NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
403430 |
1wjq   |
10037 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wjq
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 1761
_Distance_constraint_stats_list.Viol_count 862
_Distance_constraint_stats_list.Viol_total 201.719
_Distance_constraint_stats_list.Viol_max 0.187
_Distance_constraint_stats_list.Viol_rms 0.0038
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0003
_Distance_constraint_stats_list.Viol_average_violations_only 0.0117
_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 VAL 0.012 0.009 4 0 "[ . 1 . 2]"
1 9 LYS 0.095 0.083 4 0 "[ . 1 . 2]"
1 10 PRO 0.083 0.083 4 0 "[ . 1 . 2]"
1 11 PRO 0.100 0.026 20 0 "[ . 1 . 2]"
1 12 HIS 0.660 0.187 20 0 "[ . 1 . 2]"
1 13 GLY 0.560 0.187 20 0 "[ . 1 . 2]"
1 14 PHE 0.071 0.033 19 0 "[ . 1 . 2]"
1 15 GLN 0.028 0.016 14 0 "[ . 1 . 2]"
1 16 LYS 0.206 0.061 13 0 "[ . 1 . 2]"
1 17 LYS 0.213 0.033 9 0 "[ . 1 . 2]"
1 18 MET 0.251 0.186 10 0 "[ . 1 . 2]"
1 19 LYS 0.552 0.053 18 0 "[ . 1 . 2]"
1 20 LEU 0.535 0.038 9 0 "[ . 1 . 2]"
1 21 GLU 0.352 0.128 11 0 "[ . 1 . 2]"
1 22 VAL 0.663 0.128 11 0 "[ . 1 . 2]"
1 23 VAL 0.281 0.026 19 0 "[ . 1 . 2]"
1 24 ASP 0.075 0.018 15 0 "[ . 1 . 2]"
1 25 LYS 1.239 0.152 9 0 "[ . 1 . 2]"
1 26 ARG 2.025 0.183 15 0 "[ . 1 . 2]"
1 27 ASN 1.092 0.183 15 0 "[ . 1 . 2]"
1 28 PRO 0.575 0.035 2 0 "[ . 1 . 2]"
1 29 MET 0.098 0.061 18 0 "[ . 1 . 2]"
1 30 PHE 0.236 0.027 2 0 "[ . 1 . 2]"
1 31 ILE 0.291 0.027 2 0 "[ . 1 . 2]"
1 32 ARG 0.032 0.011 13 0 "[ . 1 . 2]"
1 33 VAL 0.244 0.053 18 0 "[ . 1 . 2]"
1 34 ALA 0.452 0.038 9 0 "[ . 1 . 2]"
1 35 THR 0.106 0.021 2 0 "[ . 1 . 2]"
1 36 VAL 0.192 0.013 20 0 "[ . 1 . 2]"
1 37 ALA 0.026 0.006 16 0 "[ . 1 . 2]"
1 38 ASP 0.017 0.007 16 0 "[ . 1 . 2]"
1 39 THR 0.137 0.020 14 0 "[ . 1 . 2]"
1 40 ASP 0.000 0.000 18 0 "[ . 1 . 2]"
1 41 ASP 0.000 0.000 18 0 "[ . 1 . 2]"
1 42 HIS 0.134 0.040 19 0 "[ . 1 . 2]"
1 43 ARG 0.168 0.040 19 0 "[ . 1 . 2]"
1 44 VAL 0.088 0.008 19 0 "[ . 1 . 2]"
1 45 LYS 0.106 0.014 2 0 "[ . 1 . 2]"
1 46 VAL 0.045 0.007 13 0 "[ . 1 . 2]"
1 47 HIS 0.021 0.005 9 0 "[ . 1 . 2]"
1 48 PHE 0.053 0.012 16 0 "[ . 1 . 2]"
1 49 ASP 0.036 0.012 8 0 "[ . 1 . 2]"
1 50 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 TRP 0.195 0.049 17 0 "[ . 1 . 2]"
1 52 ASN 0.182 0.050 16 0 "[ . 1 . 2]"
1 54 CYS 0.304 0.075 17 0 "[ . 1 . 2]"
1 55 TYR 0.643 0.075 17 0 "[ . 1 . 2]"
1 56 ASP 0.017 0.009 19 0 "[ . 1 . 2]"
1 57 TYR 0.239 0.018 9 0 "[ . 1 . 2]"
1 58 TRP 0.124 0.014 2 0 "[ . 1 . 2]"
1 59 ILE 0.567 0.020 2 0 "[ . 1 . 2]"
1 60 ASP 0.255 0.021 2 0 "[ . 1 . 2]"
1 61 ALA 0.194 0.021 2 0 "[ . 1 . 2]"
1 62 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 SER 0.080 0.020 2 0 "[ . 1 . 2]"
1 64 PRO 0.008 0.006 9 0 "[ . 1 . 2]"
1 65 ASP 0.031 0.010 2 0 "[ . 1 . 2]"
1 66 ILE 0.170 0.017 14 0 "[ . 1 . 2]"
1 67 HIS 0.138 0.017 14 0 "[ . 1 . 2]"
1 68 PRO 0.039 0.012 6 0 "[ . 1 . 2]"
1 69 VAL 0.348 0.049 6 0 "[ . 1 . 2]"
1 70 GLY 0.211 0.049 6 0 "[ . 1 . 2]"
1 71 TRP 0.273 0.025 12 0 "[ . 1 . 2]"
1 72 CYS 0.014 0.003 8 0 "[ . 1 . 2]"
1 73 SER 0.115 0.035 12 0 "[ . 1 . 2]"
1 74 LYS 0.434 0.054 6 0 "[ . 1 . 2]"
1 75 THR 0.104 0.061 6 0 "[ . 1 . 2]"
1 76 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 HIS 0.011 0.006 12 0 "[ . 1 . 2]"
1 78 PRO 0.058 0.014 11 0 "[ . 1 . 2]"
1 79 LEU 0.126 0.014 11 0 "[ . 1 . 2]"
1 80 GLN 0.076 0.008 8 0 "[ . 1 . 2]"
1 81 PRO 0.001 0.001 5 0 "[ . 1 . 2]"
1 82 PRO 0.139 0.025 16 0 "[ . 1 . 2]"
1 83 LEU 0.575 0.159 17 0 "[ . 1 . 2]"
1 84 SER 0.002 0.002 10 0 "[ . 1 . 2]"
1 85 PRO 0.003 0.002 6 0 "[ . 1 . 2]"
1 86 LEU 0.027 0.010 19 0 "[ . 1 . 2]"
1 87 GLU 0.054 0.014 17 0 "[ . 1 . 2]"
1 88 LEU 0.003 0.002 6 0 "[ . 1 . 2]"
1 89 MET 0.002 0.002 19 0 "[ . 1 . 2]"
1 90 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 THR 0.067 0.067 12 0 "[ . 1 . 2]"
1 100 PRO 0.067 0.067 12 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 VAL H 1 8 VAL HB . . 3.960 3.159 2.526 3.935 . 0 0 "[ . 1 . 2]" 1
2 1 8 VAL H 1 8 VAL MG1 . . 4.170 2.407 1.915 3.877 . 0 0 "[ . 1 . 2]" 1
3 1 8 VAL H 1 8 VAL QG . . 3.660 2.267 1.910 2.907 . 0 0 "[ . 1 . 2]" 1
4 1 8 VAL H 1 8 VAL MG2 . . 4.170 3.617 2.224 4.055 . 0 0 "[ . 1 . 2]" 1
5 1 8 VAL H 1 9 LYS H . . 4.610 4.443 4.134 4.613 0.003 7 0 "[ . 1 . 2]" 1
6 1 8 VAL HA 1 8 VAL MG1 . . 3.530 3.027 2.299 3.204 . 0 0 "[ . 1 . 2]" 1
7 1 8 VAL HA 1 8 VAL MG2 . . 3.530 2.469 2.232 3.200 . 0 0 "[ . 1 . 2]" 1
8 1 8 VAL HA 1 9 LYS H . . 2.760 2.287 2.190 2.512 . 0 0 "[ . 1 . 2]" 1
9 1 8 VAL HA 1 9 LYS QB . . 4.490 4.253 3.982 4.462 . 0 0 "[ . 1 . 2]" 1
10 1 8 VAL HA 1 9 LYS QG . . 4.320 4.047 3.678 4.329 0.009 4 0 "[ . 1 . 2]" 1
11 1 8 VAL HB 1 9 LYS H . . 4.070 3.721 2.158 4.067 . 0 0 "[ . 1 . 2]" 1
12 1 8 VAL QG 1 9 LYS H . . 3.750 2.180 1.886 3.046 . 0 0 "[ . 1 . 2]" 1
13 1 8 VAL QG 1 9 LYS HA . . 4.860 3.444 3.149 3.708 . 0 0 "[ . 1 . 2]" 1
14 1 8 VAL QG 1 9 LYS QB . . 4.830 3.900 3.399 4.517 . 0 0 "[ . 1 . 2]" 1
15 1 8 VAL QG 1 10 PRO HD2 . . 5.440 4.938 4.813 5.258 . 0 0 "[ . 1 . 2]" 1
16 1 8 VAL QG 1 10 PRO HD3 . . 4.610 4.293 4.124 4.564 . 0 0 "[ . 1 . 2]" 1
17 1 8 VAL MG1 1 9 LYS H . . 4.380 3.607 2.079 3.924 . 0 0 "[ . 1 . 2]" 1
18 1 8 VAL MG2 1 9 LYS H . . 4.380 2.307 1.893 3.832 . 0 0 "[ . 1 . 2]" 1
19 1 9 LYS H 1 9 LYS QB . . 3.090 2.612 2.271 3.079 . 0 0 "[ . 1 . 2]" 1
20 1 9 LYS H 1 9 LYS QG . . 3.720 2.738 2.157 3.541 . 0 0 "[ . 1 . 2]" 1
21 1 9 LYS HA 1 9 LYS QG . . 3.530 2.819 2.248 3.422 . 0 0 "[ . 1 . 2]" 1
22 1 9 LYS HA 1 10 PRO HD2 . . 2.750 2.296 2.248 2.412 . 0 0 "[ . 1 . 2]" 1
23 1 9 LYS HA 1 10 PRO HD3 . . 2.720 2.270 2.260 2.305 . 0 0 "[ . 1 . 2]" 1
24 1 9 LYS HA 1 10 PRO QG . . 4.350 3.939 3.911 4.009 . 0 0 "[ . 1 . 2]" 1
25 1 9 LYS QB 1 9 LYS QE . . 4.130 2.904 2.007 3.755 . 0 0 "[ . 1 . 2]" 1
26 1 9 LYS QB 1 10 PRO HD2 . . 3.310 2.219 1.983 2.416 . 0 0 "[ . 1 . 2]" 1
27 1 9 LYS QB 1 10 PRO HD3 . . 3.690 3.522 3.287 3.690 . 0 0 "[ . 1 . 2]" 1
28 1 9 LYS HB2 1 9 LYS QE . . 4.720 3.375 2.102 4.249 . 0 0 "[ . 1 . 2]" 1
29 1 9 LYS HB2 1 10 PRO HD2 . . 4.090 3.068 1.993 3.931 . 0 0 "[ . 1 . 2]" 1
30 1 9 LYS HB3 1 9 LYS QE . . 4.720 3.431 2.025 4.439 . 0 0 "[ . 1 . 2]" 1
31 1 9 LYS HB3 1 10 PRO HD2 . . 4.090 2.884 2.106 3.724 . 0 0 "[ . 1 . 2]" 1
32 1 9 LYS QE 1 9 LYS QG . . 2.930 2.217 2.072 2.582 . 0 0 "[ . 1 . 2]" 1
33 1 9 LYS QG 1 10 PRO HD2 . . 3.910 3.445 2.737 3.866 . 0 0 "[ . 1 . 2]" 1
34 1 9 LYS QG 1 10 PRO HD3 . . 4.640 4.303 3.592 4.723 0.083 4 0 "[ . 1 . 2]" 1
35 1 10 PRO HA 1 11 PRO HD2 . . 3.070 2.154 1.923 2.545 . 0 0 "[ . 1 . 2]" 1
36 1 10 PRO HA 1 11 PRO HD3 . . 3.140 2.338 2.263 2.472 . 0 0 "[ . 1 . 2]" 1
37 1 10 PRO QB 1 11 PRO HD2 . . 4.190 2.811 1.995 3.444 . 0 0 "[ . 1 . 2]" 1
38 1 11 PRO HA 1 12 HIS QB . . 5.500 5.172 4.730 5.302 . 0 0 "[ . 1 . 2]" 1
39 1 11 PRO HB2 1 12 HIS H . . 3.980 3.065 2.905 3.188 . 0 0 "[ . 1 . 2]" 1
40 1 11 PRO HB2 1 12 HIS QB . . 4.490 3.967 3.828 4.062 . 0 0 "[ . 1 . 2]" 1
41 1 11 PRO HB3 1 12 HIS H . . 4.030 3.985 3.893 4.056 0.026 20 0 "[ . 1 . 2]" 1
42 1 11 PRO HD2 1 12 HIS HD2 . . 5.500 5.439 5.280 5.510 0.010 20 0 "[ . 1 . 2]" 1
43 1 11 PRO HD3 1 12 HIS H . . 4.570 3.850 3.839 3.873 . 0 0 "[ . 1 . 2]" 1
44 1 11 PRO QG 1 12 HIS H . . 4.490 2.061 1.916 2.184 . 0 0 "[ . 1 . 2]" 1
45 1 11 PRO QG 1 12 HIS HD2 . . 4.990 3.132 2.940 3.293 . 0 0 "[ . 1 . 2]" 1
46 1 11 PRO QG 1 12 HIS HE1 . . 4.670 3.544 3.334 4.043 . 0 0 "[ . 1 . 2]" 1
47 1 11 PRO QG 1 39 THR MG . . 4.750 4.675 4.402 4.763 0.013 20 0 "[ . 1 . 2]" 1
48 1 12 HIS H 1 12 HIS QB . . 3.410 3.175 3.106 3.362 . 0 0 "[ . 1 . 2]" 1
49 1 12 HIS H 1 12 HIS HD2 . . 4.070 3.769 3.545 3.921 . 0 0 "[ . 1 . 2]" 1
50 1 12 HIS H 1 13 GLY H . . 4.170 2.283 1.800 4.357 0.187 20 0 "[ . 1 . 2]" 1
51 1 12 HIS H 1 61 ALA MB . . 4.970 4.732 4.508 4.975 0.005 14 0 "[ . 1 . 2]" 1
52 1 12 HIS HA 1 12 HIS HD2 . . 4.820 4.475 4.334 4.642 . 0 0 "[ . 1 . 2]" 1
53 1 12 HIS HA 1 61 ALA MB . . 4.570 4.290 3.947 4.578 0.008 5 0 "[ . 1 . 2]" 1
54 1 12 HIS QB 1 12 HIS HD2 . . 3.390 2.660 2.629 2.708 . 0 0 "[ . 1 . 2]" 1
55 1 12 HIS QB 1 13 GLY H . . 3.600 3.073 1.915 3.566 . 0 0 "[ . 1 . 2]" 1
56 1 12 HIS QB 1 14 PHE H . . 4.680 3.818 3.175 4.344 . 0 0 "[ . 1 . 2]" 1
57 1 12 HIS QB 1 14 PHE QD . . 3.800 2.829 2.041 3.519 . 0 0 "[ . 1 . 2]" 1
58 1 12 HIS QB 1 14 PHE QE . . 4.920 3.660 2.908 4.698 . 0 0 "[ . 1 . 2]" 1
59 1 12 HIS QB 1 42 HIS HA . . 4.270 3.318 2.593 4.192 . 0 0 "[ . 1 . 2]" 1
60 1 12 HIS QB 1 61 ALA MB . . 3.110 2.026 1.815 2.326 . 0 0 "[ . 1 . 2]" 1
61 1 12 HIS HD2 1 42 HIS HA . . 3.410 2.277 1.999 2.745 . 0 0 "[ . 1 . 2]" 1
62 1 12 HIS HD2 1 43 ARG H . . 4.520 3.212 2.698 3.771 . 0 0 "[ . 1 . 2]" 1
63 1 12 HIS HD2 1 61 ALA MB . . 3.350 3.272 2.979 3.352 0.002 17 0 "[ . 1 . 2]" 1
64 1 12 HIS HE1 1 14 PHE H . . 3.930 3.355 2.906 3.925 . 0 0 "[ . 1 . 2]" 1
65 1 12 HIS HE1 1 14 PHE HB2 . . 3.410 2.228 1.998 2.651 . 0 0 "[ . 1 . 2]" 1
66 1 12 HIS HE1 1 14 PHE HB3 . . 3.830 3.481 3.242 3.827 . 0 0 "[ . 1 . 2]" 1
67 1 12 HIS HE1 1 14 PHE QD . . 4.730 4.139 3.852 4.733 0.003 17 0 "[ . 1 . 2]" 1
68 1 12 HIS HE1 1 36 VAL MG1 . . 4.890 4.266 3.903 4.521 . 0 0 "[ . 1 . 2]" 1
69 1 12 HIS HE1 1 39 THR HA . . 4.720 4.049 3.647 4.395 . 0 0 "[ . 1 . 2]" 1
70 1 12 HIS HE1 1 39 THR HB . . 3.550 2.292 2.010 2.627 . 0 0 "[ . 1 . 2]" 1
71 1 12 HIS HE1 1 39 THR MG . . 3.260 2.312 1.938 2.656 . 0 0 "[ . 1 . 2]" 1
72 1 12 HIS HE1 1 40 ASP H . . 5.270 5.098 4.713 5.254 . 0 0 "[ . 1 . 2]" 1
73 1 12 HIS HE1 1 44 VAL MG1 . . 3.890 2.316 2.016 2.584 . 0 0 "[ . 1 . 2]" 1
74 1 12 HIS HE1 1 44 VAL MG2 . . 4.880 4.530 4.233 4.837 . 0 0 "[ . 1 . 2]" 1
75 1 13 GLY H 1 14 PHE H . . 4.010 2.431 1.804 3.356 . 0 0 "[ . 1 . 2]" 1
76 1 14 PHE H 1 14 PHE HB2 . . 3.400 2.581 2.328 2.840 . 0 0 "[ . 1 . 2]" 1
77 1 14 PHE H 1 14 PHE HB3 . . 3.860 3.719 3.566 3.893 0.033 19 0 "[ . 1 . 2]" 1
78 1 14 PHE H 1 14 PHE QD . . 4.050 2.500 1.893 2.935 . 0 0 "[ . 1 . 2]" 1
79 1 14 PHE H 1 15 GLN H . . 4.790 4.490 4.379 4.649 . 0 0 "[ . 1 . 2]" 1
80 1 14 PHE H 1 39 THR MG . . 5.260 4.541 4.048 4.968 . 0 0 "[ . 1 . 2]" 1
81 1 14 PHE H 1 44 VAL MG1 . . 4.770 4.254 4.029 4.457 . 0 0 "[ . 1 . 2]" 1
82 1 14 PHE H 1 61 ALA MB . . 5.500 4.104 3.495 4.603 . 0 0 "[ . 1 . 2]" 1
83 1 14 PHE HA 1 14 PHE QD . . 3.640 3.073 2.818 3.167 . 0 0 "[ . 1 . 2]" 1
84 1 14 PHE HA 1 15 GLN H . . 2.790 2.321 2.234 2.565 . 0 0 "[ . 1 . 2]" 1
85 1 14 PHE HA 1 15 GLN QG . . 4.210 3.529 3.329 3.905 . 0 0 "[ . 1 . 2]" 1
86 1 14 PHE HA 1 18 MET ME . . 3.460 2.692 2.170 3.317 . 0 0 "[ . 1 . 2]" 1
87 1 14 PHE HA 1 39 THR MG . . 4.800 4.650 4.397 4.798 . 0 0 "[ . 1 . 2]" 1
88 1 14 PHE HA 1 44 VAL MG1 . . 4.870 4.621 4.430 4.853 . 0 0 "[ . 1 . 2]" 1
89 1 14 PHE HB2 1 15 GLN H . . 4.070 3.896 3.458 4.072 0.002 9 0 "[ . 1 . 2]" 1
90 1 14 PHE HB2 1 36 VAL MG1 . . 4.290 3.970 3.619 4.197 . 0 0 "[ . 1 . 2]" 1
91 1 14 PHE HB2 1 36 VAL MG2 . . 4.490 4.396 4.061 4.494 0.004 7 0 "[ . 1 . 2]" 1
92 1 14 PHE HB2 1 39 THR MG . . 3.710 3.053 2.718 3.175 . 0 0 "[ . 1 . 2]" 1
93 1 14 PHE HB2 1 44 VAL MG1 . . 3.320 2.143 2.007 2.300 . 0 0 "[ . 1 . 2]" 1
94 1 14 PHE HB2 1 44 VAL MG2 . . 3.920 3.588 3.242 3.852 . 0 0 "[ . 1 . 2]" 1
95 1 14 PHE HB3 1 15 GLN H . . 3.450 2.668 2.085 2.911 . 0 0 "[ . 1 . 2]" 1
96 1 14 PHE HB3 1 18 MET ME . . 3.440 2.302 1.974 3.146 . 0 0 "[ . 1 . 2]" 1
97 1 14 PHE HB3 1 20 LEU MD2 . . 5.330 4.248 3.815 4.549 . 0 0 "[ . 1 . 2]" 1
98 1 14 PHE HB3 1 36 VAL MG1 . . 3.990 3.009 2.782 3.211 . 0 0 "[ . 1 . 2]" 1
99 1 14 PHE HB3 1 36 VAL MG2 . . 3.910 2.926 2.565 3.065 . 0 0 "[ . 1 . 2]" 1
100 1 14 PHE HB3 1 39 THR MG . . 3.760 3.038 2.696 3.341 . 0 0 "[ . 1 . 2]" 1
101 1 14 PHE HB3 1 44 VAL MG1 . . 3.420 2.611 2.335 3.005 . 0 0 "[ . 1 . 2]" 1
102 1 14 PHE HB3 1 44 VAL MG2 . . 4.110 3.574 3.221 3.911 . 0 0 "[ . 1 . 2]" 1
103 1 14 PHE QD 1 15 GLN H . . 4.180 3.863 3.660 4.082 . 0 0 "[ . 1 . 2]" 1
104 1 14 PHE QD 1 18 MET ME . . 3.690 1.895 1.813 2.006 . 0 0 "[ . 1 . 2]" 1
105 1 14 PHE QD 1 20 LEU MD2 . . 4.340 2.535 2.140 2.777 . 0 0 "[ . 1 . 2]" 1
106 1 14 PHE QD 1 36 VAL MG2 . . 3.720 2.663 2.277 2.973 . 0 0 "[ . 1 . 2]" 1
107 1 14 PHE QD 1 39 THR MG . . 4.720 4.345 3.994 4.573 . 0 0 "[ . 1 . 2]" 1
108 1 14 PHE QD 1 44 VAL MG1 . . 3.490 3.321 2.924 3.486 . 0 0 "[ . 1 . 2]" 1
109 1 14 PHE QD 1 44 VAL MG2 . . 3.710 3.044 2.473 3.508 . 0 0 "[ . 1 . 2]" 1
110 1 14 PHE QD 1 61 ALA HA . . 4.720 4.151 3.970 4.371 . 0 0 "[ . 1 . 2]" 1
111 1 14 PHE QD 1 61 ALA MB . . 3.480 2.525 2.218 3.044 . 0 0 "[ . 1 . 2]" 1
112 1 14 PHE QD 1 66 ILE MD . . 4.650 4.220 3.830 4.424 . 0 0 "[ . 1 . 2]" 1
113 1 14 PHE QD 1 66 ILE MG . . 4.510 3.878 3.600 4.177 . 0 0 "[ . 1 . 2]" 1
114 1 14 PHE QE 1 18 MET ME . . 4.100 3.162 2.446 3.407 . 0 0 "[ . 1 . 2]" 1
115 1 14 PHE QE 1 20 LEU MD1 . . 3.440 2.994 2.642 3.226 . 0 0 "[ . 1 . 2]" 1
116 1 14 PHE QE 1 20 LEU MD2 . . 4.330 2.379 1.962 2.711 . 0 0 "[ . 1 . 2]" 1
117 1 14 PHE QE 1 44 VAL MG1 . . 4.690 4.548 4.115 4.691 0.001 19 0 "[ . 1 . 2]" 1
118 1 14 PHE QE 1 44 VAL MG2 . . 4.410 3.586 2.853 4.010 . 0 0 "[ . 1 . 2]" 1
119 1 14 PHE QE 1 61 ALA HA . . 4.100 3.599 3.385 3.957 . 0 0 "[ . 1 . 2]" 1
120 1 14 PHE QE 1 61 ALA MB . . 3.490 2.895 2.637 3.488 . 0 0 "[ . 1 . 2]" 1
121 1 14 PHE QE 1 66 ILE MD . . 3.970 3.126 2.598 3.610 . 0 0 "[ . 1 . 2]" 1
122 1 14 PHE QE 1 66 ILE MG . . 3.640 2.044 1.809 2.381 . 0 0 "[ . 1 . 2]" 1
123 1 14 PHE HZ 1 20 LEU MD1 . . 4.600 4.373 4.096 4.612 0.012 19 0 "[ . 1 . 2]" 1
124 1 14 PHE HZ 1 20 LEU MD2 . . 4.980 4.426 3.939 4.734 . 0 0 "[ . 1 . 2]" 1
125 1 14 PHE HZ 1 61 ALA MB . . 5.030 4.001 3.459 4.410 . 0 0 "[ . 1 . 2]" 1
126 1 14 PHE HZ 1 66 ILE HB . . 4.960 3.491 3.201 3.949 . 0 0 "[ . 1 . 2]" 1
127 1 14 PHE HZ 1 66 ILE MD . . 4.180 3.215 2.745 3.883 . 0 0 "[ . 1 . 2]" 1
128 1 14 PHE HZ 1 66 ILE MG . . 3.390 1.992 1.869 2.164 . 0 0 "[ . 1 . 2]" 1
129 1 15 GLN H 1 15 GLN HB2 . . 3.410 2.669 2.481 2.909 . 0 0 "[ . 1 . 2]" 1
130 1 15 GLN H 1 15 GLN HB3 . . 4.080 3.788 3.676 3.928 . 0 0 "[ . 1 . 2]" 1
131 1 15 GLN H 1 15 GLN QG . . 3.450 2.939 2.711 3.248 . 0 0 "[ . 1 . 2]" 1
132 1 15 GLN H 1 16 LYS H . . 4.680 4.461 4.397 4.498 . 0 0 "[ . 1 . 2]" 1
133 1 15 GLN H 1 16 LYS HA . . 5.230 4.951 4.753 5.053 . 0 0 "[ . 1 . 2]" 1
134 1 15 GLN H 1 18 MET ME . . 3.450 2.323 2.009 3.041 . 0 0 "[ . 1 . 2]" 1
135 1 15 GLN H 1 36 VAL MG1 . . 4.420 3.899 3.340 4.153 . 0 0 "[ . 1 . 2]" 1
136 1 15 GLN H 1 36 VAL MG2 . . 3.740 3.333 2.957 3.586 . 0 0 "[ . 1 . 2]" 1
137 1 15 GLN H 1 39 THR MG . . 4.760 3.894 3.335 4.071 . 0 0 "[ . 1 . 2]" 1
138 1 15 GLN HA 1 15 GLN QG . . 3.410 2.458 2.266 2.548 . 0 0 "[ . 1 . 2]" 1
139 1 15 GLN HB2 1 16 LYS H . . 4.010 3.550 3.379 3.694 . 0 0 "[ . 1 . 2]" 1
140 1 15 GLN HB2 1 18 MET ME . . 4.430 4.159 3.837 4.411 . 0 0 "[ . 1 . 2]" 1
141 1 15 GLN HB2 1 18 MET HG2 . . 3.970 3.843 3.174 3.971 0.001 12 0 "[ . 1 . 2]" 1
142 1 15 GLN HB2 1 18 MET HG3 . . 4.980 4.903 4.515 4.996 0.016 14 0 "[ . 1 . 2]" 1
143 1 15 GLN HB3 1 15 GLN QG . . 2.720 2.342 2.217 2.468 . 0 0 "[ . 1 . 2]" 1
144 1 15 GLN HB3 1 16 LYS H . . 3.410 2.370 2.052 2.573 . 0 0 "[ . 1 . 2]" 1
145 1 15 GLN QG 1 16 LYS H . . 4.070 3.896 3.594 4.060 . 0 0 "[ . 1 . 2]" 1
146 1 15 GLN QG 1 39 THR MG . . 4.830 4.637 4.351 4.828 . 0 0 "[ . 1 . 2]" 1
147 1 16 LYS H 1 16 LYS HB2 . . 2.900 2.262 2.204 2.351 . 0 0 "[ . 1 . 2]" 1
148 1 16 LYS H 1 16 LYS QD . . 4.330 3.925 3.548 4.332 0.002 16 0 "[ . 1 . 2]" 1
149 1 16 LYS H 1 16 LYS QE . . 5.320 4.159 2.786 5.269 . 0 0 "[ . 1 . 2]" 1
150 1 16 LYS H 1 16 LYS HG2 . . 4.640 4.347 4.240 4.426 . 0 0 "[ . 1 . 2]" 1
151 1 16 LYS H 1 16 LYS HG3 . . 3.450 3.203 3.048 3.332 . 0 0 "[ . 1 . 2]" 1
152 1 16 LYS H 1 36 VAL MG1 . . 4.380 4.144 3.912 4.384 0.004 20 0 "[ . 1 . 2]" 1
153 1 16 LYS H 1 39 THR MG . . 3.690 3.620 3.484 3.710 0.020 14 0 "[ . 1 . 2]" 1
154 1 16 LYS HA 1 16 LYS HG2 . . 3.590 2.764 2.675 2.801 . 0 0 "[ . 1 . 2]" 1
155 1 16 LYS HA 1 16 LYS HG3 . . 3.820 2.467 2.379 2.563 . 0 0 "[ . 1 . 2]" 1
156 1 16 LYS HA 1 17 LYS H . . 2.690 2.306 2.255 2.406 . 0 0 "[ . 1 . 2]" 1
157 1 16 LYS HA 1 17 LYS HG3 . . 4.600 4.209 4.080 4.410 . 0 0 "[ . 1 . 2]" 1
158 1 16 LYS HA 1 18 MET H . . 3.840 3.310 3.206 3.477 . 0 0 "[ . 1 . 2]" 1
159 1 16 LYS HA 1 36 VAL HB . . 3.390 2.287 2.032 2.474 . 0 0 "[ . 1 . 2]" 1
160 1 16 LYS HA 1 36 VAL MG1 . . 2.890 2.372 2.082 2.716 . 0 0 "[ . 1 . 2]" 1
161 1 16 LYS HA 1 39 THR MG . . 3.900 3.342 3.198 3.535 . 0 0 "[ . 1 . 2]" 1
162 1 16 LYS HB2 1 16 LYS QE . . 4.990 2.925 1.985 3.926 . 0 0 "[ . 1 . 2]" 1
163 1 16 LYS HB2 1 17 LYS H . . 4.110 4.020 3.858 4.125 0.015 14 0 "[ . 1 . 2]" 1
164 1 16 LYS HB2 1 36 VAL MG1 . . 5.380 4.470 4.097 4.789 . 0 0 "[ . 1 . 2]" 1
165 1 16 LYS HB2 1 39 THR MG . . 4.400 4.106 3.954 4.300 . 0 0 "[ . 1 . 2]" 1
166 1 16 LYS HB3 1 16 LYS QE . . 4.670 3.348 2.512 3.723 . 0 0 "[ . 1 . 2]" 1
167 1 16 LYS HB3 1 17 LYS H . . 3.510 2.737 2.497 2.894 . 0 0 "[ . 1 . 2]" 1
168 1 16 LYS HB3 1 17 LYS HG3 . . 3.550 2.401 2.315 2.528 . 0 0 "[ . 1 . 2]" 1
169 1 16 LYS HB3 1 18 MET H . . 5.230 4.877 4.691 5.071 . 0 0 "[ . 1 . 2]" 1
170 1 16 LYS HB3 1 36 VAL MG1 . . 4.970 4.289 3.903 4.715 . 0 0 "[ . 1 . 2]" 1
171 1 16 LYS HB3 1 37 ALA HA . . 5.000 4.598 4.304 4.934 . 0 0 "[ . 1 . 2]" 1
172 1 16 LYS QD 1 36 VAL MG1 . . 5.340 4.174 3.785 4.499 . 0 0 "[ . 1 . 2]" 1
173 1 16 LYS QD 1 38 ASP HA . . 4.040 2.784 1.998 4.041 0.001 10 0 "[ . 1 . 2]" 1
174 1 16 LYS QD 1 39 THR H . . 4.440 2.589 1.931 3.757 . 0 0 "[ . 1 . 2]" 1
175 1 16 LYS QD 1 39 THR MG . . 4.460 3.291 2.919 3.736 . 0 0 "[ . 1 . 2]" 1
176 1 16 LYS HD2 1 38 ASP HA . . 4.720 3.479 2.396 4.476 . 0 0 "[ . 1 . 2]" 1
177 1 16 LYS HD3 1 38 ASP HA . . 4.720 3.363 2.014 4.618 . 0 0 "[ . 1 . 2]" 1
178 1 16 LYS QE 1 16 LYS HG2 . . 3.340 2.693 2.075 3.401 0.061 13 0 "[ . 1 . 2]" 1
179 1 16 LYS QE 1 16 LYS HG3 . . 3.370 2.688 2.231 3.377 0.007 5 0 "[ . 1 . 2]" 1
