG 1 32 GLU HB3 . . 6.530 2.399 2.182 2.629 . 0 0 "[ . 1 . 2]" 1
823 1 27 THR MG 1 32 GLU HG2 . . 6.530 4.671 3.995 5.005 . 0 0 "[ . 1 . 2]" 1
824 1 27 THR MG 1 32 GLU HG3 . . 6.530 4.238 3.859 4.862 . 0 0 "[ . 1 . 2]" 1
825 1 27 THR MG 1 33 LEU HA . . 6.530 2.714 2.595 2.952 . 0 0 "[ . 1 . 2]" 1
826 1 27 THR MG 1 33 LEU HB2 . . 6.530 4.161 3.952 4.462 . 0 0 "[ . 1 . 2]" 1
827 1 27 THR MG 1 33 LEU HB3 . . 6.530 4.521 4.354 4.747 . 0 0 "[ . 1 . 2]" 1
828 1 27 THR MG 1 33 LEU QD . . 9.130 2.662 2.493 2.828 . 0 0 "[ . 1 . 2]" 1
829 1 27 THR MG 1 33 LEU HG . . 6.530 2.070 1.940 2.212 . 0 0 "[ . 1 . 2]" 1
830 1 27 THR MG 1 36 LEU HG . . 6.530 3.504 2.671 4.245 . 0 0 "[ . 1 . 2]" 1
831 1 28 SER H 1 29 SER H . . 4.690 2.565 2.398 2.879 . 0 0 "[ . 1 . 2]" 1
832 1 28 SER HA 1 28 SER HB2 . . 2.560 2.490 2.424 2.559 . 0 0 "[ . 1 . 2]" 1
833 1 28 SER HA 1 28 SER QB . . 2.320 2.169 2.131 2.199 . 0 0 "[ . 1 . 2]" 1
834 1 28 SER HA 1 28 SER HB3 . . 2.560 2.389 2.308 2.482 . 0 0 "[ . 1 . 2]" 1
835 1 28 SER HA 1 29 SER H . . 3.360 3.334 3.322 3.345 . 0 0 "[ . 1 . 2]" 1
836 1 28 SER QB 1 29 SER H . . 3.790 3.428 3.378 3.443 . 0 0 "[ . 1 . 2]" 1
837 1 28 SER HB2 1 29 SER H . . 4.010 3.756 3.658 3.822 . 0 0 "[ . 1 . 2]" 1
838 1 28 SER HB3 1 29 SER H . . 4.010 3.959 3.892 3.980 . 0 0 "[ . 1 . 2]" 1
839 1 29 SER H 1 30 GLU H . . 4.420 2.511 2.290 3.084 . 0 0 "[ . 1 . 2]" 1
840 1 29 SER H 1 30 GLU HA . . 4.510 4.462 4.456 4.472 . 0 0 "[ . 1 . 2]" 1
841 1 29 SER H 1 31 GLU H . . 4.720 3.244 3.056 3.425 . 0 0 "[ . 1 . 2]" 1
842 1 29 SER H 1 31 GLU QB . . 4.450 3.762 3.382 3.996 . 0 0 "[ . 1 . 2]" 1
843 1 29 SER H 1 32 GLU H . . 4.110 3.638 3.392 3.843 . 0 0 "[ . 1 . 2]" 1
844 1 29 SER H 1 32 GLU QB . . 3.870 3.094 3.009 3.187 . 0 0 "[ . 1 . 2]" 1
845 1 29 SER H 1 32 GLU QG . . 6.380 4.403 4.121 4.720 . 0 0 "[ . 1 . 2]" 1
846 1 29 SER HA 1 29 SER HB2 . . 2.590 2.579 2.319 2.680 0.090 15 0 "[ . 1 . 2]" 1
847 1 29 SER HA 1 29 SER HB3 . . 2.590 2.309 2.146 2.678 0.088 8 0 "[ . 1 . 2]" 1
848 1 29 SER HA 1 30 GLU H . . 3.140 2.759 1.843 3.154 0.014 19 0 "[ . 1 . 2]" 1
849 1 29 SER HA 1 31 GLU H . . 4.660 4.377 3.718 4.593 . 0 0 "[ . 1 . 2]" 1
850 1 29 SER QB 1 30 GLU H . . 4.420 3.326 3.148 3.725 . 0 0 "[ . 1 . 2]" 1
851 1 29 SER QB 1 31 GLU H . . 5.170 4.512 4.405 4.581 . 0 0 "[ . 1 . 2]" 1
852 1 29 SER HB2 1 30 GLU H . . 4.850 3.585 3.325 4.215 . 0 0 "[ . 1 . 2]" 1
853 1 29 SER HB3 1 30 GLU H . . 4.850 4.060 3.356 4.499 . 0 0 "[ . 1 . 2]" 1
854 1 30 GLU H 1 31 GLU H . . 3.110 1.961 1.429 3.049 . 0 0 "[ . 1 . 2]" 1
855 1 30 GLU H 1 31 GLU HB2 . . 5.310 3.485 2.734 4.889 . 0 0 "[ . 1 . 2]" 1
856 1 30 GLU H 1 31 GLU QB . . 4.850 3.179 2.578 4.269 . 0 0 "[ . 1 . 2]" 1
857 1 30 GLU H 1 31 GLU HB3 . . 5.310 3.704 2.996 5.191 . 0 0 "[ . 1 . 2]" 1
858 1 30 GLU H 1 32 GLU H . . 5.500 3.868 3.406 4.818 . 0 0 "[ . 1 . 2]" 1
859 1 30 GLU H 1 33 LEU H . . 5.250 3.623 3.131 3.967 . 0 0 "[ . 1 . 2]" 1
860 1 30 GLU H 1 33 LEU QB . . 4.580 3.627 3.233 3.755 . 0 0 "[ . 1 . 2]" 1
861 1 30 GLU HA 1 31 GLU H . . 3.610 3.142 2.958 3.271 . 0 0 "[ . 1 . 2]" 1
862 1 30 GLU QB 1 31 GLU H . . 3.650 3.190 3.117 3.268 . 0 0 "[ . 1 . 2]" 1
863 1 31 GLU H 1 31 GLU HA . . 2.770 2.771 2.758 2.781 0.011 7 0 "[ . 1 . 2]" 1
864 1 31 GLU H 1 31 GLU HB2 . . 3.020 1.902 1.790 2.001 . 0 0 "[ . 1 . 2]" 1
865 1 31 GLU H 1 31 GLU QB . . 2.670 1.719 1.689 1.781 . 0 0 "[ . 1 . 2]" 1
866 1 31 GLU H 1 31 GLU HB3 . . 3.020 2.005 1.838 2.606 . 0 0 "[ . 1 . 2]" 1
867 1 31 GLU H 1 31 GLU QG . . 4.080 3.662 3.589 3.680 . 0 0 "[ . 1 . 2]" 1
868 1 31 GLU H 1 32 GLU H . . 3.210 2.472 2.283 2.687 . 0 0 "[ . 1 . 2]" 1
869 1 31 GLU H 1 32 GLU QB . . 4.610 3.751 3.663 3.850 . 0 0 "[ . 1 . 2]" 1
870 1 31 GLU H 1 33 LEU H . . 4.140 2.882 2.779 3.068 . 0 0 "[ . 1 . 2]" 1
871 1 31 GLU H 1 33 LEU HG . . 5.160 4.949 4.786 4.996 . 0 0 "[ . 1 . 2]" 1
872 1 31 GLU H 1 34 VAL QG . . 7.440 4.951 4.807 5.150 . 0 0 "[ . 1 . 2]" 1
873 1 31 GLU HA 1 31 GLU HB2 . . 2.560 2.514 2.419 2.609 0.049 7 0 "[ . 1 . 2]" 1
874 1 31 GLU HA 1 31 GLU HB3 . . 2.560 2.648 2.642 2.651 0.091 8 0 "[ . 1 . 2]" 1
875 1 31 GLU HA 1 33 LEU H . . 4.380 3.664 3.404 3.868 . 0 0 "[ . 1 . 2]" 1
876 1 31 GLU HA 1 34 VAL H . . 3.920 3.262 3.066 3.427 . 0 0 "[ . 1 . 2]" 1
877 1 31 GLU HA 1 34 VAL HB . . 2.990 3.044 3.025 3.062 0.072 8 0 "[ . 1 . 2]" 1
878 1 31 GLU HA 1 34 VAL MG1 . . 6.530 4.303 4.128 4.444 . 0 0 "[ . 1 . 2]" 1
879 1 31 GLU HA 1 34 VAL MG2 . . 6.530 3.785 3.427 4.053 . 0 0 "[ . 1 . 2]" 1
880 1 31 GLU HA 1 35 LYS H . . 4.290 4.268 4.244 4.275 . 0 0 "[ . 1 . 2]" 1
881 1 31 GLU QB 1 32 GLU H . . 2.580 1.562 1.487 1.846 . 0 0 "[ . 1 . 2]" 1
882 1 31 GLU QB 1 33 LEU H . . 5.010 3.454 3.342 3.664 . 0 0 "[ . 1 . 2]" 1
883 1 31 GLU QB 1 33 LEU HG . . 6.380 5.702 5.660 5.764 . 0 0 "[ . 1 . 2]" 1
884 1 31 GLU QB 1 34 VAL H . . 6.380 4.569 4.459 4.713 . 0 0 "[ . 1 . 2]" 1
885 1 31 GLU HB2 1 32 GLU H . . 2.990 3.004 2.990 3.012 0.022 3 0 "[ . 1 . 2]" 1
886 1 31 GLU HB3 1 32 GLU H . . 2.990 1.568 1.491 1.864 . 0 0 "[ . 1 . 2]" 1
887 1 31 GLU QG 1 32 GLU H . . 5.140 3.432 2.888 4.022 . 0 0 "[ . 1 . 2]" 1
888 1 31 GLU QG 1 33 LEU QD . . 8.970 5.817 5.572 6.093 . 0 0 "[ . 1 . 2]" 1
889 1 31 GLU O 1 35 LYS H . . 2.300 2.025 1.904 2.248 . 0 0 "[ . 1 . 2]" 1
890 1 32 GLU H 1 32 GLU HG2 . . 4.110 3.189 2.612 4.007 . 0 0 "[ . 1 . 2]" 1
891 1 32 GLU H 1 32 GLU QG . . 3.750 2.854 2.569 3.333 . 0 0 "[ . 1 . 2]" 1
892 1 32 GLU H 1 32 GLU HG3 . . 4.110 3.585 2.802 3.999 . 0 0 "[ . 1 . 2]" 1
893 1 32 GLU H 1 33 LEU H . . 3.240 2.620 2.432 2.836 . 0 0 "[ . 1 . 2]" 1
894 1 32 GLU H 1 34 VAL H . . 5.250 4.539 4.353 4.744 . 0 0 "[ . 1 . 2]" 1
895 1 32 GLU H 1 35 LYS H . . 4.690 4.580 4.507 4.618 . 0 0 "[ . 1 . 2]" 1
896 1 32 GLU HA 1 32 GLU HB2 . . 2.740 2.784 2.725 2.807 0.067 1 0 "[ . 1 . 2]" 1
897 1 32 GLU HA 1 32 GLU QB . . 2.420 2.346 2.300 2.373 . 0 0 "[ . 1 . 2]" 1
898 1 32 GLU HA 1 32 GLU HB3 . . 2.740 2.527 2.445 2.598 . 0 0 "[ . 1 . 2]" 1
899 1 32 GLU HA 1 32 GLU HG2 . . 3.580 2.377 2.072 3.358 . 0 0 "[ . 1 . 2]" 1
900 1 32 GLU HA 1 32 GLU QG . . 3.210 2.267 2.027 2.632 . 0 0 "[ . 1 . 2]" 1
901 1 32 GLU HA 1 32 GLU HG3 . . 3.580 3.189 2.317 3.372 . 0 0 "[ . 1 . 2]" 1
902 1 32 GLU HA 1 35 LYS H . . 3.670 3.409 3.230 3.603 . 0 0 "[ . 1 . 2]" 1
903 1 32 GLU HA 1 35 LYS QB . . 3.370 2.020 1.911 2.223 . 0 0 "[ . 1 . 2]" 1
904 1 32 GLU HA 1 35 LYS QD . . 4.210 2.510 1.967 3.559 . 0 0 "[ . 1 . 2]" 1
905 1 32 GLU HA 1 35 LYS QE . . 6.380 3.605 1.790 4.313 . 0 0 "[ . 1 . 2]" 1
906 1 32 GLU HA 1 35 LYS QG . . 5.660 3.407 3.048 3.875 . 0 0 "[ . 1 . 2]" 1
907 1 32 GLU HA 1 36 LEU H . . 3.980 3.727 3.293 3.919 . 0 0 "[ . 1 . 2]" 1
908 1 32 GLU QB 1 33 LEU H . . 4.360 2.748 2.583 2.985 . 0 0 "[ . 1 . 2]" 1
909 1 32 GLU QB 1 33 LEU HA . . 4.920 3.810 3.604 3.989 . 0 0 "[ . 1 . 2]" 1
910 1 32 GLU QB 1 33 LEU QB . . 6.070 4.317 4.026 4.498 . 0 0 "[ . 1 . 2]" 1
911 1 32 GLU QB 1 33 LEU QD . . 8.970 3.844 3.672 4.133 . 0 0 "[ . 1 . 2]" 1
912 1 32 GLU QB 1 33 LEU HG . . 4.360 3.761 3.721 3.787 . 0 0 "[ . 1 . 2]" 1
913 1 32 GLU QB 1 35 LYS QD . . 7.040 4.141 3.192 5.134 . 0 0 "[ . 1 . 2]" 1
914 1 32 GLU QB 1 36 LEU QD . . 6.770 2.526 1.998 3.021 . 0 0 "[ . 1 . 2]" 1
915 1 32 GLU HB2 1 36 LEU MD1 . . 8.280 4.346 3.414 5.846 . 0 0 "[ . 1 . 2]" 1
916 1 32 GLU HB2 1 36 LEU MD2 . . 8.280 5.293 4.195 5.868 . 0 0 "[ . 1 . 2]" 1
917 1 32 GLU HB3 1 36 LEU MD1 . . 8.280 2.856 2.016 4.328 . 0 0 "[ . 1 . 2]" 1
918 1 32 GLU HB3 1 36 LEU MD2 . . 8.280 3.875 2.845 4.364 . 0 0 "[ . 1 . 2]" 1
919 1 32 GLU QG 1 33 LEU HA . . 6.380 5.716 5.507 5.815 . 0 0 "[ . 1 . 2]" 1
920 1 32 GLU QG 1 35 LYS QB . . 7.250 3.800 3.440 4.151 . 0 0 "[ . 1 . 2]" 1
921 1 32 GLU QG 1 35 LYS QD . . 6.200 3.226 2.648 4.139 . 0 0 "[ . 1 . 2]" 1
922 1 32 GLU QG 1 35 LYS QE . . 5.830 3.718 2.146 4.416 . 0 0 "[ . 1 . 2]" 1
923 1 32 GLU QG 1 35 LYS QG . . 6.290 4.493 4.275 4.625 . 0 0 "[ . 1 . 2]" 1
924 1 32 GLU QG 1 36 LEU QD . . 8.050 3.477 2.647 4.052 . 0 0 "[ . 1 . 2]" 1
925 1 32 GLU HG2 1 36 LEU MD1 . . 9.670 4.704 3.037 6.139 . 0 0 "[ . 1 . 2]" 1
926 1 32 GLU HG2 1 36 LEU MD2 . . 9.670 4.845 2.702 6.223 . 0 0 "[ . 1 . 2]" 1
927 1 32 GLU HG3 1 36 LEU MD1 . . 9.670 4.557 3.806 5.857 . 0 0 "[ . 1 . 2]" 1
928 1 32 GLU HG3 1 36 LEU MD2 . . 9.670 5.036 2.777 6.118 . 0 0 "[ . 1 . 2]" 1
929 1 33 LEU H 1 33 LEU HG . . 4.510 2.829 2.666 3.117 . 0 0 "[ . 1 . 2]" 1
930 1 33 LEU H 1 34 VAL H . . 3.360 2.834 2.574 2.990 . 0 0 "[ . 1 . 2]" 1
931 1 33 LEU H 1 34 VAL HB . . 4.790 4.544 4.232 4.660 . 0 0 "[ . 1 . 2]" 1
932 1 33 LEU H 1 35 LYS H . . 4.170 3.651 3.342 3.801 . 0 0 "[ . 1 . 2]" 1
933 1 33 LEU H 1 36 LEU H . . 4.570 4.452 4.239 4.499 . 0 0 "[ . 1 . 2]" 1
934 1 33 LEU H 1 37 VAL QG . . 8.090 5.596 5.166 5.758 . 0 0 "[ . 1 . 2]" 1
935 1 33 LEU HA 1 33 LEU HG . . 3.760 2.130 2.004 2.343 . 0 0 "[ . 1 . 2]" 1
936 1 33 LEU HA 1 36 LEU H . . 3.580 3.291 3.079 3.539 . 0 0 "[ . 1 . 2]" 1
937 1 33 LEU HA 1 37 VAL QG . . 8.090 3.951 3.699 4.115 . 0 0 "[ . 1 . 2]" 1
938 1 33 LEU QB 1 34 VAL H . . 4.860 2.399 2.267 2.484 . 0 0 "[ . 1 . 2]" 1
939 1 33 LEU QB 1 37 VAL QG . . 8.040 3.675 3.241 4.037 . 0 0 "[ . 1 . 2]" 1
940 1 33 LEU HB2 1 37 VAL MG1 . . 9.650 6.529 4.541 7.110 . 0 0 "[ . 1 . 2]" 1
941 1 33 LEU HB2 1 37 VAL MG2 . . 9.650 5.325 4.945 6.320 . 0 0 "[ . 1 . 2]" 1
942 1 33 LEU HB3 1 37 VAL MG1 . . 9.650 5.524 3.365 6.144 . 0 0 "[ . 1 . 2]" 1
943 1 33 LEU HB3 1 37 VAL MG2 . . 9.650 4.144 3.654 5.520 . 0 0 "[ . 1 . 2]" 1
944 1 33 LEU QD 1 34 VAL HA . . 8.100 4.889 4.733 5.019 . 0 0 "[ . 1 . 2]" 1
945 1 33 LEU QD 1 36 LEU QD . . 10.690 3.976 3.582 4.442 . 0 0 "[ . 1 . 2]" 1
946 1 33 LEU QD 1 53 ILE MG . . 9.130 5.008 4.776 5.206 . 0 0 "[ . 1 . 2]" 1
947 1 33 LEU HG 1 34 VAL H . . 4.970 4.608 4.521 4.694 . 0 0 "[ . 1 . 2]" 1
948 1 33 LEU HG 1 36 LEU QB . . 5.230 4.231 4.171 4.285 . 0 0 "[ . 1 . 2]" 1
949 1 33 LEU HG 1 36 LEU QD . . 8.100 4.013 3.350 4.845 . 0 0 "[ . 1 . 2]" 1
950 1 33 LEU HG 1 37 VAL QG . . 8.090 5.339 4.980 5.553 . 0 0 "[ . 1 . 2]" 1
951 1 33 LEU O 1 37 VAL H . . 2.300 1.849 1.765 2.021 . 0 0 "[ . 1 . 2]" 1
952 1 34 VAL H 1 34 VAL HB . . 3.360 2.088 1.929 2.201 . 0 0 "[ . 1 . 2]" 1
953 1 34 VAL H 1 34 VAL QG . . 4.190 2.348 2.208 2.437 . 0 0 "[ . 1 . 2]" 1
954 1 34 VAL H 1 35 LYS H . . 3.140 2.566 2.399 2.693 . 0 0 "[ . 1 . 2]" 1
955 1 34 VAL H 1 35 LYS QB . . 4.920 4.075 3.788 4.307 . 0 0 "[ . 1 . 2]" 1
956 1 34 VAL H 1 36 LEU H . . 4.350 4.307 4.292 4.315 . 0 0 "[ . 1 . 2]" 1
957 1 34 VAL H 1 37 VAL QG . . 6.720 4.210 3.492 4.434 . 0 0 "[ . 1 . 2]" 1
958 1 34 VAL HA 1 34 VAL HB . . 2.800 2.876 2.872 2.886 0.086 8 0 "[ . 1 . 2]" 1
959 1 34 VAL HA 1 37 VAL H . . 4.510 3.500 2.919 3.865 . 0 0 "[ . 1 . 2]" 1
960 1 34 VAL HA 1 37 VAL HB . . 3.730 2.527 2.213 3.810 0.080 4 0 "[ . 1 . 2]" 1
961 1 34 VAL HA 1 37 VAL MG1 . . 6.530 2.985 1.935 3.237 . 0 0 "[ . 1 . 2]" 1
962 1 34 VAL HA 1 37 VAL MG2 . . 6.530 2.843 2.021 3.070 . 0 0 "[ . 1 . 2]" 1
963 1 34 VAL HA 1 38 THR H . . 5.000 4.146 3.831 4.685 . 0 0 "[ . 1 . 2]" 1
964 1 34 VAL HB 1 35 LYS H . . 3.450 3.000 2.930 3.074 . 0 0 "[ . 1 . 2]" 1
965 1 34 VAL HB 1 37 VAL MG1 . . 6.530 5.242 4.318 5.416 . 0 0 "[ . 1 . 2]" 1
966 1 34 VAL HB 1 37 VAL MG2 . . 6.530 5.166 4.219 5.388 . 0 0 "[ . 1 . 2]" 1
967 1 34 VAL QG 1 35 LYS H . . 6.170 3.355 3.187 3.445 . 0 0 "[ . 1 . 2]" 1
968 1 34 VAL QG 1 35 LYS QB . . 8.960 3.610 3.314 3.802 . 0 0 "[ . 1 . 2]" 1
969 1 34 VAL QG 1 35 LYS QD . . 8.960 5.363 4.708 5.739 . 0 0 "[ . 1 . 2]" 1
970 1 34 VAL QG 1 35 LYS QG . . 8.960 4.835 4.603 5.097 . 0 0 "[ . 1 . 2]" 1
971 1 34 VAL QG 1 36 LEU H . . 8.090 4.875 4.731 5.004 . 0 0 "[ . 1 . 2]" 1
972 1 34 VAL QG 1 37 VAL QG . . 8.290 2.968 2.248 3.158 . 0 0 "[ . 1 . 2]" 1
973 1 34 VAL QG 1 38 THR H . . 8.090 4.131 3.890 4.568 . 0 0 "[ . 1 . 2]" 1
974 1 34 VAL QG 1 38 THR HA . . 8.090 5.329 5.049 5.709 . 0 0 "[ . 1 . 2]" 1
975 1 34 VAL QG 1 38 THR HB . . 8.090 3.926 3.652 4.265 . 0 0 "[ . 1 . 2]" 1
976 1 34 VAL QG 1 38 THR MG . . 9.120 4.350 4.119 4.487 . 0 0 "[ . 1 . 2]" 1
977 1 34 VAL MG1 1 35 LYS HA . . 6.530 3.545 3.471 3.672 . 0 0 "[ . 1 . 2]" 1
978 1 34 VAL MG1 1 37 VAL HB . . 6.530 4.091 3.816 5.259 . 0 0 "[ . 1 . 2]" 1
979 1 34 VAL MG1 1 37 VAL MG1 . . 10.680 3.678 3.576 3.971 . 0 0 "[ . 1 . 2]" 1
