NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
573442 |
2mhe   |
19628 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mhe
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 2558
_Distance_constraint_stats_list.Viol_count 4063
_Distance_constraint_stats_list.Viol_total 7390.920
_Distance_constraint_stats_list.Viol_max 0.754
_Distance_constraint_stats_list.Viol_rms 0.0351
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0072
_Distance_constraint_stats_list.Viol_average_violations_only 0.0910
_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 2 PRO 0.352 0.092 5 0 "[ . 1 . 2]"
1 3 ASP 3.180 0.276 8 0 "[ . 1 . 2]"
1 4 LYS 4.107 0.276 8 0 "[ . 1 . 2]"
1 5 GLN 4.301 0.187 2 0 "[ . 1 . 2]"
1 6 LEU 5.120 0.271 2 0 "[ . 1 . 2]"
1 7 LEU 2.766 0.148 13 0 "[ . 1 . 2]"
1 8 HIS 8.868 0.362 19 0 "[ . 1 . 2]"
1 9 ILE 7.687 0.290 1 0 "[ . 1 . 2]"
1 10 VAL 9.354 0.290 1 0 "[ . 1 . 2]"
1 11 VAL 5.359 0.258 16 0 "[ . 1 . 2]"
1 12 GLY 2.621 0.253 14 0 "[ . 1 . 2]"
1 13 GLY 2.224 0.191 13 0 "[ . 1 . 2]"
1 14 GLU 6.764 0.264 9 0 "[ . 1 . 2]"
1 15 LEU 13.427 0.382 18 0 "[ . 1 . 2]"
1 16 LYS 7.324 0.296 1 0 "[ . 1 . 2]"
1 17 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 VAL 3.276 0.240 20 0 "[ . 1 . 2]"
1 19 ALA 1.237 0.240 20 0 "[ . 1 . 2]"
1 20 GLY 2.041 0.219 14 0 "[ . 1 . 2]"
1 21 VAL 4.062 0.295 17 0 "[ . 1 . 2]"
1 22 GLU 4.290 0.223 13 0 "[ . 1 . 2]"
1 23 PHE 9.681 0.382 18 0 "[ . 1 . 2]"
1 24 ARG 4.293 0.293 15 0 "[ . 1 . 2]"
1 25 ASP 3.210 0.190 7 0 "[ . 1 . 2]"
1 26 LEU 18.001 0.754 16 15 "[ ** .*-*** * **+****]"
1 27 SER 0.177 0.120 8 0 "[ . 1 . 2]"
1 28 LYS 3.673 0.607 2 1 "[ + . 1 . 2]"
1 29 VAL 1.374 0.124 18 0 "[ . 1 . 2]"
1 30 GLU 2.499 0.160 20 0 "[ . 1 . 2]"
1 31 PHE 1.685 0.160 20 0 "[ . 1 . 2]"
1 32 VAL 3.208 0.253 14 0 "[ . 1 . 2]"
1 33 GLY 0.110 0.052 7 0 "[ . 1 . 2]"
1 34 ALA 8.411 0.245 10 0 "[ . 1 . 2]"
1 35 TYR 1.885 0.148 13 0 "[ . 1 . 2]"
1 36 PRO 0.101 0.075 7 0 "[ . 1 . 2]"
1 37 SER 3.036 0.218 14 0 "[ . 1 . 2]"
1 38 TYR 2.685 0.196 8 0 "[ . 1 . 2]"
1 39 ASP 0.290 0.063 2 0 "[ . 1 . 2]"
1 40 GLU 1.912 0.191 19 0 "[ . 1 . 2]"
1 41 ALA 10.826 0.362 19 0 "[ . 1 . 2]"
1 42 HIS 3.563 0.223 11 0 "[ . 1 . 2]"
1 43 LYS 7.690 0.341 4 0 "[ . 1 . 2]"
1 44 ALA 1.769 0.149 11 0 "[ . 1 . 2]"
1 45 TRP 17.444 0.445 12 0 "[ . 1 . 2]"
1 46 LYS 12.998 0.445 12 0 "[ . 1 . 2]"
1 47 ALA 1.343 0.096 5 0 "[ . 1 . 2]"
1 48 LYS 12.623 0.248 15 0 "[ . 1 . 2]"
1 49 ALA 3.253 0.149 18 0 "[ . 1 . 2]"
1 50 GLN 1.373 0.101 10 0 "[ . 1 . 2]"
1 51 ALA 3.688 0.148 13 0 "[ . 1 . 2]"
1 52 THR 2.010 0.164 9 0 "[ . 1 . 2]"
1 53 VAL 2.424 0.179 11 0 "[ . 1 . 2]"
1 54 ASP 1.323 0.150 16 0 "[ . 1 . 2]"
1 55 ASN 4.324 0.450 8 0 "[ . 1 . 2]"
1 56 ALA 1.626 0.450 8 0 "[ . 1 . 2]"
1 57 HIS 2.675 0.244 8 0 "[ . 1 . 2]"
1 58 ALA 10.267 0.310 20 0 "[ . 1 . 2]"
1 59 ARG 7.821 0.271 12 0 "[ . 1 . 2]"
1 60 TYR 5.721 0.204 20 0 "[ . 1 . 2]"
1 61 PHE 1.978 0.150 20 0 "[ . 1 . 2]"
1 62 ILE 10.082 0.432 9 0 "[ . 1 . 2]"
1 63 ILE 3.761 0.195 4 0 "[ . 1 . 2]"
1 64 HIS 2.810 0.282 19 0 "[ . 1 . 2]"
1 65 ALA 2.120 0.342 8 0 "[ . 1 . 2]"
1 66 HIS 2.204 0.260 16 0 "[ . 1 . 2]"
1 67 LYS 2.980 0.342 8 0 "[ . 1 . 2]"
1 68 LEU 8.059 0.367 12 0 "[ . 1 . 2]"
1 69 LEU 7.919 0.296 8 0 "[ . 1 . 2]"
1 70 ASP 5.253 0.276 8 0 "[ . 1 . 2]"
1 71 PRO 4.975 0.276 8 0 "[ . 1 . 2]"
1 72 SER 0.253 0.102 9 0 "[ . 1 . 2]"
1 73 GLU 0.951 0.087 3 0 "[ . 1 . 2]"
1 74 GLY 0.627 0.085 4 0 "[ . 1 . 2]"
2 2 PRO 0.388 0.126 19 0 "[ . 1 . 2]"
2 3 ASP 2.722 0.273 3 0 "[ . 1 . 2]"
2 4 LYS 3.790 0.273 3 0 "[ . 1 . 2]"
2 5 GLN 4.933 0.326 2 0 "[ . 1 . 2]"
2 6 LEU 5.727 0.326 2 0 "[ . 1 . 2]"
2 7 LEU 3.329 0.246 8 0 "[ . 1 . 2]"
2 8 HIS 9.444 0.368 19 0 "[ . 1 . 2]"
2 9 ILE 8.097 0.248 1 0 "[ . 1 . 2]"
2 10 VAL 10.620 0.273 7 0 "[ . 1 . 2]"
2 11 VAL 5.554 0.282 5 0 "[ . 1 . 2]"
2 12 GLY 2.317 0.234 14 0 "[ . 1 . 2]"
2 13 GLY 2.166 0.171 9 0 "[ . 1 . 2]"
2 14 GLU 6.347 0.216 19 0 "[ . 1 . 2]"
2 15 LEU 12.689 0.574 5 1 "[ + 1 . 2]"
2 16 LYS 5.816 0.240 1 0 "[ . 1 . 2]"
2 17 ASP 0.141 0.141 3 0 "[ . 1 . 2]"
2 18 VAL 3.692 0.171 12 0 "[ . 1 . 2]"
2 19 ALA 1.456 0.113 18 0 "[ . 1 . 2]"
2 20 GLY 2.380 0.171 12 0 "[ . 1 . 2]"
2 21 VAL 3.950 0.296 11 0 "[ . 1 . 2]"
2 22 GLU 3.901 0.296 11 0 "[ . 1 . 2]"
2 23 PHE 9.277 0.574 5 1 "[ + 1 . 2]"
2 24 ARG 3.170 0.234 15 0 "[ . 1 . 2]"
2 25 ASP 2.617 0.227 7 0 "[ . 1 . 2]"
2 26 LEU 19.419 0.749 12 17 "[*-**.***** + *******]"
2 27 SER 0.258 0.085 12 0 "[ . 1 . 2]"
2 28 LYS 3.325 0.685 1 2 "[+- . 1 . 2]"
2 29 VAL 1.617 0.173 3 0 "[ . 1 . 2]"
2 30 GLU 2.421 0.173 3 0 "[ . 1 . 2]"
2 31 PHE 1.192 0.114 5 0 "[ . 1 . 2]"
2 32 VAL 3.785 0.234 14 0 "[ . 1 . 2]"
2 33 GLY 0.297 0.083 6 0 "[ . 1 . 2]"
2 34 ALA 9.616 0.273 7 0 "[ . 1 . 2]"
2 35 TYR 2.147 0.241 8 0 "[ . 1 . 2]"
2 36 PRO 0.572 0.350 5 0 "[ . 1 . 2]"
2 37 SER 3.574 0.350 5 0 "[ . 1 . 2]"
2 38 TYR 3.704 0.296 8 0 "[ . 1 . 2]"
2 39 ASP 0.835 0.199 9 0 "[ . 1 . 2]"
2 40 GLU 1.870 0.180 19 0 "[ . 1 . 2]"
2 41 ALA 10.485 0.368 19 0 "[ . 1 . 2]"
2 42 HIS 3.797 0.226 19 0 "[ . 1 . 2]"
2 43 LYS 7.882 0.339 11 0 "[ . 1 . 2]"
2 44 ALA 1.835 0.145 16 0 "[ . 1 . 2]"
2 45 TRP 18.509 0.447 4 0 "[ . 1 . 2]"
2 46 LYS 14.124 0.447 4 0 "[ . 1 . 2]"
2 47 ALA 1.496 0.135 13 0 "[ . 1 . 2]"
2 48 LYS 13.839 0.240 6 0 "[ . 1 . 2]"
2 49 ALA 3.356 0.204 15 0 "[ . 1 . 2]"
2 50 GLN 1.258 0.135 13 0 "[ . 1 . 2]"
2 51 ALA 3.867 0.162 11 0 "[ . 1 . 2]"
2 52 THR 2.885 0.204 9 0 "[ . 1 . 2]"
2 53 VAL 2.909 0.206 20 0 "[ . 1 . 2]"
2 54 ASP 1.776 0.206 20 0 "[ . 1 . 2]"
2 55 ASN 5.429 0.301 14 0 "[ . 1 . 2]"
2 56 ALA 1.631 0.246 3 0 "[ . 1 . 2]"
2 57 HIS 2.951 0.246 3 0 "[ . 1 . 2]"
2 58 ALA 9.944 0.341 16 0 "[ . 1 . 2]"
2 59 ARG 7.251 0.283 17 0 "[ . 1 . 2]"
2 60 TYR 4.603 0.209 13 0 "[ . 1 . 2]"
2 61 PHE 2.062 0.190 5 0 "[ . 1 . 2]"
2 62 ILE 10.310 0.372 19 0 "[ . 1 . 2]"
2 63 ILE 3.913 0.372 19 0 "[ . 1 . 2]"
2 64 HIS 2.843 0.201 2 0 "[ . 1 . 2]"
2 65 ALA 3.375 0.205 8 0 "[ . 1 . 2]"
2 66 HIS 2.491 0.248 14 0 "[ . 1 . 2]"
2 67 LYS 3.134 0.277 12 0 "[ . 1 . 2]"
2 68 LEU 8.626 0.432 9 0 "[ . 1 . 2]"
2 69 LEU 7.606 0.196 8 0 "[ . 1 . 2]"
2 70 ASP 4.851 0.257 12 0 "[ . 1 . 2]"
2 71 PRO 5.078 0.257 12 0 "[ . 1 . 2]"
2 72 SER 0.600 0.100 9 0 "[ . 1 . 2]"
2 73 GLU 0.839 0.139 17 0 "[ . 1 . 2]"
2 74 GLY 0.334 0.066 3 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 2 PRO HA 1 3 ASP H . . 2.960 2.411 2.151 2.987 0.027 16 0 "[ . 1 . 2]" 1
2 1 2 PRO QD 1 3 ASP H . . 4.930 4.616 3.430 5.022 0.092 5 0 "[ . 1 . 2]" 1
3 1 3 ASP H 1 3 ASP QB . . 3.230 2.451 2.200 2.753 . 0 0 "[ . 1 . 2]" 1
4 1 3 ASP H 1 4 LYS H . . 4.360 3.999 2.571 4.552 0.192 5 0 "[ . 1 . 2]" 1
5 1 3 ASP HA 1 4 LYS H . . 2.940 2.332 2.094 3.216 0.276 8 0 "[ . 1 . 2]" 1
6 1 3 ASP HA 1 4 LYS HB2 . . 5.500 4.924 4.397 5.679 0.179 18 0 "[ . 1 . 2]" 1
7 1 3 ASP HA 1 4 LYS HB3 . . 5.500 5.139 4.364 5.757 0.257 11 0 "[ . 1 . 2]" 1
8 1 3 ASP QB 1 4 LYS H . . 4.400 3.696 2.791 4.067 . 0 0 "[ . 1 . 2]" 1
9 1 4 LYS H 1 4 LYS QB . . 2.980 2.585 2.274 3.115 0.135 18 0 "[ . 1 . 2]" 1
10 1 4 LYS H 1 4 LYS HG2 . . 5.450 3.959 2.013 5.191 . 0 0 "[ . 1 . 2]" 1
11 1 4 LYS H 1 4 LYS QG . . 4.720 3.504 1.978 4.365 . 0 0 "[ . 1 . 2]" 1
12 1 4 LYS H 1 4 LYS HG3 . . 5.450 4.112 2.463 4.929 . 0 0 "[ . 1 . 2]" 1
13 1 4 LYS H 1 5 GLN H . . 4.420 3.930 2.938 4.542 0.122 2 0 "[ . 1 . 2]" 1
14 1 4 LYS HA 1 4 LYS QD . . 4.210 3.376 1.956 4.342 0.132 5 0 "[ . 1 . 2]" 1
15 1 4 LYS HA 1 5 GLN H . . 2.710 2.235 2.127 2.379 . 0 0 "[ . 1 . 2]" 1
16 1 4 LYS HA 1 5 GLN HG3 . . 4.670 4.008 3.617 4.408 . 0 0 "[ . 1 . 2]" 1
17 1 4 LYS QB 1 5 GLN H . . 4.090 3.722 2.662 4.055 . 0 0 "[ . 1 . 2]" 1
18 1 4 LYS HB2 1 5 GLN H . . 4.680 4.317 2.705 4.679 . 0 0 "[ . 1 . 2]" 1
19 1 4 LYS HB3 1 5 GLN H . . 4.680 4.189 3.116 4.600 . 0 0 "[ . 1 . 2]" 1
20 1 4 LYS QG 1 5 GLN H . . 4.810 4.068 3.436 4.558 . 0 0 "[ . 1 . 2]" 1
21 1 4 LYS HG2 1 5 GLN H . . 5.500 4.892 3.725 5.541 0.041 12 0 "[ . 1 . 2]" 1
22 1 4 LYS HG3 1 5 GLN H . . 5.500 4.478 3.748 5.564 0.064 20 0 "[ . 1 . 2]" 1
23 1 5 GLN H 1 5 GLN HB2 . . 3.620 3.628 3.568 3.733 0.113 12 0 "[ . 1 . 2]" 1
24 1 5 GLN H 1 5 GLN HB3 . . 3.790 2.973 2.835 3.204 . 0 0 "[ . 1 . 2]" 1
25 1 5 GLN H 1 5 GLN HE22 . . 5.500 4.716 4.275 5.154 . 0 0 "[ . 1 . 2]" 1
26 1 5 GLN H 1 5 GLN HG2 . . 4.470 3.592 3.445 3.696 . 0 0 "[ . 1 . 2]" 1
27 1 5 GLN H 1 5 GLN HG3 . . 5.060 2.093 1.840 2.333 . 0 0 "[ . 1 . 2]" 1
28 1 5 GLN H 1 6 LEU QD . . 5.440 5.360 4.754 5.607 0.167 4 0 "[ . 1 . 2]" 1
29 1 5 GLN HA 1 5 GLN HE21 . . 5.170 4.656 3.940 5.117 . 0 0 "[ . 1 . 2]" 1
30 1 5 GLN HB2 1 5 GLN HE21 . . 3.720 2.622 1.937 3.825 0.105 2 0 "[ . 1 . 2]" 1
31 1 5 GLN HB2 1 5 GLN HE22 . . 4.140 3.924 3.534 4.223 0.083 2 0 "[ . 1 . 2]" 1
32 1 5 GLN HB2 1 6 LEU H . . 4.120 3.901 2.476 4.172 0.052 19 0 "[ . 1 . 2]" 1
33 1 5 GLN HB2 2 26 LEU MD1 . . 5.500 3.665 2.289 5.265 . 0 0 "[ . 1 . 2]" 1
34 1 5 GLN HB2 2 26 LEU MD2 . . 5.500 2.636 1.544 4.840 . 0 0 "[ . 1 . 2]" 1
35 1 5 GLN HB3 1 5 GLN HE21 . . 4.770 3.926 3.508 4.257 . 0 0 "[ . 1 . 2]" 1
36 1 5 GLN HB3 1 6 LEU H . . 4.750 4.332 3.780 4.449 . 0 0 "[ . 1 . 2]" 1
37 1 5 GLN HE21 1 5 GLN HG2 . . 3.450 2.579 2.334 3.426 . 0 0 "[ . 1 . 2]" 1
38 1 5 GLN HE21 2 22 GLU HA . . 5.500 4.604 3.481 5.561 0.061 18 0 "[ . 1 . 2]" 1
39 1 5 GLN HE21 2 22 GLU QB . . 4.950 4.214 3.163 5.050 0.100 7 0 "[ . 1 . 2]" 1
40 1 5 GLN HE21 2 23 PHE H . . 4.490 3.492 2.664 4.505 0.015 18 0 "[ . 1 . 2]" 1
41 1 5 GLN HE21 2 26 LEU MD1 . . 4.690 3.243 1.949 4.775 0.085 2 0 "[ . 1 . 2]" 1
42 1 5 GLN HE21 2 26 LEU QD . . 3.690 2.525 1.652 3.877 0.187 2 0 "[ . 1 . 2]" 1
43 1 5 GLN HE21 2 26 LEU MD2 . . 4.690 2.804 1.658 4.102 . 0 0 "[ . 1 . 2]" 1
44 1 5 GLN HE21 2 26 LEU HG . . 5.390 4.655 3.637 5.404 0.014 20 0 "[ . 1 . 2]" 1
45 1 5 GLN HE22 1 5 GLN HG2 . . 3.900 3.632 3.521 4.015 0.115 2 0 "[ . 1 . 2]" 1
46 1 5 GLN HE22 1 6 LEU QB . . 4.000 3.012 1.904 4.092 0.092 2 0 "[ . 1 . 2]" 1
47 1 5 GLN HE22 1 6 LEU MD1 . . 5.160 3.557 2.610 4.658 . 0 0 "[ . 1 . 2]" 1
48 1 5 GLN HE22 1 6 LEU QD . . 4.200 3.417 2.584 4.319 0.119 9 0 "[ . 1 . 2]" 1
49 1 5 GLN HE22 1 6 LEU MD2 . . 5.160 4.665 3.769 5.256 0.096 7 0 "[ . 1 . 2]" 1
50 1 5 GLN HE22 1 6 LEU HG . . 5.280 4.654 3.672 5.400 0.120 8 0 "[ . 1 . 2]" 1
51 1 5 GLN HE22 2 16 LYS QE . . 5.130 3.939 2.914 5.069 . 0 0 "[ . 1 . 2]" 1
52 1 5 GLN HE22 2 22 GLU HA . . 5.240 3.171 2.338 3.972 . 0 0 "[ . 1 . 2]" 1
53 1 5 GLN HE22 2 22 GLU QB . . 4.080 3.335 1.911 4.189 0.109 12 0 "[ . 1 . 2]" 1
54 1 5 GLN HE22 2 23 PHE H . . 3.970 2.324 1.859 3.240 . 0 0 "[ . 1 . 2]" 1
55 1 5 GLN HE22 2 23 PHE HB3 . . 5.140 4.321 3.505 5.182 0.042 11 0 "[ . 1 . 2]" 1
56 1 5 GLN HE22 2 26 LEU MD1 . . 5.180 3.770 2.815 5.133 . 0 0 "[ . 1 . 2]" 1
57 1 5 GLN HE22 2 26 LEU QD . . 3.730 3.220 2.578 3.887 0.157 16 0 "[ . 1 . 2]" 1
58 1 5 GLN HE22 2 26 LEU MD2 . . 5.180 3.814 2.636 4.910 . 0 0 "[ . 1 . 2]" 1
59 1 5 GLN HG2 1 6 LEU H . . 4.660 4.557 4.326 4.794 0.134 2 0 "[ . 1 . 2]" 1
60 1 5 GLN HG2 2 26 LEU QD . . 5.020 3.560 2.190 4.727 . 0 0 "[ . 1 . 2]" 1
61 1 5 GLN HG3 1 6 LEU H . . 4.870 3.724 3.203 4.638 . 0 0 "[ . 1 . 2]" 1
62 1 6 LEU H 1 6 LEU QB . . 3.190 2.269 2.136 3.016 . 0 0 "[ . 1 . 2]" 1
63 1 6 LEU H 1 6 LEU MD1 . . 4.740 4.221 4.011 4.993 0.253 2 0 "[ . 1 . 2]" 1
64 1 6 LEU H 1 6 LEU QD . . 3.910 3.800 3.703 4.112 0.202 2 0 "[ . 1 . 2]" 1
65 1 6 LEU H 1 6 LEU MD2 . . 4.740 4.327 4.252 4.439 . 0 0 "[ . 1 . 2]" 1
66 1 6 LEU H 1 6 LEU HG . . 4.460 4.474 4.317 4.731 0.271 2 0 "[ . 1 . 2]" 1
67 1 6 LEU HA 1 6 LEU MD1 . . 4.110 2.809 2.057 3.876 . 0 0 "[ . 1 . 2]" 1
68 1 6 LEU HA 1 6 LEU QD . . 3.220 2.409 2.050 2.987 . 0 0 "[ . 1 . 2]" 1
69 1 6 LEU HA 1 6 LEU MD2 . . 4.110 3.533 2.790 3.977 . 0 0 "[ . 1 . 2]" 1
70 1 6 LEU HA 1 6 LEU HG . . 4.050 2.854 2.364 3.207 . 0 0 "[ . 1 . 2]" 1
71 1 6 LEU HA 1 7 LEU MD1 . . 5.430 3.227 2.348 5.397 . 0 0 "[ . 1 . 2]" 1
72 1 6 LEU HA 1 7 LEU QD . . 4.340 2.892 2.339 3.932 . 0 0 "[ . 1 . 2]" 1
73 1 6 LEU HA 1 7 LEU MD2 . . 5.430 4.786 2.934 5.527 0.097 3 0 "[ . 1 . 2]" 1
74 1 6 LEU HA 1 7 LEU HG . . 5.500 4.831 3.067 5.546 0.046 19 0 "[ . 1 . 2]" 1
75 1 6 LEU QD 1 7 LEU H . . 3.900 2.387 1.618 3.023 . 0 0 "[ . 1 . 2]" 1
76 1 6 LEU QD 1 66 HIS H . . 4.580 3.765 2.824 4.286 . 0 0 "[ . 1 . 2]" 1
77 1 6 LEU QD 1 66 HIS HA . . 4.490 2.076 1.490 2.385 . 0 0 "[ . 1 . 2]" 1
78 1 6 LEU QD 1 66 HIS QB . . 5.130 3.082 2.291 3.683 . 0 0 "[ . 1 . 2]" 1
79 1 6 LEU QD 1 66 HIS HE1 . . 4.700 3.431 2.846 4.753 0.053 1 0 "[ . 1 . 2]" 1
80 1 6 LEU QD 1 67 LYS H . . 5.440 4.319 2.506 5.005 . 0 0 "[ . 1 . 2]" 1
81 1 6 LEU MD1 1 66 HIS H . . 5.500 4.648 3.866 5.431 . 0 0 "[ . 1 . 2]" 1
82 1 6 LEU MD1 1 66 HIS HE1 . . 5.500 5.087 3.684 5.622 0.122 6 0 "[ . 1 . 2]" 1
83 1 6 LEU MD2 1 66 HIS H . . 5.500 4.191 2.858 5.407 . 0 0 "[ . 1 . 2]" 1
84 1 6 LEU MD2 1 66 HIS HE1 . . 5.500 3.721 2.855 5.578 0.078 9 0 "[ . 1 . 2]" 1
85 1 6 LEU HG 1 7 LEU H . . 3.200 3.137 2.538 3.320 0.120 8 0 "[ . 1 . 2]" 1
86 1 7 LEU H 1 7 LEU HB2 . . 4.060 3.972 3.700 4.071 0.011 19 0 "[ . 1 . 2]" 1
87 1 7 LEU H 1 7 LEU QB . . 3.410 3.210 3.000 3.359 . 0 0 "[ . 1 . 2]" 1
88 1 7 LEU H 1 7 LEU HB3 . . 4.060 3.394 3.115 3.587 . 0 0 "[ . 1 . 2]" 1
89 1 7 LEU H 1 7 LEU MD1 . . 4.510 2.458 1.855 4.329 . 0 0 "[ . 1 . 2]" 1
90 1 7 LEU H 1 7 LEU QD . . 3.920 2.187 1.822 3.018 . 0 0 "[ . 1 . 2]" 1
91 1 7 LEU H 1 7 LEU MD2 . . 4.510 3.589 1.824 4.164 . 0 0 "[ . 1 . 2]" 1
92 1 7 LEU H 1 7 LEU HG . . 4.680 3.864 1.935 4.536 . 0 0 "[ . 1 . 2]" 1
93 1 7 LEU H 1 8 HIS H . . 4.590 4.320 4.260 4.368 . 0 0 "[ . 1 . 2]" 1
94 1 7 LEU H 1 8 HIS HD2 . . 5.240 5.066 4.738 5.336 0.096 7 0 "[ . 1 . 2]" 1
95 1 7 LEU H 2 26 LEU MD1 . . 5.500 4.030 3.473 5.252 . 0 0 "[ . 1 . 2]" 1
96 1 7 LEU H 2 26 LEU MD2 . . 5.500 5.078 3.607 5.585 0.085 13 0 "[ . 1 . 2]" 1
97 1 7 LEU HA 1 7 LEU MD1 . . 4.170 3.667 3.537 4.174 0.004 6 0 "[ . 1 . 2]" 1
98 1 7 LEU HA 1 7 LEU QD . . 3.360 3.331 3.264 3.505 0.145 8 0 "[ . 1 . 2]" 1
99 1 7 LEU HA 1 7 LEU MD2 . . 4.170 3.849 3.667 4.091 . 0 0 "[ . 1 . 2]" 1
100 1 7 LEU HA 1 8 HIS H . . 3.020 2.644 2.477 2.780 . 0 0 "[ . 1 . 2]" 1
101 1 7 LEU QB 1 7 LEU QD . . 2.850 2.076 1.952 2.136 . 0 0 "[ . 1 . 2]" 1
102 1 7 LEU QB 1 35 TYR H . . 5.340 5.188 4.676 5.488 0.148 13 0 "[ . 1 . 2]" 1
103 1 7 LEU QD 1 8 HIS H . . 3.910 2.648 2.163 3.160 . 0 0 "[ . 1 . 2]" 1
104 1 7 LEU QD 1 34 ALA HA . . 4.650 3.353 2.990 3.847 . 0 0 "[ . 1 . 2]" 1
105 1 7 LEU QD 1 34 ALA MB . . 2.970 2.481 2.104 2.861 . 0 0 "[ . 1 . 2]" 1
106 1 7 LEU QD 1 35 TYR H . . 3.840 2.137 1.790 2.747 . 0 0 "[ . 1 . 2]" 1
107 1 7 LEU QD 1 35 TYR HB3 . . 5.220 4.016 3.423 4.505 . 0 0 "[ . 1 . 2]" 1
108 1 7 LEU QD 1 36 PRO QD . . 5.440 4.471 4.197 4.716 . 0 0 "[ . 1 . 2]" 1
109 1 7 LEU QD 1 38 TYR H . . 4.680 3.687 2.623 4.338 . 0 0 "[ . 1 . 2]" 1
110 1 7 LEU QD 2 23 PHE QD . . 4.550 3.819 2.977 4.569 0.019 3 0 "[ . 1 . 2]" 1
111 1 7 LEU QD 2 26 LEU HA . . 5.440 4.727 4.229 5.364 . 0 0 "[ . 1 . 2]" 1
112 1 7 LEU QD 2 26 LEU QD . . 3.000 2.157 1.799 2.451 . 0 0 "[ . 1 . 2]" 1
113 1 7 LEU HG 1 8 HIS H . . 4.770 4.099 2.599 4.570 . 0 0 "[ . 1 . 2]" 1
114 1 7 LEU HG 1 38 TYR H . . 5.410 4.443 3.237 5.541 0.131 14 0 "[ . 1 . 2]" 1
115 1 8 HIS H 1 8 HIS QB . . 3.650 2.405 2.355 2.454 . 0 0 "[ . 1 . 2]" 1
116 1 8 HIS HA 1 8 HIS HD2 . . 4.920 2.700 2.436 2.954 . 0 0 "[ . 1 . 2]" 1
117 1 8 HIS HA 1 9 ILE H . . 3.050 2.223 2.176 2.274 . 0 0 "[ . 1 . 2]" 1
118 1 8 HIS HA 1 9 ILE MD . . 5.360 5.361 5.180 5.455 0.095 1 0 "[ . 1 . 2]" 1
119 1 8 HIS HA 1 9 ILE HG12 . . 5.200 4.104 4.019 4.194 . 0 0 "[ . 1 . 2]" 1
120 1 8 HIS HA 1 62 ILE MG . . 5.070 3.781 3.592 3.981 . 0 0 "[ . 1 . 2]" 1
121 1 8 HIS HA 1 63 ILE H . . 5.500 4.670 4.431 5.148 . 0 0 "[ . 1 . 2]" 1
122 1 8 HIS HA 1 65 ALA H . . 3.620 2.222 1.717 2.683 . 0 0 "[ . 1 . 2]" 1
123 1 8 HIS HA 1 65 ALA MB . . 4.540 3.326 2.457 3.761 . 0 0 "[ . 1 . 2]" 1
124 1 8 HIS QB 1 9 ILE H . . 3.740 3.611 3.382 3.719 . 0 0 "[ . 1 . 2]" 1
125 1 8 HIS QB 1 41 ALA H . . 5.500 5.761 5.651 5.862 0.362 19 0 "[ . 1 . 2]" 1
126 1 8 HIS QB 1 41 ALA MB . . 3.340 3.410 3.131 3.553 0.213 10 0 "[ . 1 . 2]" 1
127 1 8 HIS QB 1 62 ILE MG . . 3.270 1.946 1.831 2.090 . 0 0 "[ . 1 . 2]" 1
128 1 8 HIS QB 1 63 ILE H . . 4.840 3.601 3.285 4.024 . 0 0 "[ . 1 . 2]" 1
129 1 8 HIS QB 1 63 ILE HA . . 5.100 4.532 4.184 5.102 0.002 19 0 "[ . 1 . 2]" 1
130 1 8 HIS QB 1 64 HIS HA . . 4.990 3.092 2.678 3.530 . 0 0 "[ . 1 . 2]" 1
131 1 8 HIS QB 2 69 LEU QD . . 5.260 2.779 2.118 3.287 . 0 0 "[ . 1 . 2]" 1
132 1 8 HIS HD2 1 9 ILE H . . 5.300 4.832 4.537 5.105 . 0 0 "[ . 1 . 2]" 1
133 1 8 HIS HD2 1 64 HIS HA . . 3.620 2.891 2.496 3.539 . 0 0 "[ . 1 . 2]" 1
134 1 8 HIS HD2 1 64 HIS QB . . 5.140 3.397 2.903 4.666 . 0 0 "[ . 1 . 2]" 1
135 1 8 HIS HD2 1 65 ALA H . . 3.370 3.282 2.552 3.439 0.069 8 0 "[ . 1 . 2]" 1
136 1 8 HIS HD2 1 65 ALA MB . . 4.700 4.661 3.790 4.841 0.141 3 0 "[ . 1 . 2]" 1
137 1 9 ILE H 1 9 ILE HB . . 3.790 3.685 3.649 3.708 . 0 0 "[ . 1 . 2]" 1
138 1 9 ILE H 1 9 ILE MD . . 4.250 3.718 3.593 3.794 . 0 0 "[ . 1 . 2]" 1
139 1 9 ILE H 1 9 ILE HG12 . . 3.770 2.230 2.117 2.317 . 0 0 "[ . 1 . 2]" 1
140 1 9 ILE H 1 9 ILE HG13 . . 3.930 3.409 3.299 3.528 . 0 0 "[ . 1 . 2]" 1
141 1 9 ILE H 1 9 ILE MG . . 4.110 2.216 2.067 2.339 . 0 0 "[ . 1 . 2]" 1
142 1 9 ILE H 1 10 VAL H . . 4.660 4.625 4.580 4.650 . 0 0 "[ . 1 . 2]" 1
143 1 9 ILE H 1 41 ALA MB . . 4.910 4.858 4.745 5.014 0.104 11 0 "[ . 1 . 2]" 1
144 1 9 ILE H 1 64 HIS HA . . 4.400 3.861 3.442 4.517 0.117 19 0 "[ . 1 . 2]" 1
145 1 9 ILE H 1 65 ALA H . . 4.610 2.991 2.474 3.750 . 0 0 "[ . 1 . 2]" 1
146 1 9 ILE H 1 65 ALA MB . . 4.880 2.555 2.207 2.918 . 0 0 "[ . 1 . 2]" 1
147 1 9 ILE H 2 63 ILE MD . . 5.090 4.621 4.125 5.086 . 0 0 "[ . 1 . 2]" 1
148 1 9 ILE HA 1 9 ILE MD . . 4.280 4.276 4.264 4.292 0.012 12 0 "[ . 1 . 2]" 1
149 1 9 ILE HA 1 9 ILE HG12 . . 4.130 3.806 3.771 3.839 . 0 0 "[ . 1 . 2]" 1
150 1 9 ILE HA 1 10 VAL H . . 2.830 2.447 2.335 2.550 . 0 0 "[ . 1 . 2]" 1
151 1 9 ILE HA 1 34 ALA MB . . 4.250 2.958 2.557 3.196 . 0 0 "[ . 1 . 2]" 1
152 1 9 ILE HA 1 35 TYR H . . 3.980 3.804 3.659 3.952 . 0 0 "[ . 1 . 2]" 1
153 1 9 ILE HB 1 9 ILE MD . . 3.420 2.531 2.490 2.596 . 0 0 "[ . 1 . 2]" 1
154 1 9 ILE HB 1 10 VAL H . . 3.280 2.352 2.195 2.512 . 0 0 "[ . 1 . 2]" 1
155 1 9 ILE HB 1 10 VAL MG2 . . 3.650 3.824 3.719 3.940 0.290 1 0 "[ . 1 . 2]" 1
156 1 9 ILE HB 1 34 ALA HA . . 5.500 3.480 3.348 3.658 . 0 0 "[ . 1 . 2]" 1
157 1 9 ILE HB 1 35 TYR H . . 5.500 5.333 5.067 5.640 0.140 19 0 "[ . 1 . 2]" 1
158 1 9 ILE HB 2 31 PHE QE . . 4.510 3.057 2.545 3.545 . 0 0 "[ . 1 . 2]" 1
159 1 9 ILE MD 1 9 ILE MG . . 2.630 2.031 2.004 2.050 . 0 0 "[ . 1 . 2]" 1
160 1 9 ILE MD 1 10 VAL H . . 4.830 4.204 3.973 4.410 . 0 0 "[ . 1 . 2]" 1
161 1 9 ILE MD 1 34 ALA MB . . 4.180 3.851 3.654 4.157 . 0 0 "[ . 1 . 2]" 1
162 1 9 ILE MD 1 65 ALA H . . 5.500 4.888 4.543 5.498 . 0 0 "[ . 1 . 2]" 1
163 1 9 ILE MD 1 65 ALA MB . . 3.010 2.519 2.198 2.988 . 0 0 "[ . 1 . 2]" 1
164 1 9 ILE MD 2 31 PHE QD . . 3.750 3.231 2.868 3.570 . 0 0 "[ . 1 . 2]" 1
165 1 9 ILE MD 2 31 PHE QE . . 3.590 1.699 1.505 2.018 . 0 0 "[ . 1 . 2]" 1
166 1 9 ILE MD 2 63 ILE MD . . 2.710 2.180 1.892 2.544 . 0 0 "[ . 1 . 2]" 1
167 1 9 ILE HG12 1 9 ILE MG . . 2.910 2.510 2.479 2.551 . 0 0 "[ . 1 . 2]" 1
168 1 9 ILE HG12 1 10 VAL H . . 5.190 4.518 4.384 4.659 . 0 0 "[ . 1 . 2]" 1
169 1 9 ILE HG12 1 65 ALA MB . . 4.080 2.360 1.967 2.958 . 0 0 "[ . 1 . 2]" 1
170 1 9 ILE HG13 1 10 VAL HA . . 4.990 4.120 3.948 4.379 . 0 0 "[ . 1 . 2]" 1
171 1 9 ILE HG13 1 34 ALA HA . . 5.500 5.634 5.529 5.730 0.230 14 0 "[ . 1 . 2]" 1
172 1 9 ILE HG13 1 63 ILE H . . 4.720 3.669 3.262 4.146 . 0 0 "[ . 1 . 2]" 1
173 1 9 ILE HG13 2 31 PHE QE . . 5.020 3.608 3.025 3.921 . 0 0 "[ . 1 . 2]" 1
174 1 9 ILE HG13 2 63 ILE MD . . 5.230 3.992 3.522 4.493 . 0 0 "[ . 1 . 2]" 1
175 1 9 ILE MG 1 10 VAL H . . 3.970 3.751 3.687 3.826 . 0 0 "[ . 1 . 2]" 1
176 1 9 ILE MG 1 33 GLY QA . . 5.340 5.178 4.865 5.392 0.052 7 0 "[ . 1 . 2]" 1
177 1 9 ILE MG 1 34 ALA MB . . 4.090 1.932 1.787 2.006 . 0 0 "[ . 1 . 2]" 1
178 1 9 ILE MG 1 64 HIS HA . . 5.500 5.293 4.688 5.782 0.282 19 0 "[ . 1 . 2]" 1
179 1 9 ILE MG 1 65 ALA H . . 5.000 3.891 3.347 4.519 . 0 0 "[ . 1 . 2]" 1
180 1 9 ILE MG 1 65 ALA HA . . 5.500 4.326 3.849 4.598 . 0 0 "[ . 1 . 2]" 1
181 1 9 ILE MG 1 65 ALA MB . . 2.970 1.958 1.679 2.244 . 0 0 "[ . 1 . 2]" 1
182 1 9 ILE MG 2 31 PHE QE . . 5.100 3.370 2.626 4.121 . 0 0 "[ . 1 . 2]" 1
183 1 10 VAL H 1 10 VAL HB . . 3.810 3.687 3.641 3.729 . 0 0 "[ . 1 . 2]" 1
184 1 10 VAL H 1 10 VAL MG1 . . 3.540 3.247 3.126 3.375 . 0 0 "[ . 1 . 2]" 1
185 1 10 VAL H 1 10 VAL MG2 . . 3.050 1.979 1.882 2.072 . 0 0 "[ . 1 . 2]" 1
186 1 10 VAL H 1 11 VAL H . . 4.660 4.391 4.261 4.457 . 0 0 "[ . 1 . 2]" 1
187 1 10 VAL H 1 34 ALA HA . . 4.050 2.895 2.681 3.132 . 0 0 "[ . 1 . 2]" 1
188 1 10 VAL H 1 34 ALA MB . . 4.370 3.544 3.425 3.747 . 0 0 "[ . 1 . 2]" 1
189 1 10 VAL H 1 35 TYR H . . 5.220 4.944 4.389 5.231 0.011 14 0 "[ . 1 . 2]" 1
190 1 10 VAL HA 1 10 VAL MG1 . . 3.090 2.226 2.196 2.255 . 0 0 "[ . 1 . 2]" 1
191 1 10 VAL HA 1 10 VAL MG2 . . 3.210 3.222 3.207 3.235 0.025 15 0 "[ . 1 . 2]" 1
192 1 10 VAL HA 1 11 VAL H . . 2.920 2.099 2.035 2.164 . 0 0 "[ . 1 . 2]" 1
193 1 10 VAL HA 1 11 VAL MG1 . . 5.500 3.590 3.373 3.827 . 0 0 "[ . 1 . 2]" 1
194 1 10 VAL HA 1 11 VAL QG . . 4.290 3.363 3.204 3.491 . 0 0 "[ . 1 . 2]" 1
195 1 10 VAL HA 1 11 VAL MG2 . . 5.500 4.566 3.574 5.488 . 0 0 "[ . 1 . 2]" 1
196 1 10 VAL HA 1 62 ILE MG . . 4.700 2.876 2.727 2.984 . 0 0 "[ . 1 . 2]" 1
197 1 10 VAL HA 1 63 ILE H . . 4.050 3.302 3.045 3.513 . 0 0 "[ . 1 . 2]" 1
198 1 10 VAL HB 1 11 VAL H . . 4.370 3.236 2.994 3.520 . 0 0 "[ . 1 . 2]" 1
199 1 10 VAL HB 1 11 VAL HA . . 5.500 4.423 4.283 4.562 . 0 0 "[ . 1 . 2]" 1
200 1 10 VAL HB 1 32 VAL H . . 4.610 4.196 3.850 4.488 . 0 0 "[ . 1 . 2]" 1
201 1 10 VAL HB 1 32 VAL HB . . 3.610 2.089 1.925 2.482 . 0 0 "[ . 1 . 2]" 1
202 1 10 VAL HB 1 32 VAL MG1 . . 3.770 2.872 2.729 3.143 . 0 0 "[ . 1 . 2]" 1
203 1 10 VAL HB 1 32 VAL MG2 . . 4.010 2.861 2.624 3.152 . 0 0 "[ . 1 . 2]" 1
204 1 10 VAL MG1 1 11 VAL H . . 3.550 3.517 3.400 3.614 0.064 2 0 "[ . 1 . 2]" 1
205 1 10 VAL MG1 1 32 VAL HB . . 4.630 3.747 3.570 4.013 . 0 0 "[ . 1 . 2]" 1
206 1 10 VAL MG1 1 34 ALA HA . . 4.150 4.298 4.091 4.395 0.245 10 0 "[ . 1 . 2]" 1
207 1 10 VAL MG1 1 35 TYR QD . . 3.800 3.569 3.237 3.870 0.070 17 0 "[ . 1 . 2]" 1
208 1 10 VAL MG1 1 41 ALA HA . . 3.600 2.708 2.447 2.988 . 0 0 "[ . 1 . 2]" 1
209 1 10 VAL MG1 1 45 TRP HB2 . . 4.340 3.426 3.013 3.701 . 0 0 "[ . 1 . 2]" 1
210 1 10 VAL MG1 1 62 ILE HA . . 4.320 2.901 2.540 3.095 . 0 0 "[ . 1 . 2]" 1
211 1 10 VAL MG1 1 62 ILE MD . . 3.890 3.348 2.867 3.671 . 0 0 "[ . 1 . 2]" 1
212 1 10 VAL MG1 1 62 ILE HG12 . . 3.120 2.249 1.928 2.622 . 0 0 "[ . 1 . 2]" 1
213 1 10 VAL MG1 1 62 ILE HG13 . . 4.490 3.699 3.490 4.060 . 0 0 "[ . 1 . 2]" 1
214 1 10 VAL MG1 1 63 ILE H . . 4.500 4.221 3.887 4.457 . 0 0 "[ . 1 . 2]" 1
215 1 10 VAL MG2 1 11 VAL H . . 5.080 4.233 4.114 4.352 . 0 0 "[ . 1 . 2]" 1
216 1 10 VAL MG2 1 32 VAL MG1 . . 2.870 2.405 2.305 2.524 . 0 0 "[ . 1 . 2]" 1
217 1 10 VAL MG2 1 34 ALA HA . . 3.600 2.432 2.218 2.559 . 0 0 "[ . 1 . 2]" 1
218 1 10 VAL MG2 1 34 ALA MB . . 3.610 3.724 3.644 3.842 0.232 20 0 "[ . 1 . 2]" 1
219 1 11 VAL H 1 11 VAL MG1 . . 4.190 2.726 2.320 3.179 . 0 0 "[ . 1 . 2]" 1
220 1 11 VAL H 1 11 VAL QG . . 3.130 2.338 2.215 2.472 . 0 0 "[ . 1 . 2]" 1
221 1 11 VAL H 1 11 VAL MG2 . . 4.190 3.185 2.282 4.056 . 0 0 "[ . 1 . 2]" 1
222 1 11 VAL H 1 61 PHE QB . . 5.340 4.499 4.095 4.903 . 0 0 "[ . 1 . 2]" 1
223 1 11 VAL H 1 62 ILE HA . . 4.480 2.833 2.706 2.950 . 0 0 "[ . 1 . 2]" 1
224 1 11 VAL H 1 62 ILE HG12 . . 5.390 4.842 4.472 5.135 . 0 0 "[ . 1 . 2]" 1
225 1 11 VAL H 1 62 ILE MG . . 4.190 4.350 4.211 4.448 0.258 16 0 "[ . 1 . 2]" 1
226 1 11 VAL HA 1 11 VAL QG . . 3.080 2.378 2.315 2.414 . 0 0 "[ . 1 . 2]" 1
227 1 11 VAL HA 1 12 GLY H . . 2.980 2.309 2.172 2.522 . 0 0 "[ . 1 . 2]" 1
228 1 11 VAL HA 1 31 PHE H . . 5.460 4.892 4.688 5.141 . 0 0 "[ . 1 . 2]" 1
229 1 11 VAL HA 1 32 VAL H . . 3.700 2.121 1.878 2.351 . 0 0 "[ . 1 . 2]" 1
230 1 11 VAL HA 1 32 VAL MG2 . . 4.000 2.798 2.417 3.245 . 0 0 "[ . 1 . 2]" 1
231 1 11 VAL HB 1 12 GLY H . . 3.960 3.339 2.316 4.049 0.089 18 0 "[ . 1 . 2]" 1
232 1 11 VAL HB 1 31 PHE HA . . 5.500 3.343 2.881 4.099 . 0 0 "[ . 1 . 2]" 1
233 1 11 VAL HB 1 31 PHE QD . . 5.500 3.023 2.529 3.766 . 0 0 "[ . 1 . 2]" 1
234 1 11 VAL HB 1 31 PHE QE . . 5.430 4.020 3.492 4.588 . 0 0 "[ . 1 . 2]" 1
235 1 11 VAL HB 1 63 ILE MD . . 3.990 3.964 2.797 4.140 0.150 8 0 "[ . 1 . 2]" 1
236 1 11 VAL QG 1 12 GLY HA2 . . 4.440 3.235 2.874 3.728 . 0 0 "[ . 1 . 2]" 1
237 1 11 VAL QG 1 31 PHE HA . . 3.350 2.634 2.143 3.284 . 0 0 "[ . 1 . 2]" 1
238 1 11 VAL QG 1 31 PHE QB . . 3.640 3.296 2.610 3.689 0.049 13 0 "[ . 1 . 2]" 1
239 1 11 VAL QG 1 31 PHE QD . . 3.300 2.261 1.726 2.885 . 0 0 "[ . 1 . 2]" 1
240 1 11 VAL QG 1 31 PHE QE . . 3.660 2.960 2.622 3.291 . 0 0 "[ . 1 . 2]" 1
241 1 11 VAL QG 1 32 VAL H . . 4.660 3.694 3.486 3.957 . 0 0 "[ . 1 . 2]" 1
242 1 11 VAL QG 1 61 PHE H . . 4.070 3.659 3.081 4.021 . 0 0 "[ . 1 . 2]" 1
243 1 11 VAL QG 1 61 PHE QB . . 3.820 3.332 2.748 3.901 0.081 8 0 "[ . 1 . 2]" 1
244 1 11 VAL QG 1 63 ILE H . . 3.930 3.445 3.000 3.645 . 0 0 "[ . 1 . 2]" 1
245 1 11 VAL QG 1 63 ILE QG . . 4.270 2.255 1.995 3.102 . 0 0 "[ . 1 . 2]" 1
246 1 11 VAL MG1 1 12 GLY H . . 4.030 3.844 3.508 4.059 0.029 10 0 "[ . 1 . 2]" 1
247 1 11 VAL MG2 1 12 GLY H . . 4.030 2.909 2.091 3.832 . 0 0 "[ . 1 . 2]" 1
248 1 12 GLY H 1 13 GLY H . . 4.840 4.175 3.801 4.434 . 0 0 "[ . 1 . 2]" 1
249 1 12 GLY H 1 29 VAL HA . . 5.500 4.956 4.513 5.344 . 0 0 "[ . 1 . 2]" 1
250 1 12 GLY H 1 30 GLU H . . 4.460 4.065 3.439 4.523 0.063 9 0 "[ . 1 . 2]" 1
251 1 12 GLY H 1 30 GLU QB . . 5.090 4.206 3.817 4.866 . 0 0 "[ . 1 . 2]" 1
252 1 12 GLY H 1 31 PHE HA . . 4.680 2.936 2.462 3.391 . 0 0 "[ . 1 . 2]" 1
253 1 12 GLY H 1 32 VAL H . . 4.560 3.304 3.028 3.607 . 0 0 "[ . 1 . 2]" 1
254 1 12 GLY H 1 32 VAL HA . . 5.500 5.565 5.330 5.753 0.253 14 0 "[ . 1 . 2]" 1
255 1 12 GLY H 1 32 VAL MG2 . . 4.310 3.141 2.870 3.426 . 0 0 "[ . 1 . 2]" 1
