NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
396228 |
1sbj   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1sbj
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 754
_Distance_constraint_stats_list.Viol_count 289
_Distance_constraint_stats_list.Viol_total 182.018
_Distance_constraint_stats_list.Viol_max 0.489
_Distance_constraint_stats_list.Viol_rms 0.0099
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0006
_Distance_constraint_stats_list.Viol_average_violations_only 0.0315
_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 8 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 LYS 0.260 0.089 19 0 "[ . 1 . 2]"
1 13 THR 0.384 0.089 19 0 "[ . 1 . 2]"
1 14 GLU 0.107 0.071 13 0 "[ . 1 . 2]"
1 15 GLU 0.249 0.090 15 0 "[ . 1 . 2]"
1 16 GLU 0.207 0.090 15 0 "[ . 1 . 2]"
1 17 LEU 0.007 0.006 5 0 "[ . 1 . 2]"
1 18 SER 0.005 0.005 17 0 "[ . 1 . 2]"
1 19 ASP 0.058 0.034 17 0 "[ . 1 . 2]"
1 20 LEU 0.093 0.057 15 0 "[ . 1 . 2]"
1 21 PHE 0.068 0.017 9 0 "[ . 1 . 2]"
1 22 ARG 0.040 0.038 12 0 "[ . 1 . 2]"
1 23 MET 0.056 0.038 12 0 "[ . 1 . 2]"
1 24 PHE 0.241 0.066 9 0 "[ . 1 . 2]"
1 25 ASP 0.836 0.287 7 0 "[ . 1 . 2]"
1 26 LYS 0.005 0.003 10 0 "[ . 1 . 2]"
1 27 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 ALA 0.015 0.008 19 0 "[ . 1 . 2]"
1 29 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 GLY 0.812 0.287 7 0 "[ . 1 . 2]"
1 31 TYR 0.000 0.000 15 0 "[ . 1 . 2]"
1 32 ILE 0.256 0.066 9 0 "[ . 1 . 2]"
1 33 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 LEU 0.276 0.051 15 0 "[ . 1 . 2]"
1 35 GLU 0.023 0.008 12 0 "[ . 1 . 2]"
1 36 GLU 0.108 0.027 14 0 "[ . 1 . 2]"
1 37 LEU 0.276 0.066 13 0 "[ . 1 . 2]"
1 38 LYS 0.044 0.024 10 0 "[ . 1 . 2]"
1 39 ILE 0.122 0.025 20 0 "[ . 1 . 2]"
1 40 MET 0.122 0.064 3 0 "[ . 1 . 2]"
1 41 LEU 0.347 0.064 3 0 "[ . 1 . 2]"
1 42 GLN 0.018 0.018 13 0 "[ . 1 . 2]"
1 43 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 THR 0.259 0.032 19 0 "[ . 1 . 2]"
1 45 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 ILE 0.197 0.111 14 0 "[ . 1 . 2]"
1 49 THR 0.063 0.025 3 0 "[ . 1 . 2]"
1 50 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 ASP 0.059 0.030 14 0 "[ . 1 . 2]"
1 52 ASP 0.257 0.111 14 0 "[ . 1 . 2]"
1 53 ILE 0.179 0.066 13 0 "[ . 1 . 2]"
1 54 GLU 0.048 0.016 14 0 "[ . 1 . 2]"
1 55 GLU 0.040 0.016 14 0 "[ . 1 . 2]"
1 56 LEU 0.006 0.006 18 0 "[ . 1 . 2]"
1 57 MET 0.115 0.057 7 0 "[ . 1 . 2]"
1 58 LYS 0.014 0.008 1 0 "[ . 1 . 2]"
1 59 ASP 0.097 0.027 4 0 "[ . 1 . 2]"
1 60 GLY 0.004 0.004 4 0 "[ . 1 . 2]"
1 61 ASP 3.314 0.489 8 0 "[ . 1 . 2]"
1 62 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 ASN 0.391 0.045 19 0 "[ . 1 . 2]"
1 64 ASN 0.509 0.045 19 0 "[ . 1 . 2]"
1 65 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 GLY 3.325 0.489 8 0 "[ . 1 . 2]"
1 67 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 ILE 0.185 0.057 7 0 "[ . 1 . 2]"
1 69 ASP 0.078 0.029 12 0 "[ . 1 . 2]"
1 70 TYR 0.839 0.089 11 0 "[ . 1 . 2]"
1 71 ASP 0.119 0.038 13 0 "[ . 1 . 2]"
1 72 GLU 0.244 0.038 13 0 "[ . 1 . 2]"
1 73 PHE 0.839 0.089 11 0 "[ . 1 . 2]"
1 74 LEU 0.061 0.023 19 0 "[ . 1 . 2]"
1 75 GLU 0.203 0.040 7 0 "[ . 1 . 2]"
1 76 PHE 0.231 0.049 5 0 "[ . 1 . 2]"
1 77 MET 0.228 0.074 10 0 "[ . 1 . 2]"
1 78 LYS 0.379 0.074 10 0 "[ . 1 . 2]"
1 79 GLY 0.257 0.049 5 0 "[ . 1 . 2]"
1 80 VAL 0.107 0.018 12 0 "[ . 1 . 2]"
1 81 GLU 0.000 0.000 . 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 8 ASP H 1 8 ASP QB 3.000 . 3.600 2.402 2.054 3.013 . 0 0 "[ . 1 . 2]" 1
2 1 8 ASP QB 1 9 SER H 4.800 . 5.800 3.015 1.908 4.022 . 0 0 "[ . 1 . 2]" 1
3 1 9 SER H 1 9 SER HA 3.000 . 3.600 2.902 2.770 2.947 . 0 0 "[ . 1 . 2]" 1
4 1 9 SER H 1 9 SER QB 3.000 . 3.600 2.622 2.247 3.150 . 0 0 "[ . 1 . 2]" 1
5 1 9 SER HA 1 10 LYS H 3.000 . 3.600 2.827 2.141 3.565 . 0 0 "[ . 1 . 2]" 1
6 1 10 LYS HA 1 11 GLY H 2.500 . 2.800 2.410 2.145 2.760 . 0 0 "[ . 1 . 2]" 1
7 1 11 GLY H 1 11 GLY QA 2.500 . 2.800 2.264 2.191 2.377 . 0 0 "[ . 1 . 2]" 1
8 1 11 GLY QA 1 12 LYS H 3.000 . 3.600 2.254 2.106 2.814 . 0 0 "[ . 1 . 2]" 1
9 1 12 LYS H 1 12 LYS HA 3.000 . 3.600 2.905 2.819 2.948 . 0 0 "[ . 1 . 2]" 1
10 1 12 LYS H 1 12 LYS QB 3.000 . 3.600 2.469 2.169 3.022 . 0 0 "[ . 1 . 2]" 1
11 1 12 LYS HA 1 13 THR H 2.500 . 2.800 2.377 2.125 2.889 0.089 19 0 "[ . 1 . 2]" 1
12 1 12 LYS QB 1 16 GLU QG 3.800 . 4.600 2.714 1.867 3.655 . 0 0 "[ . 1 . 2]" 1
13 1 13 THR H 1 14 GLU H 4.000 . 5.200 3.697 2.186 4.469 . 0 0 "[ . 1 . 2]" 1
14 1 13 THR H 1 15 GLU HA 5.800 . 7.000 6.146 5.694 7.052 0.052 8 0 "[ . 1 . 2]" 1
15 1 13 THR H 1 16 GLU QB 3.800 . 4.600 3.417 2.674 4.063 . 0 0 "[ . 1 . 2]" 1
16 1 13 THR HA 1 13 THR HB 3.000 . 3.600 2.691 2.295 3.025 . 0 0 "[ . 1 . 2]" 1
17 1 13 THR HA 1 13 THR HG1 3.000 . 3.600 2.472 2.039 2.985 . 0 0 "[ . 1 . 2]" 1
18 1 13 THR HB 1 14 GLU H 3.000 . 3.600 2.675 1.934 3.671 0.071 13 0 "[ . 1 . 2]" 1
19 1 13 THR MG 1 14 GLU H 3.800 . 4.600 2.649 1.823 3.782 . 0 0 "[ . 1 . 2]" 1
20 1 14 GLU H 1 15 GLU H 2.500 . 2.800 2.563 2.100 2.836 0.036 1 0 "[ . 1 . 2]" 1
21 1 14 GLU H 1 15 GLU HA 4.800 . 5.800 5.107 4.793 5.385 . 0 0 "[ . 1 . 2]" 1
22 1 14 GLU H 1 16 GLU H 4.000 . 5.200 4.141 3.313 4.476 . 0 0 "[ . 1 . 2]" 1
23 1 14 GLU H 1 16 GLU QG 4.800 . 5.800 4.768 3.306 5.265 . 0 0 "[ . 1 . 2]" 1
24 1 14 GLU H 1 17 LEU H 4.800 . 5.800 5.270 4.740 5.650 . 0 0 "[ . 1 . 2]" 1
25 1 14 GLU HA 1 14 GLU QG 3.000 . 3.600 2.327 2.001 3.315 . 0 0 "[ . 1 . 2]" 1
26 1 14 GLU HA 1 15 GLU H 3.800 . 4.600 3.388 3.239 3.563 . 0 0 "[ . 1 . 2]" 1
27 1 14 GLU HA 1 16 GLU H 4.800 . 5.800 4.000 3.552 4.484 . 0 0 "[ . 1 . 2]" 1
28 1 14 GLU QB 1 15 GLU H 3.000 . 3.600 3.131 2.203 3.398 . 0 0 "[ . 1 . 2]" 1
29 1 14 GLU QG 1 15 GLU H 4.800 . 5.800 4.246 1.954 4.732 . 0 0 "[ . 1 . 2]" 1
30 1 15 GLU H 1 15 GLU HA 3.000 . 3.600 2.881 2.700 2.933 . 0 0 "[ . 1 . 2]" 1
31 1 15 GLU H 1 16 GLU H 2.500 . 2.800 2.387 2.103 2.890 0.090 15 0 "[ . 1 . 2]" 1
32 1 15 GLU HA 1 70 TYR QE 3.800 . 4.600 4.352 3.896 4.530 . 0 0 "[ . 1 . 2]" 1
33 1 15 GLU QB 1 18 SER H 5.800 . 7.000 4.997 4.242 5.257 . 0 0 "[ . 1 . 2]" 1
34 1 16 GLU H 1 16 GLU HA 3.000 . 3.600 2.854 2.758 2.932 . 0 0 "[ . 1 . 2]" 1
35 1 16 GLU H 1 17 LEU H 2.500 . 2.800 2.462 2.091 2.784 . 0 0 "[ . 1 . 2]" 1
36 1 16 GLU H 1 17 LEU HA 5.800 . 7.000 5.051 4.750 5.382 . 0 0 "[ . 1 . 2]" 1
37 1 16 GLU H 1 18 SER H 4.000 . 5.200 4.119 3.738 4.349 . 0 0 "[ . 1 . 2]" 1
38 1 16 GLU H 1 19 ASP H 4.800 . 5.800 5.533 5.200 5.834 0.034 17 0 "[ . 1 . 2]" 1
39 1 16 GLU HA 1 17 LEU H 3.800 . 4.600 3.470 3.436 3.505 . 0 0 "[ . 1 . 2]" 1
40 1 16 GLU HA 1 19 ASP H 3.800 . 4.600 3.546 3.165 3.928 . 0 0 "[ . 1 . 2]" 1
41 1 16 GLU HA 1 19 ASP QB 3.800 . 4.600 3.545 2.794 4.133 . 0 0 "[ . 1 . 2]" 1
42 1 17 LEU H 1 17 LEU QB 3.000 . 3.600 2.209 2.062 2.407 . 0 0 "[ . 1 . 2]" 1
43 1 17 LEU H 1 17 LEU MD2 4.800 . 5.800 3.949 3.422 4.298 . 0 0 "[ . 1 . 2]" 1
44 1 17 LEU H 1 17 LEU HG 3.000 . 3.600 2.884 2.296 3.511 . 0 0 "[ . 1 . 2]" 1
45 1 17 LEU H 1 18 SER H 2.500 . 2.800 2.663 2.271 2.768 . 0 0 "[ . 1 . 2]" 1
46 1 17 LEU HA 1 17 LEU MD1 3.800 . 4.600 3.794 3.687 3.873 . 0 0 "[ . 1 . 2]" 1
47 1 17 LEU HA 1 17 LEU MD2 3.000 . 3.600 2.238 1.933 2.572 . 0 0 "[ . 1 . 2]" 1
48 1 17 LEU HA 1 17 LEU HG 3.000 . 3.600 2.624 2.288 2.963 . 0 0 "[ . 1 . 2]" 1
49 1 17 LEU HA 1 18 SER H 3.800 . 4.600 3.437 3.374 3.479 . 0 0 "[ . 1 . 2]" 1
50 1 17 LEU HA 1 19 ASP H 3.800 . 4.600 4.240 3.820 4.606 0.006 5 0 "[ . 1 . 2]" 1
51 1 17 LEU QB 1 18 SER H 3.000 . 3.600 3.046 2.910 3.201 . 0 0 "[ . 1 . 2]" 1
52 1 17 LEU QB 1 18 SER HA 4.800 . 5.800 3.947 3.874 4.013 . 0 0 "[ . 1 . 2]" 1
53 1 17 LEU QB 1 70 TYR QE 5.800 . 7.000 2.585 1.892 4.996 . 0 0 "[ . 1 . 2]" 1
54 1 17 LEU QB 1 74 LEU HA 3.800 . 4.600 3.764 3.079 4.229 . 0 0 "[ . 1 . 2]" 1
55 1 17 LEU QD 1 77 MET QB 3.000 . 3.600 2.168 1.828 2.444 . 0 0 "[ . 1 . 2]" 1
56 1 17 LEU QD 1 77 MET ME 5.800 . 7.000 3.459 1.834 4.131 . 0 0 "[ . 1 . 2]" 1
57 1 17 LEU MD2 1 77 MET H 5.800 . 7.000 4.460 3.554 5.448 . 0 0 "[ . 1 . 2]" 1
58 1 17 LEU HG 1 74 LEU HA 5.800 . 7.000 5.597 4.737 6.683 . 0 0 "[ . 1 . 2]" 1
