NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
402139 |
1wa8   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wa8
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 2956
_Distance_constraint_stats_list.Viol_count 7497
_Distance_constraint_stats_list.Viol_total 22436.625
_Distance_constraint_stats_list.Viol_max 0.999
_Distance_constraint_stats_list.Viol_rms 0.0438
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0097
_Distance_constraint_stats_list.Viol_average_violations_only 0.1069
_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 GLU 1.788 0.792 18 2 "[ . 1 .- + 2 . ]"
1 3 MET 1.788 0.792 18 2 "[ . 1 .- + 2 . ]"
1 4 LYS 1.841 0.824 1 1 "[+ . 1 . 2 . ]"
1 5 THR 6.357 0.824 1 1 "[+ . 1 . 2 . ]"
1 6 ASP 5.415 0.991 20 4 "[ . 1 . * *+- . ]"
1 7 ALA 5.776 0.991 20 4 "[ . 1 . * *+- . ]"
1 8 ALA 0.206 0.065 11 0 "[ . 1 . 2 . ]"
1 9 THR 18.748 0.491 8 0 "[ . 1 . 2 . ]"
1 10 LEU 24.529 0.490 25 0 "[ . 1 . 2 . ]"
1 11 ALA 0.748 0.127 2 0 "[ . 1 . 2 . ]"
1 12 GLN 11.744 0.491 8 0 "[ . 1 . 2 . ]"
1 13 GLU 1.884 0.360 15 0 "[ . 1 . 2 . ]"
1 14 ALA 5.367 0.307 6 0 "[ . 1 . 2 . ]"
1 15 GLY 0.455 0.074 8 0 "[ . 1 . 2 . ]"
1 16 ASN 1.034 0.145 22 0 "[ . 1 . 2 . ]"
1 17 PHE 15.513 0.246 19 0 "[ . 1 . 2 . ]"
1 18 GLU 9.504 0.593 26 5 "[ . -1 . 2** *.+ ]"
1 19 ARG 0.729 0.080 8 0 "[ . 1 . 2 . ]"
1 20 ILE 23.321 0.351 27 0 "[ . 1 . 2 . ]"
1 21 SER 14.775 0.593 26 5 "[ . -1 . 2** *.+ ]"
1 22 GLY 1.444 0.207 23 0 "[ . 1 . 2 . ]"
1 23 ASP 3.101 0.702 11 2 "[ . 1+ - . 2 . ]"
1 24 LEU 4.433 0.192 5 0 "[ . 1 . 2 . ]"
1 25 LYS 8.371 0.702 11 2 "[ . 1+ - . 2 . ]"
1 26 THR 16.585 0.969 10 7 "[ * . + -. * ** * . ]"
1 27 GLN 15.816 0.969 10 7 "[ * . + *. * ** * . ]"
1 28 ILE 17.549 0.609 18 2 "[ . - . + 2 . ]"
1 29 ASP 6.319 0.416 16 0 "[ . 1 . 2 . ]"
1 30 GLN 20.012 0.626 17 6 "[* * -1 . + 2 *.* ]"
1 31 VAL 0.181 0.047 16 0 "[ . 1 . 2 . ]"
1 32 GLU 11.553 0.215 6 0 "[ . 1 . 2 . ]"
1 33 SER 7.411 0.626 17 4 "[* . -1 . + 2 *. ]"
1 34 THR 6.739 0.239 14 0 "[ . 1 . 2 . ]"
1 35 ALA 13.905 0.280 13 0 "[ . 1 . 2 . ]"
1 36 GLY 1.577 0.745 16 1 "[ . 1 .+ 2 . ]"
1 37 SER 5.327 0.492 26 0 "[ . 1 . 2 . ]"
1 38 LEU 13.830 0.806 3 1 "[ + . 1 . 2 . ]"
1 39 GLN 9.400 0.745 16 2 "[ . 1 .+- 2 . ]"
1 40 GLY 1.485 0.540 17 1 "[ . 1 . + 2 . ]"
1 41 GLN 4.798 0.806 3 1 "[ + . 1 . 2 . ]"
1 42 TRP 22.648 0.254 16 0 "[ . 1 . 2 . ]"
1 43 ARG 5.783 0.506 22 1 "[ . 1 . 2 + . ]"
1 46 ALA 8.672 0.506 22 1 "[ . 1 . 2 + . ]"
1 47 GLY 2.679 0.179 28 0 "[ . 1 . 2 . ]"
1 48 THR 6.887 0.999 5 5 "[ * + 1 *. 2- * . ]"
1 49 ALA 1.429 0.182 22 0 "[ . 1 . 2 . ]"
1 50 ALA 23.778 0.314 22 0 "[ . 1 . 2 . ]"
1 51 GLN 18.153 0.999 5 6 "[ * + 1 *. 2* * . -]"
1 52 ALA 17.020 0.839 25 6 "[ *. 1 ** * 2 + -]"
1 53 ALA 6.354 0.257 25 0 "[ . 1 . 2 . ]"
1 54 VAL 4.531 0.245 18 0 "[ . 1 . 2 . ]"
1 55 VAL 27.741 0.849 28 6 "[ *. 1 ** * 2 * +]"
1 56 ARG 1.867 0.211 25 0 "[ . 1 . 2 . ]"
1 57 PHE 31.148 0.280 13 0 "[ . 1 . 2 . ]"
1 58 GLN 21.096 0.616 28 6 "[ *. 1 *- * 2 * +]"
1 59 GLU 4.844 0.849 28 5 "[ . 1 ** - 2 * +]"
1 60 ALA 13.401 0.919 12 3 "[ . -1 + . 2 * . ]"
1 61 ALA 5.861 0.266 27 0 "[ . 1 . 2 . ]"
1 62 ASN 5.713 0.615 22 1 "[ . 1 . 2 + . ]"
1 63 LYS 22.205 0.919 12 3 "[ . -1 + . 2 * . ]"
1 64 GLN 12.525 0.245 23 0 "[ . 1 . 2 . ]"
1 65 LYS 12.812 0.310 24 0 "[ . 1 . 2 . ]"
1 66 GLN 3.484 0.310 24 0 "[ . 1 . 2 . ]"
1 67 GLU 2.161 0.252 5 0 "[ . 1 . 2 . ]"
1 68 LEU 8.888 0.290 6 0 "[ . 1 . 2 . ]"
1 69 ASP 1.726 0.290 6 0 "[ . 1 . 2 . ]"
1 70 GLU 12.728 0.266 16 0 "[ . 1 . 2 . ]"
1 71 ILE 13.096 0.266 16 0 "[ . 1 . 2 . ]"
1 72 SER 2.886 0.178 13 0 "[ . 1 . 2 . ]"
1 73 THR 4.172 0.261 22 0 "[ . 1 . 2 . ]"
1 74 ASN 3.127 0.147 20 0 "[ . 1 . 2 . ]"
1 75 ILE 24.185 0.433 11 0 "[ . 1 . 2 . ]"
1 76 ARG 19.729 0.566 27 1 "[ . 1 . 2 . + ]"
1 77 GLN 10.180 0.447 9 0 "[ . 1 . 2 . ]"
1 78 ALA 3.337 0.251 23 0 "[ . 1 . 2 . ]"
1 79 GLY 9.245 0.283 23 0 "[ . 1 . 2 . ]"
1 80 VAL 6.956 0.433 11 0 "[ . 1 . 2 . ]"
1 81 GLN 7.293 0.458 22 0 "[ . 1 . 2 . ]"
1 82 TYR 6.372 0.458 22 0 "[ . 1 . 2 . ]"
1 83 SER 0.268 0.093 26 0 "[ . 1 . 2 . ]"
1 84 ARG 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 85 ALA 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 86 ASP 3.341 0.422 6 0 "[ . 1 . 2 . ]"
1 87 GLU 3.341 0.422 6 0 "[ . 1 . 2 . ]"
1 88 GLU 5.629 0.446 21 0 "[ . 1 . 2 . ]"
1 89 GLN 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 90 GLN 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 93 LEU 0.029 0.027 19 0 "[ . 1 . 2 . ]"
1 97 MET 0.029 0.027 19 0 "[ . 1 . 2 . ]"
2 1 MET 0.056 0.024 12 0 "[ . 1 . 2 . ]"
2 2 THR 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 3 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 4 GLN 0.545 0.064 28 0 "[ . 1 . 2 . ]"
2 5 GLN 0.001 0.001 15 0 "[ . 1 . 2 . ]"
2 6 TRP 1.532 0.188 28 0 "[ . 1 . 2 . ]"
2 7 ASN 1.112 0.188 28 0 "[ . 1 . 2 . ]"
2 9 ALA 2.443 0.173 25 0 "[ . 1 . 2 . ]"
2 10 GLY 2.443 0.173 25 0 "[ . 1 . 2 . ]"
2 11 ILE 21.377 0.825 25 3 "[ . 1 .* 2 + - ]"
2 12 GLU 0.725 0.150 6 0 "[ . 1 . 2 . ]"
2 13 ALA 0.025 0.025 20 0 "[ . 1 . 2 . ]"
2 14 ALA 11.233 0.246 9 0 "[ . 1 . 2 . ]"
2 15 ALA 17.119 0.246 9 0 "[ . 1 . 2 . ]"
2 16 SER 6.478 0.150 6 0 "[ . 1 . 2 . ]"
2 17 ALA 1.251 0.092 23 0 "[ . 1 . 2 . ]"
2 18 ILE 21.169 0.195 17 0 "[ . 1 . 2 . ]"
2 19 GLN 5.340 0.144 6 0 "[ . 1 . 2 . ]"
2 20 GLY 0.408 0.065 18 0 "[ . 1 . 2 . ]"
2 21 ASN 10.191 0.433 5 0 "[ . 1 . 2 . ]"
2 22 VAL 19.778 0.278 17 0 "[ . 1 . 2 . ]"
2 23 THR 8.235 0.244 26 0 "[ . 1 . 2 . ]"
2 24 SER 6.153 0.222 13 0 "[ . 1 . 2 . ]"
2 25 ILE 38.061 0.372 7 0 "[ . 1 . 2 . ]"
2 26 HIS 3.993 0.330 27 0 "[ . 1 . 2 . ]"
2 27 SER 13.626 0.204 21 0 "[ . 1 . 2 . ]"
2 28 LEU 25.633 0.340 25 0 "[ . 1 . 2 . ]"
2 29 LEU 17.877 0.308 23 0 "[ . 1 . 2 . ]"
2 30 ASP 17.251 0.268 22 0 "[ . 1 . 2 . ]"
2 31 GLU 4.176 0.268 22 0 "[ . 1 . 2 . ]"
2 32 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 33 LYS 28.384 0.301 21 0 "[ . 1 . 2 . ]"
2 34 GLN 6.959 0.293 23 0 "[ . 1 . 2 . ]"
2 35 SER 10.984 0.351 27 0 "[ . 1 . 2 . ]"
2 36 LEU 10.346 0.337 22 0 "[ . 1 . 2 . ]"
2 37 THR 13.923 0.947 28 3 "[ . 1 -. 2 * . +]"
2 38 LYS 11.860 0.947 28 3 "[ . 1 -. 2 * . +]"
2 39 LEU 20.439 0.337 22 0 "[ . 1 . 2 . ]"
2 40 ALA 8.317 0.263 9 0 "[ . 1 . 2 . ]"
2 41 ALA 7.441 0.225 2 0 "[ . 1 . 2 . ]"
2 42 ALA 8.011 0.341 3 0 "[ . 1 . 2 . ]"
2 43 TRP 13.058 0.380 27 0 "[ . 1 . 2 . ]"
2 44 GLY 2.510 0.225 2 0 "[ . 1 . 2 . ]"
2 45 GLY 2.967 0.380 27 0 "[ . 1 . 2 . ]"
2 46 SER 2.184 0.189 26 0 "[ . 1 . 2 . ]"
2 47 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 48 SER 0.346 0.088 8 0 "[ . 1 . 2 . ]"
2 49 GLU 10.510 0.852 26 8 "[ * . ** * * - *+ ]"
2 50 ALA 7.486 0.170 3 0 "[ . 1 . 2 . ]"
2 51 TYR 9.022 0.190 26 0 "[ . 1 . 2 . ]"
2 52 GLN 27.153 0.852 26 8 "[ * . ** * * - *+ ]"
2 53 GLY 4.473 0.158 11 0 "[ . 1 . 2 . ]"
2 54 VAL 20.415 0.692 8 1 "[ . + 1 . 2 . ]"
2 55 GLN 12.968 0.224 26 0 "[ . 1 . 2 . ]"
2 56 GLN 13.683 0.489 21 0 "[ . 1 . 2 . ]"
2 57 LYS 5.274 0.692 8 1 "[ . + 1 . 2 . ]"
2 58 TRP 16.186 0.301 21 0 "[ . 1 . 2 . ]"
2 59 ASP 3.523 0.650 7 1 "[ . + 1 . 2 . ]"
2 60 ALA 9.110 0.650 7 1 "[ . + 1 . 2 . ]"
2 61 THR 17.933 0.428 20 0 "[ . 1 . 2 . ]"
2 62 ALA 12.166 0.428 20 0 "[ . 1 . 2 . ]"
2 63 THR 14.691 0.402 19 0 "[ . 1 . 2 . ]"
2 64 GLU 5.784 0.210 20 0 "[ . 1 . 2 . ]"
2 65 LEU 6.431 0.394 27 0 "[ . 1 . 2 . ]"
2 66 ASN 15.360 0.402 19 0 "[ . 1 . 2 . ]"
2 67 ASN 3.389 0.372 7 0 "[ . 1 . 2 . ]"
2 68 ALA 7.305 0.219 9 0 "[ . 1 . 2 . ]"
2 69 LEU 10.734 0.229 10 0 "[ . 1 . 2 . ]"
2 70 GLN 8.787 0.615 8 6 "[ * . + 1 * . *-2 * ]"
2 71 ASN 15.438 0.615 8 6 "[ * . + 1 * . *-2 * ]"
2 72 LEU 10.815 0.314 22 0 "[ . 1 . 2 . ]"
2 73 ALA 7.800 0.201 27 0 "[ . 1 . 2 . ]"
2 74 ARG 5.252 0.209 22 0 "[ . 1 . 2 . ]"
2 75 THR 8.080 0.245 22 0 "[ . 1 . 2 . ]"
2 76 ILE 26.260 0.284 18 0 "[ . 1 . 2 . ]"
2 77 SER 9.142 0.245 22 0 "[ . 1 . 2 . ]"
2 78 GLU 6.822 0.253 1 0 "[ . 1 . 2 . ]"
2 79 ALA 6.040 0.243 8 0 "[ . 1 . 2 . ]"
2 80 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 81 GLN 2.586 0.435 27 0 "[ . 1 . 2 . ]"
2 82 ALA 12.904 0.451 16 0 "[ . 1 . 2 . ]"
2 83 MET 13.254 0.825 25 3 "[ . 1 .* 2 + - ]"
2 84 ALA 1.409 0.221 26 0 "[ . 1 . 2 . ]"
2 85 SER 3.792 0.451 16 0 "[ . 1 . 2 . ]"
2 86 THR 0.202 0.075 21 0 "[ . 1 . 2 . ]"
2 88 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 89 ASN 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 90 VAL 0.962 0.319 15 0 "[ . 1 . 2 . ]"
2 91 THR 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 92 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 93 MET 0.931 0.319 15 0 "[ . 1 . 2 . ]"
2 94 PHE 0.625 0.157 15 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 GLU HB3 1 3 MET QG . . 4.370 3.586 2.480 5.162 0.792 18 2 "[ . 1 .- + 2 . ]" 1
2 1 4 LYS HA 1 4 LYS HG2 . . 4.000 3.607 3.527 3.738 . 0 0 "[ . 1 . 2 . ]" 1
3 1 4 LYS HA 1 4 LYS QD . . 4.400 4.034 3.019 4.350 . 0 0 "[ . 1 . 2 . ]" 1
4 1 4 LYS HA 1 5 THR MG . . 4.510 4.316 3.959 4.748 0.238 16 0 "[ . 1 . 2 . ]" 1
5 1 4 LYS HB2 1 5 THR H . . 5.260 4.020 2.917 4.486 . 0 0 "[ . 1 . 2 . ]" 1
6 1 4 LYS HG3 1 5 THR HA . . 4.370 4.261 3.793 5.194 0.824 1 1 "[+ . 1 . 2 . ]" 1
7 1 4 LYS HG2 1 5 THR HB . . 4.980 4.609 3.585 5.036 0.056 17 0 "[ . 1 . 2 . ]" 1
8 1 4 LYS HG2 1 6 ASP H . . 5.290 4.518 2.717 5.346 0.056 5 0 "[ . 1 . 2 . ]" 1
9 1 5 THR HA 1 10 LEU MD2 . . 5.210 3.480 2.413 5.435 0.225 7 0 "[ . 1 . 2 . ]" 1
10 1 5 THR HA 1 5 THR HB . . 2.920 2.435 2.302 2.527 . 0 0 "[ . 1 . 2 . ]" 1
11 1 5 THR HA 1 5 THR MG . . 3.080 2.765 2.455 3.236 0.156 12 0 "[ . 1 . 2 . ]" 1
12 1 5 THR HA 2 41 ALA MB . . 4.950 2.290 1.873 3.818 . 0 0 "[ . 1 . 2 . ]" 1
13 1 5 THR HA 1 9 THR MG . . 4.610 3.199 2.416 4.610 . 0 0 "[ . 1 . 2 . ]" 1
14 1 5 THR HB 1 10 LEU MD2 . . 4.420 4.122 3.291 4.535 0.115 18 0 "[ . 1 . 2 . ]" 1
15 1 5 THR HB 1 10 LEU MD1 . . 4.600 3.376 2.874 4.346 . 0 0 "[ . 1 . 2 . ]" 1
16 1 5 THR HB 2 41 ALA HA . . 4.500 4.173 3.226 4.659 0.159 26 0 "[ . 1 . 2 . ]" 1
17 1 5 THR HB 2 41 ALA MB . . 4.510 2.577 1.792 3.341 . 0 0 "[ . 1 . 2 . ]" 1
18 1 5 THR HB 1 6 ASP H . . 4.950 4.198 2.716 4.592 . 0 0 "[ . 1 . 2 . ]" 1
19 1 5 THR H 1 10 LEU MD1 . . 5.500 5.061 3.831 5.564 0.064 8 0 "[ . 1 . 2 . ]" 1
20 1 5 THR H 1 6 ASP H . . 5.500 2.214 1.898 2.898 . 0 0 "[ . 1 . 2 . ]" 1
21 1 5 THR MG 1 10 LEU MD2 . . 4.570 4.205 1.928 4.787 0.217 16 0 "[ . 1 . 2 . ]" 1
22 1 5 THR MG 1 10 LEU MD1 . . 4.180 3.811 1.724 4.240 0.060 15 0 "[ . 1 . 2 . ]" 1
23 1 5 THR MG 1 6 ASP H . . 5.100 3.518 1.821 4.077 . 0 0 "[ . 1 . 2 . ]" 1
24 1 6 ASP HA 1 6 ASP HB3 . . 3.010 2.757 2.267 2.950 . 0 0 "[ . 1 . 2 . ]" 1
25 1 6 ASP HA 1 9 THR MG . . 4.580 4.083 3.464 4.682 0.102 28 0 "[ . 1 . 2 . ]" 1
26 1 6 ASP HB2 1 9 THR HB . . 4.150 2.894 2.061 4.077 . 0 0 "[ . 1 . 2 . ]" 1
27 1 6 ASP HB2 1 9 THR MG . . 4.460 2.879 1.983 4.420 . 0 0 "[ . 1 . 2 . ]" 1
28 1 6 ASP HB3 1 7 ALA H . . 4.150 3.439 3.130 4.223 0.073 20 0 "[ . 1 . 2 . ]" 1
29 1 6 ASP HB3 1 7 ALA MB . . 4.480 4.613 4.321 5.471 0.991 20 4 "[ . 1 . * *+- . ]" 1
30 1 6 ASP HB3 1 8 ALA H . . 5.100 2.715 2.044 4.127 . 0 0 "[ . 1 . 2 . ]" 1
31 1 6 ASP HB3 1 8 ALA MB . . 4.260 2.864 2.191 3.912 . 0 0 "[ . 1 . 2 . ]" 1
32 1 6 ASP HB3 1 9 THR HB . . 4.220 3.235 1.969 4.454 0.234 19 0 "[ . 1 . 2 . ]" 1
33 1 6 ASP HB3 1 9 THR H . . 5.320 2.485 1.884 4.299 . 0 0 "[ . 1 . 2 . ]" 1
34 1 6 ASP HB3 1 9 THR MG . . 4.520 3.376 2.278 4.557 0.037 21 0 "[ . 1 . 2 . ]" 1
35 1 7 ALA HA 1 10 LEU HB2 . . 3.850 2.262 2.008 2.753 . 0 0 "[ . 1 . 2 . ]" 1
36 1 7 ALA HA 1 10 LEU HG . . 4.120 3.759 3.204 4.043 . 0 0 "[ . 1 . 2 . ]" 1
37 1 7 ALA HA 1 10 LEU MD1 . . 3.790 2.863 2.320 3.188 . 0 0 "[ . 1 . 2 . ]" 1
38 1 7 ALA HA 1 80 VAL HB . . 5.430 3.983 1.955 5.261 . 0 0 "[ . 1 . 2 . ]" 1
39 1 7 ALA H 1 10 LEU MD1 . . 5.500 4.437 3.801 4.788 . 0 0 "[ . 1 . 2 . ]" 1
40 1 7 ALA H 1 7 ALA MB . . 3.530 2.036 1.945 2.162 . 0 0 "[ . 1 . 2 . ]" 1
41 1 7 ALA H 1 8 ALA H . . 4.370 2.653 2.516 2.836 . 0 0 "[ . 1 . 2 . ]" 1
42 1 7 ALA H 1 9 THR H . . 5.500 4.342 4.120 4.554 . 0 0 "[ . 1 . 2 . ]" 1
43 1 7 ALA MB 1 10 LEU MD1 . . 3.890 3.865 3.477 4.024 0.134 16 0 "[ . 1 . 2 . ]" 1
44 1 7 ALA MB 1 80 VAL QG . . 3.280 2.564 1.955 3.173 . 0 0 "[ . 1 . 2 . ]" 1
45 1 7 ALA MB 1 82 TYR H . . 5.050 3.381 2.266 3.977 . 0 0 "[ . 1 . 2 . ]" 1
46 1 7 ALA MB 1 82 TYR QD . . 4.170 3.370 2.373 3.956 . 0 0 "[ . 1 . 2 . ]" 1
47 1 7 ALA MB 1 83 SER HA . . 4.720 4.539 3.703 4.813 0.093 26 0 "[ . 1 . 2 . ]" 1
48 1 7 ALA MB 1 83 SER QB . . 4.420 3.802 3.042 4.345 . 0 0 "[ . 1 . 2 . ]" 1
49 1 7 ALA MB 1 8 ALA H . . 3.720 2.900 2.594 3.049 . 0 0 "[ . 1 . 2 . ]" 1
50 1 8 ALA H 1 8 ALA MB . . 3.250 2.012 1.987 2.164 . 0 0 "[ . 1 . 2 . ]" 1
51 1 8 ALA H 1 9 THR H . . 4.020 2.639 2.465 2.827 . 0 0 "[ . 1 . 2 . ]" 1
52 1 8 ALA MB 1 12 GLN QB . . 4.280 4.220 4.030 4.345 0.065 11 0 "[ . 1 . 2 . ]" 1
53 1 8 ALA MB 1 9 THR HA . . 4.320 3.818 3.764 3.858 . 0 0 "[ . 1 . 2 . ]" 1
54 1 8 ALA MB 1 9 THR H . . 3.710 2.628 2.437 2.739 . 0 0 "[ . 1 . 2 . ]" 1
55 1 9 THR HA 1 12 GLN QB . . 4.070 2.280 1.933 2.496 . 0 0 "[ . 1 . 2 . ]" 1
56 1 9 THR HA 1 12 GLN HG2 . . 5.030 4.562 3.409 5.044 0.014 3 0 "[ . 1 . 2 . ]" 1
57 1 9 THR HA 1 12 GLN HG3 . . 4.690 4.702 3.803 5.181 0.491 8 0 "[ . 1 . 2 . ]" 1
58 1 9 THR HA 1 9 THR HB . . 3.050 2.687 2.555 2.801 . 0 0 "[ . 1 . 2 . ]" 1
59 1 9 THR HA 1 9 THR MG . . 3.130 3.148 3.046 3.225 0.095 10 0 "[ . 1 . 2 . ]" 1
60 1 9 THR HB 1 10 LEU H . . 4.030 3.687 3.297 4.024 . 0 0 "[ . 1 . 2 . ]" 1
61 1 9 THR H 1 10 LEU HG . . 5.310 4.666 4.417 4.909 . 0 0 "[ . 1 . 2 . ]" 1
62 1 9 THR H 1 10 LEU MD1 . . 5.500 5.464 5.130 5.639 0.139 17 0 "[ . 1 . 2 . ]" 1
63 1 9 THR H 1 12 GLN QB . . 5.010 4.379 4.213 4.496 . 0 0 "[ . 1 . 2 . ]" 1
64 1 9 THR H 1 9 THR HB . . 4.300 2.177 1.982 2.384 . 0 0 "[ . 1 . 2 . ]" 1
65 1 9 THR H 1 9 THR MG . . 4.140 2.644 2.276 3.015 . 0 0 "[ . 1 . 2 . ]" 1
66 1 9 THR MG 1 10 LEU HA . . 3.070 2.937 2.751 3.125 0.055 8 0 "[ . 1 . 2 . ]" 1