180 1 16 LYS QE 1 17 LYS H . . 5.500 5.301 4.498 5.526 0.026 17 0 "[ . 1 . 2]" 1
181 1 16 LYS QE 1 36 VAL MG1 . . 4.970 4.312 3.750 4.805 . 0 0 "[ . 1 . 2]" 1
182 1 16 LYS QE 1 39 THR H . . 3.960 2.876 1.884 3.945 . 0 0 "[ . 1 . 2]" 1
183 1 16 LYS HG2 1 17 LYS H . . 4.140 3.670 3.407 3.785 . 0 0 "[ . 1 . 2]" 1
184 1 16 LYS HG2 1 17 LYS HG2 . . 5.390 5.238 5.036 5.393 0.003 6 0 "[ . 1 . 2]" 1
185 1 16 LYS HG2 1 36 VAL MG1 . . 4.100 3.121 2.618 3.668 . 0 0 "[ . 1 . 2]" 1
186 1 16 LYS HG2 1 37 ALA HA . . 4.430 3.892 3.646 4.078 . 0 0 "[ . 1 . 2]" 1
187 1 16 LYS HG2 1 38 ASP H . . 4.660 4.045 3.669 4.506 . 0 0 "[ . 1 . 2]" 1
188 1 16 LYS HG2 1 38 ASP HA . . 3.730 2.622 2.220 3.061 . 0 0 "[ . 1 . 2]" 1
189 1 16 LYS HG3 1 17 LYS H . . 4.560 4.326 4.139 4.450 . 0 0 "[ . 1 . 2]" 1
190 1 16 LYS HG3 1 36 VAL MG1 . . 4.440 2.614 2.087 2.922 . 0 0 "[ . 1 . 2]" 1
191 1 16 LYS HG3 1 37 ALA HA . . 5.460 5.379 5.153 5.464 0.004 16 0 "[ . 1 . 2]" 1
192 1 16 LYS HG3 1 38 ASP HA . . 4.070 3.437 3.014 3.767 . 0 0 "[ . 1 . 2]" 1
193 1 16 LYS HG3 1 39 THR H . . 4.530 3.239 2.864 3.633 . 0 0 "[ . 1 . 2]" 1
194 1 16 LYS HG3 1 39 THR MG . . 3.530 2.067 1.936 2.272 . 0 0 "[ . 1 . 2]" 1
195 1 17 LYS H 1 17 LYS HB2 . . 4.170 3.700 3.643 3.743 . 0 0 "[ . 1 . 2]" 1
196 1 17 LYS H 1 17 LYS HB3 . . 4.110 4.039 3.983 4.058 . 0 0 "[ . 1 . 2]" 1
197 1 17 LYS H 1 17 LYS QE . . 5.140 4.939 4.765 5.096 . 0 0 "[ . 1 . 2]" 1
198 1 17 LYS H 1 17 LYS HG2 . . 3.970 3.198 3.125 3.334 . 0 0 "[ . 1 . 2]" 1
199 1 17 LYS H 1 17 LYS HG3 . . 4.110 3.118 2.970 3.200 . 0 0 "[ . 1 . 2]" 1
200 1 17 LYS H 1 18 MET H . . 3.250 2.567 2.508 2.650 . 0 0 "[ . 1 . 2]" 1
201 1 17 LYS H 1 35 THR HA . . 5.500 5.491 5.422 5.521 0.021 2 0 "[ . 1 . 2]" 1
202 1 17 LYS H 1 35 THR MG . . 3.550 3.451 3.331 3.542 . 0 0 "[ . 1 . 2]" 1
203 1 17 LYS H 1 36 VAL H . . 4.440 4.295 4.172 4.426 . 0 0 "[ . 1 . 2]" 1
204 1 17 LYS H 1 36 VAL HA . . 5.130 4.984 4.792 5.134 0.004 20 0 "[ . 1 . 2]" 1
205 1 17 LYS H 1 36 VAL HB . . 3.350 3.144 2.856 3.289 . 0 0 "[ . 1 . 2]" 1
206 1 17 LYS H 1 36 VAL MG1 . . 4.120 3.893 3.549 4.126 0.006 14 0 "[ . 1 . 2]" 1
207 1 17 LYS H 1 36 VAL MG2 . . 4.790 4.567 4.377 4.695 . 0 0 "[ . 1 . 2]" 1
208 1 17 LYS H 1 37 ALA HA . . 4.560 3.714 3.514 3.958 . 0 0 "[ . 1 . 2]" 1
209 1 17 LYS HA 1 17 LYS HD2 . . 5.500 4.684 4.190 4.992 . 0 0 "[ . 1 . 2]" 1
210 1 17 LYS HA 1 17 LYS QD . . 4.700 4.027 3.868 4.282 . 0 0 "[ . 1 . 2]" 1
211 1 17 LYS HA 1 17 LYS HD3 . . 5.500 4.453 4.098 4.782 . 0 0 "[ . 1 . 2]" 1
212 1 17 LYS HA 1 17 LYS HG2 . . 3.690 2.608 2.532 2.699 . 0 0 "[ . 1 . 2]" 1
213 1 17 LYS HA 1 17 LYS HG3 . . 3.410 3.373 3.299 3.409 . 0 0 "[ . 1 . 2]" 1
214 1 17 LYS HA 1 18 MET H . . 3.480 2.962 2.873 2.988 . 0 0 "[ . 1 . 2]" 1
215 1 17 LYS HA 1 35 THR MG . . 3.000 2.847 2.678 2.935 . 0 0 "[ . 1 . 2]" 1
216 1 17 LYS HA 1 36 VAL H . . 5.050 4.959 4.783 5.056 0.006 9 0 "[ . 1 . 2]" 1
217 1 17 LYS HA 1 36 VAL HB . . 5.110 4.865 4.634 5.003 . 0 0 "[ . 1 . 2]" 1
218 1 17 LYS HB2 1 17 LYS QD . . 3.410 2.584 2.417 2.821 . 0 0 "[ . 1 . 2]" 1
219 1 17 LYS HB2 1 17 LYS QE . . 4.570 3.423 2.266 4.179 . 0 0 "[ . 1 . 2]" 1
220 1 17 LYS HB2 1 18 MET H . . 4.130 4.037 4.007 4.138 0.008 20 0 "[ . 1 . 2]" 1
221 1 17 LYS HB3 1 17 LYS HD2 . . 4.170 3.044 2.211 3.708 . 0 0 "[ . 1 . 2]" 1
222 1 17 LYS HB3 1 17 LYS QD . . 3.460 2.374 2.170 2.808 . 0 0 "[ . 1 . 2]" 1
223 1 17 LYS HB3 1 17 LYS HD3 . . 4.170 2.746 2.211 3.527 . 0 0 "[ . 1 . 2]" 1
224 1 17 LYS HB3 1 17 LYS QE . . 4.740 3.192 1.985 4.113 . 0 0 "[ . 1 . 2]" 1
225 1 17 LYS HB3 1 18 MET H . . 4.750 4.512 4.488 4.542 . 0 0 "[ . 1 . 2]" 1
226 1 17 LYS HB3 1 35 THR MG . . 4.660 4.568 4.370 4.661 0.001 14 0 "[ . 1 . 2]" 1
227 1 17 LYS QE 1 17 LYS HG3 . . 3.370 2.702 2.205 3.403 0.033 9 0 "[ . 1 . 2]" 1
228 1 17 LYS HG2 1 35 THR MG . . 4.670 4.601 4.439 4.674 0.004 13 0 "[ . 1 . 2]" 1
229 1 17 LYS HG3 1 18 MET H . . 5.230 4.841 4.729 4.973 . 0 0 "[ . 1 . 2]" 1
230 1 17 LYS HG3 1 35 THR MG . . 5.500 5.457 5.337 5.506 0.006 8 0 "[ . 1 . 2]" 1
231 1 18 MET H 1 18 MET HB2 . . 3.910 3.766 3.724 3.811 . 0 0 "[ . 1 . 2]" 1
232 1 18 MET H 1 18 MET HB3 . . 3.180 2.775 2.665 2.877 . 0 0 "[ . 1 . 2]" 1
233 1 18 MET H 1 18 MET HG2 . . 3.520 2.548 2.326 3.385 . 0 0 "[ . 1 . 2]" 1
234 1 18 MET H 1 18 MET HG3 . . 3.870 3.341 2.062 3.544 . 0 0 "[ . 1 . 2]" 1
235 1 18 MET H 1 19 LYS H . . 4.580 4.451 4.412 4.486 . 0 0 "[ . 1 . 2]" 1
236 1 18 MET H 1 35 THR HA . . 4.770 4.266 4.082 4.377 . 0 0 "[ . 1 . 2]" 1
237 1 18 MET H 1 35 THR MG . . 4.100 3.343 2.966 3.555 . 0 0 "[ . 1 . 2]" 1
238 1 18 MET H 1 36 VAL H . . 3.830 3.200 3.063 3.366 . 0 0 "[ . 1 . 2]" 1
239 1 18 MET H 1 36 VAL HB . . 3.400 2.789 2.644 3.068 . 0 0 "[ . 1 . 2]" 1
240 1 18 MET H 1 36 VAL MG1 . . 4.710 4.323 4.182 4.599 . 0 0 "[ . 1 . 2]" 1
241 1 18 MET H 1 36 VAL MG2 . . 3.650 3.470 3.324 3.654 0.004 10 0 "[ . 1 . 2]" 1
242 1 18 MET HA 1 18 MET HG2 . . 4.030 3.872 3.800 4.216 0.186 10 0 "[ . 1 . 2]" 1
243 1 18 MET HA 1 18 MET HG3 . . 3.720 3.593 3.553 3.665 . 0 0 "[ . 1 . 2]" 1
244 1 18 MET HA 1 19 LYS H . . 2.680 2.575 2.501 2.653 . 0 0 "[ . 1 . 2]" 1
245 1 18 MET HA 1 19 LYS HA . . 4.730 4.426 4.397 4.450 . 0 0 "[ . 1 . 2]" 1
246 1 18 MET HA 1 19 LYS HB2 . . 4.590 4.554 4.488 4.600 0.010 19 0 "[ . 1 . 2]" 1
247 1 18 MET HA 1 19 LYS QG . . 4.110 3.651 3.524 3.728 . 0 0 "[ . 1 . 2]" 1
248 1 18 MET HA 1 35 THR MG . . 4.770 4.548 4.247 4.714 . 0 0 "[ . 1 . 2]" 1
249 1 18 MET HA 1 36 VAL MG2 . . 5.500 5.004 4.805 5.155 . 0 0 "[ . 1 . 2]" 1
250 1 18 MET HB2 1 19 LYS H . . 3.830 2.289 2.123 2.429 . 0 0 "[ . 1 . 2]" 1
251 1 18 MET HB2 1 19 LYS HA . . 4.990 4.812 4.595 4.894 . 0 0 "[ . 1 . 2]" 1
252 1 18 MET HB2 1 36 VAL MG2 . . 4.590 4.411 4.247 4.570 . 0 0 "[ . 1 . 2]" 1
253 1 18 MET HB3 1 19 LYS H . . 3.970 3.735 3.629 3.837 . 0 0 "[ . 1 . 2]" 1
254 1 18 MET HB3 1 36 VAL MG2 . . 4.510 4.139 3.894 4.323 . 0 0 "[ . 1 . 2]" 1
255 1 18 MET ME 1 18 MET HG2 . . 3.070 2.573 2.069 2.912 . 0 0 "[ . 1 . 2]" 1
256 1 18 MET ME 1 18 MET HG3 . . 3.650 2.355 2.131 3.112 . 0 0 "[ . 1 . 2]" 1
257 1 18 MET ME 1 19 LYS H . . 4.700 4.413 4.085 4.622 . 0 0 "[ . 1 . 2]" 1
258 1 18 MET ME 1 20 LEU MD2 . . 4.550 2.130 1.951 2.374 . 0 0 "[ . 1 . 2]" 1
259 1 18 MET ME 1 20 LEU HG . . 4.430 4.260 3.945 4.433 0.003 9 0 "[ . 1 . 2]" 1
260 1 18 MET ME 1 34 ALA MB . . 5.500 5.104 4.891 5.374 . 0 0 "[ . 1 . 2]" 1
261 1 18 MET ME 1 36 VAL MG2 . . 3.230 1.831 1.720 2.225 . 0 0 "[ . 1 . 2]" 1
262 1 18 MET ME 1 61 ALA MB . . 5.190 4.932 4.663 5.191 0.001 14 0 "[ . 1 . 2]" 1
263 1 18 MET HG2 1 19 LYS H . . 4.430 4.089 3.855 4.338 . 0 0 "[ . 1 . 2]" 1
264 1 18 MET HG2 1 35 THR MG . . 5.470 4.949 4.691 5.478 0.008 10 0 "[ . 1 . 2]" 1
265 1 18 MET HG2 1 36 VAL HB . . 3.580 2.540 2.320 3.186 . 0 0 "[ . 1 . 2]" 1
266 1 18 MET HG2 1 36 VAL MG2 . . 4.330 2.153 1.908 2.540 . 0 0 "[ . 1 . 2]" 1
267 1 18 MET HG3 1 19 LYS H . . 4.100 2.782 2.447 3.952 . 0 0 "[ . 1 . 2]" 1
268 1 18 MET HG3 1 20 LEU MD2 . . 5.500 3.719 3.393 4.194 . 0 0 "[ . 1 . 2]" 1
269 1 18 MET HG3 1 36 VAL MG2 . . 4.020 2.456 2.184 2.668 . 0 0 "[ . 1 . 2]" 1
270 1 19 LYS H 1 19 LYS HB2 . . 3.050 2.502 2.449 2.570 . 0 0 "[ . 1 . 2]" 1
271 1 19 LYS H 1 19 LYS HB3 . . 3.690 3.694 3.660 3.738 0.048 19 0 "[ . 1 . 2]" 1
272 1 19 LYS H 1 19 LYS HD3 . . 4.470 4.284 4.082 4.462 . 0 0 "[ . 1 . 2]" 1
273 1 19 LYS H 1 19 LYS QG . . 3.110 3.041 2.919 3.122 0.012 18 0 "[ . 1 . 2]" 1
274 1 19 LYS H 1 20 LEU H . . 4.520 4.484 4.416 4.521 0.001 6 0 "[ . 1 . 2]" 1
275 1 19 LYS H 1 35 THR HA . . 5.240 5.030 4.909 5.160 . 0 0 "[ . 1 . 2]" 1
276 1 19 LYS H 1 36 VAL MG2 . . 5.220 4.679 4.484 4.868 . 0 0 "[ . 1 . 2]" 1
277 1 19 LYS H 1 69 VAL HB . . 5.500 5.498 5.347 5.519 0.019 14 0 "[ . 1 . 2]" 1
278 1 19 LYS H 1 69 VAL MG2 . . 3.990 3.546 3.267 3.791 . 0 0 "[ . 1 . 2]" 1
279 1 19 LYS HA 1 19 LYS HD2 . . 3.830 2.641 2.327 3.088 . 0 0 "[ . 1 . 2]" 1
280 1 19 LYS HA 1 19 LYS HD3 . . 3.860 2.208 1.984 2.376 . 0 0 "[ . 1 . 2]" 1
281 1 19 LYS HA 1 19 LYS HE2 . . 4.670 4.600 4.177 4.710 0.040 19 0 "[ . 1 . 2]" 1
282 1 19 LYS HA 1 19 LYS HE3 . . 4.670 4.544 4.394 4.681 0.011 18 0 "[ . 1 . 2]" 1
283 1 19 LYS HA 1 19 LYS QG . . 3.410 2.841 2.730 2.892 . 0 0 "[ . 1 . 2]" 1
284 1 19 LYS HA 1 20 LEU H . . 2.790 2.264 2.195 2.308 . 0 0 "[ . 1 . 2]" 1
285 1 19 LYS HA 1 20 LEU HG . . 5.060 4.715 4.657 4.783 . 0 0 "[ . 1 . 2]" 1
286 1 19 LYS HA 1 33 VAL MG1 . . 3.910 3.512 3.316 3.671 . 0 0 "[ . 1 . 2]" 1
287 1 19 LYS HA 1 34 ALA H . . 4.810 4.019 3.878 4.174 . 0 0 "[ . 1 . 2]" 1
288 1 19 LYS HA 1 35 THR HA . . 3.360 2.837 2.731 2.993 . 0 0 "[ . 1 . 2]" 1
289 1 19 LYS HA 1 36 VAL H . . 4.290 3.925 3.816 4.158 . 0 0 "[ . 1 . 2]" 1
290 1 19 LYS HA 1 36 VAL MG2 . . 4.600 4.213 4.019 4.499 . 0 0 "[ . 1 . 2]" 1
291 1 19 LYS HA 1 69 VAL MG2 . . 4.250 3.612 3.498 3.705 . 0 0 "[ . 1 . 2]" 1
292 1 19 LYS HB2 1 19 LYS QE . . 4.700 4.357 4.160 4.584 . 0 0 "[ . 1 . 2]" 1
293 1 19 LYS HB2 1 19 LYS QG . . 2.670 2.167 2.164 2.168 . 0 0 "[ . 1 . 2]" 1
294 1 19 LYS HB2 1 20 LEU H . . 4.180 3.998 3.890 4.158 . 0 0 "[ . 1 . 2]" 1
295 1 19 LYS HB2 1 69 VAL MG2 . . 3.480 2.158 1.986 2.355 . 0 0 "[ . 1 . 2]" 1
296 1 19 LYS HB3 1 19 LYS HD2 . . 3.490 2.392 2.313 2.498 . 0 0 "[ . 1 . 2]" 1
297 1 19 LYS HB3 1 19 LYS QE . . 4.470 3.822 3.589 4.061 . 0 0 "[ . 1 . 2]" 1
298 1 19 LYS HB3 1 20 LEU H . . 4.020 2.816 2.674 3.061 . 0 0 "[ . 1 . 2]" 1
299 1 19 LYS HB3 1 33 VAL MG2 . . 4.250 4.055 3.912 4.248 . 0 0 "[ . 1 . 2]" 1
300 1 19 LYS HB3 1 34 ALA H . . 4.600 4.114 3.932 4.347 . 0 0 "[ . 1 . 2]" 1
301 1 19 LYS HB3 1 69 VAL MG1 . . 4.140 3.749 3.378 3.854 . 0 0 "[ . 1 . 2]" 1
302 1 19 LYS HB3 1 69 VAL MG2 . . 3.470 2.045 1.894 2.229 . 0 0 "[ . 1 . 2]" 1
303 1 19 LYS HD2 1 20 LEU H . . 4.510 3.381 3.052 3.850 . 0 0 "[ . 1 . 2]" 1
304 1 19 LYS HD2 1 33 VAL MG1 . . 3.310 1.908 1.816 2.029 . 0 0 "[ . 1 . 2]" 1
305 1 19 LYS HD2 1 34 ALA H . . 4.730 3.628 3.251 4.058 . 0 0 "[ . 1 . 2]" 1
306 1 19 LYS HD2 1 35 THR HA . . 4.650 4.090 3.688 4.631 . 0 0 "[ . 1 . 2]" 1
307 1 19 LYS HD3 1 20 LEU H . . 4.700 3.909 3.487 4.152 . 0 0 "[ . 1 . 2]" 1
308 1 19 LYS HD3 1 33 VAL MG1 . . 3.770 3.172 2.839 3.333 . 0 0 "[ . 1 . 2]" 1
309 1 19 LYS HD3 1 35 THR HA . . 4.440 2.951 2.710 3.298 . 0 0 "[ . 1 . 2]" 1
310 1 19 LYS HD3 1 35 THR MG . . 4.070 3.306 3.066 3.651 . 0 0 "[ . 1 . 2]" 1
311 1 19 LYS QE 1 19 LYS QG . . 3.390 2.224 2.042 2.498 . 0 0 "[ . 1 . 2]" 1
312 1 19 LYS QE 1 33 VAL MG1 . . 3.130 2.463 2.016 3.139 0.009 18 0 "[ . 1 . 2]" 1
313 1 19 LYS QE 1 33 VAL MG2 . . 4.720 4.294 3.782 4.749 0.029 18 0 "[ . 1 . 2]" 1
314 1 19 LYS HE2 1 33 VAL MG1 . . 3.610 2.953 2.259 3.663 0.053 18 0 "[ . 1 . 2]" 1
315 1 19 LYS HE3 1 33 VAL MG1 . . 3.610 2.845 2.091 3.610 0.000 14 0 "[ . 1 . 2]" 1
316 1 19 LYS QG 1 20 LEU H . . 4.530 4.361 4.276 4.453 . 0 0 "[ . 1 . 2]" 1
317 1 19 LYS QG 1 33 VAL MG1 . . 3.540 3.181 3.004 3.436 . 0 0 "[ . 1 . 2]" 1
318 1 19 LYS QG 1 33 VAL MG2 . . 4.910 4.537 4.305 4.782 . 0 0 "[ . 1 . 2]" 1
319 1 19 LYS QG 1 35 THR HA . . 5.010 4.516 4.357 4.787 . 0 0 "[ . 1 . 2]" 1
320 1 19 LYS QG 1 69 VAL MG1 . . 4.710 4.383 4.112 4.552 . 0 0 "[ . 1 . 2]" 1
321 1 19 LYS QG 1 69 VAL MG2 . . 3.840 3.376 3.222 3.606 . 0 0 "[ . 1 . 2]" 1
322 1 20 LEU H 1 20 LEU HB2 . . 4.160 4.024 3.986 4.055 . 0 0 "[ . 1 . 2]" 1
323 1 20 LEU H 1 20 LEU HB3 . . 3.930 3.154 3.082 3.212 . 0 0 "[ . 1 . 2]" 1
324 1 20 LEU H 1 20 LEU MD2 . . 4.430 3.959 3.877 4.006 . 0 0 "[ . 1 . 2]" 1
325 1 20 LEU H 1 20 LEU HG . . 3.580 3.067 2.982 3.138 . 0 0 "[ . 1 . 2]" 1
326 1 20 LEU H 1 33 VAL HA . . 4.410 4.074 3.932 4.329 . 0 0 "[ . 1 . 2]" 1
327 1 20 LEU H 1 33 VAL MG1 . . 3.380 2.943 2.696 3.213 . 0 0 "[ . 1 . 2]" 1
328 1 20 LEU H 1 34 ALA H . . 3.470 2.400 2.304 2.548 . 0 0 "[ . 1 . 2]" 1
329 1 20 LEU H 1 34 ALA MB . . 4.030 3.265 3.079 3.387 . 0 0 "[ . 1 . 2]" 1
330 1 20 LEU H 1 35 THR HA . . 4.310 4.050 3.742 4.208 . 0 0 "[ . 1 . 2]" 1
331 1 20 LEU H 1 36 VAL MG2 . . 4.640 4.621 4.441 4.650 0.010 14 0 "[ . 1 . 2]" 1
332 1 20 LEU H 1 69 VAL MG2 . . 3.840 3.003 2.849 3.183 . 0 0 "[ . 1 . 2]" 1
333 1 20 LEU HB2 1 20 LEU MD1 . . 3.160 2.022 1.993 2.072 . 0 0 "[ . 1 . 2]" 1
334 1 20 LEU HB2 1 20 LEU MD2 . . 3.400 2.655 2.548 2.715 . 0 0 "[ . 1 . 2]" 1
335 1 20 LEU HB2 1 21 GLU H . . 3.380 3.103 2.956 3.168 . 0 0 "[ . 1 . 2]" 1
336 1 20 LEU HB2 1 34 ALA MB . . 4.690 4.607 4.571 4.644 . 0 0 "[ . 1 . 2]" 1
337 1 20 LEU HB3 1 20 LEU MD2 . . 3.210 2.060 1.959 2.178 . 0 0 "[ . 1 . 2]" 1
338 1 20 LEU HB3 1 21 GLU H . . 4.380 4.259 4.176 4.295 . 0 0 "[ . 1 . 2]" 1
339 1 20 LEU HB3 1 34 ALA MB . . 4.120 4.140 4.125 4.158 0.038 9 0 "[ . 1 . 2]" 1
340 1 20 LEU HB3 1 36 VAL MG2 . . 3.500 3.312 3.006 3.437 . 0 0 "[ . 1 . 2]" 1
341 1 20 LEU HB3 1 66 ILE MG . . 4.640 4.512 4.316 4.645 0.005 11 0 "[ . 1 . 2]" 1
342 1 20 LEU MD1 1 21 GLU H . . 3.730 2.930 2.711 3.011 . 0 0 "[ . 1 . 2]" 1
343 1 20 LEU MD1 1 66 ILE HA . . 4.590 3.087 2.877 3.375 . 0 0 "[ . 1 . 2]" 1
344 1 20 LEU MD1 1 66 ILE MG . . 2.960 1.819 1.718 1.932 . 0 0 "[ . 1 . 2]" 1
345 1 20 LEU MD1 1 67 HIS H . . 4.650 2.652 2.407 3.005 . 0 0 "[ . 1 . 2]" 1
346 1 20 LEU MD1 1 68 PRO HB3 . . 5.410 5.336 5.190 5.414 0.004 14 0 "[ . 1 . 2]" 1
347 1 20 LEU MD1 1 69 VAL H . . 5.050 5.002 4.777 5.057 0.007 10 0 "[ . 1 . 2]" 1
348 1 20 LEU MD2 1 21 GLU H . . 4.970 4.860 4.712 4.904 . 0 0 "[ . 1 . 2]" 1
349 1 20 LEU MD2 1 36 VAL H . . 4.680 3.603 3.469 3.765 . 0 0 "[ . 1 . 2]" 1
350 1 20 LEU MD2 1 36 VAL HA . . 4.620 3.869 3.545 4.100 . 0 0 "[ . 1 . 2]" 1
351 1 20 LEU MD2 1 36 VAL HB . . 4.670 4.431 4.262 4.595 . 0 0 "[ . 1 . 2]" 1
352 1 20 LEU MD2 1 36 VAL MG2 . . 3.100 2.006 1.873 2.137 . 0 0 "[ . 1 . 2]" 1
353 1 20 LEU MD2 1 44 VAL HB . . 4.760 4.457 4.082 4.640 . 0 0 "[ . 1 . 2]" 1
354 1 20 LEU MD2 1 66 ILE HB . . 5.390 5.215 4.990 5.406 0.016 14 0 "[ . 1 . 2]" 1
355 1 20 LEU MD2 1 66 ILE MD . . 3.610 3.255 2.944 3.546 . 0 0 "[ . 1 . 2]" 1
356 1 20 LEU MD2 1 66 ILE HG12 . . 4.680 3.840 3.572 4.104 . 0 0 "[ . 1 . 2]" 1
357 1 20 LEU MD2 1 66 ILE MG . . 2.960 2.702 2.441 2.895 . 0 0 "[ . 1 . 2]" 1
358 1 20 LEU HG 1 34 ALA MB . . 4.040 1.968 1.956 1.983 . 0 0 "[ . 1 . 2]" 1
359 1 21 GLU H 1 21 GLU HB2 . . 3.470 2.386 2.220 2.480 . 0 0 "[ . 1 . 2]" 1
360 1 21 GLU H 1 21 GLU HB3 . . 3.790 3.593 3.489 3.625 . 0 0 "[ . 1 . 2]" 1
361 1 21 GLU H 1 21 GLU QG . . 3.680 2.547 2.355 3.175 . 0 0 "[ . 1 . 2]" 1
362 1 21 GLU H 1 22 VAL H . . 4.430 4.436 4.386 4.558 0.128 11 0 "[ . 1 . 2]" 1
363 1 21 GLU H 1 22 VAL MG2 . . 4.780 4.428 4.291 4.563 . 0 0 "[ . 1 . 2]" 1
364 1 21 GLU H 1 33 VAL HA . . 5.110 4.762 4.519 5.071 . 0 0 "[ . 1 . 2]" 1
365 1 21 GLU H 1 66 ILE MG . . 4.910 4.717 4.407 4.914 0.004 12 0 "[ . 1 . 2]" 1
366 1 21 GLU H 1 67 HIS H . . 4.390 4.204 4.073 4.300 . 0 0 "[ . 1 . 2]" 1
367 1 21 GLU H 1 67 HIS HB2 . . 4.410 4.121 3.996 4.342 . 0 0 "[ . 1 . 2]" 1
368 1 21 GLU H 1 67 HIS HB3 . . 4.930 4.819 4.669 4.935 0.005 20 0 "[ . 1 . 2]" 1
369 1 21 GLU H 1 68 PRO HA . . 4.180 3.235 2.892 3.404 . 0 0 "[ . 1 . 2]" 1
370 1 21 GLU H 1 69 VAL H . . 4.820 3.528 3.228 3.726 . 0 0 "[ . 1 . 2]" 1
371 1 21 GLU H 1 69 VAL HA . . 4.270 3.142 2.925 3.397 . 0 0 "[ . 1 . 2]" 1
372 1 21 GLU H 1 69 VAL HB . . 5.450 5.207 5.096 5.356 . 0 0 "[ . 1 . 2]" 1
373 1 21 GLU H 1 69 VAL MG1 . . 5.320 5.064 4.930 5.274 . 0 0 "[ . 1 . 2]" 1
374 1 21 GLU H 1 69 VAL MG2 . . 4.410 3.283 3.012 3.445 . 0 0 "[ . 1 . 2]" 1
375 1 21 GLU HA 1 21 GLU HG2 . . 3.980 2.483 2.341 2.966 . 0 0 "[ . 1 . 2]" 1
376 1 21 GLU HA 1 21 GLU HG3 . . 3.980 3.110 2.973 3.559 . 0 0 "[ . 1 . 2]" 1
377 1 21 GLU HA 1 22 VAL H . . 2.940 2.143 2.138 2.207 . 0 0 "[ . 1 . 2]" 1
378 1 21 GLU HA 1 34 ALA H . . 3.920 3.520 3.282 3.810 . 0 0 "[ . 1 . 2]" 1
379 1 21 GLU HB2 1 31 ILE MG . . 4.150 3.169 3.012 3.408 . 0 0 "[ . 1 . 2]" 1
380 1 21 GLU HB2 1 67 HIS H . . 4.260 3.934 3.799 4.071 . 0 0 "[ . 1 . 2]" 1
381 1 21 GLU HB2 1 67 HIS HB2 . . 4.000 2.434 2.245 2.827 . 0 0 "[ . 1 . 2]" 1
382 1 21 GLU HB2 1 67 HIS HB3 . . 4.250 3.316 3.144 3.488 . 0 0 "[ . 1 . 2]" 1
383 1 21 GLU HB2 1 67 HIS HD2 . . 5.360 4.720 4.478 5.303 . 0 0 "[ . 1 . 2]" 1
384 1 21 GLU HB2 1 71 TRP H . . 4.460 3.906 3.563 4.352 . 0 0 "[ . 1 . 2]" 1
385 1 21 GLU HB2 1 71 TRP HB2 . . 4.790 3.954 3.414 4.378 . 0 0 "[ . 1 . 2]" 1
386 1 21 GLU HB2 1 71 TRP HB3 . . 4.770 2.967 2.764 3.183 . 0 0 "[ . 1 . 2]" 1
387 1 21 GLU HB2 1 79 LEU MD2 . . 5.500 5.296 4.758 5.494 . 0 0 "[ . 1 . 2]" 1
388 1 21 GLU HB3 1 22 VAL H . . 4.160 3.502 3.092 3.617 . 0 0 "[ . 1 . 2]" 1
389 1 21 GLU HB3 1 31 ILE MG . . 3.310 1.859 1.831 1.931 . 0 0 "[ . 1 . 2]" 1
390 1 21 GLU HB3 1 67 HIS HB2 . . 4.090 3.123 2.619 3.403 . 0 0 "[ . 1 . 2]" 1
391 1 21 GLU HB3 1 67 HIS HB3 . . 4.650 4.415 3.933 4.620 . 0 0 "[ . 1 . 2]" 1
392 1 21 GLU HB3 1 79 LEU MD1 . . 3.640 3.156 2.859 3.638 . 0 0 "[ . 1 . 2]" 1
393 1 21 GLU QG 1 22 VAL H . . 4.190 4.145 4.003 4.231 0.041 11 0 "[ . 1 . 2]" 1
394 1 21 GLU QG 1 31 ILE MG . . 4.130 3.017 2.645 3.178 . 0 0 "[ . 1 . 2]" 1
395 1 21 GLU QG 1 33 VAL HA . . 4.730 3.175 2.944 3.674 . 0 0 "[ . 1 . 2]" 1
396 1 21 GLU QG 1 33 VAL MG2 . . 3.400 3.076 2.810 3.406 0.006 11 0 "[ . 1 . 2]" 1
397 1 21 GLU QG 1 34 ALA H . . 5.340 4.545 4.349 4.950 . 0 0 "[ . 1 . 2]" 1
398 1 21 GLU QG 1 69 VAL HA . . 3.130 2.057 1.985 2.181 . 0 0 "[ . 1 . 2]" 1
399 1 21 GLU QG 1 69 VAL MG1 . . 3.800 3.713 3.584 3.805 0.005 15 0 "[ . 1 . 2]" 1
400 1 21 GLU QG 1 69 VAL MG2 . . 3.410 3.160 2.806 3.400 . 0 0 "[ . 1 . 2]" 1
401 1 21 GLU QG 1 70 GLY H . . 4.890 3.498 2.498 4.893 0.003 11 0 "[ . 1 . 2]" 1
402 1 21 GLU QG 1 79 LEU MD1 . . 3.320 2.384 1.967 2.793 . 0 0 "[ . 1 . 2]" 1
403 1 21 GLU QG 1 79 LEU MD2 . . 4.030 2.946 2.410 3.250 . 0 0 "[ . 1 . 2]" 1
404 1 21 GLU HG2 1 69 VAL HA . . 3.870 3.557 2.196 3.754 . 0 0 "[ . 1 . 2]" 1
405 1 21 GLU HG2 1 79 LEU MD1 . . 4.110 2.469 1.980 3.539 . 0 0 "[ . 1 . 2]" 1
406 1 21 GLU HG3 1 69 VAL HA . . 3.870 2.144 1.996 3.700 . 0 0 "[ . 1 . 2]" 1