59 1 18 SER H 1 18 SER HA 3.000 . 3.600 2.829 2.762 2.860 . 0 0 "[ . 1 . 2]" 1
60 1 18 SER H 1 18 SER QB 3.000 . 3.600 2.365 2.057 2.863 . 0 0 "[ . 1 . 2]" 1
61 1 18 SER H 1 19 ASP H 2.500 . 2.800 2.623 2.461 2.805 0.005 17 0 "[ . 1 . 2]" 1
62 1 18 SER H 1 19 ASP QB 5.800 . 7.000 4.354 4.139 4.555 . 0 0 "[ . 1 . 2]" 1
63 1 18 SER H 1 20 LEU H 4.000 . 5.200 4.136 3.842 4.507 . 0 0 "[ . 1 . 2]" 1
64 1 18 SER H 1 21 PHE H 4.800 . 5.800 4.729 4.371 5.133 . 0 0 "[ . 1 . 2]" 1
65 1 18 SER H 1 70 TYR QE 4.800 . 5.800 3.213 2.723 4.160 . 0 0 "[ . 1 . 2]" 1
66 1 18 SER HA 1 19 ASP H 3.800 . 4.600 3.530 3.455 3.564 . 0 0 "[ . 1 . 2]" 1
67 1 18 SER HA 1 20 LEU H 3.800 . 4.600 4.327 4.080 4.547 . 0 0 "[ . 1 . 2]" 1
68 1 18 SER HA 1 21 PHE H 3.800 . 4.600 3.338 3.174 3.518 . 0 0 "[ . 1 . 2]" 1
69 1 18 SER HA 1 21 PHE QB 3.000 . 3.600 2.566 2.217 2.878 . 0 0 "[ . 1 . 2]" 1
70 1 18 SER HA 1 70 TYR QD 3.800 . 4.600 3.223 2.752 3.837 . 0 0 "[ . 1 . 2]" 1
71 1 18 SER HA 1 70 TYR QE 3.800 . 4.600 2.447 1.999 2.927 . 0 0 "[ . 1 . 2]" 1
72 1 18 SER QB 1 19 ASP H 3.800 . 4.600 2.947 2.398 3.484 . 0 0 "[ . 1 . 2]" 1
73 1 18 SER QB 1 70 TYR QE 3.800 . 4.600 2.959 1.981 3.808 . 0 0 "[ . 1 . 2]" 1
74 1 19 ASP H 1 19 ASP QB 3.000 . 3.600 2.163 2.049 2.445 . 0 0 "[ . 1 . 2]" 1
75 1 19 ASP H 1 20 LEU H 3.200 . 3.700 2.689 2.526 2.823 . 0 0 "[ . 1 . 2]" 1
76 1 19 ASP H 1 70 TYR QE 5.800 . 7.000 5.012 4.708 5.300 . 0 0 "[ . 1 . 2]" 1
77 1 19 ASP QB 1 20 LEU H 3.000 . 3.600 2.647 2.410 2.851 . 0 0 "[ . 1 . 2]" 1
78 1 20 LEU H 1 20 LEU QB 3.000 . 3.600 2.306 2.060 2.664 . 0 0 "[ . 1 . 2]" 1
79 1 20 LEU H 1 20 LEU HG 3.000 . 3.600 2.946 2.013 3.657 0.057 15 0 "[ . 1 . 2]" 1
80 1 20 LEU H 1 21 PHE H 2.500 . 2.800 2.505 2.301 2.640 . 0 0 "[ . 1 . 2]" 1
81 1 20 LEU H 1 21 PHE QB 4.800 . 5.800 4.265 4.089 4.393 . 0 0 "[ . 1 . 2]" 1
82 1 20 LEU HA 1 22 ARG H 4.800 . 5.800 4.397 4.162 4.625 . 0 0 "[ . 1 . 2]" 1
83 1 20 LEU HA 1 23 MET H 3.800 . 4.600 3.420 3.302 3.743 . 0 0 "[ . 1 . 2]" 1
84 1 20 LEU HG 1 21 PHE H 4.800 . 5.800 4.791 4.058 5.464 . 0 0 "[ . 1 . 2]" 1
85 1 21 PHE H 1 21 PHE QB 3.000 . 3.600 2.255 2.246 2.276 . 0 0 "[ . 1 . 2]" 1
86 1 21 PHE H 1 22 ARG H 3.200 . 3.700 2.735 2.526 2.836 . 0 0 "[ . 1 . 2]" 1
87 1 21 PHE H 1 22 ARG HA 5.800 . 7.000 5.317 5.127 5.398 . 0 0 "[ . 1 . 2]" 1
88 1 21 PHE HA 1 22 ARG H 3.800 . 4.600 3.555 3.530 3.577 . 0 0 "[ . 1 . 2]" 1
89 1 21 PHE HA 1 24 PHE H 3.000 . 3.600 3.585 3.449 3.617 0.017 9 0 "[ . 1 . 2]" 1
90 1 21 PHE HA 1 73 PHE QB 5.800 . 7.000 4.824 4.424 5.358 . 0 0 "[ . 1 . 2]" 1
91 1 21 PHE QB 1 22 ARG H 3.000 . 3.600 2.462 2.292 2.680 . 0 0 "[ . 1 . 2]" 1
92 1 21 PHE QB 1 70 TYR HA 3.800 . 4.600 3.978 3.725 4.095 . 0 0 "[ . 1 . 2]" 1
93 1 21 PHE QB 1 70 TYR QE 5.800 . 7.000 3.431 2.629 4.221 . 0 0 "[ . 1 . 2]" 1
94 1 21 PHE QD 1 22 ARG HA 4.800 . 5.800 3.642 2.734 4.502 . 0 0 "[ . 1 . 2]" 1
95 1 21 PHE QE 1 22 ARG HA 4.800 . 5.800 4.910 4.318 5.477 . 0 0 "[ . 1 . 2]" 1
96 1 21 PHE QE 1 31 TYR HA 3.800 . 4.600 3.734 3.286 4.154 . 0 0 "[ . 1 . 2]" 1
97 1 21 PHE QE 1 32 ILE QG 3.800 . 4.600 3.256 2.096 3.967 . 0 0 "[ . 1 . 2]" 1
98 1 21 PHE QE 1 68 ILE MG 4.800 . 5.800 3.226 2.569 4.145 . 0 0 "[ . 1 . 2]" 1
99 1 21 PHE QE 1 69 ASP HA 3.800 . 4.600 3.190 2.577 3.624 . 0 0 "[ . 1 . 2]" 1
100 1 21 PHE QE 1 70 TYR HA 4.800 . 5.800 3.086 2.300 3.795 . 0 0 "[ . 1 . 2]" 1
101 1 21 PHE HZ 1 30 GLY QA 4.800 . 5.800 4.128 3.780 4.766 . 0 0 "[ . 1 . 2]" 1
102 1 21 PHE HZ 1 31 TYR HA 3.000 . 3.600 2.631 1.985 3.065 . 0 0 "[ . 1 . 2]" 1
103 1 21 PHE HZ 1 69 ASP HA 3.000 . 3.600 2.189 1.954 2.545 . 0 0 "[ . 1 . 2]" 1
104 1 21 PHE HZ 1 70 TYR HA 4.800 . 5.800 4.116 3.625 4.878 . 0 0 "[ . 1 . 2]" 1
105 1 22 ARG H 1 22 ARG QB 3.000 . 3.600 2.284 2.029 2.653 . 0 0 "[ . 1 . 2]" 1
106 1 22 ARG H 1 23 MET H 2.500 . 2.800 2.717 2.617 2.838 0.038 12 0 "[ . 1 . 2]" 1
107 1 22 ARG H 1 23 MET QG 4.800 . 5.800 4.571 3.752 5.127 . 0 0 "[ . 1 . 2]" 1
108 1 22 ARG HA 1 22 ARG QD 4.800 . 5.800 3.619 2.054 4.239 . 0 0 "[ . 1 . 2]" 1
109 1 22 ARG HA 1 22 ARG QG 3.800 . 4.600 2.437 2.025 3.390 . 0 0 "[ . 1 . 2]" 1
110 1 22 ARG HA 1 23 MET H 3.800 . 4.600 3.521 3.492 3.565 . 0 0 "[ . 1 . 2]" 1
111 1 22 ARG HA 1 24 PHE H 3.800 . 4.600 3.940 3.756 4.368 . 0 0 "[ . 1 . 2]" 1
112 1 22 ARG HA 1 25 ASP H 3.000 . 3.600 3.188 3.069 3.393 . 0 0 "[ . 1 . 2]" 1
113 1 22 ARG HA 1 25 ASP HA 4.800 . 5.800 5.256 5.141 5.511 . 0 0 "[ . 1 . 2]" 1
114 1 22 ARG QB 1 23 MET H 3.800 . 4.600 2.764 2.493 3.529 . 0 0 "[ . 1 . 2]" 1
115 1 22 ARG QB 1 23 MET HA 4.800 . 5.800 3.893 3.676 4.450 . 0 0 "[ . 1 . 2]" 1
116 1 22 ARG QB 1 25 ASP H 4.800 . 5.800 4.474 4.338 4.791 . 0 0 "[ . 1 . 2]" 1
117 1 22 ARG QG 1 24 PHE H 5.800 . 7.000 5.382 4.465 5.864 . 0 0 "[ . 1 . 2]" 1
118 1 23 MET H 1 23 MET HA 3.000 . 3.600 2.783 2.762 2.827 . 0 0 "[ . 1 . 2]" 1
119 1 23 MET H 1 23 MET QG 3.000 . 3.600 2.519 1.957 2.898 . 0 0 "[ . 1 . 2]" 1
120 1 23 MET H 1 24 PHE H 2.500 . 2.800 2.707 2.586 2.816 0.016 12 0 "[ . 1 . 2]" 1
121 1 23 MET H 1 25 ASP H 4.000 . 5.200 4.032 3.938 4.104 . 0 0 "[ . 1 . 2]" 1
122 1 23 MET HA 1 23 MET ME 4.800 . 5.800 4.036 2.518 4.714 . 0 0 "[ . 1 . 2]" 1
123 1 23 MET HA 1 23 MET QG 3.000 . 3.600 2.422 2.105 3.322 . 0 0 "[ . 1 . 2]" 1
124 1 23 MET HA 1 24 PHE HA 4.800 . 5.800 4.707 4.655 4.816 . 0 0 "[ . 1 . 2]" 1
125 1 23 MET QB 1 24 PHE H 3.000 . 3.600 2.854 2.658 3.291 . 0 0 "[ . 1 . 2]" 1
126 1 24 PHE H 1 24 PHE HA 3.000 . 3.600 2.874 2.796 2.903 . 0 0 "[ . 1 . 2]" 1
127 1 24 PHE H 1 24 PHE QB 3.000 . 3.600 2.140 2.081 2.228 . 0 0 "[ . 1 . 2]" 1
128 1 24 PHE H 1 25 ASP H 2.500 . 2.800 2.437 2.337 2.664 . 0 0 "[ . 1 . 2]" 1
129 1 24 PHE HA 1 25 ASP H 3.800 . 4.600 3.430 3.355 3.483 . 0 0 "[ . 1 . 2]" 1
130 1 24 PHE QB 1 25 ASP H 3.000 . 3.600 3.093 2.909 3.296 . 0 0 "[ . 1 . 2]" 1
131 1 24 PHE QB 1 25 ASP HA 4.800 . 5.800 4.001 3.923 4.104 . 0 0 "[ . 1 . 2]" 1
132 1 24 PHE QB 1 32 ILE MD 3.000 . 3.600 1.958 1.734 2.465 0.066 9 0 "[ . 1 . 2]" 1
133 1 24 PHE QD 1 40 MET ME 4.800 . 5.800 3.726 3.007 4.353 . 0 0 "[ . 1 . 2]" 1
134 1 24 PHE QE 1 40 MET ME 4.800 . 5.800 2.616 2.063 3.665 . 0 0 "[ . 1 . 2]" 1
135 1 24 PHE HZ 1 37 LEU QD 5.800 . 7.000 4.170 3.629 5.029 . 0 0 "[ . 1 . 2]" 1
136 1 24 PHE HZ 1 40 MET ME 4.800 . 5.800 2.960 2.276 4.181 . 0 0 "[ . 1 . 2]" 1
137 1 24 PHE HZ 1 56 LEU MD2 4.800 . 5.800 4.315 3.421 4.893 . 0 0 "[ . 1 . 2]" 1
138 1 25 ASP H 1 25 ASP HA 3.000 . 3.600 2.913 2.900 2.934 . 0 0 "[ . 1 . 2]" 1
139 1 25 ASP H 1 25 ASP QB 3.000 . 3.600 2.233 2.131 2.342 . 0 0 "[ . 1 . 2]" 1
140 1 25 ASP H 1 26 LYS H 4.000 . 5.200 4.556 4.490 4.588 . 0 0 "[ . 1 . 2]" 1
141 1 25 ASP H 1 32 ILE QG 3.800 . 4.600 3.813 3.361 4.002 . 0 0 "[ . 1 . 2]" 1
142 1 25 ASP HA 1 26 LYS H 2.500 . 2.800 2.226 2.181 2.276 . 0 0 "[ . 1 . 2]" 1
143 1 25 ASP HA 1 26 LYS HA 4.800 . 5.800 4.384 4.364 4.398 . 0 0 "[ . 1 . 2]" 1
144 1 25 ASP HA 1 26 LYS QB 4.800 . 5.800 4.193 3.917 4.484 . 0 0 "[ . 1 . 2]" 1
145 1 25 ASP HA 1 27 ASN H 3.800 . 4.600 4.108 3.973 4.236 . 0 0 "[ . 1 . 2]" 1
146 1 25 ASP HA 1 28 ALA H 3.800 . 4.600 4.419 4.189 4.608 0.008 19 0 "[ . 1 . 2]" 1
147 1 25 ASP HA 1 28 ALA HA 4.800 . 5.800 5.225 4.905 5.604 . 0 0 "[ . 1 . 2]" 1
148 1 25 ASP HA 1 32 ILE HA 3.800 . 4.600 3.986 3.642 4.323 . 0 0 "[ . 1 . 2]" 1
149 1 25 ASP HA 1 32 ILE QG 3.000 . 3.600 2.891 2.568 3.196 . 0 0 "[ . 1 . 2]" 1
150 1 25 ASP HA 1 33 ASP H 4.800 . 5.800 5.303 4.869 5.643 . 0 0 "[ . 1 . 2]" 1
151 1 25 ASP HA 1 37 LEU HA 5.800 . 7.000 6.317 5.552 7.008 0.008 20 0 "[ . 1 . 2]" 1
152 1 25 ASP QB 1 30 GLY H 4.800 . 5.800 3.859 3.503 4.395 . 0 0 "[ . 1 . 2]" 1
153 1 25 ASP OD1 1 30 GLY H 2.850 2.450 3.150 2.576 2.163 2.959 0.287 7 0 "[ . 1 . 2]" 1
154 1 26 LYS H 1 26 LYS HA 3.000 . 3.600 2.942 2.929 2.947 . 0 0 "[ . 1 . 2]" 1
155 1 26 LYS H 1 26 LYS QB 3.000 . 3.600 2.422 2.262 2.591 . 0 0 "[ . 1 . 2]" 1
156 1 26 LYS H 1 27 ASN H 2.500 . 2.800 2.109 2.015 2.224 . 0 0 "[ . 1 . 2]" 1
157 1 26 LYS H 1 28 ALA H 4.000 . 5.200 3.277 3.138 3.472 . 0 0 "[ . 1 . 2]" 1
158 1 26 LYS H 1 36 GLU HA 4.800 . 5.800 4.975 4.096 5.660 . 0 0 "[ . 1 . 2]" 1