67 1 9 THR MG 1 10 LEU HB3 . . 4.020 4.376 4.134 4.510 0.490 25 0 "[ . 1 . 2 . ]" 1
68 1 9 THR MG 1 10 LEU HG . . 4.330 2.438 1.944 2.763 . 0 0 "[ . 1 . 2 . ]" 1
69 1 9 THR MG 1 10 LEU H . . 4.650 2.123 1.875 2.463 . 0 0 "[ . 1 . 2 . ]" 1
70 1 9 THR MG 1 10 LEU MD2 . . 4.330 2.734 2.152 3.117 . 0 0 "[ . 1 . 2 . ]" 1
71 1 9 THR MG 1 10 LEU MD1 . . 4.620 3.760 3.347 4.032 . 0 0 "[ . 1 . 2 . ]" 1
72 1 10 LEU HA 1 10 LEU HG . . 3.930 2.978 2.808 3.244 . 0 0 "[ . 1 . 2 . ]" 1
73 1 10 LEU HA 1 10 LEU MD2 . . 3.180 2.002 1.869 2.219 . 0 0 "[ . 1 . 2 . ]" 1
74 1 10 LEU HA 1 10 LEU MD1 . . 3.860 3.795 3.681 3.912 0.052 13 0 "[ . 1 . 2 . ]" 1
75 1 10 LEU HA 1 13 GLU QB . . 4.200 3.166 2.631 4.042 . 0 0 "[ . 1 . 2 . ]" 1
76 1 10 LEU HA 1 13 GLU H . . 4.030 3.300 3.061 3.507 . 0 0 "[ . 1 . 2 . ]" 1
77 1 10 LEU HA 2 39 LEU QD . . 3.430 2.759 2.376 3.120 . 0 0 "[ . 1 . 2 . ]" 1
78 1 10 LEU HA 1 80 VAL QG . . 4.410 3.735 3.597 3.914 . 0 0 "[ . 1 . 2 . ]" 1
79 1 10 LEU HB2 1 10 LEU MD1 . . 3.600 2.356 2.248 2.502 . 0 0 "[ . 1 . 2 . ]" 1
80 1 10 LEU HB2 1 11 ALA H . . 4.080 2.623 2.415 2.857 . 0 0 "[ . 1 . 2 . ]" 1
81 1 10 LEU HB2 2 39 LEU QD . . 4.500 4.414 4.132 4.629 0.129 22 0 "[ . 1 . 2 . ]" 1
82 1 10 LEU HB2 1 80 VAL QG . . 3.780 2.028 1.691 2.438 . 0 0 "[ . 1 . 2 . ]" 1
83 1 10 LEU HB3 1 10 LEU MD2 . . 3.620 2.407 2.266 2.612 . 0 0 "[ . 1 . 2 . ]" 1
84 1 10 LEU HB3 1 10 LEU MD1 . . 3.640 2.383 2.264 2.467 . 0 0 "[ . 1 . 2 . ]" 1
85 1 10 LEU HB3 2 39 LEU QD . . 4.420 3.158 2.780 3.605 . 0 0 "[ . 1 . 2 . ]" 1
86 1 10 LEU HB3 1 80 VAL QG . . 4.100 1.883 1.741 2.200 . 0 0 "[ . 1 . 2 . ]" 1
87 1 10 LEU HG 1 80 VAL QG . . 4.530 3.544 3.122 3.889 . 0 0 "[ . 1 . 2 . ]" 1
88 1 10 LEU H 1 10 LEU HB3 . . 3.830 3.492 3.455 3.535 . 0 0 "[ . 1 . 2 . ]" 1
89 1 10 LEU H 1 10 LEU HG . . 3.550 2.615 2.126 2.938 . 0 0 "[ . 1 . 2 . ]" 1
90 1 10 LEU H 1 10 LEU MD1 . . 4.160 3.740 3.347 3.986 . 0 0 "[ . 1 . 2 . ]" 1
91 1 10 LEU H 1 13 GLU H . . 5.500 4.726 4.549 4.897 . 0 0 "[ . 1 . 2 . ]" 1
92 1 10 LEU H 1 14 ALA H . . 5.500 5.499 5.346 5.591 0.091 1 0 "[ . 1 . 2 . ]" 1
93 1 10 LEU MD2 1 14 ALA MB . . 4.230 3.745 3.311 4.080 . 0 0 "[ . 1 . 2 . ]" 1
94 1 10 LEU MD2 2 39 LEU HA . . 3.400 2.203 2.050 2.342 . 0 0 "[ . 1 . 2 . ]" 1
95 1 10 LEU MD2 2 39 LEU HB3 . . 4.480 3.567 3.059 3.940 . 0 0 "[ . 1 . 2 . ]" 1
96 1 10 LEU MD2 2 39 LEU HB2 . . 4.610 4.521 4.244 4.757 0.147 25 0 "[ . 1 . 2 . ]" 1
97 1 10 LEU MD2 2 39 LEU QD . . 4.190 2.043 1.894 2.202 . 0 0 "[ . 1 . 2 . ]" 1
98 1 10 LEU MD2 2 41 ALA MB . . 3.360 2.377 1.982 2.748 . 0 0 "[ . 1 . 2 . ]" 1
99 1 10 LEU MD2 2 42 ALA HA . . 4.290 2.844 2.334 3.340 . 0 0 "[ . 1 . 2 . ]" 1
100 1 10 LEU MD2 2 42 ALA MB . . 3.740 2.007 1.753 2.588 . 0 0 "[ . 1 . 2 . ]" 1
101 1 10 LEU MD1 2 41 ALA MB . . 3.340 3.280 3.016 3.478 0.138 11 0 "[ . 1 . 2 . ]" 1
102 1 10 LEU MD1 2 42 ALA HA . . 4.050 1.965 1.789 2.166 . 0 0 "[ . 1 . 2 . ]" 1
103 1 10 LEU MD1 2 42 ALA MB . . 3.670 2.141 1.776 2.730 . 0 0 "[ . 1 . 2 . ]" 1
104 1 10 LEU MD1 1 75 ILE MD . . 4.420 4.214 3.711 4.780 0.360 16 0 "[ . 1 . 2 . ]" 1
105 1 10 LEU MD1 1 78 ALA MB . . 3.840 2.140 1.846 2.347 . 0 0 "[ . 1 . 2 . ]" 1
106 1 10 LEU MD1 1 79 GLY H . . 4.590 4.736 4.615 4.829 0.239 19 0 "[ . 1 . 2 . ]" 1
107 1 11 ALA HA 1 14 ALA H . . 4.320 3.329 3.028 3.822 . 0 0 "[ . 1 . 2 . ]" 1
108 1 11 ALA HA 1 80 VAL QG . . 3.590 2.447 2.079 2.614 . 0 0 "[ . 1 . 2 . ]" 1
109 1 11 ALA H 1 11 ALA MB . . 3.050 2.093 1.952 2.164 . 0 0 "[ . 1 . 2 . ]" 1
110 1 11 ALA H 1 13 GLU H . . 4.950 4.192 3.874 4.406 . 0 0 "[ . 1 . 2 . ]" 1
111 1 11 ALA H 1 14 ALA H . . 5.500 4.424 4.299 4.641 . 0 0 "[ . 1 . 2 . ]" 1
112 1 11 ALA H 1 80 VAL QG . . 4.370 2.174 1.899 2.836 . 0 0 "[ . 1 . 2 . ]" 1
113 1 11 ALA MB 1 12 GLN HA . . 4.150 3.855 3.760 3.904 . 0 0 "[ . 1 . 2 . ]" 1
114 1 11 ALA MB 1 12 GLN H . . 3.520 2.851 2.516 2.990 . 0 0 "[ . 1 . 2 . ]" 1
115 1 11 ALA MB 1 80 VAL HB . . 4.060 4.036 3.715 4.187 0.127 2 0 "[ . 1 . 2 . ]" 1
116 1 11 ALA MB 1 80 VAL QG . . 3.580 1.912 1.788 2.209 . 0 0 "[ . 1 . 2 . ]" 1
117 1 11 ALA MB 1 81 GLN H . . 5.230 5.002 4.761 5.265 0.035 27 0 "[ . 1 . 2 . ]" 1
118 1 12 GLN HA 1 12 GLN HG2 . . 3.940 2.990 2.122 3.733 . 0 0 "[ . 1 . 2 . ]" 1
119 1 12 GLN HA 1 12 GLN HG3 . . 3.520 2.510 1.955 3.564 0.044 14 0 "[ . 1 . 2 . ]" 1
120 1 12 GLN QB 1 13 GLU H . . 4.080 2.832 2.628 3.017 . 0 0 "[ . 1 . 2 . ]" 1
121 1 12 GLN H 1 12 GLN QB . . 3.280 2.069 2.003 2.174 . 0 0 "[ . 1 . 2 . ]" 1
122 1 12 GLN H 1 12 GLN HG2 . . 4.260 4.393 3.758 4.643 0.383 28 0 "[ . 1 . 2 . ]" 1
123 1 12 GLN H 1 13 GLU QB . . 4.880 4.740 4.453 4.820 . 0 0 "[ . 1 . 2 . ]" 1
124 1 12 GLN H 1 13 GLU H . . 3.790 2.598 2.434 2.786 . 0 0 "[ . 1 . 2 . ]" 1
125 1 12 GLN H 1 14 ALA H . . 5.030 3.951 3.628 4.226 . 0 0 "[ . 1 . 2 . ]" 1
126 1 12 GLN H 1 15 GLY H . . 5.500 4.580 4.377 4.781 . 0 0 "[ . 1 . 2 . ]" 1
127 1 12 GLN H 1 80 VAL QG . . 5.380 4.202 4.050 4.551 . 0 0 "[ . 1 . 2 . ]" 1
128 1 13 GLU HA 1 16 ASN QB . . 3.880 2.762 2.438 3.755 . 0 0 "[ . 1 . 2 . ]" 1
129 1 13 GLU HA 1 16 ASN QD . . 4.880 3.276 1.847 4.273 . 0 0 "[ . 1 . 2 . ]" 1
130 1 13 GLU HA 1 16 ASN H . . 4.160 3.361 3.091 3.590 . 0 0 "[ . 1 . 2 . ]" 1
131 1 13 GLU HA 2 38 LYS QE . . 3.750 3.701 2.971 4.110 0.360 15 0 "[ . 1 . 2 . ]" 1
132 1 13 GLU HA 2 39 LEU QD . . 4.580 3.927 3.502 4.358 . 0 0 "[ . 1 . 2 . ]" 1
133 1 13 GLU QB 1 14 ALA H . . 4.540 2.665 2.290 3.649 . 0 0 "[ . 1 . 2 . ]" 1
134 1 13 GLU QB 1 16 ASN QD . . 5.500 3.844 2.477 5.059 . 0 0 "[ . 1 . 2 . ]" 1
135 1 13 GLU QB 1 16 ASN H . . 5.180 4.631 4.525 4.853 . 0 0 "[ . 1 . 2 . ]" 1
136 1 13 GLU QB 2 35 SER HA . . 5.090 3.353 2.847 3.862 . 0 0 "[ . 1 . 2 . ]" 1
137 1 13 GLU QB 2 35 SER QB . . 5.500 4.003 3.677 4.518 . 0 0 "[ . 1 . 2 . ]" 1
138 1 13 GLU QB 2 38 LYS QE . . 4.430 2.759 1.928 3.670 . 0 0 "[ . 1 . 2 . ]" 1
139 1 13 GLU QB 2 39 LEU QD . . 4.280 2.062 1.669 2.942 . 0 0 "[ . 1 . 2 . ]" 1
140 1 13 GLU QB 1 14 ALA MB . . 5.180 3.847 3.676 4.645 . 0 0 "[ . 1 . 2 . ]" 1
141 1 13 GLU QB 1 15 GLY H . . 5.500 4.846 4.354 5.123 . 0 0 "[ . 1 . 2 . ]" 1
142 1 13 GLU H 1 14 ALA H . . 3.960 2.227 2.104 2.474 . 0 0 "[ . 1 . 2 . ]" 1
143 1 13 GLU H 1 14 ALA MB . . 4.540 3.821 3.706 4.092 . 0 0 "[ . 1 . 2 . ]" 1
144 1 13 GLU H 1 15 GLY H . . 5.270 3.876 3.478 4.212 . 0 0 "[ . 1 . 2 . ]" 1
145 1 13 GLU H 2 39 LEU QD . . 4.790 3.493 3.255 3.846 . 0 0 "[ . 1 . 2 . ]" 1
146 1 14 ALA HA 1 16 ASN H . . 4.780 4.053 3.794 4.581 . 0 0 "[ . 1 . 2 . ]" 1
147 1 14 ALA HA 1 17 PHE HB2 . . 4.010 2.891 2.691 3.054 . 0 0 "[ . 1 . 2 . ]" 1
148 1 14 ALA HA 1 17 PHE HB3 . . 3.890 2.238 1.944 2.417 . 0 0 "[ . 1 . 2 . ]" 1
149 1 14 ALA HA 1 17 PHE H . . 4.270 3.011 2.837 3.261 . 0 0 "[ . 1 . 2 . ]" 1
150 1 14 ALA HA 1 18 GLU H . . 4.740 3.722 3.393 3.955 . 0 0 "[ . 1 . 2 . ]" 1
151 1 14 ALA HA 2 39 LEU QD . . 3.670 2.124 1.843 2.514 . 0 0 "[ . 1 . 2 . ]" 1
152 1 14 ALA HA 1 75 ILE MD . . 3.950 3.996 3.381 4.257 0.307 6 0 "[ . 1 . 2 . ]" 1
153 1 14 ALA HA 1 75 ILE MG . . 4.200 3.797 3.263 4.278 0.078 11 0 "[ . 1 . 2 . ]" 1
154 1 14 ALA H 1 14 ALA MB . . 3.380 2.078 1.941 2.161 . 0 0 "[ . 1 . 2 . ]" 1
155 1 14 ALA H 1 15 GLY H . . 3.970 2.780 2.486 2.901 . 0 0 "[ . 1 . 2 . ]" 1
156 1 14 ALA H 2 39 LEU QD . . 4.070 2.275 1.975 2.859 . 0 0 "[ . 1 . 2 . ]" 1
157 1 14 ALA MB 1 15 GLY H . . 3.890 2.481 2.260 2.897 . 0 0 "[ . 1 . 2 . ]" 1
158 1 14 ALA MB 1 16 ASN H . . 5.140 4.363 4.190 4.882 . 0 0 "[ . 1 . 2 . ]" 1
159 1 14 ALA MB 1 17 PHE HB2 . . 4.480 4.459 4.251 4.598 0.118 6 0 "[ . 1 . 2 . ]" 1
160 1 14 ALA MB 1 17 PHE HB3 . . 4.270 3.569 3.271 3.772 . 0 0 "[ . 1 . 2 . ]" 1
161 1 14 ALA MB 1 17 PHE H . . 5.180 4.229 4.085 4.444 . 0 0 "[ . 1 . 2 . ]" 1
162 1 14 ALA MB 1 18 GLU H . . 5.500 4.117 3.803 4.433 . 0 0 "[ . 1 . 2 . ]" 1
163 1 14 ALA MB 2 39 LEU QD . . 3.590 2.056 1.770 2.649 . 0 0 "[ . 1 . 2 . ]" 1
164 1 14 ALA MB 1 75 ILE HB . . 4.630 3.122 2.482 3.418 . 0 0 "[ . 1 . 2 . ]" 1
165 1 14 ALA MB 1 75 ILE MD . . 3.700 3.159 2.508 3.501 . 0 0 "[ . 1 . 2 . ]" 1
166 1 14 ALA MB 1 75 ILE MG . . 3.240 1.912 1.687 2.285 . 0 0 "[ . 1 . 2 . ]" 1
167 1 15 GLY HA3 1 18 GLU H . . 4.740 3.784 3.576 3.989 . 0 0 "[ . 1 . 2 . ]" 1
168 1 15 GLY H 1 16 ASN QB . . 5.170 4.553 4.310 4.914 . 0 0 "[ . 1 . 2 . ]" 1
169 1 15 GLY H 1 18 GLU H . . 5.380 4.827 4.655 5.019 . 0 0 "[ . 1 . 2 . ]" 1
170 1 15 GLY H 1 75 ILE MG . . 5.290 5.078 4.768 5.364 0.074 8 0 "[ . 1 . 2 . ]" 1
171 1 16 ASN HA 1 19 ARG HB2 . . 3.930 3.329 3.158 3.406 . 0 0 "[ . 1 . 2 . ]" 1
172 1 16 ASN HA 1 19 ARG HB3 . . 4.240 4.243 4.115 4.320 0.080 8 0 "[ . 1 . 2 . ]" 1
173 1 16 ASN HA 1 19 ARG QD . . 3.830 3.736 3.571 3.815 . 0 0 "[ . 1 . 2 . ]" 1
174 1 16 ASN QB 1 17 PHE H . . 4.440 3.003 2.736 3.603 . 0 0 "[ . 1 . 2 . ]" 1
175 1 16 ASN QD 1 20 ILE MD . . 4.590 2.965 1.754 4.479 . 0 0 "[ . 1 . 2 . ]" 1
176 1 16 ASN H 1 16 ASN QB . . 3.600 2.142 2.050 2.441 . 0 0 "[ . 1 . 2 . ]" 1
177 1 16 ASN H 1 16 ASN QD . . 5.500 3.945 2.821 4.375 . 0 0 "[ . 1 . 2 . ]" 1
178 1 16 ASN H 1 17 PHE H . . 3.790 2.361 2.261 2.544 . 0 0 "[ . 1 . 2 . ]" 1
179 1 16 ASN H 1 18 GLU H . . 4.990 4.306 4.202 4.518 . 0 0 "[ . 1 . 2 . ]" 1
180 1 16 ASN H 1 20 ILE MD . . 5.380 5.346 5.125 5.525 0.145 22 0 "[ . 1 . 2 . ]" 1
181 1 17 PHE HA 1 19 ARG H . . 4.880 3.895 3.714 4.036 . 0 0 "[ . 1 . 2 . ]" 1
182 1 17 PHE HA 1 20 ILE HB . . 3.820 2.785 2.672 2.891 . 0 0 "[ . 1 . 2 . ]" 1
183 1 17 PHE HA 1 20 ILE H . . 4.890 2.985 2.888 3.040 . 0 0 "[ . 1 . 2 . ]" 1
184 1 17 PHE HA 1 20 ILE MD . . 3.430 1.987 1.837 2.157 . 0 0 "[ . 1 . 2 . ]" 1
185 1 17 PHE HA 1 21 SER H . . 3.870 4.049 3.934 4.116 0.246 19 0 "[ . 1 . 2 . ]" 1
186 1 17 PHE HB2 1 18 GLU H . . 4.850 3.708 3.673 3.751 . 0 0 "[ . 1 . 2 . ]" 1
187 1 17 PHE HB2 2 35 SER QB . . 5.250 2.410 2.054 2.913 . 0 0 "[ . 1 . 2 . ]" 1
188 1 17 PHE HB2 2 39 LEU QD . . 4.440 2.019 1.909 2.296 . 0 0 "[ . 1 . 2 . ]" 1
189 1 17 PHE HB3 1 18 GLU H . . 4.350 2.224 2.173 2.289 . 0 0 "[ . 1 . 2 . ]" 1
190 1 17 PHE HB3 2 39 LEU QD . . 4.580 2.771 2.418 3.064 . 0 0 "[ . 1 . 2 . ]" 1
191 1 17 PHE H 1 17 PHE HB2 . . 3.920 2.475 2.376 2.522 . 0 0 "[ . 1 . 2 . ]" 1
192 1 17 PHE H 1 17 PHE HB3 . . 3.950 2.251 2.220 2.319 . 0 0 "[ . 1 . 2 . ]" 1
193 1 17 PHE H 1 18 GLU HB2 . . 5.340 4.437 4.299 4.613 . 0 0 "[ . 1 . 2 . ]" 1
194 1 17 PHE H 1 18 GLU H . . 4.150 2.688 2.626 2.860 . 0 0 "[ . 1 . 2 . ]" 1
195 1 17 PHE H 1 19 ARG HB2 . . 5.260 5.195 5.089 5.308 0.048 7 0 "[ . 1 . 2 . ]" 1
196 1 17 PHE H 1 19 ARG H . . 5.480 4.005 3.912 4.123 . 0 0 "[ . 1 . 2 . ]" 1
197 1 17 PHE H 1 20 ILE HB . . 5.500 5.531 5.410 5.640 0.140 23 0 "[ . 1 . 2 . ]" 1
198 1 17 PHE H 1 20 ILE MD . . 4.900 4.012 3.754 4.154 . 0 0 "[ . 1 . 2 . ]" 1
199 1 17 PHE H 2 39 LEU QD . . 4.680 3.601 3.427 3.936 . 0 0 "[ . 1 . 2 . ]" 1
200 1 17 PHE QD 2 36 LEU QD . . 5.230 3.459 3.198 3.662 . 0 0 "[ . 1 . 2 . ]" 1
201 1 17 PHE QD 1 71 ILE MG . . 3.960 3.888 3.587 4.168 0.208 8 0 "[ . 1 . 2 . ]" 1
202 1 17 PHE QE 1 18 GLU HA . . 4.410 4.258 4.181 4.348 . 0 0 "[ . 1 . 2 . ]" 1
203 1 17 PHE QE 1 18 GLU QG . . 4.480 4.355 4.235 4.421 . 0 0 "[ . 1 . 2 . ]" 1
204 1 17 PHE QE 1 18 GLU H . . 4.960 5.132 5.077 5.182 0.222 27 0 "[ . 1 . 2 . ]" 1
205 1 17 PHE QE 1 20 ILE HB . . 4.810 4.420 4.178 4.549 . 0 0 "[ . 1 . 2 . ]" 1
206 1 17 PHE QE 1 20 ILE MD . . 4.170 4.281 4.223 4.346 0.176 6 0 "[ . 1 . 2 . ]" 1
207 1 17 PHE QE 1 20 ILE MG . . 4.720 4.234 4.046 4.449 . 0 0 "[ . 1 . 2 . ]" 1
208 1 17 PHE QE 2 35 SER QB . . 4.250 3.758 3.399 3.887 . 0 0 "[ . 1 . 2 . ]" 1
209 1 17 PHE QE 2 35 SER H . . 5.500 5.162 4.757 5.453 . 0 0 "[ . 1 . 2 . ]" 1
210 1 17 PHE QE 2 36 LEU HB2 . . 5.500 5.136 4.831 5.402 . 0 0 "[ . 1 . 2 . ]" 1
211 1 17 PHE QE 2 36 LEU HG . . 5.500 4.847 4.518 5.164 . 0 0 "[ . 1 . 2 . ]" 1
212 1 17 PHE QE 2 36 LEU H . . 5.480 4.714 4.163 5.112 . 0 0 "[ . 1 . 2 . ]" 1
213 1 17 PHE QE 2 36 LEU QD . . 4.810 2.385 2.153 2.598 . 0 0 "[ . 1 . 2 . ]" 1
214 1 17 PHE QE 2 39 LEU QD . . 4.290 3.902 3.536 4.256 . 0 0 "[ . 1 . 2 . ]" 1
215 1 17 PHE QE 1 71 ILE MD . . 4.620 4.017 3.703 4.367 . 0 0 "[ . 1 . 2 . ]" 1
216 1 17 PHE QE 1 71 ILE MG . . 4.260 2.559 2.155 2.746 . 0 0 "[ . 1 . 2 . ]" 1
217 1 18 GLU HA 1 18 GLU QG . . 3.620 2.077 2.023 2.154 . 0 0 "[ . 1 . 2 . ]" 1
218 1 18 GLU HA 1 21 SER HB2 . . 4.170 3.720 2.476 4.272 0.102 12 0 "[ . 1 . 2 . ]" 1
219 1 18 GLU HA 1 21 SER HB3 . . 3.650 3.384 2.435 4.243 0.593 26 5 "[ . -1 . 2** *.+ ]" 1
220 1 18 GLU HA 1 72 SER QB . . 3.460 3.385 3.153 3.504 0.044 2 0 "[ . 1 . 2 . ]" 1
221 1 18 GLU HB2 1 19 ARG H . . 3.940 3.010 2.894 3.131 . 0 0 "[ . 1 . 2 . ]" 1
222 1 18 GLU QG 1 72 SER HA . . 5.120 3.962 3.631 4.290 . 0 0 "[ . 1 . 2 . ]" 1
223 1 18 GLU H 1 18 GLU HB2 . . 3.570 2.295 2.200 2.467 . 0 0 "[ . 1 . 2 . ]" 1
224 1 18 GLU H 1 18 GLU QG . . 4.050 2.729 2.363 3.001 . 0 0 "[ . 1 . 2 . ]" 1
225 1 18 GLU H 1 19 ARG H . . 4.180 2.963 2.932 2.992 . 0 0 "[ . 1 . 2 . ]" 1
226 1 18 GLU H 1 20 ILE MD . . 5.500 5.060 4.846 5.224 . 0 0 "[ . 1 . 2 . ]" 1
227 1 18 GLU H 1 21 SER H . . 5.500 4.747 4.645 4.938 . 0 0 "[ . 1 . 2 . ]" 1
228 1 19 ARG HA 1 19 ARG QD . . 4.620 3.776 3.442 3.990 . 0 0 "[ . 1 . 2 . ]" 1
229 1 19 ARG HA 1 19 ARG HG2 . . 3.780 3.030 2.807 3.278 . 0 0 "[ . 1 . 2 . ]" 1
230 1 19 ARG HA 1 19 ARG HG3 . . 3.580 2.113 2.010 2.241 . 0 0 "[ . 1 . 2 . ]" 1
231 1 19 ARG HB2 1 20 ILE H . . 4.510 3.414 3.326 3.492 . 0 0 "[ . 1 . 2 . ]" 1
232 1 19 ARG HB3 1 20 ILE H . . 5.050 2.700 2.557 2.850 . 0 0 "[ . 1 . 2 . ]" 1
233 1 19 ARG HB3 2 28 LEU QD . . 5.110 4.864 4.655 5.083 . 0 0 "[ . 1 . 2 . ]" 1
234 1 19 ARG H 1 19 ARG HB2 . . 3.750 2.107 2.064 2.165 . 0 0 "[ . 1 . 2 . ]" 1
235 1 19 ARG H 1 19 ARG HB3 . . 3.720 2.973 2.891 3.047 . 0 0 "[ . 1 . 2 . ]" 1
236 1 19 ARG H 1 19 ARG QD . . 5.230 4.006 3.684 4.198 . 0 0 "[ . 1 . 2 . ]" 1
237 1 19 ARG H 1 19 ARG HG2 . . 4.800 4.588 4.523 4.641 . 0 0 "[ . 1 . 2 . ]" 1
238 1 19 ARG H 1 19 ARG HG3 . . 4.440 4.012 3.924 4.164 . 0 0 "[ . 1 . 2 . ]" 1