407 1 21 GLU HG3 1 79 LEU MD1 . . 4.110 3.645 2.449 4.043 . 0 0 "[ . 1 . 2]" 1
408 1 22 VAL H 1 22 VAL HB . . 3.260 2.589 2.505 2.783 . 0 0 "[ . 1 . 2]" 1
409 1 22 VAL H 1 22 VAL MG1 . . 4.130 3.825 3.764 3.903 . 0 0 "[ . 1 . 2]" 1
410 1 22 VAL H 1 22 VAL MG2 . . 3.320 2.637 2.398 2.905 . 0 0 "[ . 1 . 2]" 1
411 1 22 VAL H 1 23 VAL H . . 4.920 4.478 4.359 4.541 . 0 0 "[ . 1 . 2]" 1
412 1 22 VAL H 1 23 VAL HA . . 5.310 5.049 4.805 5.110 . 0 0 "[ . 1 . 2]" 1
413 1 22 VAL H 1 31 ILE MG . . 3.720 3.012 2.215 3.212 . 0 0 "[ . 1 . 2]" 1
414 1 22 VAL H 1 32 ARG H . . 3.740 3.318 3.016 3.512 . 0 0 "[ . 1 . 2]" 1
415 1 22 VAL H 1 32 ARG HB2 . . 5.020 4.802 4.697 4.972 . 0 0 "[ . 1 . 2]" 1
416 1 22 VAL H 1 33 VAL HA . . 4.060 3.913 3.752 4.021 . 0 0 "[ . 1 . 2]" 1
417 1 22 VAL H 1 33 VAL MG2 . . 5.400 5.375 5.205 5.409 0.009 9 0 "[ . 1 . 2]" 1
418 1 22 VAL H 1 34 ALA H . . 4.660 4.217 4.032 4.668 0.008 11 0 "[ . 1 . 2]" 1
419 1 22 VAL H 1 34 ALA MB . . 3.680 3.046 2.785 3.647 . 0 0 "[ . 1 . 2]" 1
420 1 22 VAL H 1 48 PHE QE . . 4.800 4.438 3.509 4.780 . 0 0 "[ . 1 . 2]" 1
421 1 22 VAL HA 1 22 VAL MG1 . . 3.320 2.361 2.223 2.447 . 0 0 "[ . 1 . 2]" 1
422 1 22 VAL HA 1 22 VAL MG2 . . 3.300 2.381 2.255 2.485 . 0 0 "[ . 1 . 2]" 1
423 1 22 VAL HA 1 23 VAL H . . 3.020 2.211 2.161 2.297 . 0 0 "[ . 1 . 2]" 1
424 1 22 VAL HA 1 23 VAL HA . . 4.590 4.352 4.345 4.364 . 0 0 "[ . 1 . 2]" 1
425 1 22 VAL HA 1 23 VAL HB . . 4.640 4.636 4.577 4.666 0.026 19 0 "[ . 1 . 2]" 1
426 1 22 VAL HA 1 34 ALA MB . . 4.860 4.430 4.294 4.729 . 0 0 "[ . 1 . 2]" 1
427 1 22 VAL HA 1 66 ILE H . . 5.500 5.256 5.114 5.369 . 0 0 "[ . 1 . 2]" 1
428 1 22 VAL HA 1 66 ILE HA . . 3.770 2.723 2.591 2.872 . 0 0 "[ . 1 . 2]" 1
429 1 22 VAL HA 1 66 ILE MG . . 4.520 4.012 3.659 4.259 . 0 0 "[ . 1 . 2]" 1
430 1 22 VAL HA 1 67 HIS H . . 3.660 2.874 2.744 2.978 . 0 0 "[ . 1 . 2]" 1
431 1 22 VAL HA 1 67 HIS HD2 . . 4.710 4.399 4.108 4.705 . 0 0 "[ . 1 . 2]" 1
432 1 22 VAL HB 1 23 VAL H . . 4.600 3.994 3.761 4.183 . 0 0 "[ . 1 . 2]" 1
433 1 22 VAL HB 1 32 ARG H . . 4.770 4.416 4.044 4.582 . 0 0 "[ . 1 . 2]" 1
434 1 22 VAL HB 1 34 ALA MB . . 3.640 2.752 2.570 3.153 . 0 0 "[ . 1 . 2]" 1
435 1 22 VAL HB 1 46 VAL MG1 . . 4.670 4.313 4.147 4.565 . 0 0 "[ . 1 . 2]" 1
436 1 22 VAL HB 1 46 VAL MG2 . . 4.860 3.784 3.553 4.013 . 0 0 "[ . 1 . 2]" 1
437 1 22 VAL HB 1 48 PHE QD . . 4.670 4.535 4.393 4.671 0.001 9 0 "[ . 1 . 2]" 1
438 1 22 VAL HB 1 48 PHE QE . . 3.620 2.904 2.612 3.145 . 0 0 "[ . 1 . 2]" 1
439 1 22 VAL HB 1 48 PHE HZ . . 4.570 2.298 1.998 2.624 . 0 0 "[ . 1 . 2]" 1
440 1 22 VAL HB 1 59 ILE MD . . 4.780 4.785 4.773 4.799 0.019 14 0 "[ . 1 . 2]" 1
441 1 22 VAL MG1 1 23 VAL H . . 3.500 2.146 1.877 2.486 . 0 0 "[ . 1 . 2]" 1
442 1 22 VAL MG1 1 24 ASP HA . . 4.450 3.829 3.537 4.153 . 0 0 "[ . 1 . 2]" 1
443 1 22 VAL MG1 1 25 LYS H . . 4.670 4.357 4.080 4.672 0.002 10 0 "[ . 1 . 2]" 1
444 1 22 VAL MG1 1 25 LYS QE . . 5.200 4.388 3.005 5.204 0.004 9 0 "[ . 1 . 2]" 1
445 1 22 VAL MG1 1 46 VAL MG2 . . 3.030 2.426 2.133 2.868 . 0 0 "[ . 1 . 2]" 1
446 1 22 VAL MG1 1 48 PHE QE . . 3.520 2.758 2.406 3.158 . 0 0 "[ . 1 . 2]" 1
447 1 22 VAL MG1 1 48 PHE HZ . . 3.610 2.225 1.970 2.683 . 0 0 "[ . 1 . 2]" 1
448 1 22 VAL MG1 1 57 TYR QE . . 4.150 2.653 2.434 2.957 . 0 0 "[ . 1 . 2]" 1
449 1 22 VAL MG1 1 59 ILE HG12 . . 4.990 4.627 4.466 4.812 . 0 0 "[ . 1 . 2]" 1
450 1 22 VAL MG1 1 65 ASP HB2 . . 4.700 3.916 3.643 4.162 . 0 0 "[ . 1 . 2]" 1
451 1 22 VAL MG1 1 65 ASP QB . . 3.960 3.673 3.449 3.898 . 0 0 "[ . 1 . 2]" 1
452 1 22 VAL MG1 1 65 ASP HB3 . . 4.700 4.449 4.266 4.701 0.001 20 0 "[ . 1 . 2]" 1
453 1 22 VAL MG1 1 66 ILE HA . . 3.890 3.407 3.072 3.722 . 0 0 "[ . 1 . 2]" 1
454 1 22 VAL MG1 1 66 ILE HG12 . . 3.870 3.175 2.811 3.648 . 0 0 "[ . 1 . 2]" 1
455 1 22 VAL MG1 1 66 ILE MG . . 4.750 4.339 4.104 4.753 0.003 5 0 "[ . 1 . 2]" 1
456 1 22 VAL MG1 1 67 HIS H . . 4.760 4.512 4.307 4.709 . 0 0 "[ . 1 . 2]" 1
457 1 22 VAL MG2 1 23 VAL H . . 3.950 3.892 3.715 3.969 0.019 17 0 "[ . 1 . 2]" 1
458 1 22 VAL MG2 1 34 ALA H . . 4.230 4.025 3.757 4.233 0.003 18 0 "[ . 1 . 2]" 1
459 1 22 VAL MG2 1 34 ALA MB . . 2.970 1.928 1.802 2.157 . 0 0 "[ . 1 . 2]" 1
460 1 22 VAL MG2 1 46 VAL HB . . 3.750 2.248 2.023 2.553 . 0 0 "[ . 1 . 2]" 1
461 1 22 VAL MG2 1 46 VAL MG1 . . 3.170 2.034 1.886 2.344 . 0 0 "[ . 1 . 2]" 1
462 1 22 VAL MG2 1 46 VAL MG2 . . 3.480 2.548 2.290 2.796 . 0 0 "[ . 1 . 2]" 1
463 1 22 VAL MG2 1 47 HIS H . . 5.500 5.196 5.008 5.496 . 0 0 "[ . 1 . 2]" 1
464 1 22 VAL MG2 1 48 PHE QD . . 4.810 4.559 4.363 4.743 . 0 0 "[ . 1 . 2]" 1
465 1 22 VAL MG2 1 48 PHE QE . . 3.900 3.271 2.903 3.597 . 0 0 "[ . 1 . 2]" 1
466 1 22 VAL MG2 1 48 PHE HZ . . 4.350 3.773 3.195 4.033 . 0 0 "[ . 1 . 2]" 1
467 1 22 VAL MG2 1 57 TYR QE . . 4.590 4.150 3.950 4.591 0.001 16 0 "[ . 1 . 2]" 1
468 1 22 VAL MG2 1 59 ILE MD . . 3.600 3.420 3.132 3.594 . 0 0 "[ . 1 . 2]" 1
469 1 22 VAL MG2 1 66 ILE HA . . 3.540 3.224 2.992 3.447 . 0 0 "[ . 1 . 2]" 1
470 1 22 VAL MG2 1 67 HIS H . . 3.870 3.668 3.517 3.841 . 0 0 "[ . 1 . 2]" 1
471 1 23 VAL H 1 23 VAL HB . . 3.320 2.465 2.404 2.495 . 0 0 "[ . 1 . 2]" 1
472 1 23 VAL H 1 23 VAL MG2 . . 3.120 2.408 2.177 2.639 . 0 0 "[ . 1 . 2]" 1
473 1 23 VAL H 1 31 ILE HA . . 5.220 5.069 4.841 5.178 . 0 0 "[ . 1 . 2]" 1
474 1 23 VAL H 1 31 ILE MD . . 5.360 5.207 4.899 5.356 . 0 0 "[ . 1 . 2]" 1
475 1 23 VAL H 1 31 ILE MG . . 4.450 4.070 3.502 4.410 . 0 0 "[ . 1 . 2]" 1
476 1 23 VAL H 1 65 ASP HA . . 4.960 4.671 4.596 4.830 . 0 0 "[ . 1 . 2]" 1
477 1 23 VAL H 1 65 ASP HB2 . . 4.390 3.772 3.600 3.919 . 0 0 "[ . 1 . 2]" 1
478 1 23 VAL H 1 65 ASP QB . . 3.700 3.299 3.184 3.464 . 0 0 "[ . 1 . 2]" 1
479 1 23 VAL H 1 65 ASP HB3 . . 4.390 3.645 3.506 3.877 . 0 0 "[ . 1 . 2]" 1
480 1 23 VAL H 1 67 HIS HD2 . . 4.780 4.054 3.796 4.331 . 0 0 "[ . 1 . 2]" 1
481 1 23 VAL HA 1 23 VAL MG1 . . 3.160 2.469 2.441 2.501 . 0 0 "[ . 1 . 2]" 1
482 1 23 VAL HA 1 23 VAL MG2 . . 3.180 2.373 2.312 2.420 . 0 0 "[ . 1 . 2]" 1
483 1 23 VAL HA 1 24 ASP H . . 3.140 2.142 2.139 2.152 . 0 0 "[ . 1 . 2]" 1
484 1 23 VAL HA 1 24 ASP HA . . 4.980 4.388 4.360 4.404 . 0 0 "[ . 1 . 2]" 1
485 1 23 VAL HA 1 24 ASP HB2 . . 4.650 4.327 4.279 4.416 . 0 0 "[ . 1 . 2]" 1
486 1 23 VAL HA 1 24 ASP HB3 . . 5.500 4.912 4.787 4.989 . 0 0 "[ . 1 . 2]" 1
487 1 23 VAL HA 1 31 ILE HA . . 3.430 2.721 2.519 2.867 . 0 0 "[ . 1 . 2]" 1
488 1 23 VAL HA 1 31 ILE MD . . 4.100 4.028 3.808 4.103 0.003 4 0 "[ . 1 . 2]" 1
489 1 23 VAL HA 1 31 ILE HG12 . . 3.410 2.439 2.124 2.606 . 0 0 "[ . 1 . 2]" 1
490 1 23 VAL HA 1 31 ILE HG13 . . 4.170 3.244 3.000 3.443 . 0 0 "[ . 1 . 2]" 1
491 1 23 VAL HA 1 31 ILE MG . . 3.890 3.243 2.912 3.605 . 0 0 "[ . 1 . 2]" 1
492 1 23 VAL HA 1 32 ARG H . . 4.290 4.109 3.947 4.258 . 0 0 "[ . 1 . 2]" 1
493 1 23 VAL HB 1 24 ASP H . . 4.860 4.309 4.191 4.356 . 0 0 "[ . 1 . 2]" 1
494 1 23 VAL HB 1 28 PRO HA . . 4.870 4.379 4.245 4.584 . 0 0 "[ . 1 . 2]" 1
495 1 23 VAL HB 1 31 ILE MD . . 5.500 5.164 5.034 5.320 . 0 0 "[ . 1 . 2]" 1
496 1 23 VAL HB 1 31 ILE MG . . 5.500 5.225 4.801 5.500 0.000 17 0 "[ . 1 . 2]" 1
497 1 23 VAL HB 1 65 ASP HA . . 3.730 3.595 3.403 3.721 . 0 0 "[ . 1 . 2]" 1
498 1 23 VAL HB 1 65 ASP HB2 . . 3.860 3.272 3.145 3.381 . 0 0 "[ . 1 . 2]" 1
499 1 23 VAL HB 1 65 ASP QB . . 3.230 2.037 1.976 2.209 . 0 0 "[ . 1 . 2]" 1
500 1 23 VAL HB 1 65 ASP HB3 . . 3.860 2.058 1.996 2.239 . 0 0 "[ . 1 . 2]" 1
501 1 23 VAL HB 1 67 HIS HD2 . . 5.500 4.533 4.298 4.751 . 0 0 "[ . 1 . 2]" 1
502 1 23 VAL MG1 1 24 ASP H . . 3.330 2.799 2.481 2.938 . 0 0 "[ . 1 . 2]" 1
503 1 23 VAL MG1 1 24 ASP HA . . 4.830 4.120 3.959 4.191 . 0 0 "[ . 1 . 2]" 1
504 1 23 VAL MG1 1 24 ASP HB3 . . 4.490 4.001 3.858 4.093 . 0 0 "[ . 1 . 2]" 1
505 1 23 VAL MG1 1 25 LYS H . . 4.850 4.422 4.257 4.674 . 0 0 "[ . 1 . 2]" 1
506 1 23 VAL MG1 1 25 LYS HA . . 4.080 3.893 3.695 4.050 . 0 0 "[ . 1 . 2]" 1
507 1 23 VAL MG1 1 25 LYS QD . . 4.530 4.032 3.872 4.325 . 0 0 "[ . 1 . 2]" 1
508 1 23 VAL MG1 1 27 ASN H . . 4.800 4.709 4.511 4.813 0.013 10 0 "[ . 1 . 2]" 1
509 1 23 VAL MG1 1 28 PRO HA . . 2.880 1.904 1.840 2.052 . 0 0 "[ . 1 . 2]" 1
510 1 23 VAL MG1 1 28 PRO HB3 . . 3.350 3.142 2.933 3.296 . 0 0 "[ . 1 . 2]" 1
511 1 23 VAL MG1 1 28 PRO HD3 . . 4.950 4.648 4.572 4.796 . 0 0 "[ . 1 . 2]" 1
512 1 23 VAL MG1 1 28 PRO HG3 . . 5.080 4.950 4.784 5.081 0.001 10 0 "[ . 1 . 2]" 1
513 1 23 VAL MG1 1 29 MET H . . 4.710 4.265 4.044 4.457 . 0 0 "[ . 1 . 2]" 1
514 1 23 VAL MG1 1 65 ASP HB2 . . 4.640 4.550 4.421 4.650 0.010 2 0 "[ . 1 . 2]" 1
515 1 23 VAL MG1 1 65 ASP QB . . 4.080 3.120 3.025 3.246 . 0 0 "[ . 1 . 2]" 1
516 1 23 VAL MG1 1 65 ASP HB3 . . 4.640 3.178 3.079 3.314 . 0 0 "[ . 1 . 2]" 1
517 1 23 VAL MG2 1 28 PRO HA . . 4.610 4.181 4.024 4.348 . 0 0 "[ . 1 . 2]" 1
518 1 23 VAL MG2 1 31 ILE HA . . 4.960 4.002 3.891 4.148 . 0 0 "[ . 1 . 2]" 1
519 1 23 VAL MG2 1 31 ILE MD . . 3.050 2.559 2.446 2.675 . 0 0 "[ . 1 . 2]" 1
520 1 23 VAL MG2 1 31 ILE HG13 . . 3.580 2.992 2.736 3.200 . 0 0 "[ . 1 . 2]" 1
521 1 23 VAL MG2 1 65 ASP H . . 5.320 5.030 4.920 5.159 . 0 0 "[ . 1 . 2]" 1
522 1 23 VAL MG2 1 65 ASP HA . . 3.260 2.675 2.534 2.902 . 0 0 "[ . 1 . 2]" 1
523 1 23 VAL MG2 1 65 ASP HB2 . . 3.950 3.878 3.753 3.954 0.004 10 0 "[ . 1 . 2]" 1
524 1 23 VAL MG2 1 65 ASP QB . . 3.440 2.776 2.581 2.959 . 0 0 "[ . 1 . 2]" 1
525 1 23 VAL MG2 1 65 ASP HB3 . . 3.950 2.845 2.629 3.056 . 0 0 "[ . 1 . 2]" 1
526 1 23 VAL MG2 1 66 ILE H . . 5.300 4.738 4.600 4.923 . 0 0 "[ . 1 . 2]" 1
527 1 23 VAL MG2 1 67 HIS HD2 . . 3.620 2.032 1.899 2.171 . 0 0 "[ . 1 . 2]" 1
528 1 23 VAL MG2 1 67 HIS HE1 . . 4.670 4.467 4.002 4.675 0.005 20 0 "[ . 1 . 2]" 1
529 1 23 VAL MG2 1 71 TRP HH2 . . 5.250 4.999 4.848 5.141 . 0 0 "[ . 1 . 2]" 1
530 1 23 VAL MG2 1 71 TRP HZ3 . . 5.500 5.443 5.311 5.506 0.006 16 0 "[ . 1 . 2]" 1
531 1 24 ASP H 1 24 ASP HB2 . . 3.640 2.243 2.179 2.364 . 0 0 "[ . 1 . 2]" 1
532 1 24 ASP H 1 24 ASP HB3 . . 3.570 2.869 2.713 2.965 . 0 0 "[ . 1 . 2]" 1
533 1 24 ASP H 1 30 PHE HB3 . . 4.940 4.722 4.577 4.847 . 0 0 "[ . 1 . 2]" 1
534 1 24 ASP H 1 31 ILE HA . . 4.170 2.999 2.676 3.268 . 0 0 "[ . 1 . 2]" 1
535 1 24 ASP H 1 31 ILE HG12 . . 4.910 4.168 3.834 4.323 . 0 0 "[ . 1 . 2]" 1
536 1 24 ASP H 1 31 ILE MG . . 4.840 4.487 4.163 4.730 . 0 0 "[ . 1 . 2]" 1
537 1 24 ASP H 1 32 ARG H . . 4.550 4.264 4.098 4.528 . 0 0 "[ . 1 . 2]" 1
538 1 24 ASP HA 1 25 LYS H . . 2.840 2.148 2.138 2.173 . 0 0 "[ . 1 . 2]" 1
539 1 24 ASP HA 1 25 LYS HA . . 4.660 4.402 4.343 4.432 . 0 0 "[ . 1 . 2]" 1
540 1 24 ASP HA 1 25 LYS HB2 . . 5.040 4.929 4.669 5.015 . 0 0 "[ . 1 . 2]" 1
541 1 24 ASP HA 1 25 LYS QG . . 4.790 3.596 3.549 3.665 . 0 0 "[ . 1 . 2]" 1
542 1 24 ASP HA 1 26 ARG H . . 4.310 4.207 4.014 4.322 0.012 16 0 "[ . 1 . 2]" 1
543 1 24 ASP HA 1 48 PHE QE . . 4.720 3.979 3.697 4.414 . 0 0 "[ . 1 . 2]" 1
544 1 24 ASP HA 1 48 PHE HZ . . 3.950 3.517 3.297 3.952 0.002 17 0 "[ . 1 . 2]" 1
545 1 24 ASP HB2 1 25 LYS H . . 4.700 4.494 4.288 4.569 . 0 0 "[ . 1 . 2]" 1
546 1 24 ASP HB2 1 27 ASN H . . 4.360 4.068 3.992 4.173 . 0 0 "[ . 1 . 2]" 1
547 1 24 ASP HB2 1 30 PHE HB2 . . 4.360 3.510 3.081 3.797 . 0 0 "[ . 1 . 2]" 1
548 1 24 ASP HB2 1 30 PHE HB3 . . 4.200 3.794 3.448 4.155 . 0 0 "[ . 1 . 2]" 1
549 1 24 ASP HB2 1 30 PHE QD . . 5.500 5.282 4.965 5.500 0.000 5 0 "[ . 1 . 2]" 1
550 1 24 ASP HB2 1 32 ARG H . . 4.990 4.863 4.625 4.992 0.002 20 0 "[ . 1 . 2]" 1
551 1 24 ASP HB2 1 48 PHE HZ . . 5.500 4.734 4.362 5.483 . 0 0 "[ . 1 . 2]" 1
552 1 24 ASP HB3 1 25 LYS H . . 4.630 4.148 3.928 4.292 . 0 0 "[ . 1 . 2]" 1
553 1 24 ASP HB3 1 25 LYS HA . . 5.500 5.212 5.031 5.340 . 0 0 "[ . 1 . 2]" 1
554 1 24 ASP HB3 1 26 ARG H . . 4.490 4.327 3.889 4.492 0.002 8 0 "[ . 1 . 2]" 1
555 1 24 ASP HB3 1 27 ASN H . . 3.510 2.430 2.308 2.565 . 0 0 "[ . 1 . 2]" 1
556 1 24 ASP HB3 1 27 ASN HB2 . . 4.360 2.348 1.996 3.288 . 0 0 "[ . 1 . 2]" 1
557 1 24 ASP HB3 1 27 ASN HB3 . . 4.360 3.516 2.933 4.140 . 0 0 "[ . 1 . 2]" 1
558 1 24 ASP HB3 1 28 PRO HA . . 4.780 4.499 4.305 4.742 . 0 0 "[ . 1 . 2]" 1
559 1 24 ASP HB3 1 30 PHE H . . 4.330 3.997 3.753 4.186 . 0 0 "[ . 1 . 2]" 1
560 1 24 ASP HB3 1 30 PHE HB2 . . 4.130 3.176 2.853 3.389 . 0 0 "[ . 1 . 2]" 1
561 1 24 ASP HB3 1 30 PHE HB3 . . 4.270 4.227 4.026 4.288 0.018 15 0 "[ . 1 . 2]" 1
562 1 24 ASP HB3 1 30 PHE QD . . 5.200 4.846 4.484 5.201 0.001 10 0 "[ . 1 . 2]" 1
563 1 25 LYS H 1 25 LYS HB2 . . 3.330 2.948 2.695 3.063 . 0 0 "[ . 1 . 2]" 1
564 1 25 LYS H 1 25 LYS HB3 . . 3.660 3.514 3.476 3.584 . 0 0 "[ . 1 . 2]" 1
565 1 25 LYS H 1 25 LYS QD . . 4.600 2.163 1.922 3.106 . 0 0 "[ . 1 . 2]" 1
566 1 25 LYS H 1 25 LYS QG . . 3.520 1.865 1.828 1.889 . 0 0 "[ . 1 . 2]" 1
567 1 25 LYS H 1 26 ARG H . . 3.410 3.006 2.569 3.107 . 0 0 "[ . 1 . 2]" 1
568 1 25 LYS H 1 27 ASN H . . 4.680 4.027 3.921 4.224 . 0 0 "[ . 1 . 2]" 1
569 1 25 LYS H 1 48 PHE HZ . . 5.180 4.897 4.601 5.122 . 0 0 "[ . 1 . 2]" 1
570 1 25 LYS H 1 57 TYR QE . . 4.740 3.862 3.592 4.117 . 0 0 "[ . 1 . 2]" 1
571 1 25 LYS HA 1 25 LYS QD . . 3.910 2.152 1.969 2.422 . 0 0 "[ . 1 . 2]" 1
572 1 25 LYS HA 1 25 LYS QG . . 3.560 3.250 2.992 3.301 . 0 0 "[ . 1 . 2]" 1
573 1 25 LYS HA 1 27 ASN H . . 4.470 4.236 4.126 4.422 . 0 0 "[ . 1 . 2]" 1
574 1 25 LYS HA 1 28 PRO HA . . 4.940 4.635 4.529 4.902 . 0 0 "[ . 1 . 2]" 1
575 1 25 LYS HA 1 28 PRO HB3 . . 5.000 4.772 4.589 5.033 0.033 15 0 "[ . 1 . 2]" 1
576 1 25 LYS HA 1 28 PRO HD3 . . 4.950 4.759 4.566 4.955 0.005 11 0 "[ . 1 . 2]" 1
577 1 25 LYS HB2 1 57 TYR QE . . 4.880 4.774 4.111 4.884 0.004 3 0 "[ . 1 . 2]" 1
578 1 25 LYS HB3 1 25 LYS QD . . 3.460 2.851 2.477 3.024 . 0 0 "[ . 1 . 2]" 1
579 1 25 LYS QD 1 57 TYR QD . . 5.130 4.257 3.772 5.096 . 0 0 "[ . 1 . 2]" 1
580 1 25 LYS QD 1 57 TYR QE . . 4.760 2.988 2.596 4.410 . 0 0 "[ . 1 . 2]" 1
581 1 25 LYS QE 1 25 LYS QG . . 3.060 2.314 2.035 2.596 . 0 0 "[ . 1 . 2]" 1
582 1 25 LYS QE 1 26 ARG H . . 5.340 5.323 5.195 5.406 0.066 11 0 "[ . 1 . 2]" 1
583 1 25 LYS QE 1 57 TYR QB . . 5.340 5.200 4.608 5.351 0.011 12 0 "[ . 1 . 2]" 1
584 1 25 LYS QE 1 57 TYR QD . . 4.750 4.557 3.582 4.752 0.002 19 0 "[ . 1 . 2]" 1
585 1 25 LYS QE 1 57 TYR QE . . 4.640 3.904 2.575 4.536 . 0 0 "[ . 1 . 2]" 1
586 1 25 LYS QE 1 59 ILE MD . . 4.460 2.646 2.092 3.651 . 0 0 "[ . 1 . 2]" 1
587 1 25 LYS HE2 1 25 LYS QG . . 3.510 2.561 2.096 3.327 . 0 0 "[ . 1 . 2]" 1
588 1 25 LYS HE3 1 25 LYS QG . . 3.510 2.864 2.311 3.473 . 0 0 "[ . 1 . 2]" 1
589 1 25 LYS QG 1 26 ARG H . . 3.960 3.387 3.230 3.732 . 0 0 "[ . 1 . 2]" 1
590 1 25 LYS QG 1 26 ARG HA . . 5.500 5.480 5.393 5.652 0.152 9 0 "[ . 1 . 2]" 1
591 1 25 LYS QG 1 26 ARG QD . . 5.000 4.682 3.435 5.065 0.065 12 0 "[ . 1 . 2]" 1
592 1 25 LYS QG 1 57 TYR QD . . 4.370 3.731 3.453 4.044 . 0 0 "[ . 1 . 2]" 1
593 1 25 LYS QG 1 57 TYR QE . . 3.670 2.851 2.419 3.285 . 0 0 "[ . 1 . 2]" 1
594 1 26 ARG H 1 26 ARG QB . . 3.030 2.710 2.515 2.817 . 0 0 "[ . 1 . 2]" 1
595 1 26 ARG H 1 26 ARG QD . . 4.220 3.174 1.835 3.750 . 0 0 "[ . 1 . 2]" 1
596 1 26 ARG H 1 26 ARG QG . . 3.150 1.953 1.802 2.744 . 0 0 "[ . 1 . 2]" 1
597 1 26 ARG H 1 27 ASN H . . 2.950 2.677 2.606 2.785 . 0 0 "[ . 1 . 2]" 1
598 1 26 ARG H 1 27 ASN QB . . 5.340 4.891 4.625 5.283 . 0 0 "[ . 1 . 2]" 1
599 1 26 ARG HA 1 26 ARG QD . . 4.390 3.992 2.184 4.494 0.104 5 0 "[ . 1 . 2]" 1
600 1 26 ARG HA 1 26 ARG QG . . 3.470 3.106 2.741 3.432 . 0 0 "[ . 1 . 2]" 1
601 1 26 ARG QB 1 26 ARG QD . . 3.020 2.342 2.025 2.734 . 0 0 "[ . 1 . 2]" 1
602 1 26 ARG QB 1 27 ASN H . . 3.720 3.142 2.641 3.492 . 0 0 "[ . 1 . 2]" 1
603 1 26 ARG QB 1 27 ASN HB2 . . 5.500 4.259 3.344 5.145 . 0 0 "[ . 1 . 2]" 1
604 1 26 ARG QB 1 27 ASN QB . . 4.690 4.042 3.287 4.690 . 0 0 "[ . 1 . 2]" 1
605 1 26 ARG QB 1 27 ASN HB3 . . 5.500 5.216 4.852 5.534 0.034 16 0 "[ . 1 . 2]" 1
606 1 26 ARG QB 1 27 ASN QD . . 4.540 3.708 2.680 4.547 0.007 4 0 "[ . 1 . 2]" 1
607 1 26 ARG QD 1 55 TYR QD . . 4.910 4.309 3.564 4.885 . 0 0 "[ . 1 . 2]" 1
608 1 26 ARG QD 1 55 TYR QE . . 4.640 4.033 3.447 4.644 0.004 4 0 "[ . 1 . 2]" 1
609 1 26 ARG QG 1 27 ASN H . . 4.150 2.839 1.923 3.655 . 0 0 "[ . 1 . 2]" 1
610 1 26 ARG QG 1 27 ASN QB . . 4.640 4.017 2.755 4.823 0.183 15 0 "[ . 1 . 2]" 1
611 1 26 ARG QG 1 55 TYR QE . . 5.500 5.132 3.542 5.513 0.013 16 0 "[ . 1 . 2]" 1
612 1 27 ASN H 1 27 ASN HB2 . . 3.920 2.677 2.459 2.947 . 0 0 "[ . 1 . 2]" 1
613 1 27 ASN H 1 27 ASN QB . . 3.370 2.619 2.419 2.861 . 0 0 "[ . 1 . 2]" 1
614 1 27 ASN H 1 27 ASN HB3 . . 3.920 3.730 3.592 3.881 . 0 0 "[ . 1 . 2]" 1
615 1 27 ASN H 1 28 PRO HA . . 4.880 4.656 4.600 4.733 . 0 0 "[ . 1 . 2]" 1
616 1 27 ASN H 1 28 PRO HD2 . . 4.600 4.376 4.317 4.505 . 0 0 "[ . 1 . 2]" 1
617 1 27 ASN H 1 28 PRO HD3 . . 4.390 3.786 3.688 3.999 . 0 0 "[ . 1 . 2]" 1
618 1 27 ASN HA 1 28 PRO HD2 . . 2.880 1.927 1.912 1.937 . 0 0 "[ . 1 . 2]" 1
619 1 27 ASN HA 1 28 PRO HD3 . . 2.930 2.599 2.455 2.642 . 0 0 "[ . 1 . 2]" 1
620 1 27 ASN HA 1 28 PRO HG2 . . 4.230 4.120 4.115 4.124 . 0 0 "[ . 1 . 2]" 1
621 1 27 ASN HA 1 28 PRO HG3 . . 4.430 4.438 4.360 4.464 0.034 12 0 "[ . 1 . 2]" 1
622 1 27 ASN HA 1 29 MET H . . 4.020 3.279 3.223 3.365 . 0 0 "[ . 1 . 2]" 1
623 1 27 ASN QB 1 27 ASN QD . . 3.050 2.183 2.063 2.549 . 0 0 "[ . 1 . 2]" 1
624 1 27 ASN QB 1 28 PRO HD3 . . 4.640 4.423 4.321 4.459 . 0 0 "[ . 1 . 2]" 1
625 1 27 ASN QB 1 28 PRO HG2 . . 5.340 5.267 5.015 5.375 0.035 2 0 "[ . 1 . 2]" 1
626 1 27 ASN QB 1 29 MET H . . 3.910 3.164 2.732 3.507 . 0 0 "[ . 1 . 2]" 1
627 1 27 ASN QB 1 29 MET QB . . 5.180 4.085 3.373 4.987 . 0 0 "[ . 1 . 2]" 1
628 1 27 ASN QB 1 30 PHE H . . 4.130 3.247 3.005 3.389 . 0 0 "[ . 1 . 2]" 1
629 1 27 ASN QB 1 30 PHE HB2 . . 4.330 2.135 1.960 2.680 . 0 0 "[ . 1 . 2]" 1
630 1 27 ASN QB 1 30 PHE QD . . 3.640 2.228 1.945 2.653 . 0 0 "[ . 1 . 2]" 1
631 1 27 ASN HB2 1 28 PRO HD2 . . 4.870 4.713 4.540 4.797 . 0 0 "[ . 1 . 2]" 1
632 1 27 ASN HB2 1 30 PHE H . . 4.810 4.136 3.471 4.600 . 0 0 "[ . 1 . 2]" 1
633 1 27 ASN HB2 1 30 PHE QD . . 4.260 3.496 2.594 4.157 . 0 0 "[ . 1 . 2]" 1