159 1 26 LYS H 1 36 GLU QB 3.800 . 4.600 3.637 2.963 4.179 . 0 0 "[ . 1 . 2]" 1
160 1 26 LYS H 1 36 GLU QG 3.800 . 4.600 2.237 1.892 2.730 . 0 0 "[ . 1 . 2]" 1
161 1 26 LYS HA 1 26 LYS QD 3.000 . 3.600 2.555 1.976 3.103 . 0 0 "[ . 1 . 2]" 1
162 1 26 LYS HA 1 26 LYS QE 3.800 . 4.600 3.350 1.989 4.116 . 0 0 "[ . 1 . 2]" 1
163 1 26 LYS HA 1 26 LYS QG 3.000 . 3.600 2.581 2.168 3.030 . 0 0 "[ . 1 . 2]" 1
164 1 26 LYS HA 1 27 ASN H 3.800 . 4.600 3.538 3.512 3.559 . 0 0 "[ . 1 . 2]" 1
165 1 26 LYS HA 1 27 ASN HA 4.800 . 5.800 4.623 4.545 4.702 . 0 0 "[ . 1 . 2]" 1
166 1 26 LYS QB 1 27 ASN H 3.000 . 3.600 2.593 2.343 2.736 . 0 0 "[ . 1 . 2]" 1
167 1 26 LYS QB 1 28 ALA H 4.800 . 5.800 4.373 4.278 4.532 . 0 0 "[ . 1 . 2]" 1
168 1 26 LYS QB 1 36 GLU HG3 3.800 . 4.600 2.343 1.949 3.728 . 0 0 "[ . 1 . 2]" 1
169 1 26 LYS QB 1 39 ILE MG 4.800 . 5.800 3.963 3.479 4.178 . 0 0 "[ . 1 . 2]" 1
170 1 26 LYS HB2 1 39 ILE MD 4.800 . 5.800 3.168 1.929 4.866 . 0 0 "[ . 1 . 2]" 1
171 1 26 LYS HD3 1 39 ILE MD 3.800 . 4.600 3.779 2.148 4.244 . 0 0 "[ . 1 . 2]" 1
172 1 26 LYS HE2 1 39 ILE HB 5.800 . 7.000 4.246 2.421 5.591 . 0 0 "[ . 1 . 2]" 1
173 1 26 LYS HE2 1 39 ILE MG 3.800 . 4.600 3.328 2.123 4.337 . 0 0 "[ . 1 . 2]" 1
174 1 26 LYS QG 1 36 GLU HA 3.800 . 5.000 3.482 2.342 4.232 . 0 0 "[ . 1 . 2]" 1
175 1 26 LYS HG2 1 36 GLU HG3 3.800 . 4.600 3.970 2.692 4.603 0.003 10 0 "[ . 1 . 2]" 1
176 1 26 LYS HG2 1 39 ILE MD 4.800 . 5.800 3.438 2.168 4.854 . 0 0 "[ . 1 . 2]" 1
177 1 27 ASN H 1 27 ASN HA 3.000 . 3.600 2.911 2.864 2.948 . 0 0 "[ . 1 . 2]" 1
178 1 27 ASN H 1 27 ASN QB 3.000 . 3.600 2.747 2.588 2.956 . 0 0 "[ . 1 . 2]" 1
179 1 27 ASN H 1 28 ALA H 2.500 . 2.800 2.503 2.364 2.629 . 0 0 "[ . 1 . 2]" 1
180 1 27 ASN H 1 29 ASP H 4.800 . 5.800 4.446 3.870 5.213 . 0 0 "[ . 1 . 2]" 1
181 1 27 ASN HA 1 28 ALA H 3.800 . 4.600 3.219 3.102 3.304 . 0 0 "[ . 1 . 2]" 1
182 1 27 ASN HA 1 28 ALA MB 4.800 . 5.800 3.871 3.776 3.950 . 0 0 "[ . 1 . 2]" 1
183 1 27 ASN QB 1 29 ASP HA 5.800 . 7.000 5.336 4.852 5.922 . 0 0 "[ . 1 . 2]" 1
184 1 27 ASN QB 1 36 GLU QG 5.800 . 7.000 4.415 3.475 5.095 . 0 0 "[ . 1 . 2]" 1
185 1 27 ASN HB2 1 28 ALA H 3.800 . 4.600 4.229 3.544 4.394 . 0 0 "[ . 1 . 2]" 1
186 1 28 ALA H 1 28 ALA HA 2.500 . 2.800 2.285 2.279 2.291 . 0 0 "[ . 1 . 2]" 1
187 1 28 ALA H 1 29 ASP H 3.200 . 3.700 3.209 3.001 3.656 . 0 0 "[ . 1 . 2]" 1
188 1 28 ALA H 1 29 ASP QB 5.800 . 7.000 4.917 4.854 5.089 . 0 0 "[ . 1 . 2]" 1
189 1 28 ALA H 1 30 GLY H 4.800 . 5.800 4.822 4.560 5.259 . 0 0 "[ . 1 . 2]" 1
190 1 28 ALA HA 1 29 ASP H 2.500 . 2.800 2.455 2.186 2.606 . 0 0 "[ . 1 . 2]" 1
191 1 28 ALA HA 1 29 ASP HA 4.800 . 5.800 4.425 4.351 4.525 . 0 0 "[ . 1 . 2]" 1
192 1 28 ALA HA 1 30 GLY H 3.000 . 5.600 3.373 3.161 3.833 . 0 0 "[ . 1 . 2]" 1
193 1 28 ALA HA 1 31 TYR H 4.800 . 5.800 5.498 5.194 5.708 . 0 0 "[ . 1 . 2]" 1
194 1 28 ALA MB 1 29 ASP H 4.800 . 5.800 3.690 3.498 3.723 . 0 0 "[ . 1 . 2]" 1
195 1 28 ALA MB 1 29 ASP HA 4.800 . 5.800 4.175 4.079 4.216 . 0 0 "[ . 1 . 2]" 1
196 1 28 ALA MB 1 30 GLY H 4.800 . 5.800 4.472 4.216 4.912 . 0 0 "[ . 1 . 2]" 1
197 1 29 ASP H 1 29 ASP HA 3.000 . 3.600 2.944 2.923 2.949 . 0 0 "[ . 1 . 2]" 1
198 1 29 ASP H 1 29 ASP QB 3.000 . 3.600 2.959 2.747 3.170 . 0 0 "[ . 1 . 2]" 1
199 1 29 ASP H 1 30 GLY H 2.500 . 2.800 1.981 1.841 2.275 . 0 0 "[ . 1 . 2]" 1
200 1 29 ASP H 1 30 GLY QA 4.800 . 5.800 3.995 3.691 4.255 . 0 0 "[ . 1 . 2]" 1
201 1 29 ASP H 1 31 TYR H 3.200 . 3.700 3.413 3.205 3.609 . 0 0 "[ . 1 . 2]" 1
202 1 29 ASP HA 1 30 GLY H 3.000 . 5.600 3.371 3.293 3.521 . 0 0 "[ . 1 . 2]" 1
203 1 29 ASP HA 1 30 GLY QA 4.800 . 5.800 4.183 4.153 4.229 . 0 0 "[ . 1 . 2]" 1
204 1 29 ASP HA 1 31 TYR H 4.800 . 5.800 4.459 4.311 4.838 . 0 0 "[ . 1 . 2]" 1
205 1 29 ASP QB 1 30 GLY H 4.800 . 5.800 3.756 3.341 3.877 . 0 0 "[ . 1 . 2]" 1
206 1 29 ASP QB 1 31 TYR H 4.800 . 5.800 3.537 3.372 3.754 . 0 0 "[ . 1 . 2]" 1
207 1 30 GLY H 1 31 TYR H 2.500 . 2.800 2.483 1.996 2.681 . 0 0 "[ . 1 . 2]" 1
208 1 30 GLY H 1 31 TYR QB 5.800 . 7.000 4.995 4.533 5.214 . 0 0 "[ . 1 . 2]" 1
209 1 30 GLY QA 1 31 TYR H 3.000 . 3.600 2.905 2.884 2.927 . 0 0 "[ . 1 . 2]" 1
210 1 30 GLY QA 1 31 TYR QD 4.800 . 5.800 3.293 2.864 3.989 . 0 0 "[ . 1 . 2]" 1
211 1 30 GLY QA 1 31 TYR QE 4.800 . 5.800 3.713 3.357 4.227 . 0 0 "[ . 1 . 2]" 1
212 1 31 TYR H 1 31 TYR HA 3.000 . 3.600 2.935 2.919 2.945 . 0 0 "[ . 1 . 2]" 1
213 1 31 TYR H 1 31 TYR QD 3.800 . 4.600 2.758 2.341 3.630 . 0 0 "[ . 1 . 2]" 1
214 1 31 TYR H 1 32 ILE H 4.000 . 5.200 4.409 4.362 4.455 . 0 0 "[ . 1 . 2]" 1
215 1 31 TYR H 1 69 ASP HA 4.800 . 5.800 5.443 5.054 5.708 . 0 0 "[ . 1 . 2]" 1
216 1 31 TYR HA 1 31 TYR QD 3.800 . 4.600 3.036 2.341 3.213 . 0 0 "[ . 1 . 2]" 1
217 1 31 TYR HA 1 32 ILE H 2.500 . 2.800 2.275 2.206 2.406 . 0 0 "[ . 1 . 2]" 1
218 1 31 TYR HA 1 32 ILE HB 4.800 . 5.800 4.735 4.655 4.805 . 0 0 "[ . 1 . 2]" 1
219 1 31 TYR HA 1 67 ARG QB 4.800 . 5.800 3.859 3.622 4.218 . 0 0 "[ . 1 . 2]" 1
220 1 31 TYR HA 1 68 ILE H 3.800 . 4.600 4.277 4.135 4.600 0.000 15 0 "[ . 1 . 2]" 1
221 1 31 TYR HA 1 69 ASP HA 3.000 . 3.600 2.897 2.482 3.073 . 0 0 "[ . 1 . 2]" 1
222 1 31 TYR HA 1 69 ASP QB 3.800 . 4.600 4.036 3.702 4.147 . 0 0 "[ . 1 . 2]" 1
223 1 31 TYR QB 1 32 ILE H 3.000 . 3.600 2.750 2.421 2.945 . 0 0 "[ . 1 . 2]" 1
224 1 31 TYR QB 1 32 ILE HA 4.800 . 5.800 4.226 4.140 4.256 . 0 0 "[ . 1 . 2]" 1
225 1 31 TYR QB 1 67 ARG QB 3.000 . 3.600 1.980 1.813 2.297 . 0 0 "[ . 1 . 2]" 1
226 1 31 TYR QB 1 67 ARG QD 3.000 . 3.600 2.225 1.926 2.676 . 0 0 "[ . 1 . 2]" 1
227 1 31 TYR QB 1 67 ARG QG 4.800 . 5.800 3.629 3.301 3.925 . 0 0 "[ . 1 . 2]" 1
228 1 31 TYR QB 1 68 ILE H 3.800 . 4.600 3.607 3.255 3.747 . 0 0 "[ . 1 . 2]" 1
229 1 31 TYR QD 1 32 ILE H 4.800 . 5.800 4.153 4.004 4.388 . 0 0 "[ . 1 . 2]" 1
230 1 31 TYR QD 1 67 ARG QB 4.800 . 5.800 3.053 2.324 3.785 . 0 0 "[ . 1 . 2]" 1
231 1 31 TYR QD 1 67 ARG QD 4.800 . 5.800 3.920 3.453 4.458 . 0 0 "[ . 1 . 2]" 1
232 1 31 TYR QD 1 67 ARG QG 5.800 . 7.000 4.771 3.983 5.308 . 0 0 "[ . 1 . 2]" 1
233 1 31 TYR QD 1 69 ASP HA 4.800 . 5.800 3.233 2.190 3.911 . 0 0 "[ . 1 . 2]" 1
234 1 31 TYR QD 1 69 ASP QB 3.800 . 4.600 2.403 1.965 2.963 . 0 0 "[ . 1 . 2]" 1
235 1 31 TYR QE 1 67 ARG QB 5.800 . 7.000 4.735 4.148 5.155 . 0 0 "[ . 1 . 2]" 1
236 1 31 TYR QE 1 69 ASP HA 5.800 . 7.000 4.246 3.610 4.634 . 0 0 "[ . 1 . 2]" 1
237 1 31 TYR QE 1 69 ASP QB 3.800 . 4.600 2.241 1.940 2.587 . 0 0 "[ . 1 . 2]" 1
238 1 32 ILE H 1 32 ILE HA 3.000 . 3.600 2.944 2.942 2.950 . 0 0 "[ . 1 . 2]" 1
239 1 32 ILE H 1 32 ILE HB 3.000 . 3.600 2.662 2.640 2.739 . 0 0 "[ . 1 . 2]" 1
240 1 32 ILE H 1 33 ASP H 4.000 . 5.200 4.432 4.330 4.497 . 0 0 "[ . 1 . 2]" 1
241 1 32 ILE H 1 33 ASP HA 4.800 . 5.800 4.999 4.889 5.043 . 0 0 "[ . 1 . 2]" 1
242 1 32 ILE H 1 67 ARG QB 3.800 . 4.600 3.065 2.806 3.279 . 0 0 "[ . 1 . 2]" 1
243 1 32 ILE H 1 68 ILE H 2.500 . 2.800 2.543 2.311 2.808 0.008 15 0 "[ . 1 . 2]" 1
244 1 32 ILE H 1 68 ILE HB 3.000 . 3.600 3.504 3.286 3.609 0.009 2 0 "[ . 1 . 2]" 1
245 1 32 ILE H 1 68 ILE MG 4.800 . 5.800 4.535 4.275 4.646 . 0 0 "[ . 1 . 2]" 1
246 1 32 ILE H 1 68 ILE O 2.000 . 2.300 2.215 1.755 2.311 0.011 20 0 "[ . 1 . 2]" 1
247 1 32 ILE H 1 69 ASP HA 3.800 . 4.600 4.124 3.762 4.246 . 0 0 "[ . 1 . 2]" 1
248 1 32 ILE HA 1 32 ILE HB 3.000 . 3.600 3.018 3.015 3.020 . 0 0 "[ . 1 . 2]" 1
249 1 32 ILE HA 1 32 ILE QG 3.000 . 3.600 2.494 2.397 2.536 . 0 0 "[ . 1 . 2]" 1
250 1 32 ILE HA 1 32 ILE MG 3.000 . 3.600 2.305 2.217 2.389 . 0 0 "[ . 1 . 2]" 1
251 1 32 ILE HA 1 33 ASP H 2.500 . 2.800 2.164 2.139 2.206 . 0 0 "[ . 1 . 2]" 1
252 1 32 ILE HA 1 33 ASP HA 4.800 . 5.800 4.386 4.379 4.395 . 0 0 "[ . 1 . 2]" 1
253 1 32 ILE HB 1 33 ASP H 4.800 . 5.800 4.051 3.928 4.223 . 0 0 "[ . 1 . 2]" 1
254 1 32 ILE HB 1 67 ARG HA 4.800 . 5.800 4.862 4.431 5.491 . 0 0 "[ . 1 . 2]" 1
255 1 32 ILE HB 1 68 ILE H 3.800 . 4.600 3.237 2.920 3.641 . 0 0 "[ . 1 . 2]" 1
256 1 32 ILE MG 1 33 ASP H 3.800 . 4.600 2.418 2.154 2.862 . 0 0 "[ . 1 . 2]" 1
257 1 32 ILE O 1 68 ILE H 2.000 . 2.300 2.229 1.936 2.311 0.011 19 0 "[ . 1 . 2]" 1