256 1 12 GLY H 1 60 TYR QD . . 4.700 3.760 3.047 4.774 0.074 19 0 "[ . 1 . 2]" 1
257 1 12 GLY H 1 60 TYR QE . . 5.440 4.518 3.870 4.923 . 0 0 "[ . 1 . 2]" 1
258 1 12 GLY HA2 1 13 GLY H . . 3.250 2.829 2.147 3.222 . 0 0 "[ . 1 . 2]" 1
259 1 12 GLY HA2 1 32 VAL MG2 . . 5.500 4.468 4.016 4.770 . 0 0 "[ . 1 . 2]" 1
260 1 12 GLY HA2 1 59 ARG H . . 5.500 5.231 4.662 5.592 0.092 16 0 "[ . 1 . 2]" 1
261 1 12 GLY HA2 1 60 TYR HA . . 4.010 2.582 2.032 2.881 . 0 0 "[ . 1 . 2]" 1
262 1 12 GLY HA2 1 60 TYR QD . . 4.890 3.999 3.320 4.311 . 0 0 "[ . 1 . 2]" 1
263 1 12 GLY HA2 1 61 PHE H . . 4.110 2.926 2.392 3.290 . 0 0 "[ . 1 . 2]" 1
264 1 12 GLY HA3 1 13 GLY H . . 3.370 2.390 2.133 3.340 . 0 0 "[ . 1 . 2]" 1
265 1 12 GLY HA3 1 32 VAL MG2 . . 5.020 3.410 3.036 3.777 . 0 0 "[ . 1 . 2]" 1
266 1 12 GLY HA3 1 60 TYR HA . . 3.830 1.988 1.677 2.539 . 0 0 "[ . 1 . 2]" 1
267 1 12 GLY HA3 1 60 TYR QD . . 3.760 2.450 1.871 2.972 . 0 0 "[ . 1 . 2]" 1
268 1 12 GLY HA3 1 60 TYR QE . . 4.250 3.706 3.277 4.138 . 0 0 "[ . 1 . 2]" 1
269 1 12 GLY HA3 1 61 PHE H . . 4.510 3.276 2.791 4.400 . 0 0 "[ . 1 . 2]" 1
270 1 13 GLY H 1 14 GLU H . . 4.420 4.438 4.335 4.515 0.095 13 0 "[ . 1 . 2]" 1
271 1 13 GLY H 1 14 GLU HA . . 5.380 4.849 4.645 5.089 . 0 0 "[ . 1 . 2]" 1
272 1 13 GLY H 1 15 LEU QD . . 5.130 3.900 3.373 4.587 . 0 0 "[ . 1 . 2]" 1
273 1 13 GLY H 1 58 ALA MB . . 3.910 3.771 3.268 4.078 0.168 9 0 "[ . 1 . 2]" 1
274 1 13 GLY H 1 59 ARG H . . 3.610 3.524 3.258 3.699 0.089 14 0 "[ . 1 . 2]" 1
275 1 13 GLY H 1 59 ARG HA . . 5.500 5.061 4.698 5.428 . 0 0 "[ . 1 . 2]" 1
276 1 13 GLY H 1 59 ARG QB . . 5.080 4.809 4.281 5.271 0.191 13 0 "[ . 1 . 2]" 1
277 1 13 GLY H 1 60 TYR H . . 5.150 4.751 4.371 5.158 0.008 6 0 "[ . 1 . 2]" 1
278 1 13 GLY H 1 60 TYR HA . . 4.420 3.335 2.944 3.917 . 0 0 "[ . 1 . 2]" 1
279 1 13 GLY H 1 61 PHE H . . 5.320 4.860 4.333 5.292 . 0 0 "[ . 1 . 2]" 1
280 1 13 GLY HA2 1 14 GLU H . . 2.840 2.655 2.214 2.883 0.043 9 0 "[ . 1 . 2]" 1
281 1 13 GLY HA2 1 14 GLU QB . . 5.420 4.682 4.419 4.899 . 0 0 "[ . 1 . 2]" 1
282 1 13 GLY HA2 1 29 VAL QG . . 5.070 4.252 3.128 4.973 . 0 0 "[ . 1 . 2]" 1
283 1 13 GLY HA2 1 58 ALA MB . . 4.590 3.478 3.058 3.955 . 0 0 "[ . 1 . 2]" 1
284 1 13 GLY HA3 1 14 GLU H . . 3.480 2.536 2.277 2.892 . 0 0 "[ . 1 . 2]" 1
285 1 13 GLY HA3 1 15 LEU QD . . 4.990 4.212 3.508 4.859 . 0 0 "[ . 1 . 2]" 1
286 1 13 GLY HA3 1 23 PHE QD . . 5.380 4.372 3.293 5.405 0.025 9 0 "[ . 1 . 2]" 1
287 1 13 GLY HA3 1 29 VAL QG . . 5.290 2.962 2.047 3.631 . 0 0 "[ . 1 . 2]" 1
288 1 13 GLY HA3 1 30 GLU H . . 4.810 2.520 1.684 3.781 . 0 0 "[ . 1 . 2]" 1
289 1 13 GLY HA3 1 58 ALA MB . . 4.990 4.719 4.414 5.038 0.048 4 0 "[ . 1 . 2]" 1
290 1 14 GLU H 1 14 GLU QB . . 2.830 2.384 2.307 2.453 . 0 0 "[ . 1 . 2]" 1
291 1 14 GLU H 1 14 GLU HG2 . . 4.550 3.796 3.421 3.991 . 0 0 "[ . 1 . 2]" 1
292 1 14 GLU H 1 14 GLU HG3 . . 3.730 2.909 2.530 3.332 . 0 0 "[ . 1 . 2]" 1
293 1 14 GLU H 1 15 LEU H . . 4.700 4.440 4.297 4.539 . 0 0 "[ . 1 . 2]" 1
294 1 14 GLU H 1 15 LEU QD . . 5.190 4.200 3.807 4.997 . 0 0 "[ . 1 . 2]" 1
295 1 14 GLU H 1 23 PHE HB3 . . 5.500 5.459 4.895 5.764 0.264 9 0 "[ . 1 . 2]" 1
296 1 14 GLU H 1 58 ALA MB . . 4.630 4.028 3.511 4.694 0.064 11 0 "[ . 1 . 2]" 1
297 1 14 GLU HA 1 14 GLU HG2 . . 4.060 2.359 2.176 2.704 . 0 0 "[ . 1 . 2]" 1
298 1 14 GLU HA 1 14 GLU HG3 . . 4.180 3.059 2.789 3.345 . 0 0 "[ . 1 . 2]" 1
299 1 14 GLU HA 1 15 LEU H . . 2.760 2.058 1.980 2.137 . 0 0 "[ . 1 . 2]" 1
300 1 14 GLU HA 1 58 ALA MB . . 4.080 3.162 2.628 3.804 . 0 0 "[ . 1 . 2]" 1
301 1 14 GLU QB 1 15 LEU H . . 3.750 3.085 2.696 3.525 . 0 0 "[ . 1 . 2]" 1
302 1 14 GLU QB 1 24 ARG H . . 4.820 4.019 3.409 4.578 . 0 0 "[ . 1 . 2]" 1
303 1 14 GLU QB 1 24 ARG HB2 . . 4.690 3.465 2.811 4.428 . 0 0 "[ . 1 . 2]" 1
304 1 14 GLU QB 1 24 ARG QD . . 3.780 2.867 2.259 3.922 0.142 5 0 "[ . 1 . 2]" 1
305 1 14 GLU QB 1 25 ASP H . . 5.310 4.017 3.385 4.536 . 0 0 "[ . 1 . 2]" 1
306 1 14 GLU QB 1 56 ALA MB . . 5.500 4.766 3.923 5.488 . 0 0 "[ . 1 . 2]" 1
307 1 14 GLU HG2 1 15 LEU H . . 4.540 3.934 3.677 4.447 . 0 0 "[ . 1 . 2]" 1
308 1 14 GLU HG2 1 55 ASN HD22 . . 5.440 3.986 1.760 5.525 0.085 13 0 "[ . 1 . 2]" 1
309 1 14 GLU HG2 1 56 ALA MB . . 4.330 4.321 3.475 4.497 0.167 14 0 "[ . 1 . 2]" 1
310 1 14 GLU HG2 1 57 HIS QB . . 5.100 3.508 2.526 4.254 . 0 0 "[ . 1 . 2]" 1
311 1 14 GLU HG2 1 58 ALA H . . 5.210 3.150 2.467 4.505 . 0 0 "[ . 1 . 2]" 1
312 1 14 GLU HG2 1 58 ALA HA . . 4.920 3.068 2.611 4.101 . 0 0 "[ . 1 . 2]" 1
313 1 14 GLU HG2 1 58 ALA MB . . 4.880 2.372 1.860 3.747 . 0 0 "[ . 1 . 2]" 1
314 1 14 GLU HG3 1 15 LEU H . . 4.780 4.902 4.720 4.987 0.207 12 0 "[ . 1 . 2]" 1
315 1 14 GLU HG3 1 55 ASN HD22 . . 5.500 3.631 2.089 5.486 . 0 0 "[ . 1 . 2]" 1
316 1 14 GLU HG3 1 57 HIS QB . . 5.280 4.850 3.955 5.426 0.146 16 0 "[ . 1 . 2]" 1
317 1 14 GLU HG3 1 58 ALA HA . . 5.450 3.823 3.340 4.504 . 0 0 "[ . 1 . 2]" 1
318 1 14 GLU HG3 1 58 ALA MB . . 4.350 2.769 2.265 4.115 . 0 0 "[ . 1 . 2]" 1
319 1 15 LEU H 1 15 LEU QB . . 2.930 2.398 2.311 2.528 . 0 0 "[ . 1 . 2]" 1
320 1 15 LEU H 1 15 LEU MD1 . . 4.050 3.680 2.311 4.190 0.140 4 0 "[ . 1 . 2]" 1
321 1 15 LEU H 1 15 LEU QD . . 3.550 2.568 2.042 3.432 . 0 0 "[ . 1 . 2]" 1
322 1 15 LEU H 1 15 LEU MD2 . . 4.050 2.774 2.064 4.113 0.063 8 0 "[ . 1 . 2]" 1
323 1 15 LEU H 1 15 LEU HG . . 4.310 3.746 2.358 4.357 0.047 8 0 "[ . 1 . 2]" 1
324 1 15 LEU H 1 16 LYS H . . 4.860 4.518 4.424 4.624 . 0 0 "[ . 1 . 2]" 1
325 1 15 LEU H 1 23 PHE QD . . 5.500 5.045 4.246 5.637 0.137 19 0 "[ . 1 . 2]" 1
326 1 15 LEU H 1 24 ARG H . . 5.350 4.209 3.886 4.457 . 0 0 "[ . 1 . 2]" 1
327 1 15 LEU H 1 57 HIS HB2 . . 5.110 2.917 2.384 3.470 . 0 0 "[ . 1 . 2]" 1
328 1 15 LEU H 1 57 HIS QB . . 4.230 2.399 1.866 2.881 . 0 0 "[ . 1 . 2]" 1
329 1 15 LEU H 1 57 HIS HB3 . . 5.110 2.610 1.898 3.266 . 0 0 "[ . 1 . 2]" 1
330 1 15 LEU H 1 58 ALA H . . 5.410 4.526 4.374 4.813 . 0 0 "[ . 1 . 2]" 1
331 1 15 LEU H 1 58 ALA HA . . 4.050 3.328 2.698 3.902 . 0 0 "[ . 1 . 2]" 1
332 1 15 LEU H 1 59 ARG H . . 4.770 3.720 3.084 4.188 . 0 0 "[ . 1 . 2]" 1
333 1 15 LEU HA 1 15 LEU MD1 . . 4.220 2.682 2.078 3.926 . 0 0 "[ . 1 . 2]" 1
334 1 15 LEU HA 1 15 LEU QD . . 2.890 2.158 2.047 2.630 . 0 0 "[ . 1 . 2]" 1
335 1 15 LEU HA 1 15 LEU MD2 . . 4.220 2.895 2.101 3.922 . 0 0 "[ . 1 . 2]" 1
336 1 15 LEU HA 1 16 LYS H . . 2.820 2.450 2.300 2.645 . 0 0 "[ . 1 . 2]" 1
337 1 15 LEU HA 1 16 LYS QB . . 5.340 4.675 4.483 4.804 . 0 0 "[ . 1 . 2]" 1
338 1 15 LEU HA 1 16 LYS QG . . 4.990 3.862 3.685 4.123 . 0 0 "[ . 1 . 2]" 1
339 1 15 LEU HA 1 23 PHE HB3 . . 5.420 4.525 3.995 5.017 . 0 0 "[ . 1 . 2]" 1
340 1 15 LEU QB 1 15 LEU QD . . 2.700 2.074 1.986 2.116 . 0 0 "[ . 1 . 2]" 1
341 1 15 LEU QB 1 16 LYS H . . 3.190 2.432 2.152 2.763 . 0 0 "[ . 1 . 2]" 1
342 1 15 LEU QB 1 17 ASP H . . 4.320 2.536 1.991 3.099 . 0 0 "[ . 1 . 2]" 1
343 1 15 LEU QB 1 18 VAL H . . 5.490 5.082 4.401 5.580 0.090 2 0 "[ . 1 . 2]" 1
344 1 15 LEU QB 1 18 VAL HA . . 5.500 4.135 3.373 4.682 . 0 0 "[ . 1 . 2]" 1
345 1 15 LEU QB 1 21 VAL HA . . 5.500 3.704 3.134 4.378 . 0 0 "[ . 1 . 2]" 1
346 1 15 LEU QB 1 22 GLU H . . 3.520 3.383 2.658 3.736 0.216 8 0 "[ . 1 . 2]" 1
347 1 15 LEU QB 1 23 PHE HA . . 5.430 4.040 3.620 4.443 . 0 0 "[ . 1 . 2]" 1
348 1 15 LEU QB 1 57 HIS HA . . 5.500 4.255 3.940 4.717 . 0 0 "[ . 1 . 2]" 1
349 1 15 LEU QB 1 58 ALA H . . 5.500 5.660 5.499 5.810 0.310 20 0 "[ . 1 . 2]" 1
350 1 15 LEU QB 1 58 ALA HA . . 5.500 4.869 4.467 5.170 . 0 0 "[ . 1 . 2]" 1
351 1 15 LEU QD 1 16 LYS H . . 3.620 3.445 3.280 3.820 0.200 5 0 "[ . 1 . 2]" 1
352 1 15 LEU QD 1 21 VAL H . . 5.400 4.134 3.587 4.524 . 0 0 "[ . 1 . 2]" 1
353 1 15 LEU QD 1 21 VAL HA . . 3.180 2.061 1.699 2.503 . 0 0 "[ . 1 . 2]" 1
354 1 15 LEU QD 1 21 VAL HB . . 4.390 4.192 3.730 4.403 0.013 7 0 "[ . 1 . 2]" 1
355 1 15 LEU QD 1 21 VAL QG . . 2.720 2.628 2.307 3.015 0.295 17 0 "[ . 1 . 2]" 1
356 1 15 LEU QD 1 22 GLU H . . 3.780 2.706 1.924 3.706 . 0 0 "[ . 1 . 2]" 1
357 1 15 LEU QD 1 22 GLU HA . . 4.800 3.741 3.284 4.559 . 0 0 "[ . 1 . 2]" 1
358 1 15 LEU QD 1 23 PHE H . . 4.170 3.349 2.849 4.199 0.029 5 0 "[ . 1 . 2]" 1
359 1 15 LEU QD 1 23 PHE HA . . 3.330 2.183 1.846 2.726 . 0 0 "[ . 1 . 2]" 1
360 1 15 LEU QD 1 23 PHE HB2 . . 4.460 4.315 3.837 4.687 0.227 8 0 "[ . 1 . 2]" 1
361 1 15 LEU QD 1 23 PHE HB3 . . 4.190 3.854 3.603 4.157 . 0 0 "[ . 1 . 2]" 1
362 1 15 LEU QD 1 23 PHE QD . . 3.140 2.062 1.796 2.438 . 0 0 "[ . 1 . 2]" 1
363 1 15 LEU QD 1 24 ARG H . . 4.030 3.376 3.061 3.747 . 0 0 "[ . 1 . 2]" 1
364 1 15 LEU QD 1 24 ARG HB3 . . 5.440 4.941 4.738 5.240 . 0 0 "[ . 1 . 2]" 1
365 1 15 LEU QD 1 25 ASP H . . 5.440 5.065 4.865 5.441 0.001 2 0 "[ . 1 . 2]" 1
366 1 15 LEU QD 1 58 ALA HA . . 4.140 3.497 2.835 4.310 0.170 4 0 "[ . 1 . 2]" 1
367 1 15 LEU QD 1 59 ARG H . . 4.570 2.467 1.926 3.485 . 0 0 "[ . 1 . 2]" 1
368 1 15 LEU QD 1 59 ARG QB . . 3.760 1.964 1.745 2.244 . 0 0 "[ . 1 . 2]" 1
369 1 15 LEU QD 1 59 ARG QD . . 3.900 3.487 2.091 4.159 0.259 10 0 "[ . 1 . 2]" 1
370 1 15 LEU QD 1 60 TYR H . . 5.440 5.010 4.582 5.480 0.040 19 0 "[ . 1 . 2]" 1
371 1 15 LEU MD1 1 16 LYS H . . 4.800 3.778 3.345 4.618 . 0 0 "[ . 1 . 2]" 1
372 1 15 LEU MD1 1 21 VAL HA . . 4.120 2.326 1.705 4.146 0.026 5 0 "[ . 1 . 2]" 1
373 1 15 LEU MD1 1 22 GLU H . . 5.250 3.008 1.926 5.142 . 0 0 "[ . 1 . 2]" 1
374 1 15 LEU MD1 1 23 PHE H . . 5.500 3.900 2.863 5.540 0.040 18 0 "[ . 1 . 2]" 1
375 1 15 LEU MD1 1 23 PHE QD . . 3.720 2.738 1.843 4.102 0.382 18 0 "[ . 1 . 2]" 1
376 1 15 LEU MD1 1 59 ARG QB . . 4.520 3.211 1.937 4.458 . 0 0 "[ . 1 . 2]" 1
377 1 15 LEU MD2 1 16 LYS H . . 4.800 4.423 3.463 4.836 0.036 12 0 "[ . 1 . 2]" 1
378 1 15 LEU MD2 1 21 VAL HA . . 4.120 3.512 1.805 4.165 0.045 11 0 "[ . 1 . 2]" 1
379 1 15 LEU MD2 1 22 GLU H . . 5.250 4.500 2.158 5.317 0.067 6 0 "[ . 1 . 2]" 1
380 1 15 LEU MD2 1 23 PHE H . . 5.500 4.873 3.105 5.635 0.135 6 0 "[ . 1 . 2]" 1
381 1 15 LEU MD2 1 23 PHE QD . . 3.720 2.866 1.799 3.854 0.134 8 0 "[ . 1 . 2]" 1
382 1 15 LEU MD2 1 59 ARG QB . . 4.520 2.400 1.853 3.816 . 0 0 "[ . 1 . 2]" 1
383 1 16 LYS H 1 16 LYS HB2 . . 3.710 2.540 2.341 3.665 . 0 0 "[ . 1 . 2]" 1
384 1 16 LYS H 1 16 LYS QB . . 3.190 2.474 2.313 3.097 . 0 0 "[ . 1 . 2]" 1
385 1 16 LYS H 1 16 LYS HB3 . . 3.710 3.623 3.341 3.683 . 0 0 "[ . 1 . 2]" 1
386 1 16 LYS H 1 16 LYS QD . . 4.930 4.075 3.775 4.580 . 0 0 "[ . 1 . 2]" 1
387 1 16 LYS H 1 16 LYS QE . . 5.330 4.389 3.499 5.274 . 0 0 "[ . 1 . 2]" 1
388 1 16 LYS H 1 16 LYS QG . . 3.260 2.400 2.030 2.828 . 0 0 "[ . 1 . 2]" 1
389 1 16 LYS H 1 17 ASP H . . 3.710 2.465 2.287 2.701 . 0 0 "[ . 1 . 2]" 1
390 1 16 LYS H 1 17 ASP QB . . 5.250 4.449 3.790 4.779 . 0 0 "[ . 1 . 2]" 1
391 1 16 LYS H 1 22 GLU H . . 5.430 3.803 3.046 4.383 . 0 0 "[ . 1 . 2]" 1
392 1 16 LYS H 1 23 PHE QD . . 5.500 5.614 5.404 5.796 0.296 1 0 "[ . 1 . 2]" 1
393 1 16 LYS H 1 24 ARG HA . . 4.430 3.938 3.457 4.333 . 0 0 "[ . 1 . 2]" 1
394 1 16 LYS H 1 24 ARG HB2 . . 4.200 3.536 3.065 3.905 . 0 0 "[ . 1 . 2]" 1
395 1 16 LYS H 1 24 ARG QD . . 5.340 5.267 4.716 5.540 0.200 20 0 "[ . 1 . 2]" 1
396 1 16 LYS HA 1 16 LYS QG . . 3.600 2.501 2.376 3.321 . 0 0 "[ . 1 . 2]" 1
397 1 16 LYS HA 1 24 ARG H . . 5.130 4.507 3.820 4.982 . 0 0 "[ . 1 . 2]" 1
398 1 16 LYS HA 1 24 ARG HB2 . . 4.690 2.813 2.006 3.255 . 0 0 "[ . 1 . 2]" 1
399 1 16 LYS HA 1 24 ARG HB3 . . 4.750 4.488 3.555 4.885 0.135 1 0 "[ . 1 . 2]" 1
400 1 16 LYS HA 1 24 ARG QD . . 4.890 3.480 2.647 4.018 . 0 0 "[ . 1 . 2]" 1
401 1 16 LYS HA 1 24 ARG QG . . 4.290 3.425 2.720 3.961 . 0 0 "[ . 1 . 2]" 1
402 1 16 LYS QB 1 16 LYS QE . . 4.190 3.363 2.075 3.710 . 0 0 "[ . 1 . 2]" 1
403 1 16 LYS QB 1 17 ASP H . . 4.390 2.791 2.190 3.993 . 0 0 "[ . 1 . 2]" 1
404 1 16 LYS QB 1 17 ASP HA . . 5.340 4.312 3.879 4.747 . 0 0 "[ . 1 . 2]" 1
405 1 16 LYS QB 1 17 ASP QB . . 4.340 3.428 3.102 4.232 . 0 0 "[ . 1 . 2]" 1
406 1 16 LYS QB 1 24 ARG HA . . 4.310 4.047 3.017 4.483 0.173 18 0 "[ . 1 . 2]" 1
407 1 16 LYS HB2 1 16 LYS QE . . 4.910 3.713 2.114 4.248 . 0 0 "[ . 1 . 2]" 1
408 1 16 LYS HB2 1 24 ARG HA . . 4.960 4.605 4.196 5.029 0.069 18 0 "[ . 1 . 2]" 1
409 1 16 LYS HB3 1 16 LYS QE . . 4.910 3.926 2.996 4.272 . 0 0 "[ . 1 . 2]" 1
410 1 16 LYS HB3 1 24 ARG HA . . 4.960 4.533 3.070 5.035 0.075 18 0 "[ . 1 . 2]" 1
411 1 16 LYS QD 1 22 GLU QG . . 5.110 3.666 2.013 5.212 0.102 16 0 "[ . 1 . 2]" 1
412 1 16 LYS QE 1 16 LYS QG . . 2.940 2.284 2.163 2.498 . 0 0 "[ . 1 . 2]" 1
413 1 16 LYS QE 1 22 GLU HG2 . . 5.500 4.441 3.457 5.349 . 0 0 "[ . 1 . 2]" 1
414 1 16 LYS QE 1 22 GLU HG3 . . 5.500 4.456 3.250 5.511 0.011 4 0 "[ . 1 . 2]" 1
415 1 16 LYS QE 1 24 ARG H . . 4.890 4.785 4.293 5.183 0.293 15 0 "[ . 1 . 2]" 1
416 1 16 LYS QE 1 24 ARG HA . . 3.630 3.174 2.447 3.863 0.233 12 0 "[ . 1 . 2]" 1
417 1 16 LYS QE 2 5 GLN HE22 . . 5.130 4.122 3.299 5.267 0.137 15 0 "[ . 1 . 2]" 1
418 1 16 LYS QG 1 24 ARG H . . 4.530 3.389 2.805 3.597 . 0 0 "[ . 1 . 2]" 1
419 1 16 LYS QG 1 24 ARG HA . . 3.640 2.051 1.719 2.451 . 0 0 "[ . 1 . 2]" 1
420 1 16 LYS QG 1 24 ARG HB3 . . 4.810 4.199 3.788 4.627 . 0 0 "[ . 1 . 2]" 1
421 1 16 LYS QG 1 24 ARG QD . . 4.710 4.276 3.212 4.837 0.127 13 0 "[ . 1 . 2]" 1
422 1 16 LYS QG 1 24 ARG QG . . 3.420 2.995 2.070 3.514 0.094 13 0 "[ . 1 . 2]" 1
423 1 16 LYS HG2 1 17 ASP H . . 5.500 5.011 4.310 5.384 . 0 0 "[ . 1 . 2]" 1
424 1 16 LYS HG2 1 24 ARG HA . . 4.170 2.332 1.912 2.820 . 0 0 "[ . 1 . 2]" 1
425 1 16 LYS HG2 1 24 ARG HB3 . . 5.500 4.684 4.106 5.269 . 0 0 "[ . 1 . 2]" 1
426 1 16 LYS HG3 1 17 ASP H . . 5.500 4.358 3.837 4.897 . 0 0 "[ . 1 . 2]" 1
427 1 16 LYS HG3 1 24 ARG HA . . 4.170 2.462 1.741 3.937 . 0 0 "[ . 1 . 2]" 1
428 1 16 LYS HG3 1 24 ARG HB3 . . 5.500 4.817 4.118 5.728 0.228 3 0 "[ . 1 . 2]" 1
429 1 17 ASP H 1 17 ASP HB2 . . 4.200 3.096 2.703 3.543 . 0 0 "[ . 1 . 2]" 1
430 1 17 ASP H 1 17 ASP QB . . 3.680 2.593 2.305 2.825 . 0 0 "[ . 1 . 2]" 1
431 1 17 ASP H 1 17 ASP HB3 . . 4.200 2.825 2.495 3.866 . 0 0 "[ . 1 . 2]" 1
432 1 17 ASP H 1 18 VAL H . . 5.500 4.437 4.296 4.562 . 0 0 "[ . 1 . 2]" 1
433 1 17 ASP HA 1 18 VAL H . . 2.990 2.410 2.207 2.711 . 0 0 "[ . 1 . 2]" 1
434 1 17 ASP HA 1 18 VAL MG2 . . 4.360 3.986 3.689 4.137 . 0 0 "[ . 1 . 2]" 1
435 1 17 ASP QB 1 18 VAL H . . 4.000 3.336 3.016 3.514 . 0 0 "[ . 1 . 2]" 1
436 1 17 ASP QB 1 19 ALA H . . 4.640 3.552 2.570 3.735 . 0 0 "[ . 1 . 2]" 1
437 1 17 ASP QB 1 20 GLY H . . 4.800 2.330 2.067 2.923 . 0 0 "[ . 1 . 2]" 1
438 1 17 ASP QB 1 20 GLY QA . . 5.180 2.080 1.768 2.664 . 0 0 "[ . 1 . 2]" 1
439 1 17 ASP HB2 1 18 VAL H . . 4.560 3.948 3.772 4.098 . 0 0 "[ . 1 . 2]" 1
440 1 17 ASP HB3 1 18 VAL H . . 4.560 3.615 3.104 3.894 . 0 0 "[ . 1 . 2]" 1
441 1 18 VAL H 1 18 VAL HB . . 3.950 3.637 3.600 3.693 . 0 0 "[ . 1 . 2]" 1
442 1 18 VAL H 1 18 VAL MG1 . . 3.630 2.408 2.202 2.771 . 0 0 "[ . 1 . 2]" 1
443 1 18 VAL H 1 18 VAL MG2 . . 3.180 1.973 1.923 2.065 . 0 0 "[ . 1 . 2]" 1
444 1 18 VAL H 1 19 ALA H . . 3.670 2.671 2.262 2.853 . 0 0 "[ . 1 . 2]" 1
445 1 18 VAL HA 1 18 VAL MG1 . . 3.040 2.330 2.304 2.360 . 0 0 "[ . 1 . 2]" 1
446 1 18 VAL HA 1 18 VAL MG2 . . 3.470 3.268 3.255 3.278 . 0 0 "[ . 1 . 2]" 1
447 1 18 VAL HB 1 19 ALA H . . 3.550 3.602 3.518 3.790 0.240 20 0 "[ . 1 . 2]" 1
448 1 18 VAL HB 1 19 ALA MB . . 4.710 4.296 3.938 4.549 . 0 0 "[ . 1 . 2]" 1
449 1 18 VAL HB 1 20 GLY H . . 5.300 5.385 5.208 5.519 0.219 14 0 "[ . 1 . 2]" 1
450 1 18 VAL MG1 1 19 ALA H . . 4.030 4.026 3.976 4.069 0.039 20 0 "[ . 1 . 2]" 1
451 1 18 VAL MG2 1 19 ALA H . . 3.460 2.020 1.913 2.272 . 0 0 "[ . 1 . 2]" 1
452 1 18 VAL MG2 1 20 GLY H . . 4.250 3.830 3.439 4.354 0.104 20 0 "[ . 1 . 2]" 1
453 1 19 ALA H 1 19 ALA MB . . 2.750 2.333 2.278 2.449 . 0 0 "[ . 1 . 2]" 1
454 1 19 ALA H 1 20 GLY H . . 3.240 2.185 1.868 2.611 . 0 0 "[ . 1 . 2]" 1
455 1 19 ALA MB 1 20 GLY H . . 3.700 2.994 2.600 3.586 . 0 0 "[ . 1 . 2]" 1
456 1 19 ALA MB 1 20 GLY HA2 . . 5.000 4.011 3.839 4.336 . 0 0 "[ . 1 . 2]" 1
457 1 19 ALA MB 1 20 GLY QA . . 4.270 3.717 3.573 3.954 . 0 0 "[ . 1 . 2]" 1
458 1 19 ALA MB 1 20 GLY HA3 . . 5.000 4.401 4.172 4.691 . 0 0 "[ . 1 . 2]" 1
459 1 20 GLY QA 1 21 VAL H . . 2.650 2.175 2.118 2.290 . 0 0 "[ . 1 . 2]" 1
460 1 20 GLY QA 1 21 VAL QG . . 4.300 3.513 3.088 3.870 . 0 0 "[ . 1 . 2]" 1
461 1 20 GLY QA 1 22 GLU H . . 5.150 3.420 3.088 3.898 . 0 0 "[ . 1 . 2]" 1
462 1 20 GLY HA2 1 21 VAL H . . 3.410 2.230 2.148 2.530 . 0 0 "[ . 1 . 2]" 1
463 1 20 GLY HA3 1 21 VAL H . . 3.410 3.186 2.614 3.461 0.051 12 0 "[ . 1 . 2]" 1
464 1 21 VAL H 1 21 VAL HB . . 3.200 2.702 2.470 3.189 . 0 0 "[ . 1 . 2]" 1
465 1 21 VAL H 1 21 VAL MG1 . . 3.960 3.217 2.070 3.889 . 0 0 "[ . 1 . 2]" 1
466 1 21 VAL H 1 21 VAL QG . . 3.070 2.186 1.970 2.486 . 0 0 "[ . 1 . 2]" 1
467 1 21 VAL H 1 21 VAL MG2 . . 3.960 2.856 1.976 4.058 0.098 9 0 "[ . 1 . 2]" 1
468 1 21 VAL H 1 22 GLU H . . 3.460 3.021 1.759 3.683 0.223 13 0 "[ . 1 . 2]" 1
469 1 21 VAL H 1 22 GLU QG . . 5.340 4.160 3.312 5.233 . 0 0 "[ . 1 . 2]" 1
470 1 21 VAL HA 1 21 VAL MG1 . . 3.220 2.753 2.332 3.275 0.055 2 0 "[ . 1 . 2]" 1
471 1 21 VAL HA 1 21 VAL MG2 . . 3.220 2.444 2.284 2.631 . 0 0 "[ . 1 . 2]" 1
472 1 21 VAL HA 1 22 GLU H . . 2.980 2.781 2.302 3.188 0.208 9 0 "[ . 1 . 2]" 1
473 1 21 VAL HA 2 68 LEU QD . . 5.300 4.393 3.332 4.846 . 0 0 "[ . 1 . 2]" 1
474 1 21 VAL HB 2 68 LEU QD . . 4.340 4.181 3.666 4.477 0.137 4 0 "[ . 1 . 2]" 1
475 1 21 VAL QG 2 68 LEU QB . . 4.140 3.011 2.617 3.824 . 0 0 "[ . 1 . 2]" 1
476 1 21 VAL QG 2 68 LEU QD . . 2.720 1.966 1.717 2.157 . 0 0 "[ . 1 . 2]" 1
477 1 21 VAL MG1 1 22 GLU H . . 4.380 3.872 3.209 4.344 . 0 0 "[ . 1 . 2]" 1
478 1 21 VAL MG1 2 68 LEU HG . . 4.960 3.605 2.112 5.025 0.065 3 0 "[ . 1 . 2]" 1
479 1 21 VAL MG2 1 22 GLU H . . 4.380 4.315 4.191 4.391 0.011 12 0 "[ . 1 . 2]" 1
480 1 21 VAL MG2 2 68 LEU HG . . 4.960 3.852 2.351 5.087 0.127 12 0 "[ . 1 . 2]" 1
481 1 22 GLU H 1 22 GLU QB . . 3.640 2.629 2.319 3.262 . 0 0 "[ . 1 . 2]" 1
482 1 22 GLU H 1 22 GLU HG2 . . 4.880 3.449 2.137 4.413 . 0 0 "[ . 1 . 2]" 1
483 1 22 GLU H 1 22 GLU QG . . 4.230 2.974 2.123 3.613 . 0 0 "[ . 1 . 2]" 1
484 1 22 GLU H 1 22 GLU HG3 . . 4.880 3.611 2.730 3.946 . 0 0 "[ . 1 . 2]" 1
485 1 22 GLU H 1 23 PHE H . . 4.540 4.214 3.944 4.562 0.022 15 0 "[ . 1 . 2]" 1
486 1 22 GLU HA 1 22 GLU QG . . 3.660 2.868 2.337 3.586 . 0 0 "[ . 1 . 2]" 1
487 1 22 GLU HA 1 23 PHE H . . 2.700 2.222 2.157 2.325 . 0 0 "[ . 1 . 2]" 1
488 1 22 GLU HA 1 23 PHE HB2 . . 5.250 4.679 4.534 4.898 . 0 0 "[ . 1 . 2]" 1
489 1 22 GLU HA 2 5 GLN HE21 . . 5.500 4.569 3.144 5.653 0.153 15 0 "[ . 1 . 2]" 1
490 1 22 GLU HA 2 5 GLN HE22 . . 5.240 3.145 1.979 4.308 . 0 0 "[ . 1 . 2]" 1
491 1 22 GLU QB 1 23 PHE H . . 3.730 3.454 2.936 3.821 0.091 3 0 "[ . 1 . 2]" 1
492 1 22 GLU QB 2 5 GLN HE21 . . 4.950 4.290 3.217 5.038 0.088 11 0 "[ . 1 . 2]" 1
493 1 22 GLU QB 2 5 GLN HE22 . . 4.080 3.447 2.158 4.145 0.065 10 0 "[ . 1 . 2]" 1
494 1 22 GLU HB2 1 23 PHE H . . 4.520 4.170 3.009 4.568 0.048 19 0 "[ . 1 . 2]" 1
495 1 22 GLU HB3 1 23 PHE H . . 4.520 3.821 3.012 4.409 . 0 0 "[ . 1 . 2]" 1
496 1 22 GLU QG 1 23 PHE H . . 4.850 4.476 3.780 5.017 0.167 3 0 "[ . 1 . 2]" 1
497 1 23 PHE H 1 23 PHE HB2 . . 3.110 2.559 2.460 2.708 . 0 0 "[ . 1 . 2]" 1
498 1 23 PHE H 1 23 PHE HB3 . . 3.710 3.622 3.569 3.676 . 0 0 "[ . 1 . 2]" 1
499 1 23 PHE H 1 23 PHE QD . . 3.480 3.053 2.665 3.198 . 0 0 "[ . 1 . 2]" 1
500 1 23 PHE H 1 24 ARG H . . 4.720 4.473 4.268 4.627 . 0 0 "[ . 1 . 2]" 1
501 1 23 PHE H 1 26 LEU QD . . 4.410 4.004 3.667 4.349 . 0 0 "[ . 1 . 2]" 1
502 1 23 PHE H 2 5 GLN HE21 . . 4.490 3.425 2.251 4.431 . 0 0 "[ . 1 . 2]" 1
503 1 23 PHE H 2 5 GLN HE22 . . 3.970 2.258 1.655 3.035 . 0 0 "[ . 1 . 2]" 1
504 1 23 PHE HA 1 23 PHE QD . . 3.530 2.310 2.143 2.624 . 0 0 "[ . 1 . 2]" 1
505 1 23 PHE HA 1 24 ARG H . . 2.890 2.148 2.091 2.205 . 0 0 "[ . 1 . 2]" 1
506 1 23 PHE HB2 1 24 ARG H . . 4.620 4.279 4.023 4.463 . 0 0 "[ . 1 . 2]" 1
507 1 23 PHE HB2 1 26 LEU HA . . 5.130 4.183 3.624 4.630 . 0 0 "[ . 1 . 2]" 1
508 1 23 PHE HB2 1 26 LEU QD . . 3.220 2.253 2.090 2.430 . 0 0 "[ . 1 . 2]" 1
509 1 23 PHE HB2 1 26 LEU HG . . 5.000 4.646 3.753 5.014 0.014 9 0 "[ . 1 . 2]" 1
510 1 23 PHE HB3 1 24 ARG H . . 3.910 3.463 2.934 3.890 . 0 0 "[ . 1 . 2]" 1
511 1 23 PHE HB3 1 25 ASP H . . 3.730 3.314 2.913 3.805 0.075 5 0 "[ . 1 . 2]" 1
512 1 23 PHE HB3 1 26 LEU H . . 5.290 4.828 4.449 5.350 0.060 5 0 "[ . 1 . 2]" 1
513 1 23 PHE HB3 1 26 LEU QD . . 3.590 2.634 2.223 3.108 . 0 0 "[ . 1 . 2]" 1
514 1 23 PHE HB3 1 26 LEU HG . . 5.500 5.324 4.248 5.762 0.262 9 0 "[ . 1 . 2]" 1
515 1 23 PHE HB3 2 5 GLN HE22 . . 5.140 4.391 3.649 5.184 0.044 12 0 "[ . 1 . 2]" 1
516 1 23 PHE QD 1 24 ARG H . . 4.380 3.972 3.674 4.377 . 0 0 "[ . 1 . 2]" 1
517 1 23 PHE QD 1 26 LEU QD . . 3.470 2.423 1.907 3.148 . 0 0 "[ . 1 . 2]" 1
518 1 23 PHE QD 2 7 LEU QD . . 4.550 3.465 2.360 4.613 0.063 3 0 "[ . 1 . 2]" 1
519 1 24 ARG H 1 24 ARG HB2 . . 2.970 2.489 2.340 2.637 . 0 0 "[ . 1 . 2]" 1
520 1 24 ARG H 1 24 ARG HB3 . . 3.680 2.532 2.384 2.706 . 0 0 "[ . 1 . 2]" 1
521 1 24 ARG H 1 24 ARG QD . . 4.770 4.459 4.361 4.682 . 0 0 "[ . 1 . 2]" 1
522 1 24 ARG H 1 24 ARG QG . . 4.510 3.994 3.956 4.013 . 0 0 "[ . 1 . 2]" 1
523 1 24 ARG H 1 25 ASP H . . 3.220 2.755 2.585 3.063 . 0 0 "[ . 1 . 2]" 1
524 1 24 ARG H 1 26 LEU QD . . 5.290 4.847 4.385 5.309 0.019 1 0 "[ . 1 . 2]" 1
525 1 24 ARG HA 1 24 ARG QD . . 4.470 4.109 4.030 4.366 . 0 0 "[ . 1 . 2]" 1
526 1 24 ARG HA 1 24 ARG QG . . 3.480 2.541 2.423 2.677 . 0 0 "[ . 1 . 2]" 1
527 1 24 ARG HB2 1 24 ARG QD . . 3.000 2.464 2.353 2.787 . 0 0 "[ . 1 . 2]" 1
528 1 24 ARG HB2 1 25 ASP H . . 4.040 3.819 3.685 3.989 . 0 0 "[ . 1 . 2]" 1
529 1 24 ARG HB3 1 24 ARG QD . . 3.540 2.516 2.346 2.891 . 0 0 "[ . 1 . 2]" 1
530 1 24 ARG HB3 1 25 ASP H . . 3.210 2.529 2.321 2.761 . 0 0 "[ . 1 . 2]" 1
531 1 24 ARG HB3 1 25 ASP HB2 . . 4.900 4.073 3.511 4.466 . 0 0 "[ . 1 . 2]" 1
532 1 24 ARG QG 1 25 ASP H . . 4.330 3.587 3.231 3.915 . 0 0 "[ . 1 . 2]" 1
533 1 24 ARG QG 1 25 ASP HB2 . . 4.700 3.239 2.425 4.025 . 0 0 "[ . 1 . 2]" 1
534 1 24 ARG HG2 1 25 ASP H . . 5.090 3.725 3.320 4.112 . 0 0 "[ . 1 . 2]" 1
535 1 24 ARG HG2 1 25 ASP HB2 . . 5.500 3.290 2.440 4.118 . 0 0 "[ . 1 . 2]" 1
536 1 24 ARG HG3 1 25 ASP H . . 5.090 4.695 4.408 4.917 . 0 0 "[ . 1 . 2]" 1
537 1 24 ARG HG3 1 25 ASP HB2 . . 5.500 4.882 4.158 5.674 0.174 5 0 "[ . 1 . 2]" 1
538 1 25 ASP H 1 25 ASP HB2 . . 3.470 3.223 2.588 3.487 0.017 20 0 "[ . 1 . 2]" 1
539 1 25 ASP H 1 25 ASP HB3 . . 3.610 3.130 2.780 3.800 0.190 7 0 "[ . 1 . 2]" 1
540 1 25 ASP H 1 26 LEU H . . 4.080 4.119 3.899 4.236 0.156 11 0 "[ . 1 . 2]" 1
541 1 25 ASP H 1 26 LEU QD . . 4.830 3.869 3.502 4.565 . 0 0 "[ . 1 . 2]" 1
542 1 25 ASP H 1 28 LYS H . . 5.220 4.449 3.872 4.996 . 0 0 "[ . 1 . 2]" 1
543 1 25 ASP HA 1 26 LEU H . . 2.770 2.158 2.087 2.271 . 0 0 "[ . 1 . 2]" 1
544 1 25 ASP HA 1 26 LEU HB2 . . 5.040 4.479 4.309 4.796 . 0 0 "[ . 1 . 2]" 1
545 1 25 ASP HA 1 26 LEU HG . . 5.500 5.113 3.139 5.666 0.166 6 0 "[ . 1 . 2]" 1
546 1 25 ASP HB2 1 26 LEU H . . 4.930 4.237 3.969 4.506 . 0 0 "[ . 1 . 2]" 1
547 1 25 ASP HB2 1 27 SER H . . 5.010 4.590 3.894 5.021 0.011 11 0 "[ . 1 . 2]" 1
548 1 25 ASP HB2 1 28 LYS H . . 4.670 4.267 2.958 4.684 0.014 18 0 "[ . 1 . 2]" 1
549 1 25 ASP HB2 1 28 LYS HB2 . . 4.640 3.585 1.981 4.498 . 0 0 "[ . 1 . 2]" 1
550 1 25 ASP HB3 1 26 LEU H . . 5.370 3.961 3.215 4.359 . 0 0 "[ . 1 . 2]" 1
551 1 25 ASP HB3 1 27 SER H . . 4.770 3.642 2.478 4.301 . 0 0 "[ . 1 . 2]" 1
552 1 25 ASP HB3 1 28 LYS H . . 4.140 2.953 2.294 3.366 . 0 0 "[ . 1 . 2]" 1
553 1 25 ASP HB3 1 28 LYS HB2 . . 4.360 2.429 1.780 3.515 . 0 0 "[ . 1 . 2]" 1
554 1 25 ASP HB3 1 28 LYS HB3 . . 4.970 3.964 3.404 4.984 0.014 2 0 "[ . 1 . 2]" 1
555 1 25 ASP HB3 1 28 LYS HD2 . . 5.500 4.314 2.143 5.637 0.137 10 0 "[ . 1 . 2]" 1
556 1 25 ASP HB3 1 28 LYS QD . . 4.660 3.822 2.131 4.700 0.040 2 0 "[ . 1 . 2]" 1
557 1 25 ASP HB3 1 28 LYS HD3 . . 5.500 4.564 3.505 5.555 0.055 2 0 "[ . 1 . 2]" 1
558 1 25 ASP HB3 1 28 LYS QG . . 4.520 2.539 1.794 3.731 . 0 0 "[ . 1 . 2]" 1
559 1 25 ASP HB3 1 29 VAL QG . . 5.440 4.894 4.586 5.540 0.100 19 0 "[ . 1 . 2]" 1
560 1 26 LEU H 1 26 LEU HB2 . . 3.780 2.383 2.262 2.546 . 0 0 "[ . 1 . 2]" 1
561 1 26 LEU H 1 26 LEU HB3 . . 3.800 3.559 3.508 3.635 . 0 0 "[ . 1 . 2]" 1
562 1 26 LEU H 1 26 LEU MD1 . . 4.180 3.481 2.918 3.800 . 0 0 "[ . 1 . 2]" 1
563 1 26 LEU H 1 26 LEU QD . . 3.580 2.188 1.714 3.186 . 0 0 "[ . 1 . 2]" 1
564 1 26 LEU H 1 26 LEU MD2 . . 4.180 2.283 1.726 3.695 . 0 0 "[ . 1 . 2]" 1
565 1 26 LEU H 1 26 LEU HG . . 3.210 3.525 2.029 3.964 0.754 16 14 "[ * .*-*** * **+****]" 1
566 1 26 LEU H 1 27 SER H . . 3.330 2.575 2.272 2.764 . 0 0 "[ . 1 . 2]" 1
567 1 26 LEU H 1 28 LYS H . . 4.710 3.946 3.346 4.388 . 0 0 "[ . 1 . 2]" 1
568 1 26 LEU HA 1 26 LEU QD . . 2.830 2.072 1.926 2.314 . 0 0 "[ . 1 . 2]" 1
569 1 26 LEU HA 1 26 LEU HG . . 4.060 3.607 2.984 3.792 . 0 0 "[ . 1 . 2]" 1
570 1 26 LEU HA 1 28 LYS H . . 4.540 3.776 3.049 4.088 . 0 0 "[ . 1 . 2]" 1
571 1 26 LEU HA 1 29 VAL QG . . 3.640 1.985 1.768 2.749 . 0 0 "[ . 1 . 2]" 1
572 1 26 LEU HA 2 7 LEU QD . . 5.440 4.771 4.411 5.147 . 0 0 "[ . 1 . 2]" 1
573 1 26 LEU HA 2 34 ALA MB . . 4.310 3.194 2.801 3.700 . 0 0 "[ . 1 . 2]" 1
574 1 26 LEU HB2 1 27 SER H . . 3.550 3.294 2.689 3.670 0.120 8 0 "[ . 1 . 2]" 1
575 1 26 LEU HB2 2 34 ALA MB . . 4.030 3.658 3.247 4.046 0.016 4 0 "[ . 1 . 2]" 1
576 1 26 LEU HB2 2 35 TYR H . . 5.500 4.855 4.020 5.570 0.070 2 0 "[ . 1 . 2]" 1
577 1 26 LEU HB3 1 27 SER H . . 4.550 4.089 3.781 4.297 . 0 0 "[ . 1 . 2]" 1
578 1 26 LEU HB3 1 29 VAL QG . . 4.720 3.423 2.976 3.941 . 0 0 "[ . 1 . 2]" 1
579 1 26 LEU QD 1 27 SER H . . 4.750 3.961 3.757 4.308 . 0 0 "[ . 1 . 2]" 1
580 1 26 LEU QD 1 29 VAL H . . 5.440 4.644 4.313 5.067 . 0 0 "[ . 1 . 2]" 1
581 1 26 LEU QD 2 5 GLN HE21 . . 3.690 2.539 1.498 3.731 0.041 2 0 "[ . 1 . 2]" 1
582 1 26 LEU QD 2 5 GLN HE22 . . 3.730 3.308 2.483 3.892 0.162 14 0 "[ . 1 . 2]" 1
583 1 26 LEU QD 2 5 GLN HG2 . . 5.020 3.636 2.113 4.669 . 0 0 "[ . 1 . 2]" 1
584 1 26 LEU QD 2 7 LEU QD . . 3.000 2.045 1.526 2.600 . 0 0 "[ . 1 . 2]" 1
585 1 26 LEU QD 2 34 ALA MB . . 3.400 2.159 1.797 2.766 . 0 0 "[ . 1 . 2]" 1
586 1 26 LEU QD 2 35 TYR H . . 4.490 3.625 2.637 4.251 . 0 0 "[ . 1 . 2]" 1