980 1 34 VAL MG1 1 37 VAL MG2 . . 10.680 4.244 2.562 4.624 . 0 0 "[ . 1 . 2]" 1
981 1 34 VAL MG2 1 35 LYS HA . . 6.530 5.562 5.554 5.573 . 0 0 "[ . 1 . 2]" 1
982 1 34 VAL MG2 1 37 VAL HB . . 6.530 4.178 3.897 4.845 . 0 0 "[ . 1 . 2]" 1
983 1 34 VAL MG2 1 37 VAL MG1 . . 10.680 3.756 2.807 4.147 . 0 0 "[ . 1 . 2]" 1
984 1 34 VAL MG2 1 37 VAL MG2 . . 10.680 3.688 2.845 3.985 . 0 0 "[ . 1 . 2]" 1
985 1 35 LYS H 1 35 LYS QD . . 5.420 4.199 3.770 4.748 . 0 0 "[ . 1 . 2]" 1
986 1 35 LYS H 1 35 LYS HG2 . . 4.660 4.076 3.855 4.270 . 0 0 "[ . 1 . 2]" 1
987 1 35 LYS H 1 35 LYS QG . . 4.320 3.749 3.614 3.810 . 0 0 "[ . 1 . 2]" 1
988 1 35 LYS H 1 35 LYS HG3 . . 4.660 4.402 4.254 4.523 . 0 0 "[ . 1 . 2]" 1
989 1 35 LYS H 1 36 LEU H . . 2.400 2.490 2.468 2.502 0.102 7 0 "[ . 1 . 2]" 1
990 1 35 LYS H 1 37 VAL H . . 3.520 3.473 3.426 3.489 . 0 0 "[ . 1 . 2]" 1
991 1 35 LYS H 1 37 VAL QG . . 7.590 4.416 3.902 4.588 . 0 0 "[ . 1 . 2]" 1
992 1 35 LYS HA 1 35 LYS QD . . 4.520 3.888 3.711 3.939 . 0 0 "[ . 1 . 2]" 1
993 1 35 LYS HA 1 35 LYS HG2 . . 3.450 3.049 2.424 3.247 . 0 0 "[ . 1 . 2]" 1
994 1 35 LYS HA 1 35 LYS QG . . 3.170 2.428 2.126 2.624 . 0 0 "[ . 1 . 2]" 1
995 1 35 LYS HA 1 35 LYS HG3 . . 3.450 2.637 2.177 3.249 . 0 0 "[ . 1 . 2]" 1
996 1 35 LYS HA 1 36 LEU QD . . 8.100 4.847 4.309 5.318 . 0 0 "[ . 1 . 2]" 1
997 1 35 LYS HA 1 37 VAL QG . . 7.870 4.725 4.337 5.005 . 0 0 "[ . 1 . 2]" 1
998 1 35 LYS HA 1 38 THR H . . 3.640 3.184 2.952 3.372 . 0 0 "[ . 1 . 2]" 1
999 1 35 LYS HA 1 38 THR HB . . 2.650 2.742 2.729 2.753 0.103 13 0 "[ . 1 . 2]" 1
1000 1 35 LYS QB 1 36 LEU H . . 3.990 2.810 2.386 3.128 . 0 0 "[ . 1 . 2]" 1
1001 1 35 LYS QB 1 36 LEU QD . . 8.970 3.566 2.387 4.054 . 0 0 "[ . 1 . 2]" 1
1002 1 35 LYS QB 1 38 THR HB . . 6.380 4.664 4.567 4.775 . 0 0 "[ . 1 . 2]" 1
1003 1 35 LYS QD 1 36 LEU MD1 . . 7.400 4.995 3.216 5.464 . 0 0 "[ . 1 . 2]" 1
1004 1 35 LYS QD 1 36 LEU MD2 . . 7.400 3.920 2.150 5.480 . 0 0 "[ . 1 . 2]" 1
1005 1 35 LYS QE 1 36 LEU QD . . 8.970 4.112 2.691 5.537 . 0 0 "[ . 1 . 2]" 1
1006 1 35 LYS QG 1 36 LEU H . . 4.400 3.539 3.109 3.830 . 0 0 "[ . 1 . 2]" 1
1007 1 35 LYS QG 1 36 LEU QD . . 8.970 3.134 2.052 3.888 . 0 0 "[ . 1 . 2]" 1
1008 1 35 LYS QG 1 37 VAL H . . 6.380 5.057 4.818 5.349 . 0 0 "[ . 1 . 2]" 1
1009 1 35 LYS HG2 1 36 LEU H . . 4.940 3.662 3.170 4.088 . 0 0 "[ . 1 . 2]" 1
1010 1 35 LYS HG3 1 36 LEU H . . 4.940 4.717 4.488 4.810 . 0 0 "[ . 1 . 2]" 1
1011 1 36 LEU H 1 36 LEU HA . . 2.830 2.807 2.772 2.820 . 0 0 "[ . 1 . 2]" 1
1012 1 36 LEU H 1 36 LEU QD . . 5.120 2.889 2.296 3.166 . 0 0 "[ . 1 . 2]" 1
1013 1 36 LEU H 1 36 LEU HG . . 2.770 2.552 2.343 2.736 . 0 0 "[ . 1 . 2]" 1
1014 1 36 LEU H 1 37 VAL H . . 3.020 2.377 2.167 2.563 . 0 0 "[ . 1 . 2]" 1
1015 1 36 LEU HA 1 36 LEU HG . . 4.230 3.026 2.436 3.640 . 0 0 "[ . 1 . 2]" 1
1016 1 36 LEU HA 1 39 HIS H . . 4.320 3.143 2.871 3.523 . 0 0 "[ . 1 . 2]" 1
1017 1 36 LEU HA 1 39 HIS HB2 . . 3.580 2.869 2.071 3.618 0.038 11 0 "[ . 1 . 2]" 1
1018 1 36 LEU HA 1 39 HIS QB . . 3.390 2.301 1.961 2.593 . 0 0 "[ . 1 . 2]" 1
1019 1 36 LEU HA 1 39 HIS HB3 . . 3.580 2.530 1.995 3.309 . 0 0 "[ . 1 . 2]" 1
1020 1 36 LEU HA 1 39 HIS HD2 . . 5.500 4.116 2.618 5.042 . 0 0 "[ . 1 . 2]" 1
1021 1 36 LEU HA 1 40 PHE H . . 5.070 3.982 3.734 4.315 . 0 0 "[ . 1 . 2]" 1
1022 1 36 LEU HB2 1 37 VAL H . . 5.500 2.882 2.675 3.128 . 0 0 "[ . 1 . 2]" 1
1023 1 36 LEU HB2 1 37 VAL HA . . 4.690 4.714 4.705 4.719 0.029 3 0 "[ . 1 . 2]" 1
1024 1 36 LEU HB3 1 37 VAL H . . 5.500 3.747 3.528 3.994 . 0 0 "[ . 1 . 2]" 1
1025 1 36 LEU HB3 1 37 VAL HA . . 4.690 4.662 4.549 4.713 0.023 9 0 "[ . 1 . 2]" 1
1026 1 36 LEU QD 1 38 THR H . . 8.100 5.260 5.031 5.576 . 0 0 "[ . 1 . 2]" 1
1027 1 36 LEU QD 1 39 HIS H . . 6.700 4.306 3.985 4.619 . 0 0 "[ . 1 . 2]" 1
1028 1 36 LEU QD 1 39 HIS HA . . 8.100 5.323 5.040 5.770 . 0 0 "[ . 1 . 2]" 1
1029 1 36 LEU QD 1 39 HIS HD2 . . 8.100 3.515 2.108 4.173 . 0 0 "[ . 1 . 2]" 1
1030 1 36 LEU QD 1 40 PHE H . . 7.690 4.933 4.659 5.305 . 0 0 "[ . 1 . 2]" 1
1031 1 36 LEU MD1 1 39 HIS HB2 . . 6.530 5.464 5.046 5.574 . 0 0 "[ . 1 . 2]" 1
1032 1 36 LEU MD1 1 39 HIS HB3 . . 6.530 5.186 4.324 5.561 . 0 0 "[ . 1 . 2]" 1
1033 1 36 LEU MD2 1 39 HIS HB2 . . 6.530 3.363 2.870 4.083 . 0 0 "[ . 1 . 2]" 1
1034 1 36 LEU MD2 1 39 HIS HB3 . . 6.530 3.319 2.995 4.030 . 0 0 "[ . 1 . 2]" 1
1035 1 36 LEU O 1 40 PHE H . . 2.300 2.144 2.020 2.299 . 0 0 "[ . 1 . 2]" 1
1036 1 37 VAL H 1 37 VAL HB . . 3.360 2.324 2.088 3.343 . 0 0 "[ . 1 . 2]" 1
1037 1 37 VAL H 1 38 THR H . . 3.730 2.679 2.557 2.768 . 0 0 "[ . 1 . 2]" 1
1038 1 37 VAL HA 1 40 PHE H . . 4.010 3.546 3.365 3.802 . 0 0 "[ . 1 . 2]" 1
1039 1 37 VAL HA 1 40 PHE HB2 . . 4.660 3.542 3.174 4.009 . 0 0 "[ . 1 . 2]" 1
1040 1 37 VAL HA 1 40 PHE QB . . 4.300 3.087 2.761 3.349 . 0 0 "[ . 1 . 2]" 1
1041 1 37 VAL HA 1 40 PHE HB3 . . 4.660 3.425 2.894 3.722 . 0 0 "[ . 1 . 2]" 1
1042 1 37 VAL HA 1 40 PHE QD . . 7.620 4.981 4.436 5.228 . 0 0 "[ . 1 . 2]" 1
1043 1 37 VAL HB 1 38 THR H . . 4.600 2.840 2.524 3.894 . 0 0 "[ . 1 . 2]" 1
1044 1 37 VAL QG 1 38 THR HB . . 8.090 3.566 2.903 4.015 . 0 0 "[ . 1 . 2]" 1
1045 1 37 VAL QG 1 38 THR MG . . 9.120 4.320 4.064 4.574 . 0 0 "[ . 1 . 2]" 1
1046 1 37 VAL QG 1 40 PHE QB . . 5.900 3.859 3.573 4.161 . 0 0 "[ . 1 . 2]" 1
1047 1 37 VAL QG 1 41 GLU QB . . 8.960 4.254 3.868 4.653 . 0 0 "[ . 1 . 2]" 1
1048 1 37 VAL QG 1 54 TYR HE1 . . 8.090 4.199 2.515 4.733 . 0 0 "[ . 1 . 2]" 1
1049 1 37 VAL MG1 1 40 PHE HB2 . . 9.650 5.281 5.087 5.514 . 0 0 "[ . 1 . 2]" 1
1050 1 37 VAL MG1 1 40 PHE HB3 . . 9.650 4.523 4.113 5.370 . 0 0 "[ . 1 . 2]" 1
1051 1 37 VAL MG1 1 53 ILE MD . . 7.560 4.701 3.137 5.137 . 0 0 "[ . 1 . 2]" 1
1052 1 37 VAL MG1 1 53 ILE MG . . 7.560 3.394 2.368 3.825 . 0 0 "[ . 1 . 2]" 1
1053 1 37 VAL MG1 1 54 TYR HD2 . . 6.530 5.142 4.099 7.436 0.906 3 2 "[ + - 1 . 2]" 1
1054 1 37 VAL MG1 1 54 TYR HE2 . . 6.530 3.494 2.208 6.548 0.018 3 0 "[ . 1 . 2]" 1
1055 1 37 VAL MG2 1 40 PHE HB2 . . 9.650 5.156 4.799 5.601 . 0 0 "[ . 1 . 2]" 1
1056 1 37 VAL MG2 1 40 PHE HB3 . . 9.650 4.824 4.397 5.196 . 0 0 "[ . 1 . 2]" 1
1057 1 37 VAL MG2 1 53 ILE MD . . 7.560 4.181 3.512 5.213 . 0 0 "[ . 1 . 2]" 1
1058 1 37 VAL MG2 1 53 ILE MG . . 7.560 2.458 2.024 3.794 . 0 0 "[ . 1 . 2]" 1
1059 1 37 VAL MG2 1 54 TYR HD2 . . 6.530 4.651 3.611 5.854 . 0 0 "[ . 1 . 2]" 1
1060 1 37 VAL MG2 1 54 TYR HE2 . . 6.530 2.834 2.114 4.546 . 0 0 "[ . 1 . 2]" 1
1061 1 38 THR H 1 38 THR HB . . 3.760 2.026 1.907 2.185 . 0 0 "[ . 1 . 2]" 1
1062 1 38 THR H 1 39 HIS H . . 3.270 2.681 2.466 2.884 . 0 0 "[ . 1 . 2]" 1
1063 1 38 THR H 1 40 PHE H . . 3.920 3.883 3.873 3.890 . 0 0 "[ . 1 . 2]" 1
1064 1 38 THR HA 1 38 THR HB . . 2.560 2.638 2.624 2.648 0.088 11 0 "[ . 1 . 2]" 1
1065 1 38 THR HA 1 41 GLU H . . 3.860 3.168 2.955 3.543 . 0 0 "[ . 1 . 2]" 1
1066 1 38 THR HA 1 41 GLU HA . . 4.820 4.826 4.729 4.851 0.031 11 0 "[ . 1 . 2]" 1
1067 1 38 THR HA 1 41 GLU HB2 . . 4.140 2.496 2.319 2.791 . 0 0 "[ . 1 . 2]" 1
1068 1 38 THR HA 1 41 GLU QB . . 3.530 2.474 2.302 2.751 . 0 0 "[ . 1 . 2]" 1
1069 1 38 THR HA 1 41 GLU HB3 . . 4.140 4.053 3.866 4.181 0.041 18 0 "[ . 1 . 2]" 1
1070 1 38 THR HA 1 41 GLU HG2 . . 5.500 3.591 2.449 4.085 . 0 0 "[ . 1 . 2]" 1
1071 1 38 THR HA 1 41 GLU QG . . 4.770 2.491 2.073 2.902 . 0 0 "[ . 1 . 2]" 1
1072 1 38 THR HA 1 41 GLU HG3 . . 5.500 2.861 2.084 3.976 . 0 0 "[ . 1 . 2]" 1
1073 1 38 THR HA 1 42 GLU H . . 4.480 4.098 3.767 4.382 . 0 0 "[ . 1 . 2]" 1
1074 1 38 THR HB 1 39 HIS H . . 3.420 3.117 2.685 3.415 . 0 0 "[ . 1 . 2]" 1
1075 1 38 THR HB 1 41 GLU QG . . 6.130 4.839 4.553 5.147 . 0 0 "[ . 1 . 2]" 1
1076 1 38 THR MG 1 39 HIS H . . 4.880 3.075 2.513 3.752 . 0 0 "[ . 1 . 2]" 1
1077 1 38 THR MG 1 39 HIS HA . . 6.530 3.637 3.262 4.088 . 0 0 "[ . 1 . 2]" 1
1078 1 38 THR MG 1 42 GLU H . . 5.440 4.226 4.133 4.271 . 0 0 "[ . 1 . 2]" 1
1079 1 38 THR MG 1 42 GLU HA . . 6.530 4.970 4.618 5.257 . 0 0 "[ . 1 . 2]" 1
1080 1 38 THR MG 1 42 GLU HB2 . . 6.530 3.371 3.114 3.681 . 0 0 "[ . 1 . 2]" 1
1081 1 38 THR MG 1 42 GLU HB3 . . 6.530 4.500 3.932 5.205 . 0 0 "[ . 1 . 2]" 1
1082 1 38 THR MG 1 42 GLU QG . . 7.400 4.195 3.782 4.710 . 0 0 "[ . 1 . 2]" 1
1083 1 39 HIS H 1 40 PHE H . . 3.420 2.758 2.587 2.899 . 0 0 "[ . 1 . 2]" 1
1084 1 39 HIS H 1 41 GLU H . . 4.850 4.457 4.152 4.736 . 0 0 "[ . 1 . 2]" 1
1085 1 39 HIS HA 1 39 HIS HB2 . . 2.870 2.587 2.362 2.903 0.033 16 0 "[ . 1 . 2]" 1
1086 1 39 HIS HA 1 39 HIS QB . . 2.660 2.419 2.269 2.584 . 0 0 "[ . 1 . 2]" 1
1087 1 39 HIS HA 1 39 HIS HB3 . . 2.870 2.928 2.897 2.935 0.065 19 0 "[ . 1 . 2]" 1
1088 1 39 HIS HA 1 39 HIS HD2 . . 5.310 4.403 3.921 4.714 . 0 0 "[ . 1 . 2]" 1
1089 1 39 HIS HA 1 42 GLU H . . 3.610 3.326 2.943 3.525 . 0 0 "[ . 1 . 2]" 1
1090 1 39 HIS HA 1 42 GLU HB2 . . 3.110 2.997 1.999 3.167 0.057 11 0 "[ . 1 . 2]" 1
1091 1 39 HIS HA 1 42 GLU QB . . 2.920 2.416 1.963 2.729 . 0 0 "[ . 1 . 2]" 1
1092 1 39 HIS HA 1 42 GLU HB3 . . 3.110 2.643 2.125 2.993 . 0 0 "[ . 1 . 2]" 1
1093 1 39 HIS HA 1 42 GLU QG . . 4.450 3.585 2.370 3.800 . 0 0 "[ . 1 . 2]" 1
1094 1 39 HIS HA 1 42 GLU HG3 . . 4.200 3.908 3.875 3.927 . 0 0 "[ . 1 . 2]" 1
1095 1 39 HIS HA 1 43 MET ME . . 6.530 4.515 3.614 5.154 . 0 0 "[ . 1 . 2]" 1
1096 1 39 HIS QB 1 40 PHE H . . 4.860 2.754 2.413 3.095 . 0 0 "[ . 1 . 2]" 1
1097 1 39 HIS HB2 1 40 PHE H . . 5.500 3.948 3.371 4.213 . 0 0 "[ . 1 . 2]" 1
1098 1 39 HIS HB3 1 40 PHE H . . 5.500 2.829 2.440 3.403 . 0 0 "[ . 1 . 2]" 1
1099 1 39 HIS HE1 1 43 MET ME . . 6.530 2.907 1.965 5.406 . 0 0 "[ . 1 . 2]" 1
1100 1 39 HIS O 1 43 MET H . . 2.300 1.973 1.765 2.371 0.071 17 0 "[ . 1 . 2]" 1
1101 1 40 PHE H 1 41 GLU H . . 4.010 2.613 2.504 2.846 . 0 0 "[ . 1 . 2]" 1
1102 1 40 PHE H 1 42 GLU H . . 4.760 3.886 3.750 4.030 . 0 0 "[ . 1 . 2]" 1
1103 1 40 PHE H 1 42 GLU QB . . 5.420 4.588 4.271 4.798 . 0 0 "[ . 1 . 2]" 1
1104 1 40 PHE H 1 43 MET QB . . 5.940 4.803 4.530 5.180 . 0 0 "[ . 1 . 2]" 1
1105 1 40 PHE QB 1 41 GLU HA . . 4.980 4.026 3.883 4.210 . 0 0 "[ . 1 . 2]" 1
1106 1 40 PHE QB 1 41 GLU QB . . 6.240 4.420 4.281 4.567 . 0 0 "[ . 1 . 2]" 1
1107 1 40 PHE QB 1 41 GLU QG . . 5.620 3.202 2.955 3.721 . 0 0 "[ . 1 . 2]" 1
1108 1 40 PHE QB 1 53 ILE HB . . 7.250 5.242 4.831 5.637 . 0 0 "[ . 1 . 2]" 1
1109 1 40 PHE QB 1 53 ILE MG . . 7.400 4.269 3.796 4.653 . 0 0 "[ . 1 . 2]" 1
1110 1 40 PHE QB 1 71 VAL QG . . 8.960 5.228 4.989 5.668 . 0 0 "[ . 1 . 2]" 1
1111 1 40 PHE HB2 1 41 GLU HB2 . . 7.250 6.253 6.086 6.409 . 0 0 "[ . 1 . 2]" 1
1112 1 40 PHE HB2 1 41 GLU HB3 . . 7.250 7.069 6.936 7.297 0.047 7 0 "[ . 1 . 2]" 1
1113 1 40 PHE HB2 1 41 GLU HG2 . . 7.190 5.589 4.658 6.359 . 0 0 "[ . 1 . 2]" 1
1114 1 40 PHE HB2 1 41 GLU HG3 . . 7.190 5.377 4.644 6.698 . 0 0 "[ . 1 . 2]" 1
1115 1 40 PHE HB3 1 41 GLU HB2 . . 7.250 4.893 4.673 5.070 . 0 0 "[ . 1 . 2]" 1
1116 1 40 PHE HB3 1 41 GLU HB3 . . 7.250 5.499 5.329 5.805 . 0 0 "[ . 1 . 2]" 1
1117 1 40 PHE HB3 1 41 GLU HG2 . . 7.190 3.896 3.024 4.632 . 0 0 "[ . 1 . 2]" 1
1118 1 40 PHE HB3 1 41 GLU HG3 . . 7.190 3.797 3.132 4.969 . 0 0 "[ . 1 . 2]" 1
1119 1 40 PHE QD 1 41 GLU HA . . 7.220 3.065 2.590 3.478 . 0 0 "[ . 1 . 2]" 1
1120 1 40 PHE QD 1 41 GLU HB2 . . 7.620 5.229 4.820 5.559 . 0 0 "[ . 1 . 2]" 1
1121 1 40 PHE QD 1 41 GLU HB3 . . 7.620 5.094 4.611 5.499 . 0 0 "[ . 1 . 2]" 1
1122 1 40 PHE QD 1 41 GLU HG2 . . 7.620 4.240 3.709 4.998 . 0 0 "[ . 1 . 2]" 1
1123 1 40 PHE QD 1 41 GLU HG3 . . 7.620 4.558 4.175 5.238 . 0 0 "[ . 1 . 2]" 1
1124 1 40 PHE QD 1 43 MET HA . . 7.620 6.952 6.619 7.116 . 0 0 "[ . 1 . 2]" 1
1125 1 40 PHE QD 1 43 MET HB2 . . 7.620 4.788 4.383 6.369 . 0 0 "[ . 1 . 2]" 1
1126 1 40 PHE QD 1 43 MET HB3 . . 7.620 5.580 4.689 5.892 . 0 0 "[ . 1 . 2]" 1
1127 1 40 PHE QD 1 44 THR HA . . 7.620 6.353 6.102 6.832 . 0 0 "[ . 1 . 2]" 1
1128 1 40 PHE QD 1 44 THR HB . . 7.620 4.887 4.248 5.442 . 0 0 "[ . 1 . 2]" 1
1129 1 40 PHE QD 1 44 THR MG . . 8.650 2.583 2.331 3.063 . 0 0 "[ . 1 . 2]" 1
1130 1 40 PHE QD 1 52 LEU HB2 . . 7.620 5.933 4.732 6.600 . 0 0 "[ . 1 . 2]" 1
1131 1 40 PHE QD 1 52 LEU HB3 . . 7.620 6.722 5.838 7.081 . 0 0 "[ . 1 . 2]" 1
1132 1 40 PHE QD 1 52 LEU MD1 . . 8.650 3.035 2.469 4.193 . 0 0 "[ . 1 . 2]" 1
1133 1 40 PHE QD 1 52 LEU MD2 . . 8.650 4.171 3.279 6.057 . 0 0 "[ . 1 . 2]" 1
1134 1 40 PHE QD 1 53 ILE MD . . 8.650 2.841 2.490 3.253 . 0 0 "[ . 1 . 2]" 1