239 1 19 ARG H 1 20 ILE HA . . 5.500 5.159 5.075 5.212 . 0 0 "[ . 1 . 2 . ]" 1
240 1 19 ARG H 1 20 ILE H . . 3.540 2.597 2.486 2.665 . 0 0 "[ . 1 . 2 . ]" 1
241 1 19 ARG H 1 20 ILE MD . . 5.050 4.645 4.513 4.934 . 0 0 "[ . 1 . 2 . ]" 1
242 1 19 ARG H 1 21 SER H . . 5.160 4.105 3.964 4.354 . 0 0 "[ . 1 . 2 . ]" 1
243 1 20 ILE HA 1 20 ILE HG12 . . 4.190 2.756 2.600 2.826 . 0 0 "[ . 1 . 2 . ]" 1
244 1 20 ILE HA 1 20 ILE HG13 . . 4.200 2.828 2.754 3.040 . 0 0 "[ . 1 . 2 . ]" 1
245 1 20 ILE HA 1 20 ILE MD . . 4.250 3.894 3.854 3.920 . 0 0 "[ . 1 . 2 . ]" 1
246 1 20 ILE HA 1 20 ILE MG . . 3.490 2.416 2.277 2.467 . 0 0 "[ . 1 . 2 . ]" 1
247 1 20 ILE HA 1 21 SER HA . . 4.640 4.767 4.750 4.808 0.168 25 0 "[ . 1 . 2 . ]" 1
248 1 20 ILE HA 1 23 ASP HB2 . . 4.450 2.836 2.249 3.817 . 0 0 "[ . 1 . 2 . ]" 1
249 1 20 ILE HA 1 23 ASP HB3 . . 4.630 3.786 2.659 4.473 . 0 0 "[ . 1 . 2 . ]" 1
250 1 20 ILE HA 1 23 ASP H . . 4.710 3.633 3.404 3.813 . 0 0 "[ . 1 . 2 . ]" 1
251 1 20 ILE HA 1 24 LEU HB2 . . 4.580 4.411 4.049 4.772 0.192 5 0 "[ . 1 . 2 . ]" 1
252 1 20 ILE HA 2 28 LEU QD . . 3.830 2.171 2.007 2.439 . 0 0 "[ . 1 . 2 . ]" 1
253 1 20 ILE HB 2 28 LEU QD . . 5.050 3.944 3.781 4.356 . 0 0 "[ . 1 . 2 . ]" 1
254 1 20 ILE HG12 2 31 GLU QG . . 5.190 3.516 2.116 4.058 . 0 0 "[ . 1 . 2 . ]" 1
255 1 20 ILE H 1 20 ILE HB . . 3.990 2.473 2.421 2.513 . 0 0 "[ . 1 . 2 . ]" 1
256 1 20 ILE H 1 20 ILE HG13 . . 4.170 1.939 1.867 2.058 . 0 0 "[ . 1 . 2 . ]" 1
257 1 20 ILE H 1 20 ILE MD . . 4.000 3.170 3.076 3.408 . 0 0 "[ . 1 . 2 . ]" 1
258 1 20 ILE H 1 20 ILE MG . . 4.290 3.712 3.706 3.720 . 0 0 "[ . 1 . 2 . ]" 1
259 1 20 ILE H 1 21 SER H . . 4.350 2.691 2.570 2.862 . 0 0 "[ . 1 . 2 . ]" 1
260 1 20 ILE MD 1 21 SER H . . 4.160 4.217 4.143 4.340 0.180 22 0 "[ . 1 . 2 . ]" 1
261 1 20 ILE MD 2 28 LEU HA . . 4.620 4.815 4.582 4.880 0.260 7 0 "[ . 1 . 2 . ]" 1
262 1 20 ILE MD 2 28 LEU QD . . 4.220 4.092 3.884 4.265 0.045 21 0 "[ . 1 . 2 . ]" 1
263 1 20 ILE MD 2 31 GLU HA . . 4.330 3.639 3.436 4.239 . 0 0 "[ . 1 . 2 . ]" 1
264 1 20 ILE MD 2 31 GLU QB . . 3.840 2.114 1.912 3.579 . 0 0 "[ . 1 . 2 . ]" 1
265 1 20 ILE MD 2 31 GLU QG . . 4.150 3.540 1.684 3.888 . 0 0 "[ . 1 . 2 . ]" 1
266 1 20 ILE MD 2 31 GLU H . . 4.960 4.387 4.176 4.898 . 0 0 "[ . 1 . 2 . ]" 1
267 1 20 ILE MD 2 32 GLY QA . . 4.130 1.859 1.723 1.973 . 0 0 "[ . 1 . 2 . ]" 1
268 1 20 ILE MD 2 32 GLY H . . 4.140 3.042 2.813 3.444 . 0 0 "[ . 1 . 2 . ]" 1
269 1 20 ILE MD 2 33 LYS H . . 5.500 4.511 4.340 4.854 . 0 0 "[ . 1 . 2 . ]" 1
270 1 20 ILE MD 2 34 GLN H . . 5.500 4.452 4.320 4.831 . 0 0 "[ . 1 . 2 . ]" 1
271 1 20 ILE MD 2 35 SER HA . . 4.770 4.995 4.851 5.121 0.351 27 0 "[ . 1 . 2 . ]" 1
272 1 20 ILE MD 2 35 SER QB . . 3.520 2.794 2.601 2.871 . 0 0 "[ . 1 . 2 . ]" 1
273 1 20 ILE MG 1 21 SER HA . . 3.820 3.592 3.327 3.803 . 0 0 "[ . 1 . 2 . ]" 1
274 1 20 ILE MG 1 24 LEU HB2 . . 4.170 3.182 2.627 3.773 . 0 0 "[ . 1 . 2 . ]" 1
275 1 20 ILE MG 1 24 LEU QD . . 3.320 2.704 1.923 3.128 . 0 0 "[ . 1 . 2 . ]" 1
276 1 20 ILE MG 2 28 LEU HA . . 4.120 2.720 2.534 3.084 . 0 0 "[ . 1 . 2 . ]" 1
277 1 20 ILE MG 2 28 LEU HB3 . . 4.540 2.742 2.587 2.976 . 0 0 "[ . 1 . 2 . ]" 1
278 1 20 ILE MG 2 28 LEU HB2 . . 4.360 4.083 3.931 4.314 . 0 0 "[ . 1 . 2 . ]" 1
279 1 20 ILE MG 2 28 LEU HG . . 4.670 3.896 3.684 4.259 . 0 0 "[ . 1 . 2 . ]" 1
280 1 20 ILE MG 2 28 LEU QD . . 3.150 1.889 1.728 2.240 . 0 0 "[ . 1 . 2 . ]" 1
281 1 20 ILE MG 2 29 LEU HA . . 5.430 3.563 3.169 3.999 . 0 0 "[ . 1 . 2 . ]" 1
282 1 20 ILE MG 2 29 LEU QD . . 4.590 3.999 3.622 4.438 . 0 0 "[ . 1 . 2 . ]" 1
283 1 20 ILE MG 2 31 GLU HA . . 4.880 4.528 4.258 4.960 0.080 18 0 "[ . 1 . 2 . ]" 1
284 1 20 ILE MG 2 31 GLU QB . . 4.360 2.440 1.985 3.666 . 0 0 "[ . 1 . 2 . ]" 1
285 1 20 ILE MG 2 31 GLU QG . . 5.230 3.855 1.754 4.460 . 0 0 "[ . 1 . 2 . ]" 1
286 1 20 ILE MG 2 32 GLY QA . . 4.010 2.112 1.919 2.374 . 0 0 "[ . 1 . 2 . ]" 1
287 1 20 ILE MG 1 68 LEU QD . . 4.220 3.784 3.383 4.032 . 0 0 "[ . 1 . 2 . ]" 1
288 1 21 SER HA 1 24 LEU HB2 . . 4.140 2.904 2.197 3.581 . 0 0 "[ . 1 . 2 . ]" 1
289 1 21 SER HA 1 24 LEU HB3 . . 4.200 3.121 2.339 3.794 . 0 0 "[ . 1 . 2 . ]" 1
290 1 21 SER HA 1 24 LEU QD . . 4.120 2.908 2.180 3.280 . 0 0 "[ . 1 . 2 . ]" 1
291 1 21 SER HA 1 68 LEU QD . . 4.030 2.082 1.777 2.430 . 0 0 "[ . 1 . 2 . ]" 1
292 1 21 SER HB2 1 68 LEU QD . . 3.990 2.777 2.015 3.673 . 0 0 "[ . 1 . 2 . ]" 1
293 1 21 SER HB3 1 22 GLY H . . 4.570 3.240 2.459 4.077 . 0 0 "[ . 1 . 2 . ]" 1
294 1 21 SER HB3 1 68 LEU QD . . 3.920 3.029 1.824 3.728 . 0 0 "[ . 1 . 2 . ]" 1
295 1 21 SER H 1 21 SER HB3 . . 3.960 2.702 2.088 3.487 . 0 0 "[ . 1 . 2 . ]" 1
296 1 21 SER H 1 22 GLY H . . 4.240 2.799 2.709 2.907 . 0 0 "[ . 1 . 2 . ]" 1
297 1 21 SER H 1 68 LEU QD . . 5.240 3.935 3.508 4.376 . 0 0 "[ . 1 . 2 . ]" 1
298 1 22 GLY HA2 1 25 LYS QB . . 4.960 4.362 4.020 4.842 . 0 0 "[ . 1 . 2 . ]" 1
299 1 22 GLY HA3 1 25 LYS QB . . 4.900 2.876 2.527 3.436 . 0 0 "[ . 1 . 2 . ]" 1
300 1 22 GLY HA3 1 25 LYS H . . 4.930 3.483 3.309 3.589 . 0 0 "[ . 1 . 2 . ]" 1
301 1 22 GLY HA3 1 25 LYS QD . . 4.960 4.896 4.234 5.167 0.207 23 0 "[ . 1 . 2 . ]" 1
302 1 22 GLY H 1 23 ASP HB2 . . 5.320 4.757 4.541 5.138 . 0 0 "[ . 1 . 2 . ]" 1
303 1 22 GLY H 1 23 ASP H . . 3.930 2.857 2.742 2.998 . 0 0 "[ . 1 . 2 . ]" 1
304 1 22 GLY H 1 24 LEU H . . 4.880 4.100 3.872 4.328 . 0 0 "[ . 1 . 2 . ]" 1
305 1 22 GLY H 1 68 LEU QD . . 5.500 4.321 3.923 4.722 . 0 0 "[ . 1 . 2 . ]" 1
306 1 23 ASP HA 1 26 THR HA . . 5.000 4.932 4.760 5.045 0.045 16 0 "[ . 1 . 2 . ]" 1
307 1 23 ASP HA 1 26 THR HB . . 3.190 2.054 1.980 2.160 . 0 0 "[ . 1 . 2 . ]" 1
308 1 23 ASP HA 1 26 THR MG . . 3.750 3.366 3.243 3.563 . 0 0 "[ . 1 . 2 . ]" 1
309 1 23 ASP HA 2 28 LEU QD . . 4.210 3.663 3.455 3.831 . 0 0 "[ . 1 . 2 . ]" 1
310 1 23 ASP HB2 1 24 LEU H . . 4.460 2.916 2.454 3.828 . 0 0 "[ . 1 . 2 . ]" 1
311 1 23 ASP HB2 1 25 LYS H . . 5.350 5.217 4.812 6.052 0.702 11 2 "[ . 1+ - . 2 . ]" 1
312 1 23 ASP HB2 2 28 LEU QD . . 4.220 2.203 1.843 3.040 . 0 0 "[ . 1 . 2 . ]" 1
313 1 23 ASP HB3 1 24 LEU H . . 4.600 3.089 2.306 3.555 . 0 0 "[ . 1 . 2 . ]" 1
314 1 23 ASP HB3 2 28 LEU QD . . 4.050 1.837 1.671 2.067 . 0 0 "[ . 1 . 2 . ]" 1
315 1 23 ASP H 1 23 ASP HB2 . . 3.760 2.210 2.075 2.343 . 0 0 "[ . 1 . 2 . ]" 1
316 1 23 ASP H 1 23 ASP HB3 . . 3.970 3.289 2.573 3.524 . 0 0 "[ . 1 . 2 . ]" 1
317 1 23 ASP H 1 24 LEU HB2 . . 4.950 4.696 4.326 5.056 0.106 13 0 "[ . 1 . 2 . ]" 1
318 1 23 ASP H 1 24 LEU H . . 3.830 2.738 2.550 2.894 . 0 0 "[ . 1 . 2 . ]" 1
319 1 23 ASP H 1 25 LYS H . . 5.100 4.187 4.004 4.420 . 0 0 "[ . 1 . 2 . ]" 1
320 1 23 ASP H 2 28 LEU QD . . 4.750 3.540 3.259 3.754 . 0 0 "[ . 1 . 2 . ]" 1
321 1 24 LEU HA 1 24 LEU QD . . 3.670 2.142 1.882 2.315 . 0 0 "[ . 1 . 2 . ]" 1
322 1 24 LEU HA 2 25 ILE HA . . 5.490 3.832 3.539 4.042 . 0 0 "[ . 1 . 2 . ]" 1
323 1 24 LEU HA 2 25 ILE MD . . 4.230 3.729 3.517 3.936 . 0 0 "[ . 1 . 2 . ]" 1
324 1 24 LEU HA 2 28 LEU HB3 . . 4.690 3.537 3.229 3.833 . 0 0 "[ . 1 . 2 . ]" 1
325 1 24 LEU HA 2 28 LEU QD . . 3.620 2.033 1.761 2.302 . 0 0 "[ . 1 . 2 . ]" 1
326 1 24 LEU HB2 2 28 LEU QD . . 4.080 2.740 1.996 3.700 . 0 0 "[ . 1 . 2 . ]" 1
327 1 24 LEU HB2 2 29 LEU QD . . 4.980 4.370 3.898 4.958 . 0 0 "[ . 1 . 2 . ]" 1
328 1 24 LEU HB2 1 68 LEU QD . . 3.860 2.872 2.092 3.438 . 0 0 "[ . 1 . 2 . ]" 1
329 1 24 LEU HB3 1 25 LYS H . . 4.440 2.918 2.517 3.306 . 0 0 "[ . 1 . 2 . ]" 1
330 1 24 LEU HB3 1 28 ILE MD . . 3.890 3.654 3.056 4.023 0.133 3 0 "[ . 1 . 2 . ]" 1
331 1 24 LEU HB3 2 28 LEU QD . . 4.990 3.674 3.198 4.243 . 0 0 "[ . 1 . 2 . ]" 1
332 1 24 LEU HB3 2 29 LEU QD . . 5.090 4.343 3.897 4.944 . 0 0 "[ . 1 . 2 . ]" 1
333 1 24 LEU HB3 1 68 LEU QD . . 4.250 2.104 1.923 2.409 . 0 0 "[ . 1 . 2 . ]" 1
334 1 24 LEU HG 1 25 LYS H . . 5.090 4.597 3.927 5.099 0.009 24 0 "[ . 1 . 2 . ]" 1
335 1 24 LEU HG 2 25 ILE HA . . 5.470 3.955 3.737 4.125 . 0 0 "[ . 1 . 2 . ]" 1
336 1 24 LEU HG 2 28 LEU HB2 . . 4.610 3.974 3.068 4.685 0.075 10 0 "[ . 1 . 2 . ]" 1
337 1 24 LEU HG 2 28 LEU QD . . 3.770 3.038 2.017 3.711 . 0 0 "[ . 1 . 2 . ]" 1
338 1 24 LEU HG 2 29 LEU QD . . 5.030 3.489 3.262 3.754 . 0 0 "[ . 1 . 2 . ]" 1
339 1 24 LEU HG 1 68 LEU QD . . 4.680 3.464 2.915 4.212 . 0 0 "[ . 1 . 2 . ]" 1
340 1 24 LEU H 1 24 LEU HB2 . . 3.640 2.157 1.999 2.342 . 0 0 "[ . 1 . 2 . ]" 1
341 1 24 LEU H 1 24 LEU HB3 . . 4.050 2.943 2.535 3.368 . 0 0 "[ . 1 . 2 . ]" 1
342 1 24 LEU H 1 24 LEU HG . . 4.430 3.872 3.089 4.475 0.045 21 0 "[ . 1 . 2 . ]" 1
343 1 24 LEU H 1 24 LEU QD . . 4.630 3.525 3.399 3.607 . 0 0 "[ . 1 . 2 . ]" 1
344 1 24 LEU H 1 25 LYS H . . 4.140 2.768 2.632 2.877 . 0 0 "[ . 1 . 2 . ]" 1
345 1 24 LEU H 1 26 THR H . . 5.490 4.026 3.827 4.265 . 0 0 "[ . 1 . 2 . ]" 1
346 1 24 LEU H 2 28 LEU QD . . 4.250 2.359 1.891 3.077 . 0 0 "[ . 1 . 2 . ]" 1
347 1 24 LEU QD 2 25 ILE HA . . 3.880 1.903 1.800 1.972 . 0 0 "[ . 1 . 2 . ]" 1
348 1 24 LEU QD 2 28 LEU HB2 . . 4.100 2.148 1.907 2.453 . 0 0 "[ . 1 . 2 . ]" 1
349 1 24 LEU QD 2 28 LEU QD . . 3.370 2.069 1.859 2.434 . 0 0 "[ . 1 . 2 . ]" 1
350 1 24 LEU QD 2 29 LEU HA . . 4.330 2.863 2.431 3.174 . 0 0 "[ . 1 . 2 . ]" 1
351 1 24 LEU QD 2 29 LEU HB3 . . 4.840 4.286 4.063 4.442 . 0 0 "[ . 1 . 2 . ]" 1
352 1 24 LEU QD 2 29 LEU HG . . 3.870 3.198 1.956 3.698 . 0 0 "[ . 1 . 2 . ]" 1
353 1 24 LEU QD 2 29 LEU QD . . 3.300 1.651 1.542 1.887 . 0 0 "[ . 1 . 2 . ]" 1
354 1 24 LEU QD 2 58 TRP HH2 . . 4.250 2.576 1.945 3.476 . 0 0 "[ . 1 . 2 . ]" 1
355 1 24 LEU QD 2 58 TRP HZ2 . . 5.020 3.293 2.668 3.953 . 0 0 "[ . 1 . 2 . ]" 1
356 1 24 LEU QD 2 58 TRP HZ3 . . 4.990 3.785 3.436 4.322 . 0 0 "[ . 1 . 2 . ]" 1
357 1 24 LEU QD 2 62 ALA MB . . 4.510 4.260 3.993 4.434 . 0 0 "[ . 1 . 2 . ]" 1
358 1 24 LEU QD 1 68 LEU QD . . 3.660 1.777 1.593 2.249 . 0 0 "[ . 1 . 2 . ]" 1
359 1 24 LEU QD 1 25 LYS H . . 5.160 4.064 3.774 4.199 . 0 0 "[ . 1 . 2 . ]" 1
360 1 24 LEU QD 2 25 ILE HB . . 4.340 3.650 3.487 3.772 . 0 0 "[ . 1 . 2 . ]" 1
361 1 24 LEU QD 2 25 ILE H . . 4.910 4.125 3.983 4.245 . 0 0 "[ . 1 . 2 . ]" 1
362 1 24 LEU QD 2 25 ILE MD . . 3.270 3.185 2.972 3.317 0.047 1 0 "[ . 1 . 2 . ]" 1
363 1 24 LEU QD 2 25 ILE MG . . 3.110 2.238 2.049 2.470 . 0 0 "[ . 1 . 2 . ]" 1
364 1 24 LEU QD 2 26 HIS H . . 4.800 4.692 4.437 4.900 0.100 6 0 "[ . 1 . 2 . ]" 1
365 1 24 LEU QD 2 28 LEU HA . . 4.690 3.967 3.777 4.304 . 0 0 "[ . 1 . 2 . ]" 1
366 1 24 LEU QD 2 28 LEU HB3 . . 3.900 1.986 1.731 2.496 . 0 0 "[ . 1 . 2 . ]" 1
367 1 24 LEU QD 2 28 LEU HG . . 4.310 3.921 3.641 4.299 . 0 0 "[ . 1 . 2 . ]" 1
368 1 24 LEU QD 2 29 LEU HB2 . . 4.580 3.426 3.207 3.603 . 0 0 "[ . 1 . 2 . ]" 1
369 1 25 LYS HA 1 25 LYS QE . . 4.720 4.342 3.905 4.571 . 0 0 "[ . 1 . 2 . ]" 1
370 1 25 LYS HA 1 25 LYS QD . . 4.310 3.486 2.699 4.147 . 0 0 "[ . 1 . 2 . ]" 1
371 1 25 LYS HA 1 25 LYS QG . . 3.750 2.628 2.100 2.782 . 0 0 "[ . 1 . 2 . ]" 1
372 1 25 LYS HA 1 28 ILE HB . . 4.130 2.306 2.095 2.472 . 0 0 "[ . 1 . 2 . ]" 1
373 1 25 LYS HA 1 28 ILE MD . . 3.930 2.661 2.104 2.962 . 0 0 "[ . 1 . 2 . ]" 1
374 1 25 LYS HA 1 28 ILE MG . . 4.210 3.428 3.062 3.701 . 0 0 "[ . 1 . 2 . ]" 1
375 1 25 LYS HA 1 65 LYS QE . . 4.240 3.800 1.967 4.326 0.086 1 0 "[ . 1 . 2 . ]" 1
376 1 25 LYS QB 1 25 LYS QE . . 4.060 2.149 1.895 2.547 . 0 0 "[ . 1 . 2 . ]" 1
377 1 25 LYS QB 1 26 THR H . . 3.930 2.885 2.591 3.144 . 0 0 "[ . 1 . 2 . ]" 1
378 1 25 LYS QB 1 28 ILE MD . . 4.190 4.025 3.691 4.172 . 0 0 "[ . 1 . 2 . ]" 1
379 1 25 LYS QB 1 28 ILE MG . . 4.700 4.493 4.261 4.655 . 0 0 "[ . 1 . 2 . ]" 1
380 1 25 LYS QE 1 68 LEU QD . . 4.330 3.558 2.611 3.841 . 0 0 "[ . 1 . 2 . ]" 1
381 1 25 LYS H 1 25 LYS QB . . 3.490 2.225 2.038 2.643 . 0 0 "[ . 1 . 2 . ]" 1
382 1 25 LYS H 1 25 LYS QG . . 4.010 3.229 1.855 3.920 . 0 0 "[ . 1 . 2 . ]" 1
383 1 25 LYS H 1 26 THR H . . 4.010 2.530 2.452 2.670 . 0 0 "[ . 1 . 2 . ]" 1
384 1 25 LYS H 2 28 LEU QD . . 5.020 4.278 3.918 4.672 . 0 0 "[ . 1 . 2 . ]" 1
385 1 25 LYS QD 1 26 THR H . . 5.260 5.185 4.604 5.388 0.128 16 0 "[ . 1 . 2 . ]" 1
386 1 25 LYS QD 1 28 ILE MG . . 4.400 4.506 4.357 4.612 0.212 16 0 "[ . 1 . 2 . ]" 1
387 1 25 LYS QD 1 68 LEU QD . . 4.120 3.346 1.723 4.268 0.148 6 0 "[ . 1 . 2 . ]" 1
388 1 25 LYS QG 1 26 THR H . . 5.040 3.486 2.975 4.605 . 0 0 "[ . 1 . 2 . ]" 1
389 1 26 THR HA 1 26 THR MG . . 3.100 2.600 2.501 2.674 . 0 0 "[ . 1 . 2 . ]" 1
390 1 26 THR HA 1 29 ASP HB2 . . 3.760 2.990 2.542 3.321 . 0 0 "[ . 1 . 2 . ]" 1
391 1 26 THR HA 1 29 ASP HB3 . . 4.040 3.621 3.112 4.066 0.026 17 0 "[ . 1 . 2 . ]" 1
392 1 26 THR HA 1 29 ASP H . . 4.410 3.631 3.451 3.901 . 0 0 "[ . 1 . 2 . ]" 1
393 1 26 THR HA 1 30 GLN QE . . 5.500 3.625 2.639 4.437 . 0 0 "[ . 1 . 2 . ]" 1
394 1 26 THR HA 1 30 GLN H . . 5.020 4.168 4.002 4.395 . 0 0 "[ . 1 . 2 . ]" 1
395 1 26 THR HB 1 27 GLN H . . 4.090 2.742 2.475 2.992 . 0 0 "[ . 1 . 2 . ]" 1
396 1 26 THR HB 1 30 GLN QE . . 5.500 4.414 3.768 4.807 . 0 0 "[ . 1 . 2 . ]" 1
397 1 26 THR H 1 26 THR HB . . 3.730 2.132 2.051 2.230 . 0 0 "[ . 1 . 2 . ]" 1
398 1 26 THR H 1 26 THR MG . . 4.320 3.618 3.562 3.660 . 0 0 "[ . 1 . 2 . ]" 1
399 1 26 THR H 1 27 GLN HA . . 5.240 5.301 5.207 5.397 0.157 9 0 "[ . 1 . 2 . ]" 1
400 1 26 THR H 1 27 GLN HE21 . . 5.410 5.454 3.916 6.355 0.945 21 5 "[ * . 1 -. *+ * . ]" 1
401 1 26 THR H 1 27 GLN HG2 . . 5.420 4.695 4.120 6.389 0.969 10 2 "[ . + . - 2 . ]" 1
402 1 26 THR H 1 28 ILE H . . 5.500 4.198 4.072 4.346 . 0 0 "[ . 1 . 2 . ]" 1
403 1 26 THR H 2 28 LEU QD . . 5.430 4.591 4.283 4.952 . 0 0 "[ . 1 . 2 . ]" 1
404 1 26 THR MG 1 27 GLN HA . . 4.090 3.283 3.081 3.472 . 0 0 "[ . 1 . 2 . ]" 1
405 1 26 THR MG 1 27 GLN HE21 . . 5.120 2.372 1.872 3.368 . 0 0 "[ . 1 . 2 . ]" 1
406 1 26 THR MG 1 27 GLN HE22 . . 5.150 3.027 1.878 3.546 . 0 0 "[ . 1 . 2 . ]" 1
407 1 26 THR MG 1 27 GLN H . . 4.470 3.095 2.757 3.359 . 0 0 "[ . 1 . 2 . ]" 1
408 1 26 THR MG 1 29 ASP HB2 . . 4.640 4.684 4.010 5.056 0.416 16 0 "[ . 1 . 2 . ]" 1
409 1 26 THR MG 1 29 ASP HB3 . . 5.030 4.562 4.072 5.076 0.046 2 0 "[ . 1 . 2 . ]" 1