258 1 33 ASP H 1 33 ASP HA 3.000 . 3.600 2.943 2.941 2.948 . 0 0 "[ . 1 . 2]" 1
259 1 33 ASP H 1 33 ASP QB 3.000 . 3.600 2.653 2.345 2.979 . 0 0 "[ . 1 . 2]" 1
260 1 33 ASP H 1 34 LEU H 4.000 . 5.200 4.464 4.393 4.514 . 0 0 "[ . 1 . 2]" 1
261 1 33 ASP H 1 34 LEU HA 5.800 . 7.000 5.385 5.238 5.479 . 0 0 "[ . 1 . 2]" 1
262 1 33 ASP H 1 36 GLU H 3.200 . 3.700 3.404 3.094 3.628 . 0 0 "[ . 1 . 2]" 1
263 1 33 ASP H 1 36 GLU HA 4.800 . 5.800 5.098 4.753 5.424 . 0 0 "[ . 1 . 2]" 1
264 1 33 ASP H 1 36 GLU QB 3.000 . 3.600 2.258 1.972 2.528 . 0 0 "[ . 1 . 2]" 1
265 1 33 ASP HA 1 34 LEU H 2.500 . 2.800 2.571 2.454 2.678 . 0 0 "[ . 1 . 2]" 1
266 1 33 ASP HA 1 34 LEU HA 4.800 . 5.800 4.303 4.295 4.317 . 0 0 "[ . 1 . 2]" 1
267 1 33 ASP HA 1 34 LEU QB 5.800 . 7.000 4.575 4.314 4.868 . 0 0 "[ . 1 . 2]" 1
268 1 33 ASP HA 1 35 GLU H 4.800 . 5.800 4.413 4.292 4.548 . 0 0 "[ . 1 . 2]" 1
269 1 33 ASP HA 1 36 GLU H 4.800 . 5.800 4.809 4.463 5.170 . 0 0 "[ . 1 . 2]" 1
270 1 33 ASP HA 1 57 MET ME 3.000 . 3.600 2.633 1.959 2.888 . 0 0 "[ . 1 . 2]" 1
271 1 33 ASP HA 1 67 ARG HA 3.000 . 3.600 3.064 2.766 3.456 . 0 0 "[ . 1 . 2]" 1
272 1 33 ASP HA 1 67 ARG QB 3.800 . 4.600 3.896 3.712 4.033 . 0 0 "[ . 1 . 2]" 1
273 1 33 ASP HA 1 67 ARG QD 3.800 . 4.600 3.279 2.078 4.036 . 0 0 "[ . 1 . 2]" 1
274 1 33 ASP HA 1 67 ARG QG 4.800 . 5.800 3.003 2.423 3.695 . 0 0 "[ . 1 . 2]" 1
275 1 33 ASP HA 1 68 ILE H 3.800 . 4.600 4.254 4.022 4.397 . 0 0 "[ . 1 . 2]" 1
276 1 33 ASP QB 1 34 LEU H 3.000 . 3.600 2.424 1.976 2.909 . 0 0 "[ . 1 . 2]" 1
277 1 33 ASP QB 1 35 GLU H 3.800 . 4.600 2.589 2.362 2.920 . 0 0 "[ . 1 . 2]" 1
278 1 33 ASP QB 1 36 GLU H 3.800 . 4.600 3.283 2.646 4.019 . 0 0 "[ . 1 . 2]" 1
279 1 34 LEU H 1 34 LEU HA 2.500 . 2.800 2.810 2.770 2.851 0.051 15 0 "[ . 1 . 2]" 1
280 1 34 LEU H 1 34 LEU QB 3.000 . 3.600 2.267 2.028 2.727 . 0 0 "[ . 1 . 2]" 1
281 1 34 LEU H 1 35 GLU H 2.500 . 2.800 2.647 2.485 2.806 0.006 17 0 "[ . 1 . 2]" 1
282 1 34 LEU H 1 57 MET ME 4.800 . 5.800 3.821 3.258 4.349 . 0 0 "[ . 1 . 2]" 1
283 1 34 LEU HA 1 35 GLU H 3.800 . 4.600 3.504 3.461 3.544 . 0 0 "[ . 1 . 2]" 1
284 1 34 LEU HA 1 35 GLU HA 4.800 . 5.800 4.765 4.723 4.817 . 0 0 "[ . 1 . 2]" 1
285 1 34 LEU HA 1 53 ILE MG 4.800 . 5.800 3.543 2.644 4.718 . 0 0 "[ . 1 . 2]" 1
286 1 34 LEU HA 1 57 MET QG 4.800 . 5.800 3.672 2.786 5.101 . 0 0 "[ . 1 . 2]" 1
287 1 34 LEU QB 1 35 GLU H 3.000 . 3.600 2.806 2.561 3.222 . 0 0 "[ . 1 . 2]" 1
288 1 34 LEU QB 1 54 GLU HA 4.800 . 5.800 4.752 3.848 5.132 . 0 0 "[ . 1 . 2]" 1
289 1 34 LEU QB 1 57 MET QG 5.800 . 7.000 4.254 3.119 5.378 . 0 0 "[ . 1 . 2]" 1
290 1 34 LEU QD 1 57 MET QG 4.800 . 5.800 2.454 1.849 3.442 . 0 0 "[ . 1 . 2]" 1
291 1 35 GLU H 1 35 GLU HA 3.000 . 3.600 2.836 2.802 2.865 . 0 0 "[ . 1 . 2]" 1
292 1 35 GLU H 1 35 GLU QB 3.000 . 3.600 2.188 2.038 2.502 . 0 0 "[ . 1 . 2]" 1
293 1 35 GLU H 1 36 GLU H 2.500 . 2.800 2.646 2.459 2.808 0.008 12 0 "[ . 1 . 2]" 1
294 1 35 GLU H 1 36 GLU HA 4.800 . 5.800 5.250 5.105 5.368 . 0 0 "[ . 1 . 2]" 1
295 1 35 GLU H 1 37 LEU H 4.000 . 5.200 4.291 3.974 4.643 . 0 0 "[ . 1 . 2]" 1
296 1 35 GLU HA 1 36 GLU H 3.800 . 4.600 3.529 3.442 3.573 . 0 0 "[ . 1 . 2]" 1
297 1 35 GLU HA 1 36 GLU HA 4.800 . 5.800 4.749 4.642 4.814 . 0 0 "[ . 1 . 2]" 1
298 1 35 GLU QB 1 36 GLU H 3.000 . 3.600 2.616 2.164 3.074 . 0 0 "[ . 1 . 2]" 1
299 1 36 GLU H 1 36 GLU HA 3.000 . 3.600 2.832 2.769 2.911 . 0 0 "[ . 1 . 2]" 1
300 1 36 GLU H 1 36 GLU QB 3.000 . 3.600 2.197 2.072 2.364 . 0 0 "[ . 1 . 2]" 1
301 1 36 GLU H 1 37 LEU H 2.500 . 2.800 2.700 2.324 2.827 0.027 14 0 "[ . 1 . 2]" 1
302 1 36 GLU H 1 38 LYS H 4.000 . 5.200 3.904 3.671 4.205 . 0 0 "[ . 1 . 2]" 1
303 1 36 GLU HA 1 36 GLU QG 3.000 . 3.600 2.193 2.036 2.457 . 0 0 "[ . 1 . 2]" 1
304 1 36 GLU HA 1 38 LYS H 4.800 . 5.800 3.996 3.789 4.472 . 0 0 "[ . 1 . 2]" 1
305 1 36 GLU HA 1 38 LYS HA 6.800 . 8.200 6.402 6.233 6.704 . 0 0 "[ . 1 . 2]" 1
306 1 36 GLU HA 1 39 ILE H 3.800 . 4.400 3.431 3.134 3.753 . 0 0 "[ . 1 . 2]" 1
307 1 36 GLU HA 1 39 ILE HA 5.800 . 7.000 5.505 5.003 6.050 . 0 0 "[ . 1 . 2]" 1
308 1 36 GLU HA 1 39 ILE MD 3.800 . 4.600 2.212 1.820 3.618 . 0 0 "[ . 1 . 2]" 1
309 1 36 GLU HA 1 39 ILE QG 3.800 . 4.600 2.705 1.985 3.758 . 0 0 "[ . 1 . 2]" 1
310 1 36 GLU HA 1 40 MET H 4.800 . 5.800 4.649 3.917 5.290 . 0 0 "[ . 1 . 2]" 1
311 1 36 GLU QB 1 37 LEU H 3.000 . 3.600 2.431 2.050 2.675 . 0 0 "[ . 1 . 2]" 1
312 1 37 LEU H 1 37 LEU QB 3.000 . 3.600 2.303 2.172 2.695 . 0 0 "[ . 1 . 2]" 1
313 1 37 LEU H 1 38 LYS H 2.500 . 2.800 2.745 2.494 2.824 0.024 10 0 "[ . 1 . 2]" 1
314 1 37 LEU H 1 39 ILE H 4.000 . 5.200 4.226 4.023 4.734 . 0 0 "[ . 1 . 2]" 1
315 1 37 LEU H 1 40 MET H 4.800 . 5.800 5.220 4.704 5.606 . 0 0 "[ . 1 . 2]" 1
316 1 37 LEU QB 1 53 ILE MG 3.800 . 4.600 2.641 1.734 3.239 0.066 13 0 "[ . 1 . 2]" 1
317 1 37 LEU QD 1 40 MET ME 4.800 . 5.800 2.659 1.919 3.423 . 0 0 "[ . 1 . 2]" 1
318 1 37 LEU MD2 1 57 MET ME 3.800 . 4.600 2.767 2.086 3.092 . 0 0 "[ . 1 . 2]" 1
319 1 37 LEU HG 1 39 ILE H 4.800 . 5.800 5.585 5.006 5.825 0.025 20 0 "[ . 1 . 2]" 1
320 1 37 LEU HG 1 53 ILE MG 3.800 . 4.600 2.957 1.963 3.913 . 0 0 "[ . 1 . 2]" 1
321 1 38 LYS H 1 39 ILE H 2.500 . 2.800 2.522 2.307 2.760 . 0 0 "[ . 1 . 2]" 1
322 1 38 LYS HA 1 39 ILE H 3.800 . 4.600 3.468 3.334 3.574 . 0 0 "[ . 1 . 2]" 1
323 1 38 LYS HA 1 53 ILE MG 4.800 . 5.800 2.853 1.939 4.098 . 0 0 "[ . 1 . 2]" 1
324 1 39 ILE H 1 39 ILE HA 3.000 . 3.600 2.854 2.778 2.911 . 0 0 "[ . 1 . 2]" 1
325 1 39 ILE H 1 39 ILE HB 3.000 . 3.600 2.714 2.570 3.611 0.011 18 0 "[ . 1 . 2]" 1
326 1 39 ILE H 1 39 ILE QG 3.000 . 3.600 2.037 1.917 2.255 . 0 0 "[ . 1 . 2]" 1
327 1 39 ILE H 1 40 MET H 2.500 . 2.800 2.626 2.348 2.810 0.010 19 0 "[ . 1 . 2]" 1
328 1 39 ILE H 1 42 GLN H 4.800 . 5.800 4.719 4.469 5.102 . 0 0 "[ . 1 . 2]" 1
329 1 39 ILE H 1 42 GLN QG 4.800 . 5.800 4.613 4.020 5.079 . 0 0 "[ . 1 . 2]" 1
330 1 39 ILE HA 1 39 ILE QG 3.000 . 3.600 2.133 2.084 2.259 . 0 0 "[ . 1 . 2]" 1
331 1 39 ILE HA 1 40 MET H 3.800 . 4.600 3.554 3.491 3.577 . 0 0 "[ . 1 . 2]" 1
332 1 39 ILE HA 1 40 MET QB 5.800 . 7.000 5.323 5.136 5.580 . 0 0 "[ . 1 . 2]" 1
333 1 39 ILE HA 1 41 LEU H 4.800 . 5.800 4.136 3.892 4.700 . 0 0 "[ . 1 . 2]" 1
334 1 39 ILE HA 1 42 GLN H 3.800 . 4.600 3.407 3.101 3.641 . 0 0 "[ . 1 . 2]" 1
335 1 39 ILE HA 1 42 GLN HA 4.800 . 5.800 5.446 4.977 5.818 0.018 13 0 "[ . 1 . 2]" 1
336 1 39 ILE HA 1 43 ALA H 4.800 . 5.800 4.257 3.309 5.299 . 0 0 "[ . 1 . 2]" 1
337 1 39 ILE HB 1 40 MET H 3.000 . 3.600 2.485 2.015 3.610 0.010 9 0 "[ . 1 . 2]" 1
338 1 40 MET H 1 40 MET HA 3.000 . 3.600 2.782 2.748 2.839 . 0 0 "[ . 1 . 2]" 1
339 1 40 MET H 1 41 LEU H 2.500 . 2.800 2.739 2.560 2.864 0.064 3 0 "[ . 1 . 2]" 1
340 1 40 MET HA 1 41 LEU H 3.800 . 4.600 3.495 3.437 3.564 . 0 0 "[ . 1 . 2]" 1
341 1 40 MET ME 1 41 LEU QB 4.800 . 5.800 3.513 1.799 4.275 0.001 14 0 "[ . 1 . 2]" 1
342 1 40 MET ME 1 41 LEU MD1 4.800 . 5.800 2.998 1.807 4.094 . 0 0 "[ . 1 . 2]" 1
343 1 40 MET ME 1 44 THR MG 4.800 . 5.800 3.728 3.133 3.969 . 0 0 "[ . 1 . 2]" 1
344 1 41 LEU H 1 41 LEU HA 3.000 . 3.600 2.868 2.825 2.920 . 0 0 "[ . 1 . 2]" 1
345 1 41 LEU H 1 41 LEU QB 3.000 . 3.600 2.296 2.074 3.057 . 0 0 "[ . 1 . 2]" 1
346 1 41 LEU H 1 42 GLN H 2.500 . 2.800 2.490 2.283 2.631 . 0 0 "[ . 1 . 2]" 1
347 1 41 LEU H 1 42 GLN HA 4.800 . 5.800 5.121 4.901 5.244 . 0 0 "[ . 1 . 2]" 1
348 1 41 LEU H 1 48 ILE HB 5.800 . 7.000 6.397 5.414 7.018 0.018 14 0 "[ . 1 . 2]" 1
349 1 41 LEU HA 1 44 THR H 3.000 . 3.600 3.597 3.442 3.632 0.032 19 0 "[ . 1 . 2]" 1
350 1 41 LEU QB 1 48 ILE MG 4.800 . 5.800 3.592 2.204 4.222 . 0 0 "[ . 1 . 2]" 1
351 1 42 GLN H 1 42 GLN HA 3.000 . 3.600 2.829 2.794 2.878 . 0 0 "[ . 1 . 2]" 1
352 1 42 GLN H 1 42 GLN QB 3.000 . 3.600 2.361 2.089 2.639 . 0 0 "[ . 1 . 2]" 1
353 1 42 GLN H 1 42 GLN QG 3.800 . 4.600 2.466 1.928 3.153 . 0 0 "[ . 1 . 2]" 1
354 1 42 GLN H 1 43 ALA H 2.500 . 2.800 2.587 2.494 2.719 . 0 0 "[ . 1 . 2]" 1
355 1 42 GLN H 1 43 ALA HA 4.800 . 5.800 5.192 5.116 5.311 . 0 0 "[ . 1 . 2]" 1
356 1 42 GLN H 1 44 THR H 4.000 . 5.200 4.080 3.844 4.252 . 0 0 "[ . 1 . 2]" 1