1135 1 40 PHE QD 1 53 ILE QG . . 8.500 3.582 2.949 3.943 . 0 0 "[ . 1 . 2]" 1
1136 1 40 PHE QD 1 53 ILE MG . . 8.650 4.939 4.388 5.257 . 0 0 "[ . 1 . 2]" 1
1137 1 40 PHE QD 1 67 ILE MD . . 8.650 5.202 4.825 5.516 . 0 0 "[ . 1 . 2]" 1
1138 1 40 PHE QD 1 71 VAL HB . . 7.620 5.759 5.204 6.716 . 0 0 "[ . 1 . 2]" 1
1139 1 40 PHE QD 1 71 VAL MG1 . . 8.650 5.185 4.681 5.634 . 0 0 "[ . 1 . 2]" 1
1140 1 40 PHE QD 1 71 VAL MG2 . . 8.650 3.979 3.666 4.651 . 0 0 "[ . 1 . 2]" 1
1141 1 40 PHE QE 1 41 GLU HA . . 7.620 4.886 4.238 5.412 . 0 0 "[ . 1 . 2]" 1
1142 1 40 PHE QE 1 41 GLU HG2 . . 7.620 6.069 5.495 6.689 . 0 0 "[ . 1 . 2]" 1
1143 1 40 PHE QE 1 41 GLU HG3 . . 7.620 6.468 6.183 6.784 . 0 0 "[ . 1 . 2]" 1
1144 1 40 PHE QE 1 52 LEU HB2 . . 7.620 4.522 3.562 4.999 . 0 0 "[ . 1 . 2]" 1
1145 1 40 PHE QE 1 52 LEU HB3 . . 7.620 5.297 4.477 5.723 . 0 0 "[ . 1 . 2]" 1
1146 1 40 PHE QE 1 52 LEU MD1 . . 8.650 2.097 1.948 2.351 . 0 0 "[ . 1 . 2]" 1
1147 1 40 PHE QE 1 52 LEU MD2 . . 8.650 2.447 1.946 4.449 . 0 0 "[ . 1 . 2]" 1
1148 1 40 PHE QE 1 53 ILE MD . . 8.650 3.060 2.290 3.323 . 0 0 "[ . 1 . 2]" 1
1149 1 40 PHE QE 1 53 ILE QG . . 7.410 3.950 3.309 4.276 . 0 0 "[ . 1 . 2]" 1
1150 1 40 PHE QE 1 67 ILE MG . . 8.650 5.288 4.859 5.569 . 0 0 "[ . 1 . 2]" 1
1151 1 40 PHE QE 1 71 VAL MG1 . . 8.650 3.882 3.662 4.256 . 0 0 "[ . 1 . 2]" 1
1152 1 40 PHE QE 1 71 VAL MG2 . . 8.650 2.296 2.030 3.076 . 0 0 "[ . 1 . 2]" 1
1153 1 41 GLU H 1 41 GLU HG2 . . 5.500 2.786 1.879 3.326 . 0 0 "[ . 1 . 2]" 1
1154 1 41 GLU H 1 41 GLU QG . . 4.970 2.034 1.834 2.529 . 0 0 "[ . 1 . 2]" 1
1155 1 41 GLU H 1 41 GLU HG3 . . 5.500 2.475 1.859 3.703 . 0 0 "[ . 1 . 2]" 1
1156 1 41 GLU H 1 42 GLU H . . 3.020 2.894 2.797 2.982 . 0 0 "[ . 1 . 2]" 1
1157 1 41 GLU H 1 44 THR MG . . 5.600 4.532 4.413 4.602 . 0 0 "[ . 1 . 2]" 1
1158 1 41 GLU HA 1 41 GLU HB2 . . 2.740 2.807 2.775 2.819 0.079 9 0 "[ . 1 . 2]" 1
1159 1 41 GLU HA 1 41 GLU HB3 . . 2.740 2.205 2.101 2.304 . 0 0 "[ . 1 . 2]" 1
1160 1 41 GLU HA 1 41 GLU HG2 . . 3.390 2.760 2.552 3.218 . 0 0 "[ . 1 . 2]" 1
1161 1 41 GLU HA 1 41 GLU QG . . 3.140 2.575 2.441 2.759 . 0 0 "[ . 1 . 2]" 1
1162 1 41 GLU HA 1 41 GLU HG3 . . 3.390 3.150 2.927 3.223 . 0 0 "[ . 1 . 2]" 1
1163 1 41 GLU HA 1 42 GLU HA . . 4.820 4.847 4.839 4.857 0.037 11 0 "[ . 1 . 2]" 1
1164 1 41 GLU HA 1 44 THR H . . 5.250 4.715 4.177 5.181 . 0 0 "[ . 1 . 2]" 1
1165 1 41 GLU HA 1 44 THR MG . . 6.530 3.669 3.017 4.022 . 0 0 "[ . 1 . 2]" 1
1166 1 41 GLU HA 1 49 GLY HA2 . . 4.820 3.268 2.274 4.836 0.016 9 0 "[ . 1 . 2]" 1
1167 1 41 GLU HA 1 49 GLY QA . . 4.390 2.830 2.184 4.005 . 0 0 "[ . 1 . 2]" 1
1168 1 41 GLU HA 1 49 GLY HA3 . . 4.820 3.194 2.314 4.510 . 0 0 "[ . 1 . 2]" 1
1169 1 41 GLU QB 1 42 GLU H . . 4.020 2.873 2.473 3.402 . 0 0 "[ . 1 . 2]" 1
1170 1 41 GLU QB 1 42 GLU HA . . 5.320 4.049 3.743 4.520 . 0 0 "[ . 1 . 2]" 1
1171 1 41 GLU QB 1 49 GLY QA . . 4.590 3.099 2.444 3.589 . 0 0 "[ . 1 . 2]" 1
1172 1 41 GLU QB 1 53 ILE QG . . 7.250 5.845 5.666 5.894 . 0 0 "[ . 1 . 2]" 1
1173 1 41 GLU HB2 1 49 GLY HA2 . . 5.800 4.681 4.021 5.494 . 0 0 "[ . 1 . 2]" 1
1174 1 41 GLU HB2 1 49 GLY HA3 . . 5.800 5.214 4.488 5.795 . 0 0 "[ . 1 . 2]" 1
1175 1 41 GLU HB3 1 49 GLY HA2 . . 5.800 3.341 2.521 3.960 . 0 0 "[ . 1 . 2]" 1
1176 1 41 GLU HB3 1 49 GLY HA3 . . 5.800 4.183 2.950 4.855 . 0 0 "[ . 1 . 2]" 1
1177 1 41 GLU QG 1 49 GLY QA . . 4.540 2.375 2.003 3.132 . 0 0 "[ . 1 . 2]" 1
1178 1 41 GLU QG 1 53 ILE QG . . 5.740 4.176 3.896 4.503 . 0 0 "[ . 1 . 2]" 1
1179 1 41 GLU HG2 1 49 GLY HA2 . . 5.440 3.021 2.084 5.032 . 0 0 "[ . 1 . 2]" 1
1180 1 41 GLU HG2 1 49 GLY HA3 . . 5.440 3.367 2.026 5.025 . 0 0 "[ . 1 . 2]" 1
1181 1 41 GLU HG2 1 53 ILE HG12 . . 7.250 5.521 5.069 6.281 . 0 0 "[ . 1 . 2]" 1
1182 1 41 GLU HG2 1 53 ILE HG13 . . 7.250 4.987 4.615 5.695 . 0 0 "[ . 1 . 2]" 1
1183 1 41 GLU HG3 1 49 GLY HA2 . . 5.440 3.768 2.347 5.009 . 0 0 "[ . 1 . 2]" 1
1184 1 41 GLU HG3 1 49 GLY HA3 . . 5.440 4.075 3.374 4.997 . 0 0 "[ . 1 . 2]" 1
1185 1 41 GLU HG3 1 53 ILE HG12 . . 7.250 5.885 5.400 6.665 . 0 0 "[ . 1 . 2]" 1
1186 1 41 GLU HG3 1 53 ILE HG13 . . 7.250 5.104 4.496 6.034 . 0 0 "[ . 1 . 2]" 1
1187 1 42 GLU H 1 42 GLU HB2 . . 2.800 2.441 2.061 2.749 . 0 0 "[ . 1 . 2]" 1
1188 1 42 GLU H 1 42 GLU HB3 . . 2.800 2.251 1.850 2.785 . 0 0 "[ . 1 . 2]" 1
1189 1 42 GLU H 1 42 GLU QG . . 4.760 3.905 3.608 4.026 . 0 0 "[ . 1 . 2]" 1
1190 1 42 GLU H 1 43 MET H . . 3.760 2.375 2.188 2.598 . 0 0 "[ . 1 . 2]" 1
1191 1 42 GLU H 1 43 MET HB2 . . 5.500 4.118 4.021 4.588 . 0 0 "[ . 1 . 2]" 1
1192 1 42 GLU H 1 43 MET QB . . 4.840 4.011 3.935 4.312 . 0 0 "[ . 1 . 2]" 1
1193 1 42 GLU H 1 43 MET HB3 . . 5.500 5.564 5.239 5.595 0.095 12 0 "[ . 1 . 2]" 1
1194 1 42 GLU HA 1 42 GLU HB2 . . 2.560 2.386 2.201 2.638 0.078 18 0 "[ . 1 . 2]" 1
1195 1 42 GLU HA 1 42 GLU HB3 . . 3.000 2.684 2.678 2.686 . 0 0 "[ . 1 . 2]" 1
1196 1 42 GLU QB 1 42 GLU QG . . 2.360 1.973 1.928 2.022 . 0 0 "[ . 1 . 2]" 1
1197 1 42 GLU QB 1 43 MET H . . 3.650 2.029 1.818 2.291 . 0 0 "[ . 1 . 2]" 1
1198 1 42 GLU QB 1 43 MET HA . . 4.390 3.562 3.214 3.819 . 0 0 "[ . 1 . 2]" 1
1199 1 42 GLU QB 1 43 MET ME . . 7.400 3.868 2.834 5.350 . 0 0 "[ . 1 . 2]" 1
1200 1 42 GLU QB 1 44 THR H . . 6.220 4.578 4.350 4.786 . 0 0 "[ . 1 . 2]" 1
1201 1 42 GLU HB2 1 43 MET H . . 3.830 3.464 3.097 3.718 . 0 0 "[ . 1 . 2]" 1
1202 1 42 GLU HB3 1 43 MET H . . 3.830 2.046 1.827 2.360 . 0 0 "[ . 1 . 2]" 1
1203 1 42 GLU QG 1 43 MET HA . . 5.630 3.913 2.613 4.618 . 0 0 "[ . 1 . 2]" 1
1204 1 42 GLU QG 1 43 MET ME . . 7.400 3.682 2.163 5.439 . 0 0 "[ . 1 . 2]" 1
1205 1 42 GLU QG 1 43 MET QG . . 6.510 4.401 3.951 4.752 . 0 0 "[ . 1 . 2]" 1
1206 1 43 MET H 1 43 MET QB . . 3.600 2.158 1.962 2.355 . 0 0 "[ . 1 . 2]" 1
1207 1 43 MET H 1 44 THR H . . 3.520 2.921 2.665 3.204 . 0 0 "[ . 1 . 2]" 1
1208 1 43 MET H 1 44 THR MG . . 6.530 3.842 3.531 4.245 . 0 0 "[ . 1 . 2]" 1
1209 1 43 MET H 1 45 GLU H . . 4.720 4.426 3.929 4.640 . 0 0 "[ . 1 . 2]" 1
1210 1 43 MET HA 1 43 MET ME . . 6.120 2.582 1.969 4.157 . 0 0 "[ . 1 . 2]" 1
1211 1 43 MET HA 1 44 THR MG . . 6.530 4.654 4.065 5.048 . 0 0 "[ . 1 . 2]" 1
1212 1 43 MET QB 1 44 THR HB . . 6.380 3.307 2.834 4.457 . 0 0 "[ . 1 . 2]" 1
1213 1 43 MET QB 1 44 THR MG . . 7.400 2.873 2.226 4.358 . 0 0 "[ . 1 . 2]" 1
1214 1 43 MET QB 1 45 GLU H . . 5.630 4.509 4.201 5.023 . 0 0 "[ . 1 . 2]" 1
1215 1 43 MET QG 1 44 THR HA . . 6.380 5.280 4.379 5.491 . 0 0 "[ . 1 . 2]" 1
1216 1 43 MET QG 1 44 THR MG . . 7.400 4.479 3.839 5.265 . 0 0 "[ . 1 . 2]" 1
1217 1 44 THR H 1 44 THR HB . . 3.830 3.004 2.593 3.494 . 0 0 "[ . 1 . 2]" 1
1218 1 44 THR H 1 44 THR MG . . 4.050 1.997 1.834 2.228 . 0 0 "[ . 1 . 2]" 1
1219 1 44 THR H 1 45 GLU H . . 3.520 2.507 1.649 2.936 . 0 0 "[ . 1 . 2]" 1
1220 1 44 THR H 1 45 GLU HA . . 5.500 4.684 3.990 5.107 . 0 0 "[ . 1 . 2]" 1
1221 1 44 THR HA 1 44 THR HB . . 2.870 2.286 2.118 2.400 . 0 0 "[ . 1 . 2]" 1
1222 1 44 THR HA 1 71 VAL MG1 . . 6.530 4.544 3.477 5.190 . 0 0 "[ . 1 . 2]" 1
1223 1 44 THR HA 1 71 VAL MG2 . . 6.530 4.765 4.470 5.369 . 0 0 "[ . 1 . 2]" 1
1224 1 44 THR HA 1 75 ARG QD . . 5.820 3.418 2.436 4.769 . 0 0 "[ . 1 . 2]" 1
1225 1 44 THR HB 1 46 HIS HB2 . . 5.500 4.218 3.968 4.604 . 0 0 "[ . 1 . 2]" 1
1226 1 44 THR HB 1 46 HIS QB . . 4.840 3.979 3.785 4.272 . 0 0 "[ . 1 . 2]" 1
1227 1 44 THR HB 1 46 HIS HB3 . . 5.500 4.922 4.184 5.305 . 0 0 "[ . 1 . 2]" 1
1228 1 44 THR HB 1 52 LEU QD . . 8.100 5.224 4.398 5.721 . 0 0 "[ . 1 . 2]" 1
1229 1 44 THR HB 1 71 VAL MG1 . . 6.530 3.197 2.702 3.673 . 0 0 "[ . 1 . 2]" 1
1230 1 44 THR HB 1 71 VAL MG2 . . 6.530 3.332 2.977 3.898 . 0 0 "[ . 1 . 2]" 1
1231 1 44 THR HB 1 75 ARG HD2 . . 4.400 3.751 2.681 4.430 0.030 6 0 "[ . 1 . 2]" 1
1232 1 44 THR MG 1 45 GLU H . . 5.720 3.247 2.636 3.596 . 0 0 "[ . 1 . 2]" 1
1233 1 44 THR MG 1 46 HIS H . . 5.540 2.655 1.942 3.984 . 0 0 "[ . 1 . 2]" 1
1234 1 44 THR MG 1 46 HIS HD1 . . 6.400 4.239 3.305 5.018 . 0 0 "[ . 1 . 2]" 1
1235 1 44 THR MG 1 52 LEU QD . . 9.130 3.212 2.796 3.556 . 0 0 "[ . 1 . 2]" 1
1236 1 44 THR MG 1 71 VAL QG . . 9.120 2.181 1.934 3.321 . 0 0 "[ . 1 . 2]" 1
1237 1 45 GLU H 1 45 GLU QG . . 5.070 3.196 2.554 4.175 . 0 0 "[ . 1 . 2]" 1
1238 1 45 GLU H 1 46 HIS H . . 3.390 2.889 2.748 3.063 . 0 0 "[ . 1 . 2]" 1
1239 1 45 GLU HA 1 45 GLU HB2 . . 2.930 2.809 2.464 2.983 0.053 9 0 "[ . 1 . 2]" 1
1240 1 45 GLU HA 1 45 GLU HB3 . . 2.930 2.615 2.362 2.978 0.048 13 0 "[ . 1 . 2]" 1
1241 1 45 GLU HA 1 45 GLU HG2 . . 3.450 2.916 2.475 3.187 . 0 0 "[ . 1 . 2]" 1
1242 1 45 GLU HA 1 45 GLU QG . . 3.280 2.659 2.389 2.827 . 0 0 "[ . 1 . 2]" 1
1243 1 45 GLU HA 1 45 GLU HG3 . . 3.450 3.098 2.652 3.208 . 0 0 "[ . 1 . 2]" 1
1244 1 45 GLU HA 1 74 TRP HZ3 . . 5.410 5.025 4.988 5.044 . 0 0 "[ . 1 . 2]" 1
1245 1 45 GLU QB 1 80 LYS QD . . 7.250 4.026 3.750 4.398 . 0 0 "[ . 1 . 2]" 1
1246 1 45 GLU HB2 1 74 TRP HZ3 . . 5.500 3.647 2.646 5.486 . 0 0 "[ . 1 . 2]" 1
1247 1 45 GLU HB2 1 80 LYS HE2 . . 7.250 3.214 2.207 4.840 . 0 0 "[ . 1 . 2]" 1
1248 1 45 GLU HB2 1 80 LYS HE3 . . 7.250 3.366 2.324 4.432 . 0 0 "[ . 1 . 2]" 1
1249 1 45 GLU HB3 1 74 TRP HZ3 . . 5.500 3.651 2.660 4.144 . 0 0 "[ . 1 . 2]" 1
1250 1 45 GLU HB3 1 80 LYS HE2 . . 7.250 3.546 2.254 5.106 . 0 0 "[ . 1 . 2]" 1
1251 1 45 GLU HB3 1 80 LYS HE3 . . 7.250 3.790 2.409 5.587 . 0 0 "[ . 1 . 2]" 1
1252 1 46 HIS H 1 52 LEU QD . . 7.730 4.953 4.491 5.388 . 0 0 "[ . 1 . 2]" 1
1253 1 46 HIS HA 1 47 PRO QG . . 5.710 3.808 3.667 3.926 . 0 0 "[ . 1 . 2]" 1
1254 1 46 HIS HA 1 74 TRP HZ3 . . 5.500 2.927 2.345 3.704 . 0 0 "[ . 1 . 2]" 1
1255 1 46 HIS QB 1 49 GLY H . . 5.350 4.154 3.348 4.414 . 0 0 "[ . 1 . 2]" 1
1256 1 46 HIS QB 1 71 VAL QG . . 8.040 2.518 2.202 2.919 . 0 0 "[ . 1 . 2]" 1
1257 1 46 HIS HB2 1 52 LEU MD1 . . 6.530 4.575 3.653 5.232 . 0 0 "[ . 1 . 2]" 1
1258 1 46 HIS HB2 1 52 LEU MD2 . . 6.530 4.054 3.449 5.354 . 0 0 "[ . 1 . 2]" 1
1259 1 46 HIS HB2 1 71 VAL MG1 . . 9.650 4.088 3.053 4.850 . 0 0 "[ . 1 . 2]" 1
1260 1 46 HIS HB2 1 71 VAL MG2 . . 9.650 2.704 2.267 3.551 . 0 0 "[ . 1 . 2]" 1
1261 1 46 HIS HB3 1 52 LEU MD1 . . 6.530 3.565 3.159 4.659 . 0 0 "[ . 1 . 2]" 1
1262 1 46 HIS HB3 1 52 LEU MD2 . . 6.530 3.612 2.800 5.070 . 0 0 "[ . 1 . 2]" 1
1263 1 46 HIS HB3 1 71 VAL MG1 . . 9.650 5.082 4.028 5.766 . 0 0 "[ . 1 . 2]" 1
1264 1 46 HIS HB3 1 71 VAL MG2 . . 9.650 3.317 2.890 3.671 . 0 0 "[ . 1 . 2]" 1
1265 1 46 HIS HD1 1 71 VAL QG . . 7.780 3.709 2.886 4.014 . 0 0 "[ . 1 . 2]" 1
1266 1 46 HIS HD2 1 47 PRO QD . . 6.380 2.570 2.220 3.089 . 0 0 "[ . 1 . 2]" 1
1267 1 46 HIS HD2 1 52 LEU MD1 . . 6.530 5.275 4.529 5.422 . 0 0 "[ . 1 . 2]" 1
1268 1 46 HIS HD2 1 52 LEU MD2 . . 6.530 3.947 3.441 5.119 . 0 0 "[ . 1 . 2]" 1
1269 1 46 HIS HD2 1 71 VAL HA . . 4.230 2.842 2.139 3.164 . 0 0 "[ . 1 . 2]" 1
1270 1 46 HIS HD2 1 71 VAL HB . . 5.500 5.428 4.815 5.573 0.073 8 0 "[ . 1 . 2]" 1
1271 1 46 HIS HD2 1 71 VAL MG1 . . 6.530 4.181 3.231 4.693 . 0 0 "[ . 1 . 2]" 1
1272 1 46 HIS HD2 1 71 VAL MG2 . . 6.530 2.827 2.444 3.453 . 0 0 "[ . 1 . 2]" 1
1273 1 46 HIS HD2 1 74 TRP HA . . 4.850 4.555 4.545 4.560 . 0 0 "[ . 1 . 2]" 1
1274 1 46 HIS HD2 1 74 TRP HB2 . . 4.630 2.901 2.614 3.210 . 0 0 "[ . 1 . 2]" 1
1275 1 46 HIS HD2 1 74 TRP QB . . 4.450 1.892 1.839 1.941 . 0 0 "[ . 1 . 2]" 1
1276 1 46 HIS HD2 1 74 TRP HB3 . . 4.630 1.919 1.863 1.985 . 0 0 "[ . 1 . 2]" 1
1277 1 46 HIS HD2 1 74 TRP HD1 . . 5.500 4.566 4.323 5.054 . 0 0 "[ . 1 . 2]" 1
1278 1 46 HIS HD2 1 74 TRP HE3 . . 5.500 2.540 2.142 3.297 . 0 0 "[ . 1 . 2]" 1
1279 1 46 HIS HE1 1 47 PRO QD . . 6.380 4.145 3.366 4.717 . 0 0 "[ . 1 . 2]" 1
1280 1 46 HIS HE1 1 47 PRO HG2 . . 5.500 4.139 3.712 4.482 . 0 0 "[ . 1 . 2]" 1
1281 1 46 HIS HE1 1 47 PRO HG3 . . 5.500 5.581 5.495 5.595 0.095 5 0 "[ . 1 . 2]" 1
1282 1 46 HIS HE1 1 48 SER HA . . 5.500 4.391 4.010 4.924 . 0 0 "[ . 1 . 2]" 1
1283 1 46 HIS HE1 1 48 SER QB . . 5.660 2.299 1.890 3.229 . 0 0 "[ . 1 . 2]" 1
1284 1 46 HIS HE1 1 52 LEU HA . . 5.500 5.578 5.526 5.595 0.095 11 0 "[ . 1 . 2]" 1
1285 1 46 HIS HE1 1 52 LEU MD1 . . 6.530 3.668 2.103 4.438 . 0 0 "[ . 1 . 2]" 1
1286 1 46 HIS HE1 1 52 LEU MD2 . . 6.530 2.506 2.155 2.842 . 0 0 "[ . 1 . 2]" 1
1287 1 46 HIS HE1 1 52 LEU HG . . 4.690 2.730 2.089 4.385 . 0 0 "[ . 1 . 2]" 1
1288 1 47 PRO HA 1 48 SER HA . . 4.510 4.509 4.319 4.542 0.032 9 0 "[ . 1 . 2]" 1