410 1 26 THR MG 1 30 GLN QE . . 3.950 1.962 1.741 2.325 . 0 0 "[ . 1 . 2 . ]" 1
411 1 26 THR MG 1 30 GLN HG2 . . 4.040 3.545 2.509 4.379 0.339 28 0 "[ . 1 . 2 . ]" 1
412 1 26 THR MG 1 30 GLN HG3 . . 4.360 3.563 2.729 4.469 0.109 17 0 "[ . 1 . 2 . ]" 1
413 1 26 THR MG 1 30 GLN H . . 5.240 4.133 3.969 4.251 . 0 0 "[ . 1 . 2 . ]" 1
414 1 26 THR MG 2 28 LEU QD . . 4.810 4.537 4.352 4.628 . 0 0 "[ . 1 . 2 . ]" 1
415 1 27 GLN HA 1 27 GLN HE21 . . 4.870 2.858 1.950 4.036 . 0 0 "[ . 1 . 2 . ]" 1
416 1 27 GLN HA 1 27 GLN HE22 . . 4.950 3.529 2.835 5.078 0.128 10 0 "[ . 1 . 2 . ]" 1
417 1 27 GLN HA 1 27 GLN HG3 . . 4.120 3.531 2.288 3.838 . 0 0 "[ . 1 . 2 . ]" 1
418 1 27 GLN HA 1 27 GLN HG2 . . 3.870 3.101 2.868 3.689 . 0 0 "[ . 1 . 2 . ]" 1
419 1 27 GLN HA 1 30 GLN HA . . 4.920 5.015 4.923 5.096 0.176 3 0 "[ . 1 . 2 . ]" 1
420 1 27 GLN HA 1 30 GLN HB2 . . 5.000 2.355 2.077 2.785 . 0 0 "[ . 1 . 2 . ]" 1
421 1 27 GLN HA 1 30 GLN HB3 . . 4.180 3.807 3.478 4.185 0.005 20 0 "[ . 1 . 2 . ]" 1
422 1 27 GLN HA 1 30 GLN QE . . 5.500 3.548 1.849 4.236 . 0 0 "[ . 1 . 2 . ]" 1
423 1 27 GLN HA 1 30 GLN HG2 . . 4.530 3.467 2.010 4.668 0.138 14 0 "[ . 1 . 2 . ]" 1
424 1 27 GLN HA 1 30 GLN H . . 4.400 3.210 3.083 3.352 . 0 0 "[ . 1 . 2 . ]" 1
425 1 27 GLN HA 1 31 VAL H . . 5.350 4.234 3.895 4.345 . 0 0 "[ . 1 . 2 . ]" 1
426 1 27 GLN HA 1 31 VAL QG . . 4.710 4.392 4.081 4.647 . 0 0 "[ . 1 . 2 . ]" 1
427 1 27 GLN HA 2 21 ASN HD22 . . 5.280 2.417 2.176 2.797 . 0 0 "[ . 1 . 2 . ]" 1
428 1 27 GLN HA 2 21 ASN HD21 . . 5.030 2.293 1.925 2.630 . 0 0 "[ . 1 . 2 . ]" 1
429 1 27 GLN HA 2 24 SER HB2 . . 5.010 5.063 4.836 5.232 0.222 13 0 "[ . 1 . 2 . ]" 1
430 1 27 GLN HA 2 25 ILE MD . . 4.300 3.931 3.791 4.119 . 0 0 "[ . 1 . 2 . ]" 1
431 1 27 GLN HB2 2 25 ILE MD . . 4.290 1.936 1.756 2.275 . 0 0 "[ . 1 . 2 . ]" 1
432 1 27 GLN HB3 1 27 GLN HE22 . . 5.500 4.538 4.145 5.372 . 0 0 "[ . 1 . 2 . ]" 1
433 1 27 GLN HB3 1 30 GLN H . . 5.230 5.097 4.948 5.274 0.044 17 0 "[ . 1 . 2 . ]" 1
434 1 27 GLN HB3 1 31 VAL H . . 5.430 4.944 4.634 5.106 . 0 0 "[ . 1 . 2 . ]" 1
435 1 27 GLN HB3 1 31 VAL QG . . 4.400 3.856 3.499 4.025 . 0 0 "[ . 1 . 2 . ]" 1
436 1 27 GLN HB3 2 21 ASN HA . . 5.500 2.958 2.449 3.310 . 0 0 "[ . 1 . 2 . ]" 1
437 1 27 GLN HB3 2 21 ASN HD22 . . 5.500 3.490 3.264 3.789 . 0 0 "[ . 1 . 2 . ]" 1
438 1 27 GLN HB3 2 21 ASN HD21 . . 5.500 1.953 1.886 2.192 . 0 0 "[ . 1 . 2 . ]" 1
439 1 27 GLN HB3 2 25 ILE MD . . 4.320 2.104 1.918 2.378 . 0 0 "[ . 1 . 2 . ]" 1
440 1 27 GLN HE21 1 30 GLN QE . . 5.200 3.586 1.894 4.689 . 0 0 "[ . 1 . 2 . ]" 1
441 1 27 GLN HE21 2 28 LEU QD . . 5.090 4.192 3.462 4.841 . 0 0 "[ . 1 . 2 . ]" 1
442 1 27 GLN HE22 2 28 LEU QD . . 5.230 4.696 2.549 5.209 . 0 0 "[ . 1 . 2 . ]" 1
443 1 27 GLN HG3 2 24 SER HB2 . . 5.280 3.012 2.232 3.709 . 0 0 "[ . 1 . 2 . ]" 1
444 1 27 GLN HG3 2 24 SER HB3 . . 5.210 2.123 1.930 3.595 . 0 0 "[ . 1 . 2 . ]" 1
445 1 27 GLN HG3 2 25 ILE MD . . 4.430 3.422 2.950 4.157 . 0 0 "[ . 1 . 2 . ]" 1
446 1 27 GLN HG3 2 28 LEU QD . . 4.030 2.393 1.806 3.994 . 0 0 "[ . 1 . 2 . ]" 1
447 1 27 GLN HG2 1 28 ILE H . . 4.520 4.366 4.093 5.129 0.609 18 2 "[ . - . + 2 . ]" 1
448 1 27 GLN HG2 2 21 ASN HA . . 5.320 4.847 2.786 5.351 0.031 25 0 "[ . 1 . 2 . ]" 1
449 1 27 GLN HG2 2 24 SER HB2 . . 5.090 4.134 1.989 4.765 . 0 0 "[ . 1 . 2 . ]" 1
450 1 27 GLN HG2 2 24 SER HB3 . . 4.900 3.215 1.980 3.684 . 0 0 "[ . 1 . 2 . ]" 1
451 1 27 GLN HG2 2 25 ILE MD . . 4.170 3.870 3.170 4.212 0.042 25 0 "[ . 1 . 2 . ]" 1
452 1 27 GLN HG2 2 28 LEU QD . . 3.810 2.686 1.889 3.171 . 0 0 "[ . 1 . 2 . ]" 1
453 1 27 GLN H 1 27 GLN HB3 . . 3.860 3.552 3.541 3.566 . 0 0 "[ . 1 . 2 . ]" 1
454 1 27 GLN H 1 27 GLN HE21 . . 5.480 3.443 1.899 4.011 . 0 0 "[ . 1 . 2 . ]" 1
455 1 27 GLN H 1 27 GLN HE22 . . 5.500 4.535 3.477 5.157 . 0 0 "[ . 1 . 2 . ]" 1
456 1 27 GLN H 1 27 GLN HG3 . . 4.080 3.419 3.055 3.916 . 0 0 "[ . 1 . 2 . ]" 1
457 1 27 GLN H 1 27 GLN HG2 . . 3.980 2.350 1.899 3.861 . 0 0 "[ . 1 . 2 . ]" 1
458 1 27 GLN H 1 28 ILE H . . 4.150 2.689 2.558 2.876 . 0 0 "[ . 1 . 2 . ]" 1
459 1 27 GLN H 1 29 ASP H . . 5.500 4.206 3.979 4.485 . 0 0 "[ . 1 . 2 . ]" 1
460 1 27 GLN H 2 28 LEU QD . . 4.830 3.678 3.451 3.929 . 0 0 "[ . 1 . 2 . ]" 1
461 1 28 ILE HA 1 28 ILE HG13 . . 4.060 2.580 1.983 2.867 . 0 0 "[ . 1 . 2 . ]" 1
462 1 28 ILE HA 1 28 ILE MD . . 3.970 3.725 3.389 3.793 . 0 0 "[ . 1 . 2 . ]" 1
463 1 28 ILE HA 1 28 ILE MG . . 3.540 2.627 2.471 2.813 . 0 0 "[ . 1 . 2 . ]" 1
464 1 28 ILE HA 1 31 VAL HB . . 4.170 2.930 2.748 3.071 . 0 0 "[ . 1 . 2 . ]" 1
465 1 28 ILE HA 1 31 VAL H . . 4.620 3.455 3.293 3.605 . 0 0 "[ . 1 . 2 . ]" 1
466 1 28 ILE HA 1 31 VAL QG . . 3.720 3.257 3.110 3.400 . 0 0 "[ . 1 . 2 . ]" 1
467 1 28 ILE HA 1 32 GLU H . . 5.180 4.008 3.871 4.276 . 0 0 "[ . 1 . 2 . ]" 1
468 1 28 ILE HA 1 57 PHE HZ . . 4.400 2.815 2.634 2.989 . 0 0 "[ . 1 . 2 . ]" 1
469 1 28 ILE HA 2 25 ILE MD . . 3.970 2.665 2.195 2.924 . 0 0 "[ . 1 . 2 . ]" 1
470 1 28 ILE HA 2 69 LEU MD1 . . 4.940 3.363 3.125 3.538 . 0 0 "[ . 1 . 2 . ]" 1
471 1 28 ILE HA 2 69 LEU MD2 . . 4.340 4.063 3.693 4.319 . 0 0 "[ . 1 . 2 . ]" 1
472 1 28 ILE HB 1 28 ILE MD . . 3.310 2.233 1.955 2.425 . 0 0 "[ . 1 . 2 . ]" 1
473 1 28 ILE HB 1 29 ASP H . . 3.650 2.783 2.476 2.982 . 0 0 "[ . 1 . 2 . ]" 1
474 1 28 ILE HB 1 61 ALA MB . . 4.100 4.257 4.106 4.366 0.266 27 0 "[ . 1 . 2 . ]" 1
475 1 28 ILE HB 2 25 ILE MD . . 3.610 3.737 3.550 3.860 0.250 10 0 "[ . 1 . 2 . ]" 1
476 1 28 ILE HG13 2 25 ILE MD . . 3.610 2.034 1.908 2.458 . 0 0 "[ . 1 . 2 . ]" 1
477 1 28 ILE H 1 28 ILE HB . . 3.310 2.181 2.034 2.329 . 0 0 "[ . 1 . 2 . ]" 1
478 1 28 ILE H 1 28 ILE MD . . 4.260 3.455 2.906 3.671 . 0 0 "[ . 1 . 2 . ]" 1
479 1 28 ILE H 1 28 ILE MG . . 4.280 3.601 3.453 3.687 . 0 0 "[ . 1 . 2 . ]" 1
480 1 28 ILE H 1 29 ASP H . . 3.960 2.813 2.701 2.951 . 0 0 "[ . 1 . 2 . ]" 1
481 1 28 ILE H 1 30 GLN H . . 5.260 4.057 3.933 4.176 . 0 0 "[ . 1 . 2 . ]" 1
482 1 28 ILE H 1 31 VAL QG . . 5.000 4.823 4.636 4.958 . 0 0 "[ . 1 . 2 . ]" 1
483 1 28 ILE MD 1 29 ASP H . . 5.080 4.611 4.371 4.830 . 0 0 "[ . 1 . 2 . ]" 1
484 1 28 ILE MD 1 57 PHE HZ . . 4.770 4.897 4.797 5.029 0.259 16 0 "[ . 1 . 2 . ]" 1
485 1 28 ILE MD 1 61 ALA HA . . 3.780 2.864 2.393 3.547 . 0 0 "[ . 1 . 2 . ]" 1
486 1 28 ILE MD 1 61 ALA MB . . 3.890 3.181 2.735 3.693 . 0 0 "[ . 1 . 2 . ]" 1
487 1 28 ILE MD 2 25 ILE MD . . 3.830 3.316 2.404 3.597 . 0 0 "[ . 1 . 2 . ]" 1
488 1 28 ILE MD 1 64 GLN HB3 . . 4.660 2.775 2.446 3.333 . 0 0 "[ . 1 . 2 . ]" 1
489 1 28 ILE MD 1 65 LYS QD . . 4.030 2.622 1.935 3.566 . 0 0 "[ . 1 . 2 . ]" 1
490 1 28 ILE MD 1 65 LYS QE . . 4.110 2.785 1.746 4.140 0.030 5 0 "[ . 1 . 2 . ]" 1
491 1 28 ILE MD 1 65 LYS QG . . 4.960 4.114 3.442 4.575 . 0 0 "[ . 1 . 2 . ]" 1
492 1 28 ILE MD 2 65 LEU HG . . 4.690 2.496 1.914 4.307 . 0 0 "[ . 1 . 2 . ]" 1
493 1 28 ILE MD 2 65 LEU QD . . 3.240 2.389 1.731 2.779 . 0 0 "[ . 1 . 2 . ]" 1
494 1 28 ILE MD 1 68 LEU QD . . 4.090 3.157 2.557 3.624 . 0 0 "[ . 1 . 2 . ]" 1
495 1 28 ILE HG12 1 28 ILE MG . . 3.560 2.389 2.193 2.534 . 0 0 "[ . 1 . 2 . ]" 1
496 1 28 ILE MD 1 28 ILE MG . . 3.110 2.076 1.870 2.751 . 0 0 "[ . 1 . 2 . ]" 1
497 1 28 ILE MG 1 29 ASP HA . . 4.040 3.145 2.812 3.442 . 0 0 "[ . 1 . 2 . ]" 1
498 1 28 ILE MG 1 30 GLN H . . 5.500 4.740 4.339 4.973 . 0 0 "[ . 1 . 2 . ]" 1
499 1 28 ILE MG 1 31 VAL HB . . 4.350 4.088 3.892 4.362 0.012 11 0 "[ . 1 . 2 . ]" 1
500 1 28 ILE MG 1 31 VAL QG . . 4.480 4.191 4.040 4.373 . 0 0 "[ . 1 . 2 . ]" 1
501 1 28 ILE MG 1 32 GLU HB2 . . 4.480 3.605 3.297 4.009 . 0 0 "[ . 1 . 2 . ]" 1
502 1 28 ILE MG 1 32 GLU HG3 . . 4.160 2.821 2.617 2.994 . 0 0 "[ . 1 . 2 . ]" 1
503 1 28 ILE MG 1 32 GLU HG2 . . 4.480 4.326 3.969 4.521 0.041 19 0 "[ . 1 . 2 . ]" 1
504 1 28 ILE MG 1 32 GLU H . . 5.030 3.723 3.581 3.842 . 0 0 "[ . 1 . 2 . ]" 1
505 1 28 ILE MG 1 57 PHE HZ . . 3.610 2.607 2.274 2.980 . 0 0 "[ . 1 . 2 . ]" 1
506 1 28 ILE MG 1 57 PHE QE . . 4.490 3.239 2.911 3.596 . 0 0 "[ . 1 . 2 . ]" 1
507 1 28 ILE MG 1 61 ALA HA . . 4.220 2.934 2.520 3.526 . 0 0 "[ . 1 . 2 . ]" 1
508 1 28 ILE MG 1 61 ALA MB . . 3.000 1.849 1.804 1.964 . 0 0 "[ . 1 . 2 . ]" 1
509 1 28 ILE MG 2 25 ILE MD . . 4.430 4.097 3.754 4.432 0.002 6 0 "[ . 1 . 2 . ]" 1
510 1 28 ILE MG 1 65 LYS QD . . 4.080 2.628 2.036 3.186 . 0 0 "[ . 1 . 2 . ]" 1
511 1 28 ILE MG 1 65 LYS QE . . 3.260 2.199 1.742 3.277 0.017 15 0 "[ . 1 . 2 . ]" 1
512 1 28 ILE MG 2 65 LEU QD . . 3.560 2.793 2.015 3.280 . 0 0 "[ . 1 . 2 . ]" 1
513 1 29 ASP HA 1 31 VAL H . . 5.500 4.461 4.177 4.690 . 0 0 "[ . 1 . 2 . ]" 1
514 1 29 ASP HA 1 32 GLU HB2 . . 3.580 2.345 2.223 2.459 . 0 0 "[ . 1 . 2 . ]" 1
515 1 29 ASP HA 1 32 GLU HB3 . . 3.680 3.751 3.625 3.848 0.168 7 0 "[ . 1 . 2 . ]" 1
516 1 29 ASP HA 1 32 GLU HG3 . . 4.210 3.979 3.487 4.173 . 0 0 "[ . 1 . 2 . ]" 1
517 1 29 ASP HA 1 32 GLU H . . 4.280 3.476 3.269 3.642 . 0 0 "[ . 1 . 2 . ]" 1
518 1 29 ASP HA 1 33 SER H . . 4.620 3.991 3.862 4.215 . 0 0 "[ . 1 . 2 . ]" 1
519 1 29 ASP HB2 1 30 GLN H . . 4.140 3.294 2.932 3.638 . 0 0 "[ . 1 . 2 . ]" 1
520 1 29 ASP H 1 29 ASP HB2 . . 3.560 2.052 2.001 2.213 . 0 0 "[ . 1 . 2 . ]" 1
521 1 29 ASP H 1 29 ASP HB3 . . 3.760 3.067 2.733 3.340 . 0 0 "[ . 1 . 2 . ]" 1
522 1 29 ASP H 1 30 GLN HB2 . . 4.920 4.638 4.404 4.896 . 0 0 "[ . 1 . 2 . ]" 1
523 1 29 ASP H 1 30 GLN H . . 3.780 2.662 2.539 2.773 . 0 0 "[ . 1 . 2 . ]" 1
524 1 30 GLN HA 1 30 GLN QE . . 5.370 3.960 3.112 4.609 . 0 0 "[ . 1 . 2 . ]" 1
525 1 30 GLN HA 1 30 GLN HG2 . . 3.970 3.071 2.361 3.579 . 0 0 "[ . 1 . 2 . ]" 1
526 1 30 GLN HA 1 30 GLN HG3 . . 3.400 2.843 1.968 3.698 0.298 9 0 "[ . 1 . 2 . ]" 1
527 1 30 GLN HA 1 32 GLU H . . 5.500 4.888 4.623 5.015 . 0 0 "[ . 1 . 2 . ]" 1
528 1 30 GLN HA 1 33 SER HB3 . . 3.430 3.491 2.723 4.056 0.626 17 4 "[* . -1 . + 2 *. ]" 1
529 1 30 GLN HA 1 33 SER H . . 4.070 3.634 3.517 3.732 . 0 0 "[ . 1 . 2 . ]" 1
530 1 30 GLN HA 1 34 THR H . . 3.690 3.707 3.556 3.869 0.179 5 0 "[ . 1 . 2 . ]" 1
531 1 30 GLN HB2 1 31 VAL H . . 4.190 2.727 2.386 3.137 . 0 0 "[ . 1 . 2 . ]" 1
532 1 30 GLN HB2 1 31 VAL QG . . 4.610 3.544 3.138 3.967 . 0 0 "[ . 1 . 2 . ]" 1
533 1 30 GLN HB2 2 21 ASN HD22 . . 5.340 2.294 1.942 2.680 . 0 0 "[ . 1 . 2 . ]" 1
534 1 30 GLN HB2 2 21 ASN HD21 . . 4.740 3.068 2.694 3.482 . 0 0 "[ . 1 . 2 . ]" 1
535 1 30 GLN HB3 2 21 ASN HD22 . . 5.120 2.623 2.120 3.064 . 0 0 "[ . 1 . 2 . ]" 1
536 1 30 GLN HB3 2 21 ASN HD21 . . 4.500 3.899 3.253 4.463 . 0 0 "[ . 1 . 2 . ]" 1
537 1 30 GLN HG2 1 31 VAL H . . 5.330 4.840 4.141 5.358 0.028 5 0 "[ . 1 . 2 . ]" 1
538 1 30 GLN HG3 2 21 ASN HD21 . . 5.500 4.855 3.761 5.933 0.433 5 0 "[ . 1 . 2 . ]" 1
539 1 30 GLN H 1 30 GLN HB2 . . 3.680 2.283 2.047 2.563 . 0 0 "[ . 1 . 2 . ]" 1
540 1 30 GLN H 1 30 GLN HB3 . . 3.820 3.479 3.330 3.549 . 0 0 "[ . 1 . 2 . ]" 1
541 1 30 GLN H 1 30 GLN QE . . 5.300 3.653 2.433 4.570 . 0 0 "[ . 1 . 2 . ]" 1
542 1 30 GLN H 1 30 GLN HG2 . . 3.820 3.369 2.013 4.419 0.599 26 2 "[ - 1 . 2 .+ ]" 1
543 1 30 GLN H 1 30 GLN HG3 . . 4.390 3.381 2.488 4.108 . 0 0 "[ . 1 . 2 . ]" 1
544 1 30 GLN H 1 31 VAL QG . . 4.880 4.430 4.323 4.523 . 0 0 "[ . 1 . 2 . ]" 1
545 1 30 GLN H 2 21 ASN HD21 . . 5.500 4.817 4.380 5.232 . 0 0 "[ . 1 . 2 . ]" 1
546 1 31 VAL HA 1 34 THR HB . . 3.860 2.266 2.130 2.420 . 0 0 "[ . 1 . 2 . ]" 1
547 1 31 VAL HA 1 34 THR H . . 4.660 3.335 3.256 3.401 . 0 0 "[ . 1 . 2 . ]" 1
548 1 31 VAL HA 1 34 THR MG . . 4.240 3.250 3.104 3.388 . 0 0 "[ . 1 . 2 . ]" 1
549 1 31 VAL HA 1 35 ALA H . . 5.230 3.286 3.123 3.427 . 0 0 "[ . 1 . 2 . ]" 1
550 1 31 VAL HA 2 18 ILE HG13 . . 4.990 4.700 4.468 4.952 . 0 0 "[ . 1 . 2 . ]" 1
551 1 31 VAL HA 2 18 ILE HG12 . . 4.620 4.230 4.076 4.364 . 0 0 "[ . 1 . 2 . ]" 1
552 1 31 VAL HA 2 18 ILE MD . . 4.090 1.921 1.817 2.104 . 0 0 "[ . 1 . 2 . ]" 1
553 1 31 VAL HA 2 18 ILE MG . . 4.470 4.114 3.881 4.360 . 0 0 "[ . 1 . 2 . ]" 1
554 1 31 VAL HA 2 69 LEU MD2 . . 5.220 4.428 4.285 4.580 . 0 0 "[ . 1 . 2 . ]" 1
555 1 31 VAL HA 2 72 LEU QD . . 5.350 4.107 3.909 4.383 . 0 0 "[ . 1 . 2 . ]" 1
556 1 31 VAL HB 1 32 GLU H . . 3.790 2.496 2.383 2.674 . 0 0 "[ . 1 . 2 . ]" 1
557 1 31 VAL HB 1 33 SER H . . 5.000 4.921 4.763 5.047 0.047 16 0 "[ . 1 . 2 . ]" 1
558 1 31 VAL HB 1 57 PHE HZ . . 4.410 2.265 2.023 2.433 . 0 0 "[ . 1 . 2 . ]" 1
559 1 31 VAL HB 2 18 ILE MD . . 5.100 3.627 3.514 3.742 . 0 0 "[ . 1 . 2 . ]" 1
560 1 31 VAL HB 2 72 LEU QD . . 4.930 4.082 3.854 4.399 . 0 0 "[ . 1 . 2 . ]" 1
561 1 31 VAL H 1 31 VAL HB . . 3.570 2.228 2.164 2.282 . 0 0 "[ . 1 . 2 . ]" 1
562 1 31 VAL H 1 31 VAL QG . . 3.530 2.440 2.317 2.585 . 0 0 "[ . 1 . 2 . ]" 1
563 1 31 VAL H 1 32 GLU H . . 3.950 2.728 2.543 2.837 . 0 0 "[ . 1 . 2 . ]" 1
564 1 31 VAL H 1 33 SER H . . 5.500 4.012 3.918 4.128 . 0 0 "[ . 1 . 2 . ]" 1
565 1 31 VAL H 1 34 THR H . . 5.500 4.501 4.430 4.561 . 0 0 "[ . 1 . 2 . ]" 1
566 1 31 VAL H 1 57 PHE HZ . . 5.500 3.943 3.655 4.242 . 0 0 "[ . 1 . 2 . ]" 1
567 1 31 VAL H 2 21 ASN HD22 . . 5.500 4.500 4.125 4.922 . 0 0 "[ . 1 . 2 . ]" 1
568 1 31 VAL QG 1 32 GLU H . . 4.340 2.878 2.785 2.993 . 0 0 "[ . 1 . 2 . ]" 1
569 1 31 VAL QG 1 34 THR HB . . 4.610 3.567 3.457 3.680 . 0 0 "[ . 1 . 2 . ]" 1
570 1 31 VAL QG 1 34 THR H . . 5.500 4.334 4.265 4.385 . 0 0 "[ . 1 . 2 . ]" 1
571 1 31 VAL QG 1 35 ALA MB . . 3.830 2.550 2.271 2.672 . 0 0 "[ . 1 . 2 . ]" 1
572 1 31 VAL QG 1 57 PHE HZ . . 3.750 2.588 2.380 2.777 . 0 0 "[ . 1 . 2 . ]" 1
573 1 31 VAL QG 1 57 PHE QE . . 4.150 2.429 2.212 2.616 . 0 0 "[ . 1 . 2 . ]" 1
574 1 31 VAL QG 2 18 ILE HA . . 3.830 2.206 1.950 2.371 . 0 0 "[ . 1 . 2 . ]" 1
575 1 31 VAL QG 2 18 ILE HB . . 4.570 4.075 3.927 4.210 . 0 0 "[ . 1 . 2 . ]" 1
576 1 31 VAL QG 2 18 ILE HG13 . . 4.560 3.593 3.419 3.731 . 0 0 "[ . 1 . 2 . ]" 1
577 1 31 VAL QG 2 18 ILE HG12 . . 4.150 3.778 3.671 3.817 . 0 0 "[ . 1 . 2 . ]" 1
578 1 31 VAL QG 2 18 ILE H . . 5.500 4.293 4.139 4.386 . 0 0 "[ . 1 . 2 . ]" 1
579 1 31 VAL QG 2 18 ILE MD . . 3.520 1.626 1.600 1.683 . 0 0 "[ . 1 . 2 . ]" 1
580 1 31 VAL QG 2 18 ILE MG . . 3.480 2.141 1.944 2.289 . 0 0 "[ . 1 . 2 . ]" 1