634 1 27 ASN HB3 1 28 PRO HD2 . . 4.870 3.931 3.579 4.096 . 0 0 "[ . 1 . 2]" 1
635 1 27 ASN HB3 1 30 PHE H . . 4.810 3.506 3.067 4.045 . 0 0 "[ . 1 . 2]" 1
636 1 27 ASN HB3 1 30 PHE QD . . 4.260 2.261 2.001 2.695 . 0 0 "[ . 1 . 2]" 1
637 1 28 PRO HA 1 30 PHE H . . 3.760 3.536 3.468 3.631 . 0 0 "[ . 1 . 2]" 1
638 1 28 PRO HB2 1 29 MET H . . 4.140 3.749 3.525 3.888 . 0 0 "[ . 1 . 2]" 1
639 1 28 PRO HD2 1 29 MET H . . 3.830 2.818 2.679 2.932 . 0 0 "[ . 1 . 2]" 1
640 1 28 PRO HD2 1 29 MET ME . . 4.500 3.537 2.634 4.501 0.001 1 0 "[ . 1 . 2]" 1
641 1 28 PRO HD3 1 29 MET H . . 4.220 3.934 3.860 3.993 . 0 0 "[ . 1 . 2]" 1
642 1 28 PRO HG2 1 29 MET H . . 4.270 2.972 2.623 3.203 . 0 0 "[ . 1 . 2]" 1
643 1 28 PRO HG3 1 29 MET H . . 4.500 4.333 4.070 4.507 0.007 9 0 "[ . 1 . 2]" 1
644 1 29 MET H 1 29 MET HB2 . . 3.730 2.732 2.283 3.734 0.004 18 0 "[ . 1 . 2]" 1
645 1 29 MET H 1 29 MET QB . . 2.900 2.462 2.256 2.815 . 0 0 "[ . 1 . 2]" 1
646 1 29 MET H 1 29 MET HB3 . . 3.730 3.418 2.710 3.684 . 0 0 "[ . 1 . 2]" 1
647 1 29 MET H 1 29 MET ME . . 4.640 3.539 2.645 4.313 . 0 0 "[ . 1 . 2]" 1
648 1 29 MET H 1 29 MET HG2 . . 4.210 3.437 1.900 4.225 0.015 12 0 "[ . 1 . 2]" 1
649 1 29 MET H 1 29 MET QG . . 3.370 2.716 1.886 3.344 . 0 0 "[ . 1 . 2]" 1
650 1 29 MET H 1 29 MET HG3 . . 4.210 3.294 2.632 4.166 . 0 0 "[ . 1 . 2]" 1
651 1 29 MET H 1 30 PHE H . . 2.940 2.500 2.366 2.654 . 0 0 "[ . 1 . 2]" 1
652 1 29 MET H 1 30 PHE HB2 . . 4.470 4.117 3.927 4.344 . 0 0 "[ . 1 . 2]" 1
653 1 29 MET HA 1 29 MET ME . . 4.560 4.215 3.049 4.559 . 0 0 "[ . 1 . 2]" 1
654 1 29 MET HA 1 29 MET HG2 . . 4.130 3.098 2.381 3.702 . 0 0 "[ . 1 . 2]" 1
655 1 29 MET HA 1 29 MET QG . . 3.490 2.707 2.255 3.390 . 0 0 "[ . 1 . 2]" 1
656 1 29 MET HA 1 29 MET HG3 . . 4.130 3.134 2.284 4.191 0.061 18 0 "[ . 1 . 2]" 1
657 1 29 MET HA 1 31 ILE MD . . 5.050 4.842 4.665 4.920 . 0 0 "[ . 1 . 2]" 1
658 1 29 MET QB 1 30 PHE H . . 4.150 3.677 3.521 3.980 . 0 0 "[ . 1 . 2]" 1
659 1 29 MET QB 1 30 PHE QD . . 4.490 3.093 2.380 4.488 . 0 0 "[ . 1 . 2]" 1
660 1 29 MET HB2 1 30 PHE H . . 4.750 3.976 3.722 4.515 . 0 0 "[ . 1 . 2]" 1
661 1 29 MET HB3 1 30 PHE H . . 4.750 4.364 4.168 4.500 . 0 0 "[ . 1 . 2]" 1
662 1 29 MET QG 1 30 PHE H . . 5.340 4.265 3.325 4.722 . 0 0 "[ . 1 . 2]" 1
663 1 30 PHE H 1 30 PHE HB2 . . 3.290 2.638 2.584 2.690 . 0 0 "[ . 1 . 2]" 1
664 1 30 PHE H 1 30 PHE HB3 . . 3.830 3.745 3.673 3.804 . 0 0 "[ . 1 . 2]" 1
665 1 30 PHE H 1 30 PHE QD . . 4.180 3.207 2.627 3.890 . 0 0 "[ . 1 . 2]" 1
666 1 30 PHE H 1 31 ILE MD . . 4.920 4.926 4.890 4.947 0.027 2 0 "[ . 1 . 2]" 1
667 1 30 PHE H 1 31 ILE HG13 . . 4.960 3.849 3.766 3.954 . 0 0 "[ . 1 . 2]" 1
668 1 30 PHE HA 1 30 PHE QD . . 3.640 2.932 2.154 3.149 . 0 0 "[ . 1 . 2]" 1
669 1 30 PHE HA 1 31 ILE H . . 3.100 2.159 2.140 2.187 . 0 0 "[ . 1 . 2]" 1
670 1 30 PHE HA 1 31 ILE HB . . 4.730 4.566 4.483 4.667 . 0 0 "[ . 1 . 2]" 1
671 1 30 PHE HA 1 31 ILE HG13 . . 4.710 3.773 3.613 3.953 . 0 0 "[ . 1 . 2]" 1
672 1 30 PHE HA 1 80 GLN QG . . 4.730 3.844 3.521 4.112 . 0 0 "[ . 1 . 2]" 1
673 1 30 PHE HB2 1 31 ILE H . . 4.520 4.316 4.167 4.496 . 0 0 "[ . 1 . 2]" 1
674 1 30 PHE HB3 1 31 ILE H . . 4.240 3.307 3.134 3.668 . 0 0 "[ . 1 . 2]" 1
675 1 30 PHE HB3 1 80 GLN HB3 . . 5.500 5.454 5.154 5.507 0.007 16 0 "[ . 1 . 2]" 1
676 1 30 PHE HB3 1 80 GLN HG2 . . 4.590 4.457 4.242 4.598 0.008 8 0 "[ . 1 . 2]" 1
677 1 30 PHE HB3 1 80 GLN HG3 . . 4.590 3.794 3.207 4.194 . 0 0 "[ . 1 . 2]" 1
678 1 30 PHE QD 1 31 ILE H . . 4.390 3.968 3.306 4.325 . 0 0 "[ . 1 . 2]" 1
679 1 30 PHE QD 1 80 GLN HB3 . . 4.780 4.313 4.034 4.783 0.003 11 0 "[ . 1 . 2]" 1
680 1 30 PHE QD 1 80 GLN HG2 . . 4.600 3.145 2.387 3.733 . 0 0 "[ . 1 . 2]" 1
681 1 30 PHE QD 1 80 GLN QG . . 4.010 2.098 1.908 2.627 . 0 0 "[ . 1 . 2]" 1
682 1 30 PHE QD 1 80 GLN HG3 . . 4.600 2.138 1.996 2.684 . 0 0 "[ . 1 . 2]" 1
683 1 31 ILE H 1 31 ILE HB . . 3.590 2.669 2.567 2.708 . 0 0 "[ . 1 . 2]" 1
684 1 31 ILE H 1 31 ILE MD . . 4.240 3.757 3.604 3.855 . 0 0 "[ . 1 . 2]" 1
685 1 31 ILE H 1 31 ILE HG12 . . 4.440 4.249 4.117 4.389 . 0 0 "[ . 1 . 2]" 1
686 1 31 ILE H 1 31 ILE HG13 . . 3.880 2.947 2.741 3.112 . 0 0 "[ . 1 . 2]" 1
687 1 31 ILE H 1 31 ILE MG . . 4.100 3.849 3.811 3.880 . 0 0 "[ . 1 . 2]" 1
688 1 31 ILE H 1 79 LEU MD1 . . 4.050 3.853 3.418 4.062 0.012 9 0 "[ . 1 . 2]" 1
689 1 31 ILE H 1 80 GLN H . . 4.830 3.928 3.575 4.160 . 0 0 "[ . 1 . 2]" 1
690 1 31 ILE H 1 80 GLN HB2 . . 4.970 4.319 4.130 4.448 . 0 0 "[ . 1 . 2]" 1
691 1 31 ILE H 1 80 GLN HG2 . . 4.600 3.743 3.431 4.143 . 0 0 "[ . 1 . 2]" 1
692 1 31 ILE H 1 80 GLN QG . . 4.040 3.551 3.285 3.855 . 0 0 "[ . 1 . 2]" 1
693 1 31 ILE H 1 80 GLN HG3 . . 4.600 4.468 3.921 4.606 0.006 12 0 "[ . 1 . 2]" 1
694 1 31 ILE HA 1 31 ILE MD . . 3.970 3.875 3.847 3.915 . 0 0 "[ . 1 . 2]" 1
695 1 31 ILE HA 1 31 ILE HG12 . . 3.920 2.748 2.690 2.840 . 0 0 "[ . 1 . 2]" 1
696 1 31 ILE HA 1 31 ILE HG13 . . 3.940 2.734 2.626 2.833 . 0 0 "[ . 1 . 2]" 1
697 1 31 ILE HA 1 31 ILE MG . . 3.280 2.425 2.324 2.480 . 0 0 "[ . 1 . 2]" 1
698 1 31 ILE HA 1 32 ARG H . . 3.090 2.195 2.158 2.233 . 0 0 "[ . 1 . 2]" 1
699 1 31 ILE HA 1 32 ARG QG . . 4.390 3.716 3.322 3.982 . 0 0 "[ . 1 . 2]" 1
700 1 31 ILE HB 1 31 ILE MD . . 3.260 2.211 2.149 2.294 . 0 0 "[ . 1 . 2]" 1
701 1 31 ILE HB 1 32 ARG H . . 5.020 4.049 3.937 4.159 . 0 0 "[ . 1 . 2]" 1
702 1 31 ILE HB 1 79 LEU MD1 . . 3.690 2.539 2.283 2.871 . 0 0 "[ . 1 . 2]" 1
703 1 31 ILE HB 1 79 LEU MD2 . . 5.500 5.193 4.788 5.457 . 0 0 "[ . 1 . 2]" 1
704 1 31 ILE MD 1 32 ARG H . . 5.500 5.076 4.995 5.204 . 0 0 "[ . 1 . 2]" 1
705 1 31 ILE MD 1 67 HIS HD2 . . 4.120 2.797 2.545 3.113 . 0 0 "[ . 1 . 2]" 1
706 1 31 ILE MD 1 71 TRP HD1 . . 5.500 5.505 5.494 5.513 0.013 13 0 "[ . 1 . 2]" 1
707 1 31 ILE MD 1 71 TRP HE3 . . 4.380 3.089 2.958 3.223 . 0 0 "[ . 1 . 2]" 1
708 1 31 ILE MD 1 71 TRP HH2 . . 4.250 2.404 2.208 2.576 . 0 0 "[ . 1 . 2]" 1
709 1 31 ILE MD 1 71 TRP HZ3 . . 3.460 2.012 1.953 2.086 . 0 0 "[ . 1 . 2]" 1
710 1 31 ILE MD 1 72 CYS HA . . 4.820 4.350 4.106 4.704 . 0 0 "[ . 1 . 2]" 1
711 1 31 ILE MD 1 77 HIS H . . 5.500 5.308 5.051 5.506 0.006 12 0 "[ . 1 . 2]" 1
712 1 31 ILE MD 1 77 HIS HB2 . . 4.100 3.575 3.310 3.775 . 0 0 "[ . 1 . 2]" 1
713 1 31 ILE MD 1 77 HIS HB3 . . 3.700 3.349 3.064 3.517 . 0 0 "[ . 1 . 2]" 1
714 1 31 ILE MD 1 77 HIS HD2 . . 4.180 3.808 3.332 4.144 . 0 0 "[ . 1 . 2]" 1
715 1 31 ILE MD 1 78 PRO HD2 . . 5.500 5.190 4.771 5.490 . 0 0 "[ . 1 . 2]" 1
716 1 31 ILE HG12 1 31 ILE MG . . 3.050 2.186 2.046 2.279 . 0 0 "[ . 1 . 2]" 1
717 1 31 ILE HG13 1 31 ILE MG . . 3.460 3.159 3.133 3.176 . 0 0 "[ . 1 . 2]" 1
718 1 31 ILE HG13 1 32 ARG H . . 4.860 4.766 4.645 4.846 . 0 0 "[ . 1 . 2]" 1
719 1 31 ILE MG 1 32 ARG H . . 3.360 2.294 2.013 2.508 . 0 0 "[ . 1 . 2]" 1
720 1 31 ILE MG 1 67 HIS HB2 . . 4.670 3.447 3.262 3.628 . 0 0 "[ . 1 . 2]" 1
721 1 31 ILE MG 1 67 HIS HB3 . . 4.800 4.622 4.455 4.785 . 0 0 "[ . 1 . 2]" 1
722 1 31 ILE MG 1 67 HIS HD2 . . 4.260 3.385 3.045 3.764 . 0 0 "[ . 1 . 2]" 1
723 1 31 ILE MG 1 71 TRP HE3 . . 4.600 3.447 3.197 3.906 . 0 0 "[ . 1 . 2]" 1
724 1 31 ILE MG 1 71 TRP HZ3 . . 4.250 3.849 3.613 4.250 0.000 11 0 "[ . 1 . 2]" 1
725 1 31 ILE MG 1 79 LEU MD1 . . 3.310 2.145 1.895 2.454 . 0 0 "[ . 1 . 2]" 1
726 1 32 ARG H 1 32 ARG HB2 . . 3.720 2.744 2.622 2.914 . 0 0 "[ . 1 . 2]" 1
727 1 32 ARG H 1 32 ARG QD . . 5.230 4.350 3.782 4.842 . 0 0 "[ . 1 . 2]" 1
728 1 32 ARG H 1 32 ARG HG2 . . 4.680 4.127 3.650 4.464 . 0 0 "[ . 1 . 2]" 1
729 1 32 ARG H 1 32 ARG QG . . 4.010 3.082 2.800 3.361 . 0 0 "[ . 1 . 2]" 1
730 1 32 ARG H 1 32 ARG HG3 . . 4.680 3.200 2.847 3.591 . 0 0 "[ . 1 . 2]" 1
731 1 32 ARG H 1 79 LEU MD1 . . 4.010 3.607 3.402 3.981 . 0 0 "[ . 1 . 2]" 1
732 1 32 ARG HA 1 33 VAL H . . 3.150 2.492 2.303 2.653 . 0 0 "[ . 1 . 2]" 1
733 1 32 ARG HA 1 80 GLN HB2 . . 4.420 3.867 3.572 4.152 . 0 0 "[ . 1 . 2]" 1
734 1 32 ARG HA 1 80 GLN HB3 . . 5.500 5.279 4.949 5.503 0.003 3 0 "[ . 1 . 2]" 1
735 1 32 ARG HB2 1 33 VAL H . . 4.080 3.451 3.141 3.806 . 0 0 "[ . 1 . 2]" 1
736 1 32 ARG HB2 1 48 PHE QD . . 4.130 2.712 2.119 2.986 . 0 0 "[ . 1 . 2]" 1
737 1 32 ARG HB2 1 48 PHE QE . . 4.090 2.466 2.072 2.889 . 0 0 "[ . 1 . 2]" 1
738 1 32 ARG HB3 1 33 VAL H . . 3.740 2.264 1.941 2.680 . 0 0 "[ . 1 . 2]" 1
739 1 32 ARG HB3 1 33 VAL HB . . 4.530 4.251 4.048 4.456 . 0 0 "[ . 1 . 2]" 1
740 1 32 ARG HB3 1 33 VAL MG2 . . 5.200 4.340 4.111 4.679 . 0 0 "[ . 1 . 2]" 1
741 1 32 ARG HB3 1 48 PHE QD . . 4.400 3.525 2.817 4.021 . 0 0 "[ . 1 . 2]" 1
742 1 32 ARG HB3 1 48 PHE QE . . 4.350 4.106 3.780 4.347 . 0 0 "[ . 1 . 2]" 1
743 1 32 ARG QD 1 33 VAL H . . 5.340 4.363 3.720 4.932 . 0 0 "[ . 1 . 2]" 1
744 1 32 ARG QD 1 48 PHE QD . . 4.460 2.802 2.079 3.799 . 0 0 "[ . 1 . 2]" 1
745 1 32 ARG QD 1 48 PHE QE . . 4.180 3.282 2.198 4.191 0.011 13 0 "[ . 1 . 2]" 1
746 1 32 ARG QD 1 51 TRP HE1 . . 4.680 2.546 1.897 3.555 . 0 0 "[ . 1 . 2]" 1
747 1 32 ARG QD 1 51 TRP HZ2 . . 4.510 2.581 1.943 3.186 . 0 0 "[ . 1 . 2]" 1
748 1 32 ARG QD 1 80 GLN HB3 . . 5.340 4.154 2.957 4.983 . 0 0 "[ . 1 . 2]" 1
749 1 32 ARG QG 1 33 VAL H . . 4.520 3.823 3.622 4.098 . 0 0 "[ . 1 . 2]" 1
750 1 32 ARG QG 1 51 TRP HZ2 . . 4.760 4.136 2.669 4.762 0.002 7 0 "[ . 1 . 2]" 1
751 1 32 ARG QG 1 80 GLN HB2 . . 3.920 2.068 1.853 2.395 . 0 0 "[ . 1 . 2]" 1
752 1 32 ARG QG 1 80 GLN QG . . 4.370 3.562 3.235 3.753 . 0 0 "[ . 1 . 2]" 1
753 1 32 ARG HG2 1 80 GLN HB2 . . 4.570 2.134 2.003 2.527 . 0 0 "[ . 1 . 2]" 1
754 1 32 ARG HG2 1 80 GLN HB3 . . 4.670 3.328 2.987 3.634 . 0 0 "[ . 1 . 2]" 1
755 1 32 ARG HG3 1 80 GLN HB2 . . 4.570 2.900 2.102 3.244 . 0 0 "[ . 1 . 2]" 1
756 1 32 ARG HG3 1 80 GLN HB3 . . 4.670 4.356 3.722 4.673 0.003 17 0 "[ . 1 . 2]" 1
757 1 33 VAL H 1 33 VAL HB . . 3.190 2.449 2.345 2.533 . 0 0 "[ . 1 . 2]" 1
758 1 33 VAL H 1 33 VAL MG1 . . 4.030 3.752 3.710 3.781 . 0 0 "[ . 1 . 2]" 1
759 1 33 VAL H 1 33 VAL MG2 . . 3.200 2.483 2.127 2.792 . 0 0 "[ . 1 . 2]" 1
760 1 33 VAL H 1 34 ALA H . . 4.770 4.605 4.561 4.631 . 0 0 "[ . 1 . 2]" 1
761 1 33 VAL H 1 79 LEU MD1 . . 4.380 3.824 3.531 4.138 . 0 0 "[ . 1 . 2]" 1
762 1 33 VAL H 1 79 LEU MD2 . . 4.790 3.899 3.518 4.360 . 0 0 "[ . 1 . 2]" 1
763 1 33 VAL H 1 80 GLN H . . 5.400 5.287 4.947 5.405 0.005 19 0 "[ . 1 . 2]" 1
764 1 33 VAL HA 1 33 VAL MG1 . . 3.190 2.415 2.330 2.505 . 0 0 "[ . 1 . 2]" 1
765 1 33 VAL HA 1 33 VAL MG2 . . 3.160 2.263 2.169 2.384 . 0 0 "[ . 1 . 2]" 1
766 1 33 VAL HA 1 34 ALA H . . 2.830 2.235 2.189 2.292 . 0 0 "[ . 1 . 2]" 1
767 1 33 VAL HA 1 34 ALA MB . . 4.610 3.858 3.816 3.895 . 0 0 "[ . 1 . 2]" 1
768 1 33 VAL HA 1 79 LEU MD1 . . 4.150 4.133 4.043 4.164 0.014 11 0 "[ . 1 . 2]" 1
769 1 33 VAL HA 1 79 LEU MD2 . . 4.840 4.194 3.969 4.456 . 0 0 "[ . 1 . 2]" 1
770 1 33 VAL HB 1 34 ALA H . . 4.400 3.981 3.849 4.121 . 0 0 "[ . 1 . 2]" 1
771 1 33 VAL HB 1 79 LEU MD2 . . 4.840 4.676 4.437 4.841 0.001 6 0 "[ . 1 . 2]" 1
772 1 33 VAL MG1 1 34 ALA H . . 3.260 2.052 1.869 2.212 . 0 0 "[ . 1 . 2]" 1
773 1 33 VAL MG1 1 34 ALA HA . . 4.550 3.423 3.252 3.634 . 0 0 "[ . 1 . 2]" 1
774 1 33 VAL MG1 1 49 ASP H . . 4.820 4.081 3.291 4.434 . 0 0 "[ . 1 . 2]" 1
775 1 33 VAL MG1 1 49 ASP HB2 . . 4.370 3.799 2.703 4.260 . 0 0 "[ . 1 . 2]" 1
776 1 33 VAL MG1 1 49 ASP QB . . 3.830 3.482 2.589 3.812 . 0 0 "[ . 1 . 2]" 1
777 1 33 VAL MG1 1 49 ASP HB3 . . 4.370 4.070 3.317 4.369 . 0 0 "[ . 1 . 2]" 1
778 1 33 VAL MG1 1 82 PRO QG . . 4.360 4.225 3.512 4.368 0.008 19 0 "[ . 1 . 2]" 1
779 1 33 VAL MG2 1 34 ALA H . . 3.990 3.818 3.673 3.960 . 0 0 "[ . 1 . 2]" 1
780 1 33 VAL MG2 1 79 LEU MD1 . . 3.430 3.322 3.158 3.436 0.006 17 0 "[ . 1 . 2]" 1
781 1 33 VAL MG2 1 79 LEU MD2 . . 2.820 2.295 2.051 2.471 . 0 0 "[ . 1 . 2]" 1
782 1 33 VAL MG2 1 82 PRO HD2 . . 4.680 4.379 3.832 4.684 0.004 11 0 "[ . 1 . 2]" 1
783 1 33 VAL MG2 1 82 PRO QD . . 4.050 3.061 2.548 3.430 . 0 0 "[ . 1 . 2]" 1
784 1 33 VAL MG2 1 82 PRO HD3 . . 4.680 3.126 2.587 3.527 . 0 0 "[ . 1 . 2]" 1
785 1 33 VAL MG2 1 82 PRO QG . . 4.480 4.028 3.678 4.485 0.005 17 0 "[ . 1 . 2]" 1
786 1 34 ALA H 1 34 ALA MB . . 3.200 2.575 2.503 2.651 . 0 0 "[ . 1 . 2]" 1
787 1 34 ALA HA 1 35 THR H . . 3.080 2.417 2.237 2.519 . 0 0 "[ . 1 . 2]" 1
788 1 34 ALA HA 1 46 VAL MG1 . . 5.500 5.204 5.008 5.379 . 0 0 "[ . 1 . 2]" 1
789 1 34 ALA HA 1 47 HIS H . . 4.700 4.565 4.241 4.705 0.005 16 0 "[ . 1 . 2]" 1
790 1 34 ALA HA 1 48 PHE HA . . 3.740 2.469 2.221 2.685 . 0 0 "[ . 1 . 2]" 1
791 1 34 ALA HA 1 48 PHE QD . . 4.790 4.043 3.775 4.260 . 0 0 "[ . 1 . 2]" 1
792 1 34 ALA HA 1 48 PHE QE . . 5.150 4.873 4.601 5.143 . 0 0 "[ . 1 . 2]" 1
793 1 34 ALA HA 1 49 ASP H . . 3.690 3.182 2.927 3.439 . 0 0 "[ . 1 . 2]" 1
794 1 34 ALA MB 1 35 THR H . . 3.300 2.462 2.273 2.824 . 0 0 "[ . 1 . 2]" 1
795 1 34 ALA MB 1 35 THR HA . . 5.080 3.953 3.872 4.110 . 0 0 "[ . 1 . 2]" 1
796 1 34 ALA MB 1 35 THR HB . . 5.330 4.815 4.728 5.037 . 0 0 "[ . 1 . 2]" 1
797 1 34 ALA MB 1 36 VAL HA . . 5.500 4.866 4.779 4.957 . 0 0 "[ . 1 . 2]" 1
798 1 34 ALA MB 1 46 VAL HA . . 4.040 3.464 3.321 3.645 . 0 0 "[ . 1 . 2]" 1
799 1 34 ALA MB 1 46 VAL HB . . 3.280 2.171 2.025 2.283 . 0 0 "[ . 1 . 2]" 1
800 1 34 ALA MB 1 46 VAL MG1 . . 2.940 2.792 2.591 2.931 . 0 0 "[ . 1 . 2]" 1
801 1 34 ALA MB 1 47 HIS H . . 3.800 3.491 3.362 3.658 . 0 0 "[ . 1 . 2]" 1
802 1 34 ALA MB 1 47 HIS HB3 . . 5.440 5.081 4.891 5.270 . 0 0 "[ . 1 . 2]" 1
803 1 34 ALA MB 1 48 PHE H . . 4.920 4.560 4.301 4.833 . 0 0 "[ . 1 . 2]" 1
804 1 34 ALA MB 1 48 PHE HA . . 3.690 3.500 3.320 3.667 . 0 0 "[ . 1 . 2]" 1
805 1 34 ALA MB 1 48 PHE QB . . 5.340 4.688 4.510 4.833 . 0 0 "[ . 1 . 2]" 1
806 1 34 ALA MB 1 48 PHE QD . . 3.610 3.445 3.153 3.622 0.012 16 0 "[ . 1 . 2]" 1
807 1 34 ALA MB 1 48 PHE QE . . 3.750 3.343 3.045 3.533 . 0 0 "[ . 1 . 2]" 1
808 1 34 ALA MB 1 49 ASP H . . 5.210 4.624 4.410 4.806 . 0 0 "[ . 1 . 2]" 1
809 1 35 THR H 1 35 THR HB . . 3.390 2.770 2.574 2.903 . 0 0 "[ . 1 . 2]" 1
810 1 35 THR H 1 35 THR MG . . 4.380 3.900 3.821 3.957 . 0 0 "[ . 1 . 2]" 1
811 1 35 THR H 1 36 VAL H . . 4.400 4.077 3.948 4.226 . 0 0 "[ . 1 . 2]" 1
812 1 35 THR H 1 46 VAL HA . . 4.790 3.763 3.442 4.309 . 0 0 "[ . 1 . 2]" 1
813 1 35 THR H 1 46 VAL HB . . 4.760 3.986 3.770 4.550 . 0 0 "[ . 1 . 2]" 1
814 1 35 THR H 1 46 VAL MG1 . . 5.210 4.470 4.218 5.060 . 0 0 "[ . 1 . 2]" 1
815 1 35 THR H 1 47 HIS H . . 3.570 2.574 2.329 2.877 . 0 0 "[ . 1 . 2]" 1
816 1 35 THR H 1 47 HIS HB2 . . 5.100 4.935 4.781 5.086 . 0 0 "[ . 1 . 2]" 1
817 1 35 THR H 1 47 HIS HB3 . . 4.240 3.574 3.303 3.767 . 0 0 "[ . 1 . 2]" 1
818 1 35 THR H 1 47 HIS HD2 . . 4.520 4.055 3.553 4.473 . 0 0 "[ . 1 . 2]" 1
819 1 35 THR H 1 48 PHE HA . . 4.220 3.780 3.526 4.017 . 0 0 "[ . 1 . 2]" 1
820 1 35 THR H 1 49 ASP H . . 4.860 4.125 3.667 4.861 0.001 13 0 "[ . 1 . 2]" 1
821 1 35 THR HA 1 35 THR MG . . 3.040 2.395 2.245 2.437 . 0 0 "[ . 1 . 2]" 1
822 1 35 THR HA 1 36 VAL H . . 2.850 2.151 2.143 2.165 . 0 0 "[ . 1 . 2]" 1
823 1 35 THR HA 1 36 VAL HB . . 4.910 4.730 4.676 4.801 . 0 0 "[ . 1 . 2]" 1
824 1 35 THR HA 1 36 VAL MG2 . . 3.710 3.561 3.505 3.614 . 0 0 "[ . 1 . 2]" 1
825 1 35 THR HB 1 36 VAL H . . 4.440 4.347 4.251 4.420 . 0 0 "[ . 1 . 2]" 1
826 1 35 THR HB 1 47 HIS H . . 4.230 3.688 3.516 4.043 . 0 0 "[ . 1 . 2]" 1
827 1 35 THR HB 1 47 HIS HB2 . . 5.070 4.592 4.214 4.838 . 0 0 "[ . 1 . 2]" 1
828 1 35 THR HB 1 47 HIS HB3 . . 3.680 2.846 2.454 3.089 . 0 0 "[ . 1 . 2]" 1
829 1 35 THR HB 1 47 HIS HD2 . . 3.790 2.933 2.384 3.357 . 0 0 "[ . 1 . 2]" 1
830 1 35 THR MG 1 36 VAL H . . 3.230 2.835 2.674 3.007 . 0 0 "[ . 1 . 2]" 1
831 1 35 THR MG 1 36 VAL HA . . 4.670 4.227 4.120 4.366 . 0 0 "[ . 1 . 2]" 1
832 1 35 THR MG 1 36 VAL HB . . 4.350 4.173 4.030 4.285 . 0 0 "[ . 1 . 2]" 1
833 1 35 THR MG 1 47 HIS H . . 4.810 4.450 4.260 4.764 . 0 0 "[ . 1 . 2]" 1
834 1 35 THR MG 1 47 HIS HB2 . . 5.500 5.203 4.722 5.485 . 0 0 "[ . 1 . 2]" 1
835 1 35 THR MG 1 47 HIS HD2 . . 4.570 4.196 3.708 4.571 0.001 10 0 "[ . 1 . 2]" 1
836 1 36 VAL H 1 36 VAL HB . . 3.050 2.666 2.599 2.742 . 0 0 "[ . 1 . 2]" 1
837 1 36 VAL H 1 36 VAL MG1 . . 3.770 3.759 3.745 3.764 . 0 0 "[ . 1 . 2]" 1
838 1 36 VAL H 1 36 VAL MG2 . . 3.000 1.890 1.873 1.948 . 0 0 "[ . 1 . 2]" 1
839 1 36 VAL H 1 37 ALA H . . 4.660 4.326 4.310 4.387 . 0 0 "[ . 1 . 2]" 1
840 1 36 VAL H 1 46 VAL MG1 . . 4.860 4.552 4.322 4.732 . 0 0 "[ . 1 . 2]" 1
841 1 36 VAL HA 1 36 VAL MG1 . . 3.200 2.252 2.158 2.368 . 0 0 "[ . 1 . 2]" 1
842 1 36 VAL HA 1 36 VAL MG2 . . 3.090 2.452 2.424 2.471 . 0 0 "[ . 1 . 2]" 1
843 1 36 VAL HA 1 37 ALA H . . 2.840 2.174 2.154 2.179 . 0 0 "[ . 1 . 2]" 1
844 1 36 VAL HA 1 37 ALA HA . . 4.530 4.436 4.417 4.442 . 0 0 "[ . 1 . 2]" 1
845 1 36 VAL HA 1 37 ALA MB . . 4.220 4.006 3.984 4.049 . 0 0 "[ . 1 . 2]" 1
846 1 36 VAL HA 1 38 ASP H . . 4.150 3.899 3.619 4.089 . 0 0 "[ . 1 . 2]" 1
847 1 36 VAL HA 1 44 VAL HB . . 4.530 4.106 3.912 4.411 . 0 0 "[ . 1 . 2]" 1
848 1 36 VAL HA 1 46 VAL HA . . 3.670 2.809 2.636 2.949 . 0 0 "[ . 1 . 2]" 1
849 1 36 VAL HA 1 46 VAL MG1 . . 3.980 3.344 3.161 3.534 . 0 0 "[ . 1 . 2]" 1
850 1 36 VAL HA 1 47 HIS H . . 4.170 3.634 3.426 3.826 . 0 0 "[ . 1 . 2]" 1
851 1 36 VAL HB 1 37 ALA H . . 4.400 4.349 4.309 4.388 . 0 0 "[ . 1 . 2]" 1
852 1 36 VAL HB 1 37 ALA HA . . 5.110 4.964 4.901 5.032 . 0 0 "[ . 1 . 2]" 1
853 1 36 VAL HB 1 39 THR MG . . 3.840 3.824 3.751 3.853 0.013 20 0 "[ . 1 . 2]" 1
854 1 36 VAL HB 1 44 VAL MG1 . . 5.410 5.270 4.884 5.414 0.004 6 0 "[ . 1 . 2]" 1
855 1 36 VAL HB 1 44 VAL MG2 . . 5.500 5.456 5.330 5.508 0.008 9 0 "[ . 1 . 2]" 1
856 1 36 VAL HB 1 46 VAL MG1 . . 5.440 5.304 5.002 5.440 0.000 10 0 "[ . 1 . 2]" 1
857 1 36 VAL MG1 1 37 ALA H . . 3.590 3.079 3.006 3.233 . 0 0 "[ . 1 . 2]" 1
858 1 36 VAL MG1 1 37 ALA HA . . 4.500 4.288 4.129 4.424 . 0 0 "[ . 1 . 2]" 1
859 1 36 VAL MG1 1 37 ALA MB . . 4.410 4.265 4.192 4.332 . 0 0 "[ . 1 . 2]" 1
860 1 36 VAL MG1 1 38 ASP H . . 3.190 3.089 2.853 3.190 0.000 8 0 "[ . 1 . 2]" 1
861 1 36 VAL MG1 1 39 THR H . . 4.330 3.973 3.802 4.169 . 0 0 "[ . 1 . 2]" 1