357 1 42 GLN HA 1 42 GLN QG 3.000 . 3.600 2.690 2.092 3.333 . 0 0 "[ . 1 . 2]" 1
358 1 42 GLN HA 1 43 ALA H 3.800 . 4.600 3.497 3.461 3.543 . 0 0 "[ . 1 . 2]" 1
359 1 42 GLN HA 1 43 ALA HA 4.800 . 5.800 4.798 4.698 4.853 . 0 0 "[ . 1 . 2]" 1
360 1 42 GLN HA 1 44 THR H 3.800 . 4.600 3.846 3.633 4.078 . 0 0 "[ . 1 . 2]" 1
361 1 42 GLN QB 1 43 ALA H 3.000 . 3.600 3.027 2.822 3.332 . 0 0 "[ . 1 . 2]" 1
362 1 42 GLN QB 1 44 THR H 4.800 . 5.800 4.652 4.474 4.903 . 0 0 "[ . 1 . 2]" 1
363 1 43 ALA H 1 43 ALA HA 3.000 . 3.600 2.816 2.771 2.884 . 0 0 "[ . 1 . 2]" 1
364 1 43 ALA H 1 43 ALA MB 3.000 . 3.600 2.144 2.018 2.255 . 0 0 "[ . 1 . 2]" 1
365 1 43 ALA H 1 44 THR H 2.500 . 2.800 2.637 2.491 2.757 . 0 0 "[ . 1 . 2]" 1
366 1 43 ALA HA 1 44 THR H 3.800 . 4.600 3.455 3.333 3.506 . 0 0 "[ . 1 . 2]" 1
367 1 43 ALA MB 1 44 THR HA 4.800 . 5.800 3.876 3.753 4.073 . 0 0 "[ . 1 . 2]" 1
368 1 43 ALA MB 1 44 THR MG 4.800 . 5.800 3.413 3.210 3.700 . 0 0 "[ . 1 . 2]" 1
369 1 44 THR H 1 44 THR HA 3.000 . 3.600 2.840 2.785 2.941 . 0 0 "[ . 1 . 2]" 1
370 1 44 THR H 1 44 THR HB 3.000 . 3.600 3.556 3.066 3.607 0.007 20 0 "[ . 1 . 2]" 1
371 1 44 THR H 1 44 THR MG 3.800 . 4.600 2.190 1.935 3.037 . 0 0 "[ . 1 . 2]" 1
372 1 44 THR H 1 45 GLY H 4.000 . 5.200 4.540 4.122 4.616 . 0 0 "[ . 1 . 2]" 1
373 1 44 THR H 1 45 GLY QA 4.800 . 6.800 5.151 4.484 5.316 . 0 0 "[ . 1 . 2]" 1
374 1 44 THR HA 1 44 THR HB 3.000 . 3.600 2.433 2.355 2.662 . 0 0 "[ . 1 . 2]" 1
375 1 44 THR HA 1 44 THR HG1 3.800 . 4.600 3.764 3.029 4.067 . 0 0 "[ . 1 . 2]" 1
376 1 44 THR HA 1 44 THR MG 3.000 . 3.600 2.482 2.114 3.200 . 0 0 "[ . 1 . 2]" 1
377 1 44 THR HA 1 45 GLY H 2.500 . 2.800 2.551 2.166 2.727 . 0 0 "[ . 1 . 2]" 1
378 1 44 THR HA 1 45 GLY QA 4.800 . 5.800 3.942 3.898 3.975 . 0 0 "[ . 1 . 2]" 1
379 1 44 THR HA 1 46 GLU H 3.800 . 4.600 4.172 3.574 4.408 . 0 0 "[ . 1 . 2]" 1
380 1 44 THR HB 1 45 GLY H 3.800 . 4.600 2.314 2.004 4.426 . 0 0 "[ . 1 . 2]" 1
381 1 44 THR HB 1 46 GLU H 3.800 . 4.600 2.894 2.188 4.506 . 0 0 "[ . 1 . 2]" 1
382 1 44 THR MG 1 45 GLY H 4.800 . 5.800 3.695 3.202 4.161 . 0 0 "[ . 1 . 2]" 1
383 1 44 THR MG 1 46 GLU H 4.800 . 5.800 4.050 3.311 4.185 . 0 0 "[ . 1 . 2]" 1
384 1 44 THR MG 1 48 ILE MD 5.800 . 7.000 4.153 2.838 4.722 . 0 0 "[ . 1 . 2]" 1
385 1 45 GLY H 1 46 GLU QG 3.800 . 4.600 3.456 3.073 3.929 . 0 0 "[ . 1 . 2]" 1
386 1 45 GLY QA 1 46 GLU H 3.000 . 3.600 2.905 2.826 2.930 . 0 0 "[ . 1 . 2]" 1
387 1 45 GLY QA 1 46 GLU HA 4.800 . 5.800 4.021 4.003 4.090 . 0 0 "[ . 1 . 2]" 1
388 1 46 GLU H 1 46 GLU HA 3.000 . 3.600 2.932 2.865 2.946 . 0 0 "[ . 1 . 2]" 1
389 1 46 GLU H 1 46 GLU QB 3.000 . 3.600 2.685 2.386 3.037 . 0 0 "[ . 1 . 2]" 1
390 1 46 GLU H 1 46 GLU QG 3.000 . 3.600 2.442 1.934 3.169 . 0 0 "[ . 1 . 2]" 1
391 1 46 GLU H 1 47 THR H 4.000 . 5.200 4.352 1.906 4.618 . 0 0 "[ . 1 . 2]" 1
392 1 46 GLU HA 1 46 GLU QG 3.000 . 3.600 2.826 2.304 3.333 . 0 0 "[ . 1 . 2]" 1
393 1 46 GLU HA 1 47 THR H 3.000 . 3.600 2.594 2.329 3.378 . 0 0 "[ . 1 . 2]" 1
394 1 46 GLU HA 1 47 THR MG 4.800 . 5.800 3.742 3.233 4.458 . 0 0 "[ . 1 . 2]" 1
395 1 46 GLU HA 1 48 ILE H 5.800 . 7.000 6.079 5.393 6.880 . 0 0 "[ . 1 . 2]" 1
396 1 46 GLU QB 1 47 THR H 3.000 . 3.600 2.173 1.951 3.213 . 0 0 "[ . 1 . 2]" 1
397 1 46 GLU QG 1 47 THR H 4.800 . 5.800 3.859 3.256 4.453 . 0 0 "[ . 1 . 2]" 1
398 1 47 THR H 1 47 THR HA 3.000 . 3.600 2.943 2.922 2.949 . 0 0 "[ . 1 . 2]" 1
399 1 47 THR H 1 47 THR MG 3.800 . 4.600 2.877 1.944 3.330 . 0 0 "[ . 1 . 2]" 1
400 1 47 THR H 1 48 ILE H 4.000 . 5.200 4.289 4.026 4.480 . 0 0 "[ . 1 . 2]" 1
401 1 47 THR HA 1 47 THR MG 3.000 . 3.600 2.392 2.117 3.174 . 0 0 "[ . 1 . 2]" 1
402 1 47 THR HA 1 48 ILE H 2.500 . 2.800 2.186 2.138 2.790 . 0 0 "[ . 1 . 2]" 1
403 1 47 THR HA 1 48 ILE HA 4.800 . 5.800 4.395 4.352 4.407 . 0 0 "[ . 1 . 2]" 1
404 1 47 THR HA 1 48 ILE HB 4.800 . 5.800 4.813 4.599 5.477 . 0 0 "[ . 1 . 2]" 1
405 1 48 ILE H 1 48 ILE HB 3.000 . 3.600 2.768 2.665 2.857 . 0 0 "[ . 1 . 2]" 1
406 1 48 ILE H 1 48 ILE QG 3.800 . 4.600 2.705 2.225 3.218 . 0 0 "[ . 1 . 2]" 1
407 1 48 ILE H 1 49 THR H 5.800 . 7.000 4.419 4.201 4.554 . 0 0 "[ . 1 . 2]" 1
408 1 48 ILE HA 1 49 THR HA 4.800 . 5.800 4.358 4.339 4.386 . 0 0 "[ . 1 . 2]" 1
409 1 48 ILE HB 1 49 THR H 3.800 . 4.600 3.905 3.541 4.159 . 0 0 "[ . 1 . 2]" 1
410 1 48 ILE HB 1 53 ILE H 4.800 . 5.800 5.579 4.679 5.803 0.003 17 0 "[ . 1 . 2]" 1
411 1 48 ILE MG 1 50 GLU HA 5.800 . 7.000 4.601 4.408 4.782 . 0 0 "[ . 1 . 2]" 1
412 1 48 ILE MG 1 52 ASP HA 5.800 . 7.000 4.479 3.865 5.227 . 0 0 "[ . 1 . 2]" 1
413 1 48 ILE MG 1 52 ASP QB 4.800 . 5.800 2.087 1.689 2.739 0.111 14 0 "[ . 1 . 2]" 1
414 1 49 THR H 1 49 THR HA 3.000 . 3.600 2.897 2.869 2.926 . 0 0 "[ . 1 . 2]" 1
415 1 49 THR H 1 49 THR MG 3.800 . 4.600 2.507 1.926 3.778 . 0 0 "[ . 1 . 2]" 1
416 1 49 THR H 1 50 GLU H 4.800 . 5.800 4.556 4.454 4.607 . 0 0 "[ . 1 . 2]" 1
417 1 49 THR H 1 51 ASP H 4.800 . 5.800 4.938 4.052 5.402 . 0 0 "[ . 1 . 2]" 1
418 1 49 THR H 1 52 ASP HA 5.800 . 7.000 5.869 5.516 6.308 . 0 0 "[ . 1 . 2]" 1
419 1 49 THR H 1 52 ASP QB 3.800 . 4.600 3.043 2.628 3.600 . 0 0 "[ . 1 . 2]" 1
420 1 49 THR H 1 53 ILE H 4.800 . 5.800 4.960 4.655 5.348 . 0 0 "[ . 1 . 2]" 1
421 1 49 THR HA 1 50 GLU H 2.500 . 2.800 2.490 2.367 2.645 . 0 0 "[ . 1 . 2]" 1
422 1 49 THR HA 1 50 GLU HA 4.800 . 5.800 4.308 4.292 4.334 . 0 0 "[ . 1 . 2]" 1
423 1 49 THR HA 1 50 GLU QB 4.800 . 5.800 4.370 4.143 4.766 . 0 0 "[ . 1 . 2]" 1
424 1 49 THR HA 1 52 ASP H 4.800 . 5.800 5.041 4.786 5.473 . 0 0 "[ . 1 . 2]" 1
425 1 49 THR HA 1 53 ILE H 4.800 . 5.800 5.673 5.279 5.825 0.025 3 0 "[ . 1 . 2]" 1
426 1 49 THR MG 1 50 GLU H 4.800 . 5.800 3.113 1.927 3.664 . 0 0 "[ . 1 . 2]" 1
427 1 50 GLU H 1 50 GLU HA 3.000 . 3.600 2.841 2.762 2.895 . 0 0 "[ . 1 . 2]" 1
428 1 50 GLU H 1 50 GLU QB 3.000 . 3.600 2.296 2.061 2.710 . 0 0 "[ . 1 . 2]" 1
429 1 50 GLU H 1 50 GLU QG 3.800 . 4.600 3.122 1.948 3.991 . 0 0 "[ . 1 . 2]" 1
430 1 50 GLU H 1 51 ASP H 2.500 . 2.800 2.559 2.377 2.785 . 0 0 "[ . 1 . 2]" 1
431 1 50 GLU H 1 52 ASP H 4.800 . 5.800 4.501 4.072 4.975 . 0 0 "[ . 1 . 2]" 1
432 1 50 GLU HA 1 51 ASP H 3.800 . 4.600 3.472 3.184 3.543 . 0 0 "[ . 1 . 2]" 1
433 1 50 GLU HA 1 51 ASP HA 4.800 . 5.800 4.799 4.626 4.853 . 0 0 "[ . 1 . 2]" 1
434 1 50 GLU HA 1 52 ASP H 4.800 . 5.800 4.599 4.307 4.961 . 0 0 "[ . 1 . 2]" 1
435 1 50 GLU HA 1 53 ILE H 3.800 . 4.600 3.508 3.324 3.658 . 0 0 "[ . 1 . 2]" 1
436 1 50 GLU HA 1 53 ILE HA 5.800 . 7.000 5.489 5.258 5.788 . 0 0 "[ . 1 . 2]" 1
437 1 50 GLU HA 1 53 ILE MG 4.800 . 5.800 4.235 3.863 4.578 . 0 0 "[ . 1 . 2]" 1
438 1 51 ASP H 1 51 ASP HA 3.000 . 3.600 2.817 2.776 2.912 . 0 0 "[ . 1 . 2]" 1
439 1 51 ASP H 1 52 ASP H 2.500 . 2.800 2.746 2.418 2.830 0.030 14 0 "[ . 1 . 2]" 1
440 1 51 ASP H 1 52 ASP HA 4.800 . 5.800 5.323 5.040 5.377 . 0 0 "[ . 1 . 2]" 1
441 1 51 ASP H 1 52 ASP QB 5.800 . 7.000 4.470 4.117 4.602 . 0 0 "[ . 1 . 2]" 1
442 1 51 ASP H 1 53 ILE H 4.000 . 5.200 4.030 3.445 4.230 . 0 0 "[ . 1 . 2]" 1
443 1 51 ASP H 1 53 ILE HB 4.800 . 5.800 5.273 4.751 5.504 . 0 0 "[ . 1 . 2]" 1
444 1 51 ASP H 1 54 GLU H 4.800 . 5.800 4.756 4.476 5.040 . 0 0 "[ . 1 . 2]" 1
445 1 51 ASP HA 1 52 ASP H 3.800 . 4.600 3.559 3.537 3.575 . 0 0 "[ . 1 . 2]" 1
446 1 51 ASP HA 1 53 ILE H 4.800 . 5.800 4.293 4.073 4.508 . 0 0 "[ . 1 . 2]" 1
447 1 51 ASP HA 1 54 GLU H 3.800 . 4.600 3.501 3.273 3.977 . 0 0 "[ . 1 . 2]" 1
448 1 51 ASP HA 1 55 GLU H 4.800 . 5.800 4.260 3.764 4.695 . 0 0 "[ . 1 . 2]" 1
449 1 51 ASP QB 1 52 ASP H 3.000 . 3.600 2.438 2.219 2.643 . 0 0 "[ . 1 . 2]" 1
450 1 51 ASP QB 1 52 ASP HA 4.800 . 5.800 3.774 3.676 3.870 . 0 0 "[ . 1 . 2]" 1
451 1 52 ASP H 1 52 ASP HA 3.000 . 3.600 2.785 2.757 2.834 . 0 0 "[ . 1 . 2]" 1
452 1 52 ASP H 1 52 ASP QB 3.000 . 3.600 2.197 2.063 2.344 . 0 0 "[ . 1 . 2]" 1
453 1 52 ASP H 1 53 ILE H 2.500 . 2.800 2.732 2.564 2.812 0.012 7 0 "[ . 1 . 2]" 1
454 1 52 ASP HA 1 53 ILE H 3.800 . 4.600 3.520 3.486 3.545 . 0 0 "[ . 1 . 2]" 1
455 1 52 ASP HA 1 53 ILE HA 4.800 . 5.800 4.757 4.669 4.822 . 0 0 "[ . 1 . 2]" 1
456 1 52 ASP HA 1 54 GLU H 4.800 . 5.800 4.465 3.902 5.095 . 0 0 "[ . 1 . 2]" 1