587 1 26 LEU QD 2 35 TYR HA . . 4.380 4.091 3.100 4.491 0.111 8 0 "[ . 1 . 2]" 1
588 1 26 LEU QD 2 36 PRO HA . . 3.460 2.282 1.853 3.064 . 0 0 "[ . 1 . 2]" 1
589 1 26 LEU QD 2 36 PRO QB . . 3.490 2.964 2.596 3.443 . 0 0 "[ . 1 . 2]" 1
590 1 26 LEU QD 2 36 PRO QG . . 4.760 4.274 2.412 4.715 . 0 0 "[ . 1 . 2]" 1
591 1 26 LEU QD 2 37 SER H . . 4.590 4.506 3.924 4.719 0.129 19 0 "[ . 1 . 2]" 1
592 1 26 LEU MD1 1 27 SER H . . 5.500 4.760 4.233 5.021 . 0 0 "[ . 1 . 2]" 1
593 1 26 LEU MD1 1 28 LYS H . . 5.500 5.484 5.086 6.107 0.607 2 1 "[ + . 1 . 2]" 1
594 1 26 LEU MD1 2 5 GLN HB2 . . 5.500 3.840 2.018 5.224 . 0 0 "[ . 1 . 2]" 1
595 1 26 LEU MD1 2 5 GLN HE21 . . 4.690 3.360 2.198 4.812 0.122 2 0 "[ . 1 . 2]" 1
596 1 26 LEU MD1 2 5 GLN HE22 . . 5.180 3.946 3.010 5.040 . 0 0 "[ . 1 . 2]" 1
597 1 26 LEU MD1 2 7 LEU H . . 5.500 4.214 3.361 5.301 . 0 0 "[ . 1 . 2]" 1
598 1 26 LEU MD1 2 34 ALA MB . . 4.180 2.289 1.799 3.095 . 0 0 "[ . 1 . 2]" 1
599 1 26 LEU MD2 1 27 SER H . . 5.500 4.274 3.956 4.831 . 0 0 "[ . 1 . 2]" 1
600 1 26 LEU MD2 1 28 LYS H . . 5.500 5.153 4.639 5.476 . 0 0 "[ . 1 . 2]" 1
601 1 26 LEU MD2 2 5 GLN HB2 . . 5.500 2.748 1.685 5.270 . 0 0 "[ . 1 . 2]" 1
602 1 26 LEU MD2 2 5 GLN HE21 . . 4.690 2.693 1.518 3.886 . 0 0 "[ . 1 . 2]" 1
603 1 26 LEU MD2 2 5 GLN HE22 . . 5.180 3.712 2.504 4.765 . 0 0 "[ . 1 . 2]" 1
604 1 26 LEU MD2 2 7 LEU H . . 5.500 5.163 3.967 5.667 0.167 4 0 "[ . 1 . 2]" 1
605 1 26 LEU MD2 2 34 ALA MB . . 4.180 3.816 2.038 4.301 0.121 3 0 "[ . 1 . 2]" 1
606 1 26 LEU HG 2 5 GLN HE21 . . 5.390 4.601 2.504 5.522 0.132 19 0 "[ . 1 . 2]" 1
607 1 26 LEU HG 2 34 ALA MB . . 4.490 3.572 3.005 4.461 . 0 0 "[ . 1 . 2]" 1
608 1 27 SER H 1 27 SER QB . . 2.980 2.433 2.243 2.618 . 0 0 "[ . 1 . 2]" 1
609 1 27 SER H 1 28 LYS H . . 2.920 2.296 1.963 2.625 . 0 0 "[ . 1 . 2]" 1
610 1 27 SER H 1 28 LYS QG . . 5.010 4.053 3.572 4.522 . 0 0 "[ . 1 . 2]" 1
611 1 27 SER H 1 29 VAL H . . 4.320 3.937 3.522 4.343 0.023 11 0 "[ . 1 . 2]" 1
612 1 27 SER H 1 29 VAL QG . . 4.690 3.972 3.551 4.453 . 0 0 "[ . 1 . 2]" 1
613 1 27 SER HA 1 29 VAL H . . 4.560 3.746 3.543 4.161 . 0 0 "[ . 1 . 2]" 1
614 1 28 LYS H 1 28 LYS HB2 . . 3.000 2.505 2.234 2.687 . 0 0 "[ . 1 . 2]" 1
615 1 28 LYS H 1 28 LYS HB3 . . 3.970 3.690 3.532 3.819 . 0 0 "[ . 1 . 2]" 1
616 1 28 LYS H 1 28 LYS HG2 . . 4.060 3.207 2.374 4.057 . 0 0 "[ . 1 . 2]" 1
617 1 28 LYS H 1 28 LYS QG . . 3.410 2.743 2.351 3.136 . 0 0 "[ . 1 . 2]" 1
618 1 28 LYS H 1 28 LYS HG3 . . 4.060 3.550 2.568 4.148 0.088 5 0 "[ . 1 . 2]" 1
619 1 28 LYS H 1 29 VAL H . . 3.000 2.469 2.071 2.720 . 0 0 "[ . 1 . 2]" 1
620 1 28 LYS H 1 29 VAL QG . . 3.950 3.437 2.949 3.775 . 0 0 "[ . 1 . 2]" 1
621 1 28 LYS HA 1 28 LYS QD . . 3.900 2.941 1.968 4.185 0.285 18 0 "[ . 1 . 2]" 1
622 1 28 LYS HA 1 28 LYS HG2 . . 3.930 2.851 2.407 3.225 . 0 0 "[ . 1 . 2]" 1
623 1 28 LYS HA 1 28 LYS QG . . 3.380 2.734 2.326 3.072 . 0 0 "[ . 1 . 2]" 1
624 1 28 LYS HA 1 28 LYS HG3 . . 3.930 3.530 3.058 3.862 . 0 0 "[ . 1 . 2]" 1
625 1 28 LYS HB3 1 29 VAL H . . 4.750 4.341 3.786 4.528 . 0 0 "[ . 1 . 2]" 1
626 1 29 VAL H 1 29 VAL HB . . 3.790 3.277 2.441 3.785 . 0 0 "[ . 1 . 2]" 1
627 1 29 VAL H 1 29 VAL QG . . 3.060 2.103 1.884 2.462 . 0 0 "[ . 1 . 2]" 1
628 1 29 VAL H 1 30 GLU H . . 4.740 4.284 4.046 4.621 . 0 0 "[ . 1 . 2]" 1
629 1 29 VAL H 1 30 GLU QB . . 5.500 5.529 5.404 5.624 0.124 18 0 "[ . 1 . 2]" 1
630 1 29 VAL H 2 34 ALA MB . . 5.500 4.725 4.106 5.309 . 0 0 "[ . 1 . 2]" 1
631 1 29 VAL HA 1 30 GLU H . . 2.970 2.186 2.113 2.308 . 0 0 "[ . 1 . 2]" 1
632 1 29 VAL HA 1 31 PHE H . . 5.500 5.454 5.219 5.595 0.095 20 0 "[ . 1 . 2]" 1
633 1 29 VAL HB 1 30 GLU H . . 4.650 3.898 2.561 4.565 . 0 0 "[ . 1 . 2]" 1
634 1 29 VAL QG 1 30 GLU H . . 4.210 3.506 3.186 3.798 . 0 0 "[ . 1 . 2]" 1
635 1 29 VAL QG 1 31 PHE H . . 4.780 3.930 3.381 4.243 . 0 0 "[ . 1 . 2]" 1
636 1 29 VAL QG 1 31 PHE QE . . 4.250 2.628 2.022 3.239 . 0 0 "[ . 1 . 2]" 1
637 1 29 VAL QG 2 34 ALA H . . 5.440 4.331 3.483 5.477 0.037 1 0 "[ . 1 . 2]" 1
638 1 29 VAL QG 2 34 ALA MB . . 3.300 2.389 1.911 3.157 . 0 0 "[ . 1 . 2]" 1
639 1 30 GLU H 1 30 GLU QB . . 3.240 2.358 2.264 2.641 . 0 0 "[ . 1 . 2]" 1
640 1 30 GLU H 1 30 GLU HG2 . . 4.900 4.462 4.410 4.532 . 0 0 "[ . 1 . 2]" 1
641 1 30 GLU H 1 30 GLU HG3 . . 4.760 4.615 4.530 4.778 0.018 15 0 "[ . 1 . 2]" 1
642 1 30 GLU HA 1 30 GLU HG2 . . 4.190 3.065 2.881 3.223 . 0 0 "[ . 1 . 2]" 1
643 1 30 GLU HA 1 30 GLU HG3 . . 3.850 2.624 2.488 2.733 . 0 0 "[ . 1 . 2]" 1
644 1 30 GLU HA 1 31 PHE H . . 2.690 2.151 2.123 2.183 . 0 0 "[ . 1 . 2]" 1
645 1 30 GLU QB 1 31 PHE H . . 4.150 3.947 3.891 3.988 . 0 0 "[ . 1 . 2]" 1
646 1 30 GLU QB 1 60 TYR QE . . 3.650 2.075 1.616 3.371 . 0 0 "[ . 1 . 2]" 1
647 1 30 GLU HG2 1 31 PHE H . . 4.640 3.612 3.283 3.907 . 0 0 "[ . 1 . 2]" 1
648 1 30 GLU HG2 1 32 VAL H . . 5.500 4.038 3.470 4.384 . 0 0 "[ . 1 . 2]" 1
649 1 30 GLU HG2 1 32 VAL HA . . 5.290 3.274 2.825 3.624 . 0 0 "[ . 1 . 2]" 1
650 1 30 GLU HG2 1 32 VAL MG2 . . 3.960 3.581 3.313 3.879 . 0 0 "[ . 1 . 2]" 1
651 1 30 GLU HG2 1 60 TYR QE . . 4.990 3.290 2.774 4.649 . 0 0 "[ . 1 . 2]" 1
652 1 30 GLU HG3 1 31 PHE H . . 3.760 3.821 3.730 3.920 0.160 20 0 "[ . 1 . 2]" 1
653 1 30 GLU HG3 1 32 VAL HA . . 5.190 4.742 4.271 5.138 . 0 0 "[ . 1 . 2]" 1
654 1 30 GLU HG3 1 32 VAL MG2 . . 5.250 5.043 4.632 5.353 0.103 13 0 "[ . 1 . 2]" 1
655 1 31 PHE H 1 31 PHE QB . . 3.660 2.464 2.397 2.522 . 0 0 "[ . 1 . 2]" 1
656 1 31 PHE H 1 31 PHE QD . . 4.660 2.240 1.941 2.879 . 0 0 "[ . 1 . 2]" 1
657 1 31 PHE H 1 31 PHE QE . . 4.820 4.162 3.999 4.432 . 0 0 "[ . 1 . 2]" 1
658 1 31 PHE H 1 32 VAL H . . 4.840 4.298 4.105 4.424 . 0 0 "[ . 1 . 2]" 1
659 1 31 PHE H 1 32 VAL HA . . 5.500 5.293 5.165 5.444 . 0 0 "[ . 1 . 2]" 1
660 1 31 PHE H 1 32 VAL MG2 . . 5.430 5.157 4.987 5.290 . 0 0 "[ . 1 . 2]" 1
661 1 31 PHE HA 1 31 PHE QD . . 3.460 2.968 2.599 3.170 . 0 0 "[ . 1 . 2]" 1
662 1 31 PHE HA 1 31 PHE QE . . 5.030 4.702 4.598 4.811 . 0 0 "[ . 1 . 2]" 1
663 1 31 PHE HA 1 32 VAL H . . 3.090 2.154 2.126 2.193 . 0 0 "[ . 1 . 2]" 1
664 1 31 PHE QD 1 32 VAL H . . 5.150 4.623 4.322 4.819 . 0 0 "[ . 1 . 2]" 1
665 1 31 PHE QD 2 9 ILE MD . . 3.750 3.274 2.727 3.581 . 0 0 "[ . 1 . 2]" 1
666 1 31 PHE QE 2 9 ILE HB . . 4.510 3.049 2.454 3.421 . 0 0 "[ . 1 . 2]" 1
667 1 31 PHE QE 2 9 ILE MD . . 3.590 1.669 1.503 1.876 . 0 0 "[ . 1 . 2]" 1
668 1 31 PHE QE 2 9 ILE HG13 . . 5.020 3.539 3.160 3.997 . 0 0 "[ . 1 . 2]" 1
669 1 31 PHE QE 2 9 ILE MG . . 5.100 3.403 2.345 3.890 . 0 0 "[ . 1 . 2]" 1
670 1 31 PHE QE 2 34 ALA H . . 5.090 4.074 3.621 4.501 . 0 0 "[ . 1 . 2]" 1
671 1 31 PHE QE 2 34 ALA MB . . 4.340 3.452 3.007 3.877 . 0 0 "[ . 1 . 2]" 1
672 1 32 VAL H 1 32 VAL HB . . 3.380 2.608 2.513 2.667 . 0 0 "[ . 1 . 2]" 1
673 1 32 VAL H 1 32 VAL MG1 . . 4.520 3.810 3.793 3.837 . 0 0 "[ . 1 . 2]" 1
674 1 32 VAL H 1 32 VAL MG2 . . 3.130 1.964 1.874 2.075 . 0 0 "[ . 1 . 2]" 1
675 1 32 VAL HA 1 32 VAL MG1 . . 3.130 2.469 2.433 2.495 . 0 0 "[ . 1 . 2]" 1
676 1 32 VAL HA 1 32 VAL MG2 . . 3.000 2.476 2.435 2.543 . 0 0 "[ . 1 . 2]" 1
677 1 32 VAL HB 1 33 GLY H . . 4.280 2.774 2.542 3.003 . 0 0 "[ . 1 . 2]" 1
678 1 32 VAL HB 1 60 TYR QD . . 5.470 4.649 4.448 5.215 . 0 0 "[ . 1 . 2]" 1
679 1 32 VAL MG1 1 33 GLY QA . . 5.340 3.892 3.669 4.099 . 0 0 "[ . 1 . 2]" 1
680 1 32 VAL MG1 1 48 LYS HD3 . . 3.910 2.388 2.132 3.038 . 0 0 "[ . 1 . 2]" 1
681 1 32 VAL MG1 1 48 LYS HE2 . . 3.940 3.069 2.077 3.458 . 0 0 "[ . 1 . 2]" 1
682 1 32 VAL MG1 1 48 LYS HE3 . . 4.420 4.264 3.590 4.505 0.085 17 0 "[ . 1 . 2]" 1
683 1 32 VAL MG1 1 60 TYR QE . . 5.220 4.964 3.813 5.223 0.003 8 0 "[ . 1 . 2]" 1
684 1 32 VAL MG2 1 48 LYS HE2 . . 3.460 2.353 1.933 2.703 . 0 0 "[ . 1 . 2]" 1
685 1 32 VAL MG2 1 48 LYS HE3 . . 3.980 3.735 3.339 4.036 0.056 17 0 "[ . 1 . 2]" 1
686 1 32 VAL MG2 1 60 TYR H . . 5.500 5.519 5.317 5.662 0.162 19 0 "[ . 1 . 2]" 1
687 1 32 VAL MG2 1 60 TYR HB3 . . 5.320 2.570 2.347 3.139 . 0 0 "[ . 1 . 2]" 1
688 1 32 VAL MG2 1 60 TYR QD . . 3.330 2.041 1.812 2.679 . 0 0 "[ . 1 . 2]" 1
689 1 32 VAL MG2 1 60 TYR QE . . 3.180 3.088 2.278 3.274 0.094 3 0 "[ . 1 . 2]" 1
690 1 33 GLY QA 1 34 ALA MB . . 4.610 3.662 3.586 3.756 . 0 0 "[ . 1 . 2]" 1
691 1 34 ALA H 1 34 ALA MB . . 3.210 2.758 2.692 2.829 . 0 0 "[ . 1 . 2]" 1
692 1 34 ALA H 1 35 TYR H . . 5.030 4.290 4.126 4.365 . 0 0 "[ . 1 . 2]" 1
693 1 34 ALA H 2 29 VAL QG . . 5.440 4.305 3.235 4.995 . 0 0 "[ . 1 . 2]" 1
694 1 34 ALA H 2 31 PHE QE . . 5.090 4.113 3.700 4.390 . 0 0 "[ . 1 . 2]" 1
695 1 34 ALA HA 1 35 TYR H . . 2.910 2.384 2.215 2.544 . 0 0 "[ . 1 . 2]" 1
696 1 34 ALA MB 1 35 TYR H . . 3.450 2.551 2.285 3.091 . 0 0 "[ . 1 . 2]" 1
697 1 34 ALA MB 2 26 LEU HA . . 4.310 3.187 2.878 3.485 . 0 0 "[ . 1 . 2]" 1
698 1 34 ALA MB 2 26 LEU HB2 . . 4.030 3.457 2.938 3.816 . 0 0 "[ . 1 . 2]" 1
699 1 34 ALA MB 2 26 LEU MD1 . . 4.180 2.529 1.863 3.527 . 0 0 "[ . 1 . 2]" 1
700 1 34 ALA MB 2 26 LEU QD . . 3.400 2.386 1.861 3.358 . 0 0 "[ . 1 . 2]" 1
701 1 34 ALA MB 2 26 LEU MD2 . . 4.180 3.811 2.174 4.314 0.134 10 0 "[ . 1 . 2]" 1
702 1 34 ALA MB 2 26 LEU HG . . 4.490 3.460 2.920 4.401 . 0 0 "[ . 1 . 2]" 1
703 1 34 ALA MB 2 29 VAL H . . 5.500 4.803 4.196 5.269 . 0 0 "[ . 1 . 2]" 1
704 1 34 ALA MB 2 29 VAL QG . . 3.300 2.465 2.082 2.754 . 0 0 "[ . 1 . 2]" 1
705 1 34 ALA MB 2 31 PHE QE . . 4.340 3.584 3.006 4.191 . 0 0 "[ . 1 . 2]" 1
706 1 35 TYR H 1 35 TYR HB3 . . 4.050 3.726 3.569 3.800 . 0 0 "[ . 1 . 2]" 1
707 1 35 TYR H 1 35 TYR QD . . 4.810 3.010 2.637 3.346 . 0 0 "[ . 1 . 2]" 1
708 1 35 TYR H 1 36 PRO QD . . 4.640 4.505 4.453 4.550 . 0 0 "[ . 1 . 2]" 1
709 1 35 TYR H 1 37 SER H . . 4.880 4.359 4.168 4.781 . 0 0 "[ . 1 . 2]" 1
710 1 35 TYR H 1 40 GLU HB2 . . 5.500 5.141 4.942 5.400 . 0 0 "[ . 1 . 2]" 1
711 1 35 TYR H 1 41 ALA H . . 5.500 5.090 4.770 5.504 0.004 15 0 "[ . 1 . 2]" 1
712 1 35 TYR H 2 26 LEU HB2 . . 5.500 4.618 3.843 5.481 . 0 0 "[ . 1 . 2]" 1
713 1 35 TYR H 2 26 LEU QD . . 4.490 3.803 3.041 4.436 . 0 0 "[ . 1 . 2]" 1
714 1 35 TYR HA 1 36 PRO HG2 . . 4.940 4.797 4.675 4.945 0.005 15 0 "[ . 1 . 2]" 1
715 1 35 TYR HA 1 36 PRO HG3 . . 4.940 4.728 4.598 4.918 . 0 0 "[ . 1 . 2]" 1
716 1 35 TYR HA 2 26 LEU QD . . 4.380 4.201 3.264 4.527 0.147 7 0 "[ . 1 . 2]" 1
717 1 35 TYR HB3 1 36 PRO QD . . 3.720 2.173 1.967 2.440 . 0 0 "[ . 1 . 2]" 1
718 1 35 TYR HB3 1 37 SER H . . 3.580 2.818 2.551 3.090 . 0 0 "[ . 1 . 2]" 1
719 1 35 TYR HB3 1 40 GLU H . . 4.700 4.577 4.358 4.718 0.018 19 0 "[ . 1 . 2]" 1
720 1 35 TYR HB3 1 40 GLU HB2 . . 4.030 2.116 1.962 2.311 . 0 0 "[ . 1 . 2]" 1
721 1 35 TYR HB3 1 40 GLU HB3 . . 4.000 2.601 2.265 3.027 . 0 0 "[ . 1 . 2]" 1
722 1 35 TYR HB3 1 40 GLU HG2 . . 5.010 4.197 3.993 4.424 . 0 0 "[ . 1 . 2]" 1
723 1 35 TYR HB3 1 40 GLU HG3 . . 4.390 3.370 3.113 3.678 . 0 0 "[ . 1 . 2]" 1
724 1 35 TYR HB3 1 41 ALA H . . 3.980 3.852 3.488 4.026 0.046 7 0 "[ . 1 . 2]" 1
725 1 35 TYR HB3 1 41 ALA MB . . 4.260 3.847 3.553 4.068 . 0 0 "[ . 1 . 2]" 1
726 1 35 TYR QD 1 40 GLU HB2 . . 5.500 3.508 3.028 3.812 . 0 0 "[ . 1 . 2]" 1
727 1 35 TYR QD 1 40 GLU HB3 . . 4.810 2.666 1.922 3.182 . 0 0 "[ . 1 . 2]" 1
728 1 35 TYR QD 1 40 GLU HG2 . . 5.350 5.152 4.620 5.411 0.061 19 0 "[ . 1 . 2]" 1
729 1 35 TYR QD 1 40 GLU HG3 . . 5.500 4.002 3.448 4.400 . 0 0 "[ . 1 . 2]" 1
730 1 35 TYR QD 1 41 ALA HA . . 5.160 2.636 2.245 3.535 . 0 0 "[ . 1 . 2]" 1
731 1 35 TYR QD 1 41 ALA MB . . 4.330 2.732 2.427 3.770 . 0 0 "[ . 1 . 2]" 1
732 1 36 PRO HA 2 26 LEU QD . . 3.460 2.242 1.947 2.731 . 0 0 "[ . 1 . 2]" 1
733 1 36 PRO QB 2 26 LEU QD . . 3.490 3.074 2.468 3.469 . 0 0 "[ . 1 . 2]" 1
734 1 36 PRO QD 1 37 SER H . . 3.420 3.120 2.908 3.247 . 0 0 "[ . 1 . 2]" 1
735 1 36 PRO QD 1 40 GLU HB2 . . 3.900 3.532 3.047 3.843 . 0 0 "[ . 1 . 2]" 1
736 1 36 PRO QD 1 40 GLU HG3 . . 3.740 3.236 2.644 3.748 0.008 14 0 "[ . 1 . 2]" 1
737 1 36 PRO QG 1 37 SER H . . 3.700 3.369 2.887 3.712 0.012 18 0 "[ . 1 . 2]" 1
738 1 36 PRO QG 2 26 LEU QD . . 4.760 4.454 3.990 4.835 0.075 7 0 "[ . 1 . 2]" 1
739 1 37 SER H 1 37 SER QB . . 3.510 2.838 2.702 2.929 . 0 0 "[ . 1 . 2]" 1
740 1 37 SER H 1 38 TYR H . . 5.160 4.307 4.212 4.395 . 0 0 "[ . 1 . 2]" 1
741 1 37 SER H 1 38 TYR HA . . 4.950 4.850 4.708 4.982 0.032 10 0 "[ . 1 . 2]" 1
742 1 37 SER H 1 40 GLU H . . 4.440 4.302 3.837 4.522 0.082 14 0 "[ . 1 . 2]" 1
743 1 37 SER H 1 40 GLU HB2 . . 3.580 2.979 2.398 3.273 . 0 0 "[ . 1 . 2]" 1
744 1 37 SER H 1 40 GLU HB3 . . 4.760 4.427 3.800 4.774 0.014 4 0 "[ . 1 . 2]" 1
745 1 37 SER H 1 40 GLU HG2 . . 5.340 3.916 3.469 4.299 . 0 0 "[ . 1 . 2]" 1
746 1 37 SER H 1 40 GLU HG3 . . 4.680 3.671 2.949 4.145 . 0 0 "[ . 1 . 2]" 1
747 1 37 SER H 1 41 ALA MB . . 4.320 4.421 4.301 4.538 0.218 14 0 "[ . 1 . 2]" 1
748 1 37 SER H 2 26 LEU QD . . 4.590 4.513 4.104 4.709 0.119 13 0 "[ . 1 . 2]" 1
749 1 37 SER HA 1 38 TYR H . . 3.090 2.290 2.156 2.475 . 0 0 "[ . 1 . 2]" 1
750 1 37 SER HA 1 38 TYR HB2 . . 5.490 4.756 4.644 4.970 . 0 0 "[ . 1 . 2]" 1
751 1 37 SER HA 1 38 TYR HB3 . . 5.400 4.676 4.462 4.859 . 0 0 "[ . 1 . 2]" 1
752 1 38 TYR H 1 38 TYR HB2 . . 3.870 2.730 2.647 2.853 . 0 0 "[ . 1 . 2]" 1
753 1 38 TYR H 1 38 TYR HB3 . . 3.870 2.406 2.321 2.488 . 0 0 "[ . 1 . 2]" 1
754 1 38 TYR H 1 38 TYR QD . . 4.400 4.251 4.207 4.292 . 0 0 "[ . 1 . 2]" 1
755 1 38 TYR H 1 39 ASP H . . 3.280 2.807 2.606 3.124 . 0 0 "[ . 1 . 2]" 1
756 1 38 TYR H 1 40 GLU H . . 5.190 4.235 3.993 4.436 . 0 0 "[ . 1 . 2]" 1
757 1 38 TYR HA 1 38 TYR QD . . 3.560 2.578 2.270 2.927 . 0 0 "[ . 1 . 2]" 1
758 1 38 TYR HA 1 38 TYR QE . . 5.030 4.708 4.596 4.853 . 0 0 "[ . 1 . 2]" 1
759 1 38 TYR HA 1 40 GLU H . . 4.640 4.307 4.175 4.472 . 0 0 "[ . 1 . 2]" 1
760 1 38 TYR HB2 1 39 ASP H . . 4.300 4.028 3.858 4.202 . 0 0 "[ . 1 . 2]" 1
761 1 38 TYR HB3 1 39 ASP H . . 4.300 2.701 2.432 2.986 . 0 0 "[ . 1 . 2]" 1
762 1 38 TYR HB3 1 39 ASP HA . . 4.980 4.475 4.298 4.732 . 0 0 "[ . 1 . 2]" 1
763 1 38 TYR QD 1 39 ASP H . . 3.940 3.638 3.127 3.996 0.056 5 0 "[ . 1 . 2]" 1
764 1 38 TYR QD 1 39 ASP QB . . 5.130 3.888 2.982 4.642 . 0 0 "[ . 1 . 2]" 1
765 1 38 TYR QD 2 69 LEU QD . . 5.160 4.958 4.443 5.203 0.043 6 0 "[ . 1 . 2]" 1
766 1 38 TYR QE 1 42 HIS HB2 . . 4.620 3.436 3.061 3.798 . 0 0 "[ . 1 . 2]" 1
767 1 38 TYR QE 1 42 HIS HB3 . . 5.450 4.624 4.158 5.117 . 0 0 "[ . 1 . 2]" 1
768 1 38 TYR QE 1 62 ILE HB . . 5.170 4.668 3.682 5.192 0.022 19 0 "[ . 1 . 2]" 1
769 1 38 TYR QE 1 62 ILE MD . . 4.180 3.364 2.214 3.887 . 0 0 "[ . 1 . 2]" 1
770 1 38 TYR QE 2 69 LEU HB2 . . 5.500 5.209 4.297 5.558 0.058 12 0 "[ . 1 . 2]" 1
771 1 38 TYR QE 2 69 LEU HB3 . . 5.240 4.952 4.404 5.305 0.065 11 0 "[ . 1 . 2]" 1
772 1 38 TYR QE 2 69 LEU QD . . 3.700 3.752 3.386 3.896 0.196 8 0 "[ . 1 . 2]" 1
773 1 39 ASP H 1 39 ASP HA . . 2.910 2.826 2.790 2.856 . 0 0 "[ . 1 . 2]" 1
774 1 39 ASP H 1 39 ASP HB2 . . 3.110 2.540 2.310 2.699 . 0 0 "[ . 1 . 2]" 1
775 1 39 ASP H 1 39 ASP QB . . 2.590 2.267 2.198 2.327 . 0 0 "[ . 1 . 2]" 1
776 1 39 ASP H 1 39 ASP HB3 . . 3.110 2.564 2.434 2.756 . 0 0 "[ . 1 . 2]" 1
777 1 39 ASP H 1 40 GLU H . . 3.330 2.661 2.581 2.763 . 0 0 "[ . 1 . 2]" 1
778 1 39 ASP H 1 40 GLU HG2 . . 5.500 4.210 4.025 4.520 . 0 0 "[ . 1 . 2]" 1
779 1 39 ASP H 1 41 ALA H . . 4.400 4.229 4.040 4.406 0.006 18 0 "[ . 1 . 2]" 1
780 1 39 ASP H 1 41 ALA MB . . 5.310 4.981 4.679 5.230 . 0 0 "[ . 1 . 2]" 1
781 1 39 ASP H 1 42 HIS HB2 . . 5.500 4.995 4.575 5.423 . 0 0 "[ . 1 . 2]" 1
782 1 39 ASP HA 1 41 ALA H . . 4.480 4.344 4.052 4.515 0.035 7 0 "[ . 1 . 2]" 1
783 1 39 ASP HA 1 42 HIS H . . 3.900 3.284 2.982 3.559 . 0 0 "[ . 1 . 2]" 1
784 1 39 ASP HA 1 42 HIS HB2 . . 4.430 3.001 2.510 3.439 . 0 0 "[ . 1 . 2]" 1
785 1 39 ASP HA 1 42 HIS HB3 . . 3.960 2.203 1.661 2.894 . 0 0 "[ . 1 . 2]" 1
786 1 39 ASP HA 1 43 LYS H . . 4.400 4.037 3.558 4.463 0.063 2 0 "[ . 1 . 2]" 1
787 1 39 ASP QB 1 40 GLU H . . 3.190 2.862 2.545 3.153 . 0 0 "[ . 1 . 2]" 1
788 1 39 ASP QB 1 40 GLU HA . . 5.340 4.342 4.126 4.572 . 0 0 "[ . 1 . 2]" 1
789 1 39 ASP QB 1 41 ALA H . . 5.340 4.937 4.714 5.148 . 0 0 "[ . 1 . 2]" 1
790 1 40 GLU H 1 40 GLU HB2 . . 3.150 2.536 2.443 2.639 . 0 0 "[ . 1 . 2]" 1
791 1 40 GLU H 1 40 GLU HG2 . . 3.780 2.227 2.126 2.401 . 0 0 "[ . 1 . 2]" 1
792 1 40 GLU H 1 40 GLU HG3 . . 4.570 3.674 3.561 3.832 . 0 0 "[ . 1 . 2]" 1
793 1 40 GLU H 1 41 ALA H . . 3.080 2.611 2.510 2.669 . 0 0 "[ . 1 . 2]" 1
794 1 40 GLU H 1 41 ALA MB . . 4.330 4.271 4.201 4.336 0.006 17 0 "[ . 1 . 2]" 1
795 1 40 GLU H 1 42 HIS H . . 4.430 3.876 3.729 3.992 . 0 0 "[ . 1 . 2]" 1
796 1 40 GLU H 1 43 LYS H . . 5.030 4.666 4.442 4.894 . 0 0 "[ . 1 . 2]" 1
797 1 40 GLU HA 1 40 GLU HG2 . . 3.610 3.200 3.098 3.346 . 0 0 "[ . 1 . 2]" 1
798 1 40 GLU HA 1 40 GLU HG3 . . 4.130 3.817 3.746 3.872 . 0 0 "[ . 1 . 2]" 1
799 1 40 GLU HB2 1 41 ALA H . . 3.570 2.633 2.525 2.809 . 0 0 "[ . 1 . 2]" 1
800 1 40 GLU HB2 1 41 ALA HA . . 5.500 4.369 4.247 4.524 . 0 0 "[ . 1 . 2]" 1
801 1 40 GLU HB3 1 41 ALA H . . 4.170 3.729 3.626 3.903 . 0 0 "[ . 1 . 2]" 1
802 1 40 GLU HB3 1 41 ALA MB . . 5.500 4.736 4.610 4.912 . 0 0 "[ . 1 . 2]" 1
803 1 40 GLU HG2 1 41 ALA H . . 4.700 4.244 4.059 4.379 . 0 0 "[ . 1 . 2]" 1
804 1 40 GLU HG2 1 41 ALA MB . . 5.500 5.564 5.371 5.691 0.191 19 0 "[ . 1 . 2]" 1
805 1 41 ALA H 1 41 ALA MB . . 2.860 2.214 2.193 2.251 . 0 0 "[ . 1 . 2]" 1
806 1 41 ALA H 1 42 HIS H . . 3.140 2.440 2.366 2.556 . 0 0 "[ . 1 . 2]" 1
807 1 41 ALA HA 1 44 ALA H . . 3.860 3.286 3.106 3.605 . 0 0 "[ . 1 . 2]" 1
808 1 41 ALA HA 1 44 ALA MB . . 3.440 2.436 2.223 2.691 . 0 0 "[ . 1 . 2]" 1
809 1 41 ALA MB 1 42 HIS H . . 3.210 2.632 2.396 2.844 . 0 0 "[ . 1 . 2]" 1
810 1 41 ALA MB 1 42 HIS HB2 . . 5.500 4.092 3.818 4.464 . 0 0 "[ . 1 . 2]" 1
811 1 41 ALA MB 1 45 TRP H . . 5.500 4.976 4.820 5.131 . 0 0 "[ . 1 . 2]" 1
812 1 41 ALA MB 1 62 ILE MD . . 4.070 3.806 3.194 4.120 0.050 12 0 "[ . 1 . 2]" 1
813 1 42 HIS H 1 42 HIS HB2 . . 3.020 2.530 2.353 2.728 . 0 0 "[ . 1 . 2]" 1
814 1 42 HIS H 1 42 HIS HB3 . . 2.950 2.503 2.331 2.641 . 0 0 "[ . 1 . 2]" 1
815 1 42 HIS H 1 42 HIS HD2 . . 5.110 5.043 4.954 5.122 0.012 3 0 "[ . 1 . 2]" 1
816 1 42 HIS H 1 43 LYS H . . 3.310 2.574 2.342 2.855 . 0 0 "[ . 1 . 2]" 1
817 1 42 HIS H 1 44 ALA H . . 4.520 3.944 3.737 4.223 . 0 0 "[ . 1 . 2]" 1
818 1 42 HIS H 1 62 ILE MD . . 4.450 3.951 3.685 4.105 . 0 0 "[ . 1 . 2]" 1
819 1 42 HIS HA 1 42 HIS HD2 . . 3.800 2.651 2.462 3.089 . 0 0 "[ . 1 . 2]" 1
820 1 42 HIS HA 1 45 TRP H . . 4.330 3.829 3.518 4.121 . 0 0 "[ . 1 . 2]" 1
821 1 42 HIS HA 1 45 TRP HB2 . . 4.670 4.205 3.744 4.625 . 0 0 "[ . 1 . 2]" 1
822 1 42 HIS HA 1 45 TRP HB3 . . 4.010 3.283 2.888 3.632 . 0 0 "[ . 1 . 2]" 1
823 1 42 HIS HA 1 62 ILE MD . . 3.150 1.925 1.843 2.003 . 0 0 "[ . 1 . 2]" 1
824 1 42 HIS HB2 1 43 LYS H . . 3.930 3.963 3.845 4.046 0.116 3 0 "[ . 1 . 2]" 1
825 1 42 HIS HB2 1 62 ILE MD . . 3.990 3.304 3.012 3.676 . 0 0 "[ . 1 . 2]" 1
826 1 42 HIS HB3 1 43 LYS H . . 3.320 2.793 2.453 3.036 . 0 0 "[ . 1 . 2]" 1
827 1 42 HIS HB3 1 62 ILE MD . . 4.360 4.255 4.023 4.410 0.050 9 0 "[ . 1 . 2]" 1
828 1 42 HIS HD2 1 45 TRP HB3 . . 5.260 3.715 3.440 4.082 . 0 0 "[ . 1 . 2]" 1
829 1 42 HIS HD2 1 45 TRP HE3 . . 4.080 3.283 2.658 3.598 . 0 0 "[ . 1 . 2]" 1
830 1 42 HIS HD2 1 46 LYS H . . 5.500 5.573 5.080 5.723 0.223 11 0 "[ . 1 . 2]" 1
831 1 42 HIS HD2 1 62 ILE MD . . 3.570 2.418 1.969 2.900 . 0 0 "[ . 1 . 2]" 1
832 1 42 HIS HD2 1 62 ILE MG . . 5.290 5.043 4.552 5.407 0.117 10 0 "[ . 1 . 2]" 1
833 1 42 HIS HD2 2 71 PRO HB2 . . 5.270 4.042 2.644 5.248 . 0 0 "[ . 1 . 2]" 1
834 1 42 HIS HD2 2 71 PRO HB3 . . 3.890 3.346 1.833 4.050 0.160 12 0 "[ . 1 . 2]" 1
835 1 42 HIS HD2 2 71 PRO HG2 . . 5.170 2.926 2.223 4.776 . 0 0 "[ . 1 . 2]" 1
836 1 42 HIS HD2 2 71 PRO HG3 . . 5.170 2.568 2.047 3.575 . 0 0 "[ . 1 . 2]" 1
837 1 43 LYS H 1 43 LYS HB3 . . 2.750 2.728 2.543 2.904 0.154 14 0 "[ . 1 . 2]" 1
838 1 43 LYS H 1 43 LYS QD . . 4.720 4.326 3.967 4.476 . 0 0 "[ . 1 . 2]" 1
839 1 43 LYS H 1 43 LYS QE . . 5.000 3.861 3.316 5.097 0.097 19 0 "[ . 1 . 2]" 1
840 1 43 LYS H 1 43 LYS HG2 . . 4.680 4.632 4.571 4.693 0.013 2 0 "[ . 1 . 2]" 1
841 1 43 LYS H 1 43 LYS QG . . 4.070 4.094 4.060 4.119 0.049 2 0 "[ . 1 . 2]" 1
842 1 43 LYS H 1 43 LYS HG3 . . 4.680 4.561 4.512 4.603 . 0 0 "[ . 1 . 2]" 1
843 1 43 LYS H 1 44 ALA H . . 3.160 2.417 2.202 2.656 . 0 0 "[ . 1 . 2]" 1
844 1 43 LYS H 1 44 ALA MB . . 4.320 4.087 3.905 4.307 . 0 0 "[ . 1 . 2]" 1
845 1 43 LYS H 1 45 TRP H . . 4.520 4.110 3.942 4.383 . 0 0 "[ . 1 . 2]" 1
846 1 43 LYS H 1 46 LYS H . . 5.500 5.530 5.377 5.646 0.146 19 0 "[ . 1 . 2]" 1
847 1 43 LYS H 1 62 ILE MD . . 4.930 4.805 4.652 4.929 . 0 0 "[ . 1 . 2]" 1
848 1 43 LYS HA 1 43 LYS QD . . 4.070 2.014 1.903 2.083 . 0 0 "[ . 1 . 2]" 1
849 1 43 LYS HA 1 43 LYS HG2 . . 4.010 3.729 3.667 3.797 . 0 0 "[ . 1 . 2]" 1
850 1 43 LYS HA 1 43 LYS HG3 . . 4.010 2.928 2.712 3.131 . 0 0 "[ . 1 . 2]" 1
851 1 43 LYS HA 1 45 TRP H . . 4.630 4.169 4.027 4.282 . 0 0 "[ . 1 . 2]" 1
852 1 43 LYS HA 1 46 LYS H . . 3.920 3.786 3.654 3.956 0.036 19 0 "[ . 1 . 2]" 1
853 1 43 LYS HB2 1 43 LYS QE . . 3.190 2.196 1.823 3.142 . 0 0 "[ . 1 . 2]" 1
854 1 43 LYS HB3 1 43 LYS QE . . 4.190 3.621 3.333 4.127 . 0 0 "[ . 1 . 2]" 1
855 1 43 LYS HB3 1 43 LYS QG . . 2.540 2.186 2.175 2.195 . 0 0 "[ . 1 . 2]" 1
856 1 43 LYS HB3 1 44 ALA H . . 3.040 2.806 2.710 2.922 . 0 0 "[ . 1 . 2]" 1
857 1 43 LYS QD 1 45 TRP HE3 . . 4.310 4.486 4.180 4.651 0.341 4 0 "[ . 1 . 2]" 1
858 1 43 LYS QD 1 46 LYS H . . 5.190 4.788 4.278 5.181 . 0 0 "[ . 1 . 2]" 1
859 1 43 LYS QE 1 43 LYS HG2 . . 3.880 2.739 2.400 3.169 . 0 0 "[ . 1 . 2]" 1
860 1 43 LYS QE 1 43 LYS QG . . 3.210 2.630 2.350 2.967 . 0 0 "[ . 1 . 2]" 1
861 1 43 LYS QE 1 43 LYS HG3 . . 3.880 3.469 3.358 3.576 . 0 0 "[ . 1 . 2]" 1
862 1 43 LYS QG 1 44 ALA H . . 4.480 4.156 3.885 4.304 . 0 0 "[ . 1 . 2]" 1
863 1 43 LYS QG 1 44 ALA HA . . 4.520 4.366 3.849 4.669 0.149 11 0 "[ . 1 . 2]" 1
864 1 43 LYS HG2 1 44 ALA H . . 5.130 5.092 4.984 5.202 0.072 5 0 "[ . 1 . 2]" 1
865 1 43 LYS HG3 1 44 ALA H . . 5.130 4.410 4.053 4.621 . 0 0 "[ . 1 . 2]" 1
866 1 44 ALA H 1 44 ALA MB . . 2.700 2.232 2.213 2.252 . 0 0 "[ . 1 . 2]" 1
867 1 44 ALA H 1 45 TRP H . . 3.040 2.687 2.549 2.752 . 0 0 "[ . 1 . 2]" 1
868 1 44 ALA H 1 47 ALA MB . . 5.230 4.264 4.093 4.483 . 0 0 "[ . 1 . 2]" 1
869 1 44 ALA H 1 62 ILE MD . . 5.210 5.142 4.922 5.301 0.091 10 0 "[ . 1 . 2]" 1
870 1 44 ALA HA 1 47 ALA MB . . 2.780 2.060 1.897 2.185 . 0 0 "[ . 1 . 2]" 1
871 1 44 ALA MB 1 45 TRP H . . 2.980 2.728 2.629 2.875 . 0 0 "[ . 1 . 2]" 1
872 1 44 ALA MB 1 45 TRP HB3 . . 4.570 4.489 4.372 4.615 0.045 19 0 "[ . 1 . 2]" 1
873 1 44 ALA MB 1 46 LYS H . . 4.850 4.821 4.738 4.890 0.040 14 0 "[ . 1 . 2]" 1
874 1 44 ALA MB 1 47 ALA MB . . 3.440 3.405 3.266 3.529 0.089 16 0 "[ . 1 . 2]" 1
875 1 45 TRP H 1 45 TRP HB2 . . 3.320 3.015 2.889 3.083 . 0 0 "[ . 1 . 2]" 1
876 1 45 TRP H 1 45 TRP HB3 . . 3.600 2.134 2.088 2.181 . 0 0 "[ . 1 . 2]" 1
877 1 45 TRP H 1 46 LYS HB3 . . 5.080 5.078 4.860 5.199 0.119 15 0 "[ . 1 . 2]" 1
878 1 45 TRP H 1 62 ILE MD . . 4.180 3.843 3.616 4.068 . 0 0 "[ . 1 . 2]" 1
879 1 45 TRP HA 1 45 TRP HD1 . . 3.930 3.535 3.365 3.664 . 0 0 "[ . 1 . 2]" 1
880 1 45 TRP HA 1 47 ALA H . . 5.270 4.676 4.539 4.788 . 0 0 "[ . 1 . 2]" 1
881 1 45 TRP HA 1 48 LYS H . . 4.110 4.042 3.871 4.153 0.043 19 0 "[ . 1 . 2]" 1
882 1 45 TRP HA 1 48 LYS HB2 . . 4.670 3.373 3.098 3.480 . 0 0 "[ . 1 . 2]" 1
883 1 45 TRP HA 1 48 LYS HB3 . . 4.940 4.960 4.679 5.061 0.121 17 0 "[ . 1 . 2]" 1
884 1 45 TRP HA 1 48 LYS HG3 . . 5.500 4.376 4.069 4.677 . 0 0 "[ . 1 . 2]" 1
885 1 45 TRP HA 1 49 ALA H . . 4.540 4.401 4.186 4.569 0.029 11 0 "[ . 1 . 2]" 1
886 1 45 TRP HB2 1 62 ILE MD . . 3.770 2.673 2.399 2.958 . 0 0 "[ . 1 . 2]" 1
887 1 45 TRP HB2 1 62 ILE HG12 . . 4.680 2.473 2.350 2.650 . 0 0 "[ . 1 . 2]" 1
888 1 45 TRP HB2 1 62 ILE HG13 . . 5.260 2.546 2.305 2.825 . 0 0 "[ . 1 . 2]" 1
889 1 45 TRP HB2 1 62 ILE MG . . 4.420 4.466 4.382 4.589 0.169 11 0 "[ . 1 . 2]" 1
890 1 45 TRP HB3 1 46 LYS H . . 3.330 2.883 2.706 3.012 . 0 0 "[ . 1 . 2]" 1
891 1 45 TRP HB3 1 62 ILE MD . . 4.360 2.502 2.329 2.637 . 0 0 "[ . 1 . 2]" 1
892 1 45 TRP HD1 1 46 LYS H . . 5.370 4.970 4.775 5.120 . 0 0 "[ . 1 . 2]" 1
893 1 45 TRP HD1 1 61 PHE HA . . 4.480 2.319 1.675 2.879 . 0 0 "[ . 1 . 2]" 1
894 1 45 TRP HD1 1 62 ILE H . . 5.500 4.674 4.247 4.951 . 0 0 "[ . 1 . 2]" 1
895 1 45 TRP HD1 1 62 ILE MD . . 4.410 4.391 4.178 4.509 0.099 11 0 "[ . 1 . 2]" 1
896 1 45 TRP HD1 1 62 ILE HG13 . . 4.790 3.783 3.506 3.950 . 0 0 "[ . 1 . 2]" 1
897 1 45 TRP HE1 1 49 ALA MB . . 4.110 4.084 3.871 4.259 0.149 18 0 "[ . 1 . 2]" 1
898 1 45 TRP HE1 2 70 ASP QB . . 5.290 4.400 3.266 5.292 0.002 14 0 "[ . 1 . 2]" 1
899 1 45 TRP HE1 2 71 PRO HD2 . . 3.510 2.946 2.685 3.375 . 0 0 "[ . 1 . 2]" 1
900 1 45 TRP HE1 2 71 PRO HD3 . . 5.000 4.401 3.964 5.000 . 17 0 "[ . 1 . 2]" 1
901 1 45 TRP HE1 2 71 PRO QG . . 4.210 4.256 3.712 4.458 0.248 9 0 "[ . 1 . 2]" 1
902 1 45 TRP HE1 2 72 SER H . . 5.280 4.154 3.147 5.139 . 0 0 "[ . 1 . 2]" 1
903 1 45 TRP HE1 2 72 SER QB . . 5.340 3.775 2.298 5.068 . 0 0 "[ . 1 . 2]" 1
904 1 45 TRP HE3 1 46 LYS H . . 3.070 2.545 2.285 2.777 . 0 0 "[ . 1 . 2]" 1
905 1 45 TRP HE3 1 46 LYS HA . . 5.500 4.572 4.326 4.776 . 0 0 "[ . 1 . 2]" 1
906 1 45 TRP HE3 1 46 LYS HB3 . . 3.540 3.269 2.911 3.557 0.017 15 0 "[ . 1 . 2]" 1
907 1 45 TRP HE3 1 62 ILE MD . . 4.250 3.765 3.481 4.041 . 0 0 "[ . 1 . 2]" 1
908 1 45 TRP HE3 2 71 PRO HB3 . . 5.500 5.174 4.205 5.699 0.199 15 0 "[ . 1 . 2]" 1
909 1 45 TRP HH2 1 46 LYS HB3 . . 4.480 4.778 4.630 4.925 0.445 12 0 "[ . 1 . 2]" 1
910 1 45 TRP HH2 1 46 LYS QG . . 4.930 4.615 4.200 4.986 0.056 10 0 "[ . 1 . 2]" 1
911 1 45 TRP HH2 2 71 PRO HB2 . . 4.890 3.572 3.022 4.675 . 0 0 "[ . 1 . 2]" 1
912 1 45 TRP HH2 2 71 PRO HB3 . . 5.500 4.986 4.482 5.698 0.198 1 0 "[ . 1 . 2]" 1
913 1 45 TRP HH2 2 72 SER H . . 5.370 5.050 4.442 5.419 0.049 4 0 "[ . 1 . 2]" 1
914 1 45 TRP HZ2 2 71 PRO HD2 . . 4.180 3.623 3.157 4.222 0.042 10 0 "[ . 1 . 2]" 1
915 1 45 TRP HZ2 2 72 SER H . . 4.290 3.656 3.011 4.333 0.043 4 0 "[ . 1 . 2]" 1
916 1 45 TRP HZ2 2 72 SER HA . . 5.500 4.044 2.117 5.552 0.052 17 0 "[ . 1 . 2]" 1
917 1 45 TRP HZ2 2 72 SER QB . . 3.820 2.833 1.759 3.920 0.100 9 0 "[ . 1 . 2]" 1