1289 1 47 PRO HA 1 49 GLY H . . 4.880 4.547 4.207 4.808 . 0 0 "[ . 1 . 2]" 1
1290 1 47 PRO QB 1 48 SER H . . 4.270 2.134 1.911 2.505 . 0 0 "[ . 1 . 2]" 1
1291 1 47 PRO QB 1 48 SER HA . . 6.190 3.649 3.331 3.929 . 0 0 "[ . 1 . 2]" 1
1292 1 47 PRO QB 1 49 GLY H . . 5.260 4.600 4.535 4.657 . 0 0 "[ . 1 . 2]" 1
1293 1 47 PRO QB 1 74 TRP HE1 . . 5.630 4.391 4.214 4.584 . 0 0 "[ . 1 . 2]" 1
1294 1 47 PRO HB2 1 48 SER H . . 4.570 2.152 1.923 2.539 . 0 0 "[ . 1 . 2]" 1
1295 1 47 PRO HB3 1 48 SER H . . 4.570 3.551 3.215 3.822 . 0 0 "[ . 1 . 2]" 1
1296 1 47 PRO QD 1 52 LEU QD . . 8.970 4.519 4.111 4.854 . 0 0 "[ . 1 . 2]" 1
1297 1 47 PRO QD 1 74 TRP HD1 . . 4.710 3.894 3.851 3.973 . 0 0 "[ . 1 . 2]" 1
1298 1 47 PRO QD 1 74 TRP HE1 . . 6.380 3.668 3.542 3.851 . 0 0 "[ . 1 . 2]" 1
1299 1 47 PRO QD 1 74 TRP HE3 . . 4.050 3.111 2.794 3.262 . 0 0 "[ . 1 . 2]" 1
1300 1 47 PRO QD 1 74 TRP HZ3 . . 4.310 3.351 3.068 3.555 . 0 0 "[ . 1 . 2]" 1
1301 1 47 PRO HD2 1 74 TRP HD1 . . 5.160 4.127 4.050 4.342 . 0 0 "[ . 1 . 2]" 1
1302 1 47 PRO HD2 1 74 TRP HE3 . . 4.380 3.308 2.847 3.652 . 0 0 "[ . 1 . 2]" 1
1303 1 47 PRO HD2 1 74 TRP HZ3 . . 4.570 4.042 3.617 4.255 . 0 0 "[ . 1 . 2]" 1
1304 1 47 PRO HD3 1 74 TRP HD1 . . 5.160 4.782 4.602 4.815 . 0 0 "[ . 1 . 2]" 1
1305 1 47 PRO HD3 1 74 TRP HE3 . . 4.380 3.877 3.520 4.085 . 0 0 "[ . 1 . 2]" 1
1306 1 47 PRO HD3 1 74 TRP HZ3 . . 4.570 3.624 3.148 4.090 . 0 0 "[ . 1 . 2]" 1
1307 1 47 PRO QG 1 48 SER HA . . 6.380 5.478 4.692 5.696 . 0 0 "[ . 1 . 2]" 1
1308 1 47 PRO QG 1 74 TRP HD1 . . 4.440 2.813 2.583 3.209 . 0 0 "[ . 1 . 2]" 1
1309 1 47 PRO QG 1 74 TRP HE1 . . 6.380 2.597 2.425 2.776 . 0 0 "[ . 1 . 2]" 1
1310 1 47 PRO HG2 1 74 TRP HD1 . . 4.850 2.942 2.636 3.504 . 0 0 "[ . 1 . 2]" 1
1311 1 47 PRO HG2 1 74 TRP HZ3 . . 5.500 5.603 5.591 5.610 0.110 15 0 "[ . 1 . 2]" 1
1312 1 47 PRO HG3 1 74 TRP HD1 . . 4.850 3.887 2.914 4.498 . 0 0 "[ . 1 . 2]" 1
1313 1 47 PRO HG3 1 74 TRP HZ3 . . 5.500 5.531 5.096 5.600 0.100 19 0 "[ . 1 . 2]" 1
1314 1 48 SER H 1 48 SER QB . . 3.580 2.459 2.004 2.814 . 0 0 "[ . 1 . 2]" 1
1315 1 48 SER H 1 49 GLY H . . 3.240 3.090 2.507 3.197 . 0 0 "[ . 1 . 2]" 1
1316 1 48 SER H 1 52 LEU QD . . 6.800 3.516 2.089 3.930 . 0 0 "[ . 1 . 2]" 1
1317 1 48 SER H 1 52 LEU HG . . 5.220 3.745 3.280 5.062 . 0 0 "[ . 1 . 2]" 1
1318 1 48 SER HA 1 48 SER HB2 . . 2.900 2.907 2.338 2.957 0.057 7 0 "[ . 1 . 2]" 1
1319 1 48 SER HA 1 48 SER HB3 . . 2.900 2.446 2.219 2.711 . 0 0 "[ . 1 . 2]" 1
1320 1 48 SER HA 1 49 GLY QA . . 5.290 4.284 4.080 4.628 . 0 0 "[ . 1 . 2]" 1
1321 1 48 SER HA 1 51 ASP HB2 . . 4.510 3.041 2.345 4.143 . 0 0 "[ . 1 . 2]" 1
1322 1 48 SER HA 1 51 ASP QB . . 4.030 2.845 2.290 3.531 . 0 0 "[ . 1 . 2]" 1
1323 1 48 SER HA 1 51 ASP HB3 . . 4.510 4.012 2.371 4.566 0.056 20 0 "[ . 1 . 2]" 1
1324 1 48 SER HA 1 52 LEU MD1 . . 6.530 4.880 4.630 5.521 . 0 0 "[ . 1 . 2]" 1
1325 1 48 SER HA 1 52 LEU MD2 . . 6.530 5.271 3.406 5.480 . 0 0 "[ . 1 . 2]" 1
1326 1 48 SER QB 1 51 ASP QB . . 5.440 2.037 1.894 2.398 . 0 0 "[ . 1 . 2]" 1
1327 1 48 SER QB 1 52 LEU QD . . 7.240 3.036 1.857 4.047 . 0 0 "[ . 1 . 2]" 1
1328 1 48 SER QB 1 52 LEU HG . . 6.380 2.544 1.976 4.021 . 0 0 "[ . 1 . 2]" 1
1329 1 48 SER HB2 1 51 ASP HB2 . . 6.570 3.618 2.039 5.349 . 0 0 "[ . 1 . 2]" 1
1330 1 48 SER HB2 1 51 ASP HB3 . . 6.570 4.170 2.285 5.315 . 0 0 "[ . 1 . 2]" 1
1331 1 48 SER HB2 1 52 LEU MD1 . . 8.280 3.837 2.730 4.862 . 0 0 "[ . 1 . 2]" 1
1332 1 48 SER HB2 1 52 LEU MD2 . . 8.280 3.511 1.970 5.205 . 0 0 "[ . 1 . 2]" 1
1333 1 48 SER HB3 1 51 ASP HB2 . . 6.570 2.436 1.951 3.720 . 0 0 "[ . 1 . 2]" 1
1334 1 48 SER HB3 1 51 ASP HB3 . . 6.570 2.953 2.012 3.951 . 0 0 "[ . 1 . 2]" 1
1335 1 48 SER HB3 1 52 LEU MD1 . . 8.280 4.465 3.264 5.333 . 0 0 "[ . 1 . 2]" 1
1336 1 48 SER HB3 1 52 LEU MD2 . . 8.280 4.448 2.336 5.135 . 0 0 "[ . 1 . 2]" 1
1337 1 49 GLY H 1 50 SER H . . 3.610 3.455 3.013 3.568 . 0 0 "[ . 1 . 2]" 1
1338 1 49 GLY H 1 51 ASP H . . 4.510 4.191 3.737 4.455 . 0 0 "[ . 1 . 2]" 1
1339 1 49 GLY H 1 52 LEU H . . 4.760 4.706 4.677 4.718 . 0 0 "[ . 1 . 2]" 1
1340 1 49 GLY H 1 52 LEU QD . . 6.890 3.434 2.052 4.461 . 0 0 "[ . 1 . 2]" 1
1341 1 50 SER H 1 51 ASP H . . 3.580 3.012 2.149 3.473 . 0 0 "[ . 1 . 2]" 1
1342 1 50 SER H 1 52 LEU H . . 4.880 4.227 2.735 4.794 . 0 0 "[ . 1 . 2]" 1
1343 1 50 SER H 1 53 ILE QG . . 6.380 5.093 3.333 5.751 . 0 0 "[ . 1 . 2]" 1
1344 1 51 ASP H 1 51 ASP HB2 . . 3.670 2.767 2.500 3.412 . 0 0 "[ . 1 . 2]" 1
1345 1 51 ASP H 1 51 ASP HB3 . . 3.670 3.437 2.519 3.647 . 0 0 "[ . 1 . 2]" 1
1346 1 51 ASP H 1 52 LEU H . . 3.110 1.737 1.523 2.110 . 0 0 "[ . 1 . 2]" 1
1347 1 51 ASP H 1 52 LEU HA . . 4.260 4.245 4.238 4.252 . 0 0 "[ . 1 . 2]" 1
1348 1 51 ASP H 1 52 LEU QD . . 6.760 3.102 2.751 4.000 . 0 0 "[ . 1 . 2]" 1
1349 1 51 ASP H 1 53 ILE H . . 5.190 3.322 2.766 4.099 . 0 0 "[ . 1 . 2]" 1
1350 1 51 ASP HA 1 54 TYR H . . 5.500 3.884 3.212 5.049 . 0 0 "[ . 1 . 2]" 1
1351 1 51 ASP HA 1 55 TYR H . . 4.170 2.924 2.176 3.924 . 0 0 "[ . 1 . 2]" 1
1352 1 51 ASP HA 1 55 TYR QB . . 5.040 2.367 1.951 3.221 . 0 0 "[ . 1 . 2]" 1
1353 1 51 ASP HA 1 55 TYR QD . . 6.770 3.325 2.140 4.637 . 0 0 "[ . 1 . 2]" 1
1354 1 51 ASP QB 1 52 LEU HA . . 4.890 4.347 3.689 4.458 . 0 0 "[ . 1 . 2]" 1
1355 1 51 ASP QB 1 55 TYR QD . . 8.520 3.548 2.431 5.705 . 0 0 "[ . 1 . 2]" 1
1356 1 52 LEU H 1 52 LEU HB2 . . 3.860 3.553 2.231 3.811 . 0 0 "[ . 1 . 2]" 1
1357 1 52 LEU H 1 52 LEU QB . . 3.600 3.032 2.207 3.241 . 0 0 "[ . 1 . 2]" 1
1358 1 52 LEU H 1 52 LEU HB3 . . 3.860 3.360 2.426 3.756 . 0 0 "[ . 1 . 2]" 1
1359 1 52 LEU H 1 52 LEU HG . . 4.010 2.882 2.574 3.340 . 0 0 "[ . 1 . 2]" 1
1360 1 52 LEU H 1 53 ILE H . . 3.520 2.490 1.983 3.149 . 0 0 "[ . 1 . 2]" 1
1361 1 52 LEU H 1 53 ILE MD . . 6.190 4.373 4.070 4.424 . 0 0 "[ . 1 . 2]" 1
1362 1 52 LEU H 1 53 ILE HG12 . . 5.500 3.305 2.984 5.544 0.044 19 0 "[ . 1 . 2]" 1
1363 1 52 LEU H 1 53 ILE HG13 . . 5.500 4.542 3.860 5.598 0.098 7 0 "[ . 1 . 2]" 1
1364 1 52 LEU H 1 54 TYR H . . 4.760 4.247 3.657 4.669 . 0 0 "[ . 1 . 2]" 1
1365 1 52 LEU HA 1 52 LEU HG . . 3.900 3.742 2.970 3.970 0.070 10 0 "[ . 1 . 2]" 1
1366 1 52 LEU HA 1 53 ILE HA . . 4.570 4.311 4.143 4.583 0.013 7 0 "[ . 1 . 2]" 1
1367 1 52 LEU HA 1 53 ILE QG . . 6.380 4.481 4.153 5.322 . 0 0 "[ . 1 . 2]" 1
1368 1 52 LEU HA 1 54 TYR H . . 4.760 4.070 3.095 4.672 . 0 0 "[ . 1 . 2]" 1
1369 1 52 LEU HA 1 56 PRO HA . . 5.220 5.244 5.201 5.263 0.043 10 0 "[ . 1 . 2]" 1
1370 1 52 LEU HA 1 62 ASP HA . . 4.690 4.741 4.729 4.751 0.061 6 0 "[ . 1 . 2]" 1
1371 1 52 LEU QB 1 53 ILE H . . 6.380 3.892 2.416 4.175 . 0 0 "[ . 1 . 2]" 1
1372 1 52 LEU QB 1 53 ILE MD . . 7.400 3.827 1.996 4.822 . 0 0 "[ . 1 . 2]" 1
1373 1 52 LEU QB 1 53 ILE QG . . 5.550 3.754 2.698 3.968 . 0 0 "[ . 1 . 2]" 1
1374 1 52 LEU HB2 1 53 ILE HG12 . . 7.250 4.072 2.794 5.578 . 0 0 "[ . 1 . 2]" 1
1375 1 52 LEU HB2 1 53 ILE HG13 . . 7.250 5.581 4.251 6.346 . 0 0 "[ . 1 . 2]" 1
1376 1 52 LEU HB3 1 53 ILE HG12 . . 7.250 5.051 3.957 6.491 . 0 0 "[ . 1 . 2]" 1
1377 1 52 LEU HB3 1 53 ILE HG13 . . 7.250 6.542 4.917 6.824 . 0 0 "[ . 1 . 2]" 1
1378 1 52 LEU QD 1 53 ILE H . . 6.890 3.582 2.513 4.239 . 0 0 "[ . 1 . 2]" 1
1379 1 52 LEU QD 1 53 ILE HB . . 8.100 3.979 3.505 5.220 . 0 0 "[ . 1 . 2]" 1
1380 1 52 LEU QD 1 53 ILE QG . . 6.770 2.250 1.993 3.474 . 0 0 "[ . 1 . 2]" 1
1381 1 52 LEU QD 1 54 TYR H . . 7.820 5.025 4.589 5.488 . 0 0 "[ . 1 . 2]" 1
1382 1 52 LEU QD 1 67 ILE QG . . 8.970 4.289 3.843 4.604 . 0 0 "[ . 1 . 2]" 1
1383 1 52 LEU QD 1 68 VAL QG . . 10.690 4.090 3.785 4.379 . 0 0 "[ . 1 . 2]" 1
1384 1 52 LEU QD 1 70 THR H . . 7.940 3.828 3.521 4.145 . 0 0 "[ . 1 . 2]" 1
1385 1 52 LEU QD 1 70 THR MG . . 5.200 2.237 2.017 2.895 . 0 0 "[ . 1 . 2]" 1
1386 1 52 LEU QD 1 71 VAL H . . 7.880 2.871 2.544 3.240 . 0 0 "[ . 1 . 2]" 1
1387 1 52 LEU MD1 1 53 ILE HA . . 6.530 4.058 3.890 4.606 . 0 0 "[ . 1 . 2]" 1
1388 1 52 LEU MD1 1 53 ILE MD . . 7.560 2.793 2.337 3.693 . 0 0 "[ . 1 . 2]" 1
1389 1 52 LEU MD1 1 53 ILE HG12 . . 8.280 2.369 2.019 4.123 . 0 0 "[ . 1 . 2]" 1
1390 1 52 LEU MD1 1 53 ILE HG13 . . 8.280 3.433 3.153 4.672 . 0 0 "[ . 1 . 2]" 1
1391 1 52 LEU MD1 1 53 ILE MG . . 7.560 4.561 4.333 5.228 . 0 0 "[ . 1 . 2]" 1
1392 1 52 LEU MD1 1 70 THR HB . . 6.530 4.148 2.291 4.716 . 0 0 "[ . 1 . 2]" 1
1393 1 52 LEU MD1 1 70 THR MG . . 6.250 4.164 2.782 4.331 . 0 0 "[ . 1 . 2]" 1
1394 1 52 LEU MD1 1 71 VAL HA . . 6.530 5.004 3.740 5.425 . 0 0 "[ . 1 . 2]" 1
1395 1 52 LEU MD1 1 71 VAL HB . . 6.530 4.617 3.335 5.354 . 0 0 "[ . 1 . 2]" 1
1396 1 52 LEU MD1 1 71 VAL MG1 . . 7.560 4.916 4.013 5.192 . 0 0 "[ . 1 . 2]" 1
1397 1 52 LEU MD1 1 71 VAL MG2 . . 7.560 2.990 1.941 3.422 . 0 0 "[ . 1 . 2]" 1
1398 1 52 LEU MD2 1 53 ILE HA . . 6.530 5.388 5.058 5.468 . 0 0 "[ . 1 . 2]" 1
1399 1 52 LEU MD2 1 53 ILE MD . . 7.560 4.003 3.428 4.416 . 0 0 "[ . 1 . 2]" 1
1400 1 52 LEU MD2 1 53 ILE HG12 . . 8.280 4.317 3.404 5.421 . 0 0 "[ . 1 . 2]" 1
1401 1 52 LEU MD2 1 53 ILE HG13 . . 8.280 5.385 3.621 6.375 . 0 0 "[ . 1 . 2]" 1
1402 1 52 LEU MD2 1 70 THR HB . . 6.530 2.473 1.962 4.604 . 0 0 "[ . 1 . 2]" 1
1403 1 52 LEU MD2 1 70 THR MG . . 6.250 2.365 2.020 4.135 . 0 0 "[ . 1 . 2]" 1
1404 1 52 LEU MD2 1 71 VAL HA . . 6.530 3.411 2.881 5.107 . 0 0 "[ . 1 . 2]" 1
1405 1 52 LEU MD2 1 71 VAL HB . . 6.530 3.597 2.955 5.181 . 0 0 "[ . 1 . 2]" 1
1406 1 52 LEU MD2 1 71 VAL MG1 . . 7.560 4.156 3.827 5.227 . 0 0 "[ . 1 . 2]" 1
1407 1 52 LEU MD2 1 71 VAL MG2 . . 7.560 2.055 1.781 3.143 . 0 0 "[ . 1 . 2]" 1
1408 1 52 LEU HG 1 53 ILE MD . . 6.530 5.003 3.028 5.439 . 0 0 "[ . 1 . 2]" 1
1409 1 53 ILE H 1 53 ILE HB . . 4.040 2.557 2.370 2.690 . 0 0 "[ . 1 . 2]" 1
1410 1 53 ILE H 1 53 ILE HG12 . . 5.500 3.242 2.347 4.374 . 0 0 "[ . 1 . 2]" 1
1411 1 53 ILE H 1 53 ILE HG13 . . 5.500 4.222 3.246 4.619 . 0 0 "[ . 1 . 2]" 1
1412 1 53 ILE H 1 53 ILE MG . . 4.450 3.683 3.640 3.731 . 0 0 "[ . 1 . 2]" 1
1413 1 53 ILE H 1 54 TYR H . . 3.480 2.040 1.708 2.926 . 0 0 "[ . 1 . 2]" 1
1414 1 53 ILE H 1 54 TYR HA . . 5.500 4.479 4.098 5.383 . 0 0 "[ . 1 . 2]" 1
1415 1 53 ILE H 1 55 TYR H . . 3.980 3.280 2.862 3.954 . 0 0 "[ . 1 . 2]" 1
1416 1 53 ILE H 1 56 PRO QD . . 6.380 2.964 2.515 4.276 . 0 0 "[ . 1 . 2]" 1
1417 1 53 ILE HA 1 53 ILE HG12 . . 3.700 2.817 2.588 3.243 . 0 0 "[ . 1 . 2]" 1
1418 1 53 ILE HA 1 53 ILE QG . . 3.470 2.686 2.359 2.972 . 0 0 "[ . 1 . 2]" 1
1419 1 53 ILE HA 1 53 ILE HG13 . . 3.700 3.425 2.720 3.466 . 0 0 "[ . 1 . 2]" 1
1420 1 53 ILE HA 1 67 ILE MD . . 6.090 2.271 2.037 2.574 . 0 0 "[ . 1 . 2]" 1
1421 1 53 ILE HA 1 67 ILE QG . . 6.380 4.106 3.718 4.511 . 0 0 "[ . 1 . 2]" 1
1422 1 53 ILE HA 1 67 ILE MG . . 6.530 2.328 1.898 2.882 . 0 0 "[ . 1 . 2]" 1
1423 1 53 ILE HB 1 54 TYR H . . 5.500 3.290 2.773 4.142 . 0 0 "[ . 1 . 2]" 1
1424 1 53 ILE HB 1 54 TYR HD1 . . 5.500 4.799 3.345 5.575 0.075 1 0 "[ . 1 . 2]" 1
1425 1 53 ILE HB 1 54 TYR HD2 . . 5.500 4.162 3.474 5.562 0.062 5 0 "[ . 1 . 2]" 1
1426 1 53 ILE HB 1 54 TYR HE2 . . 5.340 4.077 3.203 5.841 0.501 5 1 "[ + 1 . 2]" 1
1427 1 53 ILE HB 1 67 ILE MD . . 6.530 4.718 4.151 5.069 . 0 0 "[ . 1 . 2]" 1
1428 1 53 ILE MD 1 54 TYR HD1 . . 6.530 5.470 5.289 6.031 . 0 0 "[ . 1 . 2]" 1
1429 1 53 ILE MD 1 54 TYR HE1 . . 6.530 5.133 3.947 5.469 . 0 0 "[ . 1 . 2]" 1
1430 1 53 ILE MD 1 54 TYR HE2 . . 6.530 5.372 4.354 5.522 . 0 0 "[ . 1 . 2]" 1
1431 1 53 ILE MD 1 67 ILE HB . . 6.530 2.862 2.132 4.359 . 0 0 "[ . 1 . 2]" 1
1432 1 53 ILE MD 1 67 ILE MD . . 7.560 2.162 1.933 3.785 . 0 0 "[ . 1 . 2]" 1
1433 1 53 ILE MD 1 67 ILE QG . . 7.400 3.262 2.940 4.870 . 0 0 "[ . 1 . 2]" 1
1434 1 53 ILE MD 1 67 ILE MG . . 7.560 3.114 2.350 4.657 . 0 0 "[ . 1 . 2]" 1
1435 1 53 ILE MD 1 68 VAL HA . . 6.470 4.771 4.297 5.362 . 0 0 "[ . 1 . 2]" 1
1436 1 53 ILE QG 1 67 ILE MD . . 7.400 3.766 2.390 4.004 . 0 0 "[ . 1 . 2]" 1
1437 1 53 ILE QG 1 67 ILE MG . . 7.400 3.979 3.381 4.245 . 0 0 "[ . 1 . 2]" 1
1438 1 53 ILE MG 1 54 TYR H . . 6.060 3.595 3.070 4.233 . 0 0 "[ . 1 . 2]" 1
1439 1 53 ILE MG 1 54 TYR HA . . 6.530 4.222 3.926 4.645 . 0 0 "[ . 1 . 2]" 1
1440 1 53 ILE MG 1 54 TYR HD1 . . 6.530 3.533 3.011 4.728 . 0 0 "[ . 1 . 2]" 1
1441 1 53 ILE MG 1 54 TYR HD2 . . 6.530 3.154 2.870 3.578 . 0 0 "[ . 1 . 2]" 1
1442 1 53 ILE MG 1 54 TYR HE1 . . 6.530 3.325 2.655 4.369 . 0 0 "[ . 1 . 2]" 1