581 1 31 VAL QG 2 21 ASN HA . . 4.120 3.928 3.843 4.057 . 0 0 "[ . 1 . 2 . ]" 1
582 1 31 VAL QG 2 21 ASN HB2 . . 3.760 2.076 1.864 2.272 . 0 0 "[ . 1 . 2 . ]" 1
583 1 31 VAL QG 2 21 ASN HB3 . . 3.720 1.794 1.765 1.871 . 0 0 "[ . 1 . 2 . ]" 1
584 1 31 VAL QG 2 72 LEU QD . . 3.290 1.776 1.665 1.933 . 0 0 "[ . 1 . 2 . ]" 1
585 1 31 VAL QG 1 32 GLU HA . . 4.390 3.062 2.926 3.264 . 0 0 "[ . 1 . 2 . ]" 1
586 1 31 VAL QG 1 35 ALA H . . 5.500 3.420 3.172 3.546 . 0 0 "[ . 1 . 2 . ]" 1
587 1 31 VAL QG 1 57 PHE QD . . 3.930 3.344 3.144 3.458 . 0 0 "[ . 1 . 2 . ]" 1
588 1 31 VAL QG 2 69 LEU HA . . 4.600 3.592 3.433 3.790 . 0 0 "[ . 1 . 2 . ]" 1
589 1 31 VAL QG 2 69 LEU MD1 . . 3.720 3.069 2.989 3.200 . 0 0 "[ . 1 . 2 . ]" 1
590 1 31 VAL QG 2 69 LEU MD2 . . 3.930 1.699 1.636 1.811 . 0 0 "[ . 1 . 2 . ]" 1
591 1 31 VAL QG 2 72 LEU HB2 . . 4.610 4.454 4.321 4.641 0.031 26 0 "[ . 1 . 2 . ]" 1
592 1 31 VAL QG 2 72 LEU HB3 . . 4.670 3.869 3.740 4.025 . 0 0 "[ . 1 . 2 . ]" 1
593 1 31 VAL QG 2 72 LEU HG . . 4.590 3.457 2.789 4.003 . 0 0 "[ . 1 . 2 . ]" 1
594 1 32 GLU HA 1 32 GLU HG3 . . 3.970 2.916 2.823 3.003 . 0 0 "[ . 1 . 2 . ]" 1
595 1 32 GLU HA 1 32 GLU HG2 . . 3.380 2.139 2.033 2.343 . 0 0 "[ . 1 . 2 . ]" 1
596 1 32 GLU HA 1 33 SER HA . . 5.000 4.679 4.654 4.707 . 0 0 "[ . 1 . 2 . ]" 1
597 1 32 GLU HA 1 35 ALA MB . . 3.570 2.883 2.754 3.017 . 0 0 "[ . 1 . 2 . ]" 1
598 1 32 GLU HA 1 57 PHE HZ . . 3.890 3.946 3.889 4.003 0.113 26 0 "[ . 1 . 2 . ]" 1
599 1 32 GLU HA 1 57 PHE QD . . 4.690 4.038 3.835 4.200 . 0 0 "[ . 1 . 2 . ]" 1
600 1 32 GLU HA 1 57 PHE QE . . 4.670 2.182 2.047 2.373 . 0 0 "[ . 1 . 2 . ]" 1
601 1 32 GLU HA 2 72 LEU QD . . 5.100 4.471 4.227 4.759 . 0 0 "[ . 1 . 2 . ]" 1
602 1 32 GLU HB2 1 33 SER H . . 3.860 2.962 2.851 3.126 . 0 0 "[ . 1 . 2 . ]" 1
603 1 32 GLU HB2 1 57 PHE HZ . . 4.340 3.898 3.734 4.116 . 0 0 "[ . 1 . 2 . ]" 1
604 1 32 GLU HB2 1 57 PHE QE . . 5.020 3.641 3.460 3.866 . 0 0 "[ . 1 . 2 . ]" 1
605 1 32 GLU HB3 1 35 ALA MB . . 4.930 4.915 4.780 5.026 0.096 13 0 "[ . 1 . 2 . ]" 1
606 1 32 GLU HG3 1 33 SER H . . 5.500 4.923 4.702 5.119 . 0 0 "[ . 1 . 2 . ]" 1
607 1 32 GLU HG3 1 35 ALA MB . . 5.160 5.170 5.033 5.247 0.087 14 0 "[ . 1 . 2 . ]" 1
608 1 32 GLU HG3 1 57 PHE HZ . . 4.030 2.593 2.193 3.010 . 0 0 "[ . 1 . 2 . ]" 1
609 1 32 GLU HG3 1 57 PHE QD . . 4.970 4.041 3.954 4.185 . 0 0 "[ . 1 . 2 . ]" 1
610 1 32 GLU HG3 1 57 PHE QE . . 4.810 2.057 1.965 2.216 . 0 0 "[ . 1 . 2 . ]" 1
611 1 32 GLU HG3 1 61 ALA MB . . 4.760 3.130 2.853 3.532 . 0 0 "[ . 1 . 2 . ]" 1
612 1 32 GLU HG2 1 35 ALA MB . . 5.040 4.374 4.164 4.679 . 0 0 "[ . 1 . 2 . ]" 1
613 1 32 GLU HG2 1 57 PHE HZ . . 4.220 3.840 3.630 4.074 . 0 0 "[ . 1 . 2 . ]" 1
614 1 32 GLU HG2 1 57 PHE QE . . 4.570 1.973 1.944 1.998 . 0 0 "[ . 1 . 2 . ]" 1
615 1 32 GLU HG2 1 61 ALA MB . . 4.710 3.901 3.468 4.356 . 0 0 "[ . 1 . 2 . ]" 1
616 1 32 GLU H 1 32 GLU HG3 . . 4.320 2.829 2.413 3.147 . 0 0 "[ . 1 . 2 . ]" 1
617 1 32 GLU H 1 32 GLU HG2 . . 3.510 3.624 3.551 3.697 0.187 19 0 "[ . 1 . 2 . ]" 1
618 1 32 GLU H 1 33 SER HA . . 5.500 5.363 5.303 5.399 . 0 0 "[ . 1 . 2 . ]" 1
619 1 32 GLU H 1 35 ALA H . . 5.500 4.603 4.566 4.638 . 0 0 "[ . 1 . 2 . ]" 1
620 1 32 GLU H 1 35 ALA MB . . 5.500 4.329 4.252 4.440 . 0 0 "[ . 1 . 2 . ]" 1
621 1 32 GLU H 1 57 PHE HZ . . 4.660 2.667 2.565 2.762 . 0 0 "[ . 1 . 2 . ]" 1
622 1 32 GLU H 1 57 PHE QD . . 5.150 5.267 5.175 5.365 0.215 6 0 "[ . 1 . 2 . ]" 1
623 1 33 SER HA 1 33 SER HB3 . . 2.930 2.932 2.795 3.050 0.120 5 0 "[ . 1 . 2 . ]" 1
624 1 33 SER HA 1 36 GLY H . . 4.770 3.478 3.337 3.661 . 0 0 "[ . 1 . 2 . ]" 1
625 1 33 SER HB3 1 34 THR H . . 3.990 2.626 2.367 2.853 . 0 0 "[ . 1 . 2 . ]" 1
626 1 33 SER H 1 33 SER HB3 . . 3.480 2.849 2.091 3.345 . 0 0 "[ . 1 . 2 . ]" 1
627 1 33 SER H 1 34 THR MG . . 5.500 5.472 5.350 5.558 0.058 26 0 "[ . 1 . 2 . ]" 1
628 1 33 SER H 1 35 ALA H . . 5.440 3.919 3.779 4.024 . 0 0 "[ . 1 . 2 . ]" 1
629 1 33 SER H 1 35 ALA MB . . 5.500 4.556 4.431 4.653 . 0 0 "[ . 1 . 2 . ]" 1
630 1 33 SER H 1 36 GLY H . . 5.190 4.772 4.642 4.907 . 0 0 "[ . 1 . 2 . ]" 1
631 1 34 THR HA 1 34 THR MG . . 3.230 2.711 2.667 2.764 . 0 0 "[ . 1 . 2 . ]" 1
632 1 34 THR HA 1 35 ALA H . . 3.630 3.605 3.591 3.616 . 0 0 "[ . 1 . 2 . ]" 1
633 1 34 THR HA 1 37 SER H . . 3.950 3.581 3.438 3.861 . 0 0 "[ . 1 . 2 . ]" 1
634 1 34 THR HB 1 35 ALA H . . 4.050 2.884 2.799 3.004 . 0 0 "[ . 1 . 2 . ]" 1
635 1 34 THR HB 2 18 ILE HG13 . . 4.810 4.859 4.755 4.952 0.142 20 0 "[ . 1 . 2 . ]" 1
636 1 34 THR HB 2 18 ILE HG12 . . 5.080 3.936 3.790 4.074 . 0 0 "[ . 1 . 2 . ]" 1
637 1 34 THR HB 2 18 ILE MD . . 3.900 2.267 2.133 2.525 . 0 0 "[ . 1 . 2 . ]" 1
638 1 34 THR H 1 34 THR MG . . 4.260 3.588 3.554 3.615 . 0 0 "[ . 1 . 2 . ]" 1
639 1 34 THR H 1 35 ALA H . . 4.020 2.832 2.783 2.868 . 0 0 "[ . 1 . 2 . ]" 1
640 1 34 THR H 1 35 ALA MB . . 4.850 4.356 4.311 4.414 . 0 0 "[ . 1 . 2 . ]" 1
641 1 34 THR H 1 36 GLY H . . 5.500 4.029 3.830 4.183 . 0 0 "[ . 1 . 2 . ]" 1
642 1 34 THR H 2 18 ILE MD . . 5.500 3.834 3.697 3.975 . 0 0 "[ . 1 . 2 . ]" 1
643 1 34 THR MG 1 35 ALA HA . . 4.450 3.016 2.958 3.094 . 0 0 "[ . 1 . 2 . ]" 1
644 1 34 THR MG 1 35 ALA H . . 4.490 2.927 2.844 3.064 . 0 0 "[ . 1 . 2 . ]" 1
645 1 34 THR MG 1 35 ALA MB . . 3.540 3.679 3.507 3.779 0.239 14 0 "[ . 1 . 2 . ]" 1
646 1 34 THR MG 1 37 SER H . . 5.500 4.360 4.096 4.598 . 0 0 "[ . 1 . 2 . ]" 1
647 1 34 THR MG 1 38 LEU QD . . 3.570 2.215 2.087 2.349 . 0 0 "[ . 1 . 2 . ]" 1
648 1 34 THR MG 2 14 ALA HA . . 3.310 2.119 1.920 2.473 . 0 0 "[ . 1 . 2 . ]" 1
649 1 34 THR MG 2 14 ALA MB . . 3.050 1.906 1.824 2.085 . 0 0 "[ . 1 . 2 . ]" 1
650 1 34 THR MG 2 15 ALA HA . . 4.940 3.671 3.548 3.811 . 0 0 "[ . 1 . 2 . ]" 1
651 1 34 THR MG 2 17 ALA MB . . 3.460 2.085 1.926 2.355 . 0 0 "[ . 1 . 2 . ]" 1
652 1 34 THR MG 2 18 ILE HA . . 4.330 3.521 3.398 3.699 . 0 0 "[ . 1 . 2 . ]" 1
653 1 34 THR MG 2 18 ILE HB . . 4.220 3.934 3.815 4.082 . 0 0 "[ . 1 . 2 . ]" 1
654 1 34 THR MG 2 18 ILE HG13 . . 3.860 2.797 2.680 2.871 . 0 0 "[ . 1 . 2 . ]" 1
655 1 34 THR MG 2 18 ILE MD . . 3.420 1.834 1.746 1.887 . 0 0 "[ . 1 . 2 . ]" 1
656 1 34 THR MG 2 18 ILE MG . . 4.270 3.991 3.898 4.055 . 0 0 "[ . 1 . 2 . ]" 1
657 1 34 THR MG 2 76 ILE MG . . 3.590 3.372 3.270 3.478 . 0 0 "[ . 1 . 2 . ]" 1
658 1 35 ALA HA 1 38 LEU HB3 . . 4.270 3.737 3.624 3.953 . 0 0 "[ . 1 . 2 . ]" 1
659 1 35 ALA HA 1 38 LEU HG . . 4.020 3.717 3.502 3.952 . 0 0 "[ . 1 . 2 . ]" 1
660 1 35 ALA HA 1 38 LEU QD . . 3.460 1.976 1.852 2.172 . 0 0 "[ . 1 . 2 . ]" 1
661 1 35 ALA HA 1 39 GLN QE . . 5.310 3.173 2.079 3.861 . 0 0 "[ . 1 . 2 . ]" 1
662 1 35 ALA HA 1 39 GLN QG . . 4.540 4.520 3.647 4.686 0.146 1 0 "[ . 1 . 2 . ]" 1
663 1 35 ALA HA 1 54 VAL QG . . 4.630 3.910 3.500 4.323 . 0 0 "[ . 1 . 2 . ]" 1
664 1 35 ALA HA 2 18 ILE MD . . 4.130 3.149 2.974 3.272 . 0 0 "[ . 1 . 2 . ]" 1
665 1 35 ALA HA 2 76 ILE MD . . 3.480 2.400 2.294 2.522 . 0 0 "[ . 1 . 2 . ]" 1
666 1 35 ALA H 1 35 ALA MB . . 3.470 2.032 1.983 2.152 . 0 0 "[ . 1 . 2 . ]" 1
667 1 35 ALA H 1 36 GLY H . . 4.250 2.732 2.664 2.775 . 0 0 "[ . 1 . 2 . ]" 1
668 1 35 ALA H 1 37 SER H . . 5.210 4.660 4.294 5.057 . 0 0 "[ . 1 . 2 . ]" 1
669 1 35 ALA H 2 18 ILE MD . . 4.920 2.765 2.430 2.983 . 0 0 "[ . 1 . 2 . ]" 1
670 1 35 ALA MB 1 36 GLY H . . 4.130 2.909 2.738 3.096 . 0 0 "[ . 1 . 2 . ]" 1
671 1 35 ALA MB 1 37 SER H . . 5.080 4.756 4.304 5.062 . 0 0 "[ . 1 . 2 . ]" 1
672 1 35 ALA MB 1 38 LEU HB3 . . 4.210 4.236 3.995 4.341 0.131 20 0 "[ . 1 . 2 . ]" 1
673 1 35 ALA MB 1 38 LEU H . . 5.070 4.151 3.996 4.241 . 0 0 "[ . 1 . 2 . ]" 1
674 1 35 ALA MB 1 38 LEU QD . . 4.130 3.342 3.117 3.480 . 0 0 "[ . 1 . 2 . ]" 1
675 1 35 ALA MB 1 39 GLN H . . 5.500 3.730 3.586 3.866 . 0 0 "[ . 1 . 2 . ]" 1
676 1 35 ALA MB 1 54 VAL HA . . 4.630 4.015 3.716 4.234 . 0 0 "[ . 1 . 2 . ]" 1
677 1 35 ALA MB 1 54 VAL HB . . 4.970 3.399 2.211 4.488 . 0 0 "[ . 1 . 2 . ]" 1
678 1 35 ALA MB 1 54 VAL QG . . 3.150 2.006 1.659 2.406 . 0 0 "[ . 1 . 2 . ]" 1
679 1 35 ALA MB 1 57 PHE HZ . . 5.000 5.195 5.112 5.280 0.280 13 0 "[ . 1 . 2 . ]" 1
680 1 35 ALA MB 2 18 ILE HG13 . . 4.720 4.147 3.484 4.415 . 0 0 "[ . 1 . 2 . ]" 1
681 1 35 ALA MB 2 18 ILE MD . . 3.600 2.632 2.011 2.978 . 0 0 "[ . 1 . 2 . ]" 1
682 1 35 ALA MB 2 72 LEU QD . . 3.680 2.338 2.049 2.630 . 0 0 "[ . 1 . 2 . ]" 1
683 1 36 GLY HA2 1 39 GLN H . . 5.170 5.169 5.018 5.915 0.745 16 1 "[ . 1 .+ 2 . ]" 1
684 1 36 GLY HA2 1 39 GLN QG . . 4.370 3.783 3.539 4.681 0.311 16 0 "[ . 1 . 2 . ]" 1
685 1 36 GLY HA3 1 39 GLN QG . . 4.540 2.381 2.133 3.172 . 0 0 "[ . 1 . 2 . ]" 1
686 1 36 GLY H 1 37 SER H . . 3.940 2.920 2.633 3.044 . 0 0 "[ . 1 . 2 . ]" 1
687 1 36 GLY H 1 38 LEU HB2 . . 5.500 4.799 4.629 4.990 . 0 0 "[ . 1 . 2 . ]" 1
688 1 36 GLY H 1 38 LEU H . . 5.340 3.961 3.762 4.137 . 0 0 "[ . 1 . 2 . ]" 1
689 1 37 SER HA 2 11 ILE HA . . 5.310 4.914 4.566 5.337 0.027 24 0 "[ . 1 . 2 . ]" 1
690 1 37 SER HA 2 11 ILE HB . . 4.050 3.972 3.731 4.083 0.033 12 0 "[ . 1 . 2 . ]" 1
691 1 37 SER HA 2 11 ILE QG . . 4.950 3.975 3.472 4.754 . 0 0 "[ . 1 . 2 . ]" 1
692 1 37 SER HA 2 11 ILE MG . . 5.130 5.212 4.969 5.306 0.176 15 0 "[ . 1 . 2 . ]" 1
693 1 37 SER HB2 1 38 LEU QD . . 4.680 2.928 2.695 3.334 . 0 0 "[ . 1 . 2 . ]" 1
694 1 37 SER HB3 1 38 LEU H . . 4.400 3.983 3.298 4.494 0.094 26 0 "[ . 1 . 2 . ]" 1
695 1 37 SER HB3 2 11 ILE MD . . 4.870 4.261 3.569 5.362 0.492 26 0 "[ . 1 . 2 . ]" 1
696 1 37 SER H 1 37 SER HB3 . . 3.460 3.499 3.348 3.564 0.104 15 0 "[ . 1 . 2 . ]" 1
697 1 37 SER H 1 38 LEU H . . 3.760 2.555 2.095 2.676 . 0 0 "[ . 1 . 2 . ]" 1
698 1 37 SER H 1 38 LEU QD . . 5.500 3.484 2.907 3.728 . 0 0 "[ . 1 . 2 . ]" 1
699 1 38 LEU HA 1 38 LEU HG . . 3.890 3.495 3.416 3.561 . 0 0 "[ . 1 . 2 . ]" 1
700 1 38 LEU HA 1 38 LEU QD . . 3.290 1.794 1.756 1.846 . 0 0 "[ . 1 . 2 . ]" 1
701 1 38 LEU HA 1 41 GLN QB . . 4.040 3.206 2.700 3.813 . 0 0 "[ . 1 . 2 . ]" 1
702 1 38 LEU HA 1 41 GLN HE21 . . 4.920 4.645 3.996 5.726 0.806 3 1 "[ + . 1 . 2 . ]" 1
703 1 38 LEU HA 1 41 GLN HE22 . . 5.580 5.364 3.911 5.735 0.155 16 0 "[ . 1 . 2 . ]" 1
704 1 38 LEU HA 1 41 GLN H . . 4.370 3.489 3.152 3.786 . 0 0 "[ . 1 . 2 . ]" 1
705 1 38 LEU HA 1 41 GLN QG . . 5.000 4.819 2.631 5.157 0.157 10 0 "[ . 1 . 2 . ]" 1
706 1 38 LEU HA 2 11 ILE HA . . 5.150 4.838 4.407 5.254 0.104 18 0 "[ . 1 . 2 . ]" 1
707 1 38 LEU HA 2 11 ILE HB . . 4.950 4.635 4.053 4.982 0.032 9 0 "[ . 1 . 2 . ]" 1
708 1 38 LEU HA 2 11 ILE QG . . 5.490 2.439 2.256 2.687 . 0 0 "[ . 1 . 2 . ]" 1
709 1 38 LEU HA 2 11 ILE MD . . 3.970 2.925 1.932 3.871 . 0 0 "[ . 1 . 2 . ]" 1
710 1 38 LEU HA 2 11 ILE MG . . 4.920 4.864 4.603 5.139 0.219 22 0 "[ . 1 . 2 . ]" 1
711 1 38 LEU HB2 1 39 GLN QE . . 4.810 2.890 1.846 3.179 . 0 0 "[ . 1 . 2 . ]" 1
712 1 38 LEU HB2 1 39 GLN H . . 4.650 2.431 2.310 2.544 . 0 0 "[ . 1 . 2 . ]" 1
713 1 38 LEU HB2 2 76 ILE MD . . 4.700 2.508 2.109 2.672 . 0 0 "[ . 1 . 2 . ]" 1
714 1 38 LEU HB3 1 39 GLN H . . 4.920 2.891 2.656 3.050 . 0 0 "[ . 1 . 2 . ]" 1
715 1 38 LEU HB3 1 41 GLN H . . 5.500 4.853 4.681 5.027 . 0 0 "[ . 1 . 2 . ]" 1
716 1 38 LEU HB3 1 42 TRP HE1 . . 5.460 2.284 2.030 2.449 . 0 0 "[ . 1 . 2 . ]" 1
717 1 38 LEU HB3 1 42 TRP HZ2 . . 4.920 1.952 1.907 1.988 . 0 0 "[ . 1 . 2 . ]" 1
718 1 38 LEU HG 2 14 ALA MB . . 4.180 4.082 3.880 4.242 0.062 6 0 "[ . 1 . 2 . ]" 1
719 1 38 LEU HG 2 72 LEU QD . . 5.140 4.410 4.103 4.635 . 0 0 "[ . 1 . 2 . ]" 1
720 1 38 LEU HG 2 76 ILE MD . . 4.690 2.153 1.955 2.603 . 0 0 "[ . 1 . 2 . ]" 1
721 1 38 LEU H 1 38 LEU HB3 . . 3.960 3.463 3.417 3.506 . 0 0 "[ . 1 . 2 . ]" 1
722 1 38 LEU H 1 38 LEU QD . . 4.080 2.234 1.958 2.622 . 0 0 "[ . 1 . 2 . ]" 1
723 1 38 LEU H 1 39 GLN HB2 . . 5.980 5.989 5.212 6.328 0.348 8 0 "[ . 1 . 2 . ]" 1
724 1 38 LEU H 1 39 GLN QG . . 5.500 3.501 3.085 3.907 . 0 0 "[ . 1 . 2 . ]" 1
725 1 38 LEU H 2 11 ILE HB . . 5.150 5.211 4.991 5.374 0.224 20 0 "[ . 1 . 2 . ]" 1
726 1 38 LEU H 2 11 ILE QG . . 5.500 3.640 3.113 4.401 . 0 0 "[ . 1 . 2 . ]" 1
727 1 38 LEU H 2 76 ILE MD . . 4.360 4.242 3.903 4.393 0.033 22 0 "[ . 1 . 2 . ]" 1
728 1 38 LEU H 2 76 ILE MG . . 4.900 4.955 4.729 5.080 0.180 21 0 "[ . 1 . 2 . ]" 1
729 1 38 LEU QD 1 39 GLN QE . . 4.950 3.927 2.937 4.145 . 0 0 "[ . 1 . 2 . ]" 1
730 1 38 LEU QD 1 39 GLN H . . 5.500 3.764 3.650 3.857 . 0 0 "[ . 1 . 2 . ]" 1
731 1 38 LEU QD 1 42 TRP HH2 . . 4.970 3.065 2.765 3.516 . 0 0 "[ . 1 . 2 . ]" 1
732 1 38 LEU QD 2 11 ILE HA . . 3.600 3.094 2.799 3.533 . 0 0 "[ . 1 . 2 . ]" 1
733 1 38 LEU QD 2 11 ILE QG . . 3.940 1.781 1.646 1.910 . 0 0 "[ . 1 . 2 . ]" 1
734 1 38 LEU QD 2 14 ALA HA . . 5.140 3.706 3.537 3.912 . 0 0 "[ . 1 . 2 . ]" 1
735 1 38 LEU QD 2 14 ALA MB . . 3.300 1.772 1.676 1.888 . 0 0 "[ . 1 . 2 . ]" 1
736 1 38 LEU QD 2 18 ILE HA . . 5.210 5.232 5.127 5.379 0.169 19 0 "[ . 1 . 2 . ]" 1
737 1 38 LEU QD 2 18 ILE MD . . 4.160 2.997 2.862 3.227 . 0 0 "[ . 1 . 2 . ]" 1
738 1 38 LEU QD 2 76 ILE HA . . 5.130 3.289 3.060 3.608 . 0 0 "[ . 1 . 2 . ]" 1
739 1 38 LEU QD 2 76 ILE MG . . 3.390 1.833 1.770 1.912 . 0 0 "[ . 1 . 2 . ]" 1
740 1 38 LEU QD 1 41 GLN QB . . 4.250 3.604 3.152 4.191 . 0 0 "[ . 1 . 2 . ]" 1
741 1 38 LEU QD 1 41 GLN HE21 . . 4.910 4.135 3.363 4.860 . 0 0 "[ . 1 . 2 . ]" 1
742 1 38 LEU QD 1 41 GLN HE22 . . 5.020 4.528 2.859 4.898 . 0 0 "[ . 1 . 2 . ]" 1
743 1 38 LEU QD 1 41 GLN H . . 5.500 4.420 4.154 4.623 . 0 0 "[ . 1 . 2 . ]" 1
744 1 38 LEU QD 1 41 GLN QG . . 4.720 4.617 2.903 4.884 0.164 15 0 "[ . 1 . 2 . ]" 1
745 1 38 LEU QD 2 11 ILE HB . . 5.220 3.815 3.144 4.099 . 0 0 "[ . 1 . 2 . ]" 1
746 1 38 LEU QD 2 11 ILE H . . 5.380 5.031 4.753 5.233 . 0 0 "[ . 1 . 2 . ]" 1
747 1 38 LEU QD 2 11 ILE MD . . 3.570 2.189 1.757 2.705 . 0 0 "[ . 1 . 2 . ]" 1
748 1 38 LEU QD 2 14 ALA H . . 5.500 3.965 3.836 4.105 . 0 0 "[ . 1 . 2 . ]" 1
749 1 38 LEU QD 2 15 ALA MB . . 4.390 2.688 2.251 3.018 . 0 0 "[ . 1 . 2 . ]" 1
750 1 38 LEU QD 2 18 ILE HG13 . . 5.140 2.453 2.343 2.618 . 0 0 "[ . 1 . 2 . ]" 1
751 1 38 LEU QD 2 79 ALA HA . . 5.400 4.035 3.808 4.289 . 0 0 "[ . 1 . 2 . ]" 1