918 1 46 LYS H 1 46 LYS HB3 . . 2.740 2.340 2.153 2.490 . 0 0 "[ . 1 . 2]" 1
919 1 46 LYS H 1 46 LYS QG . . 4.210 3.989 3.843 4.044 . 0 0 "[ . 1 . 2]" 1
920 1 46 LYS H 1 47 ALA H . . 3.210 2.432 2.314 2.592 . 0 0 "[ . 1 . 2]" 1
921 1 46 LYS H 1 47 ALA MB . . 4.600 4.105 3.988 4.202 . 0 0 "[ . 1 . 2]" 1
922 1 46 LYS H 1 48 LYS H . . 4.690 4.003 3.852 4.145 . 0 0 "[ . 1 . 2]" 1
923 1 46 LYS H 1 49 ALA H . . 5.420 4.595 4.488 4.774 . 0 0 "[ . 1 . 2]" 1
924 1 46 LYS H 1 49 ALA MB . . 4.870 4.500 4.334 4.689 . 0 0 "[ . 1 . 2]" 1
925 1 46 LYS H 1 62 ILE MD . . 5.280 5.011 4.838 5.261 . 0 0 "[ . 1 . 2]" 1
926 1 46 LYS HA 1 46 LYS QG . . 3.950 2.648 2.485 2.831 . 0 0 "[ . 1 . 2]" 1
927 1 46 LYS HA 1 48 LYS H . . 4.570 4.024 3.717 4.322 . 0 0 "[ . 1 . 2]" 1
928 1 46 LYS HA 1 49 ALA H . . 3.810 3.056 2.787 3.483 . 0 0 "[ . 1 . 2]" 1
929 1 46 LYS HA 1 49 ALA MB . . 3.290 2.210 1.989 2.624 . 0 0 "[ . 1 . 2]" 1
930 1 46 LYS HA 1 50 GLN H . . 4.280 3.677 3.475 4.007 . 0 0 "[ . 1 . 2]" 1
931 1 46 LYS HA 1 50 GLN HB2 . . 5.500 5.156 4.996 5.500 . 0 0 "[ . 1 . 2]" 1
932 1 46 LYS HB3 1 47 ALA H . . 3.070 2.916 2.586 3.080 0.010 11 0 "[ . 1 . 2]" 1
933 1 46 LYS HB3 1 47 ALA MB . . 4.420 4.338 4.049 4.480 0.060 2 0 "[ . 1 . 2]" 1
934 1 46 LYS HB3 1 48 LYS H . . 5.010 5.148 5.029 5.222 0.212 1 0 "[ . 1 . 2]" 1
935 1 46 LYS QG 1 47 ALA H . . 4.010 3.669 3.153 4.031 0.021 15 0 "[ . 1 . 2]" 1
936 1 46 LYS QG 1 50 GLN H . . 4.240 3.915 3.573 4.258 0.018 12 0 "[ . 1 . 2]" 1
937 1 46 LYS QG 1 50 GLN HB2 . . 3.980 3.883 3.709 4.026 0.046 3 0 "[ . 1 . 2]" 1
938 1 46 LYS QG 1 50 GLN HE21 . . 4.810 2.906 2.531 3.275 . 0 0 "[ . 1 . 2]" 1
939 1 46 LYS QG 1 50 GLN HE22 . . 4.990 2.891 2.467 3.258 . 0 0 "[ . 1 . 2]" 1
940 1 46 LYS QG 1 50 GLN QG . . 4.310 2.511 2.192 2.959 . 0 0 "[ . 1 . 2]" 1
941 1 47 ALA H 1 47 ALA MB . . 2.660 2.242 2.214 2.267 . 0 0 "[ . 1 . 2]" 1
942 1 47 ALA H 1 48 LYS HG2 . . 5.500 4.735 4.555 4.943 . 0 0 "[ . 1 . 2]" 1
943 1 47 ALA H 1 49 ALA H . . 4.400 4.147 3.849 4.290 . 0 0 "[ . 1 . 2]" 1
944 1 47 ALA H 1 49 ALA MB . . 4.990 4.781 4.523 4.960 . 0 0 "[ . 1 . 2]" 1
945 1 47 ALA H 1 50 GLN H . . 5.210 4.931 4.760 5.016 . 0 0 "[ . 1 . 2]" 1
946 1 47 ALA H 1 50 GLN HE21 . . 4.810 4.812 4.496 4.906 0.096 5 0 "[ . 1 . 2]" 1
947 1 47 ALA HA 1 49 ALA H . . 5.160 4.782 4.529 4.884 . 0 0 "[ . 1 . 2]" 1
948 1 47 ALA HA 1 50 GLN H . . 4.400 4.139 3.850 4.360 . 0 0 "[ . 1 . 2]" 1
949 1 47 ALA HA 1 50 GLN HB2 . . 4.770 3.505 3.228 3.737 . 0 0 "[ . 1 . 2]" 1
950 1 47 ALA HA 1 50 GLN HB3 . . 5.500 5.145 4.872 5.403 . 0 0 "[ . 1 . 2]" 1
951 1 47 ALA HA 1 50 GLN HE21 . . 5.370 2.870 2.503 3.265 . 0 0 "[ . 1 . 2]" 1
952 1 47 ALA HA 1 50 GLN QG . . 5.410 4.574 4.236 4.925 . 0 0 "[ . 1 . 2]" 1
953 1 47 ALA HA 1 51 ALA H . . 4.890 4.470 4.260 4.757 . 0 0 "[ . 1 . 2]" 1
954 1 47 ALA MB 1 48 LYS H . . 3.120 2.694 2.558 2.926 . 0 0 "[ . 1 . 2]" 1
955 1 47 ALA MB 1 48 LYS HG2 . . 3.730 3.321 3.075 3.630 . 0 0 "[ . 1 . 2]" 1
956 1 47 ALA MB 1 49 ALA H . . 4.880 4.691 4.518 4.836 . 0 0 "[ . 1 . 2]" 1
957 1 47 ALA MB 1 49 ALA MB . . 5.500 5.450 5.290 5.538 0.038 5 0 "[ . 1 . 2]" 1
958 1 47 ALA MB 1 50 GLN HB2 . . 5.360 4.950 4.708 5.172 . 0 0 "[ . 1 . 2]" 1
959 1 48 LYS H 1 48 LYS HB2 . . 3.010 2.313 2.216 2.393 . 0 0 "[ . 1 . 2]" 1
960 1 48 LYS H 1 48 LYS HB3 . . 3.690 3.563 3.505 3.600 . 0 0 "[ . 1 . 2]" 1
961 1 48 LYS H 1 48 LYS HD2 . . 5.260 4.066 3.813 4.408 . 0 0 "[ . 1 . 2]" 1
962 1 48 LYS H 1 48 LYS HE2 . . 5.500 5.669 5.610 5.748 0.248 15 0 "[ . 1 . 2]" 1
963 1 48 LYS H 1 48 LYS HE3 . . 5.500 5.076 4.931 5.190 . 0 0 "[ . 1 . 2]" 1
964 1 48 LYS H 1 48 LYS HG2 . . 4.470 2.668 2.470 2.867 . 0 0 "[ . 1 . 2]" 1
965 1 48 LYS H 1 48 LYS HG3 . . 4.510 3.853 3.769 3.964 . 0 0 "[ . 1 . 2]" 1
966 1 48 LYS H 1 49 ALA H . . 2.900 2.469 2.383 2.550 . 0 0 "[ . 1 . 2]" 1
967 1 48 LYS H 1 50 GLN H . . 4.310 4.114 3.945 4.247 . 0 0 "[ . 1 . 2]" 1
968 1 48 LYS H 1 51 ALA H . . 4.550 4.605 4.538 4.673 0.123 18 0 "[ . 1 . 2]" 1
969 1 48 LYS H 1 52 THR MG . . 5.500 5.530 5.267 5.651 0.151 20 0 "[ . 1 . 2]" 1
970 1 48 LYS H 1 60 TYR HB2 . . 5.500 4.735 4.489 5.188 . 0 0 "[ . 1 . 2]" 1
971 1 48 LYS HA 1 48 LYS HD2 . . 3.540 2.105 2.031 2.252 . 0 0 "[ . 1 . 2]" 1
972 1 48 LYS HA 1 48 LYS HD3 . . 3.780 3.693 3.627 3.778 . 0 0 "[ . 1 . 2]" 1
973 1 48 LYS HA 1 51 ALA H . . 3.740 3.423 3.257 3.567 . 0 0 "[ . 1 . 2]" 1
974 1 48 LYS HA 1 51 ALA MB . . 3.600 2.395 2.307 2.473 . 0 0 "[ . 1 . 2]" 1
975 1 48 LYS HA 1 52 THR H . . 4.650 4.154 3.602 4.627 . 0 0 "[ . 1 . 2]" 1
976 1 48 LYS HA 1 52 THR MG . . 4.420 3.297 3.070 3.483 . 0 0 "[ . 1 . 2]" 1
977 1 48 LYS HB2 1 48 LYS HE2 . . 5.490 4.059 3.894 4.152 . 0 0 "[ . 1 . 2]" 1
978 1 48 LYS HB2 1 49 ALA H . . 3.360 2.575 2.443 2.736 . 0 0 "[ . 1 . 2]" 1
979 1 48 LYS HB2 1 52 THR MG . . 5.150 4.705 4.387 4.905 . 0 0 "[ . 1 . 2]" 1
980 1 48 LYS HB2 1 60 TYR HB2 . . 5.500 2.738 2.353 3.697 . 0 0 "[ . 1 . 2]" 1
981 1 48 LYS HB2 1 60 TYR QD . . 5.460 3.720 2.492 4.144 . 0 0 "[ . 1 . 2]" 1
982 1 48 LYS HB3 1 48 LYS HE2 . . 4.530 2.829 2.560 2.959 . 0 0 "[ . 1 . 2]" 1
983 1 48 LYS HB3 1 49 ALA H . . 4.190 3.433 3.286 3.585 . 0 0 "[ . 1 . 2]" 1
984 1 48 LYS HB3 1 52 THR MG . . 4.960 3.362 2.999 3.567 . 0 0 "[ . 1 . 2]" 1
985 1 48 LYS HB3 1 60 TYR QD . . 5.500 2.954 1.688 3.267 . 0 0 "[ . 1 . 2]" 1
986 1 48 LYS HB3 1 60 TYR QE . . 5.130 3.914 2.561 4.312 . 0 0 "[ . 1 . 2]" 1
987 1 48 LYS HD2 1 51 ALA MB . . 3.370 3.410 3.226 3.518 0.148 13 0 "[ . 1 . 2]" 1
988 1 48 LYS HD2 1 60 TYR QE . . 5.500 5.470 4.165 5.679 0.179 1 0 "[ . 1 . 2]" 1
989 1 48 LYS HD3 1 60 TYR QE . . 5.500 5.378 4.759 5.586 0.086 10 0 "[ . 1 . 2]" 1
990 1 48 LYS HE2 1 48 LYS HG3 . . 3.910 2.515 2.455 2.562 . 0 0 "[ . 1 . 2]" 1
991 1 48 LYS HE2 1 52 THR MG . . 4.620 3.815 3.304 4.390 . 0 0 "[ . 1 . 2]" 1
992 1 48 LYS HE2 1 60 TYR QD . . 3.430 3.184 2.733 3.532 0.102 14 0 "[ . 1 . 2]" 1
993 1 48 LYS HE2 1 60 TYR QE . . 4.160 3.136 2.861 3.416 . 0 0 "[ . 1 . 2]" 1
994 1 48 LYS HE3 1 52 THR MG . . 3.980 2.548 2.104 2.990 . 0 0 "[ . 1 . 2]" 1
995 1 48 LYS HE3 1 60 TYR QE . . 4.490 3.474 1.793 3.781 . 0 0 "[ . 1 . 2]" 1
996 1 48 LYS HG3 1 49 ALA H . . 5.330 4.935 4.789 5.058 . 0 0 "[ . 1 . 2]" 1
997 1 48 LYS HG3 1 60 TYR QE . . 5.500 4.823 4.438 5.130 . 0 0 "[ . 1 . 2]" 1
998 1 49 ALA H 1 49 ALA MB . . 2.700 2.232 2.214 2.260 . 0 0 "[ . 1 . 2]" 1
999 1 49 ALA H 1 50 GLN H . . 3.010 2.781 2.650 2.857 . 0 0 "[ . 1 . 2]" 1
1000 1 49 ALA H 1 50 GLN HB2 . . 5.500 4.920 4.777 5.081 . 0 0 "[ . 1 . 2]" 1
1001 1 49 ALA H 1 50 GLN QG . . 5.500 4.589 4.375 4.740 . 0 0 "[ . 1 . 2]" 1
1002 1 49 ALA H 1 51 ALA H . . 4.030 4.010 3.880 4.083 0.053 6 0 "[ . 1 . 2]" 1
1003 1 49 ALA H 1 60 TYR QD . . 5.450 4.348 3.575 4.839 . 0 0 "[ . 1 . 2]" 1
1004 1 49 ALA HA 1 50 GLN H . . 3.530 3.538 3.499 3.562 0.032 13 0 "[ . 1 . 2]" 1
1005 1 49 ALA HA 1 52 THR H . . 5.130 3.830 3.555 4.472 . 0 0 "[ . 1 . 2]" 1
1006 1 49 ALA HA 1 52 THR MG . . 4.960 4.269 3.816 4.739 . 0 0 "[ . 1 . 2]" 1
1007 1 49 ALA HA 1 60 TYR QD . . 3.930 3.097 2.305 3.568 . 0 0 "[ . 1 . 2]" 1
1008 1 49 ALA HA 1 60 TYR QE . . 5.180 4.614 3.239 5.057 . 0 0 "[ . 1 . 2]" 1
1009 1 49 ALA MB 1 50 GLN H . . 3.190 2.589 2.435 2.785 . 0 0 "[ . 1 . 2]" 1
1010 1 49 ALA MB 1 50 GLN HA . . 4.600 3.995 3.917 4.079 . 0 0 "[ . 1 . 2]" 1
1011 1 49 ALA MB 1 50 GLN HB2 . . 4.880 4.491 4.319 4.636 . 0 0 "[ . 1 . 2]" 1
1012 1 49 ALA MB 1 50 GLN QG . . 4.080 3.140 3.005 3.307 . 0 0 "[ . 1 . 2]" 1
1013 1 49 ALA MB 1 51 ALA H . . 4.400 4.455 4.371 4.526 0.126 10 0 "[ . 1 . 2]" 1
1014 1 49 ALA MB 1 52 THR H . . 5.500 4.859 4.598 5.484 . 0 0 "[ . 1 . 2]" 1
1015 1 49 ALA MB 1 60 TYR H . . 4.480 3.472 2.750 4.020 . 0 0 "[ . 1 . 2]" 1
1016 1 49 ALA MB 1 60 TYR HB2 . . 4.670 3.365 2.545 3.762 . 0 0 "[ . 1 . 2]" 1
1017 1 49 ALA MB 1 60 TYR HB3 . . 5.160 4.795 3.786 5.222 0.062 9 0 "[ . 1 . 2]" 1
1018 1 49 ALA MB 1 60 TYR QD . . 4.120 3.951 2.843 4.225 0.105 4 0 "[ . 1 . 2]" 1
1019 1 50 GLN H 1 50 GLN HB2 . . 2.850 2.422 2.345 2.520 . 0 0 "[ . 1 . 2]" 1
1020 1 50 GLN H 1 50 GLN HB3 . . 3.730 3.611 3.581 3.632 . 0 0 "[ . 1 . 2]" 1
1021 1 50 GLN H 1 50 GLN HE21 . . 4.080 3.687 3.492 3.857 . 0 0 "[ . 1 . 2]" 1
1022 1 50 GLN H 1 50 GLN HE22 . . 5.500 5.228 5.044 5.433 . 0 0 "[ . 1 . 2]" 1
1023 1 50 GLN H 1 50 GLN QG . . 3.360 2.459 2.244 2.673 . 0 0 "[ . 1 . 2]" 1
1024 1 50 GLN H 1 51 ALA H . . 3.090 2.473 2.276 2.640 . 0 0 "[ . 1 . 2]" 1
1025 1 50 GLN HA 1 50 GLN QG . . 3.800 2.476 2.431 2.587 . 0 0 "[ . 1 . 2]" 1
1026 1 50 GLN HA 1 51 ALA H . . 3.560 3.518 3.452 3.550 . 0 0 "[ . 1 . 2]" 1
1027 1 50 GLN HA 1 52 THR H . . 5.230 4.289 3.860 5.208 . 0 0 "[ . 1 . 2]" 1
1028 1 50 GLN HB2 1 50 GLN HE21 . . 4.560 1.874 1.757 1.941 . 0 0 "[ . 1 . 2]" 1
1029 1 50 GLN HB2 1 51 ALA H . . 3.400 2.892 2.641 3.186 . 0 0 "[ . 1 . 2]" 1
1030 1 50 GLN HB2 1 52 THR H . . 5.500 5.167 4.868 5.601 0.101 10 0 "[ . 1 . 2]" 1
1031 1 50 GLN HB3 1 50 GLN HE21 . . 4.710 2.917 2.846 3.044 . 0 0 "[ . 1 . 2]" 1
1032 1 50 GLN QG 1 51 ALA H . . 4.340 4.248 4.096 4.366 0.026 14 0 "[ . 1 . 2]" 1
1033 1 51 ALA H 1 51 ALA MB . . 2.730 2.270 2.245 2.304 . 0 0 "[ . 1 . 2]" 1
1034 1 51 ALA H 1 52 THR H . . 3.150 2.547 2.393 2.737 . 0 0 "[ . 1 . 2]" 1
1035 1 51 ALA H 1 52 THR MG . . 5.170 4.022 3.894 4.134 . 0 0 "[ . 1 . 2]" 1
1036 1 51 ALA MB 1 52 THR H . . 3.420 2.754 2.109 3.265 . 0 0 "[ . 1 . 2]" 1
1037 1 51 ALA MB 1 52 THR MG . . 3.690 2.596 2.384 2.850 . 0 0 "[ . 1 . 2]" 1
1038 1 51 ALA MB 1 53 VAL QG . . 4.910 4.570 4.264 4.930 0.020 4 0 "[ . 1 . 2]" 1
1039 1 52 THR H 1 52 THR MG . . 3.520 2.572 1.949 2.956 . 0 0 "[ . 1 . 2]" 1
1040 1 52 THR H 1 53 VAL HA . . 5.500 4.897 4.474 5.221 . 0 0 "[ . 1 . 2]" 1
1041 1 52 THR H 1 53 VAL QG . . 4.410 3.729 3.136 4.167 . 0 0 "[ . 1 . 2]" 1
1042 1 52 THR HA 1 53 VAL H . . 2.810 2.648 2.234 2.974 0.164 9 0 "[ . 1 . 2]" 1
1043 1 52 THR MG 1 53 VAL H . . 4.430 4.358 4.248 4.441 0.011 1 0 "[ . 1 . 2]" 1
1044 1 52 THR MG 1 54 ASP H . . 5.340 5.100 4.808 5.434 0.094 20 0 "[ . 1 . 2]" 1
1045 1 52 THR MG 1 60 TYR QE . . 3.910 2.288 1.752 2.771 . 0 0 "[ . 1 . 2]" 1
1046 1 53 VAL H 1 53 VAL HB . . 3.660 2.899 2.474 3.680 0.020 14 0 "[ . 1 . 2]" 1
1047 1 53 VAL H 1 53 VAL QG . . 2.970 2.103 1.857 2.480 . 0 0 "[ . 1 . 2]" 1
1048 1 53 VAL H 1 54 ASP H . . 3.220 2.418 2.070 2.664 . 0 0 "[ . 1 . 2]" 1
1049 1 53 VAL H 1 55 ASN QB . . 5.340 5.041 4.419 5.394 0.054 10 0 "[ . 1 . 2]" 1
1050 1 53 VAL HA 1 53 VAL QG . . 3.100 2.232 2.192 2.305 . 0 0 "[ . 1 . 2]" 1
1051 1 53 VAL HA 1 54 ASP QB . . 5.340 5.292 5.122 5.490 0.150 16 0 "[ . 1 . 2]" 1
1052 1 53 VAL HA 1 55 ASN H . . 4.720 4.136 3.670 4.674 . 0 0 "[ . 1 . 2]" 1
1053 1 53 VAL HB 1 54 ASP H . . 3.820 3.134 2.441 3.903 0.083 7 0 "[ . 1 . 2]" 1
1054 1 53 VAL HB 1 55 ASN H . . 5.500 5.260 4.833 5.679 0.179 11 0 "[ . 1 . 2]" 1
1055 1 53 VAL QG 1 54 ASP H . . 3.940 3.061 2.300 3.523 . 0 0 "[ . 1 . 2]" 1
1056 1 53 VAL QG 1 54 ASP QB . . 4.830 4.173 3.076 4.875 0.045 10 0 "[ . 1 . 2]" 1
1057 1 53 VAL QG 1 55 ASN H . . 5.100 4.518 4.196 4.875 . 0 0 "[ . 1 . 2]" 1
1058 1 53 VAL MG1 1 54 ASP H . . 4.760 3.847 3.355 4.175 . 0 0 "[ . 1 . 2]" 1
1059 1 53 VAL MG2 1 54 ASP H . . 4.760 3.392 2.313 3.962 . 0 0 "[ . 1 . 2]" 1
1060 1 54 ASP H 1 54 ASP QB . . 3.000 2.331 2.202 2.486 . 0 0 "[ . 1 . 2]" 1
1061 1 54 ASP H 1 55 ASN QB . . 5.180 4.487 4.177 4.767 . 0 0 "[ . 1 . 2]" 1
1062 1 54 ASP QB 1 55 ASN H . . 3.240 2.733 2.399 3.082 . 0 0 "[ . 1 . 2]" 1
1063 1 55 ASN H 1 55 ASN HA . . 2.840 2.859 2.804 2.933 0.093 5 0 "[ . 1 . 2]" 1
1064 1 55 ASN H 1 55 ASN QB . . 3.270 2.278 2.063 2.449 . 0 0 "[ . 1 . 2]" 1
1065 1 55 ASN H 1 55 ASN HD21 . . 5.270 4.638 4.457 4.983 . 0 0 "[ . 1 . 2]" 1
1066 1 55 ASN H 1 55 ASN HD22 . . 5.500 5.266 4.542 5.773 0.273 16 0 "[ . 1 . 2]" 1
1067 1 55 ASN HA 1 55 ASN HD21 . . 3.860 2.850 1.931 3.880 0.020 13 0 "[ . 1 . 2]" 1
1068 1 55 ASN HA 1 55 ASN HD22 . . 4.170 3.813 3.413 4.343 0.173 13 0 "[ . 1 . 2]" 1
1069 1 55 ASN HA 1 56 ALA H . . 2.720 2.281 2.118 3.170 0.450 8 0 "[ . 1 . 2]" 1
1070 1 55 ASN HA 1 56 ALA MB . . 4.170 3.987 3.920 4.133 . 0 0 "[ . 1 . 2]" 1
1071 1 55 ASN QB 1 55 ASN HD21 . . 3.080 2.455 2.125 2.915 . 0 0 "[ . 1 . 2]" 1
1072 1 55 ASN QB 1 55 ASN HD22 . . 3.550 3.366 3.214 3.515 . 0 0 "[ . 1 . 2]" 1
1073 1 55 ASN QB 1 56 ALA H . . 3.990 3.232 2.527 3.975 . 0 0 "[ . 1 . 2]" 1
1074 1 55 ASN QB 1 58 ALA H . . 5.030 3.141 2.276 4.842 . 0 0 "[ . 1 . 2]" 1
1075 1 55 ASN QB 1 58 ALA MB . . 3.850 2.065 1.698 3.092 . 0 0 "[ . 1 . 2]" 1
1076 1 55 ASN HB2 1 56 ALA H . . 4.570 4.160 3.707 4.627 0.057 20 0 "[ . 1 . 2]" 1
1077 1 55 ASN HB2 1 58 ALA MB . . 4.570 3.053 2.133 4.219 . 0 0 "[ . 1 . 2]" 1
1078 1 55 ASN HB3 1 56 ALA H . . 4.570 3.421 2.571 4.436 . 0 0 "[ . 1 . 2]" 1
1079 1 55 ASN HB3 1 58 ALA MB . . 4.570 2.138 1.711 3.180 . 0 0 "[ . 1 . 2]" 1
1080 1 55 ASN HD21 1 58 ALA H . . 4.910 3.938 2.786 5.010 0.100 19 0 "[ . 1 . 2]" 1
1081 1 55 ASN HD21 1 58 ALA MB . . 4.470 2.553 1.802 3.858 . 0 0 "[ . 1 . 2]" 1
1082 1 55 ASN HD22 1 58 ALA H . . 5.500 5.161 4.260 5.629 0.129 3 0 "[ . 1 . 2]" 1
1083 1 55 ASN HD22 1 58 ALA MB . . 4.650 3.102 2.547 3.456 . 0 0 "[ . 1 . 2]" 1
1084 1 56 ALA H 1 56 ALA MB . . 2.890 2.271 2.189 2.755 . 0 0 "[ . 1 . 2]" 1
1085 1 56 ALA H 1 58 ALA H . . 5.120 3.973 3.270 4.714 . 0 0 "[ . 1 . 2]" 1
1086 1 56 ALA MB 1 57 HIS H . . 4.050 2.365 1.957 3.310 . 0 0 "[ . 1 . 2]" 1
1087 1 56 ALA MB 1 57 HIS HD2 . . 5.210 3.761 1.931 5.008 . 0 0 "[ . 1 . 2]" 1
1088 1 56 ALA MB 1 58 ALA H . . 4.580 4.153 3.833 4.637 0.057 16 0 "[ . 1 . 2]" 1
1089 1 57 HIS H 1 57 HIS HD2 . . 5.280 3.928 2.353 5.233 . 0 0 "[ . 1 . 2]" 1
1090 1 57 HIS H 1 58 ALA H . . 3.180 2.472 2.156 2.787 . 0 0 "[ . 1 . 2]" 1
1091 1 57 HIS H 1 58 ALA MB . . 4.620 3.957 3.547 4.515 . 0 0 "[ . 1 . 2]" 1
1092 1 57 HIS HA 1 57 HIS HD2 . . 3.600 3.001 2.442 3.661 0.061 2 0 "[ . 1 . 2]" 1
1093 1 57 HIS HA 1 58 ALA H . . 3.000 3.104 2.977 3.244 0.244 8 0 "[ . 1 . 2]" 1
1094 1 57 HIS HB2 1 58 ALA H . . 4.530 3.913 3.476 4.135 . 0 0 "[ . 1 . 2]" 1
1095 1 57 HIS HB3 1 58 ALA H . . 4.530 4.403 4.148 4.551 0.021 3 0 "[ . 1 . 2]" 1
1096 1 58 ALA H 1 58 ALA MB . . 2.730 2.311 2.244 2.359 . 0 0 "[ . 1 . 2]" 1
1097 1 58 ALA H 1 59 ARG H . . 4.640 4.219 4.077 4.490 . 0 0 "[ . 1 . 2]" 1
1098 1 58 ALA H 1 59 ARG QB . . 5.500 5.511 4.928 5.771 0.271 12 0 "[ . 1 . 2]" 1
1099 1 58 ALA H 1 60 TYR QE . . 5.500 5.110 4.740 5.550 0.050 3 0 "[ . 1 . 2]" 1
1100 1 58 ALA HA 1 59 ARG H . . 2.740 2.152 2.095 2.225 . 0 0 "[ . 1 . 2]" 1
1101 1 58 ALA MB 1 59 ARG H . . 3.430 3.443 3.159 3.581 0.151 11 0 "[ . 1 . 2]" 1
1102 1 58 ALA MB 1 60 TYR H . . 5.500 4.889 4.221 5.378 . 0 0 "[ . 1 . 2]" 1
1103 1 58 ALA MB 1 60 TYR QD . . 4.680 3.644 3.033 4.069 . 0 0 "[ . 1 . 2]" 1
1104 1 58 ALA MB 1 60 TYR QE . . 3.560 2.199 1.578 2.916 . 0 0 "[ . 1 . 2]" 1
1105 1 59 ARG H 1 59 ARG QB . . 3.180 2.451 2.256 2.731 . 0 0 "[ . 1 . 2]" 1
1106 1 59 ARG H 1 59 ARG QD . . 4.350 3.569 2.635 4.342 . 0 0 "[ . 1 . 2]" 1
1107 1 59 ARG H 1 59 ARG QG . . 4.590 3.646 2.529 4.344 . 0 0 "[ . 1 . 2]" 1
1108 1 59 ARG H 1 60 TYR H . . 4.380 4.217 3.594 4.447 0.067 6 0 "[ . 1 . 2]" 1
1109 1 59 ARG H 1 60 TYR HA . . 5.330 4.855 4.323 5.084 . 0 0 "[ . 1 . 2]" 1
1110 1 59 ARG HA 1 59 ARG HD2 . . 3.800 2.570 1.890 3.232 . 0 0 "[ . 1 . 2]" 1
1111 1 59 ARG HA 1 59 ARG HD3 . . 3.800 3.165 2.023 3.946 0.146 14 0 "[ . 1 . 2]" 1
1112 1 59 ARG HA 1 59 ARG QG . . 3.940 2.737 2.452 3.236 . 0 0 "[ . 1 . 2]" 1
1113 1 59 ARG HA 1 60 TYR H . . 2.810 2.143 2.094 2.190 . 0 0 "[ . 1 . 2]" 1
1114 1 59 ARG HA 1 60 TYR QD . . 4.310 3.401 2.725 4.187 . 0 0 "[ . 1 . 2]" 1
1115 1 59 ARG QB 1 59 ARG HD2 . . 3.370 2.801 2.374 3.099 . 0 0 "[ . 1 . 2]" 1
1116 1 59 ARG QB 1 59 ARG HD3 . . 3.370 2.737 2.401 3.567 0.197 13 0 "[ . 1 . 2]" 1
1117 1 59 ARG QB 1 59 ARG QG . . 2.400 2.011 1.994 2.022 . 0 0 "[ . 1 . 2]" 1
1118 1 59 ARG QB 1 60 TYR H . . 3.760 3.512 3.019 3.964 0.204 20 0 "[ . 1 . 2]" 1
1119 1 59 ARG QD 1 60 TYR H . . 4.410 3.952 2.754 4.603 0.193 2 0 "[ . 1 . 2]" 1
1120 1 59 ARG QG 1 60 TYR H . . 5.050 4.137 2.975 4.983 . 0 0 "[ . 1 . 2]" 1
1121 1 60 TYR H 1 60 TYR HB2 . . 3.310 2.486 2.301 2.598 . 0 0 "[ . 1 . 2]" 1
1122 1 60 TYR H 1 60 TYR QD . . 3.300 2.467 2.034 3.230 . 0 0 "[ . 1 . 2]" 1
1123 1 60 TYR H 1 60 TYR QE . . 4.650 4.525 4.243 4.812 0.162 3 0 "[ . 1 . 2]" 1
1124 1 60 TYR H 1 61 PHE H . . 4.770 4.301 3.931 4.525 . 0 0 "[ . 1 . 2]" 1
1125 1 60 TYR HA 1 60 TYR QD . . 4.000 2.973 2.003 3.175 . 0 0 "[ . 1 . 2]" 1
1126 1 60 TYR HA 1 61 PHE H . . 2.940 2.113 2.074 2.219 . 0 0 "[ . 1 . 2]" 1
1127 1 60 TYR HB2 1 61 PHE H . . 4.860 4.297 3.964 4.571 . 0 0 "[ . 1 . 2]" 1
1128 1 60 TYR HB3 1 61 PHE H . . 4.320 3.489 2.886 4.169 . 0 0 "[ . 1 . 2]" 1
1129 1 60 TYR QD 1 61 PHE H . . 5.070 4.377 3.926 4.786 . 0 0 "[ . 1 . 2]" 1
1130 1 61 PHE H 1 61 PHE HB2 . . 4.050 2.588 2.384 2.769 . 0 0 "[ . 1 . 2]" 1
1131 1 61 PHE H 1 61 PHE QB . . 3.240 2.542 2.352 2.711 . 0 0 "[ . 1 . 2]" 1
1132 1 61 PHE H 1 61 PHE HB3 . . 4.050 3.733 3.602 3.859 . 0 0 "[ . 1 . 2]" 1
1133 1 61 PHE H 1 61 PHE QD . . 3.640 3.169 2.575 3.624 . 0 0 "[ . 1 . 2]" 1
1134 1 61 PHE H 1 62 ILE H . . 5.230 4.292 4.144 4.415 . 0 0 "[ . 1 . 2]" 1
1135 1 61 PHE H 2 68 LEU QD . . 5.440 3.856 3.289 4.863 . 0 0 "[ . 1 . 2]" 1
1136 1 61 PHE HA 1 62 ILE H . . 3.030 2.799 2.621 3.042 0.012 13 0 "[ . 1 . 2]" 1
1137 1 61 PHE HA 1 62 ILE HB . . 5.370 5.087 4.940 5.197 . 0 0 "[ . 1 . 2]" 1
1138 1 61 PHE HA 1 62 ILE HG13 . . 5.450 3.206 2.875 3.419 . 0 0 "[ . 1 . 2]" 1
1139 1 61 PHE QB 1 62 ILE H . . 3.180 1.850 1.661 2.049 . 0 0 "[ . 1 . 2]" 1
1140 1 61 PHE QB 2 68 LEU HA . . 4.620 3.990 3.591 4.581 . 0 0 "[ . 1 . 2]" 1
1141 1 61 PHE QB 2 68 LEU QB . . 3.720 2.017 1.864 2.346 . 0 0 "[ . 1 . 2]" 1
1142 1 61 PHE QB 2 68 LEU QD . . 3.130 2.053 1.729 2.679 . 0 0 "[ . 1 . 2]" 1
1143 1 61 PHE QB 2 68 LEU HG . . 5.240 3.468 2.452 4.281 . 0 0 "[ . 1 . 2]" 1
1144 1 61 PHE QB 2 69 LEU H . . 4.200 3.622 3.327 4.073 . 0 0 "[ . 1 . 2]" 1
1145 1 61 PHE HB2 1 62 ILE H . . 3.800 2.949 2.631 3.180 . 0 0 "[ . 1 . 2]" 1
1146 1 61 PHE HB2 2 68 LEU HA . . 5.500 4.722 4.091 5.072 . 0 0 "[ . 1 . 2]" 1
1147 1 61 PHE HB2 2 68 LEU MD1 . . 5.010 2.140 1.742 2.938 . 0 0 "[ . 1 . 2]" 1
1148 1 61 PHE HB2 2 68 LEU MD2 . . 5.010 3.802 2.476 4.632 . 0 0 "[ . 1 . 2]" 1
1149 1 61 PHE HB3 1 62 ILE H . . 3.800 1.870 1.673 2.080 . 0 0 "[ . 1 . 2]" 1
1150 1 61 PHE HB3 2 68 LEU HA . . 5.500 4.323 3.930 5.249 . 0 0 "[ . 1 . 2]" 1
1151 1 61 PHE HB3 2 68 LEU MD1 . . 5.010 3.087 2.682 3.431 . 0 0 "[ . 1 . 2]" 1
1152 1 61 PHE HB3 2 68 LEU MD2 . . 5.010 4.278 3.126 5.052 0.042 8 0 "[ . 1 . 2]" 1
1153 1 61 PHE QD 1 62 ILE H . . 4.320 3.756 3.578 4.038 . 0 0 "[ . 1 . 2]" 1
1154 1 61 PHE QD 2 68 LEU QB . . 4.200 3.004 2.123 3.642 . 0 0 "[ . 1 . 2]" 1
1155 1 61 PHE QD 2 68 LEU MD1 . . 4.290 2.716 1.796 3.586 . 0 0 "[ . 1 . 2]" 1
1156 1 61 PHE QD 2 68 LEU QD . . 3.680 2.640 1.795 3.298 . 0 0 "[ . 1 . 2]" 1
1157 1 61 PHE QD 2 68 LEU MD2 . . 4.290 4.068 3.706 4.433 0.143 20 0 "[ . 1 . 2]" 1
1158 1 61 PHE QD 2 69 LEU H . . 5.170 5.227 4.922 5.320 0.150 20 0 "[ . 1 . 2]" 1
1159 1 61 PHE QD 2 70 ASP H . . 5.500 4.472 3.669 5.414 . 0 0 "[ . 1 . 2]" 1
1160 1 62 ILE H 1 62 ILE HB . . 3.270 2.920 2.833 3.027 . 0 0 "[ . 1 . 2]" 1
1161 1 62 ILE H 1 62 ILE MD . . 4.070 4.005 3.777 4.233 0.163 3 0 "[ . 1 . 2]" 1
1162 1 62 ILE H 1 62 ILE HG12 . . 3.920 3.796 3.622 3.937 0.017 9 0 "[ . 1 . 2]" 1
1163 1 62 ILE H 1 62 ILE HG13 . . 3.700 2.635 2.379 2.900 . 0 0 "[ . 1 . 2]" 1
1164 1 62 ILE H 1 62 ILE MG . . 4.040 3.983 3.945 4.036 . 0 0 "[ . 1 . 2]" 1
1165 1 62 ILE H 1 63 ILE H . . 4.620 4.431 4.347 4.486 . 0 0 "[ . 1 . 2]" 1
1166 1 62 ILE H 2 68 LEU HA . . 4.860 4.572 3.924 4.901 0.041 14 0 "[ . 1 . 2]" 1
1167 1 62 ILE H 2 68 LEU QB . . 4.920 3.172 2.770 3.701 . 0 0 "[ . 1 . 2]" 1
1168 1 62 ILE H 2 68 LEU QD . . 4.260 3.637 3.201 4.188 . 0 0 "[ . 1 . 2]" 1
1169 1 62 ILE H 2 68 LEU HG . . 5.500 5.521 4.811 5.932 0.432 9 0 "[ . 1 . 2]" 1
1170 1 62 ILE H 2 69 LEU HB2 . . 3.970 3.598 3.140 4.028 0.058 9 0 "[ . 1 . 2]" 1
1171 1 62 ILE HA 1 62 ILE MD . . 4.440 4.035 3.968 4.106 . 0 0 "[ . 1 . 2]" 1
1172 1 62 ILE HA 1 62 ILE HG12 . . 4.190 2.892 2.760 3.025 . 0 0 "[ . 1 . 2]" 1
1173 1 62 ILE HA 1 62 ILE HG13 . . 4.120 3.320 3.247 3.378 . 0 0 "[ . 1 . 2]" 1
1174 1 62 ILE HA 1 62 ILE MG . . 3.310 2.320 2.278 2.373 . 0 0 "[ . 1 . 2]" 1
1175 1 62 ILE HA 1 63 ILE H . . 2.910 2.368 2.305 2.458 . 0 0 "[ . 1 . 2]" 1
1176 1 62 ILE HA 1 63 ILE HB . . 5.240 4.627 3.924 4.961 . 0 0 "[ . 1 . 2]" 1
1177 1 62 ILE HA 1 63 ILE QG . . 5.040 4.092 3.647 5.223 0.183 7 0 "[ . 1 . 2]" 1
1178 1 62 ILE HB 1 62 ILE MD . . 3.190 2.431 2.387 2.490 . 0 0 "[ . 1 . 2]" 1
1179 1 62 ILE HB 1 63 ILE H . . 5.500 3.633 3.453 3.857 . 0 0 "[ . 1 . 2]" 1
1180 1 62 ILE HB 2 69 LEU H . . 3.990 3.812 3.182 4.118 0.128 11 0 "[ . 1 . 2]" 1
1181 1 62 ILE HB 2 69 LEU HB2 . . 3.280 2.062 1.562 2.452 . 0 0 "[ . 1 . 2]" 1
1182 1 62 ILE MD 1 62 ILE MG . . 2.750 2.023 1.972 2.098 . 0 0 "[ . 1 . 2]" 1
1183 1 62 ILE MD 1 63 ILE H . . 5.140 4.979 4.769 5.147 0.007 2 0 "[ . 1 . 2]" 1
1184 1 62 ILE HG12 1 62 ILE MG . . 3.130 2.405 2.366 2.450 . 0 0 "[ . 1 . 2]" 1
1185 1 62 ILE HG12 1 63 ILE H . . 5.190 4.745 4.530 4.913 . 0 0 "[ . 1 . 2]" 1
1186 1 62 ILE HG13 1 62 ILE MG . . 3.670 3.236 3.218 3.244 . 0 0 "[ . 1 . 2]" 1
1187 1 62 ILE MG 1 63 ILE H . . 3.160 2.163 1.900 2.418 . 0 0 "[ . 1 . 2]" 1
1188 1 62 ILE MG 1 63 ILE HA . . 4.000 3.786 3.641 4.028 0.028 1 0 "[ . 1 . 2]" 1
1189 1 62 ILE MG 2 69 LEU HB2 . . 4.710 3.309 3.038 3.537 . 0 0 "[ . 1 . 2]" 1
1190 1 63 ILE H 1 63 ILE HB . . 3.210 2.821 2.587 2.961 . 0 0 "[ . 1 . 2]" 1
1191 1 63 ILE H 1 63 ILE MD . . 5.350 4.493 4.248 4.813 . 0 0 "[ . 1 . 2]" 1
1192 1 63 ILE H 1 63 ILE QG . . 4.660 3.302 2.909 4.132 . 0 0 "[ . 1 . 2]" 1
1193 1 63 ILE H 1 64 HIS H . . 4.510 4.325 4.239 4.465 . 0 0 "[ . 1 . 2]" 1
1194 1 63 ILE H 2 69 LEU HB2 . . 5.500 4.374 4.057 4.820 . 0 0 "[ . 1 . 2]" 1
1195 1 63 ILE HA 1 63 ILE MD . . 3.960 3.854 3.748 3.950 . 0 0 "[ . 1 . 2]" 1
1196 1 63 ILE HA 1 63 ILE HG12 . . 4.040 2.538 2.316 2.721 . 0 0 "[ . 1 . 2]" 1
1197 1 63 ILE HA 1 63 ILE HG13 . . 4.040 3.039 2.379 3.245 . 0 0 "[ . 1 . 2]" 1
1198 1 63 ILE HA 1 64 HIS H . . 3.070 2.207 2.091 2.318 . 0 0 "[ . 1 . 2]" 1
1199 1 63 ILE HA 1 64 HIS QB . . 4.720 4.482 4.382 4.655 . 0 0 "[ . 1 . 2]" 1
1200 1 63 ILE HA 1 64 HIS HD2 . . 5.500 3.926 2.893 4.887 . 0 0 "[ . 1 . 2]" 1
1201 1 63 ILE HA 2 68 LEU QD . . 4.520 4.022 3.352 4.493 . 0 0 "[ . 1 . 2]" 1
1202 1 63 ILE HA 2 69 LEU H . . 4.570 3.204 2.973 3.584 . 0 0 "[ . 1 . 2]" 1
1203 1 63 ILE HA 2 69 LEU MD1 . . 5.000 2.772 1.589 3.664 . 0 0 "[ . 1 . 2]" 1
1204 1 63 ILE HA 2 69 LEU QD . . 4.290 2.723 1.584 3.569 . 0 0 "[ . 1 . 2]" 1
1205 1 63 ILE HA 2 69 LEU MD2 . . 5.000 4.090 3.076 4.918 . 0 0 "[ . 1 . 2]" 1
1206 1 63 ILE HB 1 63 ILE MD . . 2.980 2.511 2.445 2.589 . 0 0 "[ . 1 . 2]" 1
1207 1 63 ILE MD 1 64 HIS H . . 4.720 4.778 4.426 4.915 0.195 4 0 "[ . 1 . 2]" 1
1208 1 63 ILE MD 2 9 ILE H . . 5.090 4.639 4.153 4.979 . 0 0 "[ . 1 . 2]" 1
1209 1 63 ILE MD 2 9 ILE MD . . 2.710 2.134 1.895 2.447 . 0 0 "[ . 1 . 2]" 1
1210 1 63 ILE MD 2 9 ILE HG13 . . 5.230 4.000 3.402 4.610 . 0 0 "[ . 1 . 2]" 1
1211 1 63 ILE MD 2 64 HIS QB . . 5.340 5.229 4.831 5.477 0.137 18 0 "[ . 1 . 2]" 1
1212 1 63 ILE MD 2 65 ALA H . . 4.560 4.271 3.805 4.640 0.080 12 0 "[ . 1 . 2]" 1
1213 1 63 ILE MD 2 65 ALA HA . . 3.280 2.396 2.068 2.736 . 0 0 "[ . 1 . 2]" 1
1214 1 63 ILE MD 2 65 ALA MB . . 3.180 2.512 2.213 3.042 . 0 0 "[ . 1 . 2]" 1
1215 1 63 ILE MD 2 68 LEU QD . . 3.120 2.216 1.919 2.575 . 0 0 "[ . 1 . 2]" 1
1216 1 63 ILE MD 2 68 LEU HG . . 5.500 4.570 4.100 4.982 . 0 0 "[ . 1 . 2]" 1
1217 1 63 ILE QG 2 68 LEU HA . . 4.380 2.820 2.472 3.410 . 0 0 "[ . 1 . 2]" 1
1218 1 63 ILE QG 2 68 LEU QD . . 3.530 2.065 1.759 2.313 . 0 0 "[ . 1 . 2]" 1
1219 1 63 ILE HG12 2 68 LEU HA . . 5.020 2.993 2.514 4.470 . 0 0 "[ . 1 . 2]" 1
1220 1 63 ILE HG13 2 68 LEU HA . . 5.020 3.785 3.077 4.432 . 0 0 "[ . 1 . 2]" 1
1221 1 64 HIS H 1 64 HIS HB2 . . 3.870 3.581 2.651 3.686 . 0 0 "[ . 1 . 2]" 1
1222 1 64 HIS H 1 64 HIS QB . . 3.380 2.670 2.536 2.852 . 0 0 "[ . 1 . 2]" 1
1223 1 64 HIS H 1 64 HIS HB3 . . 3.870 2.799 2.587 3.616 . 0 0 "[ . 1 . 2]" 1
1224 1 64 HIS H 1 64 HIS HD2 . . 5.480 2.490 1.871 3.261 . 0 0 "[ . 1 . 2]" 1
1225 1 64 HIS H 1 65 ALA H . . 5.420 4.445 4.219 4.632 . 0 0 "[ . 1 . 2]" 1
1226 1 64 HIS H 2 69 LEU QD . . 4.170 2.404 2.029 3.499 . 0 0 "[ . 1 . 2]" 1
1227 1 64 HIS H 2 69 LEU HG . . 5.050 3.261 2.690 4.568 . 0 0 "[ . 1 . 2]" 1
1228 1 64 HIS HA 1 64 HIS HD2 . . 5.060 4.502 3.973 4.829 . 0 0 "[ . 1 . 2]" 1
1229 1 64 HIS HA 1 65 ALA H . . 2.850 2.167 2.121 2.253 . 0 0 "[ . 1 . 2]" 1
1230 1 64 HIS HA 2 69 LEU QD . . 4.100 3.038 2.492 3.247 . 0 0 "[ . 1 . 2]" 1
1231 1 64 HIS QB 1 65 ALA H . . 3.900 3.383 3.014 3.676 . 0 0 "[ . 1 . 2]" 1
1232 1 64 HIS QB 2 63 ILE MD . . 5.340 5.169 4.237 5.415 0.075 2 0 "[ . 1 . 2]" 1
1233 1 64 HIS QB 2 69 LEU QD . . 4.180 2.132 1.812 3.530 . 0 0 "[ . 1 . 2]" 1
1234 1 64 HIS HB2 1 65 ALA H . . 4.650 3.579 3.089 4.243 . 0 0 "[ . 1 . 2]" 1
1235 1 64 HIS HB3 1 65 ALA H . . 4.650 4.262 3.600 4.444 . 0 0 "[ . 1 . 2]" 1
1236 1 64 HIS HD2 2 69 LEU QD . . 3.200 2.341 1.814 3.254 0.054 19 0 "[ . 1 . 2]" 1
1237 1 65 ALA H 1 65 ALA MB . . 3.050 2.355 2.274 2.614 . 0 0 "[ . 1 . 2]" 1
1238 1 65 ALA H 2 63 ILE MD . . 4.560 4.192 3.764 4.467 . 0 0 "[ . 1 . 2]" 1
1239 1 65 ALA H 2 69 LEU QD . . 5.440 4.736 4.213 4.937 . 0 0 "[ . 1 . 2]" 1
1240 1 65 ALA HA 2 63 ILE MD . . 3.280 2.278 1.964 2.622 . 0 0 "[ . 1 . 2]" 1
1241 1 65 ALA MB 1 67 LYS H . . 5.100 4.969 4.542 5.442 0.342 8 0 "[ . 1 . 2]" 1
1242 1 65 ALA MB 2 63 ILE MD . . 3.180 2.587 2.133 3.038 . 0 0 "[ . 1 . 2]" 1
1243 1 66 HIS H 1 67 LYS H . . 4.240 2.579 2.028 4.354 0.114 8 0 "[ . 1 . 2]" 1
1244 1 66 HIS H 1 67 LYS QB . . 5.340 4.529 3.960 5.322 . 0 0 "[ . 1 . 2]" 1
1245 1 66 HIS HA 1 66 HIS HE1 . . 5.080 5.014 4.708 5.262 0.182 9 0 "[ . 1 . 2]" 1
1246 1 66 HIS QB 1 66 HIS HE1 . . 4.670 4.474 4.386 4.646 . 0 0 "[ . 1 . 2]" 1