1443 1 53 ILE MG 1 54 TYR HE2 . . 6.530 2.762 2.374 3.426 . 0 0 "[ . 1 . 2]" 1
1444 1 53 ILE MG 1 55 TYR H . . 6.530 5.125 4.773 5.468 . 0 0 "[ . 1 . 2]" 1
1445 1 53 ILE MG 1 67 ILE HB . . 6.530 5.003 4.133 5.433 . 0 0 "[ . 1 . 2]" 1
1446 1 53 ILE MG 1 67 ILE MD . . 7.560 3.003 2.148 3.447 . 0 0 "[ . 1 . 2]" 1
1447 1 53 ILE MG 1 67 ILE QG . . 7.400 4.874 4.097 5.320 . 0 0 "[ . 1 . 2]" 1
1448 1 53 ILE MG 1 67 ILE MG . . 7.560 4.025 3.628 4.462 . 0 0 "[ . 1 . 2]" 1
1449 1 54 TYR H 1 55 TYR H . . 3.450 2.030 1.802 2.237 . 0 0 "[ . 1 . 2]" 1
1450 1 54 TYR H 1 56 PRO QD . . 6.380 2.568 1.886 3.167 . 0 0 "[ . 1 . 2]" 1
1451 1 54 TYR HA 1 54 TYR HD1 . . 4.380 3.171 2.309 4.417 0.037 3 0 "[ . 1 . 2]" 1
1452 1 54 TYR HA 1 54 TYR HE1 . . 5.500 5.343 4.726 6.217 0.717 3 2 "[ + - 1 . 2]" 1
1453 1 54 TYR HA 1 56 PRO QD . . 6.380 3.473 2.562 4.728 . 0 0 "[ . 1 . 2]" 1
1454 1 54 TYR QB 1 55 TYR QB . . 7.250 4.261 2.845 5.333 . 0 0 "[ . 1 . 2]" 1
1455 1 54 TYR QB 1 56 PRO QG . . 6.790 5.073 4.612 5.202 . 0 0 "[ . 1 . 2]" 1
1456 1 54 TYR QB 1 57 LYS QB . . 7.250 5.741 5.571 5.894 . 0 0 "[ . 1 . 2]" 1
1457 1 55 TYR H 1 56 PRO HD2 . . 5.500 2.540 1.887 3.574 . 0 0 "[ . 1 . 2]" 1
1458 1 55 TYR H 1 56 PRO QD . . 5.320 2.165 1.881 2.424 . 0 0 "[ . 1 . 2]" 1
1459 1 55 TYR H 1 56 PRO HD3 . . 5.500 2.981 1.999 3.866 . 0 0 "[ . 1 . 2]" 1
1460 1 55 TYR HA 1 56 PRO QG . . 5.710 4.938 4.543 5.183 . 0 0 "[ . 1 . 2]" 1
1461 1 55 TYR QB 1 56 PRO QB . . 6.890 4.695 4.067 5.217 . 0 0 "[ . 1 . 2]" 1
1462 1 56 PRO HA 1 57 LYS H . . 2.770 2.541 2.186 2.767 . 0 0 "[ . 1 . 2]" 1
1463 1 56 PRO HA 1 57 LYS QB . . 4.700 4.224 3.353 4.306 . 0 0 "[ . 1 . 2]" 1
1464 1 56 PRO HA 1 60 ASP HB2 . . 4.850 3.412 2.525 4.366 . 0 0 "[ . 1 . 2]" 1
1465 1 56 PRO HA 1 60 ASP QB . . 4.320 2.922 2.320 3.670 . 0 0 "[ . 1 . 2]" 1
1466 1 56 PRO HA 1 60 ASP HB3 . . 4.850 3.292 2.468 4.371 . 0 0 "[ . 1 . 2]" 1
1467 1 56 PRO QB 1 60 ASP QB . . 5.730 2.328 2.140 2.673 . 0 0 "[ . 1 . 2]" 1
1468 1 56 PRO QB 1 62 ASP QB . . 7.250 2.183 1.963 2.404 . 0 0 "[ . 1 . 2]" 1
1469 1 56 PRO HB2 1 60 ASP HB2 . . 6.510 3.587 2.579 4.204 . 0 0 "[ . 1 . 2]" 1
1470 1 56 PRO HB2 1 60 ASP HB3 . . 6.510 2.606 2.232 3.414 . 0 0 "[ . 1 . 2]" 1
1471 1 56 PRO HB3 1 60 ASP HB2 . . 6.510 3.904 3.310 4.587 . 0 0 "[ . 1 . 2]" 1
1472 1 56 PRO HB3 1 60 ASP HB3 . . 6.510 3.097 2.407 3.970 . 0 0 "[ . 1 . 2]" 1
1473 1 56 PRO QG 1 60 ASP QB . . 5.580 4.132 3.988 4.304 . 0 0 "[ . 1 . 2]" 1
1474 1 56 PRO QG 1 62 ASP HA . . 5.150 2.944 2.158 3.755 . 0 0 "[ . 1 . 2]" 1
1475 1 56 PRO QG 1 62 ASP QB . . 5.710 1.995 1.847 2.203 . 0 0 "[ . 1 . 2]" 1
1476 1 56 PRO HG2 1 62 ASP HA . . 5.500 3.285 2.170 4.217 . 0 0 "[ . 1 . 2]" 1
1477 1 56 PRO HG2 1 62 ASP HB2 . . 7.250 2.257 2.041 2.774 . 0 0 "[ . 1 . 2]" 1
1478 1 56 PRO HG2 1 62 ASP HB3 . . 7.250 2.513 2.049 3.854 . 0 0 "[ . 1 . 2]" 1
1479 1 56 PRO HG3 1 62 ASP HA . . 5.500 3.560 2.912 4.618 . 0 0 "[ . 1 . 2]" 1
1480 1 56 PRO HG3 1 62 ASP HB2 . . 7.250 3.353 2.472 4.106 . 0 0 "[ . 1 . 2]" 1
1481 1 56 PRO HG3 1 62 ASP HB3 . . 7.250 3.634 2.948 5.489 . 0 0 "[ . 1 . 2]" 1
1482 1 57 LYS H 1 57 LYS QG . . 5.040 4.260 3.404 4.436 . 0 0 "[ . 1 . 2]" 1
1483 1 57 LYS H 1 58 GLU H . . 2.930 2.103 1.602 2.549 . 0 0 "[ . 1 . 2]" 1
1484 1 57 LYS H 1 58 GLU QB . . 6.040 3.889 3.218 4.197 . 0 0 "[ . 1 . 2]" 1
1485 1 57 LYS H 1 58 GLU QG . . 6.380 5.758 5.307 5.817 . 0 0 "[ . 1 . 2]" 1
1486 1 57 LYS H 1 60 ASP H . . 5.070 3.040 2.503 3.498 . 0 0 "[ . 1 . 2]" 1
1487 1 57 LYS H 1 60 ASP HB2 . . 4.720 2.462 1.587 3.082 . 0 0 "[ . 1 . 2]" 1
1488 1 57 LYS H 1 60 ASP QB . . 4.580 1.936 1.584 2.574 . 0 0 "[ . 1 . 2]" 1
1489 1 57 LYS H 1 60 ASP HB3 . . 4.720 2.446 1.704 3.344 . 0 0 "[ . 1 . 2]" 1
1490 1 57 LYS H 1 62 ASP QB . . 6.380 3.477 2.453 4.434 . 0 0 "[ . 1 . 2]" 1
1491 1 57 LYS HA 1 57 LYS QD . . 4.360 3.693 3.588 3.770 . 0 0 "[ . 1 . 2]" 1
1492 1 57 LYS HA 1 58 GLU H . . 3.270 3.302 3.289 3.312 0.042 10 0 "[ . 1 . 2]" 1
1493 1 57 LYS QB 1 58 GLU H . . 4.110 2.726 2.279 3.500 . 0 0 "[ . 1 . 2]" 1
1494 1 57 LYS QB 1 58 GLU HB2 . . 6.380 3.277 2.593 4.673 . 0 0 "[ . 1 . 2]" 1
1495 1 57 LYS QB 1 58 GLU HB3 . . 6.380 4.671 4.039 5.751 . 0 0 "[ . 1 . 2]" 1
1496 1 57 LYS QB 1 58 GLU QG . . 7.250 4.704 3.298 5.656 . 0 0 "[ . 1 . 2]" 1
1497 1 57 LYS QB 1 60 ASP H . . 5.420 4.704 4.494 4.864 . 0 0 "[ . 1 . 2]" 1
1498 1 57 LYS QB 1 60 ASP HB2 . . 6.380 5.155 4.335 5.804 . 0 0 "[ . 1 . 2]" 1
1499 1 57 LYS QB 1 60 ASP HB3 . . 6.380 5.128 4.480 5.800 . 0 0 "[ . 1 . 2]" 1
1500 1 57 LYS QE 1 58 GLU H . . 6.380 5.291 4.386 5.686 . 0 0 "[ . 1 . 2]" 1
1501 1 57 LYS QG 1 58 GLU H . . 5.760 3.747 2.630 4.219 . 0 0 "[ . 1 . 2]" 1
1502 1 57 LYS QG 1 58 GLU QB . . 7.250 3.937 2.944 4.310 . 0 0 "[ . 1 . 2]" 1
1503 1 57 LYS QG 1 60 ASP H . . 5.350 4.742 4.512 4.822 . 0 0 "[ . 1 . 2]" 1
1504 1 58 GLU H 1 58 GLU HB2 . . 2.990 2.197 1.916 2.826 . 0 0 "[ . 1 . 2]" 1
1505 1 58 GLU H 1 58 GLU HB3 . . 2.990 2.782 2.313 3.024 0.034 4 0 "[ . 1 . 2]" 1
1506 1 58 GLU H 1 59 GLY H . . 4.040 2.683 2.296 3.340 . 0 0 "[ . 1 . 2]" 1
1507 1 58 GLU H 1 60 ASP H . . 4.480 3.011 2.520 3.288 . 0 0 "[ . 1 . 2]" 1
1508 1 58 GLU HA 1 58 GLU HB2 . . 2.710 2.473 2.116 2.670 . 0 0 "[ . 1 . 2]" 1
1509 1 58 GLU HA 1 58 GLU QB . . 2.410 2.302 2.054 2.359 . 0 0 "[ . 1 . 2]" 1
1510 1 58 GLU HA 1 58 GLU HB3 . . 2.710 2.766 2.620 2.789 0.079 7 0 "[ . 1 . 2]" 1
1511 1 58 GLU HA 1 58 GLU QG . . 3.280 2.249 1.897 2.961 . 0 0 "[ . 1 . 2]" 1
1512 1 58 GLU HA 1 59 GLY H . . 2.710 2.598 1.598 2.798 0.088 19 0 "[ . 1 . 2]" 1
1513 1 58 GLU HA 1 59 GLY QA . . 5.170 3.919 3.612 4.228 . 0 0 "[ . 1 . 2]" 1
1514 1 58 GLU HA 1 60 ASP H . . 3.640 3.662 3.456 3.692 0.052 18 0 "[ . 1 . 2]" 1
1515 1 58 GLU QB 1 59 GLY H . . 3.560 2.992 1.697 3.315 . 0 0 "[ . 1 . 2]" 1
1516 1 58 GLU QB 1 60 ASP H . . 4.550 4.013 3.134 4.162 . 0 0 "[ . 1 . 2]" 1
1517 1 58 GLU QB 1 60 ASP QB . . 5.680 4.263 2.764 4.544 . 0 0 "[ . 1 . 2]" 1
1518 1 58 GLU HB2 1 59 GLY H . . 3.890 3.703 3.111 3.909 0.019 5 0 "[ . 1 . 2]" 1
1519 1 58 GLU HB2 1 60 ASP HB2 . . 7.250 5.311 3.440 6.237 . 0 0 "[ . 1 . 2]" 1
1520 1 58 GLU HB2 1 60 ASP HB3 . . 7.250 6.054 4.775 6.500 . 0 0 "[ . 1 . 2]" 1
1521 1 58 GLU HB3 1 59 GLY H . . 3.890 3.192 1.705 3.766 . 0 0 "[ . 1 . 2]" 1
1522 1 58 GLU HB3 1 60 ASP HB2 . . 7.250 4.973 2.969 5.580 . 0 0 "[ . 1 . 2]" 1
1523 1 58 GLU HB3 1 60 ASP HB3 . . 7.250 5.972 4.665 6.621 . 0 0 "[ . 1 . 2]" 1
1524 1 58 GLU QG 1 59 GLY H . . 4.950 3.916 2.572 4.212 . 0 0 "[ . 1 . 2]" 1
1525 1 58 GLU QG 1 59 GLY HA2 . . 6.380 4.909 3.752 5.301 . 0 0 "[ . 1 . 2]" 1
1526 1 58 GLU QG 1 59 GLY QA . . 5.760 4.379 3.469 4.620 . 0 0 "[ . 1 . 2]" 1
1527 1 58 GLU QG 1 59 GLY HA3 . . 6.380 4.973 4.083 5.511 . 0 0 "[ . 1 . 2]" 1
1528 1 58 GLU QG 1 60 ASP H . . 6.310 5.131 4.665 5.425 . 0 0 "[ . 1 . 2]" 1
1529 1 59 GLY H 1 60 ASP H . . 3.270 1.706 1.346 2.482 . 0 0 "[ . 1 . 2]" 1
1530 1 60 ASP H 1 60 ASP HB2 . . 3.760 2.669 2.279 3.038 . 0 0 "[ . 1 . 2]" 1
1531 1 60 ASP H 1 60 ASP QB . . 3.600 2.507 2.238 2.858 . 0 0 "[ . 1 . 2]" 1
1532 1 60 ASP H 1 60 ASP HB3 . . 3.760 3.246 2.830 3.753 . 0 0 "[ . 1 . 2]" 1
1533 1 60 ASP H 1 61 ASP H . . 4.040 4.077 4.064 4.085 0.045 19 0 "[ . 1 . 2]" 1
1534 1 60 ASP HA 1 60 ASP HB2 . . 2.990 2.884 2.681 3.035 0.045 20 0 "[ . 1 . 2]" 1
1535 1 60 ASP HA 1 60 ASP QB . . 2.750 2.502 2.208 2.593 . 0 0 "[ . 1 . 2]" 1
1536 1 60 ASP HA 1 60 ASP HB3 . . 2.990 2.805 2.282 3.025 0.035 8 0 "[ . 1 . 2]" 1
1537 1 60 ASP HA 1 61 ASP H . . 2.800 2.023 1.785 2.412 . 0 0 "[ . 1 . 2]" 1
1538 1 60 ASP HA 1 61 ASP HA . . 4.170 4.203 4.192 4.213 0.043 16 0 "[ . 1 . 2]" 1
1539 1 61 ASP H 1 61 ASP HB2 . . 3.270 2.961 2.139 3.343 0.073 19 0 "[ . 1 . 2]" 1
1540 1 61 ASP H 1 61 ASP QB . . 3.020 2.416 2.080 2.640 . 0 0 "[ . 1 . 2]" 1
1541 1 61 ASP H 1 61 ASP HB3 . . 3.270 2.633 2.184 2.843 . 0 0 "[ . 1 . 2]" 1
1542 1 61 ASP H 1 62 ASP H . . 4.380 4.048 3.676 4.365 . 0 0 "[ . 1 . 2]" 1
1543 1 61 ASP H 1 62 ASP QB . . 6.160 4.968 3.698 5.268 . 0 0 "[ . 1 . 2]" 1
1544 1 61 ASP HA 1 61 ASP HB2 . . 2.710 2.318 2.256 2.524 . 0 0 "[ . 1 . 2]" 1
1545 1 61 ASP HA 1 61 ASP HB3 . . 2.710 2.777 2.482 2.794 0.084 18 0 "[ . 1 . 2]" 1
1546 1 61 ASP HA 1 62 ASP H . . 2.770 2.336 2.215 2.548 . 0 0 "[ . 1 . 2]" 1
1547 1 61 ASP HA 1 66 GLY QA . . 6.160 3.914 2.989 4.277 . 0 0 "[ . 1 . 2]" 1
1548 1 61 ASP QB 1 66 GLY QA . . 4.230 3.069 2.686 3.453 . 0 0 "[ . 1 . 2]" 1
1549 1 61 ASP HB2 1 66 GLY HA2 . . 5.040 4.317 2.986 4.823 . 0 0 "[ . 1 . 2]" 1
1550 1 61 ASP HB2 1 66 GLY HA3 . . 5.040 4.887 3.346 5.049 0.009 1 0 "[ . 1 . 2]" 1
1551 1 61 ASP HB3 1 66 GLY HA2 . . 5.040 3.482 2.904 4.554 . 0 0 "[ . 1 . 2]" 1
1552 1 61 ASP HB3 1 66 GLY HA3 . . 5.040 3.912 3.354 5.041 0.001 19 0 "[ . 1 . 2]" 1
1553 1 62 ASP H 1 63 SER H . . 2.930 2.506 2.124 2.905 . 0 0 "[ . 1 . 2]" 1
1554 1 62 ASP H 1 63 SER HA . . 4.720 4.616 4.497 4.667 . 0 0 "[ . 1 . 2]" 1
1555 1 62 ASP HA 1 62 ASP HB2 . . 2.800 2.380 2.233 2.494 . 0 0 "[ . 1 . 2]" 1
1556 1 62 ASP HA 1 62 ASP HB3 . . 2.800 2.618 2.435 2.881 0.081 19 0 "[ . 1 . 2]" 1
1557 1 62 ASP HA 1 63 SER H . . 3.640 3.446 3.262 3.582 . 0 0 "[ . 1 . 2]" 1
1558 1 62 ASP HA 1 67 ILE HA . . 3.020 3.081 3.070 3.091 0.071 9 0 "[ . 1 . 2]" 1
1559 1 62 ASP HA 1 67 ILE HB . . 4.230 4.214 4.147 4.278 0.048 11 0 "[ . 1 . 2]" 1
1560 1 62 ASP HA 1 67 ILE MD . . 6.530 3.851 3.651 4.041 . 0 0 "[ . 1 . 2]" 1
1561 1 62 ASP HA 1 67 ILE HG12 . . 5.380 4.000 3.790 4.259 . 0 0 "[ . 1 . 2]" 1
1562 1 62 ASP HA 1 67 ILE QG . . 4.940 3.847 3.680 4.040 . 0 0 "[ . 1 . 2]" 1
1563 1 62 ASP HA 1 67 ILE HG13 . . 5.380 5.009 4.984 5.022 . 0 0 "[ . 1 . 2]" 1
1564 1 62 ASP HA 1 67 ILE MG . . 6.530 1.789 1.727 1.865 . 0 0 "[ . 1 . 2]" 1
1565 1 62 ASP HB2 1 67 ILE MD . . 6.530 3.870 3.172 5.017 . 0 0 "[ . 1 . 2]" 1
1566 1 62 ASP HB3 1 67 ILE MD . . 6.530 5.103 4.682 5.320 . 0 0 "[ . 1 . 2]" 1
1567 1 63 SER H 1 63 SER QB . . 3.920 2.968 2.564 3.474 . 0 0 "[ . 1 . 2]" 1
1568 1 63 SER H 1 64 PRO QD . . 5.790 4.587 4.378 4.783 . 0 0 "[ . 1 . 2]" 1
1569 1 63 SER H 1 67 ILE H . . 4.480 4.088 3.591 4.453 . 0 0 "[ . 1 . 2]" 1
1570 1 63 SER HA 1 64 PRO QD . . 3.800 2.451 2.054 3.087 . 0 0 "[ . 1 . 2]" 1
1571 1 63 SER HA 1 65 SER H . . 4.380 4.203 3.964 4.296 . 0 0 "[ . 1 . 2]" 1
1572 1 63 SER QB 1 64 PRO QD . . 3.840 2.202 1.894 2.564 . 0 0 "[ . 1 . 2]" 1
1573 1 63 SER QB 1 65 SER QB . . 5.310 3.812 3.515 3.997 . 0 0 "[ . 1 . 2]" 1
1574 1 63 SER HB2 1 64 PRO HD2 . . 4.320 3.393 2.496 3.832 . 0 0 "[ . 1 . 2]" 1
1575 1 63 SER HB2 1 64 PRO HD3 . . 4.320 3.969 3.126 4.041 . 0 0 "[ . 1 . 2]" 1
1576 1 63 SER HB2 1 65 SER HB2 . . 6.630 4.470 4.043 5.589 . 0 0 "[ . 1 . 2]" 1
1577 1 63 SER HB2 1 65 SER HB3 . . 6.630 4.710 4.258 5.823 . 0 0 "[ . 1 . 2]" 1
1578 1 63 SER HB3 1 64 PRO HD2 . . 4.320 2.452 1.965 4.015 . 0 0 "[ . 1 . 2]" 1
1579 1 63 SER HB3 1 64 PRO HD3 . . 4.320 2.944 2.638 4.003 . 0 0 "[ . 1 . 2]" 1
1580 1 63 SER HB3 1 65 SER HB2 . . 6.630 5.434 4.292 5.719 . 0 0 "[ . 1 . 2]" 1
1581 1 63 SER HB3 1 65 SER HB3 . . 6.630 5.216 4.205 5.851 . 0 0 "[ . 1 . 2]" 1
1582 1 64 PRO HA 1 67 ILE H . . 4.720 4.360 3.634 4.657 . 0 0 "[ . 1 . 2]" 1
1583 1 64 PRO HA 1 67 ILE HB . . 5.410 5.373 4.885 5.465 0.055 10 0 "[ . 1 . 2]" 1
1584 1 64 PRO HA 1 67 ILE MD . . 6.530 1.997 1.931 2.100 . 0 0 "[ . 1 . 2]" 1
1585 1 64 PRO HA 1 67 ILE QG . . 6.380 2.822 2.153 3.025 . 0 0 "[ . 1 . 2]" 1
1586 1 64 PRO HA 1 67 ILE MG . . 6.530 4.144 3.605 4.358 . 0 0 "[ . 1 . 2]" 1
1587 1 64 PRO HA 1 68 VAL QG . . 6.480 3.973 3.818 4.092 . 0 0 "[ . 1 . 2]" 1
1588 1 64 PRO QB 1 65 SER H . . 3.840 3.119 2.908 3.473 . 0 0 "[ . 1 . 2]" 1
1589 1 64 PRO HB2 1 65 SER H . . 4.110 3.258 2.978 3.776 . 0 0 "[ . 1 . 2]" 1
1590 1 64 PRO HB3 1 65 SER H . . 4.110 4.075 4.054 4.083 . 0 0 "[ . 1 . 2]" 1
1591 1 64 PRO QD 1 65 SER H . . 3.490 2.832 2.120 2.958 . 0 0 "[ . 1 . 2]" 1
1592 1 64 PRO HD2 1 65 SER H . . 4.040 2.915 2.139 3.060 . 0 0 "[ . 1 . 2]" 1
1593 1 64 PRO HD3 1 65 SER H . . 4.040 3.869 3.462 3.936 . 0 0 "[ . 1 . 2]" 1
1594 1 65 SER H 1 65 SER HB2 . . 3.420 3.336 2.407 3.392 . 0 0 "[ . 1 . 2]" 1
1595 1 65 SER H 1 65 SER QB . . 3.030 2.676 2.359 2.717 . 0 0 "[ . 1 . 2]" 1
1596 1 65 SER H 1 65 SER HB3 . . 3.420 2.856 2.803 3.386 . 0 0 "[ . 1 . 2]" 1
1597 1 65 SER H 1 66 GLY H . . 2.710 2.499 2.242 2.681 . 0 0 "[ . 1 . 2]" 1