457 1 52 ASP HA 1 54 GLU HA 5.800 . 7.000 6.697 6.371 7.005 0.005 15 0 "[ . 1 . 2]" 1
458 1 52 ASP HA 1 55 GLU H 3.800 . 4.600 3.672 3.349 3.991 . 0 0 "[ . 1 . 2]" 1
459 1 52 ASP HA 1 55 GLU HA 5.800 . 7.000 5.730 5.248 6.241 . 0 0 "[ . 1 . 2]" 1
460 1 52 ASP QB 1 53 ILE H 3.000 . 3.600 2.728 2.491 2.913 . 0 0 "[ . 1 . 2]" 1
461 1 53 ILE H 1 53 ILE HA 3.000 . 3.600 2.841 2.789 2.897 . 0 0 "[ . 1 . 2]" 1
462 1 53 ILE H 1 53 ILE HB 3.000 . 3.600 2.612 2.521 2.668 . 0 0 "[ . 1 . 2]" 1
463 1 53 ILE H 1 54 GLU H 2.500 . 2.800 2.612 2.401 2.802 0.002 14 0 "[ . 1 . 2]" 1
464 1 53 ILE H 1 54 GLU HA 5.800 . 7.000 5.215 4.976 5.357 . 0 0 "[ . 1 . 2]" 1
465 1 53 ILE H 1 55 GLU H 4.800 . 5.800 4.151 3.735 4.590 . 0 0 "[ . 1 . 2]" 1
466 1 53 ILE HA 1 53 ILE QG 3.000 . 3.600 2.163 2.079 2.302 . 0 0 "[ . 1 . 2]" 1
467 1 53 ILE HA 1 54 GLU H 3.800 . 4.600 3.525 3.381 3.577 . 0 0 "[ . 1 . 2]" 1
468 1 53 ILE HA 1 54 GLU HA 4.800 . 5.800 4.780 4.657 4.860 . 0 0 "[ . 1 . 2]" 1
469 1 53 ILE HA 1 56 LEU H 3.800 . 4.600 3.574 3.141 3.812 . 0 0 "[ . 1 . 2]" 1
470 1 53 ILE HA 1 56 LEU MD1 3.800 . 4.600 2.950 2.146 3.522 . 0 0 "[ . 1 . 2]" 1
471 1 53 ILE HA 1 57 MET H 4.800 . 5.800 4.901 4.280 5.563 . 0 0 "[ . 1 . 2]" 1
472 1 53 ILE HB 1 54 GLU H 3.000 . 3.600 2.639 2.170 3.315 . 0 0 "[ . 1 . 2]" 1
473 1 53 ILE MG 1 54 GLU H 4.800 . 5.800 3.594 3.104 4.057 . 0 0 "[ . 1 . 2]" 1
474 1 53 ILE MG 1 54 GLU HA 4.800 . 5.800 3.660 3.292 4.032 . 0 0 "[ . 1 . 2]" 1
475 1 54 GLU H 1 54 GLU HA 3.000 . 3.600 2.818 2.741 2.904 . 0 0 "[ . 1 . 2]" 1
476 1 54 GLU H 1 55 GLU H 2.500 . 2.800 2.663 2.320 2.816 0.016 14 0 "[ . 1 . 2]" 1
477 1 54 GLU HA 1 57 MET H 3.800 . 4.600 3.702 3.249 4.352 . 0 0 "[ . 1 . 2]" 1
478 1 54 GLU QB 1 55 GLU H 3.000 . 3.600 2.664 2.299 2.999 . 0 0 "[ . 1 . 2]" 1
479 1 55 GLU H 1 55 GLU HA 3.000 . 3.600 2.835 2.790 2.927 . 0 0 "[ . 1 . 2]" 1
480 1 55 GLU H 1 55 GLU QG 3.000 . 3.600 2.402 1.952 3.114 . 0 0 "[ . 1 . 2]" 1
481 1 55 GLU H 1 56 LEU H 2.500 . 2.800 2.616 2.387 2.730 . 0 0 "[ . 1 . 2]" 1
482 1 55 GLU H 1 57 MET H 4.000 . 5.200 4.314 3.921 4.743 . 0 0 "[ . 1 . 2]" 1
483 1 55 GLU HA 1 56 LEU H 3.800 . 4.600 3.428 2.996 3.545 . 0 0 "[ . 1 . 2]" 1
484 1 55 GLU HA 1 56 LEU HA 4.800 . 5.800 4.777 4.554 4.854 . 0 0 "[ . 1 . 2]" 1
485 1 55 GLU QB 1 56 LEU H 3.800 . 4.600 3.357 2.602 4.019 . 0 0 "[ . 1 . 2]" 1
486 1 56 LEU H 1 56 LEU HA 3.000 . 3.600 2.825 2.783 2.934 . 0 0 "[ . 1 . 2]" 1
487 1 56 LEU H 1 56 LEU QB 3.000 . 3.600 2.098 2.028 2.338 . 0 0 "[ . 1 . 2]" 1
488 1 56 LEU H 1 56 LEU QD 4.800 . 5.800 3.264 2.286 3.821 . 0 0 "[ . 1 . 2]" 1
489 1 56 LEU H 1 57 MET H 2.500 . 2.800 2.584 2.091 2.806 0.006 18 0 "[ . 1 . 2]" 1
490 1 56 LEU H 1 59 ASP H 4.800 . 5.800 4.896 4.682 5.131 . 0 0 "[ . 1 . 2]" 1
491 1 56 LEU HA 1 57 MET H 3.800 . 4.600 3.510 3.485 3.554 . 0 0 "[ . 1 . 2]" 1
492 1 56 LEU HA 1 57 MET HA 4.800 . 5.800 4.749 4.677 4.846 . 0 0 "[ . 1 . 2]" 1
493 1 56 LEU QB 1 57 MET H 3.000 . 3.600 2.763 2.570 2.897 . 0 0 "[ . 1 . 2]" 1
494 1 57 MET H 1 57 MET HA 3.000 . 3.600 2.845 2.788 2.893 . 0 0 "[ . 1 . 2]" 1
495 1 57 MET H 1 57 MET QB 3.000 . 3.600 2.270 2.050 2.617 . 0 0 "[ . 1 . 2]" 1
496 1 57 MET H 1 58 LYS H 2.500 . 2.800 2.571 2.370 2.808 0.008 1 0 "[ . 1 . 2]" 1
497 1 57 MET H 1 58 LYS QB 4.800 . 5.800 4.289 4.100 4.571 . 0 0 "[ . 1 . 2]" 1
498 1 57 MET H 1 59 ASP H 4.800 . 5.800 3.960 3.771 4.315 . 0 0 "[ . 1 . 2]" 1
499 1 57 MET H 1 60 GLY H 4.800 . 5.800 5.048 4.724 5.325 . 0 0 "[ . 1 . 2]" 1
500 1 57 MET HA 1 57 MET ME 3.800 . 4.600 3.024 2.024 3.764 . 0 0 "[ . 1 . 2]" 1
501 1 57 MET HA 1 57 MET QG 3.000 . 3.600 2.448 2.072 3.144 . 0 0 "[ . 1 . 2]" 1
502 1 57 MET HA 1 58 LYS H 3.800 . 4.600 3.528 3.454 3.566 . 0 0 "[ . 1 . 2]" 1
503 1 57 MET HA 1 58 LYS HA 4.800 . 5.800 4.788 4.733 4.839 . 0 0 "[ . 1 . 2]" 1
504 1 57 MET HA 1 60 GLY H 3.800 . 4.600 3.503 3.076 3.738 . 0 0 "[ . 1 . 2]" 1
505 1 57 MET HA 1 60 GLY QA 4.800 . 5.800 3.939 3.356 4.529 . 0 0 "[ . 1 . 2]" 1
506 1 57 MET HA 1 61 ASP H 3.800 . 4.600 4.096 3.337 4.609 0.009 16 0 "[ . 1 . 2]" 1
507 1 57 MET HA 1 68 ILE HB 4.800 . 5.800 5.629 5.015 5.813 0.013 17 0 "[ . 1 . 2]" 1
508 1 57 MET HA 1 68 ILE MD 3.800 . 4.600 2.167 1.844 2.511 . 0 0 "[ . 1 . 2]" 1
509 1 57 MET HA 1 76 PHE QE 5.800 . 7.000 3.890 3.119 5.310 . 0 0 "[ . 1 . 2]" 1
510 1 57 MET QB 1 58 LYS H 3.000 . 3.600 2.633 2.390 2.965 . 0 0 "[ . 1 . 2]" 1
511 1 57 MET ME 1 67 ARG HA 3.000 . 3.600 2.561 2.161 2.909 . 0 0 "[ . 1 . 2]" 1
512 1 57 MET ME 1 68 ILE MD 3.800 . 4.600 1.973 1.743 2.351 0.057 7 0 "[ . 1 . 2]" 1
513 1 57 MET ME 1 68 ILE QG 3.000 . 3.600 1.983 1.834 2.119 . 0 0 "[ . 1 . 2]" 1
514 1 57 MET QG 1 68 ILE MD 4.800 . 5.800 3.026 1.962 3.898 . 0 0 "[ . 1 . 2]" 1
515 1 58 LYS H 1 58 LYS HA 3.000 . 3.600 2.814 2.772 2.852 . 0 0 "[ . 1 . 2]" 1
516 1 58 LYS H 1 58 LYS QB 3.000 . 3.600 2.150 2.042 2.269 . 0 0 "[ . 1 . 2]" 1
517 1 58 LYS H 1 59 ASP H 3.200 . 3.700 2.624 2.503 2.766 . 0 0 "[ . 1 . 2]" 1
518 1 58 LYS H 1 59 ASP HA 5.800 . 7.000 5.240 5.121 5.356 . 0 0 "[ . 1 . 2]" 1
519 1 58 LYS HA 1 59 ASP H 3.800 . 4.600 3.483 3.457 3.542 . 0 0 "[ . 1 . 2]" 1
520 1 58 LYS HA 1 61 ASP H 3.800 . 4.600 3.479 3.037 4.083 . 0 0 "[ . 1 . 2]" 1
521 1 58 LYS QB 1 59 ASP H 3.000 . 3.600 2.865 2.551 2.999 . 0 0 "[ . 1 . 2]" 1
522 1 58 LYS QB 1 59 ASP HA 4.800 . 5.800 4.005 3.854 4.304 . 0 0 "[ . 1 . 2]" 1
523 1 58 LYS QG 1 59 ASP H 4.800 . 5.800 4.392 3.857 4.687 . 0 0 "[ . 1 . 2]" 1
524 1 59 ASP H 1 59 ASP HA 3.000 . 3.600 2.891 2.834 2.930 . 0 0 "[ . 1 . 2]" 1
525 1 59 ASP H 1 59 ASP QB 3.000 . 3.600 2.236 2.124 2.449 . 0 0 "[ . 1 . 2]" 1
526 1 59 ASP H 1 60 GLY H 2.500 . 2.800 2.513 2.253 2.705 . 0 0 "[ . 1 . 2]" 1
527 1 59 ASP H 1 60 GLY QA 4.800 . 5.800 4.324 4.166 4.515 . 0 0 "[ . 1 . 2]" 1
528 1 59 ASP H 1 61 ASP H 4.000 . 5.200 4.039 3.814 4.348 . 0 0 "[ . 1 . 2]" 1
529 1 59 ASP H 1 76 PHE QD 5.800 . 7.000 6.067 5.826 6.399 . 0 0 "[ . 1 . 2]" 1
530 1 59 ASP H 1 76 PHE QE 5.800 . 7.000 4.193 3.772 4.826 . 0 0 "[ . 1 . 2]" 1
531 1 59 ASP H 1 76 PHE HZ 4.800 . 5.800 4.025 3.481 4.640 . 0 0 "[ . 1 . 2]" 1
532 1 59 ASP HA 1 60 GLY H 3.800 . 4.600 3.300 3.015 3.419 . 0 0 "[ . 1 . 2]" 1
533 1 59 ASP HA 1 60 GLY QA 4.800 . 5.800 4.221 4.141 4.245 . 0 0 "[ . 1 . 2]" 1
534 1 59 ASP HA 1 61 ASP H 3.800 . 4.600 4.426 3.947 4.627 0.027 4 0 "[ . 1 . 2]" 1
535 1 59 ASP HA 1 62 LYS QD 4.800 . 5.800 5.122 4.940 5.237 . 0 0 "[ . 1 . 2]" 1
536 1 59 ASP HA 1 76 PHE QE 4.800 . 5.800 4.736 3.790 5.389 . 0 0 "[ . 1 . 2]" 1
537 1 59 ASP QB 1 60 GLY H 3.800 . 4.600 3.365 3.138 3.727 . 0 0 "[ . 1 . 2]" 1
538 1 59 ASP QB 1 61 ASP H 5.800 . 7.000 4.991 4.761 5.388 . 0 0 "[ . 1 . 2]" 1
539 1 59 ASP QB 1 76 PHE QD 5.800 . 7.000 4.345 4.000 4.682 . 0 0 "[ . 1 . 2]" 1
540 1 59 ASP QB 1 76 PHE QE 3.800 . 4.600 2.756 1.989 3.303 . 0 0 "[ . 1 . 2]" 1
541 1 59 ASP QB 1 76 PHE HZ 4.800 . 5.800 2.229 1.831 3.332 . 0 0 "[ . 1 . 2]" 1
542 1 60 GLY H 1 60 GLY QA 2.500 . 2.800 2.372 2.367 2.403 . 0 0 "[ . 1 . 2]" 1
543 1 60 GLY H 1 61 ASP H 2.500 . 2.800 1.959 1.888 2.242 . 0 0 "[ . 1 . 2]" 1
544 1 60 GLY H 1 76 PHE QB 5.800 . 7.000 6.019 5.490 6.180 . 0 0 "[ . 1 . 2]" 1
545 1 60 GLY H 1 76 PHE QD 4.800 . 5.800 4.571 4.110 5.117 . 0 0 "[ . 1 . 2]" 1
546 1 60 GLY H 1 76 PHE QE 3.800 . 4.600 3.207 2.583 4.467 . 0 0 "[ . 1 . 2]" 1
547 1 60 GLY H 1 76 PHE HZ 5.800 . 7.000 4.184 3.490 4.741 . 0 0 "[ . 1 . 2]" 1
548 1 60 GLY QA 1 61 ASP H 3.000 . 3.600 2.856 2.740 2.932 . 0 0 "[ . 1 . 2]" 1
549 1 60 GLY QA 1 61 ASP HA 4.800 . 5.800 4.016 3.987 4.055 . 0 0 "[ . 1 . 2]" 1
550 1 60 GLY QA 1 68 ILE MD 3.800 . 4.600 2.399 2.016 2.916 . 0 0 "[ . 1 . 2]" 1
551 1 60 GLY QA 1 68 ILE QG 3.800 . 4.600 3.156 2.840 3.315 . 0 0 "[ . 1 . 2]" 1
552 1 60 GLY QA 1 73 PHE HA 5.800 . 7.000 4.250 3.687 5.419 . 0 0 "[ . 1 . 2]" 1
553 1 60 GLY QA 1 76 PHE HA 4.800 . 5.800 4.242 3.740 4.589 . 0 0 "[ . 1 . 2]" 1
554 1 60 GLY QA 1 76 PHE QD 3.000 . 3.600 2.271 1.796 2.972 0.004 4 0 "[ . 1 . 2]" 1
555 1 60 GLY QA 1 76 PHE QE 4.800 . 5.800 2.200 1.897 3.374 . 0 0 "[ . 1 . 2]" 1
556 1 60 GLY HA3 1 76 PHE QB 4.800 . 5.800 4.049 3.749 4.406 . 0 0 "[ . 1 . 2]" 1