862 1 36 VAL MG1 1 39 THR HA . . 4.620 3.485 3.322 3.591 . 0 0 "[ . 1 . 2]" 1
863 1 36 VAL MG1 1 39 THR HB . . 4.330 4.177 4.062 4.336 0.006 19 0 "[ . 1 . 2]" 1
864 1 36 VAL MG1 1 39 THR MG . . 2.690 1.879 1.791 2.011 . 0 0 "[ . 1 . 2]" 1
865 1 36 VAL MG1 1 44 VAL HB . . 3.380 2.151 1.968 2.261 . 0 0 "[ . 1 . 2]" 1
866 1 36 VAL MG1 1 44 VAL MG2 . . 3.790 3.199 3.003 3.312 . 0 0 "[ . 1 . 2]" 1
867 1 36 VAL MG1 1 45 LYS H . . 4.090 3.709 3.458 3.891 . 0 0 "[ . 1 . 2]" 1
868 1 36 VAL MG1 1 46 VAL HA . . 4.520 4.253 4.013 4.481 . 0 0 "[ . 1 . 2]" 1
869 1 36 VAL MG2 1 37 ALA H . . 4.480 4.269 4.225 4.301 . 0 0 "[ . 1 . 2]" 1
870 1 36 VAL MG2 1 44 VAL HB . . 3.760 3.378 3.075 3.688 . 0 0 "[ . 1 . 2]" 1
871 1 36 VAL MG2 1 46 VAL HA . . 4.800 3.803 3.557 3.914 . 0 0 "[ . 1 . 2]" 1
872 1 37 ALA H 1 37 ALA MB . . 2.950 2.152 2.070 2.266 . 0 0 "[ . 1 . 2]" 1
873 1 37 ALA H 1 38 ASP H . . 3.130 2.493 2.355 2.629 . 0 0 "[ . 1 . 2]" 1
874 1 37 ALA H 1 45 LYS H . . 4.950 4.634 4.309 4.937 . 0 0 "[ . 1 . 2]" 1
875 1 37 ALA H 1 45 LYS HB2 . . 5.230 4.992 4.655 5.230 . 0 0 "[ . 1 . 2]" 1
876 1 37 ALA H 1 45 LYS HB3 . . 4.020 3.303 2.978 3.549 . 0 0 "[ . 1 . 2]" 1
877 1 37 ALA H 1 45 LYS HG2 . . 5.000 4.262 4.112 4.630 . 0 0 "[ . 1 . 2]" 1
878 1 37 ALA H 1 46 VAL HA . . 3.710 3.505 3.244 3.641 . 0 0 "[ . 1 . 2]" 1
879 1 37 ALA H 1 46 VAL MG1 . . 4.890 4.670 4.545 4.767 . 0 0 "[ . 1 . 2]" 1
880 1 37 ALA H 1 47 HIS H . . 4.120 3.502 3.212 3.745 . 0 0 "[ . 1 . 2]" 1
881 1 37 ALA MB 1 38 ASP H . . 3.310 2.499 2.299 2.722 . 0 0 "[ . 1 . 2]" 1
882 1 37 ALA MB 1 38 ASP HB2 . . 3.720 3.128 3.051 3.207 . 0 0 "[ . 1 . 2]" 1
883 1 37 ALA MB 1 38 ASP HB3 . . 4.170 4.030 3.937 4.148 . 0 0 "[ . 1 . 2]" 1
884 1 37 ALA MB 1 45 LYS HB2 . . 4.540 4.133 3.880 4.358 . 0 0 "[ . 1 . 2]" 1
885 1 37 ALA MB 1 45 LYS HB3 . . 3.400 2.766 2.520 2.991 . 0 0 "[ . 1 . 2]" 1
886 1 37 ALA MB 1 45 LYS HG2 . . 3.710 3.225 3.065 3.440 . 0 0 "[ . 1 . 2]" 1
887 1 37 ALA MB 1 45 LYS HG3 . . 4.610 4.581 4.408 4.616 0.006 16 0 "[ . 1 . 2]" 1
888 1 37 ALA MB 1 46 VAL HA . . 4.640 4.513 4.247 4.642 0.002 15 0 "[ . 1 . 2]" 1
889 1 37 ALA MB 1 47 HIS H . . 3.910 3.778 3.479 3.912 0.002 9 0 "[ . 1 . 2]" 1
890 1 37 ALA MB 1 47 HIS HB2 . . 3.400 3.111 2.512 3.405 0.005 9 0 "[ . 1 . 2]" 1
891 1 37 ALA MB 1 47 HIS HB3 . . 3.650 3.149 2.831 3.478 . 0 0 "[ . 1 . 2]" 1
892 1 38 ASP H 1 39 THR H . . 4.420 4.304 4.213 4.367 . 0 0 "[ . 1 . 2]" 1
893 1 38 ASP H 1 39 THR HA . . 4.790 4.695 4.617 4.761 . 0 0 "[ . 1 . 2]" 1
894 1 38 ASP H 1 39 THR MG . . 4.640 4.298 4.072 4.595 . 0 0 "[ . 1 . 2]" 1
895 1 38 ASP H 1 45 LYS H . . 3.700 3.212 3.027 3.457 . 0 0 "[ . 1 . 2]" 1
896 1 38 ASP H 1 45 LYS HB2 . . 4.230 3.562 3.391 3.747 . 0 0 "[ . 1 . 2]" 1
897 1 38 ASP H 1 45 LYS HB3 . . 3.330 2.240 2.042 2.378 . 0 0 "[ . 1 . 2]" 1
898 1 38 ASP H 1 45 LYS QD . . 4.360 4.121 3.880 4.360 . 0 0 "[ . 1 . 2]" 1
899 1 38 ASP HA 1 39 THR H . . 2.770 2.189 2.158 2.239 . 0 0 "[ . 1 . 2]" 1
900 1 38 ASP HB2 1 39 THR H . . 4.440 4.297 4.209 4.380 . 0 0 "[ . 1 . 2]" 1
901 1 38 ASP HB2 1 45 LYS H . . 5.060 4.828 4.518 5.048 . 0 0 "[ . 1 . 2]" 1
902 1 38 ASP HB2 1 45 LYS HB2 . . 4.250 4.170 3.842 4.257 0.007 16 0 "[ . 1 . 2]" 1
903 1 38 ASP HB2 1 45 LYS HB3 . . 4.080 3.707 3.287 3.920 . 0 0 "[ . 1 . 2]" 1
904 1 38 ASP HB2 1 58 TRP HH2 . . 4.200 3.906 3.732 4.167 . 0 0 "[ . 1 . 2]" 1
905 1 38 ASP HB2 1 58 TRP HZ2 . . 4.290 4.200 3.850 4.293 0.003 9 0 "[ . 1 . 2]" 1
906 1 38 ASP HB3 1 39 THR H . . 4.090 3.799 3.630 3.952 . 0 0 "[ . 1 . 2]" 1
907 1 38 ASP HB3 1 45 LYS H . . 4.530 3.538 3.161 3.742 . 0 0 "[ . 1 . 2]" 1
908 1 38 ASP HB3 1 45 LYS HB2 . . 4.040 3.115 2.831 3.298 . 0 0 "[ . 1 . 2]" 1
909 1 38 ASP HB3 1 45 LYS HB3 . . 3.830 3.285 2.881 3.530 . 0 0 "[ . 1 . 2]" 1
910 1 38 ASP HB3 1 45 LYS QD . . 3.810 3.595 3.309 3.779 . 0 0 "[ . 1 . 2]" 1
911 1 38 ASP HB3 1 58 TRP HH2 . . 3.750 2.196 1.997 2.434 . 0 0 "[ . 1 . 2]" 1
912 1 38 ASP HB3 1 58 TRP HZ2 . . 4.120 3.016 2.715 3.160 . 0 0 "[ . 1 . 2]" 1
913 1 39 THR H 1 39 THR MG . . 3.470 2.792 2.571 3.149 . 0 0 "[ . 1 . 2]" 1
914 1 39 THR H 1 40 ASP H . . 4.330 4.262 4.177 4.322 . 0 0 "[ . 1 . 2]" 1
915 1 39 THR H 1 45 LYS H . . 5.180 4.907 4.806 5.004 . 0 0 "[ . 1 . 2]" 1
916 1 39 THR H 1 58 TRP HH2 . . 4.370 4.173 3.922 4.372 0.002 18 0 "[ . 1 . 2]" 1
917 1 39 THR H 1 58 TRP HZ3 . . 5.270 4.956 4.750 5.127 . 0 0 "[ . 1 . 2]" 1
918 1 39 THR HA 1 39 THR MG . . 3.190 2.314 2.104 2.429 . 0 0 "[ . 1 . 2]" 1
919 1 39 THR HA 1 40 ASP H . . 3.220 2.149 2.141 2.155 . 0 0 "[ . 1 . 2]" 1
920 1 39 THR HA 1 44 VAL HA . . 3.670 2.140 2.036 2.282 . 0 0 "[ . 1 . 2]" 1
921 1 39 THR HA 1 44 VAL HB . . 4.470 3.254 2.997 3.631 . 0 0 "[ . 1 . 2]" 1
922 1 39 THR HA 1 44 VAL MG1 . . 3.960 2.015 1.973 2.122 . 0 0 "[ . 1 . 2]" 1
923 1 39 THR HA 1 44 VAL MG2 . . 4.890 4.377 4.240 4.506 . 0 0 "[ . 1 . 2]" 1
924 1 39 THR HA 1 45 LYS H . . 3.630 3.408 3.224 3.517 . 0 0 "[ . 1 . 2]" 1
925 1 39 THR HA 1 58 TRP HH2 . . 4.280 3.968 3.536 4.145 . 0 0 "[ . 1 . 2]" 1
926 1 39 THR HA 1 58 TRP HZ3 . . 3.660 3.093 2.784 3.298 . 0 0 "[ . 1 . 2]" 1
927 1 39 THR HB 1 40 ASP H . . 4.150 3.599 3.402 3.691 . 0 0 "[ . 1 . 2]" 1
928 1 39 THR MG 1 40 ASP H . . 4.270 4.043 3.818 4.153 . 0 0 "[ . 1 . 2]" 1
929 1 39 THR MG 1 44 VAL HA . . 4.290 3.469 3.281 3.629 . 0 0 "[ . 1 . 2]" 1
930 1 39 THR MG 1 44 VAL HB . . 4.000 2.747 2.349 3.057 . 0 0 "[ . 1 . 2]" 1
931 1 39 THR MG 1 44 VAL MG1 . . 3.110 1.931 1.750 2.194 . 0 0 "[ . 1 . 2]" 1
932 1 39 THR MG 1 44 VAL MG2 . . 3.870 3.778 3.565 3.878 0.008 14 0 "[ . 1 . 2]" 1
933 1 39 THR MG 1 45 LYS H . . 4.610 4.357 4.175 4.526 . 0 0 "[ . 1 . 2]" 1
934 1 39 THR MG 1 58 TRP HZ3 . . 5.050 4.815 4.636 5.036 . 0 0 "[ . 1 . 2]" 1
935 1 40 ASP H 1 43 ARG HB2 . . 4.910 3.731 3.509 4.028 . 0 0 "[ . 1 . 2]" 1
936 1 40 ASP H 1 44 VAL HA . . 3.520 2.468 2.166 2.663 . 0 0 "[ . 1 . 2]" 1
937 1 40 ASP H 1 44 VAL MG1 . . 4.320 2.902 2.646 3.165 . 0 0 "[ . 1 . 2]" 1
938 1 40 ASP H 1 45 LYS H . . 4.780 3.864 3.514 4.131 . 0 0 "[ . 1 . 2]" 1
939 1 40 ASP H 1 58 TRP HE3 . . 4.800 4.188 3.952 4.388 . 0 0 "[ . 1 . 2]" 1
940 1 40 ASP H 1 58 TRP HH2 . . 4.760 3.358 3.136 3.553 . 0 0 "[ . 1 . 2]" 1
941 1 40 ASP H 1 58 TRP HZ3 . . 3.940 2.072 1.898 2.213 . 0 0 "[ . 1 . 2]" 1
942 1 40 ASP HB2 1 41 ASP H . . 3.970 3.687 3.483 3.772 . 0 0 "[ . 1 . 2]" 1
943 1 40 ASP HB2 1 58 TRP HH2 . . 4.250 3.034 2.712 3.678 . 0 0 "[ . 1 . 2]" 1
944 1 40 ASP HB3 1 41 ASP H . . 3.780 2.709 1.962 3.058 . 0 0 "[ . 1 . 2]" 1
945 1 40 ASP HB3 1 41 ASP QB . . 4.730 4.108 3.367 4.730 0.000 18 0 "[ . 1 . 2]" 1
946 1 40 ASP HB3 1 58 TRP HH2 . . 4.910 4.679 4.437 4.830 . 0 0 "[ . 1 . 2]" 1
947 1 41 ASP H 1 41 ASP QB . . 3.870 2.400 2.168 2.663 . 0 0 "[ . 1 . 2]" 1
948 1 41 ASP H 1 42 HIS H . . 4.130 2.994 2.537 3.352 . 0 0 "[ . 1 . 2]" 1
949 1 41 ASP HA 1 43 ARG H . . 4.920 4.501 4.391 4.680 . 0 0 "[ . 1 . 2]" 1
950 1 41 ASP QB 1 42 HIS H . . 3.970 2.326 2.063 2.983 . 0 0 "[ . 1 . 2]" 1
951 1 41 ASP QB 1 42 HIS HA . . 4.800 4.177 4.068 4.360 . 0 0 "[ . 1 . 2]" 1
952 1 41 ASP QB 1 42 HIS HD2 . . 4.360 2.502 1.987 3.825 . 0 0 "[ . 1 . 2]" 1
953 1 41 ASP QB 1 43 ARG H . . 4.710 4.223 4.070 4.525 . 0 0 "[ . 1 . 2]" 1
954 1 42 HIS H 1 42 HIS HB2 . . 3.860 3.089 2.877 3.653 . 0 0 "[ . 1 . 2]" 1
955 1 42 HIS H 1 42 HIS HD2 . . 4.580 2.459 1.900 3.647 . 0 0 "[ . 1 . 2]" 1
956 1 42 HIS H 1 43 ARG HB2 . . 4.850 4.139 4.017 4.330 . 0 0 "[ . 1 . 2]" 1
957 1 42 HIS H 1 43 ARG HG3 . . 4.630 3.167 2.861 3.512 . 0 0 "[ . 1 . 2]" 1
958 1 42 HIS HA 1 61 ALA MB . . 4.130 3.984 3.697 4.133 0.003 9 0 "[ . 1 . 2]" 1
959 1 42 HIS HB2 1 42 HIS HD2 . . 3.810 2.999 2.691 3.383 . 0 0 "[ . 1 . 2]" 1
960 1 42 HIS HB2 1 43 ARG H . . 4.140 4.070 3.472 4.180 0.040 19 0 "[ . 1 . 2]" 1
961 1 42 HIS HB2 1 43 ARG HG2 . . 4.310 3.501 3.312 3.704 . 0 0 "[ . 1 . 2]" 1
962 1 42 HIS HB2 1 43 ARG HG3 . . 4.140 3.526 3.214 3.839 . 0 0 "[ . 1 . 2]" 1
963 1 42 HIS HB3 1 43 ARG H . . 4.590 4.574 4.411 4.609 0.019 19 0 "[ . 1 . 2]" 1
964 1 42 HIS HB3 1 43 ARG HG2 . . 5.080 4.772 4.540 5.080 0.000 9 0 "[ . 1 . 2]" 1
965 1 42 HIS HB3 1 43 ARG HG3 . . 5.060 4.957 4.645 5.061 0.001 9 0 "[ . 1 . 2]" 1
966 1 42 HIS HD2 1 43 ARG H . . 5.030 4.499 2.810 5.029 . 0 0 "[ . 1 . 2]" 1
967 1 42 HIS HD2 1 43 ARG HG2 . . 5.500 4.993 3.331 5.497 . 0 0 "[ . 1 . 2]" 1
968 1 42 HIS HD2 1 43 ARG HG3 . . 4.810 3.884 2.000 4.605 . 0 0 "[ . 1 . 2]" 1
969 1 43 ARG H 1 43 ARG HB2 . . 3.540 2.921 2.623 3.038 . 0 0 "[ . 1 . 2]" 1
970 1 43 ARG H 1 43 ARG HB3 . . 4.120 3.918 3.740 3.960 . 0 0 "[ . 1 . 2]" 1
971 1 43 ARG H 1 43 ARG HG2 . . 4.070 3.674 3.502 3.932 . 0 0 "[ . 1 . 2]" 1
972 1 43 ARG H 1 43 ARG HG3 . . 3.700 3.155 2.803 3.304 . 0 0 "[ . 1 . 2]" 1
973 1 43 ARG H 1 44 VAL H . . 4.610 4.412 4.390 4.507 . 0 0 "[ . 1 . 2]" 1
974 1 43 ARG H 1 44 VAL HA . . 5.500 4.819 4.769 5.041 . 0 0 "[ . 1 . 2]" 1
975 1 43 ARG H 1 60 ASP HA . . 5.500 4.874 4.718 5.176 . 0 0 "[ . 1 . 2]" 1
976 1 43 ARG H 1 61 ALA MB . . 4.600 4.031 3.684 4.482 . 0 0 "[ . 1 . 2]" 1
977 1 43 ARG HA 1 43 ARG HD2 . . 5.040 4.419 3.984 4.915 . 0 0 "[ . 1 . 2]" 1
978 1 43 ARG HA 1 43 ARG QD . . 4.400 3.798 3.689 4.120 . 0 0 "[ . 1 . 2]" 1
979 1 43 ARG HA 1 43 ARG HD3 . . 5.040 4.204 3.959 4.770 . 0 0 "[ . 1 . 2]" 1
980 1 43 ARG HA 1 43 ARG HG2 . . 4.090 2.552 2.483 2.702 . 0 0 "[ . 1 . 2]" 1
981 1 43 ARG HA 1 44 VAL H . . 2.960 2.477 2.385 2.583 . 0 0 "[ . 1 . 2]" 1
982 1 43 ARG HA 1 44 VAL MG2 . . 4.000 3.562 3.340 3.662 . 0 0 "[ . 1 . 2]" 1
983 1 43 ARG HA 1 58 TRP HE3 . . 4.740 4.475 4.210 4.624 . 0 0 "[ . 1 . 2]" 1
984 1 43 ARG HA 1 60 ASP HA . . 3.540 2.197 1.997 2.529 . 0 0 "[ . 1 . 2]" 1
985 1 43 ARG HA 1 61 ALA H . . 3.070 1.918 1.895 1.970 . 0 0 "[ . 1 . 2]" 1
986 1 43 ARG HA 1 61 ALA HA . . 4.490 4.331 4.157 4.447 . 0 0 "[ . 1 . 2]" 1
987 1 43 ARG HA 1 61 ALA MB . . 3.570 2.927 2.710 3.104 . 0 0 "[ . 1 . 2]" 1
988 1 43 ARG HA 1 62 ASP H . . 4.890 4.405 4.302 4.505 . 0 0 "[ . 1 . 2]" 1
989 1 43 ARG HB2 1 43 ARG HE . . 5.000 4.244 2.637 4.934 . 0 0 "[ . 1 . 2]" 1
990 1 43 ARG HB2 1 44 VAL H . . 3.700 3.317 3.117 3.469 . 0 0 "[ . 1 . 2]" 1
991 1 43 ARG HB2 1 44 VAL HA . . 5.180 4.341 4.204 4.452 . 0 0 "[ . 1 . 2]" 1
992 1 43 ARG HB2 1 58 TRP HB3 . . 4.950 4.071 3.830 4.284 . 0 0 "[ . 1 . 2]" 1
993 1 43 ARG HB2 1 58 TRP HE3 . . 3.710 2.767 2.562 2.983 . 0 0 "[ . 1 . 2]" 1
994 1 43 ARG HB2 1 58 TRP HZ3 . . 4.220 3.351 2.975 3.579 . 0 0 "[ . 1 . 2]" 1
995 1 43 ARG HB2 1 59 ILE H . . 5.500 5.424 5.262 5.509 0.009 2 0 "[ . 1 . 2]" 1
996 1 43 ARG HB2 1 60 ASP HA . . 4.820 4.337 4.189 4.507 . 0 0 "[ . 1 . 2]" 1
997 1 43 ARG HB2 1 61 ALA H . . 5.040 4.918 4.864 4.979 . 0 0 "[ . 1 . 2]" 1
998 1 43 ARG HB3 1 43 ARG HD2 . . 4.050 2.525 2.135 3.603 . 0 0 "[ . 1 . 2]" 1
999 1 43 ARG HB3 1 43 ARG HD3 . . 4.050 2.773 2.180 3.494 . 0 0 "[ . 1 . 2]" 1
1000 1 43 ARG HB3 1 44 VAL H . . 3.390 2.336 2.150 2.534 . 0 0 "[ . 1 . 2]" 1
1001 1 43 ARG HB3 1 44 VAL MG2 . . 4.680 4.290 4.153 4.375 . 0 0 "[ . 1 . 2]" 1
1002 1 43 ARG HB3 1 58 TRP HB3 . . 4.430 3.488 3.146 3.700 . 0 0 "[ . 1 . 2]" 1
1003 1 43 ARG HB3 1 58 TRP HE3 . . 3.730 2.581 2.241 2.803 . 0 0 "[ . 1 . 2]" 1
1004 1 43 ARG HB3 1 58 TRP HZ3 . . 4.240 4.039 3.708 4.233 . 0 0 "[ . 1 . 2]" 1
1005 1 43 ARG HB3 1 59 ILE H . . 4.370 4.042 3.943 4.166 . 0 0 "[ . 1 . 2]" 1
1006 1 43 ARG HB3 1 59 ILE MG . . 4.920 4.551 4.406 4.685 . 0 0 "[ . 1 . 2]" 1
1007 1 43 ARG HB3 1 60 ASP HA . . 4.450 3.026 2.809 3.286 . 0 0 "[ . 1 . 2]" 1
1008 1 43 ARG HB3 1 61 ALA H . . 4.480 4.035 3.865 4.228 . 0 0 "[ . 1 . 2]" 1
1009 1 43 ARG HB3 1 61 ALA MB . . 5.060 4.924 4.711 5.064 0.004 5 0 "[ . 1 . 2]" 1
1010 1 43 ARG QD 1 44 VAL H . . 4.550 4.238 4.029 4.484 . 0 0 "[ . 1 . 2]" 1
1011 1 43 ARG QD 1 58 TRP HE3 . . 4.350 3.594 3.379 3.810 . 0 0 "[ . 1 . 2]" 1
1012 1 43 ARG QD 1 58 TRP HZ3 . . 5.340 5.233 4.948 5.342 0.002 19 0 "[ . 1 . 2]" 1
1013 1 43 ARG QD 1 60 ASP HA . . 4.660 3.327 2.816 4.278 . 0 0 "[ . 1 . 2]" 1
1014 1 43 ARG HG2 1 44 VAL H . . 4.880 4.335 4.209 4.483 . 0 0 "[ . 1 . 2]" 1
1015 1 43 ARG HG2 1 58 TRP HE3 . . 5.380 5.078 4.784 5.296 . 0 0 "[ . 1 . 2]" 1
1016 1 43 ARG HG2 1 60 ASP HA . . 3.910 2.514 2.291 2.745 . 0 0 "[ . 1 . 2]" 1
1017 1 43 ARG HG2 1 60 ASP HB2 . . 5.210 4.868 4.568 5.186 . 0 0 "[ . 1 . 2]" 1
1018 1 43 ARG HG2 1 61 ALA H . . 4.110 3.736 3.515 4.103 . 0 0 "[ . 1 . 2]" 1
1019 1 43 ARG HG3 1 44 VAL H . . 5.060 4.950 4.839 5.063 0.003 17 0 "[ . 1 . 2]" 1
1020 1 43 ARG HG3 1 60 ASP HA . . 4.290 4.152 3.969 4.289 . 0 0 "[ . 1 . 2]" 1
1021 1 43 ARG HG3 1 61 ALA H . . 5.150 5.045 4.946 5.156 0.006 16 0 "[ . 1 . 2]" 1
1022 1 44 VAL H 1 44 VAL HB . . 4.020 3.939 3.872 3.970 . 0 0 "[ . 1 . 2]" 1
1023 1 44 VAL H 1 44 VAL MG1 . . 3.950 3.190 3.049 3.387 . 0 0 "[ . 1 . 2]" 1
1024 1 44 VAL H 1 44 VAL MG2 . . 3.410 2.267 2.080 2.391 . 0 0 "[ . 1 . 2]" 1
1025 1 44 VAL H 1 45 LYS H . . 4.930 4.058 3.961 4.200 . 0 0 "[ . 1 . 2]" 1
1026 1 44 VAL H 1 58 TRP HB3 . . 5.500 4.860 4.551 5.218 . 0 0 "[ . 1 . 2]" 1
1027 1 44 VAL H 1 58 TRP HE3 . . 3.880 2.913 2.667 3.215 . 0 0 "[ . 1 . 2]" 1
1028 1 44 VAL H 1 59 ILE H . . 3.620 3.435 3.226 3.606 . 0 0 "[ . 1 . 2]" 1
1029 1 44 VAL H 1 59 ILE MG . . 4.400 3.294 3.220 3.417 . 0 0 "[ . 1 . 2]" 1
1030 1 44 VAL H 1 61 ALA H . . 3.900 3.493 3.204 3.706 . 0 0 "[ . 1 . 2]" 1
1031 1 44 VAL H 1 61 ALA HA . . 4.890 4.535 4.314 4.719 . 0 0 "[ . 1 . 2]" 1
1032 1 44 VAL H 1 61 ALA MB . . 4.230 3.839 3.618 4.021 . 0 0 "[ . 1 . 2]" 1
1033 1 44 VAL HA 1 44 VAL MG1 . . 3.270 2.274 2.149 2.375 . 0 0 "[ . 1 . 2]" 1
1034 1 44 VAL HA 1 44 VAL MG2 . . 3.720 3.193 3.184 3.201 . 0 0 "[ . 1 . 2]" 1
1035 1 44 VAL HA 1 45 LYS H . . 2.910 2.142 2.139 2.162 . 0 0 "[ . 1 . 2]" 1
1036 1 44 VAL HA 1 46 VAL MG1 . . 5.360 5.125 5.001 5.253 . 0 0 "[ . 1 . 2]" 1
1037 1 44 VAL HA 1 58 TRP HE3 . . 4.440 3.521 3.321 3.694 . 0 0 "[ . 1 . 2]" 1
1038 1 44 VAL HA 1 58 TRP HZ3 . . 4.230 2.103 1.997 2.336 . 0 0 "[ . 1 . 2]" 1
1039 1 44 VAL HB 1 45 LYS H . . 3.640 3.408 3.172 3.481 . 0 0 "[ . 1 . 2]" 1
1040 1 44 VAL HB 1 46 VAL MG1 . . 3.940 3.799 3.496 3.940 0.000 12 0 "[ . 1 . 2]" 1
1041 1 44 VAL HB 1 61 ALA MB . . 4.490 4.274 3.975 4.484 . 0 0 "[ . 1 . 2]" 1
1042 1 44 VAL MG1 1 45 LYS H . . 4.000 3.984 3.829 4.008 0.008 19 0 "[ . 1 . 2]" 1
1043 1 44 VAL MG1 1 61 ALA H . . 4.550 3.588 3.353 4.133 . 0 0 "[ . 1 . 2]" 1
1044 1 44 VAL MG1 1 61 ALA HA . . 3.950 3.587 3.281 3.853 . 0 0 "[ . 1 . 2]" 1
1045 1 44 VAL MG1 1 61 ALA MB . . 3.340 2.033 1.893 2.368 . 0 0 "[ . 1 . 2]" 1
1046 1 44 VAL MG2 1 45 LYS H . . 4.190 4.056 3.892 4.183 . 0 0 "[ . 1 . 2]" 1
1047 1 44 VAL MG2 1 45 LYS HA . . 5.010 4.442 4.296 4.581 . 0 0 "[ . 1 . 2]" 1
1048 1 44 VAL MG2 1 46 VAL H . . 5.210 4.254 3.979 4.573 . 0 0 "[ . 1 . 2]" 1
1049 1 44 VAL MG2 1 46 VAL HA . . 5.500 4.437 4.198 4.898 . 0 0 "[ . 1 . 2]" 1
1050 1 44 VAL MG2 1 46 VAL MG1 . . 3.190 2.437 2.270 2.657 . 0 0 "[ . 1 . 2]" 1
1051 1 44 VAL MG2 1 46 VAL MG2 . . 4.240 3.943 3.773 4.099 . 0 0 "[ . 1 . 2]" 1
1052 1 44 VAL MG2 1 58 TRP HA . . 5.500 5.193 4.977 5.355 . 0 0 "[ . 1 . 2]" 1
1053 1 44 VAL MG2 1 59 ILE H . . 4.310 3.884 3.605 4.098 . 0 0 "[ . 1 . 2]" 1
1054 1 44 VAL MG2 1 59 ILE HB . . 5.130 4.827 4.578 5.027 . 0 0 "[ . 1 . 2]" 1
1055 1 44 VAL MG2 1 59 ILE MD . . 4.920 4.716 4.517 4.920 0.000 12 0 "[ . 1 . 2]" 1
1056 1 44 VAL MG2 1 59 ILE HG12 . . 4.770 4.594 4.380 4.775 0.005 9 0 "[ . 1 . 2]" 1
1057 1 44 VAL MG2 1 59 ILE MG . . 3.260 2.369 2.179 2.558 . 0 0 "[ . 1 . 2]" 1
1058 1 44 VAL MG2 1 60 ASP H . . 5.500 5.080 4.871 5.285 . 0 0 "[ . 1 . 2]" 1
1059 1 44 VAL MG2 1 61 ALA H . . 4.320 3.346 3.156 3.530 . 0 0 "[ . 1 . 2]" 1
1060 1 44 VAL MG2 1 61 ALA HA . . 3.370 2.472 2.201 2.804 . 0 0 "[ . 1 . 2]" 1
1061 1 44 VAL MG2 1 61 ALA MB . . 3.560 2.402 2.111 2.726 . 0 0 "[ . 1 . 2]" 1
1062 1 45 LYS H 1 45 LYS HB2 . . 3.590 2.380 2.325 2.453 . 0 0 "[ . 1 . 2]" 1
1063 1 45 LYS H 1 45 LYS HB3 . . 3.260 2.691 2.617 2.748 . 0 0 "[ . 1 . 2]" 1
1064 1 45 LYS H 1 45 LYS QD . . 4.510 4.292 4.225 4.375 . 0 0 "[ . 1 . 2]" 1
1065 1 45 LYS H 1 45 LYS HG3 . . 4.710 4.344 4.295 4.396 . 0 0 "[ . 1 . 2]" 1
1066 1 45 LYS H 1 46 VAL H . . 4.820 4.398 4.309 4.511 . 0 0 "[ . 1 . 2]" 1
1067 1 45 LYS H 1 58 TRP HE3 . . 4.820 3.402 3.205 3.674 . 0 0 "[ . 1 . 2]" 1
1068 1 45 LYS H 1 58 TRP HZ3 . . 4.480 2.418 2.173 2.754 . 0 0 "[ . 1 . 2]" 1
1069 1 45 LYS HA 1 45 LYS QD . . 4.290 3.875 3.801 4.013 . 0 0 "[ . 1 . 2]" 1
1070 1 45 LYS HA 1 45 LYS HG2 . . 3.920 3.158 2.873 3.222 . 0 0 "[ . 1 . 2]" 1
1071 1 45 LYS HA 1 45 LYS HG3 . . 3.770 2.344 2.280 2.489 . 0 0 "[ . 1 . 2]" 1
1072 1 45 LYS HA 1 46 VAL H . . 2.960 2.153 2.140 2.175 . 0 0 "[ . 1 . 2]" 1
1073 1 45 LYS HA 1 46 VAL MG2 . . 4.360 3.649 3.595 3.695 . 0 0 "[ . 1 . 2]" 1
1074 1 45 LYS HA 1 57 TYR H . . 4.680 4.447 4.290 4.543 . 0 0 "[ . 1 . 2]" 1
1075 1 45 LYS HA 1 58 TRP H . . 5.020 4.781 4.514 4.910 . 0 0 "[ . 1 . 2]" 1
1076 1 45 LYS HA 1 58 TRP HA . . 3.330 2.444 2.124 2.550 . 0 0 "[ . 1 . 2]" 1
1077 1 45 LYS HA 1 58 TRP HE3 . . 4.870 3.544 3.293 3.815 . 0 0 "[ . 1 . 2]" 1
1078 1 45 LYS HA 1 59 ILE H . . 3.820 3.070 2.829 3.229 . 0 0 "[ . 1 . 2]" 1
1079 1 45 LYS HA 1 59 ILE MG . . 4.860 3.851 3.738 3.987 . 0 0 "[ . 1 . 2]" 1
1080 1 45 LYS HB2 1 45 LYS QD . . 3.450 2.154 2.089 2.343 . 0 0 "[ . 1 . 2]" 1
1081 1 45 LYS HB2 1 45 LYS HE2 . . 5.060 4.337 3.821 4.787 . 0 0 "[ . 1 . 2]" 1
1082 1 45 LYS HB2 1 45 LYS QE . . 4.370 3.731 3.587 4.072 . 0 0 "[ . 1 . 2]" 1
1083 1 45 LYS HB2 1 45 LYS HE3 . . 5.060 4.135 3.798 4.518 . 0 0 "[ . 1 . 2]" 1
1084 1 45 LYS HB2 1 46 VAL H . . 4.710 4.482 4.394 4.552 . 0 0 "[ . 1 . 2]" 1
1085 1 45 LYS HB2 1 58 TRP HE3 . . 4.970 3.852 3.559 4.060 . 0 0 "[ . 1 . 2]" 1
1086 1 45 LYS HB2 1 58 TRP HH2 . . 4.660 3.459 3.244 3.689 . 0 0 "[ . 1 . 2]" 1
1087 1 45 LYS HB2 1 58 TRP HZ2 . . 4.710 3.478 3.358 3.584 . 0 0 "[ . 1 . 2]" 1