1598 1 65 SER H 1 67 ILE H . . 4.420 3.690 3.556 3.865 . 0 0 "[ . 1 . 2]" 1
1599 1 65 SER H 1 67 ILE QG . . 5.040 3.449 3.181 3.795 . 0 0 "[ . 1 . 2]" 1
1600 1 65 SER H 1 67 ILE MG . . 6.530 5.068 4.771 5.207 . 0 0 "[ . 1 . 2]" 1
1601 1 65 SER H 1 68 VAL QG . . 8.090 4.085 3.832 4.677 . 0 0 "[ . 1 . 2]" 1
1602 1 65 SER HA 1 65 SER HB2 . . 2.490 2.534 2.470 2.600 0.110 1 0 "[ . 1 . 2]" 1
1603 1 65 SER HA 1 65 SER HB3 . . 2.490 2.355 2.283 2.583 0.093 1 0 "[ . 1 . 2]" 1
1604 1 65 SER HA 1 66 GLY QA . . 4.890 4.464 4.450 4.472 . 0 0 "[ . 1 . 2]" 1
1605 1 65 SER HA 1 68 VAL H . . 3.330 3.245 3.095 3.327 . 0 0 "[ . 1 . 2]" 1
1606 1 65 SER HA 1 68 VAL HB . . 3.020 2.979 2.858 3.073 0.053 6 0 "[ . 1 . 2]" 1
1607 1 65 SER HA 1 68 VAL MG1 . . 6.530 4.367 4.172 4.499 . 0 0 "[ . 1 . 2]" 1
1608 1 65 SER HA 1 68 VAL MG2 . . 6.530 2.571 2.183 3.540 . 0 0 "[ . 1 . 2]" 1
1609 1 65 SER HA 1 69 ASN QB . . 5.350 4.384 4.300 4.423 . 0 0 "[ . 1 . 2]" 1
1610 1 65 SER QB 1 66 GLY H . . 3.620 3.138 2.615 3.246 . 0 0 "[ . 1 . 2]" 1
1611 1 65 SER QB 1 68 VAL HB . . 5.260 4.462 4.414 4.491 . 0 0 "[ . 1 . 2]" 1
1612 1 65 SER O 1 69 ASN H . . 2.300 1.932 1.772 2.144 . 0 0 "[ . 1 . 2]" 1
1613 1 66 GLY H 1 67 ILE H . . 3.520 2.514 2.350 2.740 . 0 0 "[ . 1 . 2]" 1
1614 1 66 GLY H 1 67 ILE MD . . 6.530 4.939 4.769 5.296 . 0 0 "[ . 1 . 2]" 1
1615 1 66 GLY H 1 67 ILE MG . . 6.310 4.602 4.322 4.879 . 0 0 "[ . 1 . 2]" 1
1616 1 66 GLY H 1 68 VAL H . . 4.070 4.005 3.999 4.019 . 0 0 "[ . 1 . 2]" 1
1617 1 66 GLY H 1 68 VAL QG . . 8.090 4.495 4.260 5.086 . 0 0 "[ . 1 . 2]" 1
1618 1 66 GLY H 1 69 ASN H . . 5.220 4.278 4.215 4.368 . 0 0 "[ . 1 . 2]" 1
1619 1 66 GLY H 1 69 ASN QB . . 4.490 3.783 3.739 3.844 . 0 0 "[ . 1 . 2]" 1
1620 1 66 GLY QA 1 69 ASN QB . . 3.470 1.928 1.858 2.006 . 0 0 "[ . 1 . 2]" 1
1621 1 66 GLY HA2 1 69 ASN HB2 . . 4.010 3.522 3.388 3.727 . 0 0 "[ . 1 . 2]" 1
1622 1 66 GLY HA2 1 69 ASN HB3 . . 4.010 4.066 4.038 4.080 0.070 9 0 "[ . 1 . 2]" 1
1623 1 66 GLY HA3 1 69 ASN HB2 . . 4.010 2.009 1.923 2.120 . 0 0 "[ . 1 . 2]" 1
1624 1 66 GLY HA3 1 69 ASN HB3 . . 4.010 2.569 2.530 2.600 . 0 0 "[ . 1 . 2]" 1
1625 1 67 ILE H 1 67 ILE MD . . 4.640 3.452 3.242 3.619 . 0 0 "[ . 1 . 2]" 1
1626 1 67 ILE H 1 67 ILE QG . . 5.010 1.915 1.834 2.017 . 0 0 "[ . 1 . 2]" 1
1627 1 67 ILE H 1 67 ILE MG . . 4.260 2.610 2.437 2.783 . 0 0 "[ . 1 . 2]" 1
1628 1 67 ILE H 1 68 VAL H . . 3.110 2.766 2.606 2.895 . 0 0 "[ . 1 . 2]" 1
1629 1 67 ILE H 1 68 VAL QG . . 8.090 3.801 3.608 4.005 . 0 0 "[ . 1 . 2]" 1
1630 1 67 ILE HA 1 67 ILE QG . . 3.910 3.319 3.249 3.363 . 0 0 "[ . 1 . 2]" 1
1631 1 67 ILE HA 1 68 VAL H . . 3.450 3.395 3.344 3.418 . 0 0 "[ . 1 . 2]" 1
1632 1 67 ILE HA 1 68 VAL HA . . 5.500 4.657 4.562 4.792 . 0 0 "[ . 1 . 2]" 1
1633 1 67 ILE HA 1 68 VAL QG . . 8.090 4.457 4.410 4.543 . 0 0 "[ . 1 . 2]" 1
1634 1 67 ILE HA 1 69 ASN H . . 3.760 3.752 3.747 3.759 . 0 0 "[ . 1 . 2]" 1
1635 1 67 ILE HA 1 70 THR H . . 3.450 2.658 2.459 2.977 . 0 0 "[ . 1 . 2]" 1
1636 1 67 ILE HA 1 70 THR HB . . 3.020 2.833 2.429 3.059 0.039 19 0 "[ . 1 . 2]" 1
1637 1 67 ILE HA 1 71 VAL H . . 5.470 4.262 4.019 4.619 . 0 0 "[ . 1 . 2]" 1
1638 1 67 ILE HA 1 71 VAL QG . . 8.090 5.232 4.539 5.648 . 0 0 "[ . 1 . 2]" 1
1639 1 67 ILE HB 1 68 VAL H . . 3.760 3.322 3.190 3.536 . 0 0 "[ . 1 . 2]" 1
1640 1 67 ILE HB 1 68 VAL HA . . 3.980 4.025 3.959 4.048 0.068 11 0 "[ . 1 . 2]" 1
1641 1 67 ILE HB 1 68 VAL MG2 . . 6.530 3.532 3.441 3.654 . 0 0 "[ . 1 . 2]" 1
1642 1 67 ILE HB 1 71 VAL QG . . 8.090 4.983 4.402 5.351 . 0 0 "[ . 1 . 2]" 1
1643 1 67 ILE MD 1 68 VAL H . . 5.410 3.909 3.756 4.072 . 0 0 "[ . 1 . 2]" 1
1644 1 67 ILE MD 1 68 VAL HA . . 6.530 5.173 4.947 5.404 . 0 0 "[ . 1 . 2]" 1
1645 1 67 ILE MD 1 68 VAL MG1 . . 7.560 5.185 5.029 5.247 . 0 0 "[ . 1 . 2]" 1
1646 1 67 ILE MD 1 68 VAL QG . . 7.330 3.194 3.091 3.269 . 0 0 "[ . 1 . 2]" 1
1647 1 67 ILE MD 1 68 VAL MG2 . . 7.560 3.224 3.119 3.303 . 0 0 "[ . 1 . 2]" 1
1648 1 67 ILE QG 1 68 VAL H . . 4.050 2.117 1.949 2.313 . 0 0 "[ . 1 . 2]" 1
1649 1 67 ILE QG 1 68 VAL HA . . 4.610 3.686 3.627 3.799 . 0 0 "[ . 1 . 2]" 1
1650 1 67 ILE QG 1 68 VAL HB . . 4.730 4.008 3.952 4.058 . 0 0 "[ . 1 . 2]" 1
1651 1 67 ILE QG 1 68 VAL QG . . 6.780 2.053 1.961 2.130 . 0 0 "[ . 1 . 2]" 1
1652 1 67 ILE QG 1 70 THR HB . . 6.380 5.367 5.089 5.661 . 0 0 "[ . 1 . 2]" 1
1653 1 67 ILE HG12 1 68 VAL MG1 . . 8.000 5.355 5.094 5.587 . 0 0 "[ . 1 . 2]" 1
1654 1 67 ILE HG12 1 68 VAL MG2 . . 8.000 2.825 2.526 3.144 . 0 0 "[ . 1 . 2]" 1
1655 1 67 ILE HG13 1 68 VAL MG1 . . 8.000 4.388 4.286 4.523 . 0 0 "[ . 1 . 2]" 1
1656 1 67 ILE HG13 1 68 VAL MG2 . . 8.000 2.119 1.983 2.217 . 0 0 "[ . 1 . 2]" 1
1657 1 67 ILE MG 1 68 VAL H . . 5.130 4.021 3.941 4.109 . 0 0 "[ . 1 . 2]" 1
1658 1 67 ILE MG 1 68 VAL HA . . 6.530 5.309 5.229 5.394 . 0 0 "[ . 1 . 2]" 1
1659 1 67 ILE MG 1 68 VAL MG2 . . 7.560 4.288 4.229 4.361 . 0 0 "[ . 1 . 2]" 1
1660 1 67 ILE MG 1 70 THR H . . 6.090 4.542 4.290 4.860 . 0 0 "[ . 1 . 2]" 1
1661 1 67 ILE MG 1 70 THR HB . . 6.530 4.081 3.731 4.504 . 0 0 "[ . 1 . 2]" 1
1662 1 67 ILE MG 1 70 THR MG . . 7.560 4.374 4.030 4.812 . 0 0 "[ . 1 . 2]" 1
1663 1 67 ILE MG 1 71 VAL QG . . 9.120 5.496 5.022 5.721 . 0 0 "[ . 1 . 2]" 1
1664 1 68 VAL H 1 68 VAL HB . . 3.080 2.643 2.498 2.783 . 0 0 "[ . 1 . 2]" 1
1665 1 68 VAL H 1 68 VAL QG . . 3.990 1.901 1.799 2.203 . 0 0 "[ . 1 . 2]" 1
1666 1 68 VAL H 1 69 ASN H . . 3.300 2.085 1.913 2.179 . 0 0 "[ . 1 . 2]" 1
1667 1 68 VAL H 1 69 ASN HA . . 5.100 4.944 4.795 4.996 . 0 0 "[ . 1 . 2]" 1
1668 1 68 VAL H 1 69 ASN QB . . 4.640 3.708 3.539 3.926 . 0 0 "[ . 1 . 2]" 1
1669 1 68 VAL HA 1 70 THR H . . 4.760 4.067 3.796 4.306 . 0 0 "[ . 1 . 2]" 1
1670 1 68 VAL HA 1 71 VAL H . . 3.520 3.402 3.223 3.483 . 0 0 "[ . 1 . 2]" 1
1671 1 68 VAL HA 1 71 VAL HB . . 3.020 2.714 2.502 3.049 0.029 17 0 "[ . 1 . 2]" 1
1672 1 68 VAL HA 1 71 VAL MG1 . . 6.530 3.703 3.240 4.359 . 0 0 "[ . 1 . 2]" 1
1673 1 68 VAL HA 1 71 VAL MG2 . . 6.530 3.643 2.717 4.139 . 0 0 "[ . 1 . 2]" 1
1674 1 68 VAL HA 1 72 LYS H . . 4.260 4.194 4.166 4.208 . 0 0 "[ . 1 . 2]" 1
1675 1 68 VAL HA 1 83 PHE QE . . 7.620 6.394 6.174 6.525 . 0 0 "[ . 1 . 2]" 1
1676 1 68 VAL HA 1 83 PHE HZ . . 5.500 5.572 5.427 5.605 0.105 19 0 "[ . 1 . 2]" 1
1677 1 68 VAL HB 1 69 ASN H . . 3.240 2.765 2.524 3.015 . 0 0 "[ . 1 . 2]" 1
1678 1 68 VAL HB 1 69 ASN QB . . 6.380 4.161 3.923 4.435 . 0 0 "[ . 1 . 2]" 1
1679 1 68 VAL QG 1 69 ASN H . . 5.520 3.187 3.083 3.417 . 0 0 "[ . 1 . 2]" 1
1680 1 68 VAL QG 1 69 ASN HA . . 8.090 4.440 4.306 4.586 . 0 0 "[ . 1 . 2]" 1
1681 1 68 VAL QG 1 69 ASN QB . . 8.960 4.313 4.174 4.573 . 0 0 "[ . 1 . 2]" 1
1682 1 68 VAL QG 1 69 ASN QD . . 7.690 5.224 5.158 5.304 . 0 0 "[ . 1 . 2]" 1
1683 1 68 VAL QG 1 70 THR H . . 7.720 4.564 4.396 4.802 . 0 0 "[ . 1 . 2]" 1
1684 1 68 VAL QG 1 71 VAL H . . 6.260 4.406 4.226 4.497 . 0 0 "[ . 1 . 2]" 1
1685 1 68 VAL QG 1 71 VAL HB . . 8.090 3.455 3.207 3.715 . 0 0 "[ . 1 . 2]" 1
1686 1 68 VAL QG 1 71 VAL QG . . 8.980 3.068 2.702 3.593 . 0 0 "[ . 1 . 2]" 1
1687 1 68 VAL QG 1 72 LYS H . . 7.560 4.270 4.119 4.476 . 0 0 "[ . 1 . 2]" 1
1688 1 68 VAL QG 1 72 LYS QB . . 8.960 4.342 4.151 4.520 . 0 0 "[ . 1 . 2]" 1
1689 1 68 VAL QG 1 72 LYS QE . . 8.960 2.671 1.859 3.645 . 0 0 "[ . 1 . 2]" 1
1690 1 68 VAL QG 1 72 LYS QG . . 8.040 4.789 4.468 5.089 . 0 0 "[ . 1 . 2]" 1
1691 1 68 VAL QG 1 83 PHE QD . . 10.210 5.398 5.267 5.629 . 0 0 "[ . 1 . 2]" 1
1692 1 68 VAL QG 1 83 PHE HZ . . 8.090 3.414 2.749 3.912 . 0 0 "[ . 1 . 2]" 1
1693 1 68 VAL MG1 1 69 ASN HD21 . . 9.650 6.691 6.292 7.010 . 0 0 "[ . 1 . 2]" 1
1694 1 68 VAL MG1 1 69 ASN HD22 . . 9.650 6.901 6.599 7.155 . 0 0 "[ . 1 . 2]" 1
1695 1 68 VAL MG1 1 71 VAL MG1 . . 10.680 3.297 2.772 4.098 . 0 0 "[ . 1 . 2]" 1
1696 1 68 VAL MG1 1 71 VAL MG2 . . 10.680 4.210 3.622 4.636 . 0 0 "[ . 1 . 2]" 1
1697 1 68 VAL MG1 1 72 LYS HG2 . . 9.650 5.326 4.902 5.692 . 0 0 "[ . 1 . 2]" 1
1698 1 68 VAL MG1 1 72 LYS HG3 . . 9.650 5.743 5.411 6.105 . 0 0 "[ . 1 . 2]" 1
1699 1 68 VAL MG1 1 83 PHE QE . . 8.650 4.106 3.778 4.384 . 0 0 "[ . 1 . 2]" 1
1700 1 68 VAL MG2 1 69 ASN HD21 . . 9.650 6.163 5.914 6.541 . 0 0 "[ . 1 . 2]" 1
1701 1 68 VAL MG2 1 69 ASN HD22 . . 9.650 6.850 6.478 7.262 . 0 0 "[ . 1 . 2]" 1
1702 1 68 VAL MG2 1 71 VAL MG1 . . 10.680 4.995 4.579 5.702 . 0 0 "[ . 1 . 2]" 1
1703 1 68 VAL MG2 1 71 VAL MG2 . . 10.680 4.987 4.310 5.458 . 0 0 "[ . 1 . 2]" 1
1704 1 68 VAL MG2 1 72 LYS HG2 . . 9.650 7.250 6.971 7.585 . 0 0 "[ . 1 . 2]" 1
1705 1 68 VAL MG2 1 72 LYS HG3 . . 9.650 7.866 7.624 8.130 . 0 0 "[ . 1 . 2]" 1
1706 1 68 VAL MG2 1 83 PHE QE . . 8.650 6.157 5.679 6.496 . 0 0 "[ . 1 . 2]" 1
1707 1 68 VAL O 1 72 LYS H . . 2.300 2.033 1.858 2.321 0.021 9 0 "[ . 1 . 2]" 1
1708 1 69 ASN H 1 69 ASN QB . . 3.310 2.042 1.948 2.179 . 0 0 "[ . 1 . 2]" 1
1709 1 69 ASN H 1 70 THR H . . 2.930 2.645 2.513 2.748 . 0 0 "[ . 1 . 2]" 1
1710 1 69 ASN H 1 71 VAL H . . 5.440 4.000 3.808 4.175 . 0 0 "[ . 1 . 2]" 1
1711 1 69 ASN H 1 72 LYS H . . 4.350 4.283 4.264 4.299 . 0 0 "[ . 1 . 2]" 1
1712 1 69 ASN HA 1 69 ASN HB2 . . 2.620 2.608 2.555 2.662 0.042 18 0 "[ . 1 . 2]" 1
1713 1 69 ASN HA 1 69 ASN QB . . 2.380 2.331 2.321 2.340 . 0 0 "[ . 1 . 2]" 1
1714 1 69 ASN HA 1 69 ASN HB3 . . 2.620 2.631 2.557 2.687 0.067 6 0 "[ . 1 . 2]" 1
1715 1 69 ASN HA 1 72 LYS H . . 3.580 2.944 2.825 3.064 . 0 0 "[ . 1 . 2]" 1
1716 1 69 ASN HA 1 72 LYS HA . . 4.540 4.604 4.591 4.615 0.075 2 0 "[ . 1 . 2]" 1
1717 1 69 ASN HA 1 72 LYS QB . . 3.830 1.838 1.818 1.881 . 0 0 "[ . 1 . 2]" 1
1718 1 69 ASN HA 1 72 LYS QD . . 4.550 3.556 3.504 3.604 . 0 0 "[ . 1 . 2]" 1
1719 1 69 ASN HA 1 72 LYS QE . . 5.110 3.401 2.554 4.344 . 0 0 "[ . 1 . 2]" 1
1720 1 69 ASN HA 1 72 LYS HG2 . . 5.500 3.942 3.779 4.125 . 0 0 "[ . 1 . 2]" 1
1721 1 69 ASN HA 1 72 LYS QG . . 4.850 3.763 3.628 3.920 . 0 0 "[ . 1 . 2]" 1
1722 1 69 ASN HA 1 72 LYS HG3 . . 5.500 4.768 4.681 4.896 . 0 0 "[ . 1 . 2]" 1
1723 1 69 ASN HA 1 73 GLN H . . 4.630 4.518 4.377 4.561 . 0 0 "[ . 1 . 2]" 1
1724 1 69 ASN QB 1 70 THR H . . 3.680 2.856 2.694 3.049 . 0 0 "[ . 1 . 2]" 1
1725 1 69 ASN QB 1 70 THR HA . . 4.180 3.592 3.446 3.713 . 0 0 "[ . 1 . 2]" 1
1726 1 69 ASN QB 1 72 LYS QB . . 6.850 3.668 3.604 3.735 . 0 0 "[ . 1 . 2]" 1
1727 1 69 ASN QB 1 72 LYS QD . . 7.250 5.177 5.136 5.214 . 0 0 "[ . 1 . 2]" 1
1728 1 69 ASN QB 1 73 GLN QG . . 5.680 4.030 3.824 4.091 . 0 0 "[ . 1 . 2]" 1
1729 1 69 ASN HB2 1 73 GLN HG2 . . 7.250 6.921 5.711 7.087 . 0 0 "[ . 1 . 2]" 1
1730 1 69 ASN HB2 1 73 GLN HG3 . . 7.250 5.692 5.578 6.246 . 0 0 "[ . 1 . 2]" 1
1731 1 69 ASN HB3 1 70 THR HA . . 4.070 3.704 3.509 3.881 . 0 0 "[ . 1 . 2]" 1
1732 1 69 ASN HB3 1 73 GLN HG2 . . 7.250 5.514 4.347 5.721 . 0 0 "[ . 1 . 2]" 1
1733 1 69 ASN HB3 1 73 GLN HG3 . . 7.250 4.330 4.236 4.604 . 0 0 "[ . 1 . 2]" 1
1734 1 70 THR H 1 70 THR HB . . 3.020 2.425 2.297 2.545 . 0 0 "[ . 1 . 2]" 1
1735 1 70 THR H 1 70 THR MG . . 4.670 3.731 3.685 3.762 . 0 0 "[ . 1 . 2]" 1
1736 1 70 THR H 1 71 VAL H . . 3.330 2.467 2.324 2.572 . 0 0 "[ . 1 . 2]" 1
1737 1 70 THR H 1 71 VAL HB . . 4.540 4.433 4.251 4.468 . 0 0 "[ . 1 . 2]" 1
1738 1 70 THR H 1 72 LYS H . . 4.380 3.771 3.580 3.921 . 0 0 "[ . 1 . 2]" 1
1739 1 70 THR H 1 72 LYS QB . . 5.480 4.518 4.415 4.661 . 0 0 "[ . 1 . 2]" 1
1740 1 70 THR HA 1 70 THR HB . . 3.020 3.044 3.026 3.055 0.035 16 0 "[ . 1 . 2]" 1
1741 1 70 THR HA 1 71 VAL H . . 3.480 3.441 3.428 3.454 . 0 0 "[ . 1 . 2]" 1
1742 1 70 THR HA 1 73 GLN QB . . 4.080 2.932 2.564 3.244 . 0 0 "[ . 1 . 2]" 1
1743 1 70 THR HA 1 73 GLN HG2 . . 5.500 4.983 3.972 5.266 . 0 0 "[ . 1 . 2]" 1
1744 1 70 THR HA 1 73 GLN QG . . 4.710 3.638 3.294 3.826 . 0 0 "[ . 1 . 2]" 1
1745 1 70 THR HA 1 73 GLN HG3 . . 5.500 3.746 3.406 3.937 . 0 0 "[ . 1 . 2]" 1
1746 1 70 THR HB 1 71 VAL H . . 3.550 2.581 2.473 2.748 . 0 0 "[ . 1 . 2]" 1
1747 1 70 THR HB 1 71 VAL HA . . 5.280 4.449 4.316 4.610 . 0 0 "[ . 1 . 2]" 1
1748 1 70 THR HB 1 71 VAL HB . . 5.500 4.596 4.371 5.063 . 0 0 "[ . 1 . 2]" 1
1749 1 70 THR HB 1 71 VAL MG1 . . 6.530 5.546 5.486 5.577 . 0 0 "[ . 1 . 2]" 1
1750 1 70 THR HB 1 71 VAL MG2 . . 6.530 3.900 3.223 4.469 . 0 0 "[ . 1 . 2]" 1
1751 1 70 THR MG 1 71 VAL H . . 6.530 3.583 3.357 3.798 . 0 0 "[ . 1 . 2]" 1
1752 1 70 THR MG 1 71 VAL QG . . 9.120 3.883 3.385 4.178 . 0 0 "[ . 1 . 2]" 1