1247 1 66 HIS QB 1 67 LYS QB . . 5.180 3.728 3.530 4.107 . 0 0 "[ . 1 . 2]" 1
1248 1 66 HIS HB2 1 67 LYS H . . 4.050 3.854 3.567 4.310 0.260 16 0 "[ . 1 . 2]" 1
1249 1 66 HIS HB3 1 67 LYS H . . 4.050 2.793 2.234 4.137 0.087 16 0 "[ . 1 . 2]" 1
1250 1 67 LYS H 1 67 LYS HB2 . . 3.900 3.062 2.748 3.330 . 0 0 "[ . 1 . 2]" 1
1251 1 67 LYS H 1 67 LYS QB . . 3.420 2.546 2.305 3.087 . 0 0 "[ . 1 . 2]" 1
1252 1 67 LYS H 1 67 LYS HB3 . . 3.900 2.749 2.467 3.720 . 0 0 "[ . 1 . 2]" 1
1253 1 67 LYS H 1 67 LYS QG . . 4.530 4.138 4.010 4.605 0.075 8 0 "[ . 1 . 2]" 1
1254 1 67 LYS H 1 68 LEU H . . 4.410 3.995 3.240 4.307 . 0 0 "[ . 1 . 2]" 1
1255 1 67 LYS HA 1 67 LYS QD . . 4.320 3.456 2.003 4.199 . 0 0 "[ . 1 . 2]" 1
1256 1 67 LYS HA 1 67 LYS QG . . 3.390 2.657 2.410 3.124 . 0 0 "[ . 1 . 2]" 1
1257 1 67 LYS HA 1 68 LEU H . . 2.710 2.155 2.084 2.238 . 0 0 "[ . 1 . 2]" 1
1258 1 67 LYS HB2 1 68 LEU H . . 4.580 4.447 4.240 4.589 0.009 16 0 "[ . 1 . 2]" 1
1259 1 67 LYS HB3 1 68 LEU H . . 4.580 4.400 4.191 4.524 . 0 0 "[ . 1 . 2]" 1
1260 1 67 LYS QD 1 68 LEU H . . 5.500 4.487 2.545 5.516 0.016 17 0 "[ . 1 . 2]" 1
1261 1 67 LYS QD 1 69 LEU QD . . 4.790 4.070 2.443 4.850 0.060 20 0 "[ . 1 . 2]" 1
1262 1 67 LYS QE 1 67 LYS QG . . 3.190 2.275 2.147 2.434 . 0 0 "[ . 1 . 2]" 1
1263 1 67 LYS QE 1 68 LEU H . . 5.500 5.045 3.985 5.701 0.201 12 0 "[ . 1 . 2]" 1
1264 1 67 LYS QE 1 69 LEU QD . . 3.710 3.057 2.103 3.826 0.116 5 0 "[ . 1 . 2]" 1
1265 1 67 LYS QG 1 68 LEU H . . 4.050 3.439 2.811 4.124 0.074 15 0 "[ . 1 . 2]" 1
1266 1 67 LYS QG 1 69 LEU QD . . 4.140 3.377 2.750 4.195 0.055 16 0 "[ . 1 . 2]" 1
1267 1 68 LEU H 1 68 LEU HB2 . . 3.870 2.420 2.220 2.608 . 0 0 "[ . 1 . 2]" 1
1268 1 68 LEU H 1 68 LEU QB . . 3.080 2.384 2.197 2.561 . 0 0 "[ . 1 . 2]" 1
1269 1 68 LEU H 1 68 LEU HB3 . . 3.870 3.606 3.501 3.748 . 0 0 "[ . 1 . 2]" 1
1270 1 68 LEU H 1 68 LEU MD1 . . 4.430 3.736 3.134 4.087 . 0 0 "[ . 1 . 2]" 1
1271 1 68 LEU H 1 68 LEU QD . . 3.750 2.577 1.841 3.548 . 0 0 "[ . 1 . 2]" 1
1272 1 68 LEU H 1 68 LEU MD2 . . 4.430 2.702 1.854 3.925 . 0 0 "[ . 1 . 2]" 1
1273 1 68 LEU H 1 68 LEU HG . . 3.630 3.459 2.345 3.997 0.367 12 0 "[ . 1 . 2]" 1
1274 1 68 LEU H 1 69 LEU H . . 4.900 4.505 4.278 4.611 . 0 0 "[ . 1 . 2]" 1
1275 1 68 LEU HA 1 68 LEU MD1 . . 3.900 2.889 2.123 3.984 0.084 7 0 "[ . 1 . 2]" 1
1276 1 68 LEU HA 1 68 LEU QD . . 2.970 2.105 1.953 2.243 . 0 0 "[ . 1 . 2]" 1
1277 1 68 LEU HA 1 68 LEU MD2 . . 3.900 2.627 1.959 3.417 . 0 0 "[ . 1 . 2]" 1
1278 1 68 LEU HA 1 68 LEU HG . . 3.800 3.540 2.955 3.836 0.036 20 0 "[ . 1 . 2]" 1
1279 1 68 LEU HA 1 69 LEU H . . 3.010 2.260 2.118 2.578 . 0 0 "[ . 1 . 2]" 1
1280 1 68 LEU HA 2 61 PHE HB2 . . 5.500 4.685 4.029 5.171 . 0 0 "[ . 1 . 2]" 1
1281 1 68 LEU HA 2 61 PHE QB . . 4.620 3.952 3.639 4.284 . 0 0 "[ . 1 . 2]" 1
1282 1 68 LEU HA 2 61 PHE HB3 . . 5.500 4.281 3.819 4.797 . 0 0 "[ . 1 . 2]" 1
1283 1 68 LEU HA 2 62 ILE H . . 4.860 4.560 3.905 4.996 0.136 11 0 "[ . 1 . 2]" 1
1284 1 68 LEU HA 2 63 ILE HG12 . . 5.020 3.092 2.291 4.752 . 0 0 "[ . 1 . 2]" 1
1285 1 68 LEU HA 2 63 ILE QG . . 4.380 2.794 2.275 3.143 . 0 0 "[ . 1 . 2]" 1
1286 1 68 LEU HA 2 63 ILE HG13 . . 5.020 3.757 2.931 4.441 . 0 0 "[ . 1 . 2]" 1
1287 1 68 LEU QB 1 68 LEU QD . . 2.540 2.066 1.989 2.117 . 0 0 "[ . 1 . 2]" 1
1288 1 68 LEU QB 1 69 LEU H . . 3.940 2.856 2.037 3.292 . 0 0 "[ . 1 . 2]" 1
1289 1 68 LEU QB 2 21 VAL QG . . 4.140 3.004 2.095 3.749 . 0 0 "[ . 1 . 2]" 1
1290 1 68 LEU QB 2 61 PHE QB . . 3.720 1.998 1.823 2.253 . 0 0 "[ . 1 . 2]" 1
1291 1 68 LEU QB 2 61 PHE QD . . 4.200 3.050 2.487 3.529 . 0 0 "[ . 1 . 2]" 1
1292 1 68 LEU QB 2 62 ILE H . . 4.920 3.199 2.735 3.581 . 0 0 "[ . 1 . 2]" 1
1293 1 68 LEU QD 1 69 LEU H . . 4.730 3.450 3.121 3.743 . 0 0 "[ . 1 . 2]" 1
1294 1 68 LEU QD 2 21 VAL HA . . 5.300 4.552 3.669 5.097 . 0 0 "[ . 1 . 2]" 1
1295 1 68 LEU QD 2 21 VAL HB . . 4.340 4.066 3.286 4.430 0.090 1 0 "[ . 1 . 2]" 1
1296 1 68 LEU QD 2 21 VAL QG . . 2.720 1.910 1.583 2.249 . 0 0 "[ . 1 . 2]" 1
1297 1 68 LEU QD 2 61 PHE H . . 5.440 4.029 3.035 5.040 . 0 0 "[ . 1 . 2]" 1
1298 1 68 LEU QD 2 61 PHE QB . . 3.130 2.175 1.698 3.028 . 0 0 "[ . 1 . 2]" 1
1299 1 68 LEU QD 2 61 PHE QD . . 3.680 2.810 1.835 3.397 . 0 0 "[ . 1 . 2]" 1
1300 1 68 LEU QD 2 62 ILE H . . 4.260 3.726 3.067 4.264 0.004 20 0 "[ . 1 . 2]" 1
1301 1 68 LEU QD 2 63 ILE HA . . 4.520 3.996 3.325 4.532 0.012 5 0 "[ . 1 . 2]" 1
1302 1 68 LEU QD 2 63 ILE MD . . 3.120 2.268 2.009 2.529 . 0 0 "[ . 1 . 2]" 1
1303 1 68 LEU QD 2 63 ILE QG . . 3.530 2.076 1.846 2.365 . 0 0 "[ . 1 . 2]" 1
1304 1 68 LEU MD1 2 61 PHE HB2 . . 5.010 2.308 1.712 3.246 . 0 0 "[ . 1 . 2]" 1
1305 1 68 LEU MD1 2 61 PHE HB3 . . 5.010 3.172 2.322 4.164 . 0 0 "[ . 1 . 2]" 1
1306 1 68 LEU MD1 2 61 PHE QD . . 4.290 2.945 1.840 3.954 . 0 0 "[ . 1 . 2]" 1
1307 1 68 LEU MD2 2 61 PHE HB2 . . 5.010 3.855 2.280 5.023 0.013 10 0 "[ . 1 . 2]" 1
1308 1 68 LEU MD2 2 61 PHE HB3 . . 5.010 4.290 3.036 4.980 . 0 0 "[ . 1 . 2]" 1
1309 1 68 LEU MD2 2 61 PHE QD . . 4.290 4.052 3.357 4.441 0.151 3 0 "[ . 1 . 2]" 1
1310 1 68 LEU HG 1 69 LEU H . . 5.500 5.040 4.427 5.416 . 0 0 "[ . 1 . 2]" 1
1311 1 68 LEU HG 2 21 VAL MG1 . . 4.960 3.673 2.396 5.044 0.084 9 0 "[ . 1 . 2]" 1
1312 1 68 LEU HG 2 21 VAL MG2 . . 4.960 4.013 2.281 5.088 0.128 4 0 "[ . 1 . 2]" 1
1313 1 68 LEU HG 2 61 PHE QB . . 5.240 3.350 2.491 4.217 . 0 0 "[ . 1 . 2]" 1
1314 1 68 LEU HG 2 62 ILE H . . 5.500 5.455 4.924 5.829 0.329 3 0 "[ . 1 . 2]" 1
1315 1 68 LEU HG 2 63 ILE MD . . 5.500 4.602 3.813 5.066 . 0 0 "[ . 1 . 2]" 1
1316 1 69 LEU H 1 69 LEU HB2 . . 3.640 2.488 2.331 2.649 . 0 0 "[ . 1 . 2]" 1
1317 1 69 LEU H 1 69 LEU HB3 . . 3.900 3.634 3.574 3.780 . 0 0 "[ . 1 . 2]" 1
1318 1 69 LEU H 1 69 LEU MD1 . . 4.380 3.564 2.189 4.205 . 0 0 "[ . 1 . 2]" 1
1319 1 69 LEU H 1 69 LEU QD . . 3.790 3.048 2.179 3.635 . 0 0 "[ . 1 . 2]" 1
1320 1 69 LEU H 1 69 LEU MD2 . . 4.380 3.517 3.166 3.989 . 0 0 "[ . 1 . 2]" 1
1321 1 69 LEU H 1 69 LEU HG . . 4.510 2.740 2.197 3.966 . 0 0 "[ . 1 . 2]" 1
1322 1 69 LEU H 1 70 ASP H . . 4.470 3.931 2.529 4.578 0.108 7 0 "[ . 1 . 2]" 1
1323 1 69 LEU H 2 61 PHE QB . . 4.200 3.585 3.129 4.053 . 0 0 "[ . 1 . 2]" 1
1324 1 69 LEU H 2 61 PHE QD . . 5.170 5.172 4.247 5.360 0.190 5 0 "[ . 1 . 2]" 1
1325 1 69 LEU H 2 62 ILE HB . . 3.990 3.815 3.155 4.127 0.137 14 0 "[ . 1 . 2]" 1
1326 1 69 LEU H 2 63 ILE HA . . 4.570 3.196 2.838 3.711 . 0 0 "[ . 1 . 2]" 1
1327 1 69 LEU HA 1 69 LEU QD . . 2.930 2.185 1.993 2.762 . 0 0 "[ . 1 . 2]" 1
1328 1 69 LEU HA 1 69 LEU HG . . 4.180 3.119 2.576 3.290 . 0 0 "[ . 1 . 2]" 1
1329 1 69 LEU HA 1 70 ASP H . . 2.640 2.276 2.140 2.746 0.106 10 0 "[ . 1 . 2]" 1
1330 1 69 LEU HB2 1 70 ASP H . . 4.560 4.403 4.010 4.569 0.009 5 0 "[ . 1 . 2]" 1
1331 1 69 LEU HB2 2 38 TYR QE . . 5.500 5.177 4.480 5.553 0.053 12 0 "[ . 1 . 2]" 1
1332 1 69 LEU HB2 2 62 ILE H . . 3.970 3.577 3.017 4.078 0.108 9 0 "[ . 1 . 2]" 1
1333 1 69 LEU HB2 2 62 ILE HB . . 3.280 2.099 1.608 2.502 . 0 0 "[ . 1 . 2]" 1
1334 1 69 LEU HB2 2 62 ILE MG . . 4.710 3.328 2.852 3.657 . 0 0 "[ . 1 . 2]" 1
1335 1 69 LEU HB2 2 63 ILE H . . 5.500 4.358 3.945 4.728 . 0 0 "[ . 1 . 2]" 1
1336 1 69 LEU HB3 1 70 ASP H . . 4.190 3.993 3.021 4.359 0.169 9 0 "[ . 1 . 2]" 1
1337 1 69 LEU HB3 2 38 TYR QE . . 5.240 4.907 4.139 5.267 0.027 13 0 "[ . 1 . 2]" 1
1338 1 69 LEU QD 1 70 ASP H . . 4.540 3.977 3.576 4.341 . 0 0 "[ . 1 . 2]" 1
1339 1 69 LEU QD 2 8 HIS QB . . 5.260 2.831 2.220 3.347 . 0 0 "[ . 1 . 2]" 1
1340 1 69 LEU QD 2 38 TYR QD . . 5.160 4.921 4.162 5.266 0.106 8 0 "[ . 1 . 2]" 1
1341 1 69 LEU QD 2 38 TYR QE . . 3.700 3.733 3.044 3.996 0.296 8 0 "[ . 1 . 2]" 1
1342 1 69 LEU QD 2 63 ILE HA . . 4.290 2.680 1.595 3.442 . 0 0 "[ . 1 . 2]" 1
1343 1 69 LEU QD 2 64 HIS H . . 4.170 2.487 2.024 3.927 . 0 0 "[ . 1 . 2]" 1
1344 1 69 LEU QD 2 64 HIS HA . . 4.100 3.100 2.541 3.598 . 0 0 "[ . 1 . 2]" 1
1345 1 69 LEU QD 2 64 HIS QB . . 4.180 2.193 1.701 4.058 . 0 0 "[ . 1 . 2]" 1
1346 1 69 LEU QD 2 64 HIS HD2 . . 3.200 2.378 1.708 3.249 0.049 7 0 "[ . 1 . 2]" 1
1347 1 69 LEU QD 2 65 ALA H . . 5.440 4.790 4.196 5.216 . 0 0 "[ . 1 . 2]" 1
1348 1 69 LEU MD1 1 70 ASP H . . 5.500 5.381 4.534 5.679 0.179 9 0 "[ . 1 . 2]" 1
1349 1 69 LEU MD1 2 63 ILE HA . . 5.000 2.729 1.601 3.560 . 0 0 "[ . 1 . 2]" 1
1350 1 69 LEU MD2 1 70 ASP H . . 5.500 4.228 3.668 5.543 0.043 3 0 "[ . 1 . 2]" 1
1351 1 69 LEU MD2 2 63 ILE HA . . 5.000 4.061 2.932 4.660 . 0 0 "[ . 1 . 2]" 1
1352 1 69 LEU HG 1 70 ASP H . . 5.190 5.143 4.689 5.275 0.085 6 0 "[ . 1 . 2]" 1
1353 1 69 LEU HG 2 64 HIS H . . 5.050 3.423 2.707 4.694 . 0 0 "[ . 1 . 2]" 1
1354 1 70 ASP H 1 70 ASP HB2 . . 4.060 3.042 2.442 4.061 0.001 7 0 "[ . 1 . 2]" 1
1355 1 70 ASP H 1 70 ASP QB . . 3.230 2.519 2.259 3.272 0.042 7 0 "[ . 1 . 2]" 1
1356 1 70 ASP H 1 70 ASP HB3 . . 4.060 2.833 2.350 3.708 . 0 0 "[ . 1 . 2]" 1
1357 1 70 ASP H 1 71 PRO HD3 . . 5.090 4.349 3.996 4.912 . 0 0 "[ . 1 . 2]" 1
1358 1 70 ASP H 2 61 PHE QD . . 5.500 4.396 3.424 5.516 0.016 12 0 "[ . 1 . 2]" 1
1359 1 70 ASP HA 1 71 PRO QG . . 4.770 3.869 3.690 4.113 . 0 0 "[ . 1 . 2]" 1
1360 1 70 ASP HA 1 72 SER H . . 4.230 3.629 3.173 4.083 . 0 0 "[ . 1 . 2]" 1
1361 1 70 ASP QB 1 71 PRO HD3 . . 5.000 4.061 3.231 4.647 . 0 0 "[ . 1 . 2]" 1
1362 1 70 ASP QB 1 71 PRO QG . . 5.050 5.057 3.954 5.326 0.276 8 0 "[ . 1 . 2]" 1
1363 1 70 ASP QB 1 72 SER H . . 4.550 3.391 2.261 4.192 . 0 0 "[ . 1 . 2]" 1
1364 1 70 ASP QB 1 73 GLU H . . 4.390 3.187 2.432 3.942 . 0 0 "[ . 1 . 2]" 1
1365 1 70 ASP QB 1 73 GLU QG . . 4.620 3.289 1.777 4.707 0.087 3 0 "[ . 1 . 2]" 1
1366 1 70 ASP QB 2 45 TRP HE1 . . 5.290 4.554 3.111 5.345 0.055 14 0 "[ . 1 . 2]" 1
1367 1 71 PRO HB2 1 72 SER H . . 4.110 3.501 2.822 4.043 . 0 0 "[ . 1 . 2]" 1
1368 1 71 PRO HB2 2 42 HIS HD2 . . 5.270 4.007 2.841 5.065 . 0 0 "[ . 1 . 2]" 1
1369 1 71 PRO HB2 2 45 TRP HH2 . . 4.890 3.634 3.037 4.528 . 0 0 "[ . 1 . 2]" 1
1370 1 71 PRO HB3 2 42 HIS HD2 . . 3.890 3.303 2.447 3.940 0.050 10 0 "[ . 1 . 2]" 1
1371 1 71 PRO HB3 2 45 TRP HE3 . . 5.500 5.257 4.723 5.715 0.215 10 0 "[ . 1 . 2]" 1
1372 1 71 PRO HB3 2 45 TRP HH2 . . 5.500 5.084 4.480 5.654 0.154 3 0 "[ . 1 . 2]" 1
1373 1 71 PRO HD2 1 72 SER H . . 3.760 2.752 2.313 3.218 . 0 0 "[ . 1 . 2]" 1
1374 1 71 PRO HD2 2 45 TRP HE1 . . 3.510 2.943 2.659 3.532 0.022 7 0 "[ . 1 . 2]" 1
1375 1 71 PRO HD2 2 45 TRP HZ2 . . 4.180 3.614 3.147 4.258 0.078 3 0 "[ . 1 . 2]" 1
1376 1 71 PRO HD3 1 72 SER H . . 4.240 3.880 3.469 4.255 0.015 9 0 "[ . 1 . 2]" 1
1377 1 71 PRO HD3 2 45 TRP HE1 . . 5.000 4.381 3.947 5.205 0.205 10 0 "[ . 1 . 2]" 1
1378 1 71 PRO QG 2 45 TRP HE1 . . 4.210 4.212 3.699 4.401 0.191 8 0 "[ . 1 . 2]" 1
1379 1 71 PRO HG2 1 72 SER H . . 4.980 4.002 2.706 4.718 . 0 0 "[ . 1 . 2]" 1
1380 1 71 PRO HG2 2 42 HIS HD2 . . 5.170 2.964 2.201 4.399 . 0 0 "[ . 1 . 2]" 1
1381 1 71 PRO HG3 1 72 SER H . . 4.980 4.595 4.197 4.835 . 0 0 "[ . 1 . 2]" 1
1382 1 71 PRO HG3 2 42 HIS HD2 . . 5.170 2.641 2.075 3.065 . 0 0 "[ . 1 . 2]" 1
1383 1 72 SER H 1 72 SER HB2 . . 3.530 2.748 2.498 3.632 0.102 9 0 "[ . 1 . 2]" 1
1384 1 72 SER H 1 72 SER QB . . 3.090 2.323 2.233 2.623 . 0 0 "[ . 1 . 2]" 1
1385 1 72 SER H 1 72 SER HB3 . . 3.530 2.541 2.438 2.701 . 0 0 "[ . 1 . 2]" 1
1386 1 72 SER H 1 73 GLU H . . 3.060 2.624 2.345 2.935 . 0 0 "[ . 1 . 2]" 1
1387 1 72 SER H 1 73 GLU QB . . 5.340 4.841 4.391 5.210 . 0 0 "[ . 1 . 2]" 1
1388 1 72 SER H 2 45 TRP HE1 . . 5.280 4.067 3.214 4.799 . 0 0 "[ . 1 . 2]" 1
1389 1 72 SER H 2 45 TRP HH2 . . 5.370 5.003 4.453 5.417 0.047 7 0 "[ . 1 . 2]" 1
1390 1 72 SER H 2 45 TRP HZ2 . . 4.290 3.577 2.802 4.244 . 0 0 "[ . 1 . 2]" 1
1391 1 72 SER HA 2 45 TRP HZ2 . . 5.500 3.871 2.399 5.459 . 0 0 "[ . 1 . 2]" 1
1392 1 72 SER QB 1 73 GLU H . . 3.910 2.690 2.003 3.552 . 0 0 "[ . 1 . 2]" 1
1393 1 72 SER QB 2 45 TRP HE1 . . 5.340 3.630 2.571 4.817 . 0 0 "[ . 1 . 2]" 1
1394 1 72 SER QB 2 45 TRP HZ2 . . 3.820 2.672 1.781 3.510 . 0 0 "[ . 1 . 2]" 1
1395 1 72 SER HB2 1 73 GLU H . . 4.760 3.852 3.261 4.316 . 0 0 "[ . 1 . 2]" 1
1396 1 72 SER HB3 1 73 GLU H . . 4.760 2.819 2.015 4.005 . 0 0 "[ . 1 . 2]" 1
1397 1 73 GLU H 1 73 GLU HB2 . . 3.820 2.698 2.422 3.906 0.086 14 0 "[ . 1 . 2]" 1
1398 1 73 GLU H 1 73 GLU QB . . 3.030 2.569 2.389 3.099 0.069 14 0 "[ . 1 . 2]" 1
1399 1 73 GLU H 1 73 GLU HB3 . . 3.820 3.622 2.930 3.819 . 0 0 "[ . 1 . 2]" 1
1400 1 73 GLU H 1 73 GLU QG . . 3.420 2.465 2.224 2.974 . 0 0 "[ . 1 . 2]" 1
1401 1 73 GLU HA 1 73 GLU QG . . 3.710 3.007 2.419 3.403 . 0 0 "[ . 1 . 2]" 1
1402 1 73 GLU HA 1 74 GLY H . . 3.500 3.282 2.199 3.585 0.085 4 0 "[ . 1 . 2]" 1
1403 1 73 GLU HB2 1 74 GLY H . . 4.570 2.938 2.146 4.490 . 0 0 "[ . 1 . 2]" 1
1404 1 73 GLU HB3 1 74 GLY H . . 4.570 3.664 2.212 4.575 0.005 13 0 "[ . 1 . 2]" 1
1405 2 2 PRO HA 2 3 ASP H . . 2.960 2.415 2.146 3.086 0.126 19 0 "[ . 1 . 2]" 1
1406 2 2 PRO QD 2 3 ASP H . . 4.930 4.597 3.082 5.011 0.081 12 0 "[ . 1 . 2]" 1
1407 2 3 ASP H 2 3 ASP QB . . 3.230 2.486 2.229 3.282 0.052 1 0 "[ . 1 . 2]" 1
1408 2 3 ASP H 2 4 LYS H . . 4.360 4.136 2.441 4.559 0.199 14 0 "[ . 1 . 2]" 1
1409 2 3 ASP HA 2 4 LYS H . . 2.940 2.306 2.097 3.213 0.273 3 0 "[ . 1 . 2]" 1
1410 2 3 ASP HA 2 4 LYS HB2 . . 5.500 4.878 4.347 5.738 0.238 11 0 "[ . 1 . 2]" 1
1411 2 3 ASP HA 2 4 LYS HB3 . . 5.500 4.962 4.338 5.645 0.145 4 0 "[ . 1 . 2]" 1
1412 2 3 ASP QB 2 4 LYS H . . 4.400 3.616 2.156 4.088 . 0 0 "[ . 1 . 2]" 1
1413 2 4 LYS H 2 4 LYS QB . . 2.980 2.704 2.247 3.179 0.199 19 0 "[ . 1 . 2]" 1
1414 2 4 LYS H 2 4 LYS HG2 . . 5.450 4.010 2.118 5.257 . 0 0 "[ . 1 . 2]" 1
1415 2 4 LYS H 2 4 LYS QG . . 4.720 3.506 2.069 4.388 . 0 0 "[ . 1 . 2]" 1
1416 2 4 LYS H 2 4 LYS HG3 . . 5.450 4.099 2.234 4.969 . 0 0 "[ . 1 . 2]" 1
1417 2 4 LYS H 2 5 GLN H . . 4.420 4.047 3.180 4.518 0.098 4 0 "[ . 1 . 2]" 1
1418 2 4 LYS HA 2 4 LYS QD . . 4.210 3.420 2.009 4.341 0.131 5 0 "[ . 1 . 2]" 1
1419 2 4 LYS HA 2 5 GLN H . . 2.710 2.222 2.134 2.441 . 0 0 "[ . 1 . 2]" 1
1420 2 4 LYS HA 2 5 GLN HG3 . . 4.670 3.987 3.599 4.509 . 0 0 "[ . 1 . 2]" 1
1421 2 4 LYS QB 2 5 GLN H . . 4.090 3.589 2.486 4.065 . 0 0 "[ . 1 . 2]" 1
1422 2 4 LYS HB2 2 5 GLN H . . 4.680 4.141 2.523 4.633 . 0 0 "[ . 1 . 2]" 1
1423 2 4 LYS HB3 2 5 GLN H . . 4.680 4.112 2.902 4.593 . 0 0 "[ . 1 . 2]" 1
1424 2 4 LYS QG 2 5 GLN H . . 4.810 3.886 3.228 4.573 . 0 0 "[ . 1 . 2]" 1
1425 2 4 LYS HG2 2 5 GLN H . . 5.500 4.755 3.597 5.540 0.040 12 0 "[ . 1 . 2]" 1
1426 2 4 LYS HG3 2 5 GLN H . . 5.500 4.246 3.488 5.571 0.071 4 0 "[ . 1 . 2]" 1
1427 2 5 GLN H 2 5 GLN HB2 . . 3.620 3.641 3.567 3.752 0.132 19 0 "[ . 1 . 2]" 1
1428 2 5 GLN H 2 5 GLN HB3 . . 3.790 3.009 2.773 3.309 . 0 0 "[ . 1 . 2]" 1
1429 2 5 GLN H 2 5 GLN HE22 . . 5.500 4.679 4.155 5.358 . 0 0 "[ . 1 . 2]" 1
1430 2 5 GLN H 2 5 GLN HG2 . . 4.470 3.605 3.421 3.787 . 0 0 "[ . 1 . 2]" 1
1431 2 5 GLN H 2 5 GLN HG3 . . 5.060 2.126 1.831 2.479 . 0 0 "[ . 1 . 2]" 1
1432 2 5 GLN H 2 6 LEU QD . . 5.440 5.314 4.817 5.621 0.181 2 0 "[ . 1 . 2]" 1
1433 2 5 GLN HA 2 5 GLN HE21 . . 5.170 4.487 3.913 5.000 . 0 0 "[ . 1 . 2]" 1
1434 2 5 GLN HB2 2 5 GLN HE21 . . 3.720 2.493 1.895 3.805 0.085 2 0 "[ . 1 . 2]" 1
1435 2 5 GLN HB2 2 5 GLN HE22 . . 4.140 3.862 3.503 4.205 0.065 2 0 "[ . 1 . 2]" 1
1436 2 5 GLN HB2 2 6 LEU H . . 4.120 3.913 2.464 4.130 0.010 17 0 "[ . 1 . 2]" 1
1437 2 5 GLN HB3 2 5 GLN HE21 . . 4.770 3.847 3.469 4.247 . 0 0 "[ . 1 . 2]" 1
1438 2 5 GLN HB3 2 6 LEU H . . 4.750 4.331 3.789 4.462 . 0 0 "[ . 1 . 2]" 1
1439 2 5 GLN HE21 2 5 GLN HG2 . . 3.450 2.666 2.354 3.431 . 0 0 "[ . 1 . 2]" 1
1440 2 5 GLN HE22 2 5 GLN HG2 . . 3.900 3.667 3.534 4.036 0.136 2 0 "[ . 1 . 2]" 1
1441 2 5 GLN HE22 2 6 LEU QB . . 4.000 3.063 1.995 4.326 0.326 2 0 "[ . 1 . 2]" 1
1442 2 5 GLN HE22 2 6 LEU MD1 . . 5.160 3.557 2.948 5.025 . 0 0 "[ . 1 . 2]" 1
1443 2 5 GLN HE22 2 6 LEU QD . . 4.200 3.396 2.926 4.263 0.063 17 0 "[ . 1 . 2]" 1
1444 2 5 GLN HE22 2 6 LEU MD2 . . 5.160 4.707 3.522 5.238 0.078 5 0 "[ . 1 . 2]" 1
1445 2 5 GLN HE22 2 6 LEU HG . . 5.280 4.804 3.789 5.377 0.097 4 0 "[ . 1 . 2]" 1
1446 2 5 GLN HG2 2 6 LEU H . . 4.660 4.548 4.176 4.770 0.110 2 0 "[ . 1 . 2]" 1
1447 2 5 GLN HG3 2 6 LEU H . . 4.870 3.670 2.763 4.581 . 0 0 "[ . 1 . 2]" 1
1448 2 6 LEU H 2 6 LEU QB . . 3.190 2.276 2.154 2.946 . 0 0 "[ . 1 . 2]" 1
1449 2 6 LEU H 2 6 LEU MD1 . . 4.740 4.218 3.955 4.928 0.188 2 0 "[ . 1 . 2]" 1
1450 2 6 LEU H 2 6 LEU QD . . 3.910 3.793 3.667 4.118 0.208 2 0 "[ . 1 . 2]" 1
1451 2 6 LEU H 2 6 LEU MD2 . . 4.740 4.317 4.137 4.460 . 0 0 "[ . 1 . 2]" 1
1452 2 6 LEU H 2 6 LEU HG . . 4.460 4.508 4.355 4.704 0.244 2 0 "[ . 1 . 2]" 1
1453 2 6 LEU HA 2 6 LEU MD1 . . 4.110 2.699 2.017 3.883 . 0 0 "[ . 1 . 2]" 1
1454 2 6 LEU HA 2 6 LEU QD . . 3.220 2.405 2.010 3.170 . 0 0 "[ . 1 . 2]" 1
1455 2 6 LEU HA 2 6 LEU MD2 . . 4.110 3.643 2.676 3.983 . 0 0 "[ . 1 . 2]" 1
1456 2 6 LEU HA 2 6 LEU HG . . 4.050 2.901 2.388 3.261 . 0 0 "[ . 1 . 2]" 1
1457 2 6 LEU HA 2 7 LEU MD1 . . 5.430 2.876 2.248 4.468 . 0 0 "[ . 1 . 2]" 1
1458 2 6 LEU HA 2 7 LEU QD . . 4.340 2.811 2.245 4.044 . 0 0 "[ . 1 . 2]" 1
1459 2 6 LEU HA 2 7 LEU MD2 . . 5.430 4.995 3.875 5.479 0.049 16 0 "[ . 1 . 2]" 1
1460 2 6 LEU HA 2 7 LEU HG . . 5.500 4.709 3.258 5.543 0.043 19 0 "[ . 1 . 2]" 1
1461 2 6 LEU QD 2 7 LEU H . . 3.900 2.424 1.645 3.077 . 0 0 "[ . 1 . 2]" 1
1462 2 6 LEU QD 2 66 HIS H . . 4.580 3.849 2.368 4.458 . 0 0 "[ . 1 . 2]" 1
1463 2 6 LEU QD 2 66 HIS HA . . 4.490 2.273 1.795 4.358 . 0 0 "[ . 1 . 2]" 1
1464 2 6 LEU QD 2 66 HIS QB . . 5.130 2.973 1.810 3.757 . 0 0 "[ . 1 . 2]" 1
1465 2 6 LEU QD 2 66 HIS HE1 . . 4.700 3.525 2.850 4.912 0.212 5 0 "[ . 1 . 2]" 1
1466 2 6 LEU QD 2 67 LYS H . . 5.440 4.405 2.052 4.901 . 0 0 "[ . 1 . 2]" 1
1467 2 6 LEU MD1 2 66 HIS H . . 5.500 4.467 2.488 5.596 0.096 17 0 "[ . 1 . 2]" 1
1468 2 6 LEU MD1 2 66 HIS HE1 . . 5.500 5.137 3.525 5.661 0.161 19 0 "[ . 1 . 2]" 1
1469 2 6 LEU MD2 2 66 HIS H . . 5.500 4.418 2.735 5.316 . 0 0 "[ . 1 . 2]" 1
1470 2 6 LEU MD2 2 66 HIS HE1 . . 5.500 3.886 2.858 5.596 0.096 5 0 "[ . 1 . 2]" 1
1471 2 6 LEU HG 2 7 LEU H . . 3.200 3.012 2.292 3.446 0.246 8 0 "[ . 1 . 2]" 1
1472 2 7 LEU H 2 7 LEU HB2 . . 4.060 3.984 3.867 4.074 0.014 20 0 "[ . 1 . 2]" 1
1473 2 7 LEU H 2 7 LEU QB . . 3.410 3.241 3.170 3.399 . 0 0 "[ . 1 . 2]" 1
1474 2 7 LEU H 2 7 LEU HB3 . . 4.060 3.436 3.339 3.691 . 0 0 "[ . 1 . 2]" 1
1475 2 7 LEU H 2 7 LEU MD1 . . 4.510 2.205 1.844 3.036 . 0 0 "[ . 1 . 2]" 1
1476 2 7 LEU H 2 7 LEU QD . . 3.920 2.175 1.835 2.968 . 0 0 "[ . 1 . 2]" 1
1477 2 7 LEU H 2 7 LEU MD2 . . 4.510 3.808 2.511 4.247 . 0 0 "[ . 1 . 2]" 1
1478 2 7 LEU H 2 7 LEU HG . . 4.680 3.950 2.452 4.472 . 0 0 "[ . 1 . 2]" 1
1479 2 7 LEU H 2 8 HIS H . . 4.590 4.322 4.214 4.379 . 0 0 "[ . 1 . 2]" 1
1480 2 7 LEU H 2 8 HIS HD2 . . 5.240 4.940 4.025 5.445 0.205 19 0 "[ . 1 . 2]" 1
1481 2 7 LEU HA 2 7 LEU MD1 . . 4.170 3.600 3.548 3.751 . 0 0 "[ . 1 . 2]" 1
1482 2 7 LEU HA 2 7 LEU QD . . 3.360 3.311 3.241 3.475 0.115 8 0 "[ . 1 . 2]" 1
1483 2 7 LEU HA 2 7 LEU MD2 . . 4.170 3.870 3.667 4.139 . 0 0 "[ . 1 . 2]" 1
1484 2 7 LEU HA 2 8 HIS H . . 3.020 2.637 2.405 2.851 . 0 0 "[ . 1 . 2]" 1
1485 2 7 LEU QB 2 7 LEU QD . . 2.850 2.088 1.961 2.138 . 0 0 "[ . 1 . 2]" 1
1486 2 7 LEU QB 2 35 TYR H . . 5.340 5.130 3.933 5.581 0.241 8 0 "[ . 1 . 2]" 1
1487 2 7 LEU QD 2 8 HIS H . . 3.910 2.610 2.121 3.018 . 0 0 "[ . 1 . 2]" 1
1488 2 7 LEU QD 2 34 ALA HA . . 4.650 3.384 2.840 4.041 . 0 0 "[ . 1 . 2]" 1
1489 2 7 LEU QD 2 34 ALA MB . . 2.970 2.536 1.961 2.971 0.001 8 0 "[ . 1 . 2]" 1
1490 2 7 LEU QD 2 35 TYR H . . 3.840 2.289 1.859 2.861 . 0 0 "[ . 1 . 2]" 1
1491 2 7 LEU QD 2 35 TYR HB3 . . 5.220 4.211 3.619 5.235 0.015 12 0 "[ . 1 . 2]" 1
1492 2 7 LEU QD 2 36 PRO QD . . 5.440 4.557 4.304 5.109 . 0 0 "[ . 1 . 2]" 1
1493 2 7 LEU QD 2 38 TYR H . . 4.680 3.799 2.469 4.764 0.084 5 0 "[ . 1 . 2]" 1
1494 2 7 LEU HG 2 8 HIS H . . 4.770 4.288 4.044 4.613 . 0 0 "[ . 1 . 2]" 1
1495 2 7 LEU HG 2 38 TYR H . . 5.410 4.530 3.398 5.491 0.081 17 0 "[ . 1 . 2]" 1
1496 2 8 HIS H 2 8 HIS QB . . 3.650 2.419 2.367 2.532 . 0 0 "[ . 1 . 2]" 1
1497 2 8 HIS HA 2 8 HIS HD2 . . 4.920 2.704 2.449 2.892 . 0 0 "[ . 1 . 2]" 1
1498 2 8 HIS HA 2 9 ILE H . . 3.050 2.219 2.144 2.260 . 0 0 "[ . 1 . 2]" 1
1499 2 8 HIS HA 2 9 ILE MD . . 5.360 5.342 5.220 5.452 0.092 14 0 "[ . 1 . 2]" 1
1500 2 8 HIS HA 2 9 ILE HG12 . . 5.200 4.086 3.960 4.236 . 0 0 "[ . 1 . 2]" 1
1501 2 8 HIS HA 2 62 ILE MG . . 5.070 3.783 3.524 4.192 . 0 0 "[ . 1 . 2]" 1
1502 2 8 HIS HA 2 63 ILE H . . 5.500 4.657 4.225 5.097 . 0 0 "[ . 1 . 2]" 1
1503 2 8 HIS HA 2 65 ALA H . . 3.620 2.311 1.782 3.129 . 0 0 "[ . 1 . 2]" 1
1504 2 8 HIS HA 2 65 ALA MB . . 4.540 3.332 2.842 3.702 . 0 0 "[ . 1 . 2]" 1
1505 2 8 HIS QB 2 9 ILE H . . 3.740 3.605 3.330 3.763 0.023 4 0 "[ . 1 . 2]" 1
1506 2 8 HIS QB 2 41 ALA H . . 5.500 5.749 5.658 5.868 0.368 19 0 "[ . 1 . 2]" 1
1507 2 8 HIS QB 2 41 ALA MB . . 3.340 3.405 3.171 3.501 0.161 4 0 "[ . 1 . 2]" 1
1508 2 8 HIS QB 2 62 ILE MG . . 3.270 1.953 1.790 2.242 . 0 0 "[ . 1 . 2]" 1
1509 2 8 HIS QB 2 63 ILE H . . 4.840 3.597 3.274 3.953 . 0 0 "[ . 1 . 2]" 1
1510 2 8 HIS QB 2 63 ILE HA . . 5.100 4.540 4.097 5.024 . 0 0 "[ . 1 . 2]" 1
1511 2 8 HIS QB 2 64 HIS HA . . 4.990 3.130 2.698 4.067 . 0 0 "[ . 1 . 2]" 1
1512 2 8 HIS HD2 2 9 ILE H . . 5.300 4.834 4.532 4.997 . 0 0 "[ . 1 . 2]" 1
1513 2 8 HIS HD2 2 64 HIS HA . . 3.620 2.949 2.578 3.622 0.002 1 0 "[ . 1 . 2]" 1
1514 2 8 HIS HD2 2 64 HIS QB . . 5.140 3.479 2.673 4.683 . 0 0 "[ . 1 . 2]" 1
1515 2 8 HIS HD2 2 65 ALA H . . 3.370 3.308 2.737 3.507 0.137 5 0 "[ . 1 . 2]" 1
1516 2 8 HIS HD2 2 65 ALA MB . . 4.700 4.694 4.059 4.905 0.205 8 0 "[ . 1 . 2]" 1
1517 2 9 ILE H 2 9 ILE HB . . 3.790 3.685 3.657 3.709 . 0 0 "[ . 1 . 2]" 1
1518 2 9 ILE H 2 9 ILE MD . . 4.250 3.703 3.625 3.774 . 0 0 "[ . 1 . 2]" 1
1519 2 9 ILE H 2 9 ILE HG12 . . 3.770 2.206 2.083 2.310 . 0 0 "[ . 1 . 2]" 1
1520 2 9 ILE H 2 9 ILE HG13 . . 3.930 3.390 3.206 3.502 . 0 0 "[ . 1 . 2]" 1
1521 2 9 ILE H 2 9 ILE MG . . 4.110 2.233 2.102 2.382 . 0 0 "[ . 1 . 2]" 1
1522 2 9 ILE H 2 10 VAL H . . 4.660 4.619 4.559 4.654 . 0 0 "[ . 1 . 2]" 1
1523 2 9 ILE H 2 41 ALA MB . . 4.910 4.852 4.683 5.054 0.144 9 0 "[ . 1 . 2]" 1
1524 2 9 ILE H 2 64 HIS HA . . 4.400 3.870 3.191 4.442 0.042 13 0 "[ . 1 . 2]" 1
1525 2 9 ILE H 2 65 ALA H . . 4.610 3.092 2.497 3.797 . 0 0 "[ . 1 . 2]" 1
1526 2 9 ILE H 2 65 ALA MB . . 4.880 2.560 2.282 3.447 . 0 0 "[ . 1 . 2]" 1
1527 2 9 ILE HA 2 9 ILE MD . . 4.280 4.274 4.251 4.297 0.017 8 0 "[ . 1 . 2]" 1
1528 2 9 ILE HA 2 9 ILE HG12 . . 4.130 3.797 3.768 3.824 . 0 0 "[ . 1 . 2]" 1
1529 2 9 ILE HA 2 10 VAL H . . 2.830 2.460 2.348 2.616 . 0 0 "[ . 1 . 2]" 1
1530 2 9 ILE HA 2 34 ALA MB . . 4.250 3.033 2.556 3.314 . 0 0 "[ . 1 . 2]" 1
1531 2 9 ILE HA 2 35 TYR H . . 3.980 3.740 3.525 3.878 . 0 0 "[ . 1 . 2]" 1
1532 2 9 ILE HB 2 9 ILE MD . . 3.420 2.533 2.474 2.585 . 0 0 "[ . 1 . 2]" 1
1533 2 9 ILE HB 2 10 VAL H . . 3.280 2.330 2.196 2.575 . 0 0 "[ . 1 . 2]" 1
1534 2 9 ILE HB 2 10 VAL MG2 . . 3.650 3.815 3.752 3.898 0.248 1 0 "[ . 1 . 2]" 1
1535 2 9 ILE HB 2 34 ALA HA . . 5.500 3.467 3.262 3.670 . 0 0 "[ . 1 . 2]" 1
1536 2 9 ILE HB 2 35 TYR H . . 5.500 5.283 4.920 5.614 0.114 9 0 "[ . 1 . 2]" 1
1537 2 9 ILE MD 2 9 ILE MG . . 2.630 2.030 2.016 2.053 . 0 0 "[ . 1 . 2]" 1
1538 2 9 ILE MD 2 10 VAL H . . 4.830 4.186 3.964 4.406 . 0 0 "[ . 1 . 2]" 1
1539 2 9 ILE MD 2 34 ALA MB . . 4.180 3.830 3.433 4.142 . 0 0 "[ . 1 . 2]" 1
1540 2 9 ILE MD 2 65 ALA H . . 5.500 4.916 4.387 5.396 . 0 0 "[ . 1 . 2]" 1
1541 2 9 ILE MD 2 65 ALA MB . . 3.010 2.460 2.078 3.155 0.145 5 0 "[ . 1 . 2]" 1
1542 2 9 ILE HG12 2 9 ILE MG . . 2.910 2.514 2.460 2.560 . 0 0 "[ . 1 . 2]" 1
1543 2 9 ILE HG12 2 10 VAL H . . 5.190 4.502 4.232 4.666 . 0 0 "[ . 1 . 2]" 1
1544 2 9 ILE HG12 2 65 ALA MB . . 4.080 2.320 1.942 3.534 . 0 0 "[ . 1 . 2]" 1
1545 2 9 ILE HG13 2 10 VAL HA . . 4.990 4.125 3.706 4.368 . 0 0 "[ . 1 . 2]" 1
1546 2 9 ILE HG13 2 34 ALA HA . . 5.500 5.633 5.523 5.724 0.224 16 0 "[ . 1 . 2]" 1
1547 2 9 ILE HG13 2 63 ILE H . . 4.720 3.678 3.284 4.348 . 0 0 "[ . 1 . 2]" 1
1548 2 9 ILE MG 2 10 VAL H . . 3.970 3.733 3.637 3.897 . 0 0 "[ . 1 . 2]" 1
1549 2 9 ILE MG 2 33 GLY QA . . 5.340 5.230 4.948 5.423 0.083 6 0 "[ . 1 . 2]" 1
1550 2 9 ILE MG 2 34 ALA MB . . 4.090 1.948 1.728 2.134 . 0 0 "[ . 1 . 2]" 1
1551 2 9 ILE MG 2 64 HIS HA . . 5.500 5.310 4.732 5.701 0.201 2 0 "[ . 1 . 2]" 1
1552 2 9 ILE MG 2 65 ALA H . . 5.000 3.981 3.515 4.342 . 0 0 "[ . 1 . 2]" 1
1553 2 9 ILE MG 2 65 ALA HA . . 5.500 4.398 4.171 4.685 . 0 0 "[ . 1 . 2]" 1
1554 2 9 ILE MG 2 65 ALA MB . . 2.970 1.994 1.841 2.438 . 0 0 "[ . 1 . 2]" 1
1555 2 10 VAL H 2 10 VAL HB . . 3.810 3.695 3.648 3.782 . 0 0 "[ . 1 . 2]" 1
1556 2 10 VAL H 2 10 VAL MG1 . . 3.540 3.249 3.093 3.489 . 0 0 "[ . 1 . 2]" 1
1557 2 10 VAL H 2 10 VAL MG2 . . 3.050 1.997 1.872 2.190 . 0 0 "[ . 1 . 2]" 1
1558 2 10 VAL H 2 11 VAL H . . 4.660 4.357 4.216 4.442 . 0 0 "[ . 1 . 2]" 1
1559 2 10 VAL H 2 34 ALA HA . . 4.050 2.951 2.826 3.157 . 0 0 "[ . 1 . 2]" 1
1560 2 10 VAL H 2 34 ALA MB . . 4.370 3.572 3.397 3.793 . 0 0 "[ . 1 . 2]" 1
1561 2 10 VAL H 2 35 TYR H . . 5.220 4.908 4.514 5.251 0.031 3 0 "[ . 1 . 2]" 1
1562 2 10 VAL HA 2 10 VAL MG1 . . 3.090 2.219 2.197 2.245 . 0 0 "[ . 1 . 2]" 1
1563 2 10 VAL HA 2 10 VAL MG2 . . 3.210 3.222 3.200 3.233 0.023 3 0 "[ . 1 . 2]" 1
1564 2 10 VAL HA 2 11 VAL H . . 2.920 2.085 2.031 2.136 . 0 0 "[ . 1 . 2]" 1
1565 2 10 VAL HA 2 11 VAL MG1 . . 5.500 3.588 3.346 3.894 . 0 0 "[ . 1 . 2]" 1
1566 2 10 VAL HA 2 11 VAL QG . . 4.290 3.352 3.224 3.504 . 0 0 "[ . 1 . 2]" 1
1567 2 10 VAL HA 2 11 VAL MG2 . . 5.500 4.498 3.581 5.485 . 0 0 "[ . 1 . 2]" 1
1568 2 10 VAL HA 2 62 ILE MG . . 4.700 2.905 2.777 3.113 . 0 0 "[ . 1 . 2]" 1
1569 2 10 VAL HA 2 63 ILE H . . 4.050 3.324 2.830 3.682 . 0 0 "[ . 1 . 2]" 1
1570 2 10 VAL HB 2 11 VAL H . . 4.370 3.282 3.102 3.627 . 0 0 "[ . 1 . 2]" 1
1571 2 10 VAL HB 2 11 VAL HA . . 5.500 4.439 4.232 4.722 . 0 0 "[ . 1 . 2]" 1
1572 2 10 VAL HB 2 32 VAL H . . 4.610 4.169 3.968 4.310 . 0 0 "[ . 1 . 2]" 1
1573 2 10 VAL HB 2 32 VAL HB . . 3.610 2.114 1.933 2.298 . 0 0 "[ . 1 . 2]" 1
1574 2 10 VAL HB 2 32 VAL MG1 . . 3.770 2.893 2.651 3.214 . 0 0 "[ . 1 . 2]" 1
1575 2 10 VAL HB 2 32 VAL MG2 . . 4.010 2.816 2.577 3.104 . 0 0 "[ . 1 . 2]" 1