1088 1 45 LYS HB3 1 45 LYS QD . . 3.410 2.608 2.427 2.684 . 0 0 "[ . 1 . 2]" 1
1089 1 45 LYS HB3 1 45 LYS QE . . 4.620 4.176 4.074 4.298 . 0 0 "[ . 1 . 2]" 1
1090 1 45 LYS HB3 1 46 VAL H . . 4.730 4.254 4.120 4.331 . 0 0 "[ . 1 . 2]" 1
1091 1 45 LYS HB3 1 46 VAL HA . . 5.500 4.805 4.672 4.881 . 0 0 "[ . 1 . 2]" 1
1092 1 45 LYS HB3 1 47 HIS H . . 5.500 5.332 5.168 5.504 0.004 10 0 "[ . 1 . 2]" 1
1093 1 45 LYS HB3 1 58 TRP HA . . 5.250 5.100 4.708 5.254 0.004 9 0 "[ . 1 . 2]" 1
1094 1 45 LYS HB3 1 58 TRP HZ2 . . 4.830 4.759 4.496 4.837 0.007 5 0 "[ . 1 . 2]" 1
1095 1 45 LYS QD 1 46 VAL H . . 5.350 5.200 4.986 5.349 . 0 0 "[ . 1 . 2]" 1
1096 1 45 LYS QD 1 56 ASP HB2 . . 4.680 4.434 3.653 4.679 . 0 0 "[ . 1 . 2]" 1
1097 1 45 LYS QD 1 56 ASP HB3 . . 4.680 4.383 3.959 4.689 0.009 19 0 "[ . 1 . 2]" 1
1098 1 45 LYS QD 1 57 TYR H . . 5.500 5.454 5.300 5.506 0.006 16 0 "[ . 1 . 2]" 1
1099 1 45 LYS QD 1 58 TRP HA . . 4.900 4.742 4.621 4.865 . 0 0 "[ . 1 . 2]" 1
1100 1 45 LYS QD 1 58 TRP HD1 . . 4.670 4.480 4.229 4.670 0.000 19 0 "[ . 1 . 2]" 1
1101 1 45 LYS QD 1 58 TRP HE1 . . 3.740 3.194 2.968 3.447 . 0 0 "[ . 1 . 2]" 1
1102 1 45 LYS QD 1 58 TRP HH2 . . 4.660 4.362 4.110 4.674 0.014 2 0 "[ . 1 . 2]" 1
1103 1 45 LYS QD 1 58 TRP HZ2 . . 3.660 3.169 2.925 3.381 . 0 0 "[ . 1 . 2]" 1
1104 1 45 LYS QE 1 45 LYS HG3 . . 3.400 2.292 2.094 2.702 . 0 0 "[ . 1 . 2]" 1
1105 1 45 LYS QE 1 56 ASP QB . . 3.800 2.650 1.967 3.569 . 0 0 "[ . 1 . 2]" 1
1106 1 45 LYS QE 1 58 TRP HD1 . . 4.340 3.724 3.020 4.342 0.002 20 0 "[ . 1 . 2]" 1
1107 1 45 LYS QE 1 58 TRP HE1 . . 3.960 3.425 2.794 3.894 . 0 0 "[ . 1 . 2]" 1
1108 1 45 LYS HE2 1 45 LYS HG2 . . 3.950 3.057 2.479 3.919 . 0 0 "[ . 1 . 2]" 1
1109 1 45 LYS HE2 1 45 LYS HG3 . . 3.920 2.727 2.113 3.630 . 0 0 "[ . 1 . 2]" 1
1110 1 45 LYS HE3 1 45 LYS HG2 . . 3.950 3.424 2.616 3.951 0.001 6 0 "[ . 1 . 2]" 1
1111 1 45 LYS HE3 1 45 LYS HG3 . . 3.920 2.761 2.276 3.572 . 0 0 "[ . 1 . 2]" 1
1112 1 45 LYS HG2 1 46 VAL H . . 3.980 3.740 3.505 3.914 . 0 0 "[ . 1 . 2]" 1
1113 1 45 LYS HG2 1 56 ASP HB2 . . 4.430 3.957 2.868 4.428 . 0 0 "[ . 1 . 2]" 1
1114 1 45 LYS HG2 1 56 ASP HB3 . . 4.430 3.224 2.771 3.882 . 0 0 "[ . 1 . 2]" 1
1115 1 45 LYS HG2 1 57 TYR H . . 4.380 4.250 3.887 4.369 . 0 0 "[ . 1 . 2]" 1
1116 1 45 LYS HG2 1 58 TRP HA . . 5.500 4.921 4.214 5.083 . 0 0 "[ . 1 . 2]" 1
1117 1 45 LYS HG3 1 46 VAL H . . 4.080 3.490 3.135 4.006 . 0 0 "[ . 1 . 2]" 1
1118 1 45 LYS HG3 1 56 ASP HB2 . . 4.810 4.231 3.103 4.610 . 0 0 "[ . 1 . 2]" 1
1119 1 45 LYS HG3 1 56 ASP QB . . 4.200 3.445 3.051 4.142 . 0 0 "[ . 1 . 2]" 1
1120 1 45 LYS HG3 1 56 ASP HB3 . . 4.810 3.824 3.319 4.691 . 0 0 "[ . 1 . 2]" 1
1121 1 45 LYS HG3 1 57 TYR H . . 4.520 3.725 3.501 4.179 . 0 0 "[ . 1 . 2]" 1
1122 1 45 LYS HG3 1 58 TRP HA . . 4.720 3.369 2.926 3.517 . 0 0 "[ . 1 . 2]" 1
1123 1 45 LYS HG3 1 58 TRP HD1 . . 5.210 4.749 3.838 5.061 . 0 0 "[ . 1 . 2]" 1
1124 1 45 LYS HG3 1 58 TRP HE1 . . 5.280 4.777 4.069 5.080 . 0 0 "[ . 1 . 2]" 1
1125 1 46 VAL H 1 46 VAL HB . . 3.870 3.647 3.603 3.721 . 0 0 "[ . 1 . 2]" 1
1126 1 46 VAL H 1 46 VAL MG1 . . 3.720 2.846 2.721 2.972 . 0 0 "[ . 1 . 2]" 1
1127 1 46 VAL H 1 46 VAL MG2 . . 3.090 1.897 1.856 1.999 . 0 0 "[ . 1 . 2]" 1
1128 1 46 VAL H 1 47 HIS H . . 4.720 4.363 4.264 4.459 . 0 0 "[ . 1 . 2]" 1
1129 1 46 VAL H 1 57 TYR H . . 3.680 3.602 3.288 3.685 0.005 15 0 "[ . 1 . 2]" 1
1130 1 46 VAL H 1 58 TRP HA . . 3.790 3.732 3.598 3.797 0.007 13 0 "[ . 1 . 2]" 1
1131 1 46 VAL H 1 59 ILE H . . 4.160 3.317 3.092 3.494 . 0 0 "[ . 1 . 2]" 1
1132 1 46 VAL H 1 59 ILE HB . . 4.750 4.351 4.185 4.630 . 0 0 "[ . 1 . 2]" 1
1133 1 46 VAL H 1 59 ILE MG . . 3.620 3.005 2.730 3.418 . 0 0 "[ . 1 . 2]" 1
1134 1 46 VAL HA 1 46 VAL MG1 . . 3.250 2.165 2.099 2.281 . 0 0 "[ . 1 . 2]" 1
1135 1 46 VAL HA 1 46 VAL MG2 . . 3.420 3.179 3.173 3.184 . 0 0 "[ . 1 . 2]" 1
1136 1 46 VAL HA 1 47 HIS H . . 2.830 2.142 2.140 2.145 . 0 0 "[ . 1 . 2]" 1
1137 1 46 VAL HA 1 47 HIS HB3 . . 4.610 4.434 4.350 4.513 . 0 0 "[ . 1 . 2]" 1
1138 1 46 VAL HB 1 47 HIS H . . 3.780 3.518 3.426 3.584 . 0 0 "[ . 1 . 2]" 1
1139 1 46 VAL HB 1 48 PHE QE . . 4.830 3.312 2.972 3.769 . 0 0 "[ . 1 . 2]" 1
1140 1 46 VAL MG1 1 47 HIS H . . 4.090 3.921 3.842 3.999 . 0 0 "[ . 1 . 2]" 1
1141 1 46 VAL MG1 1 48 PHE QE . . 4.750 4.417 4.100 4.716 . 0 0 "[ . 1 . 2]" 1
1142 1 46 VAL MG1 1 57 TYR QD . . 5.250 4.863 4.703 5.022 . 0 0 "[ . 1 . 2]" 1
1143 1 46 VAL MG1 1 57 TYR QE . . 4.470 4.222 3.913 4.452 . 0 0 "[ . 1 . 2]" 1
1144 1 46 VAL MG1 1 66 ILE MD . . 3.690 3.005 2.568 3.237 . 0 0 "[ . 1 . 2]" 1
1145 1 46 VAL MG2 1 47 HIS H . . 4.410 4.173 4.149 4.211 . 0 0 "[ . 1 . 2]" 1
1146 1 46 VAL MG2 1 48 PHE QE . . 3.850 2.363 2.058 2.730 . 0 0 "[ . 1 . 2]" 1
1147 1 46 VAL MG2 1 48 PHE HZ . . 4.300 4.071 3.330 4.304 0.004 19 0 "[ . 1 . 2]" 1
1148 1 46 VAL MG2 1 57 TYR H . . 3.690 2.927 2.648 3.191 . 0 0 "[ . 1 . 2]" 1
1149 1 46 VAL MG2 1 57 TYR QD . . 3.580 2.877 2.722 3.070 . 0 0 "[ . 1 . 2]" 1
1150 1 46 VAL MG2 1 57 TYR QE . . 3.780 2.316 2.147 2.656 . 0 0 "[ . 1 . 2]" 1
1151 1 46 VAL MG2 1 58 TRP HA . . 4.680 4.325 4.172 4.415 . 0 0 "[ . 1 . 2]" 1
1152 1 46 VAL MG2 1 59 ILE H . . 4.820 3.329 3.197 3.412 . 0 0 "[ . 1 . 2]" 1
1153 1 46 VAL MG2 1 59 ILE HB . . 4.650 2.596 2.501 2.689 . 0 0 "[ . 1 . 2]" 1
1154 1 46 VAL MG2 1 59 ILE MD . . 3.270 2.904 2.766 2.990 . 0 0 "[ . 1 . 2]" 1
1155 1 46 VAL MG2 1 59 ILE HG12 . . 4.540 4.492 4.405 4.546 0.006 13 0 "[ . 1 . 2]" 1
1156 1 46 VAL MG2 1 59 ILE HG13 . . 4.700 4.627 4.489 4.706 0.006 16 0 "[ . 1 . 2]" 1
1157 1 46 VAL MG2 1 59 ILE MG . . 3.300 1.887 1.834 2.011 . 0 0 "[ . 1 . 2]" 1
1158 1 46 VAL MG2 1 66 ILE MD . . 4.260 3.949 3.537 4.209 . 0 0 "[ . 1 . 2]" 1
1159 1 46 VAL MG2 1 66 ILE HG13 . . 5.430 5.098 4.875 5.374 . 0 0 "[ . 1 . 2]" 1
1160 1 47 HIS H 1 47 HIS HB2 . . 3.570 3.097 2.989 3.205 . 0 0 "[ . 1 . 2]" 1
1161 1 47 HIS H 1 47 HIS HB3 . . 3.350 2.385 2.323 2.461 . 0 0 "[ . 1 . 2]" 1
1162 1 47 HIS H 1 47 HIS HD2 . . 4.770 4.546 4.342 4.763 . 0 0 "[ . 1 . 2]" 1
1163 1 47 HIS HB2 1 48 PHE H . . 4.380 4.103 3.913 4.289 . 0 0 "[ . 1 . 2]" 1
1164 1 47 HIS HB3 1 47 HIS HD2 . . 3.750 2.926 2.839 3.017 . 0 0 "[ . 1 . 2]" 1
1165 1 47 HIS HB3 1 48 PHE H . . 4.630 4.329 4.119 4.437 . 0 0 "[ . 1 . 2]" 1
1166 1 47 HIS HD2 1 48 PHE H . . 4.690 4.030 3.699 4.392 . 0 0 "[ . 1 . 2]" 1
1167 1 47 HIS HD2 1 49 ASP H . . 4.980 3.146 2.665 3.884 . 0 0 "[ . 1 . 2]" 1
1168 1 47 HIS HD2 1 49 ASP HA . . 4.020 2.750 2.452 3.191 . 0 0 "[ . 1 . 2]" 1
1169 1 48 PHE H 1 48 PHE HB2 . . 3.870 2.320 2.277 2.402 . 0 0 "[ . 1 . 2]" 1
1170 1 48 PHE H 1 48 PHE QB . . 3.300 2.292 2.251 2.368 . 0 0 "[ . 1 . 2]" 1
1171 1 48 PHE H 1 48 PHE HB3 . . 3.870 3.575 3.551 3.607 . 0 0 "[ . 1 . 2]" 1
1172 1 48 PHE H 1 48 PHE QD . . 3.870 2.153 1.898 2.455 . 0 0 "[ . 1 . 2]" 1
1173 1 48 PHE H 1 48 PHE QE . . 5.260 4.490 4.231 4.787 . 0 0 "[ . 1 . 2]" 1
1174 1 48 PHE H 1 51 TRP QB . . 4.410 3.627 3.094 4.017 . 0 0 "[ . 1 . 2]" 1
1175 1 48 PHE HA 1 48 PHE QD . . 3.920 2.926 2.695 3.138 . 0 0 "[ . 1 . 2]" 1
1176 1 48 PHE HA 1 48 PHE QE . . 4.810 4.551 4.448 4.679 . 0 0 "[ . 1 . 2]" 1
1177 1 48 PHE HA 1 49 ASP H . . 3.350 2.171 2.138 2.233 . 0 0 "[ . 1 . 2]" 1
1178 1 48 PHE HA 1 49 ASP HB2 . . 5.260 4.467 4.301 4.719 . 0 0 "[ . 1 . 2]" 1
1179 1 48 PHE HA 1 49 ASP QB . . 4.430 4.071 4.041 4.088 . 0 0 "[ . 1 . 2]" 1
1180 1 48 PHE HA 1 49 ASP HB3 . . 5.260 4.727 4.467 4.967 . 0 0 "[ . 1 . 2]" 1
1181 1 48 PHE QB 1 51 TRP QB . . 3.540 2.142 1.947 2.625 . 0 0 "[ . 1 . 2]" 1
1182 1 48 PHE QB 1 51 TRP HD1 . . 4.070 2.619 2.030 3.309 . 0 0 "[ . 1 . 2]" 1
1183 1 48 PHE QB 1 51 TRP HE1 . . 4.820 3.534 2.684 4.057 . 0 0 "[ . 1 . 2]" 1
1184 1 48 PHE HB2 1 51 TRP H . . 5.050 3.952 3.509 4.409 . 0 0 "[ . 1 . 2]" 1
1185 1 48 PHE HB2 1 51 TRP HB2 . . 4.750 2.243 2.007 2.793 . 0 0 "[ . 1 . 2]" 1
1186 1 48 PHE HB2 1 51 TRP HB3 . . 4.750 3.411 3.096 3.769 . 0 0 "[ . 1 . 2]" 1
1187 1 48 PHE HB2 1 51 TRP HE1 . . 5.500 4.959 3.993 5.459 . 0 0 "[ . 1 . 2]" 1
1188 1 48 PHE HB3 1 51 TRP H . . 5.050 3.583 3.339 3.833 . 0 0 "[ . 1 . 2]" 1
1189 1 48 PHE HB3 1 51 TRP HB2 . . 4.750 2.965 2.531 3.628 . 0 0 "[ . 1 . 2]" 1
1190 1 48 PHE HB3 1 51 TRP HB3 . . 4.750 4.220 3.876 4.702 . 0 0 "[ . 1 . 2]" 1
1191 1 48 PHE HB3 1 51 TRP HE1 . . 5.500 3.621 2.728 4.201 . 0 0 "[ . 1 . 2]" 1
1192 1 48 PHE QE 1 57 TYR QE . . 3.760 3.458 3.265 3.678 . 0 0 "[ . 1 . 2]" 1
1193 1 48 PHE HZ 1 57 TYR QE . . 4.630 4.144 3.764 4.470 . 0 0 "[ . 1 . 2]" 1
1194 1 49 ASP H 1 49 ASP HB2 . . 4.020 2.339 2.172 2.615 . 0 0 "[ . 1 . 2]" 1
1195 1 49 ASP H 1 49 ASP QB . . 3.470 2.212 2.125 2.273 . 0 0 "[ . 1 . 2]" 1
1196 1 49 ASP H 1 49 ASP HB3 . . 4.020 2.803 2.465 3.048 . 0 0 "[ . 1 . 2]" 1
1197 1 49 ASP H 1 82 PRO QB . . 5.250 4.152 3.682 4.527 . 0 0 "[ . 1 . 2]" 1
1198 1 49 ASP QB 1 82 PRO HA . . 5.340 4.945 4.399 5.346 0.006 17 0 "[ . 1 . 2]" 1
1199 1 49 ASP QB 1 82 PRO QB . . 3.560 2.670 2.232 3.036 . 0 0 "[ . 1 . 2]" 1
1200 1 49 ASP HB2 1 82 PRO QG . . 4.530 4.469 4.268 4.542 0.012 8 0 "[ . 1 . 2]" 1
1201 1 49 ASP HB3 1 82 PRO QG . . 4.530 3.105 2.893 3.341 . 0 0 "[ . 1 . 2]" 1
1202 1 50 GLY QA 1 51 TRP HD1 . . 4.650 3.473 2.906 3.903 . 0 0 "[ . 1 . 2]" 1
1203 1 50 GLY QA 1 82 PRO QB . . 4.330 3.124 2.450 3.698 . 0 0 "[ . 1 . 2]" 1
1204 1 50 GLY QA 1 83 LEU QB . . 4.040 2.082 1.948 3.021 . 0 0 "[ . 1 . 2]" 1
1205 1 51 TRP H 1 51 TRP QB . . 3.150 2.430 2.381 2.528 . 0 0 "[ . 1 . 2]" 1
1206 1 51 TRP H 1 51 TRP HD1 . . 3.480 1.971 1.887 2.192 . 0 0 "[ . 1 . 2]" 1
1207 1 51 TRP H 1 51 TRP HE3 . . 5.500 5.446 5.299 5.549 0.049 17 0 "[ . 1 . 2]" 1
1208 1 51 TRP H 1 52 ASN H . . 4.790 4.614 4.521 4.648 . 0 0 "[ . 1 . 2]" 1
1209 1 51 TRP H 1 82 PRO QB . . 5.340 4.229 3.823 4.751 . 0 0 "[ . 1 . 2]" 1
1210 1 51 TRP QB 1 52 ASN H . . 3.510 2.715 2.203 3.234 . 0 0 "[ . 1 . 2]" 1
1211 1 51 TRP QB 1 55 TYR QD . . 4.130 2.737 2.006 3.729 . 0 0 "[ . 1 . 2]" 1
1212 1 51 TRP HB2 1 55 TYR QD . . 4.700 4.210 3.642 4.716 0.016 13 0 "[ . 1 . 2]" 1
1213 1 51 TRP HB3 1 55 TYR QD . . 4.700 2.780 2.016 3.908 . 0 0 "[ . 1 . 2]" 1
1214 1 51 TRP HD1 1 82 PRO HA . . 4.480 3.800 3.101 4.478 . 0 0 "[ . 1 . 2]" 1
1215 1 51 TRP HD1 1 82 PRO QB . . 5.340 3.654 3.034 4.252 . 0 0 "[ . 1 . 2]" 1
1216 1 51 TRP HD1 1 83 LEU H . . 4.760 3.163 2.571 3.772 . 0 0 "[ . 1 . 2]" 1
1217 1 51 TRP HD1 1 83 LEU QB . . 4.990 3.796 2.766 4.763 . 0 0 "[ . 1 . 2]" 1
1218 1 51 TRP HD1 1 83 LEU QD . . 4.680 2.749 1.875 4.240 . 0 0 "[ . 1 . 2]" 1
1219 1 51 TRP HD1 1 83 LEU HG . . 5.500 4.443 3.374 5.139 . 0 0 "[ . 1 . 2]" 1
1220 1 51 TRP HE1 1 82 PRO HA . . 4.370 2.857 2.132 3.420 . 0 0 "[ . 1 . 2]" 1
1221 1 51 TRP HE1 1 82 PRO QB . . 5.340 3.994 3.375 4.412 . 0 0 "[ . 1 . 2]" 1
1222 1 51 TRP HE1 1 83 LEU QD . . 4.560 3.019 2.227 4.140 . 0 0 "[ . 1 . 2]" 1
1223 1 51 TRP HE3 1 52 ASN H . . 5.440 4.210 3.372 5.208 . 0 0 "[ . 1 . 2]" 1
1224 1 51 TRP HE3 1 55 TYR HB2 . . 4.840 3.495 1.965 4.383 . 0 0 "[ . 1 . 2]" 1
1225 1 51 TRP HE3 1 55 TYR QB . . 4.000 2.993 1.784 3.896 . 0 0 "[ . 1 . 2]" 1
1226 1 51 TRP HE3 1 55 TYR HB3 . . 4.840 3.337 1.999 4.487 . 0 0 "[ . 1 . 2]" 1
1227 1 51 TRP HE3 1 55 TYR QD . . 4.300 2.942 2.469 3.476 . 0 0 "[ . 1 . 2]" 1
1228 1 51 TRP HZ2 1 82 PRO HA . . 5.500 5.153 4.400 5.504 0.004 17 0 "[ . 1 . 2]" 1
1229 1 51 TRP HZ2 1 83 LEU QD . . 4.880 4.052 3.059 4.844 . 0 0 "[ . 1 . 2]" 1
1230 1 52 ASN H 1 52 ASN HB2 . . 3.580 2.322 2.165 2.751 . 0 0 "[ . 1 . 2]" 1
1231 1 52 ASN H 1 52 ASN QB . . 3.100 2.252 2.134 2.538 . 0 0 "[ . 1 . 2]" 1
1232 1 52 ASN H 1 52 ASN HB3 . . 3.580 3.171 2.663 3.591 0.011 17 0 "[ . 1 . 2]" 1
1233 1 52 ASN H 1 52 ASN QD . . 5.340 4.272 3.063 4.846 . 0 0 "[ . 1 . 2]" 1
1234 1 52 ASN H 1 55 TYR QD . . 4.040 2.552 1.888 4.004 . 0 0 "[ . 1 . 2]" 1
1235 1 52 ASN H 1 55 TYR QE . . 4.270 3.255 2.541 4.118 . 0 0 "[ . 1 . 2]" 1
1236 1 52 ASN QB 1 55 TYR QD . . 3.740 2.563 1.983 3.681 . 0 0 "[ . 1 . 2]" 1
1237 1 52 ASN QB 1 55 TYR QE . . 3.560 2.896 1.804 3.447 . 0 0 "[ . 1 . 2]" 1
1238 1 52 ASN HB2 1 55 TYR QD . . 4.350 3.107 2.004 4.389 0.039 8 0 "[ . 1 . 2]" 1
1239 1 52 ASN HB2 1 55 TYR QE . . 4.130 3.185 1.981 4.138 0.008 8 0 "[ . 1 . 2]" 1
1240 1 52 ASN HB3 1 55 TYR QD . . 4.350 3.094 2.192 4.400 0.050 16 0 "[ . 1 . 2]" 1
1241 1 52 ASN HB3 1 55 TYR QE . . 4.130 3.719 2.078 4.157 0.027 16 0 "[ . 1 . 2]" 1
1242 1 54 CYS H 1 55 TYR H . . 4.400 2.755 1.877 3.173 . 0 0 "[ . 1 . 2]" 1
1243 1 54 CYS HB2 1 55 TYR H . . 4.260 3.368 2.311 4.306 0.046 17 0 "[ . 1 . 2]" 1
1244 1 54 CYS HB3 1 55 TYR H . . 4.260 3.346 2.219 4.335 0.075 17 0 "[ . 1 . 2]" 1
1245 1 55 TYR H 1 55 TYR HB2 . . 3.650 2.343 2.207 2.532 . 0 0 "[ . 1 . 2]" 1
1246 1 55 TYR H 1 55 TYR QB . . 3.020 2.313 2.185 2.487 . 0 0 "[ . 1 . 2]" 1
1247 1 55 TYR H 1 55 TYR HB3 . . 3.650 3.572 3.509 3.710 0.060 13 0 "[ . 1 . 2]" 1
1248 1 55 TYR H 1 55 TYR QD . . 3.410 2.712 2.109 3.080 . 0 0 "[ . 1 . 2]" 1
1249 1 55 TYR H 1 55 TYR QE . . 4.900 4.633 4.154 4.971 0.071 13 0 "[ . 1 . 2]" 1
1250 1 55 TYR H 1 56 ASP H . . 3.080 2.829 2.115 3.066 . 0 0 "[ . 1 . 2]" 1
1251 1 55 TYR HA 1 55 TYR QD . . 3.560 2.712 2.400 3.082 . 0 0 "[ . 1 . 2]" 1
1252 1 56 ASP H 1 56 ASP HB2 . . 4.000 3.009 2.789 3.591 . 0 0 "[ . 1 . 2]" 1
1253 1 56 ASP H 1 56 ASP QB . . 3.350 2.777 2.696 2.891 . 0 0 "[ . 1 . 2]" 1
1254 1 56 ASP H 1 56 ASP HB3 . . 4.000 3.451 2.857 3.604 . 0 0 "[ . 1 . 2]" 1
1255 1 56 ASP H 1 57 TYR H . . 4.750 4.623 4.536 4.650 . 0 0 "[ . 1 . 2]" 1
1256 1 56 ASP HA 1 57 TYR H . . 2.870 2.277 2.159 2.380 . 0 0 "[ . 1 . 2]" 1
1257 1 56 ASP QB 1 57 TYR H . . 3.330 2.762 2.485 3.151 . 0 0 "[ . 1 . 2]" 1
1258 1 56 ASP HB2 1 57 TYR H . . 3.890 3.561 3.081 3.885 . 0 0 "[ . 1 . 2]" 1
1259 1 56 ASP HB3 1 57 TYR H . . 3.890 2.953 2.543 3.896 0.006 13 0 "[ . 1 . 2]" 1
1260 1 57 TYR H 1 57 TYR QB . . 3.900 3.295 3.214 3.358 . 0 0 "[ . 1 . 2]" 1
1261 1 57 TYR H 1 57 TYR QD . . 3.740 3.251 3.124 3.353 . 0 0 "[ . 1 . 2]" 1
1262 1 57 TYR H 1 57 TYR QE . . 4.850 4.372 4.229 4.485 . 0 0 "[ . 1 . 2]" 1
1263 1 57 TYR H 1 58 TRP H . . 4.570 4.342 4.284 4.398 . 0 0 "[ . 1 . 2]" 1
1264 1 57 TYR H 1 59 ILE MG . . 5.500 5.281 5.070 5.472 . 0 0 "[ . 1 . 2]" 1
1265 1 57 TYR HA 1 57 TYR QD . . 3.990 3.716 3.700 3.731 . 0 0 "[ . 1 . 2]" 1
1266 1 57 TYR HA 1 58 TRP H . . 2.900 2.307 2.236 2.444 . 0 0 "[ . 1 . 2]" 1
1267 1 57 TYR HA 1 58 TRP HD1 . . 4.790 4.557 4.355 4.664 . 0 0 "[ . 1 . 2]" 1
1268 1 57 TYR QB 1 58 TRP H . . 3.440 2.630 2.312 2.815 . 0 0 "[ . 1 . 2]" 1
1269 1 57 TYR QB 1 59 ILE MG . . 5.450 5.454 5.401 5.468 0.018 9 0 "[ . 1 . 2]" 1
1270 1 57 TYR QD 1 58 TRP H . . 3.990 3.871 3.677 3.997 0.007 12 0 "[ . 1 . 2]" 1
1271 1 57 TYR QD 1 59 ILE HA . . 4.710 3.879 3.733 3.980 . 0 0 "[ . 1 . 2]" 1
1272 1 57 TYR QD 1 59 ILE HB . . 3.860 2.432 2.382 2.497 . 0 0 "[ . 1 . 2]" 1
1273 1 57 TYR QD 1 59 ILE MD . . 4.300 3.823 3.698 3.988 . 0 0 "[ . 1 . 2]" 1
1274 1 57 TYR QD 1 59 ILE HG12 . . 5.500 5.341 5.274 5.424 . 0 0 "[ . 1 . 2]" 1
1275 1 57 TYR QD 1 59 ILE HG13 . . 4.500 4.407 4.270 4.501 0.001 3 0 "[ . 1 . 2]" 1
1276 1 57 TYR QD 1 59 ILE MG . . 3.980 3.677 3.543 3.761 . 0 0 "[ . 1 . 2]" 1
1277 1 57 TYR QE 1 59 ILE HA . . 4.850 4.808 4.679 4.857 0.007 13 0 "[ . 1 . 2]" 1
1278 1 57 TYR QE 1 59 ILE HB . . 3.660 2.508 2.395 2.599 . 0 0 "[ . 1 . 2]" 1
1279 1 57 TYR QE 1 59 ILE MD . . 3.400 2.460 2.329 2.692 . 0 0 "[ . 1 . 2]" 1
1280 1 57 TYR QE 1 59 ILE HG12 . . 5.190 4.791 4.670 4.952 . 0 0 "[ . 1 . 2]" 1
1281 1 57 TYR QE 1 59 ILE HG13 . . 4.270 4.169 4.065 4.264 . 0 0 "[ . 1 . 2]" 1
1282 1 57 TYR QE 1 59 ILE MG . . 3.480 3.350 3.213 3.485 0.005 8 0 "[ . 1 . 2]" 1
1283 1 58 TRP H 1 58 TRP HB2 . . 2.840 2.212 2.192 2.227 . 0 0 "[ . 1 . 2]" 1
1284 1 58 TRP H 1 58 TRP HB3 . . 3.640 3.509 3.489 3.522 . 0 0 "[ . 1 . 2]" 1
1285 1 58 TRP H 1 58 TRP HD1 . . 3.520 3.317 3.110 3.443 . 0 0 "[ . 1 . 2]" 1
1286 1 58 TRP H 1 59 ILE H . . 4.540 4.318 4.292 4.352 . 0 0 "[ . 1 . 2]" 1
1287 1 58 TRP HA 1 58 TRP HD1 . . 4.830 4.188 4.102 4.241 . 0 0 "[ . 1 . 2]" 1
1288 1 58 TRP HA 1 58 TRP HE3 . . 3.860 2.762 2.668 2.956 . 0 0 "[ . 1 . 2]" 1
1289 1 58 TRP HA 1 59 ILE H . . 2.940 2.164 2.157 2.167 . 0 0 "[ . 1 . 2]" 1
1290 1 58 TRP HA 1 59 ILE MG . . 4.440 4.038 3.986 4.079 . 0 0 "[ . 1 . 2]" 1
1291 1 58 TRP HB2 1 58 TRP HD1 . . 3.590 2.570 2.561 2.597 . 0 0 "[ . 1 . 2]" 1
1292 1 58 TRP HB2 1 58 TRP HE1 . . 4.860 4.758 4.755 4.766 . 0 0 "[ . 1 . 2]" 1
1293 1 58 TRP HB2 1 59 ILE H . . 4.650 4.552 4.544 4.562 . 0 0 "[ . 1 . 2]" 1
1294 1 58 TRP HB3 1 58 TRP HE3 . . 3.940 2.793 2.706 2.833 . 0 0 "[ . 1 . 2]" 1
1295 1 58 TRP HB3 1 58 TRP HZ3 . . 5.170 5.134 5.062 5.167 . 0 0 "[ . 1 . 2]" 1
1296 1 58 TRP HB3 1 59 ILE H . . 3.800 3.798 3.765 3.809 0.009 13 0 "[ . 1 . 2]" 1
1297 1 58 TRP HB3 1 59 ILE MG . . 5.500 5.432 5.384 5.466 . 0 0 "[ . 1 . 2]" 1
1298 1 58 TRP HE3 1 59 ILE H . . 4.170 3.477 3.348 3.741 . 0 0 "[ . 1 . 2]" 1
1299 1 59 ILE H 1 59 ILE HB . . 3.810 2.798 2.748 2.842 . 0 0 "[ . 1 . 2]" 1
1300 1 59 ILE H 1 59 ILE MD . . 4.750 4.543 4.518 4.580 . 0 0 "[ . 1 . 2]" 1
1301 1 59 ILE H 1 59 ILE HG12 . . 4.880 4.597 4.566 4.620 . 0 0 "[ . 1 . 2]" 1
1302 1 59 ILE H 1 59 ILE HG13 . . 4.620 4.536 4.519 4.553 . 0 0 "[ . 1 . 2]" 1
1303 1 59 ILE H 1 59 ILE MG . . 3.400 2.239 2.148 2.272 . 0 0 "[ . 1 . 2]" 1
1304 1 59 ILE HA 1 59 ILE MD . . 3.970 3.662 3.615 3.707 . 0 0 "[ . 1 . 2]" 1
1305 1 59 ILE HA 1 59 ILE HG12 . . 3.560 3.062 2.960 3.142 . 0 0 "[ . 1 . 2]" 1
1306 1 59 ILE HA 1 59 ILE HG13 . . 3.860 2.265 2.231 2.314 . 0 0 "[ . 1 . 2]" 1
1307 1 59 ILE HA 1 59 ILE MG . . 3.290 3.188 3.183 3.192 . 0 0 "[ . 1 . 2]" 1
1308 1 59 ILE HA 1 60 ASP H . . 3.120 2.224 2.182 2.253 . 0 0 "[ . 1 . 2]" 1
1309 1 59 ILE HA 1 66 ILE MD . . 5.000 4.465 4.281 4.850 . 0 0 "[ . 1 . 2]" 1
1310 1 59 ILE HB 1 59 ILE MD . . 3.350 2.323 2.260 2.379 . 0 0 "[ . 1 . 2]" 1
1311 1 59 ILE HB 1 60 ASP H . . 4.390 4.132 4.073 4.236 . 0 0 "[ . 1 . 2]" 1
1312 1 59 ILE HB 1 66 ILE MD . . 4.130 3.994 3.826 4.134 0.004 14 0 "[ . 1 . 2]" 1