557 1 61 ASP H 1 61 ASP HA 3.000 . 3.600 2.904 2.836 2.947 . 0 0 "[ . 1 . 2]" 1
558 1 61 ASP H 1 61 ASP QB 3.000 . 3.600 2.275 2.084 2.946 . 0 0 "[ . 1 . 2]" 1
559 1 61 ASP H 1 62 LYS H 4.800 . 5.800 4.130 3.887 4.368 . 0 0 "[ . 1 . 2]" 1
560 1 61 ASP H 1 63 ASN H 5.800 . 7.000 5.824 5.452 6.092 . 0 0 "[ . 1 . 2]" 1
561 1 61 ASP HA 1 62 LYS H 2.500 . 2.800 2.206 2.113 2.308 . 0 0 "[ . 1 . 2]" 1
562 1 61 ASP HA 1 62 LYS HA 4.800 . 5.800 4.451 4.374 4.500 . 0 0 "[ . 1 . 2]" 1
563 1 61 ASP HA 1 62 LYS QB 4.800 . 5.800 4.451 4.135 4.636 . 0 0 "[ . 1 . 2]" 1
564 1 61 ASP HA 1 62 LYS QG 4.800 . 5.800 4.269 3.773 5.262 . 0 0 "[ . 1 . 2]" 1
565 1 61 ASP HA 1 68 ILE HA 3.800 . 4.600 3.861 3.405 4.331 . 0 0 "[ . 1 . 2]" 1
566 1 61 ASP HA 1 72 GLU HA 5.800 . 7.000 6.103 5.105 6.941 . 0 0 "[ . 1 . 2]" 1
567 1 61 ASP QB 1 66 GLY H 4.800 . 5.800 3.771 2.863 4.886 . 0 0 "[ . 1 . 2]" 1
568 1 61 ASP OD1 1 66 GLY H 2.850 2.450 3.150 2.403 1.961 2.969 0.489 8 0 "[ . 1 . 2]" 1
569 1 62 LYS H 1 62 LYS HA 3.000 . 3.600 2.874 2.809 2.905 . 0 0 "[ . 1 . 2]" 1
570 1 62 LYS H 1 62 LYS QB 3.000 . 3.600 2.442 2.166 2.624 . 0 0 "[ . 1 . 2]" 1
571 1 62 LYS H 1 63 ASN H 2.500 . 2.800 2.428 2.309 2.646 . 0 0 "[ . 1 . 2]" 1
572 1 62 LYS H 1 63 ASN HA 4.800 . 5.800 5.097 4.998 5.280 . 0 0 "[ . 1 . 2]" 1
573 1 62 LYS H 1 72 GLU HB2 4.800 . 5.800 3.850 2.497 5.202 . 0 0 "[ . 1 . 2]" 1
574 1 62 LYS HA 1 62 LYS QD 3.000 . 3.600 2.192 1.964 3.076 . 0 0 "[ . 1 . 2]" 1
575 1 62 LYS HA 1 62 LYS QG 3.000 . 3.600 2.860 2.287 3.170 . 0 0 "[ . 1 . 2]" 1
576 1 62 LYS HA 1 63 ASN H 3.800 . 4.600 3.501 3.445 3.534 . 0 0 "[ . 1 . 2]" 1
577 1 62 LYS HA 1 64 ASN H 3.800 . 4.600 3.816 3.595 3.953 . 0 0 "[ . 1 . 2]" 1
578 1 62 LYS QB 1 63 ASN H 3.800 . 4.600 2.761 2.604 3.045 . 0 0 "[ . 1 . 2]" 1
579 1 62 LYS QB 1 64 ASN H 4.800 . 5.800 4.453 4.375 4.622 . 0 0 "[ . 1 . 2]" 1
580 1 63 ASN H 1 63 ASN HA 3.000 . 3.600 2.903 2.885 2.945 . 0 0 "[ . 1 . 2]" 1
581 1 63 ASN H 1 63 ASN QB 3.000 . 3.600 2.739 2.277 3.041 . 0 0 "[ . 1 . 2]" 1
582 1 63 ASN H 1 64 ASN H 2.500 . 2.800 2.417 2.274 2.476 . 0 0 "[ . 1 . 2]" 1
583 1 63 ASN H 1 64 ASN HA 3.800 . 4.600 4.594 4.345 4.645 0.045 19 0 "[ . 1 . 2]" 1
584 1 63 ASN H 1 65 ASP H 4.000 . 5.200 3.855 3.510 4.255 . 0 0 "[ . 1 . 2]" 1
585 1 63 ASN HA 1 64 ASN H 3.000 . 3.600 3.302 3.161 3.365 . 0 0 "[ . 1 . 2]" 1
586 1 63 ASN HA 1 64 ASN HA 4.800 . 5.800 5.176 5.083 5.231 . 0 0 "[ . 1 . 2]" 1
587 1 63 ASN HA 1 64 ASN QB 4.800 . 5.800 4.000 3.850 4.578 . 0 0 "[ . 1 . 2]" 1
588 1 63 ASN HA 1 65 ASP H 4.800 . 5.800 4.503 4.348 4.796 . 0 0 "[ . 1 . 2]" 1
589 1 63 ASN QB 1 64 ASN H 3.800 . 4.600 3.753 3.234 3.922 . 0 0 "[ . 1 . 2]" 1
590 1 64 ASN H 1 64 ASN HA 2.500 . 2.800 2.273 2.262 2.284 . 0 0 "[ . 1 . 2]" 1
591 1 64 ASN H 1 65 ASP H 3.200 . 3.700 2.821 2.680 2.953 . 0 0 "[ . 1 . 2]" 1
592 1 64 ASN H 1 66 GLY H 4.800 . 5.800 4.457 4.199 4.690 . 0 0 "[ . 1 . 2]" 1
593 1 64 ASN HA 1 65 ASP H 3.000 . 3.600 2.920 2.742 3.094 . 0 0 "[ . 1 . 2]" 1
594 1 64 ASN HA 1 65 ASP HA 4.800 . 5.800 4.672 4.497 4.777 . 0 0 "[ . 1 . 2]" 1
595 1 64 ASN HA 1 66 GLY H 3.000 . 3.600 3.345 3.000 3.627 0.027 14 0 "[ . 1 . 2]" 1
596 1 64 ASN HA 1 67 ARG H 5.800 . 7.000 5.321 4.744 5.624 . 0 0 "[ . 1 . 2]" 1
597 1 64 ASN QB 1 65 ASP H 4.800 . 5.800 3.804 3.664 4.056 . 0 0 "[ . 1 . 2]" 1
598 1 64 ASN QB 1 66 GLY H 5.800 . 7.000 4.680 4.114 5.034 . 0 0 "[ . 1 . 2]" 1
599 1 65 ASP H 1 65 ASP HA 3.000 . 3.600 2.866 2.811 2.940 . 0 0 "[ . 1 . 2]" 1
600 1 65 ASP H 1 65 ASP QB 3.000 . 3.600 2.529 2.095 2.867 . 0 0 "[ . 1 . 2]" 1
601 1 65 ASP H 1 66 GLY H 2.500 . 2.800 2.516 2.297 2.660 . 0 0 "[ . 1 . 2]" 1
602 1 65 ASP H 1 67 ARG H 4.000 . 5.200 3.753 3.197 4.063 . 0 0 "[ . 1 . 2]" 1
603 1 65 ASP HA 1 66 GLY H 3.800 . 4.600 3.409 3.131 3.520 . 0 0 "[ . 1 . 2]" 1
604 1 65 ASP HA 1 66 GLY QA 4.800 . 5.800 4.193 4.095 4.233 . 0 0 "[ . 1 . 2]" 1
605 1 65 ASP HA 1 67 ARG H 4.800 . 5.800 4.630 4.281 4.899 . 0 0 "[ . 1 . 2]" 1
606 1 66 GLY H 1 66 GLY QA 2.500 . 2.800 2.328 2.246 2.432 . 0 0 "[ . 1 . 2]" 1
607 1 66 GLY H 1 67 ARG H 2.500 . 2.800 2.281 1.926 2.724 . 0 0 "[ . 1 . 2]" 1
608 1 66 GLY QA 1 67 ARG H 3.800 . 4.600 2.920 2.887 2.932 . 0 0 "[ . 1 . 2]" 1
609 1 67 ARG H 1 67 ARG QB 3.000 . 3.600 2.791 2.677 2.886 . 0 0 "[ . 1 . 2]" 1
610 1 67 ARG H 1 67 ARG QG 3.000 . 3.600 3.079 2.882 3.275 . 0 0 "[ . 1 . 2]" 1
611 1 67 ARG HA 1 67 ARG QD 4.800 . 5.800 3.562 2.785 3.852 . 0 0 "[ . 1 . 2]" 1
612 1 67 ARG HA 1 67 ARG QG 3.000 . 3.600 2.440 2.314 2.640 . 0 0 "[ . 1 . 2]" 1
613 1 67 ARG HA 1 68 ILE H 2.500 . 2.800 2.332 2.234 2.443 . 0 0 "[ . 1 . 2]" 1
614 1 67 ARG QG 1 68 ILE H 4.800 . 5.800 4.134 3.936 4.338 . 0 0 "[ . 1 . 2]" 1
615 1 68 ILE H 1 68 ILE HA 3.000 . 3.600 2.944 2.942 2.945 . 0 0 "[ . 1 . 2]" 1
616 1 68 ILE H 1 68 ILE HB 3.000 . 3.600 2.635 2.502 2.698 . 0 0 "[ . 1 . 2]" 1
617 1 68 ILE H 1 68 ILE QG 3.800 . 4.600 2.469 2.349 2.722 . 0 0 "[ . 1 . 2]" 1
618 1 68 ILE HA 1 68 ILE QG 3.000 . 3.600 2.159 2.082 2.189 . 0 0 "[ . 1 . 2]" 1
619 1 68 ILE HA 1 69 ASP H 2.500 . 2.800 2.144 2.126 2.164 . 0 0 "[ . 1 . 2]" 1
620 1 68 ILE HA 1 72 GLU H 4.800 . 5.800 5.178 4.553 5.535 . 0 0 "[ . 1 . 2]" 1
621 1 68 ILE HB 1 69 ASP H 3.800 . 4.600 4.113 3.988 4.256 . 0 0 "[ . 1 . 2]" 1
622 1 68 ILE MD 1 76 PHE HZ 4.800 . 5.800 4.611 3.794 4.813 . 0 0 "[ . 1 . 2]" 1
623 1 68 ILE QG 1 69 ASP H 3.800 . 4.600 2.536 2.336 2.803 . 0 0 "[ . 1 . 2]" 1
624 1 68 ILE MG 1 69 ASP HA 4.800 . 5.800 3.827 3.746 4.007 . 0 0 "[ . 1 . 2]" 1
625 1 68 ILE MG 1 72 GLU H 4.800 . 5.800 3.981 3.488 4.441 . 0 0 "[ . 1 . 2]" 1
626 1 68 ILE MG 1 73 PHE H 3.800 . 4.600 2.747 2.304 3.086 . 0 0 "[ . 1 . 2]" 1
627 1 68 ILE MG 1 73 PHE HA 3.000 . 3.600 2.751 2.212 3.118 . 0 0 "[ . 1 . 2]" 1
628 1 69 ASP H 1 69 ASP HA 3.000 . 3.600 2.938 2.935 2.940 . 0 0 "[ . 1 . 2]" 1
629 1 69 ASP H 1 69 ASP QB 3.000 . 3.600 2.820 2.389 2.938 . 0 0 "[ . 1 . 2]" 1
630 1 69 ASP H 1 70 TYR H 4.800 . 5.800 4.491 4.443 4.532 . 0 0 "[ . 1 . 2]" 1
631 1 69 ASP H 1 72 GLU H 3.200 . 3.700 3.456 3.063 3.729 0.029 12 0 "[ . 1 . 2]" 1
632 1 69 ASP H 1 72 GLU HA 4.800 . 5.800 5.396 4.922 5.811 0.011 14 0 "[ . 1 . 2]" 1
633 1 69 ASP H 1 72 GLU QG 3.000 . 3.600 2.422 1.919 3.138 . 0 0 "[ . 1 . 2]" 1
634 1 69 ASP HA 1 70 TYR H 2.500 . 2.800 2.543 2.405 2.638 . 0 0 "[ . 1 . 2]" 1
635 1 69 ASP HA 1 70 TYR HA 4.800 . 5.800 4.298 4.276 4.313 . 0 0 "[ . 1 . 2]" 1
636 1 69 ASP HA 1 70 TYR QB 4.800 . 5.800 4.339 4.244 4.432 . 0 0 "[ . 1 . 2]" 1
637 1 69 ASP HA 1 71 ASP H 4.800 . 5.800 4.258 4.060 4.664 . 0 0 "[ . 1 . 2]" 1
638 1 69 ASP QB 1 70 TYR H 3.000 . 3.600 2.217 2.012 3.085 . 0 0 "[ . 1 . 2]" 1
639 1 70 TYR H 1 70 TYR HA 3.000 . 3.600 2.805 2.759 2.860 . 0 0 "[ . 1 . 2]" 1
640 1 70 TYR H 1 70 TYR QB 3.000 . 3.600 2.254 2.233 2.264 . 0 0 "[ . 1 . 2]" 1
641 1 70 TYR H 1 70 TYR QD 4.800 . 5.800 4.191 4.133 4.212 . 0 0 "[ . 1 . 2]" 1
642 1 70 TYR H 1 71 ASP H 3.200 . 3.700 2.668 2.512 2.778 . 0 0 "[ . 1 . 2]" 1
643 1 70 TYR HA 1 70 TYR QD 3.000 . 3.600 2.345 2.077 3.166 . 0 0 "[ . 1 . 2]" 1
644 1 70 TYR HA 1 70 TYR QE 4.800 . 5.800 4.479 4.314 4.712 . 0 0 "[ . 1 . 2]" 1
645 1 70 TYR HA 1 71 ASP H 3.800 . 4.600 3.463 3.425 3.535 . 0 0 "[ . 1 . 2]" 1
646 1 70 TYR HA 1 71 ASP HA 4.800 . 5.800 4.750 4.688 4.825 . 0 0 "[ . 1 . 2]" 1
647 1 70 TYR HA 1 72 GLU H 4.800 . 5.800 4.844 4.694 4.988 . 0 0 "[ . 1 . 2]" 1
648 1 70 TYR HA 1 73 PHE H 3.000 . 3.600 3.634 3.541 3.689 0.089 11 0 "[ . 1 . 2]" 1
649 1 70 TYR HA 1 74 LEU H 4.800 . 5.800 3.937 3.317 4.770 . 0 0 "[ . 1 . 2]" 1
650 1 70 TYR HA 1 74 LEU QD 5.800 . 7.000 3.862 3.139 4.426 . 0 0 "[ . 1 . 2]" 1
651 1 70 TYR QB 1 71 ASP H 3.000 . 3.600 2.919 2.542 3.065 . 0 0 "[ . 1 . 2]" 1
652 1 70 TYR QD 1 71 ASP H 4.800 . 5.800 4.257 3.735 4.510 . 0 0 "[ . 1 . 2]" 1
653 1 70 TYR QD 1 71 ASP HA 4.800 . 5.800 4.268 3.036 4.667 . 0 0 "[ . 1 . 2]" 1
654 1 70 TYR QD 1 73 PHE H 5.800 . 7.000 5.299 4.997 5.635 . 0 0 "[ . 1 . 2]" 1
655 1 70 TYR QD 1 74 LEU MD2 3.800 . 4.600 3.162 2.347 3.482 . 0 0 "[ . 1 . 2]" 1