1753 1 70 THR MG 1 73 GLN QB . . 7.400 3.852 3.569 4.065 . 0 0 "[ . 1 . 2]" 1
1754 1 70 THR MG 1 73 GLN QG . . 7.400 5.141 4.673 5.362 . 0 0 "[ . 1 . 2]" 1
1755 1 70 THR MG 1 74 TRP H . . 6.530 4.197 3.933 4.416 . 0 0 "[ . 1 . 2]" 1
1756 1 70 THR MG 1 74 TRP QB . . 7.400 3.701 3.404 4.036 . 0 0 "[ . 1 . 2]" 1
1757 1 70 THR O 1 74 TRP H . . 2.300 2.039 1.851 2.246 . 0 0 "[ . 1 . 2]" 1
1758 1 71 VAL H 1 71 VAL HB . . 3.210 2.309 2.184 2.507 . 0 0 "[ . 1 . 2]" 1
1759 1 71 VAL H 1 71 VAL MG1 . . 4.360 3.564 3.443 3.651 . 0 0 "[ . 1 . 2]" 1
1760 1 71 VAL H 1 71 VAL QG . . 3.670 2.640 1.946 2.964 . 0 0 "[ . 1 . 2]" 1
1761 1 71 VAL H 1 71 VAL MG2 . . 4.360 2.758 1.954 3.189 . 0 0 "[ . 1 . 2]" 1
1762 1 71 VAL H 1 72 LYS H . . 2.830 2.481 2.329 2.579 . 0 0 "[ . 1 . 2]" 1
1763 1 71 VAL H 1 72 LYS QB . . 5.040 4.222 4.186 4.257 . 0 0 "[ . 1 . 2]" 1
1764 1 71 VAL HA 1 73 GLN H . . 4.230 3.652 3.533 3.727 . 0 0 "[ . 1 . 2]" 1
1765 1 71 VAL HA 1 74 TRP H . . 3.860 3.215 3.019 3.362 . 0 0 "[ . 1 . 2]" 1
1766 1 71 VAL HB 1 72 LYS H . . 3.520 2.810 2.396 3.043 . 0 0 "[ . 1 . 2]" 1
1767 1 71 VAL HB 1 72 LYS QG . . 6.380 5.591 5.087 5.809 . 0 0 "[ . 1 . 2]" 1
1768 1 71 VAL QG 1 72 LYS H . . 4.320 2.721 2.444 3.132 . 0 0 "[ . 1 . 2]" 1
1769 1 71 VAL QG 1 72 LYS HA . . 8.090 3.048 2.824 3.395 . 0 0 "[ . 1 . 2]" 1
1770 1 71 VAL QG 1 72 LYS QB . . 8.960 3.719 3.337 4.232 . 0 0 "[ . 1 . 2]" 1
1771 1 71 VAL QG 1 72 LYS QD . . 8.040 2.292 1.944 3.062 . 0 0 "[ . 1 . 2]" 1
1772 1 71 VAL QG 1 72 LYS QG . . 8.960 3.936 3.679 4.436 . 0 0 "[ . 1 . 2]" 1
1773 1 71 VAL QG 1 73 GLN H . . 5.540 4.002 3.906 4.136 . 0 0 "[ . 1 . 2]" 1
1774 1 71 VAL QG 1 73 GLN QB . . 8.960 5.233 5.129 5.305 . 0 0 "[ . 1 . 2]" 1
1775 1 71 VAL QG 1 74 TRP QB . . 7.240 3.330 3.129 3.646 . 0 0 "[ . 1 . 2]" 1
1776 1 71 VAL QG 1 74 TRP HE3 . . 8.090 3.877 3.583 4.292 . 0 0 "[ . 1 . 2]" 1
1777 1 71 VAL QG 1 74 TRP HZ3 . . 8.090 5.190 4.838 5.541 . 0 0 "[ . 1 . 2]" 1
1778 1 71 VAL QG 1 75 ARG H . . 8.090 3.166 2.757 3.513 . 0 0 "[ . 1 . 2]" 1
1779 1 71 VAL QG 1 75 ARG HA . . 8.090 4.415 4.123 4.732 . 0 0 "[ . 1 . 2]" 1
1780 1 71 VAL QG 1 75 ARG QD . . 8.960 2.302 1.959 3.168 . 0 0 "[ . 1 . 2]" 1
1781 1 71 VAL MG1 1 72 LYS H . . 4.700 2.805 2.469 3.400 . 0 0 "[ . 1 . 2]" 1
1782 1 71 VAL MG1 1 72 LYS HD2 . . 9.650 3.031 2.669 3.812 . 0 0 "[ . 1 . 2]" 1
1783 1 71 VAL MG1 1 72 LYS HD3 . . 9.650 2.408 2.001 3.321 . 0 0 "[ . 1 . 2]" 1
1784 1 71 VAL MG1 1 73 GLN H . . 6.000 4.267 4.113 4.475 . 0 0 "[ . 1 . 2]" 1
1785 1 71 VAL MG1 1 74 TRP HB2 . . 8.280 5.544 4.842 5.999 . 0 0 "[ . 1 . 2]" 1
1786 1 71 VAL MG1 1 74 TRP HB3 . . 8.280 4.387 3.619 5.058 . 0 0 "[ . 1 . 2]" 1
1787 1 71 VAL MG1 1 83 PHE QE . . 8.650 3.459 2.563 4.507 . 0 0 "[ . 1 . 2]" 1
1788 1 71 VAL MG2 1 72 LYS H . . 4.700 3.863 3.576 3.915 . 0 0 "[ . 1 . 2]" 1
1789 1 71 VAL MG2 1 72 LYS HD2 . . 9.650 5.492 5.198 5.875 . 0 0 "[ . 1 . 2]" 1
1790 1 71 VAL MG2 1 72 LYS HD3 . . 9.650 4.688 4.537 4.892 . 0 0 "[ . 1 . 2]" 1
1791 1 71 VAL MG2 1 73 GLN H . . 6.000 4.846 4.822 4.874 . 0 0 "[ . 1 . 2]" 1
1792 1 71 VAL MG2 1 74 TRP HB2 . . 8.280 4.535 4.311 4.862 . 0 0 "[ . 1 . 2]" 1
1793 1 71 VAL MG2 1 74 TRP HB3 . . 8.280 3.699 3.392 4.174 . 0 0 "[ . 1 . 2]" 1
1794 1 71 VAL MG2 1 83 PHE QE . . 8.650 5.419 4.493 6.127 . 0 0 "[ . 1 . 2]" 1
1795 1 71 VAL O 1 75 ARG H . . 2.300 1.760 1.712 1.828 . 0 0 "[ . 1 . 2]" 1
1796 1 72 LYS H 1 72 LYS QE . . 6.380 3.774 3.276 4.465 . 0 0 "[ . 1 . 2]" 1
1797 1 72 LYS H 1 72 LYS HG2 . . 4.760 4.400 4.338 4.457 . 0 0 "[ . 1 . 2]" 1
1798 1 72 LYS H 1 72 LYS QG . . 4.340 3.771 3.722 3.802 . 0 0 "[ . 1 . 2]" 1
1799 1 72 LYS H 1 72 LYS HG3 . . 4.760 4.103 4.048 4.161 . 0 0 "[ . 1 . 2]" 1
1800 1 72 LYS H 1 73 GLN H . . 2.830 2.814 2.783 2.831 0.001 9 0 "[ . 1 . 2]" 1
1801 1 72 LYS HA 1 72 LYS HD2 . . 2.770 2.628 2.611 2.639 . 0 0 "[ . 1 . 2]" 1
1802 1 72 LYS HA 1 72 LYS HD3 . . 2.770 2.430 2.304 2.592 . 0 0 "[ . 1 . 2]" 1
1803 1 72 LYS HA 1 72 LYS HG2 . . 3.240 3.313 3.306 3.319 0.079 4 0 "[ . 1 . 2]" 1
1804 1 72 LYS HA 1 72 LYS QG . . 2.760 1.957 1.944 1.966 . 0 0 "[ . 1 . 2]" 1
1805 1 72 LYS HA 1 72 LYS HG3 . . 3.020 1.971 1.957 1.980 . 0 0 "[ . 1 . 2]" 1
1806 1 72 LYS HA 1 73 GLN H . . 3.050 3.057 3.050 3.067 0.017 19 0 "[ . 1 . 2]" 1
1807 1 72 LYS HA 1 75 ARG H . . 4.450 4.104 3.889 4.309 . 0 0 "[ . 1 . 2]" 1
1808 1 72 LYS HA 1 75 ARG QB . . 3.280 2.742 2.603 2.908 . 0 0 "[ . 1 . 2]" 1
1809 1 72 LYS HA 1 76 ALA H . . 4.170 4.143 4.137 4.149 . 0 0 "[ . 1 . 2]" 1
1810 1 72 LYS HA 1 83 PHE QE . . 7.620 4.554 4.058 5.387 . 0 0 "[ . 1 . 2]" 1
1811 1 72 LYS QB 1 73 GLN H . . 3.830 3.197 3.099 3.317 . 0 0 "[ . 1 . 2]" 1
1812 1 72 LYS QB 1 73 GLN QB . . 7.250 4.395 4.259 4.533 . 0 0 "[ . 1 . 2]" 1
1813 1 72 LYS QB 1 73 GLN QE . . 7.240 3.485 3.151 3.587 . 0 0 "[ . 1 . 2]" 1
1814 1 72 LYS QB 1 83 PHE QE . . 8.500 5.352 5.022 5.743 . 0 0 "[ . 1 . 2]" 1
1815 1 72 LYS QD 1 72 LYS QG . . 2.450 2.004 1.972 2.047 . 0 0 "[ . 1 . 2]" 1
1816 1 72 LYS QD 1 73 GLN H . . 5.730 4.293 4.217 4.428 . 0 0 "[ . 1 . 2]" 1
1817 1 72 LYS QD 1 83 PHE QD . . 7.750 4.219 3.986 4.447 . 0 0 "[ . 1 . 2]" 1
1818 1 72 LYS QD 1 83 PHE QE . . 6.790 2.601 2.174 2.983 . 0 0 "[ . 1 . 2]" 1
1819 1 72 LYS QD 1 83 PHE HZ . . 6.380 3.505 3.119 3.874 . 0 0 "[ . 1 . 2]" 1
1820 1 72 LYS QE 1 83 PHE QD . . 8.500 4.836 3.819 5.881 . 0 0 "[ . 1 . 2]" 1
1821 1 72 LYS QE 1 83 PHE QE . . 8.500 3.647 2.012 4.960 . 0 0 "[ . 1 . 2]" 1
1822 1 72 LYS QG 1 73 GLN H . . 5.480 4.374 4.280 4.479 . 0 0 "[ . 1 . 2]" 1
1823 1 72 LYS QG 1 73 GLN HA . . 6.380 5.065 4.915 5.273 . 0 0 "[ . 1 . 2]" 1
1824 1 72 LYS QG 1 73 GLN QE . . 7.150 5.249 4.195 5.400 . 0 0 "[ . 1 . 2]" 1
1825 1 72 LYS QG 1 83 PHE QE . . 6.750 4.009 3.624 4.364 . 0 0 "[ . 1 . 2]" 1
1826 1 72 LYS QG 1 83 PHE HZ . . 6.380 5.389 4.898 5.761 . 0 0 "[ . 1 . 2]" 1
1827 1 72 LYS HG2 1 76 ALA MB . . 6.530 4.776 4.571 5.055 . 0 0 "[ . 1 . 2]" 1
1828 1 72 LYS HG2 1 83 PHE QD . . 7.620 6.072 5.683 6.321 . 0 0 "[ . 1 . 2]" 1
1829 1 72 LYS HG2 1 83 PHE QE . . 7.500 4.946 4.247 5.545 . 0 0 "[ . 1 . 2]" 1
1830 1 72 LYS HG3 1 76 ALA MB . . 6.530 3.584 3.319 3.914 . 0 0 "[ . 1 . 2]" 1
1831 1 72 LYS HG3 1 83 PHE QD . . 7.620 5.482 5.176 5.905 . 0 0 "[ . 1 . 2]" 1
1832 1 72 LYS HG3 1 83 PHE QE . . 7.500 4.269 3.801 4.588 . 0 0 "[ . 1 . 2]" 1
1833 1 73 GLN H 1 73 GLN HA . . 2.770 2.786 2.780 2.789 0.019 11 0 "[ . 1 . 2]" 1
1834 1 73 GLN H 1 73 GLN QE . . 4.940 3.910 3.760 4.051 . 0 0 "[ . 1 . 2]" 1
1835 1 73 GLN H 1 73 GLN HG2 . . 3.580 3.417 2.707 3.501 . 0 0 "[ . 1 . 2]" 1
1836 1 73 GLN H 1 73 GLN QG . . 3.310 2.487 2.413 2.635 . 0 0 "[ . 1 . 2]" 1
1837 1 73 GLN H 1 73 GLN HG3 . . 3.580 2.624 2.461 3.497 . 0 0 "[ . 1 . 2]" 1
1838 1 73 GLN H 1 74 TRP H . . 2.560 2.275 2.170 2.411 . 0 0 "[ . 1 . 2]" 1
1839 1 73 GLN H 1 76 ALA MB . . 5.040 3.917 3.907 3.928 . 0 0 "[ . 1 . 2]" 1
1840 1 73 GLN HA 1 73 GLN HG2 . . 2.990 2.179 2.075 2.432 . 0 0 "[ . 1 . 2]" 1
1841 1 73 GLN HA 1 73 GLN QG . . 2.760 2.107 2.022 2.303 . 0 0 "[ . 1 . 2]" 1
1842 1 73 GLN HA 1 73 GLN HG3 . . 2.990 2.804 2.780 2.849 . 0 0 "[ . 1 . 2]" 1
1843 1 73 GLN HA 1 75 ARG H . . 5.500 4.869 4.744 4.990 . 0 0 "[ . 1 . 2]" 1
1844 1 73 GLN HA 1 76 ALA H . . 3.360 3.321 3.299 3.334 . 0 0 "[ . 1 . 2]" 1
1845 1 73 GLN HA 1 76 ALA MB . . 6.310 2.200 2.071 2.314 . 0 0 "[ . 1 . 2]" 1
1846 1 73 GLN HA 1 77 ALA H . . 5.000 3.845 3.684 4.036 . 0 0 "[ . 1 . 2]" 1
1847 1 73 GLN HA 1 77 ALA MB . . 6.530 4.030 3.820 4.161 . 0 0 "[ . 1 . 2]" 1
1848 1 73 GLN QB 1 76 ALA MB . . 7.400 4.061 3.902 4.179 . 0 0 "[ . 1 . 2]" 1
1849 1 73 GLN QB 1 77 ALA MB . . 7.400 4.121 3.899 4.320 . 0 0 "[ . 1 . 2]" 1
1850 1 73 GLN QG 1 74 TRP H . . 6.380 4.027 3.954 4.113 . 0 0 "[ . 1 . 2]" 1
1851 1 73 GLN QG 1 77 ALA MB . . 7.400 5.152 4.922 5.309 . 0 0 "[ . 1 . 2]" 1
1852 1 73 GLN HG2 1 76 ALA MB . . 6.530 3.646 3.455 3.851 . 0 0 "[ . 1 . 2]" 1
1853 1 73 GLN HG3 1 76 ALA MB . . 6.530 4.287 4.135 4.629 . 0 0 "[ . 1 . 2]" 1
1854 1 74 TRP H 1 75 ARG H . . 3.670 2.718 2.514 2.890 . 0 0 "[ . 1 . 2]" 1
1855 1 74 TRP H 1 76 ALA H . . 3.860 3.549 3.450 3.635 . 0 0 "[ . 1 . 2]" 1
1856 1 74 TRP H 1 77 ALA H . . 4.540 4.478 4.473 4.482 . 0 0 "[ . 1 . 2]" 1
1857 1 74 TRP HA 1 74 TRP HB2 . . 2.800 2.451 2.420 2.490 . 0 0 "[ . 1 . 2]" 1
1858 1 74 TRP HA 1 74 TRP HB3 . . 2.800 2.842 2.827 2.856 0.056 10 0 "[ . 1 . 2]" 1
1859 1 74 TRP HA 1 74 TRP HD1 . . 2.990 2.818 2.802 2.832 . 0 0 "[ . 1 . 2]" 1
1860 1 74 TRP HA 1 74 TRP HE1 . . 5.500 4.487 4.381 4.661 . 0 0 "[ . 1 . 2]" 1
1861 1 74 TRP HA 1 74 TRP HE3 . . 5.500 4.477 4.346 4.617 . 0 0 "[ . 1 . 2]" 1
1862 1 74 TRP HA 1 77 ALA H . . 3.610 3.534 3.444 3.592 . 0 0 "[ . 1 . 2]" 1
1863 1 74 TRP HA 1 77 ALA MB . . 6.530 2.883 2.567 2.960 . 0 0 "[ . 1 . 2]" 1
1864 1 74 TRP HA 1 78 ASN H . . 3.730 3.601 3.350 3.692 . 0 0 "[ . 1 . 2]" 1
1865 1 74 TRP QB 1 75 ARG H . . 5.010 2.130 2.015 2.319 . 0 0 "[ . 1 . 2]" 1
1866 1 74 TRP HB2 1 77 ALA MB . . 6.530 5.001 4.676 5.122 . 0 0 "[ . 1 . 2]" 1
1867 1 74 TRP HB3 1 77 ALA MB . . 6.530 5.254 4.961 5.300 . 0 0 "[ . 1 . 2]" 1
1868 1 74 TRP HD1 1 77 ALA MB . . 6.530 4.696 4.307 4.888 . 0 0 "[ . 1 . 2]" 1
1869 1 74 TRP HE1 1 78 ASN QB . . 6.190 4.406 4.065 4.688 . 0 0 "[ . 1 . 2]" 1
1870 1 74 TRP HE3 1 75 ARG HA . . 4.140 3.323 3.054 3.495 . 0 0 "[ . 1 . 2]" 1
1871 1 74 TRP HE3 1 80 LYS HD2 . . 5.500 4.639 4.452 4.845 . 0 0 "[ . 1 . 2]" 1
1872 1 74 TRP HE3 1 80 LYS HD3 . . 5.500 3.252 2.940 3.917 . 0 0 "[ . 1 . 2]" 1
1873 1 74 TRP HE3 1 80 LYS HE2 . . 4.880 2.991 2.115 3.564 . 0 0 "[ . 1 . 2]" 1
1874 1 74 TRP HE3 1 80 LYS QE . . 4.560 2.940 2.097 3.440 . 0 0 "[ . 1 . 2]" 1
1875 1 74 TRP HE3 1 80 LYS HE3 . . 4.880 4.380 3.447 4.536 . 0 0 "[ . 1 . 2]" 1
1876 1 74 TRP HZ3 1 75 ARG HA . . 5.070 4.625 4.304 4.712 . 0 0 "[ . 1 . 2]" 1
1877 1 74 TRP HZ3 1 80 LYS HD2 . . 3.980 3.744 3.731 3.758 . 0 0 "[ . 1 . 2]" 1
1878 1 74 TRP HZ3 1 80 LYS HD3 . . 3.980 2.618 2.365 3.097 . 0 0 "[ . 1 . 2]" 1
1879 1 74 TRP HZ3 1 80 LYS HE2 . . 3.360 1.697 1.635 1.817 . 0 0 "[ . 1 . 2]" 1
1880 1 74 TRP HZ3 1 80 LYS QE . . 3.000 1.690 1.630 1.806 . 0 0 "[ . 1 . 2]" 1
1881 1 74 TRP HZ3 1 80 LYS HE3 . . 3.360 3.163 3.146 3.168 . 0 0 "[ . 1 . 2]" 1
1882 1 74 TRP HZ3 1 80 LYS QG . . 6.380 3.250 2.738 4.102 . 0 0 "[ . 1 . 2]" 1
1883 1 75 ARG H 1 76 ALA H . . 3.640 2.771 2.702 2.836 . 0 0 "[ . 1 . 2]" 1
1884 1 75 ARG H 1 76 ALA MB . . 6.310 4.537 4.422 4.652 . 0 0 "[ . 1 . 2]" 1
1885 1 75 ARG HA 1 75 ARG HD2 . . 5.500 4.705 4.213 5.040 . 0 0 "[ . 1 . 2]" 1
1886 1 75 ARG HA 1 75 ARG QD . . 4.970 4.085 3.469 4.369 . 0 0 "[ . 1 . 2]" 1
1887 1 75 ARG HA 1 75 ARG HD3 . . 5.500 4.585 3.579 5.096 . 0 0 "[ . 1 . 2]" 1
1888 1 75 ARG HA 1 75 ARG QG . . 3.840 2.484 2.163 2.674 . 0 0 "[ . 1 . 2]" 1
1889 1 75 ARG HA 1 76 ALA HA . . 5.500 4.425 4.328 4.653 . 0 0 "[ . 1 . 2]" 1
1890 1 75 ARG HA 1 77 ALA MB . . 6.530 5.355 5.308 5.381 . 0 0 "[ . 1 . 2]" 1
1891 1 75 ARG HA 1 78 ASN HB2 . . 3.920 3.924 3.835 3.976 0.056 6 0 "[ . 1 . 2]" 1
1892 1 75 ARG HA 1 78 ASN QB . . 3.650 2.668 2.500 2.914 . 0 0 "[ . 1 . 2]" 1
1893 1 75 ARG HA 1 78 ASN HB3 . . 3.920 2.716 2.534 2.997 . 0 0 "[ . 1 . 2]" 1
1894 1 75 ARG HA 1 80 LYS H . . 4.320 2.563 2.296 3.176 . 0 0 "[ . 1 . 2]" 1
1895 1 75 ARG HA 1 80 LYS HA . . 4.110 4.126 3.956 4.169 0.059 7 0 "[ . 1 . 2]" 1
1896 1 75 ARG HA 1 80 LYS HB2 . . 4.290 2.738 2.133 3.259 . 0 0 "[ . 1 . 2]" 1
1897 1 75 ARG HA 1 80 LYS QB . . 3.980 2.683 2.111 3.159 . 0 0 "[ . 1 . 2]" 1
1898 1 75 ARG HA 1 80 LYS HB3 . . 4.290 3.889 3.359 4.241 . 0 0 "[ . 1 . 2]" 1
1899 1 75 ARG HA 1 80 LYS HD2 . . 4.110 3.829 3.810 3.846 . 0 0 "[ . 1 . 2]" 1
1900 1 75 ARG HA 1 80 LYS QD . . 3.720 3.104 2.996 3.167 . 0 0 "[ . 1 . 2]" 1
1901 1 75 ARG HA 1 80 LYS HD3 . . 4.110 3.283 3.127 3.385 . 0 0 "[ . 1 . 2]" 1
1902 1 75 ARG HA 1 80 LYS HE2 . . 5.500 4.030 2.776 4.495 . 0 0 "[ . 1 . 2]" 1
1903 1 75 ARG HA 1 80 LYS HE3 . . 5.500 4.404 2.742 4.787 . 0 0 "[ . 1 . 2]" 1
1904 1 75 ARG HA 1 80 LYS QG . . 6.380 1.704 1.672 1.755 . 0 0 "[ . 1 . 2]" 1
1905 1 75 ARG QD 1 80 LYS HA . . 6.380 5.495 4.511 5.821 . 0 0 "[ . 1 . 2]" 1
1906 1 75 ARG QG 1 80 LYS QD . . 7.250 3.724 3.316 4.344 . 0 0 "[ . 1 . 2]" 1
1907 1 76 ALA H 1 77 ALA H . . 2.830 1.976 1.840 2.067 . 0 0 "[ . 1 . 2]" 1