1576 2 10 VAL MG1 2 11 VAL H . . 3.550 3.536 3.428 3.716 0.166 10 0 "[ . 1 . 2]" 1
1577 2 10 VAL MG1 2 32 VAL HB . . 4.630 3.755 3.635 3.867 . 0 0 "[ . 1 . 2]" 1
1578 2 10 VAL MG1 2 34 ALA HA . . 4.150 4.334 4.225 4.423 0.273 7 0 "[ . 1 . 2]" 1
1579 2 10 VAL MG1 2 35 TYR QD . . 3.800 3.554 3.307 3.871 0.071 3 0 "[ . 1 . 2]" 1
1580 2 10 VAL MG1 2 41 ALA HA . . 3.600 2.717 2.450 2.997 . 0 0 "[ . 1 . 2]" 1
1581 2 10 VAL MG1 2 45 TRP HB2 . . 4.340 3.398 3.107 3.632 . 0 0 "[ . 1 . 2]" 1
1582 2 10 VAL MG1 2 62 ILE HA . . 4.320 2.883 2.519 3.212 . 0 0 "[ . 1 . 2]" 1
1583 2 10 VAL MG1 2 62 ILE MD . . 3.890 3.319 2.780 3.770 . 0 0 "[ . 1 . 2]" 1
1584 2 10 VAL MG1 2 62 ILE HG12 . . 3.120 2.258 1.864 2.662 . 0 0 "[ . 1 . 2]" 1
1585 2 10 VAL MG1 2 62 ILE HG13 . . 4.490 3.729 3.469 4.022 . 0 0 "[ . 1 . 2]" 1
1586 2 10 VAL MG1 2 63 ILE H . . 4.500 4.199 3.696 4.554 0.054 10 0 "[ . 1 . 2]" 1
1587 2 10 VAL MG2 2 11 VAL H . . 5.080 4.247 4.170 4.336 . 0 0 "[ . 1 . 2]" 1
1588 2 10 VAL MG2 2 32 VAL MG1 . . 2.870 2.413 2.300 2.550 . 0 0 "[ . 1 . 2]" 1
1589 2 10 VAL MG2 2 34 ALA HA . . 3.600 2.480 2.367 2.635 . 0 0 "[ . 1 . 2]" 1
1590 2 10 VAL MG2 2 34 ALA MB . . 3.610 3.744 3.651 3.869 0.259 11 0 "[ . 1 . 2]" 1
1591 2 11 VAL H 2 11 VAL MG1 . . 4.190 2.750 2.355 3.171 . 0 0 "[ . 1 . 2]" 1
1592 2 11 VAL H 2 11 VAL QG . . 3.130 2.341 2.182 2.476 . 0 0 "[ . 1 . 2]" 1
1593 2 11 VAL H 2 11 VAL MG2 . . 4.190 3.104 2.264 4.049 . 0 0 "[ . 1 . 2]" 1
1594 2 11 VAL H 2 61 PHE QB . . 5.340 4.459 3.863 4.909 . 0 0 "[ . 1 . 2]" 1
1595 2 11 VAL H 2 62 ILE HA . . 4.480 2.846 2.630 2.991 . 0 0 "[ . 1 . 2]" 1
1596 2 11 VAL H 2 62 ILE HG12 . . 5.390 4.849 4.374 5.166 . 0 0 "[ . 1 . 2]" 1
1597 2 11 VAL H 2 62 ILE MG . . 4.190 4.352 4.253 4.472 0.282 5 0 "[ . 1 . 2]" 1
1598 2 11 VAL HA 2 11 VAL QG . . 3.080 2.384 2.355 2.431 . 0 0 "[ . 1 . 2]" 1
1599 2 11 VAL HA 2 12 GLY H . . 2.980 2.282 2.192 2.482 . 0 0 "[ . 1 . 2]" 1
1600 2 11 VAL HA 2 31 PHE H . . 5.460 4.906 4.746 5.066 . 0 0 "[ . 1 . 2]" 1
1601 2 11 VAL HA 2 32 VAL H . . 3.700 2.172 1.908 2.742 . 0 0 "[ . 1 . 2]" 1
1602 2 11 VAL HA 2 32 VAL MG2 . . 4.000 2.848 2.391 3.642 . 0 0 "[ . 1 . 2]" 1
1603 2 11 VAL HB 2 12 GLY H . . 3.960 3.346 2.401 4.037 0.077 17 0 "[ . 1 . 2]" 1
1604 2 11 VAL HB 2 31 PHE HA . . 5.500 3.363 2.956 3.758 . 0 0 "[ . 1 . 2]" 1
1605 2 11 VAL HB 2 31 PHE QD . . 5.500 2.983 2.602 3.925 . 0 0 "[ . 1 . 2]" 1
1606 2 11 VAL HB 2 31 PHE QE . . 5.430 3.996 3.160 4.641 . 0 0 "[ . 1 . 2]" 1
1607 2 11 VAL HB 2 63 ILE MD . . 3.990 4.024 3.788 4.113 0.123 20 0 "[ . 1 . 2]" 1
1608 2 11 VAL QG 2 12 GLY HA2 . . 4.440 3.253 2.897 3.826 . 0 0 "[ . 1 . 2]" 1
1609 2 11 VAL QG 2 31 PHE HA . . 3.350 2.660 1.995 3.436 0.086 10 0 "[ . 1 . 2]" 1
1610 2 11 VAL QG 2 31 PHE QB . . 3.640 3.258 2.872 3.601 . 0 0 "[ . 1 . 2]" 1
1611 2 11 VAL QG 2 31 PHE QD . . 3.300 2.144 1.680 2.695 . 0 0 "[ . 1 . 2]" 1
1612 2 11 VAL QG 2 31 PHE QE . . 3.660 2.923 2.743 3.150 . 0 0 "[ . 1 . 2]" 1
1613 2 11 VAL QG 2 32 VAL H . . 4.660 3.714 3.411 4.191 . 0 0 "[ . 1 . 2]" 1
1614 2 11 VAL QG 2 61 PHE H . . 4.070 3.727 3.078 3.984 . 0 0 "[ . 1 . 2]" 1
1615 2 11 VAL QG 2 61 PHE QB . . 3.820 3.319 2.317 3.932 0.112 17 0 "[ . 1 . 2]" 1
1616 2 11 VAL QG 2 63 ILE H . . 3.930 3.472 3.173 3.865 . 0 0 "[ . 1 . 2]" 1
1617 2 11 VAL QG 2 63 ILE QG . . 4.270 2.320 2.029 3.139 . 0 0 "[ . 1 . 2]" 1
1618 2 11 VAL MG1 2 12 GLY H . . 4.030 3.893 3.719 4.088 0.058 10 0 "[ . 1 . 2]" 1
1619 2 11 VAL MG2 2 12 GLY H . . 4.030 3.030 2.264 3.931 . 0 0 "[ . 1 . 2]" 1
1620 2 12 GLY H 2 13 GLY H . . 4.840 4.210 3.911 4.364 . 0 0 "[ . 1 . 2]" 1
1621 2 12 GLY H 2 29 VAL HA . . 5.500 5.048 4.632 5.395 . 0 0 "[ . 1 . 2]" 1
1622 2 12 GLY H 2 30 GLU H . . 4.460 4.128 3.517 4.537 0.077 19 0 "[ . 1 . 2]" 1
1623 2 12 GLY H 2 30 GLU QB . . 5.090 4.284 3.774 4.785 . 0 0 "[ . 1 . 2]" 1
1624 2 12 GLY H 2 31 PHE HA . . 4.680 2.891 2.250 3.346 . 0 0 "[ . 1 . 2]" 1
1625 2 12 GLY H 2 32 VAL H . . 4.560 3.301 2.824 3.621 . 0 0 "[ . 1 . 2]" 1
1626 2 12 GLY H 2 32 VAL HA . . 5.500 5.540 5.171 5.734 0.234 14 0 "[ . 1 . 2]" 1
1627 2 12 GLY H 2 32 VAL MG2 . . 4.310 3.147 2.643 3.498 . 0 0 "[ . 1 . 2]" 1
1628 2 12 GLY H 2 60 TYR QD . . 4.700 3.527 2.844 3.912 . 0 0 "[ . 1 . 2]" 1
1629 2 12 GLY H 2 60 TYR QE . . 5.440 4.326 3.598 5.003 . 0 0 "[ . 1 . 2]" 1
1630 2 12 GLY HA2 2 13 GLY H . . 3.250 2.885 2.632 3.172 . 0 0 "[ . 1 . 2]" 1
1631 2 12 GLY HA2 2 32 VAL MG2 . . 5.500 4.562 4.077 4.936 . 0 0 "[ . 1 . 2]" 1
1632 2 12 GLY HA2 2 59 ARG H . . 5.500 5.301 4.890 5.536 0.036 19 0 "[ . 1 . 2]" 1
1633 2 12 GLY HA2 2 60 TYR HA . . 4.010 2.665 2.139 2.921 . 0 0 "[ . 1 . 2]" 1
1634 2 12 GLY HA2 2 60 TYR QD . . 4.890 4.016 3.639 4.262 . 0 0 "[ . 1 . 2]" 1
1635 2 12 GLY HA2 2 61 PHE H . . 4.110 2.979 2.428 3.331 . 0 0 "[ . 1 . 2]" 1
1636 2 12 GLY HA3 2 13 GLY H . . 3.370 2.314 2.145 2.545 . 0 0 "[ . 1 . 2]" 1
1637 2 12 GLY HA3 2 32 VAL MG2 . . 5.020 3.503 3.049 3.962 . 0 0 "[ . 1 . 2]" 1
1638 2 12 GLY HA3 2 60 TYR HA . . 3.830 1.943 1.698 2.310 . 0 0 "[ . 1 . 2]" 1
1639 2 12 GLY HA3 2 60 TYR QD . . 3.760 2.417 2.025 2.776 . 0 0 "[ . 1 . 2]" 1
1640 2 12 GLY HA3 2 60 TYR QE . . 4.250 3.730 3.325 4.099 . 0 0 "[ . 1 . 2]" 1
1641 2 12 GLY HA3 2 61 PHE H . . 4.510 3.167 2.851 3.658 . 0 0 "[ . 1 . 2]" 1
1642 2 13 GLY H 2 14 GLU H . . 4.420 4.433 4.331 4.482 0.062 15 0 "[ . 1 . 2]" 1
1643 2 13 GLY H 2 14 GLU HA . . 5.380 4.849 4.661 5.075 . 0 0 "[ . 1 . 2]" 1
1644 2 13 GLY H 2 15 LEU QD . . 5.130 3.973 3.507 4.646 . 0 0 "[ . 1 . 2]" 1
1645 2 13 GLY H 2 58 ALA MB . . 3.910 3.694 3.149 4.081 0.171 9 0 "[ . 1 . 2]" 1
1646 2 13 GLY H 2 59 ARG H . . 3.610 3.469 2.905 3.700 0.090 2 0 "[ . 1 . 2]" 1
1647 2 13 GLY H 2 59 ARG HA . . 5.500 5.009 4.641 5.334 . 0 0 "[ . 1 . 2]" 1
1648 2 13 GLY H 2 59 ARG QB . . 5.080 4.865 4.290 5.174 0.094 17 0 "[ . 1 . 2]" 1
1649 2 13 GLY H 2 60 TYR H . . 5.150 4.664 4.433 5.054 . 0 0 "[ . 1 . 2]" 1
1650 2 13 GLY H 2 60 TYR HA . . 4.420 3.258 2.963 3.538 . 0 0 "[ . 1 . 2]" 1
1651 2 13 GLY H 2 61 PHE H . . 5.320 4.914 4.692 5.246 . 0 0 "[ . 1 . 2]" 1
1652 2 13 GLY HA2 2 14 GLU H . . 2.840 2.693 2.448 2.872 0.032 15 0 "[ . 1 . 2]" 1
1653 2 13 GLY HA2 2 14 GLU QB . . 5.420 4.704 4.570 4.851 . 0 0 "[ . 1 . 2]" 1
1654 2 13 GLY HA2 2 29 VAL QG . . 5.070 4.371 3.665 5.148 0.078 11 0 "[ . 1 . 2]" 1
1655 2 13 GLY HA2 2 58 ALA MB . . 4.590 3.367 2.844 3.860 . 0 0 "[ . 1 . 2]" 1
1656 2 13 GLY HA3 2 14 GLU H . . 3.480 2.488 2.289 2.749 . 0 0 "[ . 1 . 2]" 1
1657 2 13 GLY HA3 2 15 LEU QD . . 4.990 4.394 4.084 5.071 0.081 8 0 "[ . 1 . 2]" 1
1658 2 13 GLY HA3 2 23 PHE QD . . 5.380 4.326 3.112 5.428 0.048 7 0 "[ . 1 . 2]" 1
1659 2 13 GLY HA3 2 29 VAL QG . . 5.290 3.034 2.429 3.941 . 0 0 "[ . 1 . 2]" 1
1660 2 13 GLY HA3 2 30 GLU H . . 4.810 2.290 1.842 2.881 . 0 0 "[ . 1 . 2]" 1
1661 2 13 GLY HA3 2 58 ALA MB . . 4.990 4.635 4.124 5.056 0.066 7 0 "[ . 1 . 2]" 1
1662 2 14 GLU H 2 14 GLU QB . . 2.830 2.380 2.273 2.465 . 0 0 "[ . 1 . 2]" 1
1663 2 14 GLU H 2 14 GLU HG2 . . 4.550 3.821 3.505 4.071 . 0 0 "[ . 1 . 2]" 1
1664 2 14 GLU H 2 14 GLU HG3 . . 3.730 2.871 2.634 3.090 . 0 0 "[ . 1 . 2]" 1
1665 2 14 GLU H 2 15 LEU H . . 4.700 4.445 4.290 4.555 . 0 0 "[ . 1 . 2]" 1
1666 2 14 GLU H 2 15 LEU QD . . 5.190 4.331 3.965 5.021 . 0 0 "[ . 1 . 2]" 1
1667 2 14 GLU H 2 23 PHE HB3 . . 5.500 5.526 5.094 5.716 0.216 19 0 "[ . 1 . 2]" 1
1668 2 14 GLU H 2 58 ALA MB . . 4.630 4.004 3.343 4.703 0.073 16 0 "[ . 1 . 2]" 1
1669 2 14 GLU HA 2 14 GLU HG2 . . 4.060 2.371 2.246 2.663 . 0 0 "[ . 1 . 2]" 1
1670 2 14 GLU HA 2 14 GLU HG3 . . 4.180 3.015 2.714 3.239 . 0 0 "[ . 1 . 2]" 1
1671 2 14 GLU HA 2 15 LEU H . . 2.760 2.055 1.992 2.117 . 0 0 "[ . 1 . 2]" 1
1672 2 14 GLU HA 2 58 ALA MB . . 4.080 3.159 2.590 3.849 . 0 0 "[ . 1 . 2]" 1
1673 2 14 GLU QB 2 15 LEU H . . 3.750 3.092 2.687 3.531 . 0 0 "[ . 1 . 2]" 1
1674 2 14 GLU QB 2 24 ARG H . . 4.820 4.046 3.599 4.560 . 0 0 "[ . 1 . 2]" 1
1675 2 14 GLU QB 2 24 ARG HB2 . . 4.690 3.495 2.800 4.351 . 0 0 "[ . 1 . 2]" 1
1676 2 14 GLU QB 2 24 ARG QD . . 3.780 3.001 2.310 3.899 0.119 19 0 "[ . 1 . 2]" 1
1677 2 14 GLU QB 2 25 ASP H . . 5.310 4.162 3.396 4.886 . 0 0 "[ . 1 . 2]" 1
1678 2 14 GLU QB 2 56 ALA MB . . 5.500 4.562 3.313 5.306 . 0 0 "[ . 1 . 2]" 1
1679 2 14 GLU HG2 2 15 LEU H . . 4.540 3.928 3.629 4.486 . 0 0 "[ . 1 . 2]" 1
1680 2 14 GLU HG2 2 55 ASN HD22 . . 5.440 3.998 1.923 5.477 0.037 6 0 "[ . 1 . 2]" 1
1681 2 14 GLU HG2 2 56 ALA MB . . 4.330 4.123 2.707 4.495 0.165 15 0 "[ . 1 . 2]" 1
1682 2 14 GLU HG2 2 57 HIS QB . . 5.100 3.511 2.477 4.335 . 0 0 "[ . 1 . 2]" 1
1683 2 14 GLU HG2 2 58 ALA H . . 5.210 3.104 2.272 4.251 . 0 0 "[ . 1 . 2]" 1
1684 2 14 GLU HG2 2 58 ALA HA . . 4.920 3.124 2.486 4.148 . 0 0 "[ . 1 . 2]" 1
1685 2 14 GLU HG2 2 58 ALA MB . . 4.880 2.445 1.874 3.152 . 0 0 "[ . 1 . 2]" 1
1686 2 14 GLU HG3 2 15 LEU H . . 4.780 4.878 4.777 4.986 0.206 11 0 "[ . 1 . 2]" 1
1687 2 14 GLU HG3 2 55 ASN HD22 . . 5.500 3.458 1.973 5.180 . 0 0 "[ . 1 . 2]" 1
1688 2 14 GLU HG3 2 57 HIS QB . . 5.280 4.861 3.828 5.487 0.207 9 0 "[ . 1 . 2]" 1
1689 2 14 GLU HG3 2 58 ALA HA . . 5.450 3.802 3.264 4.270 . 0 0 "[ . 1 . 2]" 1
1690 2 14 GLU HG3 2 58 ALA MB . . 4.350 2.742 2.074 3.763 . 0 0 "[ . 1 . 2]" 1
1691 2 15 LEU H 2 15 LEU QB . . 2.930 2.378 2.251 2.621 . 0 0 "[ . 1 . 2]" 1
1692 2 15 LEU H 2 15 LEU MD1 . . 4.050 3.726 2.769 4.154 0.104 20 0 "[ . 1 . 2]" 1
1693 2 15 LEU H 2 15 LEU QD . . 3.550 2.598 2.080 3.511 . 0 0 "[ . 1 . 2]" 1
1694 2 15 LEU H 2 15 LEU MD2 . . 4.050 2.748 2.095 4.071 0.021 7 0 "[ . 1 . 2]" 1
1695 2 15 LEU H 2 15 LEU HG . . 4.310 3.729 2.276 4.337 0.027 7 0 "[ . 1 . 2]" 1
1696 2 15 LEU H 2 16 LYS H . . 4.860 4.528 4.423 4.617 . 0 0 "[ . 1 . 2]" 1
1697 2 15 LEU H 2 23 PHE QD . . 5.500 4.988 4.454 5.553 0.053 19 0 "[ . 1 . 2]" 1
1698 2 15 LEU H 2 24 ARG H . . 5.350 4.234 3.897 4.468 . 0 0 "[ . 1 . 2]" 1
1699 2 15 LEU H 2 57 HIS HB2 . . 5.110 2.960 2.490 4.623 . 0 0 "[ . 1 . 2]" 1
1700 2 15 LEU H 2 57 HIS QB . . 4.230 2.429 1.964 3.103 . 0 0 "[ . 1 . 2]" 1
1701 2 15 LEU H 2 57 HIS HB3 . . 5.110 2.659 2.009 3.328 . 0 0 "[ . 1 . 2]" 1
1702 2 15 LEU H 2 58 ALA H . . 5.410 4.523 4.234 4.933 . 0 0 "[ . 1 . 2]" 1
1703 2 15 LEU H 2 58 ALA HA . . 4.050 3.307 2.551 4.005 . 0 0 "[ . 1 . 2]" 1
1704 2 15 LEU H 2 59 ARG H . . 4.770 3.769 3.235 4.454 . 0 0 "[ . 1 . 2]" 1
1705 2 15 LEU HA 2 15 LEU MD1 . . 4.220 2.689 2.088 3.957 . 0 0 "[ . 1 . 2]" 1
1706 2 15 LEU HA 2 15 LEU QD . . 2.890 2.123 2.027 2.424 . 0 0 "[ . 1 . 2]" 1
1707 2 15 LEU HA 2 15 LEU MD2 . . 4.220 2.824 2.034 3.880 . 0 0 "[ . 1 . 2]" 1
1708 2 15 LEU HA 2 16 LYS H . . 2.820 2.436 2.282 2.552 . 0 0 "[ . 1 . 2]" 1
1709 2 15 LEU HA 2 16 LYS QB . . 5.340 4.674 4.527 4.776 . 0 0 "[ . 1 . 2]" 1
1710 2 15 LEU HA 2 16 LYS QG . . 4.990 3.906 3.640 4.259 . 0 0 "[ . 1 . 2]" 1
1711 2 15 LEU HA 2 23 PHE HB3 . . 5.420 4.533 3.952 5.033 . 0 0 "[ . 1 . 2]" 1
1712 2 15 LEU QB 2 15 LEU QD . . 2.700 2.072 1.994 2.126 . 0 0 "[ . 1 . 2]" 1
1713 2 15 LEU QB 2 16 LYS H . . 3.190 2.471 2.205 2.840 . 0 0 "[ . 1 . 2]" 1
1714 2 15 LEU QB 2 17 ASP H . . 4.320 2.463 1.972 2.983 . 0 0 "[ . 1 . 2]" 1
1715 2 15 LEU QB 2 18 VAL H . . 5.490 5.025 4.600 5.277 . 0 0 "[ . 1 . 2]" 1
1716 2 15 LEU QB 2 18 VAL HA . . 5.500 4.061 3.476 4.522 . 0 0 "[ . 1 . 2]" 1
1717 2 15 LEU QB 2 21 VAL HA . . 5.500 3.659 3.049 4.286 . 0 0 "[ . 1 . 2]" 1
1718 2 15 LEU QB 2 22 GLU H . . 3.520 3.290 2.743 3.647 0.127 9 0 "[ . 1 . 2]" 1
1719 2 15 LEU QB 2 23 PHE HA . . 5.430 4.042 3.580 4.469 . 0 0 "[ . 1 . 2]" 1
1720 2 15 LEU QB 2 57 HIS HA . . 5.500 4.355 4.045 4.726 . 0 0 "[ . 1 . 2]" 1
1721 2 15 LEU QB 2 58 ALA H . . 5.500 5.657 5.518 5.841 0.341 16 0 "[ . 1 . 2]" 1
1722 2 15 LEU QB 2 58 ALA HA . . 5.500 4.818 4.211 5.300 . 0 0 "[ . 1 . 2]" 1
1723 2 15 LEU QD 2 16 LYS H . . 3.620 3.401 3.213 3.713 0.093 7 0 "[ . 1 . 2]" 1
1724 2 15 LEU QD 2 21 VAL H . . 5.400 4.176 3.825 4.435 . 0 0 "[ . 1 . 2]" 1
1725 2 15 LEU QD 2 21 VAL HA . . 3.180 2.077 1.593 2.388 . 0 0 "[ . 1 . 2]" 1
1726 2 15 LEU QD 2 21 VAL HB . . 4.390 4.145 3.539 4.447 0.057 11 0 "[ . 1 . 2]" 1
1727 2 15 LEU QD 2 21 VAL QG . . 2.720 2.556 1.893 2.930 0.210 17 0 "[ . 1 . 2]" 1
1728 2 15 LEU QD 2 22 GLU H . . 3.780 2.538 1.782 3.623 . 0 0 "[ . 1 . 2]" 1
1729 2 15 LEU QD 2 22 GLU HA . . 4.800 3.584 3.196 4.493 . 0 0 "[ . 1 . 2]" 1
1730 2 15 LEU QD 2 23 PHE H . . 4.170 3.191 2.952 4.072 . 0 0 "[ . 1 . 2]" 1
1731 2 15 LEU QD 2 23 PHE HA . . 3.330 2.088 1.898 2.489 . 0 0 "[ . 1 . 2]" 1
1732 2 15 LEU QD 2 23 PHE HB2 . . 4.460 4.229 4.001 4.718 0.258 7 0 "[ . 1 . 2]" 1
1733 2 15 LEU QD 2 23 PHE HB3 . . 4.190 3.863 3.597 4.074 . 0 0 "[ . 1 . 2]" 1
1734 2 15 LEU QD 2 23 PHE QD . . 3.140 2.105 1.755 2.498 . 0 0 "[ . 1 . 2]" 1
1735 2 15 LEU QD 2 24 ARG H . . 4.030 3.357 3.038 3.675 . 0 0 "[ . 1 . 2]" 1
1736 2 15 LEU QD 2 24 ARG HB3 . . 5.440 5.027 4.736 5.429 . 0 0 "[ . 1 . 2]" 1
1737 2 15 LEU QD 2 25 ASP H . . 5.440 5.143 4.792 5.421 . 0 0 "[ . 1 . 2]" 1
1738 2 15 LEU QD 2 58 ALA HA . . 4.140 3.477 2.592 4.329 0.189 5 0 "[ . 1 . 2]" 1
1739 2 15 LEU QD 2 59 ARG H . . 4.570 2.462 1.929 3.333 . 0 0 "[ . 1 . 2]" 1
1740 2 15 LEU QD 2 59 ARG QB . . 3.760 1.896 1.779 1.958 . 0 0 "[ . 1 . 2]" 1
1741 2 15 LEU QD 2 59 ARG QD . . 3.900 3.474 2.521 4.137 0.237 8 0 "[ . 1 . 2]" 1
1742 2 15 LEU QD 2 60 TYR H . . 5.440 4.938 4.635 5.278 . 0 0 "[ . 1 . 2]" 1
1743 2 15 LEU MD1 2 16 LYS H . . 4.800 3.792 3.276 4.796 . 0 0 "[ . 1 . 2]" 1
1744 2 15 LEU MD1 2 21 VAL HA . . 4.120 2.226 1.598 4.160 0.040 7 0 "[ . 1 . 2]" 1
1745 2 15 LEU MD1 2 22 GLU H . . 5.250 2.868 1.782 4.522 . 0 0 "[ . 1 . 2]" 1
1746 2 15 LEU MD1 2 23 PHE H . . 5.500 3.858 2.965 5.561 0.061 4 0 "[ . 1 . 2]" 1
1747 2 15 LEU MD1 2 23 PHE QD . . 3.720 2.848 1.886 4.294 0.574 5 1 "[ + 1 . 2]" 1
1748 2 15 LEU MD1 2 59 ARG QB . . 4.520 3.199 1.781 4.114 . 0 0 "[ . 1 . 2]" 1
1749 2 15 LEU MD2 2 16 LYS H . . 4.800 4.390 3.408 4.900 0.100 3 0 "[ . 1 . 2]" 1
1750 2 15 LEU MD2 2 21 VAL HA . . 4.120 3.419 1.868 4.228 0.108 11 0 "[ . 1 . 2]" 1
1751 2 15 LEU MD2 2 22 GLU H . . 5.250 4.306 2.410 5.443 0.193 15 0 "[ . 1 . 2]" 1
1752 2 15 LEU MD2 2 23 PHE H . . 5.500 4.786 3.074 5.607 0.107 2 0 "[ . 1 . 2]" 1
1753 2 15 LEU MD2 2 23 PHE QD . . 3.720 2.816 1.757 3.798 0.078 7 0 "[ . 1 . 2]" 1
1754 2 15 LEU MD2 2 59 ARG QB . . 4.520 2.441 1.802 4.133 . 0 0 "[ . 1 . 2]" 1
1755 2 16 LYS H 2 16 LYS HB2 . . 3.710 2.534 2.308 3.734 0.024 3 0 "[ . 1 . 2]" 1
1756 2 16 LYS H 2 16 LYS QB . . 3.190 2.464 2.281 3.063 . 0 0 "[ . 1 . 2]" 1
1757 2 16 LYS H 2 16 LYS HB3 . . 3.710 3.610 3.254 3.662 . 0 0 "[ . 1 . 2]" 1
1758 2 16 LYS H 2 16 LYS QD . . 4.930 3.987 2.886 4.500 . 0 0 "[ . 1 . 2]" 1
1759 2 16 LYS H 2 16 LYS QE . . 5.330 4.259 3.379 4.705 . 0 0 "[ . 1 . 2]" 1
1760 2 16 LYS H 2 16 LYS QG . . 3.260 2.378 2.025 2.777 . 0 0 "[ . 1 . 2]" 1
1761 2 16 LYS H 2 17 ASP H . . 3.710 2.476 2.152 2.626 . 0 0 "[ . 1 . 2]" 1
1762 2 16 LYS H 2 17 ASP QB . . 5.250 4.471 3.812 4.758 . 0 0 "[ . 1 . 2]" 1
1763 2 16 LYS H 2 22 GLU H . . 5.430 3.794 3.038 4.648 . 0 0 "[ . 1 . 2]" 1
1764 2 16 LYS H 2 23 PHE QD . . 5.500 5.598 5.436 5.740 0.240 1 0 "[ . 1 . 2]" 1
1765 2 16 LYS H 2 24 ARG HA . . 4.430 3.815 3.425 4.206 . 0 0 "[ . 1 . 2]" 1
1766 2 16 LYS H 2 24 ARG HB2 . . 4.200 3.487 3.012 3.864 . 0 0 "[ . 1 . 2]" 1
1767 2 16 LYS H 2 24 ARG QD . . 5.340 5.229 4.787 5.574 0.234 15 0 "[ . 1 . 2]" 1
1768 2 16 LYS HA 2 16 LYS QG . . 3.600 2.518 2.393 3.478 . 0 0 "[ . 1 . 2]" 1
1769 2 16 LYS HA 2 24 ARG H . . 5.130 4.579 4.320 5.009 . 0 0 "[ . 1 . 2]" 1
1770 2 16 LYS HA 2 24 ARG HB2 . . 4.690 2.828 2.368 3.238 . 0 0 "[ . 1 . 2]" 1
1771 2 16 LYS HA 2 24 ARG HB3 . . 4.750 4.536 4.046 4.896 0.146 3 0 "[ . 1 . 2]" 1
1772 2 16 LYS HA 2 24 ARG QD . . 4.890 3.442 2.739 3.941 . 0 0 "[ . 1 . 2]" 1
1773 2 16 LYS HA 2 24 ARG QG . . 4.290 3.331 2.637 4.187 . 0 0 "[ . 1 . 2]" 1
1774 2 16 LYS QB 2 16 LYS QE . . 4.190 3.278 1.942 3.889 . 0 0 "[ . 1 . 2]" 1
1775 2 16 LYS QB 2 17 ASP H . . 4.390 2.795 2.247 3.989 . 0 0 "[ . 1 . 2]" 1
1776 2 16 LYS QB 2 17 ASP HA . . 5.340 4.317 4.059 4.625 . 0 0 "[ . 1 . 2]" 1
1777 2 16 LYS QB 2 17 ASP QB . . 4.340 3.441 3.099 4.481 0.141 3 0 "[ . 1 . 2]" 1
1778 2 16 LYS QB 2 24 ARG HA . . 4.310 4.026 2.907 4.379 0.069 4 0 "[ . 1 . 2]" 1
1779 2 16 LYS HB2 2 16 LYS QE . . 4.910 3.598 1.978 4.221 . 0 0 "[ . 1 . 2]" 1
1780 2 16 LYS HB2 2 24 ARG HA . . 4.960 4.560 4.111 4.966 0.006 4 0 "[ . 1 . 2]" 1
1781 2 16 LYS HB3 2 16 LYS QE . . 4.910 3.885 2.821 4.554 . 0 0 "[ . 1 . 2]" 1
1782 2 16 LYS HB3 2 24 ARG HA . . 4.960 4.520 2.964 4.868 . 0 0 "[ . 1 . 2]" 1
1783 2 16 LYS QD 2 22 GLU QG . . 5.110 3.690 2.045 5.286 0.176 16 0 "[ . 1 . 2]" 1
1784 2 16 LYS QE 2 16 LYS QG . . 2.940 2.288 2.160 2.396 . 0 0 "[ . 1 . 2]" 1
1785 2 16 LYS QE 2 22 GLU HG2 . . 5.500 4.514 2.206 5.595 0.095 7 0 "[ . 1 . 2]" 1
1786 2 16 LYS QE 2 22 GLU HG3 . . 5.500 4.361 2.357 5.385 . 0 0 "[ . 1 . 2]" 1
1787 2 16 LYS QE 2 24 ARG H . . 4.890 4.853 4.508 5.023 0.133 5 0 "[ . 1 . 2]" 1
1788 2 16 LYS QE 2 24 ARG HA . . 3.630 3.253 2.316 3.854 0.224 16 0 "[ . 1 . 2]" 1
1789 2 16 LYS QG 2 24 ARG H . . 4.530 3.483 3.288 3.696 . 0 0 "[ . 1 . 2]" 1
1790 2 16 LYS QG 2 24 ARG HA . . 3.640 2.024 1.648 2.367 . 0 0 "[ . 1 . 2]" 1
1791 2 16 LYS QG 2 24 ARG HB3 . . 4.810 4.250 3.850 4.647 . 0 0 "[ . 1 . 2]" 1
1792 2 16 LYS QG 2 24 ARG QD . . 4.710 4.258 3.517 4.824 0.114 15 0 "[ . 1 . 2]" 1
1793 2 16 LYS QG 2 24 ARG QG . . 3.420 2.910 2.352 3.398 . 0 0 "[ . 1 . 2]" 1
1794 2 16 LYS HG2 2 17 ASP H . . 5.500 5.081 4.786 5.352 . 0 0 "[ . 1 . 2]" 1
1795 2 16 LYS HG2 2 24 ARG HA . . 4.170 2.364 2.052 2.604 . 0 0 "[ . 1 . 2]" 1
1796 2 16 LYS HG2 2 24 ARG HB3 . . 5.500 4.806 4.065 5.191 . 0 0 "[ . 1 . 2]" 1
1797 2 16 LYS HG3 2 17 ASP H . . 5.500 4.380 3.955 4.866 . 0 0 "[ . 1 . 2]" 1
1798 2 16 LYS HG3 2 24 ARG HA . . 4.170 2.291 1.670 2.781 . 0 0 "[ . 1 . 2]" 1
1799 2 16 LYS HG3 2 24 ARG HB3 . . 5.500 4.774 4.226 5.242 . 0 0 "[ . 1 . 2]" 1
1800 2 17 ASP H 2 17 ASP HB2 . . 4.200 3.096 2.500 3.483 . 0 0 "[ . 1 . 2]" 1
1801 2 17 ASP H 2 17 ASP QB . . 3.680 2.589 2.323 2.799 . 0 0 "[ . 1 . 2]" 1
1802 2 17 ASP H 2 17 ASP HB3 . . 4.200 2.824 2.560 3.690 . 0 0 "[ . 1 . 2]" 1
1803 2 17 ASP H 2 18 VAL H . . 5.500 4.432 4.345 4.602 . 0 0 "[ . 1 . 2]" 1
1804 2 17 ASP HA 2 18 VAL H . . 2.990 2.439 2.254 2.764 . 0 0 "[ . 1 . 2]" 1
1805 2 17 ASP HA 2 18 VAL MG2 . . 4.360 4.000 3.757 4.214 . 0 0 "[ . 1 . 2]" 1
1806 2 17 ASP QB 2 18 VAL H . . 4.000 3.295 1.884 3.546 . 0 0 "[ . 1 . 2]" 1
1807 2 17 ASP QB 2 19 ALA H . . 4.640 3.582 2.877 4.058 . 0 0 "[ . 1 . 2]" 1
1808 2 17 ASP QB 2 20 GLY H . . 4.800 2.317 2.048 2.964 . 0 0 "[ . 1 . 2]" 1
1809 2 17 ASP QB 2 20 GLY QA . . 5.180 2.169 1.755 3.434 . 0 0 "[ . 1 . 2]" 1
1810 2 17 ASP HB2 2 18 VAL H . . 4.560 3.910 3.101 4.211 . 0 0 "[ . 1 . 2]" 1
1811 2 17 ASP HB3 2 18 VAL H . . 4.560 3.571 1.901 3.858 . 0 0 "[ . 1 . 2]" 1
1812 2 18 VAL H 2 18 VAL HB . . 3.950 3.641 3.588 3.760 . 0 0 "[ . 1 . 2]" 1
1813 2 18 VAL H 2 18 VAL MG1 . . 3.630 2.441 2.222 3.044 . 0 0 "[ . 1 . 2]" 1
1814 2 18 VAL H 2 18 VAL MG2 . . 3.180 1.985 1.901 2.101 . 0 0 "[ . 1 . 2]" 1
1815 2 18 VAL H 2 19 ALA H . . 3.670 2.651 2.036 2.887 . 0 0 "[ . 1 . 2]" 1
1816 2 18 VAL HA 2 18 VAL MG1 . . 3.040 2.327 2.300 2.365 . 0 0 "[ . 1 . 2]" 1
1817 2 18 VAL HA 2 18 VAL MG2 . . 3.470 3.268 3.256 3.280 . 0 0 "[ . 1 . 2]" 1
1818 2 18 VAL HB 2 19 ALA H . . 3.550 3.597 3.464 3.663 0.113 18 0 "[ . 1 . 2]" 1
1819 2 18 VAL HB 2 19 ALA MB . . 4.710 4.257 3.885 4.692 . 0 0 "[ . 1 . 2]" 1
1820 2 18 VAL HB 2 20 GLY H . . 5.300 5.412 5.336 5.471 0.171 12 0 "[ . 1 . 2]" 1
1821 2 18 VAL MG1 2 19 ALA H . . 4.030 4.033 3.948 4.095 0.065 12 0 "[ . 1 . 2]" 1
1822 2 18 VAL MG2 2 19 ALA H . . 3.460 2.025 1.892 2.142 . 0 0 "[ . 1 . 2]" 1
1823 2 18 VAL MG2 2 20 GLY H . . 4.250 3.805 3.545 4.237 . 0 0 "[ . 1 . 2]" 1
1824 2 19 ALA H 2 19 ALA MB . . 2.750 2.354 2.256 2.488 . 0 0 "[ . 1 . 2]" 1
1825 2 19 ALA H 2 20 GLY H . . 3.240 2.140 1.833 2.603 . 0 0 "[ . 1 . 2]" 1
1826 2 19 ALA MB 2 20 GLY H . . 3.700 2.965 2.732 3.348 . 0 0 "[ . 1 . 2]" 1
1827 2 19 ALA MB 2 20 GLY HA2 . . 5.000 4.035 3.884 4.203 . 0 0 "[ . 1 . 2]" 1
1828 2 19 ALA MB 2 20 GLY QA . . 4.270 3.737 3.628 3.913 . 0 0 "[ . 1 . 2]" 1
1829 2 19 ALA MB 2 20 GLY HA3 . . 5.000 4.422 4.190 4.724 . 0 0 "[ . 1 . 2]" 1
1830 2 20 GLY QA 2 21 VAL H . . 2.650 2.178 2.124 2.307 . 0 0 "[ . 1 . 2]" 1
1831 2 20 GLY QA 2 21 VAL QG . . 4.300 3.529 3.144 3.810 . 0 0 "[ . 1 . 2]" 1
1832 2 20 GLY QA 2 22 GLU H . . 5.150 3.521 3.163 4.047 . 0 0 "[ . 1 . 2]" 1
1833 2 20 GLY HA2 2 21 VAL H . . 3.410 2.237 2.148 2.673 . 0 0 "[ . 1 . 2]" 1
1834 2 20 GLY HA3 2 21 VAL H . . 3.410 3.221 2.522 3.480 0.070 4 0 "[ . 1 . 2]" 1
1835 2 21 VAL H 2 21 VAL HB . . 3.200 2.680 2.452 3.163 . 0 0 "[ . 1 . 2]" 1
1836 2 21 VAL H 2 21 VAL MG1 . . 3.960 3.194 1.969 3.875 . 0 0 "[ . 1 . 2]" 1
1837 2 21 VAL H 2 21 VAL QG . . 3.070 2.181 1.963 2.461 . 0 0 "[ . 1 . 2]" 1
1838 2 21 VAL H 2 21 VAL MG2 . . 3.960 2.864 2.050 4.043 0.083 17 0 "[ . 1 . 2]" 1
1839 2 21 VAL H 2 22 GLU H . . 3.460 3.190 2.006 3.756 0.296 11 0 "[ . 1 . 2]" 1
1840 2 21 VAL H 2 22 GLU QG . . 5.340 4.074 3.305 5.006 . 0 0 "[ . 1 . 2]" 1
1841 2 21 VAL HA 2 21 VAL MG1 . . 3.220 2.756 2.366 3.278 0.058 3 0 "[ . 1 . 2]" 1
1842 2 21 VAL HA 2 21 VAL MG2 . . 3.220 2.448 2.283 2.605 . 0 0 "[ . 1 . 2]" 1
1843 2 21 VAL HA 2 22 GLU H . . 2.980 2.689 2.297 3.130 0.150 9 0 "[ . 1 . 2]" 1
1844 2 21 VAL MG1 2 22 GLU H . . 4.380 3.889 3.382 4.334 . 0 0 "[ . 1 . 2]" 1
1845 2 21 VAL MG2 2 22 GLU H . . 4.380 4.321 4.023 4.404 0.024 18 0 "[ . 1 . 2]" 1
1846 2 22 GLU H 2 22 GLU QB . . 3.640 2.674 2.331 3.323 . 0 0 "[ . 1 . 2]" 1
1847 2 22 GLU H 2 22 GLU HG2 . . 4.880 3.419 2.201 4.489 . 0 0 "[ . 1 . 2]" 1
1848 2 22 GLU H 2 22 GLU QG . . 4.230 2.884 2.183 3.746 . 0 0 "[ . 1 . 2]" 1
1849 2 22 GLU H 2 22 GLU HG3 . . 4.880 3.491 2.559 4.362 . 0 0 "[ . 1 . 2]" 1
1850 2 22 GLU H 2 23 PHE H . . 4.540 4.170 3.847 4.386 . 0 0 "[ . 1 . 2]" 1
1851 2 22 GLU HA 2 22 GLU QG . . 3.660 2.884 2.433 3.588 . 0 0 "[ . 1 . 2]" 1
1852 2 22 GLU HA 2 23 PHE H . . 2.700 2.193 2.116 2.257 . 0 0 "[ . 1 . 2]" 1
1853 2 22 GLU HA 2 23 PHE HB2 . . 5.250 4.621 4.450 4.733 . 0 0 "[ . 1 . 2]" 1
1854 2 22 GLU QB 2 23 PHE H . . 3.730 3.507 3.271 3.776 0.046 3 0 "[ . 1 . 2]" 1
1855 2 22 GLU HB2 2 23 PHE H . . 4.520 4.185 3.395 4.557 0.037 6 0 "[ . 1 . 2]" 1
1856 2 22 GLU HB3 2 23 PHE H . . 4.520 3.882 3.525 4.334 . 0 0 "[ . 1 . 2]" 1
1857 2 22 GLU QG 2 23 PHE H . . 4.850 4.519 4.127 4.961 0.111 7 0 "[ . 1 . 2]" 1
1858 2 23 PHE H 2 23 PHE HB2 . . 3.110 2.520 2.397 2.635 . 0 0 "[ . 1 . 2]" 1
1859 2 23 PHE H 2 23 PHE HB3 . . 3.710 3.609 3.575 3.668 . 0 0 "[ . 1 . 2]" 1
1860 2 23 PHE H 2 23 PHE QD . . 3.480 3.015 2.455 3.233 . 0 0 "[ . 1 . 2]" 1
1861 2 23 PHE H 2 24 ARG H . . 4.720 4.503 4.285 4.669 . 0 0 "[ . 1 . 2]" 1
1862 2 23 PHE H 2 26 LEU QD . . 4.410 3.964 3.589 4.339 . 0 0 "[ . 1 . 2]" 1
1863 2 23 PHE HA 2 23 PHE QD . . 3.530 2.311 2.076 2.786 . 0 0 "[ . 1 . 2]" 1
1864 2 23 PHE HA 2 24 ARG H . . 2.890 2.162 2.092 2.313 . 0 0 "[ . 1 . 2]" 1
1865 2 23 PHE HB2 2 24 ARG H . . 4.620 4.257 3.913 4.492 . 0 0 "[ . 1 . 2]" 1
1866 2 23 PHE HB2 2 26 LEU HA . . 5.130 4.142 3.634 4.677 . 0 0 "[ . 1 . 2]" 1
1867 2 23 PHE HB2 2 26 LEU QD . . 3.220 2.212 1.981 2.476 . 0 0 "[ . 1 . 2]" 1
1868 2 23 PHE HB2 2 26 LEU HG . . 5.000 4.678 3.700 5.053 0.053 12 0 "[ . 1 . 2]" 1
1869 2 23 PHE HB3 2 24 ARG H . . 3.910 3.388 2.755 3.827 . 0 0 "[ . 1 . 2]" 1
1870 2 23 PHE HB3 2 25 ASP H . . 3.730 3.309 2.765 3.759 0.029 18 0 "[ . 1 . 2]" 1
1871 2 23 PHE HB3 2 26 LEU H . . 5.290 4.855 4.549 5.380 0.090 5 0 "[ . 1 . 2]" 1
1872 2 23 PHE HB3 2 26 LEU QD . . 3.590 2.637 2.165 3.106 . 0 0 "[ . 1 . 2]" 1
1873 2 23 PHE HB3 2 26 LEU HG . . 5.500 5.351 4.031 5.742 0.242 15 0 "[ . 1 . 2]" 1
1874 2 23 PHE QD 2 24 ARG H . . 4.380 3.874 3.415 4.214 . 0 0 "[ . 1 . 2]" 1
1875 2 23 PHE QD 2 26 LEU QD . . 3.470 2.538 2.032 3.223 . 0 0 "[ . 1 . 2]" 1
1876 2 24 ARG H 2 24 ARG HB2 . . 2.970 2.499 2.350 2.702 . 0 0 "[ . 1 . 2]" 1
1877 2 24 ARG H 2 24 ARG HB3 . . 3.680 2.549 2.413 2.733 . 0 0 "[ . 1 . 2]" 1
1878 2 24 ARG H 2 24 ARG QD . . 4.770 4.484 4.357 4.763 . 0 0 "[ . 1 . 2]" 1
1879 2 24 ARG H 2 24 ARG QG . . 4.510 4.004 3.960 4.049 . 0 0 "[ . 1 . 2]" 1
1880 2 24 ARG H 2 25 ASP H . . 3.220 2.747 2.366 2.954 . 0 0 "[ . 1 . 2]" 1
1881 2 24 ARG H 2 26 LEU QD . . 5.290 4.844 4.492 5.386 0.096 5 0 "[ . 1 . 2]" 1
1882 2 24 ARG HA 2 24 ARG QD . . 4.470 4.089 3.989 4.173 . 0 0 "[ . 1 . 2]" 1
1883 2 24 ARG HA 2 24 ARG QG . . 3.480 2.527 2.466 2.654 . 0 0 "[ . 1 . 2]" 1
1884 2 24 ARG HB2 2 24 ARG QD . . 3.000 2.461 2.391 2.593 . 0 0 "[ . 1 . 2]" 1
1885 2 24 ARG HB2 2 25 ASP H . . 4.040 3.825 3.603 3.990 . 0 0 "[ . 1 . 2]" 1
1886 2 24 ARG HB3 2 24 ARG QD . . 3.540 2.523 2.404 3.038 . 0 0 "[ . 1 . 2]" 1
1887 2 24 ARG HB3 2 25 ASP H . . 3.210 2.531 2.309 2.820 . 0 0 "[ . 1 . 2]" 1
1888 2 24 ARG HB3 2 25 ASP QB . . 4.780 3.712 3.483 3.987 . 0 0 "[ . 1 . 2]" 1
1889 2 24 ARG QG 2 25 ASP H . . 4.330 3.612 3.420 3.855 . 0 0 "[ . 1 . 2]" 1
1890 2 24 ARG QG 2 25 ASP QB . . 4.580 3.202 2.745 4.456 . 0 0 "[ . 1 . 2]" 1
1891 2 24 ARG HG2 2 25 ASP H . . 5.090 3.751 3.521 4.038 . 0 0 "[ . 1 . 2]" 1
1892 2 24 ARG HG3 2 25 ASP H . . 5.090 4.718 4.542 4.884 . 0 0 "[ . 1 . 2]" 1
1893 2 25 ASP H 2 25 ASP HB2 . . 3.610 3.305 2.608 3.641 0.031 12 0 "[ . 1 . 2]" 1
1894 2 25 ASP H 2 25 ASP QB . . 3.150 2.768 2.561 2.916 . 0 0 "[ . 1 . 2]" 1
1895 2 25 ASP H 2 25 ASP HB3 . . 3.610 3.085 2.877 3.837 0.227 7 0 "[ . 1 . 2]" 1
1896 2 25 ASP H 2 26 LEU H . . 4.080 4.142 4.008 4.267 0.187 5 0 "[ . 1 . 2]" 1
1897 2 25 ASP H 2 26 LEU QD . . 4.830 3.917 3.634 4.693 . 0 0 "[ . 1 . 2]" 1
1898 2 25 ASP H 2 28 LYS H . . 5.220 4.388 3.789 4.755 . 0 0 "[ . 1 . 2]" 1
1899 2 25 ASP HA 2 26 LEU H . . 2.770 2.168 2.090 2.369 . 0 0 "[ . 1 . 2]" 1
1900 2 25 ASP HA 2 26 LEU HB2 . . 5.040 4.531 4.353 4.726 . 0 0 "[ . 1 . 2]" 1
1901 2 25 ASP HA 2 26 LEU HG . . 5.500 5.081 2.957 5.592 0.092 7 0 "[ . 1 . 2]" 1
1902 2 25 ASP QB 2 27 SER H . . 4.350 3.514 2.443 3.971 . 0 0 "[ . 1 . 2]" 1
1903 2 25 ASP QB 2 28 LYS H . . 3.880 2.875 2.336 3.209 . 0 0 "[ . 1 . 2]" 1