752 1 38 LEU QD 2 79 ALA MB . . 4.340 1.986 1.766 2.311 . 0 0 "[ . 1 . 2 . ]" 1
753 1 39 GLN HA 1 39 GLN QE . . 5.500 3.273 2.966 3.858 . 0 0 "[ . 1 . 2 . ]" 1
754 1 39 GLN HA 1 41 GLN H . . 4.860 3.532 3.368 3.800 . 0 0 "[ . 1 . 2 . ]" 1
755 1 39 GLN HA 1 42 TRP HE1 . . 4.660 2.041 1.866 2.316 . 0 0 "[ . 1 . 2 . ]" 1
756 1 39 GLN HB2 1 51 GLN HA . . 4.140 3.928 2.991 4.342 0.202 20 0 "[ . 1 . 2 . ]" 1
757 1 39 GLN HB3 1 54 VAL HB . . 5.320 4.381 3.525 5.565 0.245 18 0 "[ . 1 . 2 . ]" 1
758 1 39 GLN HB3 1 54 VAL QG . . 4.260 2.695 2.270 3.444 . 0 0 "[ . 1 . 2 . ]" 1
759 1 39 GLN QE 1 54 VAL QG . . 4.450 1.815 1.577 3.622 . 0 0 "[ . 1 . 2 . ]" 1
760 1 39 GLN QE 2 76 ILE MD . . 4.300 3.222 1.806 4.423 0.123 16 0 "[ . 1 . 2 . ]" 1
761 1 39 GLN QE 2 76 ILE QG . . 5.500 4.230 2.408 5.408 . 0 0 "[ . 1 . 2 . ]" 1
762 1 39 GLN H 1 39 GLN HB2 . . 3.830 3.472 2.952 3.545 . 0 0 "[ . 1 . 2 . ]" 1
763 1 39 GLN H 1 39 GLN HB3 . . 3.960 2.804 2.620 3.453 . 0 0 "[ . 1 . 2 . ]" 1
764 1 39 GLN H 1 39 GLN QG . . 4.230 1.883 1.743 1.958 . 0 0 "[ . 1 . 2 . ]" 1
765 1 39 GLN H 1 40 GLY H . . 5.160 2.774 2.720 2.829 . 0 0 "[ . 1 . 2 . ]" 1
766 1 39 GLN H 1 41 GLN H . . 4.930 4.090 3.976 4.258 . 0 0 "[ . 1 . 2 . ]" 1
767 1 39 GLN H 1 54 VAL QG . . 4.130 3.644 3.019 3.752 . 0 0 "[ . 1 . 2 . ]" 1
768 1 39 GLN QG 1 40 GLY HA3 . . 4.970 4.233 3.873 5.510 0.540 17 1 "[ . 1 . + 2 . ]" 1
769 1 39 GLN QG 1 40 GLY H . . 5.500 2.513 2.085 3.632 . 0 0 "[ . 1 . 2 . ]" 1
770 1 39 GLN QG 1 54 VAL QG . . 4.420 3.373 1.735 3.824 . 0 0 "[ . 1 . 2 . ]" 1
771 1 40 GLY H 1 41 GLN H . . 4.770 2.495 2.318 2.632 . 0 0 "[ . 1 . 2 . ]" 1
772 1 41 GLN HA 1 41 GLN HE21 . . 5.430 4.583 3.233 5.362 . 0 0 "[ . 1 . 2 . ]" 1
773 1 41 GLN HA 1 41 GLN QG . . 3.460 2.486 2.020 3.488 0.028 11 0 "[ . 1 . 2 . ]" 1
774 1 41 GLN QB 1 42 TRP H . . 4.620 3.843 3.452 4.040 . 0 0 "[ . 1 . 2 . ]" 1
775 1 41 GLN QB 2 11 ILE HB . . 5.330 3.643 3.246 4.183 . 0 0 "[ . 1 . 2 . ]" 1
776 1 41 GLN QB 2 11 ILE MD . . 3.970 2.269 1.721 3.289 . 0 0 "[ . 1 . 2 . ]" 1
777 1 41 GLN HE21 2 11 ILE MD . . 5.390 2.812 1.857 5.137 . 0 0 "[ . 1 . 2 . ]" 1
778 1 41 GLN HE21 2 11 ILE MG . . 5.500 3.607 1.991 4.804 . 0 0 "[ . 1 . 2 . ]" 1
779 1 41 GLN HE22 2 11 ILE MD . . 5.500 3.280 1.843 5.020 . 0 0 "[ . 1 . 2 . ]" 1
780 1 41 GLN HE22 2 11 ILE MG . . 5.500 3.690 1.919 5.315 . 0 0 "[ . 1 . 2 . ]" 1
781 1 41 GLN H 1 41 GLN QG . . 5.000 3.913 2.662 4.403 . 0 0 "[ . 1 . 2 . ]" 1
782 1 41 GLN H 1 42 TRP HA . . 5.500 4.940 4.882 5.055 . 0 0 "[ . 1 . 2 . ]" 1
783 1 41 GLN H 1 42 TRP H . . 3.880 3.923 3.819 3.996 0.116 3 0 "[ . 1 . 2 . ]" 1
784 1 41 GLN QG 2 11 ILE MD . . 4.690 2.801 1.723 4.529 . 0 0 "[ . 1 . 2 . ]" 1
785 1 42 TRP HA 1 43 ARG QG . . 4.630 4.040 3.491 4.654 0.024 9 0 "[ . 1 . 2 . ]" 1
786 1 42 TRP HA 1 47 GLY HA3 . . 4.880 4.412 4.257 4.594 . 0 0 "[ . 1 . 2 . ]" 1
787 1 42 TRP HA 1 47 GLY HA2 . . 5.070 4.853 4.687 5.017 . 0 0 "[ . 1 . 2 . ]" 1
788 1 42 TRP HA 2 11 ILE MD . . 5.000 5.068 4.512 5.214 0.214 17 0 "[ . 1 . 2 . ]" 1
789 1 42 TRP HB3 1 46 ALA MB . . 4.740 3.143 2.714 3.342 . 0 0 "[ . 1 . 2 . ]" 1
790 1 42 TRP HB3 1 47 GLY HA2 . . 4.460 2.379 2.230 2.504 . 0 0 "[ . 1 . 2 . ]" 1
791 1 42 TRP HB3 1 50 ALA MB . . 4.550 4.703 4.636 4.787 0.237 11 0 "[ . 1 . 2 . ]" 1
792 1 42 TRP HB2 1 43 ARG H . . 4.240 3.766 3.349 4.179 . 0 0 "[ . 1 . 2 . ]" 1
793 1 42 TRP HB2 1 46 ALA MB . . 4.680 4.621 4.289 4.771 0.091 14 0 "[ . 1 . 2 . ]" 1
794 1 42 TRP HB2 1 47 GLY HA3 . . 4.300 2.670 2.384 2.937 . 0 0 "[ . 1 . 2 . ]" 1
795 1 42 TRP HB2 1 47 GLY H . . 5.210 3.949 3.447 4.257 . 0 0 "[ . 1 . 2 . ]" 1
796 1 42 TRP HD1 1 46 ALA MB . . 5.370 5.478 5.279 5.589 0.219 28 0 "[ . 1 . 2 . ]" 1
797 1 42 TRP HE1 1 50 ALA MB . . 5.240 2.488 2.300 2.778 . 0 0 "[ . 1 . 2 . ]" 1
798 1 42 TRP HE3 1 43 ARG H . . 4.730 3.024 2.817 3.366 . 0 0 "[ . 1 . 2 . ]" 1
799 1 42 TRP HE3 1 46 ALA MB . . 4.340 1.924 1.796 2.007 . 0 0 "[ . 1 . 2 . ]" 1
800 1 42 TRP HE3 1 47 GLY HA3 . . 4.970 4.189 4.072 4.374 . 0 0 "[ . 1 . 2 . ]" 1
801 1 42 TRP HE3 1 47 GLY HA2 . . 4.910 5.002 4.817 5.089 0.179 28 0 "[ . 1 . 2 . ]" 1
802 1 42 TRP HE3 1 50 ALA MB . . 4.560 4.615 4.572 4.680 0.120 18 0 "[ . 1 . 2 . ]" 1
803 1 42 TRP HE3 2 83 MET HG2 . . 5.370 3.310 2.175 4.414 . 0 0 "[ . 1 . 2 . ]" 1
804 1 42 TRP HE3 2 83 MET HG3 . . 5.500 3.365 2.183 4.747 . 0 0 "[ . 1 . 2 . ]" 1
805 1 42 TRP HH2 1 50 ALA MB . . 4.390 3.654 3.520 3.819 . 0 0 "[ . 1 . 2 . ]" 1
806 1 42 TRP HH2 2 76 ILE HA . . 4.820 1.963 1.901 2.099 . 0 0 "[ . 1 . 2 . ]" 1
807 1 42 TRP HH2 2 76 ILE HB . . 5.500 4.945 4.894 5.084 . 0 0 "[ . 1 . 2 . ]" 1
808 1 42 TRP HH2 2 76 ILE MD . . 4.960 4.866 4.675 5.016 0.056 26 0 "[ . 1 . 2 . ]" 1
809 1 42 TRP HH2 2 76 ILE QG . . 5.230 3.348 3.157 3.582 . 0 0 "[ . 1 . 2 . ]" 1
810 1 42 TRP HH2 2 76 ILE MG . . 4.340 3.748 3.480 3.872 . 0 0 "[ . 1 . 2 . ]" 1
811 1 42 TRP H 1 42 TRP HB2 . . 3.860 3.003 2.960 3.047 . 0 0 "[ . 1 . 2 . ]" 1
812 1 42 TRP H 1 42 TRP HD1 . . 4.470 4.514 4.402 4.626 0.156 14 0 "[ . 1 . 2 . ]" 1
813 1 42 TRP H 1 42 TRP HE3 . . 5.000 4.954 4.847 5.087 0.087 16 0 "[ . 1 . 2 . ]" 1
814 1 42 TRP H 1 43 ARG H . . 5.010 4.292 4.176 4.336 . 0 0 "[ . 1 . 2 . ]" 1
815 1 42 TRP H 1 43 ARG QG . . 5.500 4.415 3.407 5.573 0.073 24 0 "[ . 1 . 2 . ]" 1
816 1 42 TRP HZ2 1 50 ALA MB . . 4.230 2.532 2.344 2.742 . 0 0 "[ . 1 . 2 . ]" 1
817 1 42 TRP HZ2 2 76 ILE HA . . 5.020 2.622 2.272 2.887 . 0 0 "[ . 1 . 2 . ]" 1
818 1 42 TRP HZ2 2 76 ILE HB . . 5.500 4.692 4.479 4.826 . 0 0 "[ . 1 . 2 . ]" 1
819 1 42 TRP HZ2 2 76 ILE MD . . 4.150 3.406 3.205 3.539 . 0 0 "[ . 1 . 2 . ]" 1
820 1 42 TRP HZ2 2 76 ILE QG . . 5.180 1.886 1.825 1.952 . 0 0 "[ . 1 . 2 . ]" 1
821 1 42 TRP HZ2 2 76 ILE MG . . 4.780 3.582 3.225 3.738 . 0 0 "[ . 1 . 2 . ]" 1
822 1 42 TRP HZ3 1 50 ALA MB . . 4.390 4.537 4.489 4.644 0.254 16 0 "[ . 1 . 2 . ]" 1
823 1 42 TRP HZ3 2 76 ILE HA . . 5.080 4.333 4.233 4.455 . 0 0 "[ . 1 . 2 . ]" 1
824 1 42 TRP HZ3 2 83 MET HG2 . . 5.500 3.180 1.971 4.601 . 0 0 "[ . 1 . 2 . ]" 1
825 1 42 TRP HZ3 2 83 MET HG3 . . 5.500 3.138 1.972 5.009 . 0 0 "[ . 1 . 2 . ]" 1
826 1 43 ARG HA 1 43 ARG HD2 . . 3.810 3.405 2.182 4.157 0.347 10 0 "[ . 1 . 2 . ]" 1
827 1 43 ARG HA 1 43 ARG HD3 . . 4.100 3.168 2.177 4.171 0.071 24 0 "[ . 1 . 2 . ]" 1
828 1 43 ARG HA 1 43 ARG QG . . 3.720 2.430 2.059 3.458 . 0 0 "[ . 1 . 2 . ]" 1
829 1 43 ARG HB2 1 43 ARG HD3 . . 3.990 3.598 2.085 4.278 0.288 23 0 "[ . 1 . 2 . ]" 1
830 1 43 ARG HB2 1 46 ALA MB . . 4.570 4.304 3.532 5.076 0.506 22 1 "[ . 1 . 2 + . ]" 1
831 1 43 ARG HB3 1 43 ARG HD3 . . 4.190 3.172 2.319 3.681 . 0 0 "[ . 1 . 2 . ]" 1
832 1 43 ARG H 1 43 ARG QG . . 4.590 3.174 1.940 3.959 . 0 0 "[ . 1 . 2 . ]" 1
833 1 43 ARG H 1 47 GLY HA2 . . 5.380 4.501 3.877 5.077 . 0 0 "[ . 1 . 2 . ]" 1
834 1 43 ARG H 1 47 GLY H . . 5.500 3.639 2.885 4.238 . 0 0 "[ . 1 . 2 . ]" 1
835 1 46 ALA HA 1 50 ALA H . . 4.270 3.746 3.484 3.946 . 0 0 "[ . 1 . 2 . ]" 1
836 1 46 ALA HA 1 50 ALA MB . . 4.260 4.120 3.718 4.356 0.096 10 0 "[ . 1 . 2 . ]" 1
837 1 46 ALA MB 1 47 GLY H . . 4.240 2.924 2.791 3.022 . 0 0 "[ . 1 . 2 . ]" 1
838 1 46 ALA MB 1 50 ALA H . . 4.820 4.384 3.916 4.628 . 0 0 "[ . 1 . 2 . ]" 1
839 1 46 ALA MB 1 50 ALA MB . . 4.150 3.795 3.249 4.145 . 0 0 "[ . 1 . 2 . ]" 1
840 1 46 ALA MB 2 78 GLU QB . . 4.540 4.447 4.032 4.648 0.108 7 0 "[ . 1 . 2 . ]" 1
841 1 46 ALA MB 2 83 MET HA . . 4.170 3.889 3.094 4.278 0.108 17 0 "[ . 1 . 2 . ]" 1
842 1 46 ALA MB 2 83 MET HG2 . . 4.950 3.698 2.689 4.956 0.006 18 0 "[ . 1 . 2 . ]" 1
843 1 46 ALA MB 2 83 MET HG3 . . 5.170 4.024 2.577 5.188 0.018 14 0 "[ . 1 . 2 . ]" 1
844 1 46 ALA MB 2 83 MET H . . 5.080 5.072 4.481 5.274 0.194 27 0 "[ . 1 . 2 . ]" 1
845 1 47 GLY HA3 1 50 ALA MB . . 3.810 3.171 2.786 3.487 . 0 0 "[ . 1 . 2 . ]" 1
846 1 47 GLY HA2 1 48 THR HA . . 4.650 4.306 4.303 4.312 . 0 0 "[ . 1 . 2 . ]" 1
847 1 47 GLY HA2 1 50 ALA H . . 5.100 4.639 4.424 4.788 . 0 0 "[ . 1 . 2 . ]" 1
848 1 47 GLY H 1 48 THR HA . . 5.500 5.360 5.279 5.463 . 0 0 "[ . 1 . 2 . ]" 1
849 1 47 GLY H 1 48 THR H . . 4.560 2.897 2.782 3.026 . 0 0 "[ . 1 . 2 . ]" 1
850 1 47 GLY H 1 49 ALA H . . 5.500 3.649 3.508 3.851 . 0 0 "[ . 1 . 2 . ]" 1
851 1 47 GLY H 1 50 ALA MB . . 5.400 4.772 4.602 4.957 . 0 0 "[ . 1 . 2 . ]" 1
852 1 48 THR HA 1 48 THR MG . . 2.910 2.355 1.996 2.482 . 0 0 "[ . 1 . 2 . ]" 1
853 1 48 THR HA 1 51 GLN HB3 . . 3.320 2.547 2.089 3.215 . 0 0 "[ . 1 . 2 . ]" 1
854 1 48 THR HA 1 51 GLN HE21 . . 5.300 4.643 3.763 5.284 . 0 0 "[ . 1 . 2 . ]" 1
855 1 48 THR HA 1 51 GLN H . . 4.540 3.814 3.432 4.178 . 0 0 "[ . 1 . 2 . ]" 1
856 1 48 THR HA 1 51 GLN QG . . 4.020 3.468 1.904 4.207 0.187 11 0 "[ . 1 . 2 . ]" 1
857 1 48 THR HA 1 52 ALA H . . 5.100 3.303 2.949 3.642 . 0 0 "[ . 1 . 2 . ]" 1
858 1 48 THR HA 1 52 ALA MB . . 4.670 3.607 3.395 4.075 . 0 0 "[ . 1 . 2 . ]" 1
859 1 48 THR HB 1 52 ALA MB . . 4.080 3.936 3.617 4.183 0.103 16 0 "[ . 1 . 2 . ]" 1
860 1 48 THR H 1 48 THR MG . . 4.760 2.220 1.872 3.517 . 0 0 "[ . 1 . 2 . ]" 1
861 1 48 THR H 1 49 ALA H . . 4.570 2.732 2.629 2.797 . 0 0 "[ . 1 . 2 . ]" 1
862 1 48 THR MG 1 49 ALA H . . 4.940 4.027 3.784 4.331 . 0 0 "[ . 1 . 2 . ]" 1
863 1 48 THR MG 1 51 GLN HB3 . . 4.260 4.139 3.872 4.443 0.183 14 0 "[ . 1 . 2 . ]" 1
864 1 48 THR MG 1 51 GLN HE22 . . 5.500 5.408 4.510 6.499 0.999 5 5 "[ * + 1 *. 2- * . ]" 1
865 1 48 THR MG 1 52 ALA H . . 5.480 5.015 3.648 5.504 0.024 27 0 "[ . 1 . 2 . ]" 1
866 1 49 ALA HA 2 75 THR HB . . 5.260 5.263 5.013 5.442 0.182 22 0 "[ . 1 . 2 . ]" 1
867 1 49 ALA HA 2 75 THR MG . . 3.660 3.588 3.121 3.707 0.047 16 0 "[ . 1 . 2 . ]" 1
868 1 49 ALA H 1 49 ALA MB . . 3.640 2.117 2.064 2.174 . 0 0 "[ . 1 . 2 . ]" 1
869 1 49 ALA H 1 50 ALA MB . . 5.470 4.257 4.070 4.478 . 0 0 "[ . 1 . 2 . ]" 1
870 1 49 ALA MB 1 50 ALA HA . . 4.290 3.864 3.818 3.895 . 0 0 "[ . 1 . 2 . ]" 1
871 1 49 ALA MB 1 50 ALA H . . 3.770 2.469 2.320 2.586 . 0 0 "[ . 1 . 2 . ]" 1
872 1 49 ALA MB 1 50 ALA MB . . 4.220 3.528 3.354 3.625 . 0 0 "[ . 1 . 2 . ]" 1
873 1 49 ALA MB 2 75 THR HB . . 4.950 3.404 3.073 3.865 . 0 0 "[ . 1 . 2 . ]" 1
874 1 50 ALA HA 1 53 ALA H . . 4.480 3.132 2.924 3.376 . 0 0 "[ . 1 . 2 . ]" 1
875 1 50 ALA HA 1 53 ALA MB . . 3.410 2.287 2.098 2.561 . 0 0 "[ . 1 . 2 . ]" 1
876 1 50 ALA HA 1 54 VAL QG . . 3.350 3.365 3.105 3.568 0.218 12 0 "[ . 1 . 2 . ]" 1
877 1 50 ALA HA 2 72 LEU HA . . 3.510 3.568 3.349 3.824 0.314 22 0 "[ . 1 . 2 . ]" 1
878 1 50 ALA HA 2 72 LEU QD . . 4.410 3.637 3.203 4.269 . 0 0 "[ . 1 . 2 . ]" 1
879 1 50 ALA H 1 50 ALA MB . . 3.360 2.058 1.968 2.196 . 0 0 "[ . 1 . 2 . ]" 1
880 1 50 ALA H 1 51 GLN HB3 . . 5.130 4.387 4.216 4.527 . 0 0 "[ . 1 . 2 . ]" 1
881 1 50 ALA H 1 51 GLN H . . 3.870 2.632 2.508 2.687 . 0 0 "[ . 1 . 2 . ]" 1
882 1 50 ALA MB 1 51 GLN HA . . 4.800 3.647 3.559 3.728 . 0 0 "[ . 1 . 2 . ]" 1
883 1 50 ALA MB 1 51 GLN H . . 3.840 2.366 2.118 2.531 . 0 0 "[ . 1 . 2 . ]" 1
884 1 50 ALA MB 1 51 GLN QG . . 5.200 5.158 4.774 5.324 0.124 13 0 "[ . 1 . 2 . ]" 1
885 1 50 ALA MB 1 52 ALA H . . 5.500 4.426 4.183 4.719 . 0 0 "[ . 1 . 2 . ]" 1
886 1 50 ALA MB 1 53 ALA MB . . 3.850 3.542 3.396 3.720 . 0 0 "[ . 1 . 2 . ]" 1
887 1 50 ALA MB 1 54 VAL QG . . 3.420 2.819 2.610 2.975 . 0 0 "[ . 1 . 2 . ]" 1
888 1 50 ALA MB 2 72 LEU HA . . 4.240 4.343 4.237 4.442 0.202 9 0 "[ . 1 . 2 . ]" 1
889 1 50 ALA MB 2 72 LEU QD . . 3.950 3.395 3.050 3.893 . 0 0 "[ . 1 . 2 . ]" 1
890 1 50 ALA MB 2 75 THR HB . . 4.020 2.752 2.404 2.968 . 0 0 "[ . 1 . 2 . ]" 1
891 1 50 ALA MB 2 76 ILE HA . . 3.910 3.442 3.041 3.647 . 0 0 "[ . 1 . 2 . ]" 1
892 1 50 ALA MB 2 76 ILE QG . . 4.370 2.289 2.150 2.425 . 0 0 "[ . 1 . 2 . ]" 1
893 1 50 ALA MB 2 76 ILE MG . . 4.180 4.380 4.225 4.464 0.284 18 0 "[ . 1 . 2 . ]" 1
894 1 51 GLN HA 1 51 GLN HE22 . . 5.250 5.237 4.827 5.464 0.214 25 0 "[ . 1 . 2 . ]" 1
895 1 51 GLN HA 1 51 GLN HE21 . . 4.940 4.239 3.821 4.977 0.037 16 0 "[ . 1 . 2 . ]" 1
896 1 51 GLN HA 1 51 GLN QG . . 3.480 2.870 2.483 3.464 . 0 0 "[ . 1 . 2 . ]" 1
897 1 51 GLN HA 1 54 VAL H . . 4.180 3.575 3.208 4.010 . 0 0 "[ . 1 . 2 . ]" 1
898 1 51 GLN HA 1 54 VAL QG . . 3.540 2.081 1.802 2.332 . 0 0 "[ . 1 . 2 . ]" 1
899 1 51 GLN HB2 1 54 VAL QG . . 4.230 3.945 3.548 4.220 . 0 0 "[ . 1 . 2 . ]" 1
900 1 51 GLN HB3 1 51 GLN HE22 . . 5.070 4.530 3.915 5.411 0.341 16 0 "[ . 1 . 2 . ]" 1
901 1 51 GLN HB3 1 52 ALA H . . 3.790 2.925 2.471 3.553 . 0 0 "[ . 1 . 2 . ]" 1
902 1 51 GLN HB3 1 52 ALA MB . . 4.510 4.259 3.915 4.842 0.332 20 0 "[ . 1 . 2 . ]" 1
903 1 51 GLN HE22 1 52 ALA HA . . 5.470 2.466 2.154 3.518 . 0 0 "[ . 1 . 2 . ]" 1
904 1 51 GLN HE22 1 52 ALA MB . . 5.500 3.063 2.394 4.693 . 0 0 "[ . 1 . 2 . ]" 1
905 1 51 GLN HE22 1 55 VAL HB . . 5.500 3.539 1.938 4.088 . 0 0 "[ . 1 . 2 . ]" 1
906 1 51 GLN HE22 1 55 VAL H . . 5.470 4.780 3.942 5.489 0.019 19 0 "[ . 1 . 2 . ]" 1
907 1 51 GLN HE22 1 55 VAL MG2 . . 4.410 2.789 1.832 4.268 . 0 0 "[ . 1 . 2 . ]" 1
908 1 51 GLN HE22 1 55 VAL MG1 . . 5.000 3.674 2.590 4.471 . 0 0 "[ . 1 . 2 . ]" 1
909 1 51 GLN HE21 1 55 VAL H . . 5.500 3.889 3.201 4.893 . 0 0 "[ . 1 . 2 . ]" 1
910 1 51 GLN HE21 1 55 VAL MG2 . . 4.600 2.480 1.885 3.385 . 0 0 "[ . 1 . 2 . ]" 1
911 1 51 GLN HE21 1 55 VAL MG1 . . 4.820 3.709 2.332 4.674 . 0 0 "[ . 1 . 2 . ]" 1
912 1 51 GLN H 1 51 GLN HB3 . . 3.340 2.255 2.031 2.448 . 0 0 "[ . 1 . 2 . ]" 1
913 1 51 GLN H 1 51 GLN QG . . 4.000 3.786 3.220 4.027 0.027 18 0 "[ . 1 . 2 . ]" 1
914 1 51 GLN H 1 52 ALA HA . . 5.400 5.473 5.401 5.545 0.145 8 0 "[ . 1 . 2 . ]" 1
915 1 51 GLN H 1 52 ALA H . . 3.680 2.990 2.883 3.099 . 0 0 "[ . 1 . 2 . ]" 1
916 1 51 GLN H 1 52 ALA MB . . 4.700 4.571 4.462 4.625 . 0 0 "[ . 1 . 2 . ]" 1
917 1 51 GLN H 1 54 VAL H . . 5.500 4.645 4.428 4.846 . 0 0 "[ . 1 . 2 . ]" 1
918 1 51 GLN H 1 54 VAL QG . . 4.880 3.480 3.276 3.607 . 0 0 "[ . 1 . 2 . ]" 1
919 1 51 GLN QG 1 52 ALA HA . . 4.570 3.564 2.906 3.947 . 0 0 "[ . 1 . 2 . ]" 1
920 1 51 GLN QG 1 52 ALA H . . 4.790 3.224 2.109 3.869 . 0 0 "[ . 1 . 2 . ]" 1