656 1 70 TYR QE 1 71 ASP H 5.800 . 7.000 6.100 5.759 6.295 . 0 0 "[ . 1 . 2]" 1
657 1 70 TYR QE 1 71 ASP HA 5.800 . 7.000 5.389 4.728 5.830 . 0 0 "[ . 1 . 2]" 1
658 1 70 TYR QE 1 74 LEU MD2 3.800 . 4.600 2.544 1.940 3.240 . 0 0 "[ . 1 . 2]" 1
659 1 70 TYR QE 1 74 LEU HG 4.800 . 5.600 4.440 3.146 5.221 . 0 0 "[ . 1 . 2]" 1
660 1 71 ASP H 1 71 ASP HA 3.000 . 3.600 2.846 2.789 2.887 . 0 0 "[ . 1 . 2]" 1
661 1 71 ASP H 1 71 ASP QB 3.000 . 3.600 2.272 2.086 2.671 . 0 0 "[ . 1 . 2]" 1
662 1 71 ASP H 1 72 GLU H 2.500 . 2.800 2.708 2.511 2.838 0.038 13 0 "[ . 1 . 2]" 1
663 1 71 ASP H 1 73 PHE H 4.000 . 5.200 3.812 3.591 4.283 . 0 0 "[ . 1 . 2]" 1
664 1 71 ASP HA 1 72 GLU H 3.800 . 4.600 3.564 3.557 3.573 . 0 0 "[ . 1 . 2]" 1
665 1 71 ASP HA 1 73 PHE H 4.800 . 5.800 4.510 4.087 4.844 . 0 0 "[ . 1 . 2]" 1
666 1 71 ASP HA 1 74 LEU H 3.800 . 4.600 3.804 3.598 4.033 . 0 0 "[ . 1 . 2]" 1
667 1 71 ASP HA 1 74 LEU QB 3.800 . 4.600 3.087 2.607 4.000 . 0 0 "[ . 1 . 2]" 1
668 1 71 ASP HA 1 74 LEU HG 4.800 . 5.800 4.383 2.743 5.808 0.008 1 0 "[ . 1 . 2]" 1
669 1 71 ASP HA 1 75 GLU H 4.800 . 5.800 5.273 4.341 5.802 0.002 18 0 "[ . 1 . 2]" 1
670 1 71 ASP QB 1 72 GLU H 3.000 . 3.600 2.345 2.132 2.496 . 0 0 "[ . 1 . 2]" 1
671 1 72 GLU H 1 72 GLU HA 3.000 . 3.600 2.833 2.799 2.865 . 0 0 "[ . 1 . 2]" 1
672 1 72 GLU H 1 72 GLU QB 3.000 . 3.600 2.599 2.521 2.768 . 0 0 "[ . 1 . 2]" 1
673 1 72 GLU H 1 72 GLU QG 3.000 . 3.600 1.977 1.763 2.136 0.037 20 0 "[ . 1 . 2]" 1
674 1 72 GLU H 1 73 PHE H 3.200 . 3.700 2.616 2.473 2.771 . 0 0 "[ . 1 . 2]" 1
675 1 72 GLU H 1 74 LEU H 4.000 . 5.200 4.102 3.927 4.419 . 0 0 "[ . 1 . 2]" 1
676 1 72 GLU H 1 75 GLU H 5.800 . 7.000 5.356 5.013 5.547 . 0 0 "[ . 1 . 2]" 1
677 1 72 GLU HA 1 72 GLU QG 3.000 . 3.600 2.898 2.434 3.331 . 0 0 "[ . 1 . 2]" 1
678 1 72 GLU HA 1 73 PHE H 3.800 . 4.600 3.518 3.429 3.567 . 0 0 "[ . 1 . 2]" 1
679 1 72 GLU HA 1 74 LEU H 3.800 . 4.600 4.115 3.810 4.620 0.020 16 0 "[ . 1 . 2]" 1
680 1 72 GLU HA 1 75 GLU QB 3.800 . 4.600 3.490 2.849 3.727 . 0 0 "[ . 1 . 2]" 1
681 1 72 GLU QB 1 73 PHE H 3.800 . 4.600 3.044 2.359 3.718 . 0 0 "[ . 1 . 2]" 1
682 1 73 PHE H 1 73 PHE HA 3.000 . 3.600 2.835 2.798 2.907 . 0 0 "[ . 1 . 2]" 1
683 1 73 PHE H 1 74 LEU H 2.500 . 2.800 2.582 2.371 2.736 . 0 0 "[ . 1 . 2]" 1
684 1 73 PHE H 1 74 LEU QB 4.800 . 5.800 4.303 4.139 4.630 . 0 0 "[ . 1 . 2]" 1
685 1 73 PHE H 1 75 GLU H 4.800 . 5.800 4.298 3.995 4.465 . 0 0 "[ . 1 . 2]" 1
686 1 73 PHE H 1 76 PHE H 4.800 . 5.800 4.856 4.681 5.017 . 0 0 "[ . 1 . 2]" 1
687 1 73 PHE HA 1 76 PHE QD 4.800 . 5.800 3.181 2.764 4.006 . 0 0 "[ . 1 . 2]" 1
688 1 73 PHE QB 1 74 LEU H 3.000 . 3.600 2.902 2.544 3.053 . 0 0 "[ . 1 . 2]" 1
689 1 73 PHE QD 1 77 MET ME 5.800 . 7.000 3.223 2.360 4.323 . 0 0 "[ . 1 . 2]" 1
690 1 73 PHE QE 1 77 MET ME 4.800 . 5.800 2.689 1.882 3.874 . 0 0 "[ . 1 . 2]" 1
691 1 74 LEU H 1 74 LEU HA 3.000 . 3.600 2.786 2.747 2.865 . 0 0 "[ . 1 . 2]" 1
692 1 74 LEU H 1 74 LEU QB 3.000 . 3.600 2.112 2.031 2.389 . 0 0 "[ . 1 . 2]" 1
693 1 74 LEU H 1 74 LEU QD 3.800 . 4.600 3.020 2.463 3.414 . 0 0 "[ . 1 . 2]" 1
694 1 74 LEU H 1 74 LEU HG 3.800 . 4.600 4.044 2.467 4.572 . 0 0 "[ . 1 . 2]" 1
695 1 74 LEU H 1 75 GLU H 2.500 . 2.800 2.722 2.520 2.823 0.023 19 0 "[ . 1 . 2]" 1
696 1 74 LEU H 1 75 GLU HA 4.800 . 5.800 5.332 5.158 5.412 . 0 0 "[ . 1 . 2]" 1
697 1 74 LEU H 1 76 PHE H 4.000 . 5.200 4.022 3.900 4.230 . 0 0 "[ . 1 . 2]" 1
698 1 74 LEU HA 1 75 GLU H 3.800 . 4.600 3.514 3.482 3.544 . 0 0 "[ . 1 . 2]" 1
699 1 74 LEU HA 1 76 PHE H 4.800 . 5.800 4.318 4.046 4.692 . 0 0 "[ . 1 . 2]" 1
700 1 74 LEU HA 1 77 MET H 3.800 . 4.600 4.006 3.787 4.226 . 0 0 "[ . 1 . 2]" 1
701 1 74 LEU QB 1 75 GLU H 3.000 . 3.600 2.806 2.596 3.375 . 0 0 "[ . 1 . 2]" 1
702 1 75 GLU H 1 75 GLU HA 3.000 . 3.600 2.872 2.806 2.919 . 0 0 "[ . 1 . 2]" 1
703 1 75 GLU H 1 75 GLU QB 3.000 . 3.600 2.228 2.089 2.615 . 0 0 "[ . 1 . 2]" 1
704 1 75 GLU H 1 75 GLU QG 3.000 . 3.600 2.898 2.144 3.226 . 0 0 "[ . 1 . 2]" 1
705 1 75 GLU H 1 76 PHE H 2.500 . 2.800 2.424 2.205 2.650 . 0 0 "[ . 1 . 2]" 1
706 1 75 GLU H 1 76 PHE HA 5.800 . 7.000 5.024 4.850 5.234 . 0 0 "[ . 1 . 2]" 1
707 1 75 GLU H 1 77 MET H 4.000 . 5.200 4.169 3.846 4.534 . 0 0 "[ . 1 . 2]" 1
708 1 75 GLU H 1 78 LYS H 4.800 . 5.800 5.162 4.653 5.600 . 0 0 "[ . 1 . 2]" 1
709 1 75 GLU HA 1 76 PHE H 3.800 . 4.600 3.490 3.455 3.549 . 0 0 "[ . 1 . 2]" 1
710 1 75 GLU HA 1 77 MET H 3.800 . 4.600 3.868 3.444 4.608 0.008 13 0 "[ . 1 . 2]" 1
711 1 75 GLU HA 1 78 LYS H 3.000 . 3.600 3.360 2.860 3.640 0.040 7 0 "[ . 1 . 2]" 1
712 1 75 GLU QB 1 76 PHE H 3.000 . 3.600 2.840 2.425 2.994 . 0 0 "[ . 1 . 2]" 1
713 1 75 GLU QG 1 76 PHE H 4.800 . 5.800 4.355 3.716 4.539 . 0 0 "[ . 1 . 2]" 1
714 1 76 PHE H 1 76 PHE HA 3.000 . 3.600 2.779 2.723 2.838 . 0 0 "[ . 1 . 2]" 1
715 1 76 PHE H 1 76 PHE QB 3.000 . 3.600 2.106 2.059 2.259 . 0 0 "[ . 1 . 2]" 1
716 1 76 PHE H 1 77 MET H 3.200 . 3.700 2.751 2.632 2.864 . 0 0 "[ . 1 . 2]" 1
717 1 76 PHE H 1 77 MET QB 4.800 . 5.800 4.595 4.321 4.874 . 0 0 "[ . 1 . 2]" 1
718 1 76 PHE H 1 78 LYS H 4.000 . 5.200 4.303 3.742 5.099 . 0 0 "[ . 1 . 2]" 1
719 1 76 PHE HA 1 76 PHE QD 3.800 . 4.600 2.384 1.972 2.979 . 0 0 "[ . 1 . 2]" 1
720 1 76 PHE HA 1 77 MET H 3.800 . 4.600 3.483 3.342 3.567 . 0 0 "[ . 1 . 2]" 1
721 1 76 PHE HA 1 79 GLY H 4.800 . 5.800 5.649 5.289 5.849 0.049 5 0 "[ . 1 . 2]" 1
722 1 76 PHE HA 1 80 VAL MG1 4.800 . 5.800 3.629 2.774 4.606 . 0 0 "[ . 1 . 2]" 1
723 1 76 PHE QB 1 77 MET H 3.800 . 4.600 2.828 2.283 3.319 . 0 0 "[ . 1 . 2]" 1
724 1 77 MET H 1 77 MET HA 3.000 . 3.600 2.911 2.861 2.949 . 0 0 "[ . 1 . 2]" 1
725 1 77 MET H 1 77 MET QB 3.000 . 3.600 2.288 2.090 2.492 . 0 0 "[ . 1 . 2]" 1
726 1 77 MET H 1 78 LYS H 2.500 . 2.800 2.541 2.130 2.874 0.074 10 0 "[ . 1 . 2]" 1
727 1 77 MET HA 1 77 MET ME 3.800 . 4.600 2.802 1.953 3.854 . 0 0 "[ . 1 . 2]" 1
728 1 77 MET HA 1 78 LYS H 3.000 . 3.600 3.301 3.013 3.565 . 0 0 "[ . 1 . 2]" 1
729 1 77 MET HA 1 80 VAL H 5.800 . 7.000 5.204 3.845 6.002 . 0 0 "[ . 1 . 2]" 1
730 1 77 MET HA 1 80 VAL MG1 4.800 . 5.800 4.595 3.807 4.752 . 0 0 "[ . 1 . 2]" 1
731 1 77 MET HA 1 80 VAL MG2 3.000 . 3.600 2.940 2.768 3.052 . 0 0 "[ . 1 . 2]" 1
732 1 77 MET QB 1 78 LYS H 3.800 . 4.600 3.062 1.917 3.730 . 0 0 "[ . 1 . 2]" 1
733 1 78 LYS H 1 78 LYS HA 3.000 . 3.600 2.879 2.803 2.935 . 0 0 "[ . 1 . 2]" 1
734 1 78 LYS H 1 78 LYS QB 3.000 . 3.600 2.279 2.089 2.672 . 0 0 "[ . 1 . 2]" 1
735 1 78 LYS H 1 79 GLY H 4.000 . 5.200 3.213 2.836 3.932 . 0 0 "[ . 1 . 2]" 1
736 1 78 LYS H 1 80 VAL H 5.800 . 7.000 5.553 3.442 6.495 . 0 0 "[ . 1 . 2]" 1
737 1 78 LYS HA 1 78 LYS QD 4.800 . 5.800 3.358 2.002 4.264 . 0 0 "[ . 1 . 2]" 1
738 1 78 LYS HA 1 79 GLY H 3.000 . 3.600 2.767 2.377 3.165 . 0 0 "[ . 1 . 2]" 1
739 1 78 LYS HA 1 80 VAL H 5.800 . 7.000 5.610 4.652 6.378 . 0 0 "[ . 1 . 2]" 1
740 1 78 LYS QB 1 79 GLY H 3.800 . 4.600 3.831 3.616 3.983 . 0 0 "[ . 1 . 2]" 1
741 1 79 GLY H 1 80 VAL H 3.200 . 3.700 3.073 2.128 3.718 0.018 12 0 "[ . 1 . 2]" 1
742 1 79 GLY QA 1 80 VAL H 3.000 . 3.600 2.370 2.127 2.941 . 0 0 "[ . 1 . 2]" 1
743 1 80 VAL H 1 80 VAL HA 3.000 . 3.600 2.881 2.721 2.948 . 0 0 "[ . 1 . 2]" 1
744 1 80 VAL H 1 80 VAL HB 3.000 . 3.600 3.146 2.709 3.618 0.018 5 0 "[ . 1 . 2]" 1
745 1 80 VAL H 1 80 VAL QG 3.800 . 4.600 2.158 1.831 2.410 . 0 0 "[ . 1 . 2]" 1
746 1 80 VAL H 1 81 GLU H 3.200 . 3.700 2.828 2.321 3.138 . 0 0 "[ . 1 . 2]" 1
747 1 80 VAL HA 1 80 VAL QG 3.000 . 3.600 2.115 1.953 2.337 . 0 0 "[ . 1 . 2]" 1
748 1 80 VAL HA 1 81 GLU H 3.000 . 3.600 3.067 2.628 3.585 . 0 0 "[ . 1 . 2]" 1
749 1 80 VAL HA 1 81 GLU HA 4.800 . 5.800 4.576 4.392 4.740 . 0 0 "[ . 1 . 2]" 1
750 1 80 VAL HB 1 81 GLU HA 4.800 . 5.800 4.494 3.934 4.785 . 0 0 "[ . 1 . 2]" 1
751 1 80 VAL QG 1 81 GLU H 4.800 . 5.800 3.199 1.913 3.780 . 0 0 "[ . 1 . 2]" 1
752 1 81 GLU H 1 81 GLU HA 3.000 . 3.600 2.899 2.786 2.947 . 0 0 "[ . 1 . 2]" 1
753 1 81 GLU H 1 81 GLU QB 3.000 . 3.600 2.686 2.236 3.183 . 0 0 "[ . 1 . 2]" 1
754 1 81 GLU H 1 81 GLU QG 3.000 . 3.600 2.360 1.987 2.951 . 0 0 "[ . 1 . 2]" 1
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