1908 1 76 ALA H 1 77 ALA MB . . 5.100 3.770 3.645 3.853 . 0 0 "[ . 1 . 2]" 1
1909 1 76 ALA H 1 78 ASN H . . 4.880 3.460 3.327 3.763 . 0 0 "[ . 1 . 2]" 1
1910 1 76 ALA H 1 78 ASN QB . . 4.640 4.166 4.124 4.188 . 0 0 "[ . 1 . 2]" 1
1911 1 76 ALA HA 1 77 ALA H . . 3.200 3.293 3.285 3.298 0.098 5 0 "[ . 1 . 2]" 1
1912 1 76 ALA HA 1 79 GLY H . . 3.860 3.220 3.119 3.395 . 0 0 "[ . 1 . 2]" 1
1913 1 76 ALA HA 1 80 LYS H . . 3.890 3.785 3.460 3.826 . 0 0 "[ . 1 . 2]" 1
1914 1 76 ALA MB 1 77 ALA HA . . 6.530 3.977 3.917 4.049 . 0 0 "[ . 1 . 2]" 1
1915 1 76 ALA MB 1 78 ASN QB . . 7.400 5.369 5.144 5.436 . 0 0 "[ . 1 . 2]" 1
1916 1 77 ALA H 1 77 ALA HA . . 2.900 2.960 2.950 2.969 0.069 7 0 "[ . 1 . 2]" 1
1917 1 77 ALA H 1 77 ALA MB . . 3.430 2.312 2.224 2.360 . 0 0 "[ . 1 . 2]" 1
1918 1 77 ALA H 1 78 ASN H . . 2.770 2.137 2.023 2.251 . 0 0 "[ . 1 . 2]" 1
1919 1 77 ALA H 1 78 ASN QB . . 6.380 3.668 3.444 3.803 . 0 0 "[ . 1 . 2]" 1
1920 1 77 ALA H 1 79 GLY H . . 2.830 2.829 2.820 2.837 0.007 7 0 "[ . 1 . 2]" 1
1921 1 77 ALA HA 1 78 ASN H . . 3.580 3.394 3.344 3.440 . 0 0 "[ . 1 . 2]" 1
1922 1 77 ALA HA 1 79 GLY H . . 3.450 3.428 3.408 3.437 . 0 0 "[ . 1 . 2]" 1
1923 1 77 ALA MB 1 78 ASN HA . . 6.530 4.059 3.939 4.159 . 0 0 "[ . 1 . 2]" 1
1924 1 77 ALA MB 1 79 GLY H . . 5.160 3.804 3.668 3.912 . 0 0 "[ . 1 . 2]" 1
1925 1 78 ASN H 1 78 ASN HB2 . . 3.450 2.181 2.071 2.298 . 0 0 "[ . 1 . 2]" 1
1926 1 78 ASN H 1 78 ASN QB . . 3.020 2.045 1.931 2.087 . 0 0 "[ . 1 . 2]" 1
1927 1 78 ASN H 1 78 ASN HB3 . . 3.450 2.481 2.310 2.640 . 0 0 "[ . 1 . 2]" 1
1928 1 78 ASN H 1 79 GLY H . . 2.740 2.062 1.980 2.179 . 0 0 "[ . 1 . 2]" 1
1929 1 78 ASN H 1 79 GLY QA . . 6.100 4.104 4.007 4.250 . 0 0 "[ . 1 . 2]" 1
1930 1 78 ASN H 1 80 LYS H . . 3.790 3.754 3.745 3.762 . 0 0 "[ . 1 . 2]" 1
1931 1 78 ASN H 1 80 LYS QG . . 4.800 3.882 3.633 4.005 . 0 0 "[ . 1 . 2]" 1
1932 1 78 ASN HA 1 78 ASN HB2 . . 3.020 2.723 2.648 2.807 . 0 0 "[ . 1 . 2]" 1
1933 1 78 ASN HA 1 78 ASN HB3 . . 3.020 3.023 2.997 3.038 0.018 17 0 "[ . 1 . 2]" 1
1934 1 78 ASN HA 1 79 GLY H . . 3.170 3.184 3.178 3.187 0.017 2 0 "[ . 1 . 2]" 1
1935 1 78 ASN QB 1 79 GLY H . . 3.970 2.857 2.609 3.147 . 0 0 "[ . 1 . 2]" 1
1936 1 78 ASN QB 1 80 LYS H . . 3.830 2.711 2.281 3.030 . 0 0 "[ . 1 . 2]" 1
1937 1 78 ASN QB 1 80 LYS QD . . 7.250 2.266 2.065 2.976 . 0 0 "[ . 1 . 2]" 1
1938 1 78 ASN QB 1 80 LYS QE . . 5.840 3.975 3.304 4.193 . 0 0 "[ . 1 . 2]" 1
1939 1 78 ASN QB 1 80 LYS QG . . 6.150 1.972 1.869 2.041 . 0 0 "[ . 1 . 2]" 1
1940 1 78 ASN HB2 1 79 GLY H . . 4.570 3.663 3.568 3.789 . 0 0 "[ . 1 . 2]" 1
1941 1 78 ASN HB2 1 80 LYS H . . 4.510 4.295 3.984 4.420 . 0 0 "[ . 1 . 2]" 1
1942 1 78 ASN HB2 1 80 LYS HE2 . . 7.070 5.408 4.449 5.653 . 0 0 "[ . 1 . 2]" 1
1943 1 78 ASN HB2 1 80 LYS HE3 . . 7.070 6.216 5.695 6.411 . 0 0 "[ . 1 . 2]" 1
1944 1 78 ASN HB2 1 80 LYS HG2 . . 7.250 3.738 3.522 4.363 . 0 0 "[ . 1 . 2]" 1
1945 1 78 ASN HB2 1 80 LYS HG3 . . 7.250 4.321 3.158 4.659 . 0 0 "[ . 1 . 2]" 1
1946 1 78 ASN HB3 1 79 GLY H . . 4.570 2.986 2.680 3.362 . 0 0 "[ . 1 . 2]" 1
1947 1 78 ASN HB3 1 80 LYS H . . 4.510 2.742 2.295 3.086 . 0 0 "[ . 1 . 2]" 1
1948 1 78 ASN HB3 1 80 LYS HE2 . . 7.070 4.466 3.534 4.812 . 0 0 "[ . 1 . 2]" 1
1949 1 78 ASN HB3 1 80 LYS HE3 . . 7.070 4.969 4.622 5.140 . 0 0 "[ . 1 . 2]" 1
1950 1 78 ASN HB3 1 80 LYS HG2 . . 7.250 2.114 1.963 2.715 . 0 0 "[ . 1 . 2]" 1
1951 1 78 ASN HB3 1 80 LYS HG3 . . 7.250 2.967 1.934 3.316 . 0 0 "[ . 1 . 2]" 1
1952 1 79 GLY H 1 80 LYS H . . 2.520 2.536 2.518 2.543 0.023 4 0 "[ . 1 . 2]" 1
1953 1 79 GLY H 1 80 LYS QG . . 5.480 3.634 3.488 3.860 . 0 0 "[ . 1 . 2]" 1
1954 1 80 LYS H 1 80 LYS HA . . 2.830 2.661 2.575 2.758 . 0 0 "[ . 1 . 2]" 1
1955 1 80 LYS H 1 80 LYS QB . . 3.890 2.867 2.711 3.117 . 0 0 "[ . 1 . 2]" 1
1956 1 80 LYS H 1 80 LYS HG2 . . 3.300 1.921 1.762 2.544 . 0 0 "[ . 1 . 2]" 1
1957 1 80 LYS H 1 80 LYS HG3 . . 3.300 3.091 2.055 3.248 . 0 0 "[ . 1 . 2]" 1
1958 1 80 LYS H 1 81 SER H . . 3.330 3.110 2.826 3.285 . 0 0 "[ . 1 . 2]" 1
1959 1 80 LYS HA 1 80 LYS HB2 . . 2.770 2.852 2.821 2.867 0.097 4 0 "[ . 1 . 2]" 1
1960 1 80 LYS HA 1 80 LYS QB . . 2.520 2.180 2.076 2.268 . 0 0 "[ . 1 . 2]" 1
1961 1 80 LYS HA 1 80 LYS HB3 . . 2.770 2.263 2.137 2.377 . 0 0 "[ . 1 . 2]" 1
1962 1 80 LYS HA 1 80 LYS HD2 . . 3.170 2.265 2.097 2.783 . 0 0 "[ . 1 . 2]" 1
1963 1 80 LYS HA 1 80 LYS QD . . 3.020 2.238 2.084 2.697 . 0 0 "[ . 1 . 2]" 1
1964 1 80 LYS HA 1 80 LYS HD3 . . 3.500 3.608 3.601 3.617 0.117 6 0 "[ . 1 . 2]" 1
1965 1 80 LYS HA 1 80 LYS HE2 . . 5.500 4.545 4.328 4.887 . 0 0 "[ . 1 . 2]" 1
1966 1 80 LYS HA 1 80 LYS QE . . 5.020 3.484 3.203 3.986 . 0 0 "[ . 1 . 2]" 1
1967 1 80 LYS HA 1 80 LYS HE3 . . 5.500 3.622 3.300 4.225 . 0 0 "[ . 1 . 2]" 1
1968 1 80 LYS HA 1 80 LYS HG2 . . 3.000 2.424 1.854 2.610 . 0 0 "[ . 1 . 2]" 1
1969 1 80 LYS HA 1 80 LYS HG3 . . 3.500 3.397 2.904 3.538 0.038 20 0 "[ . 1 . 2]" 1
1970 1 80 LYS HA 1 81 SER H . . 3.330 3.340 3.332 3.348 0.018 3 0 "[ . 1 . 2]" 1
1971 1 80 LYS QB 1 80 LYS QE . . 3.360 2.103 1.937 2.321 . 0 0 "[ . 1 . 2]" 1
1972 1 80 LYS QB 1 81 SER H . . 3.890 2.219 1.810 2.743 . 0 0 "[ . 1 . 2]" 1
1973 1 80 LYS HB2 1 80 LYS HE2 . . 4.450 3.994 3.790 4.132 . 0 0 "[ . 1 . 2]" 1
1974 1 80 LYS HB2 1 80 LYS HE3 . . 4.450 3.392 2.805 3.562 . 0 0 "[ . 1 . 2]" 1
1975 1 80 LYS HB2 1 81 SER H . . 4.230 2.253 1.831 2.818 . 0 0 "[ . 1 . 2]" 1
1976 1 80 LYS HB3 1 80 LYS HE2 . . 4.450 3.323 3.018 3.753 . 0 0 "[ . 1 . 2]" 1
1977 1 80 LYS HB3 1 80 LYS HE3 . . 4.450 2.167 1.977 2.483 . 0 0 "[ . 1 . 2]" 1
1978 1 80 LYS HB3 1 81 SER H . . 4.230 3.347 2.847 3.762 . 0 0 "[ . 1 . 2]" 1
1979 1 80 LYS QD 1 80 LYS QG . . 2.320 1.710 1.612 1.800 . 0 0 "[ . 1 . 2]" 1
1980 1 80 LYS QD 1 81 SER H . . 6.310 4.741 4.568 5.029 . 0 0 "[ . 1 . 2]" 1
1981 1 80 LYS HD2 1 80 LYS HG2 . . 2.800 2.038 1.900 2.162 . 0 0 "[ . 1 . 2]" 1
1982 1 80 LYS HD2 1 80 LYS HG3 . . 2.800 2.671 2.662 2.679 . 0 0 "[ . 1 . 2]" 1
1983 1 80 LYS HD3 1 80 LYS HG2 . . 2.800 2.044 1.919 2.137 . 0 0 "[ . 1 . 2]" 1
1984 1 80 LYS HD3 1 80 LYS HG3 . . 2.800 2.183 1.988 2.346 . 0 0 "[ . 1 . 2]" 1
1985 1 80 LYS QE 1 80 LYS QG . . 3.370 2.258 2.123 2.578 . 0 0 "[ . 1 . 2]" 1
1986 1 80 LYS HE2 1 80 LYS HG2 . . 3.790 3.539 3.508 3.557 . 0 0 "[ . 1 . 2]" 1
1987 1 80 LYS HE2 1 80 LYS HG3 . . 3.790 2.469 2.278 2.911 . 0 0 "[ . 1 . 2]" 1
1988 1 80 LYS HE3 1 80 LYS HG2 . . 3.790 3.532 3.479 3.547 . 0 0 "[ . 1 . 2]" 1
1989 1 80 LYS HE3 1 80 LYS HG3 . . 3.790 2.824 2.580 3.317 . 0 0 "[ . 1 . 2]" 1
1990 1 80 LYS QG 1 81 SER H . . 5.150 3.663 3.455 3.851 . 0 0 "[ . 1 . 2]" 1
1991 1 80 LYS HG2 1 81 SER H . . 5.500 3.986 3.681 4.379 . 0 0 "[ . 1 . 2]" 1
1992 1 80 LYS HG3 1 81 SER H . . 5.500 4.300 4.036 4.641 . 0 0 "[ . 1 . 2]" 1
1993 1 81 SER H 1 81 SER QB . . 3.610 3.259 2.876 3.324 . 0 0 "[ . 1 . 2]" 1
1994 1 81 SER H 1 82 GLY H . . 4.200 4.117 3.952 4.143 . 0 0 "[ . 1 . 2]" 1
1995 1 81 SER H 1 83 PHE H . . 5.500 5.477 5.061 5.543 0.043 5 0 "[ . 1 . 2]" 1
1996 1 81 SER HA 1 81 SER HB2 . . 2.620 2.608 2.370 2.709 0.089 14 0 "[ . 1 . 2]" 1
1997 1 81 SER HA 1 81 SER QB . . 2.350 2.090 2.004 2.164 . 0 0 "[ . 1 . 2]" 1
1998 1 81 SER HA 1 81 SER HB3 . . 2.620 2.216 2.069 2.490 . 0 0 "[ . 1 . 2]" 1
1999 1 81 SER HA 1 82 GLY H . . 2.960 2.449 1.918 2.969 0.009 7 0 "[ . 1 . 2]" 1
2000 1 81 SER HA 1 83 PHE H . . 4.070 4.019 3.813 4.059 . 0 0 "[ . 1 . 2]" 1
2001 1 81 SER QB 1 83 PHE H . . 6.380 3.455 2.412 4.652 . 0 0 "[ . 1 . 2]" 1
2002 1 81 SER HB2 1 82 GLY H . . 3.110 2.196 1.684 3.102 . 0 0 "[ . 1 . 2]" 1
2003 1 81 SER HB3 1 82 GLY H . . 3.110 2.716 1.936 3.118 0.008 12 0 "[ . 1 . 2]" 1
2004 1 82 GLY H 1 83 PHE H . . 3.580 2.623 1.731 3.343 . 0 0 "[ . 1 . 2]" 1
2005 1 82 GLY QA 1 83 PHE H . . 3.100 2.738 2.344 2.863 . 0 0 "[ . 1 . 2]" 1
2006 1 82 GLY QA 1 83 PHE QD . . 8.500 3.956 2.286 5.230 . 0 0 "[ . 1 . 2]" 1
2007 1 82 GLY QA 1 83 PHE QE . . 8.500 5.056 3.025 6.302 . 0 0 "[ . 1 . 2]" 1
2008 1 82 GLY HA2 1 83 PHE H . . 3.550 3.251 2.380 3.485 . 0 0 "[ . 1 . 2]" 1
2009 1 82 GLY HA3 1 83 PHE H . . 3.550 3.071 2.537 3.519 . 0 0 "[ . 1 . 2]" 1
2010 1 83 PHE H 1 83 PHE HB2 . . 3.610 2.982 2.522 3.481 . 0 0 "[ . 1 . 2]" 1
2011 1 83 PHE H 1 83 PHE QB . . 3.420 2.819 2.475 3.138 . 0 0 "[ . 1 . 2]" 1
2012 1 83 PHE H 1 83 PHE HB3 . . 3.610 3.582 3.549 3.598 . 0 0 "[ . 1 . 2]" 1
2013 1 83 PHE H 1 84 LYS H . . 3.980 3.955 3.881 3.973 . 0 0 "[ . 1 . 2]" 1
2014 1 83 PHE HA 1 84 LYS H . . 3.080 2.700 1.962 3.075 . 0 0 "[ . 1 . 2]" 1
2015 1 83 PHE QB 1 84 LYS H . . 3.850 1.573 1.484 1.752 . 0 0 "[ . 1 . 2]" 1
2016 1 83 PHE HB2 1 84 LYS H . . 4.290 2.132 1.554 3.006 . 0 0 "[ . 1 . 2]" 1
2017 1 83 PHE HB3 1 84 LYS H . . 4.290 1.744 1.518 2.069 . 0 0 "[ . 1 . 2]" 1
2018 1 83 PHE QE 1 84 LYS QB . . 7.780 6.005 5.901 6.120 . 0 0 "[ . 1 . 2]" 1
2019 1 84 LYS H 1 84 LYS QE . . 6.380 5.287 4.139 5.804 . 0 0 "[ . 1 . 2]" 1
2020 1 84 LYS H 1 84 LYS QG . . 4.490 3.944 3.769 4.062 . 0 0 "[ . 1 . 2]" 1
2021 1 84 LYS H 1 85 GLN H . . 3.890 3.911 3.525 3.938 0.048 19 0 "[ . 1 . 2]" 1
2022 1 84 LYS HA 1 84 LYS HB2 . . 2.830 2.467 2.266 2.522 . 0 0 "[ . 1 . 2]" 1
2023 1 84 LYS HA 1 84 LYS QB . . 2.480 2.305 2.169 2.337 . 0 0 "[ . 1 . 2]" 1
2024 1 84 LYS HA 1 84 LYS HB3 . . 2.830 2.769 2.758 2.781 . 0 0 "[ . 1 . 2]" 1
2025 1 84 LYS HA 1 84 LYS QD . . 4.270 3.558 3.435 3.592 . 0 0 "[ . 1 . 2]" 1
2026 1 84 LYS HA 1 85 GLN H . . 3.020 2.311 2.125 3.056 0.036 20 0 "[ . 1 . 2]" 1
2027 1 84 LYS HA 1 85 GLN QG . . 6.380 4.581 2.714 5.047 . 0 0 "[ . 1 . 2]" 1
2028 1 84 LYS QB 1 85 GLN H . . 3.640 2.769 2.221 3.201 . 0 0 "[ . 1 . 2]" 1
2029 1 84 LYS QB 1 86 GLY H . . 5.230 4.384 3.817 4.646 . 0 0 "[ . 1 . 2]" 1
2030 1 84 LYS HB2 1 85 GLN H . . 4.010 3.727 3.399 4.008 . 0 0 "[ . 1 . 2]" 1
2031 1 84 LYS HB3 1 85 GLN H . . 4.010 2.863 2.252 3.384 . 0 0 "[ . 1 . 2]" 1
2032 1 84 LYS QD 1 85 GLN H . . 6.380 3.834 3.025 4.328 . 0 0 "[ . 1 . 2]" 1
2033 1 84 LYS QD 1 86 GLY H . . 6.380 4.788 3.413 5.685 . 0 0 "[ . 1 . 2]" 1
2034 1 84 LYS QE 1 85 GLN H . . 6.380 4.032 2.659 4.733 . 0 0 "[ . 1 . 2]" 1
2035 1 84 LYS QE 1 86 GLY H . . 6.380 4.496 3.042 5.518 . 0 0 "[ . 1 . 2]" 1
2036 1 84 LYS QE 1 86 GLY QA . . 7.250 4.269 2.843 5.470 . 0 0 "[ . 1 . 2]" 1
2037 1 84 LYS QG 1 85 GLN H . . 4.140 1.889 1.596 2.181 . 0 0 "[ . 1 . 2]" 1
2038 1 84 LYS QG 1 85 GLN HA . . 6.380 4.378 3.170 4.671 . 0 0 "[ . 1 . 2]" 1
2039 1 84 LYS QG 1 85 GLN HB2 . . 6.380 4.185 2.879 4.887 . 0 0 "[ . 1 . 2]" 1
2040 1 84 LYS QG 1 85 GLN HB3 . . 6.380 4.795 4.341 5.292 . 0 0 "[ . 1 . 2]" 1
2041 1 84 LYS QG 1 85 GLN QG . . 7.250 4.753 2.405 5.479 . 0 0 "[ . 1 . 2]" 1
2042 1 84 LYS QG 1 86 GLY QA . . 7.250 3.892 3.023 5.597 . 0 0 "[ . 1 . 2]" 1
2043 1 84 LYS HG2 1 85 GLN H . . 4.290 2.016 1.601 3.075 . 0 0 "[ . 1 . 2]" 1
2044 1 84 LYS HG3 1 85 GLN H . . 4.290 2.704 1.652 3.265 . 0 0 "[ . 1 . 2]" 1
2045 1 85 GLN H 1 85 GLN HB2 . . 3.550 2.835 2.226 3.498 . 0 0 "[ . 1 . 2]" 1
2046 1 85 GLN H 1 85 GLN QB . . 3.180 2.674 2.205 2.934 . 0 0 "[ . 1 . 2]" 1
2047 1 85 GLN H 1 85 GLN HB3 . . 3.550 3.471 3.113 3.562 0.012 7 0 "[ . 1 . 2]" 1
2048 1 85 GLN H 1 86 GLY H . . 3.270 2.181 1.909 2.640 . 0 0 "[ . 1 . 2]" 1
2049 1 85 GLN H 1 86 GLY QA . . 5.480 3.913 3.524 4.451 . 0 0 "[ . 1 . 2]" 1
2050 1 85 GLN HA 1 85 GLN HB2 . . 2.400 2.511 2.493 2.523 0.123 12 0 "[ . 1 . 2]" 1
2051 1 85 GLN HA 1 85 GLN HB3 . . 2.400 2.446 2.070 2.517 0.117 2 0 "[ . 1 . 2]" 1
2052 1 85 GLN HA 1 85 GLN QG . . 3.620 2.223 1.998 3.124 . 0 0 "[ . 1 . 2]" 1
2053 1 85 GLN HA 1 86 GLY H . . 3.600 3.377 3.039 3.481 . 0 0 "[ . 1 . 2]" 1
2054 1 85 GLN QB 1 86 GLY H . . 2.840 2.507 1.983 2.671 . 0 0 "[ . 1 . 2]" 1
2055 1 85 GLN QB 1 86 GLY QA . . 6.010 3.761 3.473 3.990 . 0 0 "[ . 1 . 2]" 1
2056 1 85 GLN HB2 1 86 GLY H . . 3.080 2.923 2.005 3.094 0.014 7 0 "[ . 1 . 2]" 1
2057 1 85 GLN HB2 1 86 GLY QA . . 6.380 4.655 3.553 4.895 . 0 0 "[ . 1 . 2]" 1
2058 1 85 GLN HB3 1 86 GLY H . . 3.080 2.836 2.550 3.131 0.051 13 0 "[ . 1 . 2]" 1
2059 1 85 GLN HB3 1 86 GLY QA . . 6.380 4.118 3.770 4.936 . 0 0 "[ . 1 . 2]" 1
2060 1 85 GLN QG 1 86 GLY H . . 4.860 3.965 1.587 4.394 . 0 0 "[ . 1 . 2]" 1
2061 1 85 GLN QG 1 86 GLY QA . . 7.250 4.970 3.626 5.493 . 0 0 "[ . 1 . 2]" 1
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