921 1 51 GLN QG 1 54 VAL QG . . 4.560 3.918 3.211 4.598 0.038 2 0 "[ . 1 . 2 . ]" 1
922 1 51 GLN QG 1 55 VAL MG2 . . 3.790 3.216 2.266 4.349 0.559 28 1 "[ . 1 . 2 . +]" 1
923 1 52 ALA HA 1 55 VAL HB . . 3.570 2.497 2.023 2.972 . 0 0 "[ . 1 . 2 . ]" 1
924 1 52 ALA HA 1 55 VAL H . . 4.540 3.303 3.030 3.618 . 0 0 "[ . 1 . 2 . ]" 1
925 1 52 ALA HA 1 55 VAL MG2 . . 3.410 3.170 2.775 4.103 0.693 25 4 "[ *. 1 * 2 + -]" 1
926 1 52 ALA HA 1 55 VAL MG1 . . 3.800 3.282 1.869 4.063 0.263 2 0 "[ . 1 . 2 . ]" 1
927 1 52 ALA HA 1 56 ARG H . . 3.950 3.867 3.506 4.054 0.104 27 0 "[ . 1 . 2 . ]" 1
928 1 52 ALA H 1 52 ALA MB . . 3.290 2.154 2.032 2.211 . 0 0 "[ . 1 . 2 . ]" 1
929 1 52 ALA H 1 53 ALA H . . 3.490 2.595 2.388 2.822 . 0 0 "[ . 1 . 2 . ]" 1
930 1 52 ALA H 1 54 VAL H . . 5.300 4.045 3.666 4.613 . 0 0 "[ . 1 . 2 . ]" 1
931 1 52 ALA H 1 54 VAL QG . . 5.060 4.065 3.592 4.579 . 0 0 "[ . 1 . 2 . ]" 1
932 1 52 ALA MB 1 53 ALA H . . 3.530 2.556 2.365 2.972 . 0 0 "[ . 1 . 2 . ]" 1
933 1 52 ALA MB 1 55 VAL HB . . 4.310 4.018 3.667 4.558 0.248 28 0 "[ . 1 . 2 . ]" 1
934 1 52 ALA MB 1 55 VAL H . . 4.900 4.523 4.257 4.773 . 0 0 "[ . 1 . 2 . ]" 1
935 1 52 ALA MB 1 55 VAL MG2 . . 4.180 4.387 4.126 5.019 0.839 25 6 "[ *. 1 -* * 2 + *]" 1
936 1 53 ALA HA 1 56 ARG QB . . 3.780 2.783 2.631 2.967 . 0 0 "[ . 1 . 2 . ]" 1
937 1 53 ALA HA 1 56 ARG QD . . 4.630 3.815 2.543 4.556 . 0 0 "[ . 1 . 2 . ]" 1
938 1 53 ALA HA 1 56 ARG QG . . 4.470 4.323 3.627 4.681 0.211 25 0 "[ . 1 . 2 . ]" 1
939 1 53 ALA HA 2 71 ASN HD21 . . 5.030 3.261 2.483 3.750 . 0 0 "[ . 1 . 2 . ]" 1
940 1 53 ALA HA 2 71 ASN HD22 . . 4.870 4.667 3.866 5.127 0.257 25 0 "[ . 1 . 2 . ]" 1
941 1 53 ALA HA 2 72 LEU QD . . 4.530 4.245 4.035 4.461 . 0 0 "[ . 1 . 2 . ]" 1
942 1 53 ALA H 1 54 VAL H . . 3.570 2.723 2.464 2.944 . 0 0 "[ . 1 . 2 . ]" 1
943 1 53 ALA H 1 54 VAL QG . . 4.340 3.580 3.126 3.942 . 0 0 "[ . 1 . 2 . ]" 1
944 1 53 ALA MB 1 54 VAL HA . . 4.690 3.833 3.713 3.939 . 0 0 "[ . 1 . 2 . ]" 1
945 1 53 ALA MB 1 54 VAL QG . . 3.070 2.918 2.685 3.143 0.073 18 0 "[ . 1 . 2 . ]" 1
946 1 53 ALA MB 1 56 ARG QB . . 4.310 4.178 4.030 4.282 . 0 0 "[ . 1 . 2 . ]" 1
947 1 53 ALA MB 1 56 ARG H . . 4.870 4.799 4.613 4.955 0.085 8 0 "[ . 1 . 2 . ]" 1
948 1 53 ALA MB 2 71 ASN HB2 . . 5.210 4.159 3.867 4.427 . 0 0 "[ . 1 . 2 . ]" 1
949 1 53 ALA MB 2 71 ASN HB3 . . 4.660 2.642 2.323 2.933 . 0 0 "[ . 1 . 2 . ]" 1
950 1 53 ALA MB 2 71 ASN HD21 . . 4.980 2.618 1.844 3.531 . 0 0 "[ . 1 . 2 . ]" 1
951 1 53 ALA MB 2 71 ASN HD22 . . 4.540 3.638 2.926 4.292 . 0 0 "[ . 1 . 2 . ]" 1
952 1 53 ALA MB 2 72 LEU HA . . 3.040 1.855 1.741 1.949 . 0 0 "[ . 1 . 2 . ]" 1
953 1 53 ALA MB 2 72 LEU HB2 . . 4.320 2.529 2.139 2.930 . 0 0 "[ . 1 . 2 . ]" 1
954 1 53 ALA MB 2 72 LEU HG . . 5.280 3.842 3.392 4.294 . 0 0 "[ . 1 . 2 . ]" 1
955 1 53 ALA MB 2 72 LEU QD . . 3.210 2.411 1.983 2.881 . 0 0 "[ . 1 . 2 . ]" 1
956 1 53 ALA MB 2 74 ARG HB2 . . 4.690 4.793 4.703 4.899 0.209 22 0 "[ . 1 . 2 . ]" 1
957 1 53 ALA MB 2 75 THR HB . . 3.860 3.303 2.945 3.505 . 0 0 "[ . 1 . 2 . ]" 1
958 1 53 ALA MB 2 75 THR H . . 5.500 4.168 4.011 4.250 . 0 0 "[ . 1 . 2 . ]" 1
959 1 54 VAL HA 1 57 PHE HA . . 5.500 5.278 5.081 5.518 0.018 11 0 "[ . 1 . 2 . ]" 1
960 1 54 VAL HA 1 57 PHE HB3 . . 3.890 2.298 2.091 2.550 . 0 0 "[ . 1 . 2 . ]" 1
961 1 54 VAL HA 1 57 PHE HB2 . . 4.140 3.811 3.574 4.089 . 0 0 "[ . 1 . 2 . ]" 1
962 1 54 VAL HA 1 57 PHE H . . 4.740 3.463 3.321 3.649 . 0 0 "[ . 1 . 2 . ]" 1
963 1 54 VAL HA 1 57 PHE QE . . 4.600 4.600 4.293 4.767 0.167 16 0 "[ . 1 . 2 . ]" 1
964 1 54 VAL HA 1 58 GLN H . . 5.170 3.658 3.565 3.835 . 0 0 "[ . 1 . 2 . ]" 1
965 1 54 VAL HA 2 72 LEU QD . . 3.760 2.084 1.779 2.487 . 0 0 "[ . 1 . 2 . ]" 1
966 1 54 VAL HB 1 55 VAL H . . 4.250 3.262 2.330 4.255 0.005 6 0 "[ . 1 . 2 . ]" 1
967 1 54 VAL HB 2 72 LEU QD . . 4.820 2.871 1.746 3.787 . 0 0 "[ . 1 . 2 . ]" 1
968 1 54 VAL H 1 54 VAL HB . . 3.570 2.690 2.406 3.022 . 0 0 "[ . 1 . 2 . ]" 1
969 1 54 VAL H 1 54 VAL QG . . 3.470 1.897 1.618 2.181 . 0 0 "[ . 1 . 2 . ]" 1
970 1 54 VAL H 1 55 VAL H . . 3.590 2.620 2.425 2.910 . 0 0 "[ . 1 . 2 . ]" 1
971 1 54 VAL H 1 56 ARG H . . 5.500 4.288 3.974 4.552 . 0 0 "[ . 1 . 2 . ]" 1
972 1 54 VAL H 1 57 PHE H . . 5.500 4.597 4.451 4.692 . 0 0 "[ . 1 . 2 . ]" 1
973 1 54 VAL H 2 72 LEU QD . . 4.590 2.707 2.048 3.238 . 0 0 "[ . 1 . 2 . ]" 1
974 1 54 VAL QG 1 57 PHE HB3 . . 4.450 3.740 3.503 3.936 . 0 0 "[ . 1 . 2 . ]" 1
975 1 54 VAL QG 1 57 PHE H . . 5.490 4.407 4.268 4.567 . 0 0 "[ . 1 . 2 . ]" 1
976 1 54 VAL QG 1 58 GLN H . . 5.230 3.645 3.546 3.810 . 0 0 "[ . 1 . 2 . ]" 1
977 1 54 VAL QG 2 72 LEU HA . . 4.380 4.072 3.682 4.523 0.143 5 0 "[ . 1 . 2 . ]" 1
978 1 54 VAL QG 2 72 LEU HG . . 4.380 3.596 3.077 4.342 . 0 0 "[ . 1 . 2 . ]" 1
979 1 54 VAL QG 2 72 LEU QD . . 3.190 1.887 1.596 2.329 . 0 0 "[ . 1 . 2 . ]" 1
980 1 54 VAL QG 1 57 PHE HB2 . . 5.500 4.891 4.607 5.157 . 0 0 "[ . 1 . 2 . ]" 1
981 1 54 VAL QG 1 57 PHE QE . . 3.950 3.625 3.398 3.897 . 0 0 "[ . 1 . 2 . ]" 1
982 1 54 VAL QG 1 58 GLN HA . . 4.650 4.521 4.370 4.745 0.095 16 0 "[ . 1 . 2 . ]" 1
983 1 54 VAL QG 1 58 GLN HE22 . . 4.500 3.903 3.515 4.561 0.061 10 0 "[ . 1 . 2 . ]" 1
984 1 54 VAL QG 1 58 GLN HE21 . . 4.480 2.980 2.098 4.528 0.048 8 0 "[ . 1 . 2 . ]" 1
985 1 54 VAL QG 1 58 GLN HG3 . . 3.770 2.001 1.897 2.291 . 0 0 "[ . 1 . 2 . ]" 1
986 1 54 VAL QG 1 58 GLN HG2 . . 4.190 2.651 2.420 3.187 . 0 0 "[ . 1 . 2 . ]" 1
987 1 55 VAL HA 1 55 VAL MG2 . . 3.020 2.183 1.997 2.289 . 0 0 "[ . 1 . 2 . ]" 1
988 1 55 VAL HA 1 55 VAL MG1 . . 3.270 2.713 2.519 3.158 . 0 0 "[ . 1 . 2 . ]" 1
989 1 55 VAL HA 1 58 GLN HB3 . . 4.250 4.170 3.947 4.296 0.046 14 0 "[ . 1 . 2 . ]" 1
990 1 55 VAL HA 1 58 GLN HB2 . . 3.570 2.623 2.392 2.785 . 0 0 "[ . 1 . 2 . ]" 1
991 1 55 VAL HA 1 58 GLN HE21 . . 5.440 4.950 2.799 5.605 0.165 9 0 "[ . 1 . 2 . ]" 1
992 1 55 VAL HA 1 58 GLN HG3 . . 4.480 3.048 2.687 3.729 . 0 0 "[ . 1 . 2 . ]" 1
993 1 55 VAL HA 1 58 GLN HG2 . . 4.410 4.466 4.292 4.650 0.240 22 0 "[ . 1 . 2 . ]" 1
994 1 55 VAL HA 1 58 GLN H . . 4.390 3.541 3.441 3.657 . 0 0 "[ . 1 . 2 . ]" 1
995 1 55 VAL HA 1 59 GLU H . . 4.780 4.022 3.711 4.381 . 0 0 "[ . 1 . 2 . ]" 1
996 1 55 VAL HB 1 56 ARG H . . 3.960 2.764 2.460 3.504 . 0 0 "[ . 1 . 2 . ]" 1
997 1 55 VAL HB 1 57 PHE H . . 5.420 5.186 5.037 5.606 0.186 25 0 "[ . 1 . 2 . ]" 1
998 1 55 VAL H 1 55 VAL HB . . 4.010 2.168 2.042 2.360 . 0 0 "[ . 1 . 2 . ]" 1
999 1 55 VAL H 1 55 VAL MG2 . . 3.780 2.728 2.247 3.552 . 0 0 "[ . 1 . 2 . ]" 1
1000 1 55 VAL H 1 55 VAL MG1 . . 4.230 3.423 2.644 3.692 . 0 0 "[ . 1 . 2 . ]" 1
1001 1 55 VAL H 1 56 ARG QB . . 5.500 4.557 4.367 4.797 . 0 0 "[ . 1 . 2 . ]" 1
1002 1 55 VAL MG2 1 56 ARG H . . 4.560 4.006 3.915 4.112 . 0 0 "[ . 1 . 2 . ]" 1
1003 1 55 VAL MG2 1 58 GLN HB2 . . 4.690 4.193 3.690 4.492 . 0 0 "[ . 1 . 2 . ]" 1
1004 1 55 VAL MG1 1 56 ARG HA . . 4.250 3.051 2.708 3.318 . 0 0 "[ . 1 . 2 . ]" 1
1005 1 55 VAL MG1 1 56 ARG H . . 4.390 2.646 1.807 3.169 . 0 0 "[ . 1 . 2 . ]" 1
1006 1 55 VAL MG1 1 57 PHE H . . 5.450 4.718 4.070 5.036 . 0 0 "[ . 1 . 2 . ]" 1
1007 1 55 VAL MG1 1 58 GLN HB2 . . 4.170 4.168 3.824 4.786 0.616 28 6 "[ *. 1 *- * 2 * +]" 1
1008 1 55 VAL MG1 1 58 GLN H . . 4.610 4.714 4.590 4.827 0.217 16 0 "[ . 1 . 2 . ]" 1
1009 1 55 VAL MG1 1 59 GLU HG3 . . 3.740 3.330 2.529 4.414 0.674 13 1 "[ . 1 + . 2 . ]" 1
1010 1 55 VAL MG1 1 59 GLU HG2 . . 4.080 3.841 2.992 4.929 0.849 28 5 "[ . 1 ** - 2 * +]" 1
1011 1 55 VAL MG1 1 59 GLU H . . 4.800 4.088 3.654 4.751 . 0 0 "[ . 1 . 2 . ]" 1
1012 1 56 ARG HA 1 56 ARG QD . . 4.190 3.434 2.279 3.988 . 0 0 "[ . 1 . 2 . ]" 1
1013 1 56 ARG HA 1 59 GLU HB2 . . 3.990 3.072 2.942 3.270 . 0 0 "[ . 1 . 2 . ]" 1
1014 1 56 ARG HA 1 59 GLU HG3 . . 4.610 3.934 3.260 4.390 . 0 0 "[ . 1 . 2 . ]" 1
1015 1 56 ARG HA 1 59 GLU H . . 4.750 3.720 3.530 3.853 . 0 0 "[ . 1 . 2 . ]" 1
1016 1 56 ARG QB 1 57 PHE H . . 4.350 2.499 2.396 2.682 . 0 0 "[ . 1 . 2 . ]" 1
1017 1 56 ARG QB 2 68 ALA MB . . 4.480 2.986 2.651 3.614 . 0 0 "[ . 1 . 2 . ]" 1
1018 1 56 ARG H 1 56 ARG QB . . 3.620 2.194 2.068 2.340 . 0 0 "[ . 1 . 2 . ]" 1
1019 1 56 ARG H 1 56 ARG QD . . 5.330 3.244 1.902 4.506 . 0 0 "[ . 1 . 2 . ]" 1
1020 1 56 ARG H 1 57 PHE H . . 4.110 2.790 2.673 2.881 . 0 0 "[ . 1 . 2 . ]" 1
1021 1 56 ARG H 1 58 GLN H . . 5.160 4.133 3.980 4.356 . 0 0 "[ . 1 . 2 . ]" 1
1022 1 56 ARG H 1 59 GLU H . . 5.500 4.932 4.840 5.034 . 0 0 "[ . 1 . 2 . ]" 1
1023 1 57 PHE HA 1 60 ALA H . . 5.040 3.399 3.333 3.454 . 0 0 "[ . 1 . 2 . ]" 1
1024 1 57 PHE HA 1 60 ALA MB . . 3.370 2.326 2.151 2.448 . 0 0 "[ . 1 . 2 . ]" 1
1025 1 57 PHE HA 1 61 ALA H . . 5.230 4.200 4.057 4.308 . 0 0 "[ . 1 . 2 . ]" 1
1026 1 57 PHE HA 2 65 LEU QD . . 4.570 2.729 2.575 3.021 . 0 0 "[ . 1 . 2 . ]" 1
1027 1 57 PHE HB3 2 68 ALA MB . . 4.690 3.076 2.864 3.416 . 0 0 "[ . 1 . 2 . ]" 1
1028 1 57 PHE HB3 2 72 LEU QD . . 4.690 3.209 2.738 3.631 . 0 0 "[ . 1 . 2 . ]" 1
1029 1 57 PHE HB2 1 58 GLN H . . 4.830 4.061 3.916 4.164 . 0 0 "[ . 1 . 2 . ]" 1
1030 1 57 PHE HB2 1 60 ALA MB . . 4.520 4.351 4.224 4.467 . 0 0 "[ . 1 . 2 . ]" 1
1031 1 57 PHE HB2 2 68 ALA MB . . 4.310 1.935 1.803 2.185 . 0 0 "[ . 1 . 2 . ]" 1
1032 1 57 PHE HB2 2 69 LEU HA . . 5.500 3.581 3.382 3.749 . 0 0 "[ . 1 . 2 . ]" 1
1033 1 57 PHE HB2 2 72 LEU QD . . 4.650 3.676 3.230 4.082 . 0 0 "[ . 1 . 2 . ]" 1
1034 1 57 PHE H 1 57 PHE HB3 . . 4.000 1.988 1.957 2.022 . 0 0 "[ . 1 . 2 . ]" 1
1035 1 57 PHE H 1 57 PHE HB2 . . 4.170 2.786 2.730 2.837 . 0 0 "[ . 1 . 2 . ]" 1
1036 1 57 PHE H 1 58 GLN H . . 3.830 2.745 2.636 2.817 . 0 0 "[ . 1 . 2 . ]" 1
1037 1 57 PHE H 1 60 ALA MB . . 5.320 4.456 4.270 4.584 . 0 0 "[ . 1 . 2 . ]" 1
1038 1 57 PHE H 2 68 ALA MB . . 4.950 2.744 2.403 3.151 . 0 0 "[ . 1 . 2 . ]" 1
1039 1 57 PHE H 2 72 LEU QD . . 5.500 4.339 3.948 4.656 . 0 0 "[ . 1 . 2 . ]" 1
1040 1 57 PHE HZ 1 58 GLN HA . . 4.850 4.900 4.811 4.985 0.135 20 0 "[ . 1 . 2 . ]" 1
1041 1 57 PHE HZ 1 61 ALA MB . . 3.800 3.724 3.535 3.894 0.094 17 0 "[ . 1 . 2 . ]" 1
1042 1 57 PHE HZ 2 25 ILE MD . . 5.000 4.657 4.417 4.864 . 0 0 "[ . 1 . 2 . ]" 1
1043 1 57 PHE HZ 2 65 LEU QD . . 3.770 3.472 3.385 3.530 . 0 0 "[ . 1 . 2 . ]" 1
1044 1 57 PHE HZ 2 69 LEU HG . . 5.060 4.256 4.051 4.500 . 0 0 "[ . 1 . 2 . ]" 1
1045 1 57 PHE HZ 2 69 LEU MD1 . . 4.340 4.034 3.754 4.320 . 0 0 "[ . 1 . 2 . ]" 1
1046 1 57 PHE HZ 2 69 LEU MD2 . . 4.210 3.805 3.457 4.018 . 0 0 "[ . 1 . 2 . ]" 1
1047 1 57 PHE HZ 2 72 LEU QD . . 4.950 4.528 4.236 4.825 . 0 0 "[ . 1 . 2 . ]" 1
1048 1 57 PHE QD 1 61 ALA MB . . 4.190 3.922 3.725 4.131 . 0 0 "[ . 1 . 2 . ]" 1
1049 1 57 PHE QD 2 25 ILE MD . . 5.200 5.325 5.250 5.457 0.257 23 0 "[ . 1 . 2 . ]" 1
1050 1 57 PHE QD 2 65 LEU QD . . 4.810 1.878 1.753 2.258 . 0 0 "[ . 1 . 2 . ]" 1
1051 1 57 PHE QE 1 58 GLN HA . . 4.150 3.664 3.375 3.831 . 0 0 "[ . 1 . 2 . ]" 1
1052 1 57 PHE QE 1 58 GLN HG3 . . 4.320 4.267 3.358 4.449 0.129 16 0 "[ . 1 . 2 . ]" 1
1053 1 57 PHE QE 1 58 GLN HG2 . . 4.640 2.842 2.661 3.384 . 0 0 "[ . 1 . 2 . ]" 1
1054 1 57 PHE QE 1 58 GLN H . . 4.460 4.620 4.504 4.694 0.234 18 0 "[ . 1 . 2 . ]" 1
1055 1 57 PHE QE 1 61 ALA MB . . 4.070 3.533 3.370 3.672 . 0 0 "[ . 1 . 2 . ]" 1
1056 1 57 PHE QE 2 65 LEU QD . . 3.930 1.980 1.832 2.335 . 0 0 "[ . 1 . 2 . ]" 1
1057 1 57 PHE QE 2 68 ALA MB . . 4.430 4.551 4.477 4.643 0.213 13 0 "[ . 1 . 2 . ]" 1
1058 1 57 PHE QE 2 69 LEU HA . . 4.400 4.434 4.334 4.502 0.102 13 0 "[ . 1 . 2 . ]" 1
1059 1 57 PHE QE 2 69 LEU HB2 . . 5.040 4.543 4.356 4.696 . 0 0 "[ . 1 . 2 . ]" 1
1060 1 57 PHE QE 2 69 LEU HB3 . . 5.350 5.158 4.903 5.295 . 0 0 "[ . 1 . 2 . ]" 1
1061 1 57 PHE QE 2 69 LEU HG . . 4.950 2.368 2.236 2.471 . 0 0 "[ . 1 . 2 . ]" 1
1062 1 57 PHE QE 2 69 LEU H . . 5.500 5.066 4.895 5.261 . 0 0 "[ . 1 . 2 . ]" 1
1063 1 57 PHE QE 2 69 LEU MD1 . . 4.390 2.234 1.941 2.466 . 0 0 "[ . 1 . 2 . ]" 1
1064 1 57 PHE QE 2 69 LEU MD2 . . 4.500 3.072 2.827 3.341 . 0 0 "[ . 1 . 2 . ]" 1
1065 1 57 PHE QE 2 72 LEU QD . . 4.420 3.770 3.462 4.036 . 0 0 "[ . 1 . 2 . ]" 1
1066 1 58 GLN HA 1 58 GLN HE22 . . 5.490 5.099 4.380 5.704 0.214 22 0 "[ . 1 . 2 . ]" 1
1067 1 58 GLN HA 1 58 GLN HE21 . . 5.500 4.331 2.718 4.878 . 0 0 "[ . 1 . 2 . ]" 1
1068 1 58 GLN HA 1 58 GLN HG3 . . 3.930 3.487 2.687 3.609 . 0 0 "[ . 1 . 2 . ]" 1
1069 1 58 GLN HA 1 58 GLN HG2 . . 3.630 2.286 2.197 2.681 . 0 0 "[ . 1 . 2 . ]" 1
1070 1 58 GLN HA 1 61 ALA H . . 4.700 3.088 2.995 3.173 . 0 0 "[ . 1 . 2 . ]" 1
1071 1 58 GLN HA 1 61 ALA MB . . 3.340 2.224 2.016 2.334 . 0 0 "[ . 1 . 2 . ]" 1
1072 1 58 GLN HA 1 62 ASN H . . 4.670 4.553 4.285 4.792 0.122 25 0 "[ . 1 . 2 . ]" 1
1073 1 58 GLN HB3 1 62 ASN QD . . 4.950 3.502 3.090 3.793 . 0 0 "[ . 1 . 2 . ]" 1
1074 1 58 GLN HB2 1 58 GLN HE22 . . 5.140 4.822 3.446 5.218 0.078 20 0 "[ . 1 . 2 . ]" 1
1075 1 58 GLN HB2 1 59 GLU H . . 3.550 2.414 2.327 2.526 . 0 0 "[ . 1 . 2 . ]" 1
1076 1 58 GLN HB2 1 60 ALA H . . 4.620 4.694 4.602 4.760 0.140 25 0 "[ . 1 . 2 . ]" 1
1077 1 58 GLN HB2 1 61 ALA H . . 5.130 5.134 5.072 5.198 0.068 12 0 "[ . 1 . 2 . ]" 1
1078 1 58 GLN HB2 1 62 ASN QD . . 5.060 4.478 4.114 4.687 . 0 0 "[ . 1 . 2 . ]" 1
1079 1 58 GLN HG3 1 59 GLU H . . 5.290 4.534 4.278 4.693 . 0 0 "[ . 1 . 2 . ]" 1
1080 1 58 GLN HE22 1 58 GLN HG2 . . 3.930 3.779 3.648 4.148 0.218 23 0 "[ . 1 . 2 . ]" 1
1081 1 58 GLN HG2 1 61 ALA MB . . 4.700 3.999 3.702 4.279 . 0 0 "[ . 1 . 2 . ]" 1
1082 1 58 GLN H 1 58 GLN HB2 . . 4.010 2.353 2.275 2.506 . 0 0 "[ . 1 . 2 . ]" 1
1083 1 58 GLN H 1 58 GLN HE21 . . 5.500 4.903 4.193 5.243 . 0 0 "[ . 1 . 2 . ]" 1
1084 1 58 GLN H 1 58 GLN HG3 . . 4.000 2.867 2.147 3.206 . 0 0 "[ . 1 . 2 . ]" 1
1085 1 58 GLN H 1 58 GLN HG2 . . 3.830 2.755 2.480 3.572 . 0 0 "[ . 1 . 2 . ]" 1
1086 1 58 GLN H 1 59 GLU H . . 3.820 2.892 2.780 2.984 . 0 0 "[ . 1 . 2 . ]" 1
1087 1 58 GLN H 1 60 ALA H . . 5.500 3.879 3.794 4.006 . 0 0 "[ . 1 . 2 . ]" 1
1088 1 59 GLU HA 1 59 GLU HG2 . . 3.560 2.495 2.255 2.719 . 0 0 "[ . 1 . 2 . ]" 1
1089 1 59 GLU HA 1 61 ALA MB . . 4.720 4.602 4.520 4.658 . 0 0 "[ . 1 . 2 . ]" 1