1904 2 25 ASP QB 2 28 LYS HB2 . . 4.000 2.178 1.811 3.240 . 0 0 "[ . 1 . 2]" 1
1905 2 25 ASP QB 2 28 LYS HB3 . . 4.850 3.657 3.357 4.328 . 0 0 "[ . 1 . 2]" 1
1906 2 25 ASP QB 2 28 LYS QD . . 4.540 3.716 2.123 4.331 . 0 0 "[ . 1 . 2]" 1
1907 2 25 ASP QB 2 28 LYS QG . . 4.410 2.404 1.781 3.401 . 0 0 "[ . 1 . 2]" 1
1908 2 25 ASP QB 2 29 VAL QG . . 5.280 4.629 4.123 5.305 0.025 12 0 "[ . 1 . 2]" 1
1909 2 25 ASP HB2 2 26 LEU H . . 5.370 4.160 3.813 4.429 . 0 0 "[ . 1 . 2]" 1
1910 2 25 ASP HB2 2 27 SER H . . 5.010 4.530 3.342 4.925 . 0 0 "[ . 1 . 2]" 1
1911 2 25 ASP HB2 2 28 LYS H . . 4.670 4.224 2.451 4.656 . 0 0 "[ . 1 . 2]" 1
1912 2 25 ASP HB2 2 28 LYS HB2 . . 4.640 3.612 1.825 4.539 . 0 0 "[ . 1 . 2]" 1
1913 2 25 ASP HB3 2 26 LEU H . . 5.370 3.969 2.965 4.329 . 0 0 "[ . 1 . 2]" 1
1914 2 25 ASP HB3 2 27 SER H . . 5.010 3.675 2.511 4.236 . 0 0 "[ . 1 . 2]" 1
1915 2 25 ASP HB3 2 28 LYS H . . 4.670 2.959 2.755 3.272 . 0 0 "[ . 1 . 2]" 1
1916 2 25 ASP HB3 2 28 LYS HB2 . . 4.640 2.392 1.817 3.669 . 0 0 "[ . 1 . 2]" 1
1917 2 26 LEU H 2 26 LEU HB2 . . 3.780 2.426 2.284 2.557 . 0 0 "[ . 1 . 2]" 1
1918 2 26 LEU H 2 26 LEU HB3 . . 3.800 3.571 3.500 3.631 . 0 0 "[ . 1 . 2]" 1
1919 2 26 LEU H 2 26 LEU MD1 . . 4.180 3.332 2.921 3.659 . 0 0 "[ . 1 . 2]" 1
1920 2 26 LEU H 2 26 LEU QD . . 3.580 2.116 1.642 3.161 . 0 0 "[ . 1 . 2]" 1
1921 2 26 LEU H 2 26 LEU MD2 . . 4.180 2.216 1.651 3.616 . 0 0 "[ . 1 . 2]" 1
1922 2 26 LEU H 2 26 LEU HG . . 3.210 3.538 2.200 3.959 0.749 12 15 "[ **.*-*** + *******]" 1
1923 2 26 LEU H 2 27 SER H . . 3.330 2.577 2.237 2.753 . 0 0 "[ . 1 . 2]" 1
1924 2 26 LEU H 2 28 LYS H . . 4.710 3.935 3.325 4.160 . 0 0 "[ . 1 . 2]" 1
1925 2 26 LEU HA 2 26 LEU QD . . 2.830 2.098 2.005 2.352 . 0 0 "[ . 1 . 2]" 1
1926 2 26 LEU HA 2 26 LEU HG . . 4.060 3.598 3.001 3.758 . 0 0 "[ . 1 . 2]" 1
1927 2 26 LEU HA 2 28 LYS H . . 4.540 3.843 3.157 4.176 . 0 0 "[ . 1 . 2]" 1
1928 2 26 LEU HA 2 29 VAL QG . . 3.640 2.054 1.722 2.730 . 0 0 "[ . 1 . 2]" 1
1929 2 26 LEU HB2 2 27 SER H . . 3.550 3.336 2.959 3.635 0.085 12 0 "[ . 1 . 2]" 1
1930 2 26 LEU HB3 2 27 SER H . . 4.550 4.150 3.953 4.354 . 0 0 "[ . 1 . 2]" 1
1931 2 26 LEU HB3 2 29 VAL QG . . 4.720 3.388 2.894 3.870 . 0 0 "[ . 1 . 2]" 1
1932 2 26 LEU QD 2 27 SER H . . 4.750 3.943 3.650 4.311 . 0 0 "[ . 1 . 2]" 1
1933 2 26 LEU QD 2 29 VAL H . . 5.440 4.681 4.284 5.087 . 0 0 "[ . 1 . 2]" 1
1934 2 26 LEU MD1 2 27 SER H . . 5.500 4.727 4.439 4.892 . 0 0 "[ . 1 . 2]" 1
1935 2 26 LEU MD1 2 28 LYS H . . 5.500 5.485 4.932 6.185 0.685 1 2 "[+- . 1 . 2]" 1
1936 2 26 LEU MD2 2 27 SER H . . 5.500 4.250 3.830 4.853 . 0 0 "[ . 1 . 2]" 1
1937 2 26 LEU MD2 2 28 LYS H . . 5.500 5.192 4.844 5.346 . 0 0 "[ . 1 . 2]" 1
1938 2 27 SER H 2 27 SER QB . . 2.980 2.446 2.277 2.682 . 0 0 "[ . 1 . 2]" 1
1939 2 27 SER H 2 28 LYS H . . 2.920 2.231 1.981 2.447 . 0 0 "[ . 1 . 2]" 1
1940 2 27 SER H 2 28 LYS QG . . 5.010 4.057 3.662 4.547 . 0 0 "[ . 1 . 2]" 1
1941 2 27 SER H 2 29 VAL H . . 4.320 3.870 3.630 4.140 . 0 0 "[ . 1 . 2]" 1
1942 2 27 SER H 2 29 VAL QG . . 4.690 3.910 3.597 4.453 . 0 0 "[ . 1 . 2]" 1
1943 2 27 SER HA 2 29 VAL H . . 4.560 3.703 3.439 4.062 . 0 0 "[ . 1 . 2]" 1
1944 2 28 LYS H 2 28 LYS HB2 . . 3.000 2.467 2.356 2.676 . 0 0 "[ . 1 . 2]" 1
1945 2 28 LYS H 2 28 LYS HB3 . . 3.970 3.671 3.619 3.812 . 0 0 "[ . 1 . 2]" 1
1946 2 28 LYS H 2 28 LYS HG2 . . 4.060 3.090 2.401 4.044 . 0 0 "[ . 1 . 2]" 1
1947 2 28 LYS H 2 28 LYS QG . . 3.410 2.716 2.376 3.091 . 0 0 "[ . 1 . 2]" 1
1948 2 28 LYS H 2 28 LYS HG3 . . 4.060 3.619 2.533 4.127 0.067 2 0 "[ . 1 . 2]" 1
1949 2 28 LYS H 2 29 VAL H . . 3.000 2.508 2.264 2.751 . 0 0 "[ . 1 . 2]" 1
1950 2 28 LYS H 2 29 VAL QG . . 3.950 3.476 3.254 3.755 . 0 0 "[ . 1 . 2]" 1
1951 2 28 LYS HA 2 28 LYS QD . . 3.900 2.829 2.037 4.060 0.160 14 0 "[ . 1 . 2]" 1
1952 2 28 LYS HA 2 28 LYS HG2 . . 3.930 2.887 2.452 3.198 . 0 0 "[ . 1 . 2]" 1
1953 2 28 LYS HA 2 28 LYS QG . . 3.380 2.774 2.366 3.051 . 0 0 "[ . 1 . 2]" 1
1954 2 28 LYS HA 2 28 LYS HG3 . . 3.930 3.594 3.054 3.856 . 0 0 "[ . 1 . 2]" 1
1955 2 28 LYS HB3 2 29 VAL H . . 4.750 4.325 4.058 4.470 . 0 0 "[ . 1 . 2]" 1
1956 2 29 VAL H 2 29 VAL HB . . 3.790 3.282 2.360 3.766 . 0 0 "[ . 1 . 2]" 1
1957 2 29 VAL H 2 29 VAL QG . . 3.060 2.073 1.891 2.520 . 0 0 "[ . 1 . 2]" 1
1958 2 29 VAL H 2 30 GLU H . . 4.740 4.313 4.082 4.556 . 0 0 "[ . 1 . 2]" 1
1959 2 29 VAL H 2 30 GLU QB . . 5.500 5.550 5.414 5.673 0.173 3 0 "[ . 1 . 2]" 1
1960 2 29 VAL HA 2 30 GLU H . . 2.970 2.173 2.111 2.245 . 0 0 "[ . 1 . 2]" 1
1961 2 29 VAL HA 2 31 PHE H . . 5.500 5.441 5.230 5.614 0.114 5 0 "[ . 1 . 2]" 1
1962 2 29 VAL HB 2 30 GLU H . . 4.650 3.886 2.899 4.557 . 0 0 "[ . 1 . 2]" 1
1963 2 29 VAL QG 2 30 GLU H . . 4.210 3.496 3.218 3.783 . 0 0 "[ . 1 . 2]" 1
1964 2 29 VAL QG 2 31 PHE H . . 4.780 3.913 3.597 4.309 . 0 0 "[ . 1 . 2]" 1
1965 2 29 VAL QG 2 31 PHE QE . . 4.250 2.604 2.150 3.087 . 0 0 "[ . 1 . 2]" 1
1966 2 30 GLU H 2 30 GLU QB . . 3.240 2.334 2.286 2.492 . 0 0 "[ . 1 . 2]" 1
1967 2 30 GLU H 2 30 GLU HG2 . . 4.900 4.436 4.388 4.491 . 0 0 "[ . 1 . 2]" 1
1968 2 30 GLU H 2 30 GLU HG3 . . 4.760 4.608 4.523 4.743 . 0 0 "[ . 1 . 2]" 1
1969 2 30 GLU HA 2 30 GLU HG2 . . 4.190 3.170 3.003 3.312 . 0 0 "[ . 1 . 2]" 1
1970 2 30 GLU HA 2 30 GLU HG3 . . 3.850 2.614 2.558 2.701 . 0 0 "[ . 1 . 2]" 1
1971 2 30 GLU HA 2 31 PHE H . . 2.690 2.152 2.102 2.191 . 0 0 "[ . 1 . 2]" 1
1972 2 30 GLU QB 2 31 PHE H . . 4.150 3.956 3.897 4.003 . 0 0 "[ . 1 . 2]" 1
1973 2 30 GLU QB 2 60 TYR QE . . 3.650 2.042 1.747 2.609 . 0 0 "[ . 1 . 2]" 1
1974 2 30 GLU HG2 2 31 PHE H . . 4.640 3.756 3.429 4.085 . 0 0 "[ . 1 . 2]" 1
1975 2 30 GLU HG2 2 32 VAL H . . 5.500 4.095 3.729 4.491 . 0 0 "[ . 1 . 2]" 1
1976 2 30 GLU HG2 2 32 VAL HA . . 5.290 3.290 2.879 3.806 . 0 0 "[ . 1 . 2]" 1
1977 2 30 GLU HG2 2 32 VAL MG2 . . 3.960 3.528 2.953 3.972 0.012 19 0 "[ . 1 . 2]" 1
1978 2 30 GLU HG2 2 60 TYR QE . . 4.990 2.982 2.403 3.581 . 0 0 "[ . 1 . 2]" 1
1979 2 30 GLU HG3 2 31 PHE H . . 3.760 3.764 3.583 3.873 0.113 11 0 "[ . 1 . 2]" 1
1980 2 30 GLU HG3 2 32 VAL HA . . 5.190 4.655 4.109 5.179 . 0 0 "[ . 1 . 2]" 1
1981 2 30 GLU HG3 2 32 VAL MG2 . . 5.250 5.010 4.463 5.382 0.132 19 0 "[ . 1 . 2]" 1
1982 2 31 PHE H 2 31 PHE QB . . 3.660 2.478 2.420 2.537 . 0 0 "[ . 1 . 2]" 1
1983 2 31 PHE H 2 31 PHE QD . . 4.660 2.226 1.859 2.507 . 0 0 "[ . 1 . 2]" 1
1984 2 31 PHE H 2 31 PHE QE . . 4.820 4.131 4.031 4.329 . 0 0 "[ . 1 . 2]" 1
1985 2 31 PHE H 2 32 VAL H . . 4.840 4.328 4.201 4.464 . 0 0 "[ . 1 . 2]" 1
1986 2 31 PHE H 2 32 VAL HA . . 5.500 5.305 5.158 5.467 . 0 0 "[ . 1 . 2]" 1
1987 2 31 PHE H 2 32 VAL MG2 . . 5.430 5.187 5.021 5.419 . 0 0 "[ . 1 . 2]" 1
1988 2 31 PHE HA 2 31 PHE QD . . 3.460 2.979 2.769 3.177 . 0 0 "[ . 1 . 2]" 1
1989 2 31 PHE HA 2 31 PHE QE . . 5.030 4.724 4.630 4.812 . 0 0 "[ . 1 . 2]" 1
1990 2 31 PHE HA 2 32 VAL H . . 3.090 2.158 2.131 2.195 . 0 0 "[ . 1 . 2]" 1
1991 2 31 PHE QD 2 32 VAL H . . 5.150 4.623 4.426 4.750 . 0 0 "[ . 1 . 2]" 1
1992 2 32 VAL H 2 32 VAL HB . . 3.380 2.598 2.537 2.688 . 0 0 "[ . 1 . 2]" 1
1993 2 32 VAL H 2 32 VAL MG1 . . 4.520 3.811 3.783 3.836 . 0 0 "[ . 1 . 2]" 1
1994 2 32 VAL H 2 32 VAL MG2 . . 3.130 1.979 1.931 2.073 . 0 0 "[ . 1 . 2]" 1
1995 2 32 VAL HA 2 32 VAL MG1 . . 3.130 2.473 2.421 2.514 . 0 0 "[ . 1 . 2]" 1
1996 2 32 VAL HA 2 32 VAL MG2 . . 3.000 2.474 2.417 2.525 . 0 0 "[ . 1 . 2]" 1
1997 2 32 VAL HB 2 33 GLY H . . 4.280 2.698 2.403 2.967 . 0 0 "[ . 1 . 2]" 1
1998 2 32 VAL HB 2 60 TYR QD . . 5.470 4.620 4.484 4.802 . 0 0 "[ . 1 . 2]" 1
1999 2 32 VAL MG1 2 33 GLY QA . . 5.340 3.829 3.519 4.098 . 0 0 "[ . 1 . 2]" 1
2000 2 32 VAL MG1 2 48 LYS HD3 . . 3.910 2.384 2.028 2.676 . 0 0 "[ . 1 . 2]" 1
2001 2 32 VAL MG1 2 48 LYS HE2 . . 4.420 3.176 2.878 3.621 . 0 0 "[ . 1 . 2]" 1
2002 2 32 VAL MG1 2 48 LYS QE . . 3.680 3.100 2.823 3.483 . 0 0 "[ . 1 . 2]" 1
2003 2 32 VAL MG1 2 48 LYS HE3 . . 4.420 4.340 4.081 4.524 0.104 14 0 "[ . 1 . 2]" 1
2004 2 32 VAL MG1 2 60 TYR QE . . 5.220 5.037 4.818 5.229 0.009 1 0 "[ . 1 . 2]" 1
2005 2 32 VAL MG2 2 48 LYS HE2 . . 3.980 2.370 2.013 2.714 . 0 0 "[ . 1 . 2]" 1
2006 2 32 VAL MG2 2 48 LYS QE . . 3.260 2.345 2.002 2.676 . 0 0 "[ . 1 . 2]" 1
2007 2 32 VAL MG2 2 48 LYS HE3 . . 3.980 3.752 3.473 4.072 0.092 14 0 "[ . 1 . 2]" 1
2008 2 32 VAL MG2 2 60 TYR H . . 5.500 5.545 5.394 5.681 0.181 16 0 "[ . 1 . 2]" 1
2009 2 32 VAL MG2 2 60 TYR HB3 . . 5.320 2.603 2.382 2.812 . 0 0 "[ . 1 . 2]" 1
2010 2 32 VAL MG2 2 60 TYR QD . . 3.330 2.039 1.834 2.229 . 0 0 "[ . 1 . 2]" 1
2011 2 32 VAL MG2 2 60 TYR QE . . 3.180 3.087 2.816 3.270 0.090 9 0 "[ . 1 . 2]" 1
2012 2 33 GLY QA 2 34 ALA MB . . 4.610 3.633 3.556 3.731 . 0 0 "[ . 1 . 2]" 1
2013 2 34 ALA H 2 34 ALA MB . . 3.210 2.762 2.677 2.850 . 0 0 "[ . 1 . 2]" 1
2014 2 34 ALA H 2 35 TYR H . . 5.030 4.265 4.083 4.369 . 0 0 "[ . 1 . 2]" 1
2015 2 34 ALA HA 2 35 TYR H . . 2.910 2.329 2.168 2.535 . 0 0 "[ . 1 . 2]" 1
2016 2 34 ALA MB 2 35 TYR H . . 3.450 2.674 2.322 3.084 . 0 0 "[ . 1 . 2]" 1
2017 2 35 TYR H 2 35 TYR HB3 . . 4.050 3.726 3.589 3.837 . 0 0 "[ . 1 . 2]" 1
2018 2 35 TYR H 2 35 TYR QD . . 4.810 2.923 2.394 3.516 . 0 0 "[ . 1 . 2]" 1
2019 2 35 TYR H 2 36 PRO QD . . 4.640 4.493 4.379 4.559 . 0 0 "[ . 1 . 2]" 1
2020 2 35 TYR H 2 37 SER H . . 4.880 4.413 4.144 4.971 0.091 5 0 "[ . 1 . 2]" 1
2021 2 35 TYR H 2 40 GLU HB2 . . 5.500 5.125 4.903 5.526 0.026 8 0 "[ . 1 . 2]" 1
2022 2 35 TYR H 2 41 ALA H . . 5.500 5.075 4.788 5.490 . 0 0 "[ . 1 . 2]" 1
2023 2 35 TYR HA 2 36 PRO HG2 . . 4.940 4.772 4.530 4.925 . 0 0 "[ . 1 . 2]" 1
2024 2 35 TYR HA 2 36 PRO HG3 . . 4.940 4.663 4.135 4.856 . 0 0 "[ . 1 . 2]" 1
2025 2 35 TYR HB3 2 36 PRO QD . . 3.720 2.228 2.004 2.867 . 0 0 "[ . 1 . 2]" 1
2026 2 35 TYR HB3 2 37 SER H . . 3.580 2.858 2.475 3.140 . 0 0 "[ . 1 . 2]" 1
2027 2 35 TYR HB3 2 40 GLU H . . 4.700 4.560 4.342 4.716 0.016 12 0 "[ . 1 . 2]" 1
2028 2 35 TYR HB3 2 40 GLU HB2 . . 4.030 2.094 1.925 2.272 . 0 0 "[ . 1 . 2]" 1
2029 2 35 TYR HB3 2 40 GLU HB3 . . 4.000 2.617 2.106 3.022 . 0 0 "[ . 1 . 2]" 1
2030 2 35 TYR HB3 2 40 GLU HG2 . . 5.010 4.165 3.852 4.387 . 0 0 "[ . 1 . 2]" 1
2031 2 35 TYR HB3 2 40 GLU HG3 . . 4.390 3.353 3.022 3.671 . 0 0 "[ . 1 . 2]" 1
2032 2 35 TYR HB3 2 41 ALA H . . 3.980 3.832 3.541 4.025 0.045 15 0 "[ . 1 . 2]" 1
2033 2 35 TYR HB3 2 41 ALA MB . . 4.260 3.826 3.607 4.173 . 0 0 "[ . 1 . 2]" 1
2034 2 35 TYR QD 2 40 GLU HB2 . . 5.500 3.505 3.113 3.817 . 0 0 "[ . 1 . 2]" 1
2035 2 35 TYR QD 2 40 GLU HB3 . . 4.810 2.702 2.404 3.132 . 0 0 "[ . 1 . 2]" 1
2036 2 35 TYR QD 2 40 GLU HG2 . . 5.350 5.162 4.885 5.453 0.103 2 0 "[ . 1 . 2]" 1
2037 2 35 TYR QD 2 40 GLU HG3 . . 5.500 4.020 3.710 4.386 . 0 0 "[ . 1 . 2]" 1
2038 2 35 TYR QD 2 41 ALA HA . . 5.160 2.613 2.081 3.208 . 0 0 "[ . 1 . 2]" 1
2039 2 35 TYR QD 2 41 ALA MB . . 4.330 2.698 2.306 3.220 . 0 0 "[ . 1 . 2]" 1
2040 2 36 PRO QD 2 37 SER H . . 3.420 3.097 2.856 3.276 . 0 0 "[ . 1 . 2]" 1
2041 2 36 PRO QD 2 40 GLU HB2 . . 3.900 3.565 3.172 3.989 0.089 5 0 "[ . 1 . 2]" 1
2042 2 36 PRO QD 2 40 GLU HG3 . . 3.740 3.246 2.728 3.809 0.069 5 0 "[ . 1 . 2]" 1
2043 2 36 PRO QG 2 37 SER H . . 3.700 3.441 3.165 4.050 0.350 5 0 "[ . 1 . 2]" 1
2044 2 37 SER H 2 37 SER QB . . 3.510 2.823 2.631 2.919 . 0 0 "[ . 1 . 2]" 1
2045 2 37 SER H 2 38 TYR H . . 5.160 4.298 4.165 4.390 . 0 0 "[ . 1 . 2]" 1
2046 2 37 SER H 2 38 TYR HA . . 4.950 4.852 4.667 5.041 0.091 5 0 "[ . 1 . 2]" 1
2047 2 37 SER H 2 40 GLU H . . 4.440 4.319 3.873 4.487 0.047 14 0 "[ . 1 . 2]" 1
2048 2 37 SER H 2 40 GLU HB2 . . 3.580 3.039 2.373 3.286 . 0 0 "[ . 1 . 2]" 1
2049 2 37 SER H 2 40 GLU HB3 . . 4.760 4.487 3.783 4.794 0.034 15 0 "[ . 1 . 2]" 1
2050 2 37 SER H 2 40 GLU HG2 . . 5.340 3.898 3.236 4.380 . 0 0 "[ . 1 . 2]" 1
2051 2 37 SER H 2 40 GLU HG3 . . 4.680 3.668 3.043 4.280 . 0 0 "[ . 1 . 2]" 1
2052 2 37 SER H 2 41 ALA MB . . 4.320 4.423 4.277 4.526 0.206 4 0 "[ . 1 . 2]" 1
2053 2 37 SER HA 2 38 TYR H . . 3.090 2.277 2.169 2.452 . 0 0 "[ . 1 . 2]" 1
2054 2 37 SER HA 2 38 TYR HB2 . . 5.490 4.737 4.557 4.866 . 0 0 "[ . 1 . 2]" 1
2055 2 37 SER HA 2 38 TYR HB3 . . 5.400 4.664 4.486 4.834 . 0 0 "[ . 1 . 2]" 1
2056 2 38 TYR H 2 38 TYR HB2 . . 3.870 2.708 2.615 2.825 . 0 0 "[ . 1 . 2]" 1
2057 2 38 TYR H 2 38 TYR HB3 . . 3.870 2.410 2.302 2.515 . 0 0 "[ . 1 . 2]" 1
2058 2 38 TYR H 2 38 TYR QD . . 4.400 4.251 4.214 4.293 . 0 0 "[ . 1 . 2]" 1
2059 2 38 TYR H 2 39 ASP H . . 3.280 2.813 2.670 2.967 . 0 0 "[ . 1 . 2]" 1
2060 2 38 TYR H 2 40 GLU H . . 5.190 4.285 4.158 4.510 . 0 0 "[ . 1 . 2]" 1
2061 2 38 TYR HA 2 38 TYR QD . . 3.560 2.545 2.264 2.776 . 0 0 "[ . 1 . 2]" 1
2062 2 38 TYR HA 2 38 TYR QE . . 5.030 4.700 4.519 4.810 . 0 0 "[ . 1 . 2]" 1
2063 2 38 TYR HA 2 40 GLU H . . 4.640 4.340 4.259 4.503 . 0 0 "[ . 1 . 2]" 1
2064 2 38 TYR HB2 2 39 ASP H . . 4.300 4.036 3.890 4.209 . 0 0 "[ . 1 . 2]" 1
2065 2 38 TYR HB3 2 39 ASP H . . 4.300 2.718 2.511 2.971 . 0 0 "[ . 1 . 2]" 1
2066 2 38 TYR HB3 2 39 ASP HA . . 4.980 4.470 4.250 4.751 . 0 0 "[ . 1 . 2]" 1
2067 2 38 TYR QD 2 39 ASP H . . 3.940 3.725 3.104 4.139 0.199 9 0 "[ . 1 . 2]" 1
2068 2 38 TYR QD 2 39 ASP HB2 . . 5.270 4.170 2.883 5.327 0.057 9 0 "[ . 1 . 2]" 1
2069 2 38 TYR QE 2 42 HIS HB2 . . 4.620 3.427 2.893 3.791 . 0 0 "[ . 1 . 2]" 1
2070 2 38 TYR QE 2 42 HIS HB3 . . 5.450 4.659 4.153 5.052 . 0 0 "[ . 1 . 2]" 1
2071 2 38 TYR QE 2 62 ILE HB . . 5.170 4.562 3.856 5.202 0.032 10 0 "[ . 1 . 2]" 1
2072 2 38 TYR QE 2 62 ILE MD . . 4.180 3.241 2.414 4.118 . 0 0 "[ . 1 . 2]" 1
2073 2 39 ASP H 2 39 ASP HA . . 2.910 2.824 2.789 2.889 . 0 0 "[ . 1 . 2]" 1
2074 2 39 ASP H 2 39 ASP HB2 . . 2.770 2.528 2.391 2.618 . 0 0 "[ . 1 . 2]" 1
2075 2 39 ASP H 2 39 ASP HB3 . . 3.110 2.588 2.490 2.744 . 0 0 "[ . 1 . 2]" 1
2076 2 39 ASP H 2 40 GLU H . . 3.330 2.671 2.491 2.853 . 0 0 "[ . 1 . 2]" 1
2077 2 39 ASP H 2 40 GLU HG2 . . 5.500 4.187 3.954 4.550 . 0 0 "[ . 1 . 2]" 1
2078 2 39 ASP H 2 41 ALA H . . 4.400 4.225 4.007 4.420 0.020 12 0 "[ . 1 . 2]" 1
2079 2 39 ASP H 2 41 ALA MB . . 5.310 4.963 4.672 5.283 . 0 0 "[ . 1 . 2]" 1
2080 2 39 ASP H 2 42 HIS HB2 . . 5.500 5.024 4.679 5.298 . 0 0 "[ . 1 . 2]" 1
2081 2 39 ASP HA 2 41 ALA H . . 4.480 4.362 3.996 4.511 0.031 4 0 "[ . 1 . 2]" 1
2082 2 39 ASP HA 2 42 HIS H . . 3.900 3.303 2.789 3.708 . 0 0 "[ . 1 . 2]" 1
2083 2 39 ASP HA 2 42 HIS HB2 . . 4.430 3.049 2.743 3.492 . 0 0 "[ . 1 . 2]" 1
2084 2 39 ASP HA 2 42 HIS HB3 . . 3.960 2.230 1.771 2.584 . 0 0 "[ . 1 . 2]" 1
2085 2 39 ASP HA 2 43 LYS H . . 4.400 4.085 3.753 4.377 . 0 0 "[ . 1 . 2]" 1
2086 2 39 ASP HB3 2 40 GLU H . . 3.230 2.872 2.612 3.246 0.016 16 0 "[ . 1 . 2]" 1
2087 2 39 ASP HB3 2 40 GLU HA . . 5.500 4.436 4.244 4.634 . 0 0 "[ . 1 . 2]" 1
2088 2 39 ASP HB3 2 41 ALA H . . 5.500 5.239 4.990 5.494 . 0 0 "[ . 1 . 2]" 1
2089 2 40 GLU H 2 40 GLU HB2 . . 3.150 2.546 2.422 2.659 . 0 0 "[ . 1 . 2]" 1
2090 2 40 GLU H 2 40 GLU HG2 . . 3.780 2.192 2.068 2.308 . 0 0 "[ . 1 . 2]" 1
2091 2 40 GLU H 2 40 GLU HG3 . . 4.570 3.638 3.507 3.752 . 0 0 "[ . 1 . 2]" 1
2092 2 40 GLU H 2 41 ALA H . . 3.080 2.614 2.519 2.703 . 0 0 "[ . 1 . 2]" 1
2093 2 40 GLU H 2 41 ALA MB . . 4.330 4.269 4.149 4.350 0.020 7 0 "[ . 1 . 2]" 1
2094 2 40 GLU H 2 42 HIS H . . 4.430 3.879 3.793 4.111 . 0 0 "[ . 1 . 2]" 1
2095 2 40 GLU H 2 43 LYS H . . 5.030 4.706 4.471 4.903 . 0 0 "[ . 1 . 2]" 1
2096 2 40 GLU HA 2 40 GLU HG2 . . 3.610 3.215 2.994 3.428 . 0 0 "[ . 1 . 2]" 1
2097 2 40 GLU HA 2 40 GLU HG3 . . 4.130 3.825 3.781 3.867 . 0 0 "[ . 1 . 2]" 1
2098 2 40 GLU HB2 2 41 ALA H . . 3.570 2.609 2.505 2.862 . 0 0 "[ . 1 . 2]" 1
2099 2 40 GLU HB2 2 41 ALA HA . . 5.500 4.341 4.187 4.513 . 0 0 "[ . 1 . 2]" 1
2100 2 40 GLU HB3 2 41 ALA H . . 4.170 3.726 3.545 3.871 . 0 0 "[ . 1 . 2]" 1
2101 2 40 GLU HB3 2 41 ALA MB . . 5.500 4.735 4.437 4.952 . 0 0 "[ . 1 . 2]" 1
2102 2 40 GLU HG2 2 41 ALA H . . 4.700 4.199 4.027 4.373 . 0 0 "[ . 1 . 2]" 1
2103 2 40 GLU HG2 2 41 ALA MB . . 5.500 5.515 5.306 5.680 0.180 19 0 "[ . 1 . 2]" 1
2104 2 41 ALA H 2 41 ALA MB . . 2.860 2.213 2.173 2.248 . 0 0 "[ . 1 . 2]" 1
2105 2 41 ALA H 2 42 HIS H . . 3.140 2.447 2.323 2.545 . 0 0 "[ . 1 . 2]" 1
2106 2 41 ALA HA 2 44 ALA H . . 3.860 3.276 3.060 3.432 . 0 0 "[ . 1 . 2]" 1
2107 2 41 ALA HA 2 44 ALA MB . . 3.440 2.429 2.137 2.694 . 0 0 "[ . 1 . 2]" 1
2108 2 41 ALA MB 2 42 HIS H . . 3.210 2.641 2.400 2.869 . 0 0 "[ . 1 . 2]" 1
2109 2 41 ALA MB 2 42 HIS HB2 . . 5.500 4.118 3.811 4.394 . 0 0 "[ . 1 . 2]" 1
2110 2 41 ALA MB 2 45 TRP H . . 5.500 4.953 4.791 5.204 . 0 0 "[ . 1 . 2]" 1
2111 2 41 ALA MB 2 62 ILE MD . . 4.070 3.770 3.316 4.140 0.070 3 0 "[ . 1 . 2]" 1
2112 2 42 HIS H 2 42 HIS HB2 . . 3.020 2.569 2.406 2.711 . 0 0 "[ . 1 . 2]" 1
2113 2 42 HIS H 2 42 HIS HB3 . . 2.950 2.490 2.368 2.656 . 0 0 "[ . 1 . 2]" 1
2114 2 42 HIS H 2 42 HIS HD2 . . 5.110 5.051 4.960 5.139 0.029 14 0 "[ . 1 . 2]" 1
2115 2 42 HIS H 2 43 LYS H . . 3.310 2.582 2.383 2.768 . 0 0 "[ . 1 . 2]" 1
2116 2 42 HIS H 2 44 ALA H . . 4.520 3.945 3.761 4.162 . 0 0 "[ . 1 . 2]" 1
2117 2 42 HIS H 2 62 ILE MD . . 4.450 3.935 3.670 4.170 . 0 0 "[ . 1 . 2]" 1
2118 2 42 HIS HA 2 42 HIS HD2 . . 3.800 2.619 2.479 2.821 . 0 0 "[ . 1 . 2]" 1
2119 2 42 HIS HA 2 45 TRP H . . 4.330 3.812 3.484 4.057 . 0 0 "[ . 1 . 2]" 1
2120 2 42 HIS HA 2 45 TRP HB2 . . 4.670 4.187 3.716 4.667 . 0 0 "[ . 1 . 2]" 1
2121 2 42 HIS HA 2 45 TRP HB3 . . 4.010 3.266 2.829 3.565 . 0 0 "[ . 1 . 2]" 1
2122 2 42 HIS HA 2 62 ILE MD . . 3.150 1.916 1.780 2.027 . 0 0 "[ . 1 . 2]" 1
2123 2 42 HIS HB2 2 43 LYS H . . 3.930 3.989 3.943 4.079 0.149 12 0 "[ . 1 . 2]" 1
2124 2 42 HIS HB2 2 62 ILE MD . . 3.990 3.268 2.820 3.523 . 0 0 "[ . 1 . 2]" 1
2125 2 42 HIS HB3 2 43 LYS H . . 3.320 2.802 2.662 3.048 . 0 0 "[ . 1 . 2]" 1
2126 2 42 HIS HB3 2 62 ILE MD . . 4.360 4.241 3.980 4.386 0.026 10 0 "[ . 1 . 2]" 1
2127 2 42 HIS HD2 2 45 TRP HB3 . . 5.260 3.727 3.440 4.075 . 0 0 "[ . 1 . 2]" 1
2128 2 42 HIS HD2 2 45 TRP HE3 . . 4.080 3.355 2.976 3.617 . 0 0 "[ . 1 . 2]" 1
2129 2 42 HIS HD2 2 46 LYS H . . 5.500 5.610 5.405 5.726 0.226 19 0 "[ . 1 . 2]" 1
2130 2 42 HIS HD2 2 62 ILE MD . . 3.570 2.312 1.900 2.785 . 0 0 "[ . 1 . 2]" 1
2131 2 42 HIS HD2 2 62 ILE MG . . 5.290 4.930 4.589 5.370 0.080 11 0 "[ . 1 . 2]" 1
2132 2 43 LYS H 2 43 LYS HB3 . . 2.750 2.683 2.522 2.901 0.151 16 0 "[ . 1 . 2]" 1
2133 2 43 LYS H 2 43 LYS QD . . 4.720 4.368 4.040 4.589 . 0 0 "[ . 1 . 2]" 1
2134 2 43 LYS H 2 43 LYS QE . . 5.000 3.935 3.377 5.035 0.035 9 0 "[ . 1 . 2]" 1
2135 2 43 LYS H 2 43 LYS HG2 . . 4.680 4.649 4.569 4.687 0.007 6 0 "[ . 1 . 2]" 1
2136 2 43 LYS H 2 43 LYS QG . . 4.070 4.094 4.067 4.111 0.041 6 0 "[ . 1 . 2]" 1
2137 2 43 LYS H 2 43 LYS HG3 . . 4.680 4.546 4.504 4.595 . 0 0 "[ . 1 . 2]" 1
2138 2 43 LYS H 2 44 ALA H . . 3.160 2.434 2.244 2.607 . 0 0 "[ . 1 . 2]" 1
2139 2 43 LYS H 2 44 ALA MB . . 4.320 4.108 3.932 4.282 . 0 0 "[ . 1 . 2]" 1
2140 2 43 LYS H 2 45 TRP H . . 4.520 4.136 3.928 4.334 . 0 0 "[ . 1 . 2]" 1
2141 2 43 LYS H 2 46 LYS H . . 5.500 5.521 5.414 5.614 0.114 15 0 "[ . 1 . 2]" 1
2142 2 43 LYS H 2 62 ILE MD . . 4.930 4.805 4.558 4.971 0.041 7 0 "[ . 1 . 2]" 1
2143 2 43 LYS HA 2 43 LYS QD . . 4.070 2.027 1.899 2.170 . 0 0 "[ . 1 . 2]" 1
2144 2 43 LYS HA 2 43 LYS HG2 . . 4.010 3.741 3.661 3.796 . 0 0 "[ . 1 . 2]" 1
2145 2 43 LYS HA 2 43 LYS HG3 . . 4.010 2.977 2.731 3.235 . 0 0 "[ . 1 . 2]" 1
2146 2 43 LYS HA 2 45 TRP H . . 4.630 4.179 3.994 4.316 . 0 0 "[ . 1 . 2]" 1
2147 2 43 LYS HA 2 46 LYS H . . 3.920 3.764 3.647 3.968 0.048 16 0 "[ . 1 . 2]" 1
2148 2 43 LYS HB2 2 43 LYS QE . . 3.190 2.172 1.885 3.144 . 0 0 "[ . 1 . 2]" 1
2149 2 43 LYS HB3 2 43 LYS QE . . 4.190 3.612 3.360 4.154 . 0 0 "[ . 1 . 2]" 1
2150 2 43 LYS HB3 2 43 LYS QG . . 2.540 2.189 2.176 2.195 . 0 0 "[ . 1 . 2]" 1
2151 2 43 LYS HB3 2 44 ALA H . . 3.040 2.782 2.610 2.898 . 0 0 "[ . 1 . 2]" 1
2152 2 43 LYS QD 2 45 TRP HE3 . . 4.310 4.510 4.341 4.649 0.339 11 0 "[ . 1 . 2]" 1
2153 2 43 LYS QD 2 46 LYS H . . 5.190 4.663 4.142 5.231 0.041 9 0 "[ . 1 . 2]" 1
2154 2 43 LYS QE 2 43 LYS HG2 . . 3.880 2.729 2.345 3.155 . 0 0 "[ . 1 . 2]" 1
2155 2 43 LYS QE 2 43 LYS QG . . 3.210 2.622 2.301 2.958 . 0 0 "[ . 1 . 2]" 1
2156 2 43 LYS QE 2 43 LYS HG3 . . 3.880 3.466 3.346 3.584 . 0 0 "[ . 1 . 2]" 1
2157 2 43 LYS QG 2 44 ALA H . . 4.480 4.068 3.803 4.320 . 0 0 "[ . 1 . 2]" 1
2158 2 43 LYS QG 2 44 ALA HA . . 4.520 4.221 3.814 4.662 0.142 5 0 "[ . 1 . 2]" 1
2159 2 43 LYS HG2 2 44 ALA H . . 5.130 5.041 4.830 5.194 0.064 5 0 "[ . 1 . 2]" 1
2160 2 43 LYS HG3 2 44 ALA H . . 5.130 4.299 3.961 4.620 . 0 0 "[ . 1 . 2]" 1
2161 2 44 ALA H 2 44 ALA MB . . 2.700 2.235 2.222 2.255 . 0 0 "[ . 1 . 2]" 1
2162 2 44 ALA H 2 45 TRP H . . 3.040 2.709 2.536 2.791 . 0 0 "[ . 1 . 2]" 1
2163 2 44 ALA H 2 47 ALA MB . . 5.230 4.217 4.007 4.371 . 0 0 "[ . 1 . 2]" 1
2164 2 44 ALA H 2 62 ILE MD . . 5.210 5.143 4.885 5.355 0.145 16 0 "[ . 1 . 2]" 1
2165 2 44 ALA HA 2 47 ALA MB . . 2.780 2.040 1.862 2.210 . 0 0 "[ . 1 . 2]" 1
2166 2 44 ALA MB 2 45 TRP H . . 2.980 2.726 2.502 2.907 . 0 0 "[ . 1 . 2]" 1
2167 2 44 ALA MB 2 45 TRP HB3 . . 4.570 4.485 4.341 4.611 0.041 9 0 "[ . 1 . 2]" 1
2168 2 44 ALA MB 2 46 LYS H . . 4.850 4.837 4.702 4.919 0.069 2 0 "[ . 1 . 2]" 1
2169 2 44 ALA MB 2 47 ALA MB . . 3.440 3.406 3.155 3.516 0.076 5 0 "[ . 1 . 2]" 1
2170 2 45 TRP H 2 45 TRP HB2 . . 3.320 3.000 2.898 3.090 . 0 0 "[ . 1 . 2]" 1
2171 2 45 TRP H 2 45 TRP HB3 . . 3.600 2.131 2.094 2.170 . 0 0 "[ . 1 . 2]" 1
2172 2 45 TRP H 2 46 LYS HB3 . . 5.080 5.084 4.780 5.200 0.120 15 0 "[ . 1 . 2]" 1
2173 2 45 TRP H 2 62 ILE MD . . 4.180 3.837 3.524 4.175 . 0 0 "[ . 1 . 2]" 1
2174 2 45 TRP HA 2 45 TRP HD1 . . 3.930 3.515 3.426 3.658 . 0 0 "[ . 1 . 2]" 1
2175 2 45 TRP HA 2 47 ALA H . . 5.270 4.661 4.522 4.830 . 0 0 "[ . 1 . 2]" 1
2176 2 45 TRP HA 2 48 LYS H . . 4.110 4.058 3.868 4.138 0.028 11 0 "[ . 1 . 2]" 1
2177 2 45 TRP HA 2 48 LYS HB2 . . 4.670 3.399 3.192 3.501 . 0 0 "[ . 1 . 2]" 1
2178 2 45 TRP HA 2 48 LYS HB3 . . 4.940 4.987 4.785 5.074 0.134 17 0 "[ . 1 . 2]" 1
2179 2 45 TRP HA 2 48 LYS HG3 . . 5.500 4.421 4.169 4.881 . 0 0 "[ . 1 . 2]" 1
2180 2 45 TRP HA 2 49 ALA H . . 4.540 4.417 4.179 4.630 0.090 15 0 "[ . 1 . 2]" 1
2181 2 45 TRP HB2 2 62 ILE MD . . 3.770 2.689 2.237 2.871 . 0 0 "[ . 1 . 2]" 1
2182 2 45 TRP HB2 2 62 ILE HG12 . . 4.680 2.419 2.188 2.601 . 0 0 "[ . 1 . 2]" 1
2183 2 45 TRP HB2 2 62 ILE HG13 . . 5.260 2.564 2.343 3.019 . 0 0 "[ . 1 . 2]" 1
2184 2 45 TRP HB2 2 62 ILE MG . . 4.420 4.435 4.240 4.553 0.133 5 0 "[ . 1 . 2]" 1
2185 2 45 TRP HB3 2 46 LYS H . . 3.330 2.854 2.758 2.954 . 0 0 "[ . 1 . 2]" 1
2186 2 45 TRP HB3 2 62 ILE MD . . 4.360 2.508 2.195 2.708 . 0 0 "[ . 1 . 2]" 1
2187 2 45 TRP HD1 2 46 LYS H . . 5.370 4.966 4.831 5.095 . 0 0 "[ . 1 . 2]" 1
2188 2 45 TRP HD1 2 61 PHE HA . . 4.480 2.296 1.692 3.113 . 0 0 "[ . 1 . 2]" 1
2189 2 45 TRP HD1 2 62 ILE H . . 5.500 4.630 4.099 5.395 . 0 0 "[ . 1 . 2]" 1
2190 2 45 TRP HD1 2 62 ILE MD . . 4.410 4.404 3.928 4.530 0.120 5 0 "[ . 1 . 2]" 1
2191 2 45 TRP HD1 2 62 ILE HG13 . . 4.790 3.760 3.502 4.003 . 0 0 "[ . 1 . 2]" 1
2192 2 45 TRP HE1 2 49 ALA MB . . 4.110 4.117 3.841 4.314 0.204 15 0 "[ . 1 . 2]" 1
2193 2 45 TRP HE3 2 46 LYS H . . 3.070 2.530 2.385 2.810 . 0 0 "[ . 1 . 2]" 1
2194 2 45 TRP HE3 2 46 LYS HA . . 5.500 4.568 4.364 4.826 . 0 0 "[ . 1 . 2]" 1
2195 2 45 TRP HE3 2 46 LYS HB3 . . 3.540 3.247 2.940 3.503 . 0 0 "[ . 1 . 2]" 1
2196 2 45 TRP HE3 2 62 ILE MD . . 4.250 3.740 3.267 4.042 . 0 0 "[ . 1 . 2]" 1
2197 2 45 TRP HH2 2 46 LYS HB3 . . 4.480 4.779 4.636 4.927 0.447 4 0 "[ . 1 . 2]" 1
2198 2 45 TRP HH2 2 46 LYS QG . . 4.930 4.676 4.315 5.048 0.118 3 0 "[ . 1 . 2]" 1
2199 2 46 LYS H 2 46 LYS HB3 . . 2.740 2.344 2.151 2.524 . 0 0 "[ . 1 . 2]" 1
2200 2 46 LYS H 2 46 LYS QG . . 4.210 3.985 3.803 4.060 . 0 0 "[ . 1 . 2]" 1
2201 2 46 LYS H 2 47 ALA H . . 3.210 2.438 2.309 2.563 . 0 0 "[ . 1 . 2]" 1
2202 2 46 LYS H 2 47 ALA MB . . 4.600 4.113 4.009 4.183 . 0 0 "[ . 1 . 2]" 1
2203 2 46 LYS H 2 48 LYS H . . 4.690 4.022 3.918 4.191 . 0 0 "[ . 1 . 2]" 1
2204 2 46 LYS H 2 49 ALA H . . 5.420 4.606 4.492 4.766 . 0 0 "[ . 1 . 2]" 1
2205 2 46 LYS H 2 49 ALA MB . . 4.870 4.492 4.378 4.619 . 0 0 "[ . 1 . 2]" 1
2206 2 46 LYS H 2 62 ILE MD . . 5.280 4.983 4.652 5.221 . 0 0 "[ . 1 . 2]" 1
2207 2 46 LYS HA 2 46 LYS QG . . 3.950 2.641 2.463 2.863 . 0 0 "[ . 1 . 2]" 1
2208 2 46 LYS HA 2 48 LYS H . . 4.570 4.010 3.768 4.334 . 0 0 "[ . 1 . 2]" 1
2209 2 46 LYS HA 2 49 ALA H . . 3.810 3.043 2.712 3.466 . 0 0 "[ . 1 . 2]" 1
2210 2 46 LYS HA 2 49 ALA MB . . 3.290 2.197 1.974 2.580 . 0 0 "[ . 1 . 2]" 1
2211 2 46 LYS HA 2 50 GLN H . . 4.280 3.673 3.449 3.839 . 0 0 "[ . 1 . 2]" 1
2212 2 46 LYS HA 2 50 GLN HB2 . . 5.500 5.158 4.752 5.393 . 0 0 "[ . 1 . 2]" 1
2213 2 46 LYS HB3 2 47 ALA H . . 3.070 2.948 2.673 3.086 0.016 15 0 "[ . 1 . 2]" 1
2214 2 46 LYS HB3 2 47 ALA MB . . 4.420 4.362 4.149 4.484 0.064 2 0 "[ . 1 . 2]" 1
2215 2 46 LYS HB3 2 48 LYS H . . 5.010 5.164 5.097 5.232 0.222 16 0 "[ . 1 . 2]" 1
2216 2 46 LYS QG 2 47 ALA H . . 4.010 3.669 3.126 4.046 0.036 15 0 "[ . 1 . 2]" 1
2217 2 46 LYS QG 2 50 GLN H . . 4.240 3.888 3.534 4.256 0.016 3 0 "[ . 1 . 2]" 1
2218 2 46 LYS QG 2 50 GLN HB2 . . 3.980 3.880 3.588 4.078 0.098 7 0 "[ . 1 . 2]" 1
2219 2 46 LYS QG 2 50 GLN HE21 . . 4.810 2.937 2.565 3.438 . 0 0 "[ . 1 . 2]" 1
2220 2 46 LYS QG 2 50 GLN HE22 . . 4.990 2.955 2.521 3.570 . 0 0 "[ . 1 . 2]" 1
2221 2 46 LYS QG 2 50 GLN QG . . 4.310 2.476 2.170 2.917 . 0 0 "[ . 1 . 2]" 1
2222 2 47 ALA H 2 47 ALA MB . . 2.660 2.243 2.214 2.259 . 0 0 "[ . 1 . 2]" 1
2223 2 47 ALA H 2 48 LYS HG2 . . 5.500 4.732 4.474 5.023 . 0 0 "[ . 1 . 2]" 1
2224 2 47 ALA H 2 49 ALA H . . 4.400 4.138 4.006 4.316 . 0 0 "[ . 1 . 2]" 1
2225 2 47 ALA H 2 49 ALA MB . . 4.990 4.765 4.631 5.003 0.013 13 0 "[ . 1 . 2]" 1
2226 2 47 ALA H 2 50 GLN H . . 5.210 4.922 4.802 5.036 . 0 0 "[ . 1 . 2]" 1
2227 2 47 ALA H 2 50 GLN HE21 . . 4.810 4.787 4.474 4.945 0.135 13 0 "[ . 1 . 2]" 1
2228 2 47 ALA HA 2 49 ALA H . . 5.160 4.782 4.683 4.964 . 0 0 "[ . 1 . 2]" 1
2229 2 47 ALA HA 2 50 GLN H . . 4.400 4.130 3.866 4.444 0.044 13 0 "[ . 1 . 2]" 1
2230 2 47 ALA HA 2 50 GLN HB2 . . 4.770 3.479 3.225 3.793 . 0 0 "[ . 1 . 2]" 1
2231 2 47 ALA HA 2 50 GLN HB3 . . 5.500 5.117 4.850 5.430 . 0 0 "[ . 1 . 2]" 1