1313 1 59 ILE MD 1 59 ILE MG . . 2.870 2.045 1.931 2.173 . 0 0 "[ . 1 . 2]" 1
1314 1 59 ILE MD 1 60 ASP H . . 4.320 4.018 3.917 4.197 . 0 0 "[ . 1 . 2]" 1
1315 1 59 ILE MD 1 63 SER H . . 5.310 5.101 4.975 5.206 . 0 0 "[ . 1 . 2]" 1
1316 1 59 ILE MD 1 63 SER HB2 . . 4.150 3.814 3.589 3.991 . 0 0 "[ . 1 . 2]" 1
1317 1 59 ILE MD 1 63 SER HB3 . . 4.010 3.028 2.912 3.183 . 0 0 "[ . 1 . 2]" 1
1318 1 59 ILE MD 1 65 ASP H . . 4.690 4.354 4.213 4.551 . 0 0 "[ . 1 . 2]" 1
1319 1 59 ILE MD 1 65 ASP QB . . 3.990 2.678 2.489 2.894 . 0 0 "[ . 1 . 2]" 1
1320 1 59 ILE MD 1 66 ILE H . . 4.400 3.490 3.369 3.630 . 0 0 "[ . 1 . 2]" 1
1321 1 59 ILE MD 1 66 ILE HA . . 4.880 3.725 3.558 3.870 . 0 0 "[ . 1 . 2]" 1
1322 1 59 ILE MD 1 66 ILE HB . . 4.430 4.253 4.134 4.431 0.001 14 0 "[ . 1 . 2]" 1
1323 1 59 ILE MD 1 66 ILE MD . . 3.330 2.821 2.639 3.025 . 0 0 "[ . 1 . 2]" 1
1324 1 59 ILE MD 1 66 ILE HG12 . . 3.450 2.673 2.450 2.824 . 0 0 "[ . 1 . 2]" 1
1325 1 59 ILE MD 1 66 ILE HG13 . . 3.650 2.048 1.965 2.245 . 0 0 "[ . 1 . 2]" 1
1326 1 59 ILE MD 1 66 ILE MG . . 5.020 4.230 4.082 4.360 . 0 0 "[ . 1 . 2]" 1
1327 1 59 ILE HG12 1 60 ASP H . . 3.860 2.605 2.486 2.733 . 0 0 "[ . 1 . 2]" 1
1328 1 59 ILE HG12 1 63 SER H . . 5.300 4.417 4.281 4.528 . 0 0 "[ . 1 . 2]" 1
1329 1 59 ILE HG12 1 63 SER HB2 . . 4.470 2.956 2.798 3.078 . 0 0 "[ . 1 . 2]" 1
1330 1 59 ILE HG12 1 63 SER HB3 . . 4.580 2.892 2.675 3.012 . 0 0 "[ . 1 . 2]" 1
1331 1 59 ILE HG12 1 66 ILE H . . 5.500 4.787 4.624 5.029 . 0 0 "[ . 1 . 2]" 1
1332 1 59 ILE HG12 1 66 ILE MD . . 3.300 2.218 1.977 2.789 . 0 0 "[ . 1 . 2]" 1
1333 1 59 ILE HG12 1 66 ILE HG13 . . 3.900 2.840 2.610 3.189 . 0 0 "[ . 1 . 2]" 1
1334 1 59 ILE HG13 1 59 ILE MG . . 3.270 3.191 3.180 3.200 . 0 0 "[ . 1 . 2]" 1
1335 1 59 ILE HG13 1 60 ASP H . . 4.040 2.644 2.490 2.946 . 0 0 "[ . 1 . 2]" 1
1336 1 59 ILE HG13 1 60 ASP HB2 . . 4.690 4.396 4.241 4.636 . 0 0 "[ . 1 . 2]" 1
1337 1 59 ILE HG13 1 63 SER HB2 . . 4.340 3.829 3.605 4.084 . 0 0 "[ . 1 . 2]" 1
1338 1 59 ILE HG13 1 63 SER HB3 . . 4.310 4.107 3.914 4.270 . 0 0 "[ . 1 . 2]" 1
1339 1 59 ILE HG13 1 66 ILE MD . . 4.310 3.799 3.594 4.226 . 0 0 "[ . 1 . 2]" 1
1340 1 59 ILE MG 1 60 ASP H . . 4.120 3.526 3.473 3.589 . 0 0 "[ . 1 . 2]" 1
1341 1 59 ILE MG 1 60 ASP HB2 . . 4.990 4.895 4.856 4.956 . 0 0 "[ . 1 . 2]" 1
1342 1 59 ILE MG 1 60 ASP HB3 . . 5.500 5.498 5.474 5.518 0.018 14 0 "[ . 1 . 2]" 1
1343 1 59 ILE MG 1 63 SER H . . 4.960 4.905 4.805 4.980 0.020 2 0 "[ . 1 . 2]" 1
1344 1 59 ILE MG 1 63 SER HB2 . . 4.500 4.460 4.332 4.510 0.010 13 0 "[ . 1 . 2]" 1
1345 1 59 ILE MG 1 63 SER HB3 . . 4.280 4.195 3.945 4.286 0.006 8 0 "[ . 1 . 2]" 1
1346 1 59 ILE MG 1 65 ASP QB . . 5.340 5.182 4.981 5.341 0.001 11 0 "[ . 1 . 2]" 1
1347 1 59 ILE MG 1 66 ILE H . . 5.260 5.202 5.064 5.268 0.008 14 0 "[ . 1 . 2]" 1
1348 1 59 ILE MG 1 66 ILE MD . . 3.090 1.818 1.675 1.953 . 0 0 "[ . 1 . 2]" 1
1349 1 59 ILE MG 1 66 ILE HG13 . . 3.810 3.139 2.969 3.333 . 0 0 "[ . 1 . 2]" 1
1350 1 59 ILE MG 1 66 ILE MG . . 3.960 3.816 3.650 3.945 . 0 0 "[ . 1 . 2]" 1
1351 1 60 ASP H 1 60 ASP HB2 . . 3.360 2.416 2.381 2.467 . 0 0 "[ . 1 . 2]" 1
1352 1 60 ASP H 1 60 ASP HB3 . . 3.810 3.586 3.577 3.593 . 0 0 "[ . 1 . 2]" 1
1353 1 60 ASP H 1 61 ALA H . . 4.700 4.528 4.486 4.570 . 0 0 "[ . 1 . 2]" 1
1354 1 60 ASP H 1 63 SER HB3 . . 4.900 4.306 4.026 4.470 . 0 0 "[ . 1 . 2]" 1
1355 1 60 ASP H 1 66 ILE MD . . 4.690 3.840 3.590 4.320 . 0 0 "[ . 1 . 2]" 1
1356 1 60 ASP HA 1 61 ALA H . . 2.920 2.148 2.139 2.163 . 0 0 "[ . 1 . 2]" 1
1357 1 60 ASP HA 1 61 ALA HA . . 4.870 4.362 4.348 4.380 . 0 0 "[ . 1 . 2]" 1
1358 1 60 ASP HA 1 61 ALA MB . . 3.960 3.937 3.919 3.981 0.021 2 0 "[ . 1 . 2]" 1
1359 1 60 ASP HA 1 66 ILE MD . . 5.500 4.248 4.086 4.567 . 0 0 "[ . 1 . 2]" 1
1360 1 60 ASP HB2 1 61 ALA H . . 4.300 4.279 4.229 4.317 0.017 14 0 "[ . 1 . 2]" 1
1361 1 60 ASP HB2 1 61 ALA MB . . 5.500 5.504 5.495 5.511 0.011 2 0 "[ . 1 . 2]" 1
1362 1 60 ASP HB2 1 62 ASP H . . 4.220 3.785 3.508 4.174 . 0 0 "[ . 1 . 2]" 1
1363 1 60 ASP HB2 1 63 SER H . . 3.790 3.238 2.702 3.542 . 0 0 "[ . 1 . 2]" 1
1364 1 60 ASP HB2 1 63 SER HB2 . . 4.390 2.069 1.989 2.332 . 0 0 "[ . 1 . 2]" 1
1365 1 60 ASP HB2 1 63 SER HB3 . . 4.830 3.760 3.623 3.976 . 0 0 "[ . 1 . 2]" 1
1366 1 60 ASP HB3 1 61 ALA H . . 3.870 3.341 3.215 3.461 . 0 0 "[ . 1 . 2]" 1
1367 1 60 ASP HB3 1 62 ASP H . . 3.880 2.642 2.471 2.978 . 0 0 "[ . 1 . 2]" 1
1368 1 60 ASP HB3 1 63 SER H . . 3.690 3.339 2.853 3.693 0.003 9 0 "[ . 1 . 2]" 1
1369 1 60 ASP HB3 1 63 SER HB2 . . 4.490 3.420 3.298 3.700 . 0 0 "[ . 1 . 2]" 1
1370 1 60 ASP HB3 1 63 SER HB3 . . 4.990 4.905 4.717 4.994 0.004 14 0 "[ . 1 . 2]" 1
1371 1 61 ALA H 1 61 ALA MB . . 3.040 2.077 2.025 2.192 . 0 0 "[ . 1 . 2]" 1
1372 1 61 ALA H 1 62 ASP H . . 3.580 2.661 2.587 2.769 . 0 0 "[ . 1 . 2]" 1
1373 1 61 ALA H 1 63 SER H . . 4.690 4.131 4.011 4.265 . 0 0 "[ . 1 . 2]" 1
1374 1 61 ALA HA 1 62 ASP HA . . 5.350 4.622 4.569 4.739 . 0 0 "[ . 1 . 2]" 1
1375 1 61 ALA HA 1 63 SER H . . 4.490 3.631 3.446 3.927 . 0 0 "[ . 1 . 2]" 1
1376 1 61 ALA HA 1 66 ILE HB . . 4.850 4.482 4.342 4.730 . 0 0 "[ . 1 . 2]" 1
1377 1 61 ALA HA 1 66 ILE MD . . 3.220 2.165 1.951 2.323 . 0 0 "[ . 1 . 2]" 1
1378 1 61 ALA MB 1 62 ASP H . . 3.690 2.958 2.653 3.158 . 0 0 "[ . 1 . 2]" 1
1379 1 61 ALA MB 1 62 ASP QB . . 5.340 4.172 3.695 4.453 . 0 0 "[ . 1 . 2]" 1
1380 1 61 ALA MB 1 63 SER H . . 4.630 4.311 4.076 4.463 . 0 0 "[ . 1 . 2]" 1
1381 1 62 ASP H 1 62 ASP HB2 . . 3.770 2.737 2.269 3.700 . 0 0 "[ . 1 . 2]" 1
1382 1 62 ASP H 1 62 ASP HB3 . . 3.770 3.414 2.623 3.699 . 0 0 "[ . 1 . 2]" 1
1383 1 62 ASP H 1 63 SER H . . 3.040 2.486 2.211 2.710 . 0 0 "[ . 1 . 2]" 1
1384 1 62 ASP H 1 63 SER HB3 . . 5.420 4.992 4.660 5.163 . 0 0 "[ . 1 . 2]" 1
1385 1 62 ASP QB 1 63 SER H . . 4.360 3.616 3.165 4.003 . 0 0 "[ . 1 . 2]" 1
1386 1 63 SER H 1 63 SER HB2 . . 3.040 2.451 2.240 2.619 . 0 0 "[ . 1 . 2]" 1
1387 1 63 SER H 1 63 SER HB3 . . 2.930 2.665 2.459 2.901 . 0 0 "[ . 1 . 2]" 1
1388 1 63 SER H 1 64 PRO QD . . 4.400 4.328 4.263 4.351 . 0 0 "[ . 1 . 2]" 1
1389 1 63 SER H 1 65 ASP H . . 5.500 5.310 5.065 5.502 0.002 5 0 "[ . 1 . 2]" 1
1390 1 63 SER H 1 66 ILE HB . . 5.500 3.929 3.601 4.395 . 0 0 "[ . 1 . 2]" 1
1391 1 63 SER H 1 66 ILE MD . . 3.620 2.915 2.534 3.350 . 0 0 "[ . 1 . 2]" 1
1392 1 63 SER H 1 66 ILE HG13 . . 4.690 4.281 4.073 4.461 . 0 0 "[ . 1 . 2]" 1
1393 1 63 SER HA 1 64 PRO QD . . 2.870 1.980 1.942 1.998 . 0 0 "[ . 1 . 2]" 1
1394 1 63 SER HA 1 66 ILE MD . . 5.500 4.805 4.528 5.209 . 0 0 "[ . 1 . 2]" 1
1395 1 63 SER HB2 1 64 PRO QD . . 4.140 3.576 3.391 3.738 . 0 0 "[ . 1 . 2]" 1
1396 1 63 SER HB2 1 65 ASP H . . 4.650 4.407 4.240 4.565 . 0 0 "[ . 1 . 2]" 1
1397 1 63 SER HB2 1 66 ILE MD . . 4.070 3.335 3.088 3.754 . 0 0 "[ . 1 . 2]" 1
1398 1 63 SER HB2 1 66 ILE HG13 . . 4.440 3.821 3.544 4.126 . 0 0 "[ . 1 . 2]" 1
1399 1 63 SER HB3 1 64 PRO QD . . 4.600 3.658 3.547 3.873 . 0 0 "[ . 1 . 2]" 1
1400 1 63 SER HB3 1 65 ASP H . . 4.470 3.345 3.012 3.680 . 0 0 "[ . 1 . 2]" 1
1401 1 63 SER HB3 1 66 ILE H . . 4.280 2.745 2.551 3.014 . 0 0 "[ . 1 . 2]" 1
1402 1 63 SER HB3 1 66 ILE HB . . 4.740 3.207 2.860 3.617 . 0 0 "[ . 1 . 2]" 1
1403 1 63 SER HB3 1 66 ILE MD . . 3.550 2.698 2.331 3.092 . 0 0 "[ . 1 . 2]" 1
1404 1 63 SER HB3 1 66 ILE HG12 . . 4.640 4.030 3.777 4.303 . 0 0 "[ . 1 . 2]" 1
1405 1 63 SER HB3 1 66 ILE HG13 . . 3.930 2.335 2.095 2.617 . 0 0 "[ . 1 . 2]" 1
1406 1 64 PRO HA 1 66 ILE H . . 4.320 4.171 4.008 4.326 0.006 9 0 "[ . 1 . 2]" 1
1407 1 64 PRO QD 1 65 ASP H . . 3.850 2.653 2.607 2.760 . 0 0 "[ . 1 . 2]" 1
1408 1 64 PRO QG 1 65 ASP H . . 3.840 2.649 2.443 2.953 . 0 0 "[ . 1 . 2]" 1
1409 1 64 PRO HG2 1 65 ASP H . . 4.570 2.682 2.466 3.003 . 0 0 "[ . 1 . 2]" 1
1410 1 64 PRO HG3 1 65 ASP H . . 4.570 4.114 3.952 4.356 . 0 0 "[ . 1 . 2]" 1
1411 1 65 ASP H 1 65 ASP HB2 . . 3.840 2.838 2.783 2.913 . 0 0 "[ . 1 . 2]" 1
1412 1 65 ASP H 1 65 ASP QB . . 3.340 2.733 2.691 2.781 . 0 0 "[ . 1 . 2]" 1
1413 1 65 ASP H 1 65 ASP HB3 . . 3.840 3.570 3.521 3.608 . 0 0 "[ . 1 . 2]" 1
1414 1 65 ASP H 1 66 ILE H . . 3.220 2.482 2.321 2.653 . 0 0 "[ . 1 . 2]" 1
1415 1 65 ASP H 1 66 ILE MD . . 5.380 5.215 4.995 5.378 . 0 0 "[ . 1 . 2]" 1
1416 1 65 ASP QB 1 66 ILE H . . 3.930 2.811 2.705 2.954 . 0 0 "[ . 1 . 2]" 1
1417 1 65 ASP QB 1 66 ILE HG13 . . 5.280 3.487 3.364 3.643 . 0 0 "[ . 1 . 2]" 1
1418 1 65 ASP QB 1 66 ILE MG . . 5.340 5.225 5.169 5.274 . 0 0 "[ . 1 . 2]" 1
1419 1 65 ASP HB2 1 66 ILE H . . 4.500 2.864 2.748 3.020 . 0 0 "[ . 1 . 2]" 1
1420 1 65 ASP HB3 1 66 ILE H . . 4.500 4.091 4.031 4.183 . 0 0 "[ . 1 . 2]" 1
1421 1 66 ILE H 1 66 ILE HB . . 3.080 2.385 2.339 2.461 . 0 0 "[ . 1 . 2]" 1
1422 1 66 ILE H 1 66 ILE MD . . 4.050 3.699 3.539 3.835 . 0 0 "[ . 1 . 2]" 1
1423 1 66 ILE H 1 66 ILE HG12 . . 4.010 3.652 3.547 3.776 . 0 0 "[ . 1 . 2]" 1
1424 1 66 ILE H 1 66 ILE HG13 . . 3.450 2.428 2.238 2.560 . 0 0 "[ . 1 . 2]" 1
1425 1 66 ILE H 1 66 ILE MG . . 3.960 3.729 3.707 3.753 . 0 0 "[ . 1 . 2]" 1
1426 1 66 ILE H 1 67 HIS H . . 4.660 4.528 4.473 4.563 . 0 0 "[ . 1 . 2]" 1
1427 1 66 ILE H 1 67 HIS HA . . 5.500 5.480 5.412 5.517 0.017 14 0 "[ . 1 . 2]" 1
1428 1 66 ILE HA 1 66 ILE MD . . 4.010 3.782 3.737 3.828 . 0 0 "[ . 1 . 2]" 1
1429 1 66 ILE HA 1 66 ILE HG12 . . 4.180 2.440 2.347 2.537 . 0 0 "[ . 1 . 2]" 1
1430 1 66 ILE HA 1 66 ILE HG13 . . 3.990 2.869 2.773 2.932 . 0 0 "[ . 1 . 2]" 1
1431 1 66 ILE HA 1 66 ILE MG . . 3.250 2.470 2.398 2.556 . 0 0 "[ . 1 . 2]" 1
1432 1 66 ILE HA 1 67 HIS H . . 2.900 2.148 2.140 2.161 . 0 0 "[ . 1 . 2]" 1
1433 1 66 ILE HB 1 66 ILE MD . . 3.600 2.360 2.284 2.481 . 0 0 "[ . 1 . 2]" 1
1434 1 66 ILE HB 1 67 HIS H . . 4.420 4.295 4.209 4.390 . 0 0 "[ . 1 . 2]" 1
1435 1 66 ILE HG13 1 66 ILE MG . . 3.370 3.192 3.183 3.204 . 0 0 "[ . 1 . 2]" 1
1436 1 66 ILE HG13 1 67 HIS H . . 4.940 4.921 4.838 4.948 0.008 19 0 "[ . 1 . 2]" 1
1437 1 66 ILE MG 1 67 HIS H . . 3.460 2.510 2.273 2.818 . 0 0 "[ . 1 . 2]" 1
1438 1 66 ILE MG 1 67 HIS HA . . 4.670 3.417 3.311 3.506 . 0 0 "[ . 1 . 2]" 1
1439 1 66 ILE MG 1 68 PRO HD3 . . 4.470 4.123 3.987 4.275 . 0 0 "[ . 1 . 2]" 1
1440 1 67 HIS H 1 67 HIS HB2 . . 3.580 2.695 2.611 2.762 . 0 0 "[ . 1 . 2]" 1
1441 1 67 HIS H 1 67 HIS HB3 . . 4.030 3.807 3.763 3.834 . 0 0 "[ . 1 . 2]" 1
1442 1 67 HIS H 1 67 HIS HD2 . . 4.240 3.818 3.661 3.970 . 0 0 "[ . 1 . 2]" 1
1443 1 67 HIS H 1 68 PRO HD3 . . 5.160 4.841 4.794 4.909 . 0 0 "[ . 1 . 2]" 1
1444 1 67 HIS HA 1 67 HIS HD2 . . 5.190 4.622 4.539 4.741 . 0 0 "[ . 1 . 2]" 1
1445 1 67 HIS HA 1 68 PRO HD2 . . 3.150 2.245 2.205 2.311 . 0 0 "[ . 1 . 2]" 1
1446 1 67 HIS HB2 1 68 PRO HD2 . . 4.070 3.824 3.727 3.901 . 0 0 "[ . 1 . 2]" 1
1447 1 67 HIS HB2 1 68 PRO HD3 . . 5.000 4.815 4.755 4.859 . 0 0 "[ . 1 . 2]" 1
1448 1 67 HIS HB2 1 71 TRP H . . 5.340 5.020 4.719 5.329 . 0 0 "[ . 1 . 2]" 1
1449 1 67 HIS HB2 1 71 TRP HB2 . . 4.400 3.504 3.183 3.823 . 0 0 "[ . 1 . 2]" 1
1450 1 67 HIS HB2 1 71 TRP HB3 . . 4.370 3.109 2.829 3.420 . 0 0 "[ . 1 . 2]" 1
1451 1 67 HIS HB3 1 68 PRO HD2 . . 3.830 2.342 2.200 2.441 . 0 0 "[ . 1 . 2]" 1
1452 1 67 HIS HB3 1 68 PRO HD3 . . 3.830 3.742 3.623 3.825 . 0 0 "[ . 1 . 2]" 1
1453 1 67 HIS HB3 1 68 PRO QG . . 4.330 3.909 3.787 3.983 . 0 0 "[ . 1 . 2]" 1
1454 1 67 HIS HB3 1 71 TRP H . . 4.660 4.318 4.075 4.664 0.004 4 0 "[ . 1 . 2]" 1
1455 1 67 HIS HB3 1 71 TRP HB2 . . 4.050 2.045 1.995 2.210 . 0 0 "[ . 1 . 2]" 1
1456 1 67 HIS HB3 1 71 TRP HB3 . . 4.130 2.462 2.180 2.886 . 0 0 "[ . 1 . 2]" 1
1457 1 67 HIS HB3 1 71 TRP HD1 . . 4.820 2.828 2.326 3.259 . 0 0 "[ . 1 . 2]" 1
1458 1 67 HIS HB3 1 71 TRP HE3 . . 4.950 4.491 4.314 4.693 . 0 0 "[ . 1 . 2]" 1
1459 1 67 HIS HE1 1 71 TRP HE1 . . 4.590 3.148 2.873 3.542 . 0 0 "[ . 1 . 2]" 1
1460 1 67 HIS HE1 1 71 TRP HZ2 . . 4.870 4.815 4.506 4.876 0.006 13 0 "[ . 1 . 2]" 1
1461 1 68 PRO HA 1 69 VAL H . . 2.830 2.319 2.260 2.378 . 0 0 "[ . 1 . 2]" 1
1462 1 68 PRO HB2 1 69 VAL H . . 3.560 2.834 2.671 3.011 . 0 0 "[ . 1 . 2]" 1
1463 1 68 PRO HB2 1 69 VAL MG1 . . 5.500 5.198 5.111 5.397 . 0 0 "[ . 1 . 2]" 1
1464 1 68 PRO HB2 1 69 VAL MG2 . . 5.500 4.848 4.633 4.955 . 0 0 "[ . 1 . 2]" 1
1465 1 68 PRO HB3 1 69 VAL H . . 3.780 3.572 3.484 3.672 . 0 0 "[ . 1 . 2]" 1
1466 1 68 PRO HD2 1 71 TRP HA . . 4.700 4.252 3.825 4.506 . 0 0 "[ . 1 . 2]" 1
1467 1 68 PRO HD2 1 71 TRP HB2 . . 3.980 2.395 2.211 2.495 . 0 0 "[ . 1 . 2]" 1
1468 1 68 PRO HD2 1 71 TRP HB3 . . 4.530 3.854 3.641 4.184 . 0 0 "[ . 1 . 2]" 1
1469 1 68 PRO HD2 1 74 LYS QD . . 5.500 4.347 3.780 5.120 . 0 0 "[ . 1 . 2]" 1
1470 1 68 PRO HD3 1 71 TRP HB2 . . 4.290 4.115 3.862 4.225 . 0 0 "[ . 1 . 2]" 1
1471 1 68 PRO HD3 1 71 TRP HD1 . . 4.800 4.590 4.093 4.805 0.005 8 0 "[ . 1 . 2]" 1
1472 1 68 PRO QG 1 69 VAL H . . 4.420 4.308 4.206 4.413 . 0 0 "[ . 1 . 2]" 1
1473 1 68 PRO QG 1 71 TRP H . . 4.110 3.912 3.173 4.122 0.012 6 0 "[ . 1 . 2]" 1
1474 1 68 PRO QG 1 71 TRP HA . . 4.810 3.641 3.018 3.994 . 0 0 "[ . 1 . 2]" 1
1475 1 68 PRO QG 1 71 TRP HB2 . . 3.720 2.884 2.562 3.031 . 0 0 "[ . 1 . 2]" 1
1476 1 68 PRO QG 1 71 TRP HB3 . . 4.520 4.239 4.022 4.420 . 0 0 "[ . 1 . 2]" 1
1477 1 68 PRO QG 1 71 TRP HD1 . . 4.660 4.160 3.686 4.433 . 0 0 "[ . 1 . 2]" 1
1478 1 69 VAL H 1 69 VAL HB . . 2.880 2.387 2.336 2.527 . 0 0 "[ . 1 . 2]" 1
1479 1 69 VAL H 1 69 VAL MG1 . . 3.930 3.730 3.710 3.761 . 0 0 "[ . 1 . 2]" 1
1480 1 69 VAL H 1 69 VAL MG2 . . 2.940 2.454 2.054 2.577 . 0 0 "[ . 1 . 2]" 1
1481 1 69 VAL H 1 70 GLY H . . 4.330 3.693 2.690 4.345 0.015 10 0 "[ . 1 . 2]" 1
1482 1 69 VAL HA 1 69 VAL MG1 . . 3.200 2.502 2.398 2.554 . 0 0 "[ . 1 . 2]" 1
1483 1 69 VAL HA 1 69 VAL MG2 . . 3.140 2.180 2.111 2.378 . 0 0 "[ . 1 . 2]" 1
1484 1 69 VAL HA 1 70 GLY H . . 3.550 2.701 2.173 3.494 . 0 0 "[ . 1 . 2]" 1
1485 1 69 VAL HA 1 71 TRP H . . 4.040 3.687 3.563 3.842 . 0 0 "[ . 1 . 2]" 1
1486 1 69 VAL HB 1 70 GLY H . . 4.500 3.923 2.916 4.549 0.049 6 0 "[ . 1 . 2]" 1
1487 1 69 VAL MG1 1 70 GLY H . . 3.520 3.214 3.004 3.501 . 0 0 "[ . 1 . 2]" 1
1488 1 69 VAL MG1 1 70 GLY HA2 . . 4.490 3.476 3.215 3.651 . 0 0 "[ . 1 . 2]" 1
1489 1 69 VAL MG1 1 70 GLY QA . . 3.870 3.188 3.088 3.261 . 0 0 "[ . 1 . 2]" 1
1490 1 69 VAL MG1 1 70 GLY HA3 . . 4.490 3.761 3.542 4.090 . 0 0 "[ . 1 . 2]" 1
1491 1 69 VAL MG1 1 71 TRP H . . 4.850 4.539 4.286 4.822 . 0 0 "[ . 1 . 2]" 1
1492 1 69 VAL MG2 1 70 GLY H . . 4.460 4.088 3.984 4.203 . 0 0 "[ . 1 . 2]" 1
1493 1 70 GLY H 1 70 GLY QA . . 2.560 2.339 2.257 2.405 . 0 0 "[ . 1 . 2]" 1
1494 1 70 GLY H 1 71 TRP H . . 3.200 2.334 1.785 3.167 . 0 0 "[ . 1 . 2]" 1
1495 1 70 GLY QA 1 71 TRP HA . . 4.680 4.087 4.051 4.122 . 0 0 "[ . 1 . 2]" 1
1496 1 70 GLY QA 1 73 SER H . . 4.770 3.645 3.448 3.791 . 0 0 "[ . 1 . 2]" 1
1497 1 70 GLY QA 1 73 SER QB . . 4.340 3.858 3.314 4.344 0.004 14 0 "[ . 1 . 2]" 1
1498 1 70 GLY QA 1 74 LYS QD . . 5.340 4.682 3.627 5.282 . 0 0 "[ . 1 . 2]" 1
1499 1 71 TRP H 1 71 TRP HB2 . . 3.160 2.867 2.626 2.987 . 0 0 "[ . 1 . 2]" 1
1500 1 71 TRP H 1 71 TRP HB3 . . 3.160 2.333 2.234 2.498 . 0 0 "[ . 1 . 2]" 1
1501 1 71 TRP H 1 71 TRP HE3 . . 4.580 4.095 3.806 4.536 . 0 0 "[ . 1 . 2]" 1
1502 1 71 TRP H 1 72 CYS H . . 3.700 2.469 2.282 2.607 . 0 0 "[ . 1 . 2]" 1
1503 1 71 TRP H 1 72 CYS HA . . 5.290 5.018 4.916 5.197 . 0 0 "[ . 1 . 2]" 1
1504 1 71 TRP H 1 72 CYS HB3 . . 4.710 4.664 4.547 4.713 0.003 8 0 "[ . 1 . 2]" 1
1505 1 71 TRP H 1 74 LYS QD . . 5.500 4.806 4.143 5.512 0.012 17 0 "[ . 1 . 2]" 1
1506 1 71 TRP HA 1 71 TRP HD1 . . 3.970 3.491 3.184 3.724 . 0 0 "[ . 1 . 2]" 1
1507 1 71 TRP HA 1 71 TRP HE1 . . 5.500 5.336 5.110 5.502 0.002 2 0 "[ . 1 . 2]" 1
1508 1 71 TRP HA 1 72 CYS HA . . 5.190 4.851 4.722 4.954 . 0 0 "[ . 1 . 2]" 1
1509 1 71 TRP HA 1 74 LYS QB . . 3.220 2.758 2.168 3.245 0.025 12 0 "[ . 1 . 2]" 1
1510 1 71 TRP HA 1 74 LYS QD . . 3.660 2.641 1.873 3.676 0.016 9 0 "[ . 1 . 2]" 1
1511 1 71 TRP HA 1 74 LYS QE . . 5.120 3.447 1.873 4.539 . 0 0 "[ . 1 . 2]" 1
1512 1 71 TRP HA 1 74 LYS QG . . 3.920 2.886 1.986 3.922 0.002 14 0 "[ . 1 . 2]" 1
1513 1 71 TRP HB2 1 71 TRP HE1 . . 4.980 4.771 4.756 4.796 . 0 0 "[ . 1 . 2]" 1
1514 1 71 TRP HB2 1 72 CYS H . . 5.020 4.129 3.641 4.401 . 0 0 "[ . 1 . 2]" 1
1515 1 71 TRP HB3 1 71 TRP HE3 . . 4.020 2.698 2.547 2.818 . 0 0 "[ . 1 . 2]" 1
1516 1 71 TRP HB3 1 72 CYS H . . 4.730 2.933 2.160 3.403 . 0 0 "[ . 1 . 2]" 1
1517 1 71 TRP HD1 1 75 THR MG . . 4.290 3.463 2.910 4.105 . 0 0 "[ . 1 . 2]" 1
1518 1 71 TRP HE1 1 75 THR MG . . 3.630 2.332 1.972 3.341 . 0 0 "[ . 1 . 2]" 1
1519 1 71 TRP HE3 1 72 CYS H . . 4.860 2.670 2.269 2.943 . 0 0 "[ . 1 . 2]" 1
1520 1 71 TRP HE3 1 72 CYS HA . . 4.110 2.343 2.117 2.515 . 0 0 "[ . 1 . 2]" 1
1521 1 71 TRP HZ2 1 75 THR MG . . 4.160 2.686 2.166 3.186 . 0 0 "[ . 1 . 2]" 1
1522 1 72 CYS H 1 73 SER H . . 3.900 2.732 2.418 2.994 . 0 0 "[ . 1 . 2]" 1
1523 1 72 CYS HA 1 75 THR H . . 4.620 4.397 4.157 4.610 . 0 0 "[ . 1 . 2]" 1
1524 1 72 CYS HA 1 75 THR MG . . 5.090 4.690 3.022 5.091 0.001 14 0 "[ . 1 . 2]" 1
1525 1 72 CYS HA 1 77 HIS H . . 3.280 2.872 2.589 3.102 . 0 0 "[ . 1 . 2]" 1
1526 1 72 CYS HA 1 77 HIS HB2 . . 3.800 3.151 2.663 3.459 . 0 0 "[ . 1 . 2]" 1
1527 1 72 CYS HA 1 77 HIS HB3 . . 4.460 4.209 3.809 4.437 . 0 0 "[ . 1 . 2]" 1
1528 1 72 CYS HB2 1 73 SER H . . 4.140 3.881 3.648 4.128 . 0 0 "[ . 1 . 2]" 1
1529 1 72 CYS HB2 1 77 HIS H . . 4.490 4.041 3.579 4.274 . 0 0 "[ . 1 . 2]" 1
1530 1 72 CYS HB2 1 77 HIS HB2 . . 4.890 4.675 4.159 4.893 0.003 16 0 "[ . 1 . 2]" 1
1531 1 72 CYS HB2 1 79 LEU HB2 . . 4.620 2.941 2.481 3.223 . 0 0 "[ . 1 . 2]" 1
1532 1 72 CYS HB2 1 79 LEU QB . . 3.810 2.889 2.457 3.151 . 0 0 "[ . 1 . 2]" 1
1533 1 72 CYS HB2 1 79 LEU HB3 . . 4.620 4.251 3.966 4.446 . 0 0 "[ . 1 . 2]" 1
1534 1 72 CYS HB2 1 79 LEU MD1 . . 4.610 4.052 3.351 4.561 . 0 0 "[ . 1 . 2]" 1
1535 1 72 CYS HB2 1 79 LEU MD2 . . 4.730 4.306 3.865 4.615 . 0 0 "[ . 1 . 2]" 1
1536 1 72 CYS HB3 1 73 SER H . . 4.130 3.979 3.872 4.130 0.000 6 0 "[ . 1 . 2]" 1
1537 1 72 CYS HB3 1 79 LEU QB . . 3.840 2.454 2.174 2.724 . 0 0 "[ . 1 . 2]" 1
1538 1 72 CYS HB3 1 79 LEU MD1 . . 4.480 2.846 2.170 3.433 . 0 0 "[ . 1 . 2]" 1
1539 1 72 CYS HB3 1 79 LEU MD2 . . 4.380 3.328 2.924 3.529 . 0 0 "[ . 1 . 2]" 1
1540 1 73 SER H 1 73 SER QB . . 2.980 2.394 2.194 2.761 . 0 0 "[ . 1 . 2]" 1
1541 1 73 SER H 1 74 LYS H . . 3.550 2.606 2.409 2.885 . 0 0 "[ . 1 . 2]" 1
1542 1 73 SER H 1 74 LYS QB . . 4.780 4.380 4.019 4.778 . 0 0 "[ . 1 . 2]" 1
1543 1 73 SER HA 1 77 HIS H . . 4.930 4.592 4.216 4.923 . 0 0 "[ . 1 . 2]" 1
1544 1 73 SER QB 1 74 LYS H . . 3.340 2.331 2.057 2.888 . 0 0 "[ . 1 . 2]" 1
1545 1 73 SER QB 1 74 LYS QB . . 4.740 4.306 3.727 4.753 0.013 14 0 "[ . 1 . 2]" 1
1546 1 73 SER QB 1 74 LYS QD . . 5.260 5.134 4.812 5.272 0.012 9 0 "[ . 1 . 2]" 1
1547 1 73 SER QB 1 74 LYS QG . . 4.450 3.787 3.120 4.485 0.035 12 0 "[ . 1 . 2]" 1
1548 1 74 LYS H 1 74 LYS QB . . 2.850 2.434 2.207 2.760 . 0 0 "[ . 1 . 2]" 1
1549 1 74 LYS H 1 74 LYS QD . . 4.320 3.795 3.309 4.170 . 0 0 "[ . 1 . 2]" 1
1550 1 74 LYS H 1 74 LYS QE . . 5.020 4.584 3.302 5.036 0.016 12 0 "[ . 1 . 2]" 1
1551 1 74 LYS H 1 74 LYS HG2 . . 4.240 3.270 2.629 3.961 . 0 0 "[ . 1 . 2]" 1
1552 1 74 LYS H 1 74 LYS QG . . 3.630 2.380 1.854 2.874 . 0 0 "[ . 1 . 2]" 1
1553 1 74 LYS H 1 74 LYS HG3 . . 4.240 2.670 1.886 4.140 . 0 0 "[ . 1 . 2]" 1
1554 1 74 LYS H 1 75 THR MG . . 5.040 4.672 3.979 4.983 . 0 0 "[ . 1 . 2]" 1
1555 1 74 LYS HA 1 74 LYS QD . . 4.410 4.082 3.757 4.439 0.029 8 0 "[ . 1 . 2]" 1
1556 1 74 LYS HA 1 74 LYS QE . . 5.340 4.421 3.852 5.337 . 0 0 "[ . 1 . 2]" 1
1557 1 74 LYS HA 1 74 LYS HG2 . . 3.770 2.780 2.369 3.752 . 0 0 "[ . 1 . 2]" 1
1558 1 74 LYS HA 1 74 LYS QG . . 3.280 2.558 2.252 3.334 0.054 6 0 "[ . 1 . 2]" 1
1559 1 74 LYS HA 1 74 LYS HG3 . . 3.770 3.104 2.450 3.770 . 0 0 "[ . 1 . 2]" 1
1560 1 74 LYS QB 1 75 THR H . . 3.470 2.440 1.896 3.470 . 0 0 "[ . 1 . 2]" 1
1561 1 74 LYS QB 1 75 THR MG . . 3.610 2.890 2.518 3.624 0.014 6 0 "[ . 1 . 2]" 1
1562 1 74 LYS QD 1 74 LYS QG . . 2.440 2.025 1.989 2.078 . 0 0 "[ . 1 . 2]" 1
1563 1 74 LYS QD 1 75 THR MG . . 4.720 4.119 2.795 4.719 . 0 0 "[ . 1 . 2]" 1
1564 1 74 LYS QE 1 74 LYS QG . . 3.250 2.286 2.080 2.616 . 0 0 "[ . 1 . 2]" 1
1565 1 74 LYS QE 1 75 THR MG . . 4.750 3.841 2.170 4.771 0.021 17 0 "[ . 1 . 2]" 1
1566 1 74 LYS QG 1 75 THR H . . 4.750 3.622 2.049 4.286 . 0 0 "[ . 1 . 2]" 1
1567 1 74 LYS QG 1 75 THR MG . . 5.290 3.991 1.754 4.851 . 0 0 "[ . 1 . 2]" 1
1568 1 75 THR H 1 75 THR HB . . 3.950 3.634 3.411 3.717 . 0 0 "[ . 1 . 2]" 1
1569 1 75 THR H 1 75 THR MG . . 3.450 2.226 1.844 2.642 . 0 0 "[ . 1 . 2]" 1
1570 1 75 THR HA 1 75 THR MG . . 3.050 2.473 2.330 3.111 0.061 6 0 "[ . 1 . 2]" 1
1571 1 75 THR MG 1 76 GLY H . . 4.430 3.685 2.126 4.023 . 0 0 "[ . 1 . 2]" 1
1572 1 75 THR MG 1 77 HIS H . . 4.800 4.372 2.507 4.734 . 0 0 "[ . 1 . 2]" 1
1573 1 77 HIS H 1 77 HIS HB2 . . 3.240 2.273 2.217 2.344 . 0 0 "[ . 1 . 2]" 1
1574 1 77 HIS H 1 77 HIS HB3 . . 3.580 3.523 3.495 3.560 . 0 0 "[ . 1 . 2]" 1
1575 1 77 HIS HA 1 78 PRO HD2 . . 3.200 2.298 2.247 2.395 . 0 0 "[ . 1 . 2]" 1
1576 1 77 HIS HA 1 78 PRO HD3 . . 2.920 2.268 2.257 2.296 . 0 0 "[ . 1 . 2]" 1
1577 1 77 HIS HA 1 78 PRO QG . . 4.410 3.939 3.910 3.998 . 0 0 "[ . 1 . 2]" 1
1578 1 77 HIS HB2 1 78 PRO HD2 . . 4.500 3.932 3.786 4.012 . 0 0 "[ . 1 . 2]" 1
1579 1 77 HIS HB3 1 78 PRO HD2 . . 3.930 2.493 2.293 2.610 . 0 0 "[ . 1 . 2]" 1
1580 1 77 HIS HB3 1 78 PRO HD3 . . 4.140 3.853 3.691 3.947 . 0 0 "[ . 1 . 2]" 1
1581 1 78 PRO HA 1 79 LEU H . . 3.020 2.181 2.151 2.236 . 0 0 "[ . 1 . 2]" 1
1582 1 78 PRO HA 1 79 LEU HB2 . . 4.820 4.378 4.303 4.482 . 0 0 "[ . 1 . 2]" 1
1583 1 78 PRO HA 1 79 LEU QB . . 4.180 4.023 3.959 4.077 . 0 0 "[ . 1 . 2]" 1
1584 1 78 PRO HA 1 79 LEU HB3 . . 4.820 4.691 4.622 4.746 . 0 0 "[ . 1 . 2]" 1
1585 1 78 PRO HA 1 79 LEU MD1 . . 5.500 5.489 5.440 5.514 0.014 11 0 "[ . 1 . 2]" 1
1586 1 78 PRO QB 1 79 LEU H . . 3.750 3.178 2.950 3.419 . 0 0 "[ . 1 . 2]" 1
1587 1 78 PRO HB2 1 79 LEU H . . 4.290 3.370 3.094 3.665 . 0 0 "[ . 1 . 2]" 1
1588 1 78 PRO HB3 1 79 LEU H . . 4.290 3.896 3.721 4.092 . 0 0 "[ . 1 . 2]" 1
1589 1 79 LEU H 1 79 LEU HB2 . . 3.640 2.779 2.619 3.076 . 0 0 "[ . 1 . 2]" 1
1590 1 79 LEU H 1 79 LEU HB3 . . 3.640 2.622 2.550 2.786 . 0 0 "[ . 1 . 2]" 1
1591 1 79 LEU H 1 79 LEU MD1 . . 4.950 4.215 4.067 4.398 . 0 0 "[ . 1 . 2]" 1
1592 1 79 LEU H 1 79 LEU MD2 . . 4.670 4.372 4.288 4.520 . 0 0 "[ . 1 . 2]" 1
1593 1 79 LEU H 1 80 GLN H . . 5.070 4.514 4.346 4.574 . 0 0 "[ . 1 . 2]" 1
1594 1 79 LEU HA 1 80 GLN H . . 3.150 2.242 2.185 2.324 . 0 0 "[ . 1 . 2]" 1
1595 1 79 LEU QB 1 79 LEU MD1 . . 2.990 2.210 2.049 2.300 . 0 0 "[ . 1 . 2]" 1
1596 1 79 LEU QB 1 80 GLN H . . 3.980 3.519 3.364 3.638 . 0 0 "[ . 1 . 2]" 1
1597 1 79 LEU HB2 1 79 LEU MD2 . . 3.200 2.510 2.362 2.624 . 0 0 "[ . 1 . 2]" 1
1598 1 79 LEU HB2 1 80 GLN H . . 4.710 4.096 3.980 4.195 . 0 0 "[ . 1 . 2]" 1
1599 1 79 LEU HB3 1 79 LEU MD2 . . 3.200 2.192 2.107 2.344 . 0 0 "[ . 1 . 2]" 1
1600 1 79 LEU HB3 1 80 GLN H . . 4.710 3.836 3.628 3.990 . 0 0 "[ . 1 . 2]" 1
1601 1 79 LEU MD1 1 80 GLN H . . 3.530 2.675 2.373 2.886 . 0 0 "[ . 1 . 2]" 1
1602 1 79 LEU MD1 1 80 GLN HB2 . . 4.770 4.528 4.205 4.770 . 0 0 "[ . 1 . 2]" 1
1603 1 79 LEU MD1 1 80 GLN QG . . 5.310 4.533 4.129 4.827 . 0 0 "[ . 1 . 2]" 1
1604 1 79 LEU MD2 1 80 GLN H . . 4.680 4.041 3.758 4.226 . 0 0 "[ . 1 . 2]" 1
1605 1 79 LEU HG 1 80 GLN HB2 . . 4.840 4.552 4.273 4.792 . 0 0 "[ . 1 . 2]" 1
1606 1 80 GLN H 1 80 GLN HB2 . . 3.520 2.546 2.471 2.665 . 0 0 "[ . 1 . 2]" 1
1607 1 80 GLN H 1 80 GLN HB3 . . 3.890 3.706 3.663 3.764 . 0 0 "[ . 1 . 2]" 1
1608 1 80 GLN H 1 80 GLN HG2 . . 4.380 2.754 2.563 3.073 . 0 0 "[ . 1 . 2]" 1
1609 1 80 GLN H 1 80 GLN QG . . 3.680 2.708 2.526 3.010 . 0 0 "[ . 1 . 2]" 1
1610 1 80 GLN H 1 80 GLN HG3 . . 4.380 4.013 3.829 4.298 . 0 0 "[ . 1 . 2]" 1
1611 1 80 GLN HA 1 80 GLN HE21 . . 5.010 3.494 2.045 4.774 . 0 0 "[ . 1 . 2]" 1
1612 1 80 GLN HA 1 80 GLN QE . . 4.310 3.193 2.014 4.178 . 0 0 "[ . 1 . 2]" 1
1613 1 80 GLN HA 1 80 GLN HE22 . . 5.010 3.778 3.022 4.614 . 0 0 "[ . 1 . 2]" 1
1614 1 80 GLN HA 1 81 PRO HD2 . . 3.010 2.089 2.031 2.141 . 0 0 "[ . 1 . 2]" 1
1615 1 80 GLN HA 1 81 PRO HD3 . . 2.990 2.264 2.253 2.284 . 0 0 "[ . 1 . 2]" 1
1616 1 80 GLN HA 1 81 PRO QG . . 4.650 3.827 3.801 3.853 . 0 0 "[ . 1 . 2]" 1
1617 1 80 GLN HB2 1 81 PRO HD2 . . 4.400 4.120 3.979 4.262 . 0 0 "[ . 1 . 2]" 1
1618 1 80 GLN HB3 1 81 PRO HD2 . . 3.950 2.759 2.605 2.956 . 0 0 "[ . 1 . 2]" 1
1619 1 80 GLN HB3 1 81 PRO HD3 . . 4.320 4.077 3.956 4.226 . 0 0 "[ . 1 . 2]" 1
1620 1 81 PRO HA 1 82 PRO QD . . 2.750 2.055 2.013 2.184 . 0 0 "[ . 1 . 2]" 1
1621 1 81 PRO QB 1 82 PRO QD . . 3.060 2.368 1.970 2.501 . 0 0 "[ . 1 . 2]" 1
1622 1 81 PRO HB2 1 82 PRO HD2 . . 4.140 2.546 2.045 2.720 . 0 0 "[ . 1 . 2]" 1
1623 1 81 PRO HB2 1 82 PRO HD3 . . 4.140 3.897 3.489 4.034 . 0 0 "[ . 1 . 2]" 1
1624 1 81 PRO HB3 1 82 PRO HD2 . . 4.140 2.973 2.709 3.072 . 0 0 "[ . 1 . 2]" 1
1625 1 81 PRO HB3 1 82 PRO HD3 . . 4.140 4.041 3.754 4.141 0.001 5 0 "[ . 1 . 2]" 1
1626 1 82 PRO HA 1 83 LEU H . . 3.150 2.541 2.324 2.692 . 0 0 "[ . 1 . 2]" 1
1627 1 82 PRO QB 1 83 LEU H . . 3.760 2.248 1.945 2.717 . 0 0 "[ . 1 . 2]" 1
1628 1 82 PRO QB 1 83 LEU QD . . 4.540 3.941 3.356 4.559 0.019 17 0 "[ . 1 . 2]" 1
1629 1 82 PRO HB2 1 83 LEU H . . 4.470 2.291 1.963 2.818 . 0 0 "[ . 1 . 2]" 1
1630 1 82 PRO HB3 1 83 LEU H . . 4.470 3.306 3.168 3.563 . 0 0 "[ . 1 . 2]" 1
1631 1 82 PRO QD 1 83 LEU H . . 4.960 4.858 4.743 4.985 0.025 16 0 "[ . 1 . 2]" 1
1632 1 82 PRO QG 1 83 LEU H . . 4.830 3.923 3.655 4.300 . 0 0 "[ . 1 . 2]" 1
1633 1 83 LEU H 1 83 LEU HB2 . . 3.610 2.236 2.168 2.472 . 0 0 "[ . 1 . 2]" 1
1634 1 83 LEU H 1 83 LEU HB3 . . 3.610 3.520 3.466 3.609 . 0 0 "[ . 1 . 2]" 1
1635 1 83 LEU H 1 83 LEU QD . . 4.380 2.457 1.932 3.413 . 0 0 "[ . 1 . 2]" 1
1636 1 83 LEU H 1 83 LEU HG . . 4.140 3.532 2.528 3.994 . 0 0 "[ . 1 . 2]" 1
1637 1 83 LEU H 1 84 SER H . . 4.860 4.608 4.501 4.642 . 0 0 "[ . 1 . 2]" 1
1638 1 83 LEU HA 1 83 LEU MD1 . . 3.700 2.862 1.974 3.859 0.159 17 0 "[ . 1 . 2]" 1
1639 1 83 LEU HA 1 83 LEU MD2 . . 3.700 2.710 1.921 3.724 0.024 16 0 "[ . 1 . 2]" 1
1640 1 83 LEU HA 1 83 LEU HG . . 3.930 3.036 2.302 3.704 . 0 0 "[ . 1 . 2]" 1
1641 1 83 LEU HA 1 84 SER H . . 3.210 2.431 2.180 2.612 . 0 0 "[ . 1 . 2]" 1
1642 1 83 LEU HA 1 84 SER HB2 . . 4.820 4.634 4.336 4.815 . 0 0 "[ . 1 . 2]" 1
1643 1 83 LEU QB 1 83 LEU QD . . 2.860 1.938 1.776 2.066 . 0 0 "[ . 1 . 2]" 1
1644 1 83 LEU QB 1 84 SER H . . 3.830 2.390 2.018 3.109 . 0 0 "[ . 1 . 2]" 1
1645 1 83 LEU QB 1 87 GLU HA . . 5.340 5.133 4.796 5.354 0.014 17 0 "[ . 1 . 2]" 1
1646 1 83 LEU QB 1 87 GLU QB . . 3.900 2.462 1.982 2.898 . 0 0 "[ . 1 . 2]" 1
1647 1 83 LEU HB2 1 84 SER H . . 4.670 3.788 3.283 4.298 . 0 0 "[ . 1 . 2]" 1
1648 1 83 LEU HB2 1 87 GLU QB . . 4.580 3.566 3.002 4.492 . 0 0 "[ . 1 . 2]" 1
1649 1 83 LEU HB3 1 84 SER H . . 4.670 2.418 2.030 3.190 . 0 0 "[ . 1 . 2]" 1
1650 1 83 LEU HB3 1 87 GLU QB . . 4.580 2.537 1.997 3.304 . 0 0 "[ . 1 . 2]" 1
1651 1 83 LEU QD 1 84 SER H . . 4.030 2.863 2.260 4.008 . 0 0 "[ . 1 . 2]" 1
1652 1 83 LEU QD 1 87 GLU QB . . 3.750 2.740 1.959 3.656 . 0 0 "[ . 1 . 2]" 1
1653 1 83 LEU MD1 1 84 SER H . . 4.630 3.619 2.301 4.632 0.002 10 0 "[ . 1 . 2]" 1
1654 1 83 LEU MD1 1 87 GLU QB . . 4.820 3.371 1.977 4.509 . 0 0 "[ . 1 . 2]" 1
1655 1 83 LEU MD1 1 87 GLU QG . . 4.730 3.355 2.038 4.739 0.009 16 0 "[ . 1 . 2]" 1
1656 1 83 LEU MD2 1 84 SER H . . 4.630 3.619 2.269 4.509 . 0 0 "[ . 1 . 2]" 1
1657 1 83 LEU MD2 1 87 GLU QB . . 4.820 3.509 2.061 4.784 . 0 0 "[ . 1 . 2]" 1
1658 1 83 LEU MD2 1 87 GLU QG . . 4.730 3.428 1.831 4.730 . 0 0 "[ . 1 . 2]" 1
1659 1 83 LEU HG 1 84 SER H . . 4.670 4.269 3.526 4.627 . 0 0 "[ . 1 . 2]" 1
1660 1 84 SER H 1 84 SER HB2 . . 3.790 2.251 2.184 2.466 . 0 0 "[ . 1 . 2]" 1
1661 1 84 SER H 1 84 SER HB3 . . 4.030 3.531 3.493 3.598 . 0 0 "[ . 1 . 2]" 1
1662 1 84 SER H 1 87 GLU QB . . 4.300 3.539 2.404 4.219 . 0 0 "[ . 1 . 2]" 1
1663 1 84 SER H 1 87 GLU QG . . 5.060 2.817 2.228 3.525 . 0 0 "[ . 1 . 2]" 1
1664 1 84 SER HA 1 85 PRO HD2 . . 3.170 2.463 2.316 2.525 . 0 0 "[ . 1 . 2]" 1
1665 1 84 SER HA 1 85 PRO HD3 . . 3.750 2.325 2.270 2.354 . 0 0 "[ . 1 . 2]" 1
1666 1 84 SER HA 1 86 LEU H . . 4.430 3.883 3.790 3.934 . 0 0 "[ . 1 . 2]" 1
1667 1 84 SER HB2 1 85 PRO HD2 . . 3.900 3.642 3.574 3.880 . 0 0 "[ . 1 . 2]" 1
1668 1 84 SER HB2 1 86 LEU QB . . 4.920 4.540 4.028 4.920 0.000 1 0 "[ . 1 . 2]" 1
1669 1 84 SER HB2 1 86 LEU QD . . 5.420 2.849 2.301 3.347 . 0 0 "[ . 1 . 2]" 1
1670 1 84 SER HB2 1 87 GLU QB . . 4.890 3.838 2.278 4.637 . 0 0 "[ . 1 . 2]" 1
1671 1 84 SER HB2 1 87 GLU QG . . 4.890 2.596 1.975 3.561 . 0 0 "[ . 1 . 2]" 1
1672 1 84 SER HB3 1 85 PRO HD2 . . 3.900 2.061 1.996 2.385 . 0 0 "[ . 1 . 2]" 1
1673 1 84 SER HB3 1 86 LEU QB . . 4.620 3.698 3.163 4.228 . 0 0 "[ . 1 . 2]" 1
1674 1 85 PRO HA 1 86 LEU H . . 3.380 3.321 3.289 3.365 . 0 0 "[ . 1 . 2]" 1
1675 1 85 PRO HA 1 88 LEU QB . . 5.080 4.339 3.458 4.893 . 0 0 "[ . 1 . 2]" 1
1676 1 85 PRO HA 1 88 LEU QD . . 3.890 2.008 1.846 2.319 . 0 0 "[ . 1 . 2]" 1
1677 1 85 PRO HA 1 88 LEU HG . . 5.320 3.743 2.276 4.909 . 0 0 "[ . 1 . 2]" 1
1678 1 85 PRO QB 1 86 LEU H . . 3.850 3.688 3.623 3.732 . 0 0 "[ . 1 . 2]" 1
1679 1 85 PRO QB 1 88 LEU QD . . 4.350 3.242 2.761 3.498 . 0 0 "[ . 1 . 2]" 1
1680 1 85 PRO HD2 1 86 LEU H . . 4.760 2.979 2.884 3.049 . 0 0 "[ . 1 . 2]" 1
1681 1 85 PRO HD2 1 86 LEU QB . . 4.930 4.388 4.032 4.803 . 0 0 "[ . 1 . 2]" 1
1682 1 85 PRO HD2 1 86 LEU QD . . 5.440 3.268 1.966 4.030 . 0 0 "[ . 1 . 2]" 1
1683 1 85 PRO HD2 1 86 LEU HG . . 5.500 4.206 3.708 5.119 . 0 0 "[ . 1 . 2]" 1
1684 1 85 PRO HD2 1 88 LEU QD . . 5.440 5.047 4.743 5.417 . 0 0 "[ . 1 . 2]" 1
1685 1 85 PRO HD3 1 88 LEU QD . . 5.440 4.649 4.092 5.130 . 0 0 "[ . 1 . 2]" 1
1686 1 85 PRO QG 1 86 LEU QD . . 4.850 3.508 1.967 4.491 . 0 0 "[ . 1 . 2]" 1
1687 1 85 PRO QG 1 88 LEU QD . . 4.610 4.461 4.239 4.612 0.002 6 0 "[ . 1 . 2]" 1
1688 1 86 LEU H 1 86 LEU QB . . 3.260 2.723 2.386 3.072 . 0 0 "[ . 1 . 2]" 1
1689 1 86 LEU H 1 86 LEU MD1 . . 4.800 3.632 2.098 4.178 . 0 0 "[ . 1 . 2]" 1
1690 1 86 LEU H 1 86 LEU QD . . 4.170 2.717 1.934 3.149 . 0 0 "[ . 1 . 2]" 1
1691 1 86 LEU H 1 86 LEU MD2 . . 4.800 2.961 1.939 4.029 . 0 0 "[ . 1 . 2]" 1
1692 1 86 LEU H 1 87 GLU H . . 3.800 2.138 1.862 2.365 . 0 0 "[ . 1 . 2]" 1
1693 1 86 LEU H 1 87 GLU QG . . 5.130 3.778 3.366 4.149 . 0 0 "[ . 1 . 2]" 1
1694 1 86 LEU H 1 88 LEU QD . . 5.290 3.823 2.989 4.563 . 0 0 "[ . 1 . 2]" 1
1695 1 86 LEU HA 1 86 LEU MD1 . . 4.290 3.684 3.432 4.123 . 0 0 "[ . 1 . 2]" 1
1696 1 86 LEU HA 1 86 LEU QD . . 3.590 3.319 3.249 3.386 . 0 0 "[ . 1 . 2]" 1
1697 1 86 LEU HA 1 86 LEU MD2 . . 4.290 3.904 3.401 4.125 . 0 0 "[ . 1 . 2]" 1
1698 1 86 LEU HA 1 86 LEU HG . . 4.090 3.648 2.854 3.731 . 0 0 "[ . 1 . 2]" 1
1699 1 86 LEU HA 1 87 GLU QG . . 5.500 5.190 4.827 5.506 0.006 19 0 "[ . 1 . 2]" 1
1700 1 86 LEU HA 1 89 MET HB2 . . 4.910 3.646 2.388 4.906 . 0 0 "[ . 1 . 2]" 1
1701 1 86 LEU HA 1 89 MET QB . . 4.320 3.299 2.349 4.144 . 0 0 "[ . 1 . 2]" 1
1702 1 86 LEU HA 1 89 MET HB3 . . 4.910 4.211 2.799 4.912 0.002 19 0 "[ . 1 . 2]" 1
1703 1 86 LEU HA 1 89 MET ME . . 4.540 2.832 1.993 3.711 . 0 0 "[ . 1 . 2]" 1
1704 1 86 LEU QB 1 87 GLU H . . 3.930 3.518 2.878 3.815 . 0 0 "[ . 1 . 2]" 1
1705 1 86 LEU QB 1 87 GLU QG . . 4.350 4.285 3.760 4.354 0.004 6 0 "[ . 1 . 2]" 1
1706 1 86 LEU QB 1 89 MET ME . . 5.080 3.132 2.402 3.743 . 0 0 "[ . 1 . 2]" 1
1707 1 86 LEU QD 1 87 GLU H . . 5.170 2.935 2.554 3.339 . 0 0 "[ . 1 . 2]" 1
1708 1 86 LEU QD 1 87 GLU HA . . 4.610 3.063 2.327 4.561 . 0 0 "[ . 1 . 2]" 1
1709 1 86 LEU QD 1 87 GLU QB . . 4.390 3.833 3.497 4.400 0.010 19 0 "[ . 1 . 2]" 1
1710 1 86 LEU QD 1 87 GLU QG . . 4.140 2.503 1.938 3.581 . 0 0 "[ . 1 . 2]" 1
1711 1 86 LEU QD 1 89 MET ME . . 4.380 3.984 3.076 4.368 . 0 0 "[ . 1 . 2]" 1
1712 1 86 LEU MD1 1 87 GLU QG . . 5.500 2.588 1.943 3.630 . 0 0 "[ . 1 . 2]" 1
1713 1 86 LEU MD2 1 87 GLU QG . . 5.500 3.817 2.646 5.475 . 0 0 "[ . 1 . 2]" 1
1714 1 86 LEU HG 1 87 GLU H . . 4.750 2.497 1.999 4.380 . 0 0 "[ . 1 . 2]" 1
1715 1 87 GLU H 1 87 GLU QB . . 3.450 2.404 2.230 2.534 . 0 0 "[ . 1 . 2]" 1
1716 1 87 GLU H 1 87 GLU QG . . 3.800 2.386 2.003 2.906 . 0 0 "[ . 1 . 2]" 1
1717 1 87 GLU HA 1 87 GLU QG . . 3.360 2.615 2.333 2.793 . 0 0 "[ . 1 . 2]" 1
1718 1 87 GLU QB 1 88 LEU H . . 3.950 2.624 2.127 3.239 . 0 0 "[ . 1 . 2]" 1
1719 1 87 GLU QB 1 88 LEU HA . . 4.580 3.927 3.738 4.279 . 0 0 "[ . 1 . 2]" 1
1720 1 87 GLU QB 1 88 LEU QB . . 4.830 3.968 3.518 4.628 . 0 0 "[ . 1 . 2]" 1
1721 1 87 GLU QG 1 88 LEU H . . 5.500 4.101 3.774 4.480 . 0 0 "[ . 1 . 2]" 1
1722 1 88 LEU H 1 88 LEU QB . . 3.350 2.557 2.244 2.934 . 0 0 "[ . 1 . 2]" 1
1723 1 88 LEU H 1 88 LEU MD1 . . 5.010 3.521 1.869 4.195 . 0 0 "[ . 1 . 2]" 1
1724 1 88 LEU H 1 88 LEU QD . . 4.070 2.385 1.823 3.046 . 0 0 "[ . 1 . 2]" 1
1725 1 88 LEU H 1 88 LEU MD2 . . 5.010 2.784 1.826 3.903 . 0 0 "[ . 1 . 2]" 1
1726 1 88 LEU H 1 88 LEU HG . . 3.690 2.659 1.897 3.575 . 0 0 "[ . 1 . 2]" 1
1727 1 88 LEU HA 1 88 LEU MD1 . . 4.700 3.775 3.478 4.073 . 0 0 "[ . 1 . 2]" 1
1728 1 88 LEU HA 1 88 LEU QD . . 4.050 3.299 2.339 3.420 . 0 0 "[ . 1 . 2]" 1
1729 1 88 LEU HA 1 88 LEU MD2 . . 4.700 3.742 2.356 4.102 . 0 0 "[ . 1 . 2]" 1
1730 1 88 LEU HA 1 88 LEU HG . . 3.940 3.469 2.595 3.704 . 0 0 "[ . 1 . 2]" 1
1731 1 88 LEU QB 1 89 MET H . . 4.470 3.461 2.112 4.042 . 0 0 "[ . 1 . 2]" 1
1732 1 88 LEU QD 1 89 MET H . . 4.780 3.169 2.091 4.150 . 0 0 "[ . 1 . 2]" 1
1733 1 88 LEU MD1 1 89 MET H . . 5.500 3.819 2.103 5.248 . 0 0 "[ . 1 . 2]" 1
1734 1 88 LEU MD2 1 89 MET H . . 5.500 3.996 2.100 5.266 . 0 0 "[ . 1 . 2]" 1
1735 1 88 LEU HG 1 89 MET H . . 4.620 3.394 1.972 4.617 . 0 0 "[ . 1 . 2]" 1
1736 1 89 MET H 1 89 MET HB2 . . 4.080 2.708 2.226 3.605 . 0 0 "[ . 1 . 2]" 1
1737 1 89 MET H 1 89 MET QB . . 3.440 2.372 2.171 3.113 . 0 0 "[ . 1 . 2]" 1
1738 1 89 MET H 1 89 MET HB3 . . 4.080 2.983 2.243 3.985 . 0 0 "[ . 1 . 2]" 1
1739 1 89 MET H 1 89 MET HG2 . . 4.780 3.848 1.906 4.664 . 0 0 "[ . 1 . 2]" 1
1740 1 89 MET H 1 89 MET QG . . 4.080 3.206 1.859 4.039 . 0 0 "[ . 1 . 2]" 1
1741 1 89 MET H 1 89 MET HG3 . . 4.780 3.659 1.925 4.555 . 0 0 "[ . 1 . 2]" 1
1742 1 89 MET HA 1 89 MET ME . . 4.680 4.270 3.636 4.671 . 0 0 "[ . 1 . 2]" 1
1743 1 89 MET HA 1 89 MET QG . . 3.730 2.603 2.219 3.435 . 0 0 "[ . 1 . 2]" 1
1744 1 89 MET QB 1 90 GLU H . . 4.150 3.174 2.333 4.016 . 0 0 "[ . 1 . 2]" 1
1745 1 90 GLU H 1 90 GLU QB . . 3.500 2.565 2.154 3.134 . 0 0 "[ . 1 . 2]" 1
1746 1 90 GLU H 1 90 GLU HG2 . . 5.040 4.030 1.900 4.899 . 0 0 "[ . 1 . 2]" 1
1747 1 90 GLU H 1 90 GLU QG . . 4.390 3.641 1.891 4.251 . 0 0 "[ . 1 . 2]" 1
1748 1 90 GLU H 1 90 GLU HG3 . . 5.040 4.349 3.074 4.932 . 0 0 "[ . 1 . 2]" 1
1749 1 90 GLU HA 1 90 GLU HG2 . . 4.230 3.174 2.260 3.789 . 0 0 "[ . 1 . 2]" 1
1750 1 90 GLU HA 1 90 GLU QG . . 3.450 2.677 2.169 3.439 . 0 0 "[ . 1 . 2]" 1
1751 1 90 GLU HA 1 90 GLU HG3 . . 4.230 3.115 2.215 4.229 . 0 0 "[ . 1 . 2]" 1
1752 1 90 GLU QB 1 91 ALA H . . 4.120 3.110 2.103 4.043 . 0 0 "[ . 1 . 2]" 1
1753 1 90 GLU HB2 1 91 ALA H . . 4.870 3.735 2.117 4.605 . 0 0 "[ . 1 . 2]" 1
1754 1 90 GLU HB3 1 91 ALA H . . 4.870 3.630 2.273 4.588 . 0 0 "[ . 1 . 2]" 1
1755 1 90 GLU QG 1 91 ALA HA . . 5.340 4.363 3.619 5.292 . 0 0 "[ . 1 . 2]" 1
1756 1 91 ALA H 1 91 ALA MB . . 3.620 2.372 2.054 2.888 . 0 0 "[ . 1 . 2]" 1
1757 1 91 ALA MB 1 92 SER H . . 4.980 2.929 2.301 3.694 . 0 0 "[ . 1 . 2]" 1
1758 1 96 GLY QA 1 97 CYS H . . 3.050 2.290 2.109 2.629 . 0 0 "[ . 1 . 2]" 1
1759 1 99 THR HA 1 100 PRO QD . . 3.430 1.994 1.881 2.440 . 0 0 "[ . 1 . 2]" 1
1760 1 99 THR HB 1 100 PRO QD . . 4.060 3.259 2.007 4.127 0.067 12 0 "[ . 1 . 2]" 1
1761 1 99 THR MG 1 100 PRO QD . . 4.590 3.141 1.800 3.974 . 0 0 "[ . 1 . 2]" 1
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