2232 2 47 ALA HA 2 50 GLN HE21 . . 5.370 2.815 2.253 3.349 . 0 0 "[ . 1 . 2]" 1
2233 2 47 ALA HA 2 50 GLN QG . . 5.410 4.537 4.174 4.995 . 0 0 "[ . 1 . 2]" 1
2234 2 47 ALA HA 2 51 ALA H . . 4.890 4.472 4.243 4.758 . 0 0 "[ . 1 . 2]" 1
2235 2 47 ALA MB 2 48 LYS H . . 3.120 2.695 2.484 2.859 . 0 0 "[ . 1 . 2]" 1
2236 2 47 ALA MB 2 48 LYS HG2 . . 3.730 3.314 3.055 3.641 . 0 0 "[ . 1 . 2]" 1
2237 2 47 ALA MB 2 49 ALA H . . 4.880 4.689 4.555 4.778 . 0 0 "[ . 1 . 2]" 1
2238 2 47 ALA MB 2 49 ALA MB . . 5.500 5.441 5.326 5.582 0.082 13 0 "[ . 1 . 2]" 1
2239 2 47 ALA MB 2 50 GLN HB2 . . 5.360 4.926 4.670 5.197 . 0 0 "[ . 1 . 2]" 1
2240 2 48 LYS H 2 48 LYS HB2 . . 3.010 2.306 2.216 2.369 . 0 0 "[ . 1 . 2]" 1
2241 2 48 LYS H 2 48 LYS HB3 . . 3.690 3.561 3.513 3.595 . 0 0 "[ . 1 . 2]" 1
2242 2 48 LYS H 2 48 LYS HD2 . . 5.260 4.073 3.895 4.380 . 0 0 "[ . 1 . 2]" 1
2243 2 48 LYS H 2 48 LYS HE2 . . 5.500 5.673 5.614 5.740 0.240 6 0 "[ . 1 . 2]" 1
2244 2 48 LYS H 2 48 LYS HE3 . . 5.500 5.080 4.943 5.206 . 0 0 "[ . 1 . 2]" 1
2245 2 48 LYS H 2 48 LYS HG2 . . 4.470 2.676 2.455 2.929 . 0 0 "[ . 1 . 2]" 1
2246 2 48 LYS H 2 48 LYS HG3 . . 4.510 3.860 3.722 4.044 . 0 0 "[ . 1 . 2]" 1
2247 2 48 LYS H 2 49 ALA H . . 2.900 2.462 2.356 2.567 . 0 0 "[ . 1 . 2]" 1
2248 2 48 LYS H 2 50 GLN H . . 4.310 4.103 3.959 4.277 . 0 0 "[ . 1 . 2]" 1
2249 2 48 LYS H 2 51 ALA H . . 4.550 4.602 4.487 4.653 0.103 6 0 "[ . 1 . 2]" 1
2250 2 48 LYS H 2 52 THR MG . . 5.500 5.537 5.371 5.625 0.125 9 0 "[ . 1 . 2]" 1
2251 2 48 LYS H 2 60 TYR HB2 . . 5.500 4.693 4.283 5.189 . 0 0 "[ . 1 . 2]" 1
2252 2 48 LYS HA 2 48 LYS HD2 . . 3.540 2.096 2.032 2.177 . 0 0 "[ . 1 . 2]" 1
2253 2 48 LYS HA 2 48 LYS HD3 . . 3.780 3.685 3.629 3.734 . 0 0 "[ . 1 . 2]" 1
2254 2 48 LYS HA 2 51 ALA H . . 3.740 3.418 3.271 3.592 . 0 0 "[ . 1 . 2]" 1
2255 2 48 LYS HA 2 51 ALA MB . . 3.600 2.416 2.291 2.524 . 0 0 "[ . 1 . 2]" 1
2256 2 48 LYS HA 2 52 THR H . . 4.650 4.197 3.689 4.676 0.026 15 0 "[ . 1 . 2]" 1
2257 2 48 LYS HA 2 52 THR MG . . 4.420 3.426 3.054 4.235 . 0 0 "[ . 1 . 2]" 1
2258 2 48 LYS HB2 2 49 ALA H . . 3.360 2.575 2.463 2.655 . 0 0 "[ . 1 . 2]" 1
2259 2 48 LYS HB2 2 52 THR MG . . 5.150 4.720 4.477 4.921 . 0 0 "[ . 1 . 2]" 1
2260 2 48 LYS HB2 2 60 TYR HB2 . . 5.500 2.738 2.398 3.276 . 0 0 "[ . 1 . 2]" 1
2261 2 48 LYS HB2 2 60 TYR QD . . 5.460 3.726 3.486 3.981 . 0 0 "[ . 1 . 2]" 1
2262 2 48 LYS HB3 2 48 LYS QE . . 4.430 2.084 2.032 2.142 . 0 0 "[ . 1 . 2]" 1
2263 2 48 LYS HB3 2 49 ALA H . . 4.190 3.426 3.261 3.561 . 0 0 "[ . 1 . 2]" 1
2264 2 48 LYS HB3 2 52 THR MG . . 4.960 3.431 3.128 3.876 . 0 0 "[ . 1 . 2]" 1
2265 2 48 LYS HB3 2 60 TYR QD . . 5.500 3.049 2.777 3.402 . 0 0 "[ . 1 . 2]" 1
2266 2 48 LYS HB3 2 60 TYR QE . . 5.130 3.848 3.402 4.108 . 0 0 "[ . 1 . 2]" 1
2267 2 48 LYS HD2 2 51 ALA MB . . 3.370 3.412 3.195 3.520 0.150 8 0 "[ . 1 . 2]" 1
2268 2 48 LYS HD2 2 60 TYR QE . . 5.500 5.515 5.284 5.652 0.152 13 0 "[ . 1 . 2]" 1
2269 2 48 LYS HD3 2 60 TYR QE . . 5.500 5.432 5.005 5.598 0.098 13 0 "[ . 1 . 2]" 1
2270 2 48 LYS QE 2 48 LYS HG3 . . 3.610 2.428 2.370 2.517 . 0 0 "[ . 1 . 2]" 1
2271 2 48 LYS QE 2 52 THR MG . . 3.760 2.719 2.183 3.721 . 0 0 "[ . 1 . 2]" 1
2272 2 48 LYS QE 2 60 TYR QD . . 3.380 3.211 2.883 3.461 0.081 7 0 "[ . 1 . 2]" 1
2273 2 48 LYS QE 2 60 TYR QE . . 3.830 2.968 2.739 3.105 . 0 0 "[ . 1 . 2]" 1
2274 2 48 LYS HE2 2 52 THR MG . . 4.620 4.032 3.464 4.817 0.197 10 0 "[ . 1 . 2]" 1
2275 2 48 LYS HE2 2 60 TYR QE . . 4.490 3.183 2.875 3.388 . 0 0 "[ . 1 . 2]" 1
2276 2 48 LYS HE3 2 52 THR MG . . 4.620 2.769 2.207 3.874 . 0 0 "[ . 1 . 2]" 1
2277 2 48 LYS HE3 2 60 TYR QE . . 4.490 3.573 3.378 3.738 . 0 0 "[ . 1 . 2]" 1
2278 2 48 LYS HG3 2 49 ALA H . . 5.330 4.936 4.841 5.002 . 0 0 "[ . 1 . 2]" 1
2279 2 48 LYS HG3 2 60 TYR QE . . 5.500 4.769 4.398 5.062 . 0 0 "[ . 1 . 2]" 1
2280 2 49 ALA H 2 49 ALA MB . . 2.700 2.232 2.209 2.247 . 0 0 "[ . 1 . 2]" 1
2281 2 49 ALA H 2 50 GLN H . . 3.010 2.786 2.732 2.881 . 0 0 "[ . 1 . 2]" 1
2282 2 49 ALA H 2 50 GLN HB2 . . 5.500 4.914 4.802 5.056 . 0 0 "[ . 1 . 2]" 1
2283 2 49 ALA H 2 50 GLN QG . . 5.500 4.599 4.386 4.825 . 0 0 "[ . 1 . 2]" 1
2284 2 49 ALA H 2 51 ALA H . . 4.030 4.017 3.940 4.083 0.053 15 0 "[ . 1 . 2]" 1
2285 2 49 ALA H 2 60 TYR QD . . 5.450 4.160 3.538 4.641 . 0 0 "[ . 1 . 2]" 1
2286 2 49 ALA HA 2 50 GLN H . . 3.530 3.536 3.500 3.564 0.034 13 0 "[ . 1 . 2]" 1
2287 2 49 ALA HA 2 52 THR H . . 5.130 3.890 3.505 4.433 . 0 0 "[ . 1 . 2]" 1
2288 2 49 ALA HA 2 52 THR MG . . 4.960 4.001 2.331 4.601 . 0 0 "[ . 1 . 2]" 1
2289 2 49 ALA HA 2 60 TYR QD . . 3.930 2.850 2.105 3.239 . 0 0 "[ . 1 . 2]" 1
2290 2 49 ALA HA 2 60 TYR QE . . 5.180 4.328 3.572 4.809 . 0 0 "[ . 1 . 2]" 1
2291 2 49 ALA MB 2 50 GLN H . . 3.190 2.588 2.306 2.765 . 0 0 "[ . 1 . 2]" 1
2292 2 49 ALA MB 2 50 GLN HA . . 4.600 3.993 3.894 4.080 . 0 0 "[ . 1 . 2]" 1
2293 2 49 ALA MB 2 50 GLN HB2 . . 4.880 4.491 4.367 4.590 . 0 0 "[ . 1 . 2]" 1
2294 2 49 ALA MB 2 50 GLN QG . . 4.080 3.155 2.985 3.410 . 0 0 "[ . 1 . 2]" 1
2295 2 49 ALA MB 2 51 ALA H . . 4.400 4.458 4.278 4.562 0.162 11 0 "[ . 1 . 2]" 1
2296 2 49 ALA MB 2 52 THR H . . 5.500 4.905 4.582 5.390 . 0 0 "[ . 1 . 2]" 1
2297 2 49 ALA MB 2 60 TYR H . . 4.480 3.402 2.258 4.048 . 0 0 "[ . 1 . 2]" 1
2298 2 49 ALA MB 2 60 TYR HB2 . . 4.670 3.308 2.661 3.699 . 0 0 "[ . 1 . 2]" 1
2299 2 49 ALA MB 2 60 TYR HB3 . . 5.160 4.773 4.167 5.237 0.077 15 0 "[ . 1 . 2]" 1
2300 2 49 ALA MB 2 60 TYR QD . . 4.120 3.743 3.047 4.127 0.007 14 0 "[ . 1 . 2]" 1
2301 2 50 GLN H 2 50 GLN HB2 . . 2.850 2.422 2.370 2.490 . 0 0 "[ . 1 . 2]" 1
2302 2 50 GLN H 2 50 GLN HB3 . . 3.730 3.612 3.578 3.636 . 0 0 "[ . 1 . 2]" 1
2303 2 50 GLN H 2 50 GLN HE21 . . 4.080 3.694 3.496 3.868 . 0 0 "[ . 1 . 2]" 1
2304 2 50 GLN H 2 50 GLN HE22 . . 5.500 5.240 5.033 5.400 . 0 0 "[ . 1 . 2]" 1
2305 2 50 GLN H 2 50 GLN QG . . 3.360 2.468 2.237 2.671 . 0 0 "[ . 1 . 2]" 1
2306 2 50 GLN H 2 51 ALA H . . 3.090 2.475 2.284 2.698 . 0 0 "[ . 1 . 2]" 1
2307 2 50 GLN HA 2 50 GLN QG . . 3.800 2.476 2.423 2.526 . 0 0 "[ . 1 . 2]" 1
2308 2 50 GLN HA 2 51 ALA H . . 3.560 3.520 3.465 3.567 0.007 1 0 "[ . 1 . 2]" 1
2309 2 50 GLN HA 2 52 THR H . . 5.230 4.298 3.766 4.907 . 0 0 "[ . 1 . 2]" 1
2310 2 50 GLN HB2 2 50 GLN HE21 . . 4.560 1.881 1.803 1.946 . 0 0 "[ . 1 . 2]" 1
2311 2 50 GLN HB2 2 51 ALA H . . 3.400 2.877 2.498 3.174 . 0 0 "[ . 1 . 2]" 1
2312 2 50 GLN HB2 2 52 THR H . . 5.500 5.164 4.965 5.627 0.127 2 0 "[ . 1 . 2]" 1
2313 2 50 GLN HB3 2 50 GLN HE21 . . 4.710 2.922 2.838 3.015 . 0 0 "[ . 1 . 2]" 1
2314 2 50 GLN QG 2 51 ALA H . . 4.340 4.249 4.125 4.354 0.014 19 0 "[ . 1 . 2]" 1
2315 2 51 ALA H 2 51 ALA MB . . 2.730 2.272 2.246 2.313 . 0 0 "[ . 1 . 2]" 1
2316 2 51 ALA H 2 52 THR H . . 3.150 2.559 2.344 2.756 . 0 0 "[ . 1 . 2]" 1
2317 2 51 ALA H 2 52 THR MG . . 5.170 3.978 3.696 4.231 . 0 0 "[ . 1 . 2]" 1
2318 2 51 ALA MB 2 52 THR H . . 3.420 2.800 2.209 3.314 . 0 0 "[ . 1 . 2]" 1
2319 2 51 ALA MB 2 52 THR MG . . 3.690 2.824 2.513 3.795 0.105 10 0 "[ . 1 . 2]" 1
2320 2 51 ALA MB 2 53 VAL QG . . 4.910 4.518 4.000 4.878 . 0 0 "[ . 1 . 2]" 1
2321 2 52 THR H 2 52 THR MG . . 3.520 2.508 2.003 2.906 . 0 0 "[ . 1 . 2]" 1
2322 2 52 THR H 2 53 VAL HA . . 5.500 4.969 4.395 5.525 0.025 10 0 "[ . 1 . 2]" 1
2323 2 52 THR H 2 53 VAL QG . . 4.410 3.773 3.161 4.341 . 0 0 "[ . 1 . 2]" 1
2324 2 52 THR HA 2 53 VAL H . . 2.810 2.595 2.132 3.014 0.204 9 0 "[ . 1 . 2]" 1
2325 2 52 THR MG 2 53 VAL H . . 4.430 4.352 4.248 4.422 . 0 0 "[ . 1 . 2]" 1
2326 2 52 THR MG 2 54 ASP H . . 5.340 5.089 4.717 5.416 0.076 20 0 "[ . 1 . 2]" 1
2327 2 52 THR MG 2 60 TYR QE . . 3.910 2.186 1.541 2.706 . 0 0 "[ . 1 . 2]" 1
2328 2 53 VAL H 2 53 VAL HB . . 3.660 2.975 2.477 3.722 0.062 14 0 "[ . 1 . 2]" 1
2329 2 53 VAL H 2 53 VAL QG . . 2.970 2.112 1.832 2.475 . 0 0 "[ . 1 . 2]" 1
2330 2 53 VAL H 2 54 ASP H . . 3.220 2.354 1.738 2.665 . 0 0 "[ . 1 . 2]" 1
2331 2 53 VAL H 2 55 ASN QB . . 5.340 4.982 4.108 5.446 0.106 2 0 "[ . 1 . 2]" 1
2332 2 53 VAL HA 2 53 VAL QG . . 3.100 2.238 2.192 2.325 . 0 0 "[ . 1 . 2]" 1
2333 2 53 VAL HA 2 54 ASP QB . . 5.340 5.292 4.996 5.546 0.206 20 0 "[ . 1 . 2]" 1
2334 2 53 VAL HA 2 55 ASN H . . 4.720 4.113 3.661 4.717 . 0 0 "[ . 1 . 2]" 1
2335 2 53 VAL HB 2 54 ASP H . . 3.820 3.237 2.529 3.975 0.155 18 0 "[ . 1 . 2]" 1
2336 2 53 VAL HB 2 55 ASN H . . 5.500 5.277 4.645 5.704 0.204 14 0 "[ . 1 . 2]" 1
2337 2 53 VAL QG 2 54 ASP H . . 3.940 3.028 2.206 3.593 . 0 0 "[ . 1 . 2]" 1
2338 2 53 VAL QG 2 54 ASP QB . . 4.830 4.170 3.066 4.883 0.053 10 0 "[ . 1 . 2]" 1
2339 2 53 VAL QG 2 55 ASN H . . 5.100 4.512 4.191 4.934 . 0 0 "[ . 1 . 2]" 1
2340 2 53 VAL MG1 2 54 ASP H . . 4.760 3.886 3.495 4.160 . 0 0 "[ . 1 . 2]" 1
2341 2 53 VAL MG2 2 54 ASP H . . 4.760 3.326 2.216 4.051 . 0 0 "[ . 1 . 2]" 1
2342 2 54 ASP H 2 54 ASP QB . . 3.000 2.348 2.194 2.557 . 0 0 "[ . 1 . 2]" 1
2343 2 54 ASP H 2 55 ASN QB . . 5.180 4.451 3.737 4.758 . 0 0 "[ . 1 . 2]" 1
2344 2 54 ASP QB 2 55 ASN H . . 3.240 2.759 2.338 3.399 0.159 8 0 "[ . 1 . 2]" 1
2345 2 55 ASN H 2 55 ASN HA . . 2.840 2.862 2.750 2.911 0.071 14 0 "[ . 1 . 2]" 1
2346 2 55 ASN H 2 55 ASN QB . . 3.270 2.292 2.081 2.422 . 0 0 "[ . 1 . 2]" 1
2347 2 55 ASN H 2 55 ASN HD21 . . 5.270 4.663 4.252 4.962 . 0 0 "[ . 1 . 2]" 1
2348 2 55 ASN H 2 55 ASN HD22 . . 5.500 5.240 4.613 5.801 0.301 14 0 "[ . 1 . 2]" 1
2349 2 55 ASN HA 2 55 ASN HD21 . . 3.860 3.265 2.295 4.123 0.263 15 0 "[ . 1 . 2]" 1
2350 2 55 ASN HA 2 55 ASN HD22 . . 4.170 3.979 3.513 4.374 0.204 18 0 "[ . 1 . 2]" 1
2351 2 55 ASN HA 2 56 ALA H . . 2.720 2.281 2.111 2.485 . 0 0 "[ . 1 . 2]" 1
2352 2 55 ASN HA 2 56 ALA MB . . 4.170 3.982 3.746 4.188 0.018 13 0 "[ . 1 . 2]" 1
2353 2 55 ASN QB 2 55 ASN HD21 . . 3.080 2.269 2.107 2.863 . 0 0 "[ . 1 . 2]" 1
2354 2 55 ASN QB 2 55 ASN HD22 . . 3.550 3.296 3.192 3.503 . 0 0 "[ . 1 . 2]" 1
2355 2 55 ASN QB 2 56 ALA H . . 3.990 3.101 2.141 4.035 0.045 8 0 "[ . 1 . 2]" 1
2356 2 55 ASN QB 2 58 ALA H . . 5.030 3.072 2.267 4.391 . 0 0 "[ . 1 . 2]" 1
2357 2 55 ASN QB 2 58 ALA MB . . 3.850 2.110 1.689 3.838 . 0 0 "[ . 1 . 2]" 1
2358 2 55 ASN HB2 2 56 ALA H . . 4.570 4.100 3.452 4.642 0.072 8 0 "[ . 1 . 2]" 1
2359 2 55 ASN HB2 2 58 ALA MB . . 4.570 2.960 2.038 4.256 . 0 0 "[ . 1 . 2]" 1
2360 2 55 ASN HB3 2 56 ALA H . . 4.570 3.257 2.159 4.434 . 0 0 "[ . 1 . 2]" 1
2361 2 55 ASN HB3 2 58 ALA MB . . 4.570 2.246 1.700 4.366 . 0 0 "[ . 1 . 2]" 1
2362 2 55 ASN HD21 2 58 ALA H . . 4.910 3.871 2.783 5.064 0.154 15 0 "[ . 1 . 2]" 1
2363 2 55 ASN HD21 2 58 ALA MB . . 4.470 2.245 1.494 3.151 . 0 0 "[ . 1 . 2]" 1
2364 2 55 ASN HD22 2 58 ALA H . . 5.500 5.120 3.233 5.744 0.244 5 0 "[ . 1 . 2]" 1
2365 2 55 ASN HD22 2 58 ALA MB . . 4.650 2.988 1.565 3.549 . 0 0 "[ . 1 . 2]" 1
2366 2 56 ALA H 2 56 ALA MB . . 2.890 2.287 2.208 2.795 . 0 0 "[ . 1 . 2]" 1
2367 2 56 ALA H 2 58 ALA H . . 5.120 3.899 3.427 4.872 . 0 0 "[ . 1 . 2]" 1
2368 2 56 ALA MB 2 57 HIS H . . 4.050 2.298 1.912 3.548 . 0 0 "[ . 1 . 2]" 1
2369 2 56 ALA MB 2 57 HIS HD2 . . 5.210 3.711 1.908 5.456 0.246 3 0 "[ . 1 . 2]" 1
2370 2 56 ALA MB 2 58 ALA H . . 4.580 4.149 3.735 4.591 0.011 19 0 "[ . 1 . 2]" 1
2371 2 57 HIS H 2 57 HIS HD2 . . 5.280 3.997 2.482 5.300 0.020 7 0 "[ . 1 . 2]" 1
2372 2 57 HIS H 2 58 ALA H . . 3.180 2.471 2.154 2.984 . 0 0 "[ . 1 . 2]" 1
2373 2 57 HIS H 2 58 ALA MB . . 4.620 3.883 3.461 4.473 . 0 0 "[ . 1 . 2]" 1
2374 2 57 HIS HA 2 57 HIS HD2 . . 3.600 2.966 2.196 3.668 0.068 11 0 "[ . 1 . 2]" 1
2375 2 57 HIS HA 2 58 ALA H . . 3.000 3.075 2.893 3.212 0.212 17 0 "[ . 1 . 2]" 1
2376 2 57 HIS HB2 2 58 ALA H . . 4.530 4.001 3.636 4.496 . 0 0 "[ . 1 . 2]" 1
2377 2 57 HIS HB3 2 58 ALA H . . 4.530 4.405 4.083 4.538 0.008 8 0 "[ . 1 . 2]" 1
2378 2 58 ALA H 2 58 ALA MB . . 2.730 2.309 2.256 2.365 . 0 0 "[ . 1 . 2]" 1
2379 2 58 ALA H 2 59 ARG H . . 4.640 4.277 4.103 4.579 . 0 0 "[ . 1 . 2]" 1
2380 2 58 ALA H 2 59 ARG QB . . 5.500 5.532 5.133 5.783 0.283 17 0 "[ . 1 . 2]" 1
2381 2 58 ALA H 2 60 TYR QE . . 5.500 5.195 4.950 5.486 . 0 0 "[ . 1 . 2]" 1
2382 2 58 ALA HA 2 59 ARG H . . 2.740 2.151 2.110 2.198 . 0 0 "[ . 1 . 2]" 1
2383 2 58 ALA MB 2 59 ARG H . . 3.430 3.382 2.751 3.548 0.118 16 0 "[ . 1 . 2]" 1
2384 2 58 ALA MB 2 60 TYR H . . 5.500 4.845 4.208 5.477 . 0 0 "[ . 1 . 2]" 1
2385 2 58 ALA MB 2 60 TYR QD . . 4.680 3.685 3.195 4.251 . 0 0 "[ . 1 . 2]" 1
2386 2 58 ALA MB 2 60 TYR QE . . 3.560 2.264 1.596 3.165 . 0 0 "[ . 1 . 2]" 1
2387 2 59 ARG H 2 59 ARG QB . . 3.180 2.485 2.304 2.731 . 0 0 "[ . 1 . 2]" 1
2388 2 59 ARG H 2 59 ARG QD . . 4.350 3.548 2.768 4.502 0.152 8 0 "[ . 1 . 2]" 1
2389 2 59 ARG H 2 59 ARG QG . . 4.590 3.784 2.746 4.290 . 0 0 "[ . 1 . 2]" 1
2390 2 59 ARG H 2 60 TYR H . . 4.380 4.182 3.849 4.432 0.052 6 0 "[ . 1 . 2]" 1
2391 2 59 ARG H 2 60 TYR HA . . 5.330 4.790 4.508 5.067 . 0 0 "[ . 1 . 2]" 1
2392 2 59 ARG HA 2 59 ARG HD2 . . 3.800 2.545 1.977 3.130 . 0 0 "[ . 1 . 2]" 1
2393 2 59 ARG HA 2 59 ARG HD3 . . 3.800 3.178 2.030 3.913 0.113 14 0 "[ . 1 . 2]" 1
2394 2 59 ARG HA 2 59 ARG QG . . 3.940 2.736 2.411 3.131 . 0 0 "[ . 1 . 2]" 1
2395 2 59 ARG HA 2 60 TYR H . . 2.810 2.144 2.065 2.204 . 0 0 "[ . 1 . 2]" 1
2396 2 59 ARG HA 2 60 TYR QD . . 4.310 3.387 2.927 4.125 . 0 0 "[ . 1 . 2]" 1
2397 2 59 ARG QB 2 59 ARG HD2 . . 3.370 2.848 2.468 3.047 . 0 0 "[ . 1 . 2]" 1
2398 2 59 ARG QB 2 59 ARG HD3 . . 3.370 2.662 2.405 3.098 . 0 0 "[ . 1 . 2]" 1
2399 2 59 ARG QB 2 59 ARG QG . . 2.400 2.011 1.997 2.023 . 0 0 "[ . 1 . 2]" 1
2400 2 59 ARG QB 2 60 TYR H . . 3.760 3.544 3.007 3.852 0.092 7 0 "[ . 1 . 2]" 1
2401 2 59 ARG QD 2 60 TYR H . . 4.410 3.839 2.107 4.619 0.209 13 0 "[ . 1 . 2]" 1
2402 2 59 ARG QG 2 60 TYR H . . 5.050 3.970 2.848 4.895 . 0 0 "[ . 1 . 2]" 1
2403 2 60 TYR H 2 60 TYR HB2 . . 3.310 2.492 2.362 2.585 . 0 0 "[ . 1 . 2]" 1
2404 2 60 TYR H 2 60 TYR QD . . 3.300 2.422 2.158 2.689 . 0 0 "[ . 1 . 2]" 1
2405 2 60 TYR H 2 60 TYR QE . . 4.650 4.465 4.243 4.683 0.033 4 0 "[ . 1 . 2]" 1
2406 2 60 TYR H 2 61 PHE H . . 4.770 4.374 3.938 4.547 . 0 0 "[ . 1 . 2]" 1
2407 2 60 TYR HA 2 60 TYR QD . . 4.000 2.998 2.650 3.162 . 0 0 "[ . 1 . 2]" 1
2408 2 60 TYR HA 2 61 PHE H . . 2.940 2.111 2.060 2.175 . 0 0 "[ . 1 . 2]" 1
2409 2 60 TYR HB2 2 61 PHE H . . 4.860 4.222 4.010 4.466 . 0 0 "[ . 1 . 2]" 1
2410 2 60 TYR HB3 2 61 PHE H . . 4.320 3.336 2.922 3.914 . 0 0 "[ . 1 . 2]" 1
2411 2 60 TYR QD 2 61 PHE H . . 5.070 4.270 3.981 4.648 . 0 0 "[ . 1 . 2]" 1
2412 2 61 PHE H 2 61 PHE HB2 . . 4.050 2.634 2.456 2.780 . 0 0 "[ . 1 . 2]" 1
2413 2 61 PHE H 2 61 PHE QB . . 3.240 2.585 2.419 2.719 . 0 0 "[ . 1 . 2]" 1
2414 2 61 PHE H 2 61 PHE HB3 . . 4.050 3.756 3.578 3.848 . 0 0 "[ . 1 . 2]" 1
2415 2 61 PHE H 2 61 PHE QD . . 3.640 3.142 2.311 3.644 0.004 17 0 "[ . 1 . 2]" 1
2416 2 61 PHE H 2 62 ILE H . . 5.230 4.294 4.129 4.554 . 0 0 "[ . 1 . 2]" 1
2417 2 61 PHE HA 2 62 ILE H . . 3.030 2.771 2.468 3.028 . 0 0 "[ . 1 . 2]" 1
2418 2 61 PHE HA 2 62 ILE HB . . 5.370 5.077 4.939 5.210 . 0 0 "[ . 1 . 2]" 1
2419 2 61 PHE HA 2 62 ILE HG13 . . 5.450 3.247 2.900 3.520 . 0 0 "[ . 1 . 2]" 1
2420 2 61 PHE QB 2 62 ILE H . . 3.180 1.890 1.682 2.336 . 0 0 "[ . 1 . 2]" 1
2421 2 61 PHE HB2 2 62 ILE H . . 3.800 2.967 2.684 3.368 . 0 0 "[ . 1 . 2]" 1
2422 2 61 PHE HB3 2 62 ILE H . . 3.800 1.913 1.698 2.383 . 0 0 "[ . 1 . 2]" 1
2423 2 61 PHE QD 2 62 ILE H . . 4.320 3.760 3.527 3.979 . 0 0 "[ . 1 . 2]" 1
2424 2 62 ILE H 2 62 ILE HB . . 3.270 2.914 2.789 3.071 . 0 0 "[ . 1 . 2]" 1
2425 2 62 ILE H 2 62 ILE MD . . 4.070 4.030 3.855 4.216 0.146 4 0 "[ . 1 . 2]" 1
2426 2 62 ILE H 2 62 ILE HG12 . . 3.920 3.778 3.608 3.955 0.035 9 0 "[ . 1 . 2]" 1
2427 2 62 ILE H 2 62 ILE HG13 . . 3.700 2.646 2.448 2.887 . 0 0 "[ . 1 . 2]" 1
2428 2 62 ILE H 2 62 ILE MG . . 4.040 3.979 3.927 4.037 . 0 0 "[ . 1 . 2]" 1
2429 2 62 ILE H 2 63 ILE H . . 4.620 4.428 4.371 4.471 . 0 0 "[ . 1 . 2]" 1
2430 2 62 ILE HA 2 62 ILE MD . . 4.440 4.022 3.934 4.086 . 0 0 "[ . 1 . 2]" 1
2431 2 62 ILE HA 2 62 ILE HG12 . . 4.190 2.871 2.729 2.980 . 0 0 "[ . 1 . 2]" 1
2432 2 62 ILE HA 2 62 ILE HG13 . . 4.120 3.333 3.236 3.411 . 0 0 "[ . 1 . 2]" 1
2433 2 62 ILE HA 2 62 ILE MG . . 3.310 2.321 2.261 2.381 . 0 0 "[ . 1 . 2]" 1
2434 2 62 ILE HA 2 63 ILE H . . 2.910 2.377 2.275 2.522 . 0 0 "[ . 1 . 2]" 1
2435 2 62 ILE HA 2 63 ILE HB . . 5.240 4.655 3.885 5.289 0.049 16 0 "[ . 1 . 2]" 1
2436 2 62 ILE HA 2 63 ILE QG . . 5.040 4.175 3.583 5.412 0.372 19 0 "[ . 1 . 2]" 1
2437 2 62 ILE HB 2 62 ILE MD . . 3.190 2.446 2.401 2.515 . 0 0 "[ . 1 . 2]" 1
2438 2 62 ILE HB 2 63 ILE H . . 5.500 3.636 3.291 3.816 . 0 0 "[ . 1 . 2]" 1
2439 2 62 ILE MD 2 62 ILE MG . . 2.750 2.012 1.976 2.065 . 0 0 "[ . 1 . 2]" 1
2440 2 62 ILE MD 2 63 ILE H . . 5.140 4.968 4.713 5.191 0.051 10 0 "[ . 1 . 2]" 1
2441 2 62 ILE HG12 2 62 ILE MG . . 3.130 2.418 2.382 2.471 . 0 0 "[ . 1 . 2]" 1
2442 2 62 ILE HG12 2 63 ILE H . . 5.190 4.738 4.537 4.958 . 0 0 "[ . 1 . 2]" 1
2443 2 62 ILE HG13 2 62 ILE MG . . 3.670 3.238 3.227 3.248 . 0 0 "[ . 1 . 2]" 1
2444 2 62 ILE MG 2 63 ILE H . . 3.160 2.162 1.808 2.459 . 0 0 "[ . 1 . 2]" 1
2445 2 62 ILE MG 2 63 ILE HA . . 4.000 3.779 3.516 4.020 0.020 13 0 "[ . 1 . 2]" 1
2446 2 63 ILE H 2 63 ILE HB . . 3.210 2.877 2.499 3.143 . 0 0 "[ . 1 . 2]" 1
2447 2 63 ILE H 2 63 ILE MD . . 5.350 4.494 4.168 4.915 . 0 0 "[ . 1 . 2]" 1
2448 2 63 ILE H 2 63 ILE QG . . 4.660 3.313 2.704 4.225 . 0 0 "[ . 1 . 2]" 1
2449 2 63 ILE H 2 64 HIS H . . 4.510 4.343 4.274 4.433 . 0 0 "[ . 1 . 2]" 1
2450 2 63 ILE HA 2 63 ILE MD . . 3.960 3.871 3.750 4.052 0.092 14 0 "[ . 1 . 2]" 1
2451 2 63 ILE HA 2 63 ILE HG12 . . 4.040 2.603 2.300 2.978 . 0 0 "[ . 1 . 2]" 1
2452 2 63 ILE HA 2 63 ILE HG13 . . 4.040 3.024 2.354 3.420 . 0 0 "[ . 1 . 2]" 1
2453 2 63 ILE HA 2 64 HIS H . . 3.070 2.240 2.106 2.527 . 0 0 "[ . 1 . 2]" 1
2454 2 63 ILE HA 2 64 HIS QB . . 4.720 4.434 4.263 4.594 . 0 0 "[ . 1 . 2]" 1
2455 2 63 ILE HA 2 64 HIS HD2 . . 5.500 4.024 3.233 5.522 0.022 13 0 "[ . 1 . 2]" 1
2456 2 63 ILE HB 2 63 ILE MD . . 2.980 2.497 2.408 2.582 . 0 0 "[ . 1 . 2]" 1
2457 2 63 ILE MD 2 64 HIS H . . 4.720 4.699 3.608 4.910 0.190 7 0 "[ . 1 . 2]" 1
2458 2 64 HIS H 2 64 HIS HB2 . . 3.870 3.515 2.401 3.687 . 0 0 "[ . 1 . 2]" 1
2459 2 64 HIS H 2 64 HIS QB . . 3.380 2.615 2.369 2.934 . 0 0 "[ . 1 . 2]" 1
2460 2 64 HIS H 2 64 HIS HB3 . . 3.870 2.805 2.560 3.633 . 0 0 "[ . 1 . 2]" 1
2461 2 64 HIS H 2 64 HIS HD2 . . 5.480 2.579 1.828 4.004 . 0 0 "[ . 1 . 2]" 1
2462 2 64 HIS H 2 65 ALA H . . 5.420 4.441 4.049 4.625 . 0 0 "[ . 1 . 2]" 1
2463 2 64 HIS HA 2 64 HIS HD2 . . 5.060 4.412 2.609 4.841 . 0 0 "[ . 1 . 2]" 1
2464 2 64 HIS HA 2 65 ALA H . . 2.850 2.189 2.124 2.273 . 0 0 "[ . 1 . 2]" 1
2465 2 64 HIS QB 2 65 ALA H . . 3.900 3.332 2.899 3.832 . 0 0 "[ . 1 . 2]" 1
2466 2 64 HIS HB2 2 65 ALA H . . 4.650 3.564 2.972 4.478 . 0 0 "[ . 1 . 2]" 1
2467 2 64 HIS HB3 2 65 ALA H . . 4.650 4.224 3.259 4.548 . 0 0 "[ . 1 . 2]" 1
2468 2 65 ALA H 2 65 ALA MB . . 3.050 2.391 2.273 2.646 . 0 0 "[ . 1 . 2]" 1
2469 2 65 ALA MB 2 67 LYS H . . 5.100 5.027 4.431 5.271 0.171 9 0 "[ . 1 . 2]" 1
2470 2 66 HIS H 2 67 LYS H . . 4.240 2.460 1.865 4.336 0.096 14 0 "[ . 1 . 2]" 1
2471 2 66 HIS H 2 67 LYS QB . . 5.340 4.456 3.780 5.582 0.242 5 0 "[ . 1 . 2]" 1
2472 2 66 HIS HA 2 66 HIS HE1 . . 5.080 5.005 4.724 5.204 0.124 9 0 "[ . 1 . 2]" 1
2473 2 66 HIS QB 2 66 HIS HE1 . . 4.670 4.485 4.401 4.644 . 0 0 "[ . 1 . 2]" 1
2474 2 66 HIS QB 2 67 LYS QB . . 5.180 3.727 3.464 4.215 . 0 0 "[ . 1 . 2]" 1
2475 2 66 HIS HB2 2 67 LYS H . . 4.050 3.773 3.468 4.298 0.248 14 0 "[ . 1 . 2]" 1
2476 2 66 HIS HB3 2 67 LYS H . . 4.050 2.582 1.971 4.155 0.105 14 0 "[ . 1 . 2]" 1
2477 2 67 LYS H 2 67 LYS HB2 . . 3.900 2.974 2.683 3.284 . 0 0 "[ . 1 . 2]" 1
2478 2 67 LYS H 2 67 LYS QB . . 3.420 2.485 2.317 3.072 . 0 0 "[ . 1 . 2]" 1
2479 2 67 LYS H 2 67 LYS HB3 . . 3.900 2.678 2.483 3.710 . 0 0 "[ . 1 . 2]" 1
2480 2 67 LYS H 2 67 LYS QG . . 4.530 4.103 4.015 4.274 . 0 0 "[ . 1 . 2]" 1
2481 2 67 LYS H 2 68 LEU H . . 4.410 4.044 3.426 4.275 . 0 0 "[ . 1 . 2]" 1
2482 2 67 LYS HA 2 67 LYS QD . . 4.320 3.638 1.879 4.201 . 0 0 "[ . 1 . 2]" 1
2483 2 67 LYS HA 2 67 LYS QG . . 3.390 2.587 2.408 3.098 . 0 0 "[ . 1 . 2]" 1
2484 2 67 LYS HA 2 68 LEU H . . 2.710 2.158 2.108 2.232 . 0 0 "[ . 1 . 2]" 1
2485 2 67 LYS HB2 2 68 LEU H . . 4.580 4.458 4.202 4.559 . 0 0 "[ . 1 . 2]" 1
2486 2 67 LYS HB3 2 68 LEU H . . 4.580 4.395 4.110 4.503 . 0 0 "[ . 1 . 2]" 1
2487 2 67 LYS QD 2 68 LEU H . . 5.500 4.755 2.654 5.553 0.053 5 0 "[ . 1 . 2]" 1
2488 2 67 LYS QD 2 69 LEU QD . . 4.790 4.155 2.452 4.781 . 0 0 "[ . 1 . 2]" 1
2489 2 67 LYS QE 2 67 LYS QG . . 3.190 2.265 2.152 2.401 . 0 0 "[ . 1 . 2]" 1
2490 2 67 LYS QE 2 68 LEU H . . 5.500 5.137 3.766 5.777 0.277 12 0 "[ . 1 . 2]" 1
2491 2 67 LYS QE 2 69 LEU QD . . 3.710 3.259 2.289 3.789 0.079 3 0 "[ . 1 . 2]" 1
2492 2 67 LYS QG 2 68 LEU H . . 4.050 3.423 2.600 4.140 0.090 6 0 "[ . 1 . 2]" 1
2493 2 67 LYS QG 2 69 LEU QD . . 4.140 3.410 2.387 4.209 0.069 16 0 "[ . 1 . 2]" 1
2494 2 68 LEU H 2 68 LEU HB2 . . 3.870 2.395 2.228 2.637 . 0 0 "[ . 1 . 2]" 1
2495 2 68 LEU H 2 68 LEU QB . . 3.080 2.361 2.204 2.587 . 0 0 "[ . 1 . 2]" 1
2496 2 68 LEU H 2 68 LEU HB3 . . 3.870 3.595 3.503 3.743 . 0 0 "[ . 1 . 2]" 1
2497 2 68 LEU H 2 68 LEU MD1 . . 4.430 3.759 3.330 4.070 . 0 0 "[ . 1 . 2]" 1
2498 2 68 LEU H 2 68 LEU QD . . 3.750 2.652 1.828 3.420 . 0 0 "[ . 1 . 2]" 1
2499 2 68 LEU H 2 68 LEU MD2 . . 4.430 2.825 1.836 4.130 . 0 0 "[ . 1 . 2]" 1
2500 2 68 LEU H 2 68 LEU HG . . 3.630 3.345 2.348 3.964 0.334 12 0 "[ . 1 . 2]" 1
2501 2 68 LEU H 2 69 LEU H . . 4.900 4.515 4.327 4.594 . 0 0 "[ . 1 . 2]" 1
2502 2 68 LEU HA 2 68 LEU MD1 . . 3.900 2.993 2.132 3.960 0.060 11 0 "[ . 1 . 2]" 1
2503 2 68 LEU HA 2 68 LEU QD . . 2.970 2.134 2.046 2.278 . 0 0 "[ . 1 . 2]" 1
2504 2 68 LEU HA 2 68 LEU MD2 . . 3.900 2.542 2.053 3.233 . 0 0 "[ . 1 . 2]" 1
2505 2 68 LEU HA 2 68 LEU HG . . 3.800 3.491 2.816 3.848 0.048 16 0 "[ . 1 . 2]" 1
2506 2 68 LEU HA 2 69 LEU H . . 3.010 2.258 2.133 2.631 . 0 0 "[ . 1 . 2]" 1
2507 2 68 LEU QB 2 68 LEU QD . . 2.540 2.056 1.959 2.113 . 0 0 "[ . 1 . 2]" 1
2508 2 68 LEU QB 2 69 LEU H . . 3.940 2.881 2.062 3.356 . 0 0 "[ . 1 . 2]" 1
2509 2 68 LEU QD 2 69 LEU H . . 4.730 3.449 3.236 3.744 . 0 0 "[ . 1 . 2]" 1
2510 2 68 LEU HG 2 69 LEU H . . 5.500 5.080 4.768 5.481 . 0 0 "[ . 1 . 2]" 1
2511 2 69 LEU H 2 69 LEU HB2 . . 3.640 2.508 2.335 2.606 . 0 0 "[ . 1 . 2]" 1
2512 2 69 LEU H 2 69 LEU HB3 . . 3.900 3.635 3.578 3.743 . 0 0 "[ . 1 . 2]" 1
2513 2 69 LEU H 2 69 LEU MD1 . . 4.380 3.611 2.181 4.002 . 0 0 "[ . 1 . 2]" 1
2514 2 69 LEU H 2 69 LEU QD . . 3.790 3.046 2.172 3.452 . 0 0 "[ . 1 . 2]" 1
2515 2 69 LEU H 2 69 LEU MD2 . . 4.380 3.432 3.161 4.036 . 0 0 "[ . 1 . 2]" 1
2516 2 69 LEU H 2 69 LEU HG . . 4.510 2.596 2.168 3.900 . 0 0 "[ . 1 . 2]" 1
2517 2 69 LEU H 2 70 ASP H . . 4.470 3.988 3.533 4.515 0.045 17 0 "[ . 1 . 2]" 1
2518 2 69 LEU HA 2 69 LEU QD . . 2.930 2.185 2.044 2.840 . 0 0 "[ . 1 . 2]" 1
2519 2 69 LEU HA 2 69 LEU HG . . 4.180 3.167 2.580 3.323 . 0 0 "[ . 1 . 2]" 1
2520 2 69 LEU HA 2 70 ASP H . . 2.640 2.261 2.116 2.435 . 0 0 "[ . 1 . 2]" 1
2521 2 69 LEU HB2 2 70 ASP H . . 4.560 4.417 4.029 4.579 0.019 4 0 "[ . 1 . 2]" 1
2522 2 69 LEU HB3 2 70 ASP H . . 4.190 4.002 3.050 4.284 0.094 16 0 "[ . 1 . 2]" 1
2523 2 69 LEU QD 2 70 ASP H . . 4.540 3.956 3.538 4.371 . 0 0 "[ . 1 . 2]" 1
2524 2 69 LEU MD1 2 70 ASP H . . 5.500 5.435 4.551 5.682 0.182 9 0 "[ . 1 . 2]" 1
2525 2 69 LEU MD2 2 70 ASP H . . 5.500 4.157 3.622 5.650 0.150 3 0 "[ . 1 . 2]" 1
2526 2 69 LEU HG 2 70 ASP H . . 5.190 5.204 4.797 5.319 0.129 6 0 "[ . 1 . 2]" 1
2527 2 70 ASP H 2 70 ASP HB2 . . 4.060 3.233 2.495 3.730 . 0 0 "[ . 1 . 2]" 1
2528 2 70 ASP H 2 70 ASP QB . . 3.230 2.585 2.291 2.873 . 0 0 "[ . 1 . 2]" 1
2529 2 70 ASP H 2 70 ASP HB3 . . 4.060 2.826 2.392 3.693 . 0 0 "[ . 1 . 2]" 1
2530 2 70 ASP H 2 71 PRO HD3 . . 5.090 4.339 3.987 4.762 . 0 0 "[ . 1 . 2]" 1
2531 2 70 ASP HA 2 71 PRO QG . . 4.770 3.846 3.693 3.967 . 0 0 "[ . 1 . 2]" 1
2532 2 70 ASP HA 2 72 SER H . . 4.230 3.685 3.194 4.045 . 0 0 "[ . 1 . 2]" 1
2533 2 70 ASP QB 2 71 PRO HD3 . . 5.000 4.010 3.573 4.526 . 0 0 "[ . 1 . 2]" 1
2534 2 70 ASP QB 2 71 PRO QG . . 5.050 5.035 4.361 5.307 0.257 12 0 "[ . 1 . 2]" 1
2535 2 70 ASP QB 2 72 SER H . . 4.550 3.308 2.598 4.031 . 0 0 "[ . 1 . 2]" 1
2536 2 70 ASP QB 2 73 GLU H . . 4.390 3.217 1.973 3.844 . 0 0 "[ . 1 . 2]" 1
2537 2 70 ASP QB 2 73 GLU QG . . 4.620 3.533 2.265 4.663 0.043 4 0 "[ . 1 . 2]" 1
2538 2 71 PRO HB2 2 72 SER H . . 4.110 3.474 2.670 4.173 0.063 3 0 "[ . 1 . 2]" 1
2539 2 71 PRO HD2 2 72 SER H . . 3.760 2.834 2.151 3.357 . 0 0 "[ . 1 . 2]" 1
2540 2 71 PRO HD3 2 72 SER H . . 4.240 3.945 3.457 4.322 0.082 9 0 "[ . 1 . 2]" 1
2541 2 71 PRO HG2 2 72 SER H . . 4.980 4.109 2.741 4.828 . 0 0 "[ . 1 . 2]" 1
2542 2 71 PRO HG3 2 72 SER H . . 4.980 4.661 4.244 4.993 0.013 3 0 "[ . 1 . 2]" 1
2543 2 72 SER H 2 72 SER HB2 . . 3.530 2.795 2.504 3.572 0.042 9 0 "[ . 1 . 2]" 1
2544 2 72 SER H 2 72 SER QB . . 3.090 2.332 2.241 2.641 . 0 0 "[ . 1 . 2]" 1
2545 2 72 SER H 2 72 SER HB3 . . 3.530 2.528 2.436 2.721 . 0 0 "[ . 1 . 2]" 1
2546 2 72 SER H 2 73 GLU H . . 3.060 2.582 2.275 2.920 . 0 0 "[ . 1 . 2]" 1
2547 2 72 SER H 2 73 GLU QB . . 5.340 4.817 4.406 5.312 . 0 0 "[ . 1 . 2]" 1
2548 2 72 SER QB 2 73 GLU H . . 3.910 2.727 2.091 3.533 . 0 0 "[ . 1 . 2]" 1
2549 2 72 SER HB2 2 73 GLU H . . 4.760 3.887 3.334 4.284 . 0 0 "[ . 1 . 2]" 1
2550 2 72 SER HB3 2 73 GLU H . . 4.760 2.858 2.104 4.115 . 0 0 "[ . 1 . 2]" 1
2551 2 73 GLU H 2 73 GLU HB2 . . 3.820 2.701 2.374 3.918 0.098 17 0 "[ . 1 . 2]" 1
2552 2 73 GLU H 2 73 GLU QB . . 3.030 2.589 2.344 3.169 0.139 17 0 "[ . 1 . 2]" 1
2553 2 73 GLU H 2 73 GLU HB3 . . 3.820 3.665 3.348 3.799 . 0 0 "[ . 1 . 2]" 1
2554 2 73 GLU H 2 73 GLU QG . . 3.420 2.561 2.190 2.946 . 0 0 "[ . 1 . 2]" 1
2555 2 73 GLU HA 2 73 GLU QG . . 3.710 2.992 2.476 3.391 . 0 0 "[ . 1 . 2]" 1
2556 2 73 GLU HA 2 74 GLY H . . 3.500 3.135 2.192 3.566 0.066 3 0 "[ . 1 . 2]" 1
2557 2 73 GLU HB2 2 74 GLY H . . 4.570 3.408 2.141 4.492 . 0 0 "[ . 1 . 2]" 1
2558 2 73 GLU HB3 2 74 GLY H . . 4.570 3.922 2.125 4.592 0.022 17 0 "[ . 1 . 2]" 1
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