1090 1 59 GLU HB2 1 60 ALA H . . 4.150 3.012 2.856 3.151 . 0 0 "[ . 1 . 2 . ]" 1
1091 1 59 GLU HG3 1 60 ALA H . . 5.290 5.105 4.723 5.289 . 0 0 "[ . 1 . 2 . ]" 1
1092 1 59 GLU HG2 1 60 ALA H . . 5.480 4.660 4.493 4.864 . 0 0 "[ . 1 . 2 . ]" 1
1093 1 59 GLU H 1 59 GLU HB2 . . 3.570 2.353 2.191 2.562 . 0 0 "[ . 1 . 2 . ]" 1
1094 1 59 GLU H 1 59 GLU HG3 . . 3.660 3.280 2.735 3.639 . 0 0 "[ . 1 . 2 . ]" 1
1095 1 59 GLU H 1 59 GLU HG2 . . 4.380 2.424 2.145 2.826 . 0 0 "[ . 1 . 2 . ]" 1
1096 1 59 GLU H 1 60 ALA H . . 3.760 2.746 2.667 2.807 . 0 0 "[ . 1 . 2 . ]" 1
1097 1 59 GLU H 1 60 ALA MB . . 4.920 4.360 4.275 4.424 . 0 0 "[ . 1 . 2 . ]" 1
1098 1 59 GLU H 1 61 ALA H . . 5.310 4.022 3.971 4.133 . 0 0 "[ . 1 . 2 . ]" 1
1099 1 60 ALA HA 1 61 ALA MB . . 5.020 4.955 4.933 4.978 . 0 0 "[ . 1 . 2 . ]" 1
1100 1 60 ALA HA 1 62 ASN H . . 4.580 4.395 3.716 4.753 0.173 19 0 "[ . 1 . 2 . ]" 1
1101 1 60 ALA HA 1 63 LYS QB . . 3.930 2.424 2.218 2.599 . 0 0 "[ . 1 . 2 . ]" 1
1102 1 60 ALA HA 1 63 LYS HG2 . . 4.230 4.298 3.553 5.149 0.919 12 3 "[ . -1 + . 2 * . ]" 1
1103 1 60 ALA HA 1 63 LYS QE . . 4.490 3.713 1.791 4.338 . 0 0 "[ . 1 . 2 . ]" 1
1104 1 60 ALA HA 2 64 GLU QG . . 4.710 3.076 2.705 3.245 . 0 0 "[ . 1 . 2 . ]" 1
1105 1 60 ALA HA 2 65 LEU HB2 . . 4.740 4.723 4.423 4.844 0.104 20 0 "[ . 1 . 2 . ]" 1
1106 1 60 ALA HA 2 65 LEU QD . . 4.550 3.864 3.612 3.996 . 0 0 "[ . 1 . 2 . ]" 1
1107 1 60 ALA H 1 60 ALA MB . . 3.450 2.147 2.075 2.212 . 0 0 "[ . 1 . 2 . ]" 1
1108 1 60 ALA H 1 61 ALA H . . 3.870 2.362 2.294 2.484 . 0 0 "[ . 1 . 2 . ]" 1
1109 1 60 ALA H 1 61 ALA MB . . 4.910 3.925 3.828 4.053 . 0 0 "[ . 1 . 2 . ]" 1
1110 1 60 ALA H 1 62 ASN H . . 5.500 4.334 4.007 4.556 . 0 0 "[ . 1 . 2 . ]" 1
1111 1 60 ALA H 2 68 ALA MB . . 4.760 4.377 4.240 4.447 . 0 0 "[ . 1 . 2 . ]" 1
1112 1 60 ALA MB 1 61 ALA H . . 3.930 2.858 2.746 2.916 . 0 0 "[ . 1 . 2 . ]" 1
1113 1 60 ALA MB 1 61 ALA MB . . 3.970 3.952 3.868 3.997 0.027 3 0 "[ . 1 . 2 . ]" 1
1114 1 60 ALA MB 1 62 ASN QD . . 5.500 4.916 4.605 5.337 . 0 0 "[ . 1 . 2 . ]" 1
1115 1 60 ALA MB 1 62 ASN H . . 5.270 4.799 4.392 5.045 . 0 0 "[ . 1 . 2 . ]" 1
1116 1 60 ALA MB 1 63 LYS QB . . 4.360 3.571 3.366 3.736 . 0 0 "[ . 1 . 2 . ]" 1
1117 1 60 ALA MB 1 63 LYS QE . . 4.690 4.459 2.905 4.739 0.049 3 0 "[ . 1 . 2 . ]" 1
1118 1 60 ALA MB 1 64 GLN H . . 5.230 4.426 4.138 4.647 . 0 0 "[ . 1 . 2 . ]" 1
1119 1 60 ALA MB 2 64 GLU HA . . 5.230 4.221 4.072 4.383 . 0 0 "[ . 1 . 2 . ]" 1
1120 1 60 ALA MB 2 64 GLU HB3 . . 4.210 3.160 2.956 3.433 . 0 0 "[ . 1 . 2 . ]" 1
1121 1 60 ALA MB 2 64 GLU HB2 . . 4.000 4.119 4.030 4.210 0.210 20 0 "[ . 1 . 2 . ]" 1
1122 1 60 ALA MB 2 64 GLU QG . . 3.480 1.729 1.701 1.785 . 0 0 "[ . 1 . 2 . ]" 1
1123 1 60 ALA MB 2 65 LEU HA . . 2.670 2.500 2.186 2.637 . 0 0 "[ . 1 . 2 . ]" 1
1124 1 60 ALA MB 2 65 LEU HB2 . . 3.860 2.715 2.400 2.905 . 0 0 "[ . 1 . 2 . ]" 1
1125 1 60 ALA MB 2 65 LEU HB3 . . 4.930 4.091 3.827 4.245 . 0 0 "[ . 1 . 2 . ]" 1
1126 1 60 ALA MB 2 65 LEU QD . . 3.150 2.172 1.873 2.330 . 0 0 "[ . 1 . 2 . ]" 1
1127 1 60 ALA MB 2 68 ALA H . . 5.060 4.464 4.231 4.618 . 0 0 "[ . 1 . 2 . ]" 1
1128 1 60 ALA MB 2 68 ALA MB . . 2.790 2.795 2.598 2.886 0.096 4 0 "[ . 1 . 2 . ]" 1
1129 1 60 ALA MB 2 69 LEU H . . 5.500 5.325 5.082 5.594 0.094 20 0 "[ . 1 . 2 . ]" 1
1130 1 61 ALA HA 1 64 GLN HB2 . . 4.090 2.697 2.480 3.106 . 0 0 "[ . 1 . 2 . ]" 1
1131 1 61 ALA HA 1 64 GLN H . . 4.410 3.446 3.257 3.725 . 0 0 "[ . 1 . 2 . ]" 1
1132 1 61 ALA HA 1 65 LYS QE . . 4.950 3.587 2.708 4.898 . 0 0 "[ . 1 . 2 . ]" 1
1133 1 61 ALA HA 2 65 LEU HA . . 5.230 5.009 4.666 5.373 0.143 10 0 "[ . 1 . 2 . ]" 1
1134 1 61 ALA HA 2 65 LEU HB2 . . 4.070 3.639 3.364 3.917 . 0 0 "[ . 1 . 2 . ]" 1
1135 1 61 ALA HA 2 65 LEU QD . . 3.360 1.977 1.746 2.138 . 0 0 "[ . 1 . 2 . ]" 1
1136 1 61 ALA H 1 61 ALA MB . . 3.430 2.033 1.932 2.123 . 0 0 "[ . 1 . 2 . ]" 1
1137 1 61 ALA H 1 62 ASN H . . 3.800 2.812 2.657 2.927 . 0 0 "[ . 1 . 2 . ]" 1
1138 1 61 ALA H 1 63 LYS H . . 5.370 4.227 4.060 4.483 . 0 0 "[ . 1 . 2 . ]" 1
1139 1 61 ALA H 1 64 GLN H . . 5.500 4.664 4.470 4.895 . 0 0 "[ . 1 . 2 . ]" 1
1140 1 61 ALA H 2 68 ALA MB . . 5.380 5.027 4.891 5.159 . 0 0 "[ . 1 . 2 . ]" 1
1141 1 61 ALA MB 1 62 ASN HA . . 4.540 3.689 3.606 3.868 . 0 0 "[ . 1 . 2 . ]" 1
1142 1 61 ALA MB 1 62 ASN H . . 3.660 2.446 2.184 2.872 . 0 0 "[ . 1 . 2 . ]" 1
1143 1 61 ALA MB 1 64 GLN HB2 . . 4.650 4.241 3.921 4.656 0.006 2 0 "[ . 1 . 2 . ]" 1
1144 1 61 ALA MB 1 65 LYS HB2 . . 4.760 4.520 4.273 4.796 0.036 19 0 "[ . 1 . 2 . ]" 1
1145 1 61 ALA MB 1 65 LYS H . . 4.720 4.525 4.381 4.674 . 0 0 "[ . 1 . 2 . ]" 1
1146 1 61 ALA MB 1 65 LYS QD . . 4.610 3.319 2.760 3.714 . 0 0 "[ . 1 . 2 . ]" 1
1147 1 61 ALA MB 1 65 LYS QE . . 3.920 2.745 1.830 3.925 0.005 26 0 "[ . 1 . 2 . ]" 1
1148 1 61 ALA MB 2 65 LEU QD . . 3.190 2.263 1.943 2.430 . 0 0 "[ . 1 . 2 . ]" 1
1149 1 62 ASN HA 1 65 LYS HB2 . . 3.900 2.176 2.067 2.295 . 0 0 "[ . 1 . 2 . ]" 1
1150 1 62 ASN HA 1 65 LYS H . . 4.480 3.092 2.994 3.224 . 0 0 "[ . 1 . 2 . ]" 1
1151 1 62 ASN HA 1 65 LYS QD . . 4.360 3.496 2.735 4.046 . 0 0 "[ . 1 . 2 . ]" 1
1152 1 62 ASN HA 1 65 LYS QE . . 4.700 3.447 2.333 4.783 0.083 28 0 "[ . 1 . 2 . ]" 1
1153 1 62 ASN HA 1 66 GLN H . . 4.640 4.059 3.751 4.295 . 0 0 "[ . 1 . 2 . ]" 1
1154 1 62 ASN HB2 1 63 LYS HA . . 3.740 3.815 3.639 4.355 0.615 22 1 "[ . 1 . 2 + . ]" 1
1155 1 62 ASN HB2 1 63 LYS H . . 4.090 2.559 2.158 3.068 . 0 0 "[ . 1 . 2 . ]" 1
1156 1 62 ASN HB2 1 65 LYS HB2 . . 4.870 4.845 4.372 5.037 0.167 22 0 "[ . 1 . 2 . ]" 1
1157 1 62 ASN HB3 1 63 LYS H . . 4.220 3.826 3.164 4.092 . 0 0 "[ . 1 . 2 . ]" 1
1158 1 62 ASN HB3 1 65 LYS HB2 . . 4.910 4.252 4.093 4.466 . 0 0 "[ . 1 . 2 . ]" 1
1159 1 62 ASN H 1 62 ASN HB2 . . 3.470 2.979 2.238 3.459 . 0 0 "[ . 1 . 2 . ]" 1
1160 1 62 ASN H 1 62 ASN HB3 . . 3.720 3.374 2.971 3.548 . 0 0 "[ . 1 . 2 . ]" 1
1161 1 62 ASN H 1 62 ASN QD . . 5.040 1.868 1.772 2.109 . 0 0 "[ . 1 . 2 . ]" 1
1162 1 62 ASN H 1 63 LYS QB . . 5.040 4.525 4.026 4.814 . 0 0 "[ . 1 . 2 . ]" 1
1163 1 62 ASN H 1 63 LYS H . . 3.770 2.765 2.407 2.936 . 0 0 "[ . 1 . 2 . ]" 1
1164 1 62 ASN H 1 64 GLN H . . 5.500 4.027 3.674 4.171 . 0 0 "[ . 1 . 2 . ]" 1
1165 1 62 ASN H 1 65 LYS QD . . 5.340 4.628 3.824 5.173 . 0 0 "[ . 1 . 2 . ]" 1
1166 1 63 LYS HA 1 63 LYS HG2 . . 4.080 2.913 2.291 3.710 . 0 0 "[ . 1 . 2 . ]" 1
1167 1 63 LYS HA 1 63 LYS HG3 . . 3.770 2.880 2.289 3.685 . 0 0 "[ . 1 . 2 . ]" 1
1168 1 63 LYS HA 1 63 LYS QD . . 3.960 3.044 2.080 4.180 0.220 3 0 "[ . 1 . 2 . ]" 1
1169 1 63 LYS HA 1 63 LYS QE . . 3.700 3.696 3.524 3.980 0.280 12 0 "[ . 1 . 2 . ]" 1
1170 1 63 LYS HA 1 64 GLN HA . . 4.470 4.680 4.659 4.700 0.230 21 0 "[ . 1 . 2 . ]" 1
1171 1 63 LYS HA 1 65 LYS H . . 5.240 4.503 4.282 4.852 . 0 0 "[ . 1 . 2 . ]" 1
1172 1 63 LYS HA 2 61 THR MG . . 4.310 3.390 3.176 3.882 . 0 0 "[ . 1 . 2 . ]" 1
1173 1 63 LYS HA 1 66 GLN QB . . 3.530 2.838 2.610 3.095 . 0 0 "[ . 1 . 2 . ]" 1
1174 1 63 LYS HA 1 66 GLN QG . . 4.660 4.471 4.235 4.711 0.051 14 0 "[ . 1 . 2 . ]" 1
1175 1 63 LYS QB 1 63 LYS QE . . 4.010 1.967 1.873 2.165 . 0 0 "[ . 1 . 2 . ]" 1
1176 1 63 LYS QB 1 64 GLN HA . . 4.440 3.997 3.902 4.274 . 0 0 "[ . 1 . 2 . ]" 1
1177 1 63 LYS QB 2 61 THR MG . . 4.010 2.239 1.850 3.002 . 0 0 "[ . 1 . 2 . ]" 1
1178 1 63 LYS QE 1 63 LYS HG2 . . 3.740 2.691 2.272 3.337 . 0 0 "[ . 1 . 2 . ]" 1
1179 1 63 LYS HG2 2 61 THR MG . . 4.410 3.210 1.796 4.469 0.059 16 0 "[ . 1 . 2 . ]" 1
1180 1 63 LYS QE 1 63 LYS HG3 . . 3.880 3.045 2.333 3.378 . 0 0 "[ . 1 . 2 . ]" 1
1181 1 63 LYS HG3 2 61 THR MG . . 4.390 3.316 1.912 4.638 0.248 3 0 "[ . 1 . 2 . ]" 1
1182 1 63 LYS H 1 63 LYS QB . . 3.680 2.247 1.999 2.446 . 0 0 "[ . 1 . 2 . ]" 1
1183 1 63 LYS H 1 63 LYS HG2 . . 4.420 3.599 2.198 4.619 0.199 18 0 "[ . 1 . 2 . ]" 1
1184 1 63 LYS H 1 63 LYS HG3 . . 4.240 3.366 2.027 4.350 0.110 20 0 "[ . 1 . 2 . ]" 1
1185 1 63 LYS H 1 64 GLN H . . 3.910 2.786 2.637 2.855 . 0 0 "[ . 1 . 2 . ]" 1
1186 1 63 LYS H 1 65 LYS H . . 5.500 4.157 3.976 4.315 . 0 0 "[ . 1 . 2 . ]" 1
1187 1 63 LYS H 2 61 THR MG . . 4.640 4.738 4.640 4.925 0.285 20 0 "[ . 1 . 2 . ]" 1
1188 1 63 LYS H 1 66 GLN QB . . 5.330 4.763 4.462 5.019 . 0 0 "[ . 1 . 2 . ]" 1
1189 1 63 LYS H 1 66 GLN H . . 5.500 4.716 4.535 4.875 . 0 0 "[ . 1 . 2 . ]" 1
1190 1 63 LYS QD 2 61 THR MG . . 4.230 3.511 3.131 4.036 . 0 0 "[ . 1 . 2 . ]" 1
1191 1 63 LYS QE 2 61 THR MG . . 4.380 3.012 2.039 4.257 . 0 0 "[ . 1 . 2 . ]" 1
1192 1 64 GLN HA 1 64 GLN QG . . 3.650 2.075 1.956 2.385 . 0 0 "[ . 1 . 2 . ]" 1
1193 1 64 GLN HA 1 65 LYS QD . . 5.170 5.089 4.540 5.365 0.195 26 0 "[ . 1 . 2 . ]" 1
1194 1 64 GLN HA 2 61 THR MG . . 3.340 3.211 2.930 3.376 0.036 24 0 "[ . 1 . 2 . ]" 1
1195 1 64 GLN HA 1 66 GLN H . . 4.740 4.135 3.904 4.474 . 0 0 "[ . 1 . 2 . ]" 1
1196 1 64 GLN HA 1 68 LEU H . . 4.580 3.922 3.735 4.098 . 0 0 "[ . 1 . 2 . ]" 1
1197 1 64 GLN HB2 2 65 LEU QD . . 4.280 3.262 2.613 3.548 . 0 0 "[ . 1 . 2 . ]" 1
1198 1 64 GLN H 1 65 LYS HB2 . . 4.150 4.309 4.243 4.395 0.245 23 0 "[ . 1 . 2 . ]" 1
1199 1 64 GLN H 1 65 LYS H . . 4.240 2.512 2.420 2.599 . 0 0 "[ . 1 . 2 . ]" 1
1200 1 64 GLN H 1 65 LYS QD . . 4.280 4.060 3.682 4.302 0.022 22 0 "[ . 1 . 2 . ]" 1
1201 1 64 GLN H 2 65 LEU QD . . 4.120 4.080 3.710 4.265 0.145 20 0 "[ . 1 . 2 . ]" 1
1202 1 64 GLN H 1 66 GLN H . . 5.450 3.929 3.797 4.101 . 0 0 "[ . 1 . 2 . ]" 1
1203 1 64 GLN H 1 67 GLU QB . . 5.500 5.032 4.693 5.457 . 0 0 "[ . 1 . 2 . ]" 1
1204 1 64 GLN H 1 67 GLU H . . 5.110 4.776 4.618 4.897 . 0 0 "[ . 1 . 2 . ]" 1
1205 1 64 GLN QG 2 65 LEU HA . . 4.610 4.498 4.138 4.674 0.064 4 0 "[ . 1 . 2 . ]" 1
1206 1 65 LYS HA 1 65 LYS QD . . 3.870 2.827 2.272 3.371 . 0 0 "[ . 1 . 2 . ]" 1
1207 1 65 LYS HA 1 65 LYS QE . . 4.410 3.742 1.901 4.536 0.126 23 0 "[ . 1 . 2 . ]" 1
1208 1 65 LYS HA 1 68 LEU HB2 . . 4.160 2.707 2.163 3.576 . 0 0 "[ . 1 . 2 . ]" 1
1209 1 65 LYS HA 1 68 LEU HB3 . . 4.420 3.075 2.085 3.920 . 0 0 "[ . 1 . 2 . ]" 1
1210 1 65 LYS HA 1 68 LEU QD . . 3.640 2.588 2.038 2.949 . 0 0 "[ . 1 . 2 . ]" 1
1211 1 65 LYS HA 1 69 ASP H . . 5.080 3.899 3.402 4.199 . 0 0 "[ . 1 . 2 . ]" 1
1212 1 65 LYS HB3 1 65 LYS QD . . 3.730 3.391 3.263 3.466 . 0 0 "[ . 1 . 2 . ]" 1
1213 1 65 LYS HB3 1 65 LYS QE . . 4.190 3.729 3.154 4.304 0.114 24 0 "[ . 1 . 2 . ]" 1
1214 1 65 LYS HB3 1 66 GLN HA . . 5.350 4.095 4.003 4.193 . 0 0 "[ . 1 . 2 . ]" 1
1215 1 65 LYS HB2 1 65 LYS QD . . 3.580 2.369 2.130 2.635 . 0 0 "[ . 1 . 2 . ]" 1
1216 1 65 LYS HB2 1 65 LYS QE . . 3.700 2.885 2.197 3.843 0.143 14 0 "[ . 1 . 2 . ]" 1
1217 1 65 LYS HB2 1 66 GLN H . . 3.840 3.160 2.946 3.328 . 0 0 "[ . 1 . 2 . ]" 1
1218 1 65 LYS H 1 65 LYS HB2 . . 3.540 2.073 2.030 2.137 . 0 0 "[ . 1 . 2 . ]" 1
1219 1 65 LYS H 1 65 LYS QD . . 3.820 2.337 1.962 2.545 . 0 0 "[ . 1 . 2 . ]" 1
1220 1 65 LYS H 1 65 LYS QE . . 5.280 3.449 2.446 4.134 . 0 0 "[ . 1 . 2 . ]" 1
1221 1 65 LYS H 1 65 LYS QG . . 4.600 3.594 3.473 3.728 . 0 0 "[ . 1 . 2 . ]" 1
1222 1 65 LYS H 1 66 GLN H . . 3.930 2.634 2.471 2.770 . 0 0 "[ . 1 . 2 . ]" 1
1223 1 65 LYS H 1 67 GLU H . . 5.350 4.397 3.994 4.576 . 0 0 "[ . 1 . 2 . ]" 1
1224 1 65 LYS QD 2 65 LEU QD . . 4.740 4.356 3.702 4.628 . 0 0 "[ . 1 . 2 . ]" 1
1225 1 65 LYS QD 1 66 GLN H . . 4.510 4.549 4.265 4.668 0.158 8 0 "[ . 1 . 2 . ]" 1
1226 1 65 LYS QD 1 68 LEU H . . 5.800 5.573 5.086 5.950 0.150 26 0 "[ . 1 . 2 . ]" 1
1227 1 65 LYS QE 1 66 GLN H . . 5.500 5.295 4.395 5.810 0.310 24 0 "[ . 1 . 2 . ]" 1
1228 1 65 LYS QG 1 66 GLN H . . 5.500 4.678 4.567 4.770 . 0 0 "[ . 1 . 2 . ]" 1
1229 1 66 GLN HA 1 69 ASP HB2 . . 4.000 3.505 2.861 3.879 . 0 0 "[ . 1 . 2 . ]" 1
1230 1 66 GLN HA 1 69 ASP HB3 . . 3.940 3.586 2.947 3.977 0.037 1 0 "[ . 1 . 2 . ]" 1
1231 1 66 GLN HA 1 69 ASP H . . 4.280 3.517 3.396 3.659 . 0 0 "[ . 1 . 2 . ]" 1
1232 1 66 GLN QB 1 67 GLU H . . 3.320 2.417 2.305 2.737 . 0 0 "[ . 1 . 2 . ]" 1
1233 1 66 GLN H 2 61 THR MG . . 5.500 4.954 4.529 5.357 . 0 0 "[ . 1 . 2 . ]" 1
1234 1 66 GLN H 1 66 GLN QB . . 3.230 2.113 2.012 2.235 . 0 0 "[ . 1 . 2 . ]" 1
1235 1 66 GLN H 1 66 GLN QG . . 4.060 3.882 3.541 4.040 . 0 0 "[ . 1 . 2 . ]" 1
1236 1 66 GLN H 1 67 GLU QB . . 4.450 4.418 4.246 4.573 0.123 6 0 "[ . 1 . 2 . ]" 1
1237 1 66 GLN H 1 68 LEU H . . 5.250 3.679 3.587 3.792 . 0 0 "[ . 1 . 2 . ]" 1
1238 1 66 GLN H 1 68 LEU QD . . 5.460 5.135 4.699 5.395 . 0 0 "[ . 1 . 2 . ]" 1
1239 1 67 GLU HA 1 70 GLU HB3 . . 3.650 2.993 2.510 3.221 . 0 0 "[ . 1 . 2 . ]" 1
1240 1 67 GLU HA 1 70 GLU HG3 . . 4.580 3.485 3.411 3.575 . 0 0 "[ . 1 . 2 . ]" 1
1241 1 67 GLU HA 1 70 GLU HG2 . . 3.740 1.996 1.937 2.143 . 0 0 "[ . 1 . 2 . ]" 1
1242 1 67 GLU HA 1 70 GLU H . . 4.310 3.603 3.283 3.789 . 0 0 "[ . 1 . 2 . ]" 1
1243 1 67 GLU HA 1 71 ILE MD . . 4.630 3.748 3.504 4.131 . 0 0 "[ . 1 . 2 . ]" 1
1244 1 67 GLU QB 2 61 THR HB . . 5.140 3.923 3.466 4.530 . 0 0 "[ . 1 . 2 . ]" 1
1245 1 67 GLU QB 2 61 THR MG . . 4.320 2.733 2.248 3.317 . 0 0 "[ . 1 . 2 . ]" 1
1246 1 67 GLU H 2 61 THR MG . . 4.950 3.706 3.309 4.059 . 0 0 "[ . 1 . 2 . ]" 1
1247 1 67 GLU H 1 68 LEU H . . 3.970 2.607 2.415 2.743 . 0 0 "[ . 1 . 2 . ]" 1
1248 1 67 GLU QG 2 61 THR HA . . 5.480 5.451 4.893 5.732 0.252 5 0 "[ . 1 . 2 . ]" 1
1249 1 67 GLU QG 1 71 ILE MD . . 4.130 3.118 1.817 3.957 . 0 0 "[ . 1 . 2 . ]" 1
1250 1 68 LEU HA 2 58 TRP HZ3 . . 4.770 2.691 2.022 3.423 . 0 0 "[ . 1 . 2 . ]" 1
1251 1 68 LEU HA 1 68 LEU QD . . 3.480 2.094 1.862 2.574 . 0 0 "[ . 1 . 2 . ]" 1
1252 1 68 LEU HA 1 71 ILE HB . . 4.610 3.069 2.845 3.424 . 0 0 "[ . 1 . 2 . ]" 1
1253 1 68 LEU HA 1 71 ILE MD . . 4.020 3.401 3.139 3.654 . 0 0 "[ . 1 . 2 . ]" 1
1254 1 68 LEU HA 1 71 ILE MG . . 4.610 4.104 3.872 4.260 . 0 0 "[ . 1 . 2 . ]" 1
1255 1 68 LEU HB2 1 69 ASP H . . 3.840 3.260 2.413 4.130 0.290 6 0 "[ . 1 . 2 . ]" 1
1256 1 68 LEU HB3 1 69 ASP H . . 4.440 2.830 2.358 3.449 . 0 0 "[ . 1 . 2 . ]" 1
1257 1 68 LEU H 1 68 LEU HB2 . . 3.530 2.241 2.007 2.701 . 0 0 "[ . 1 . 2 . ]" 1
1258 1 68 LEU H 1 68 LEU QD . . 4.370 3.323 2.761 3.683 . 0 0 "[ . 1 . 2 . ]" 1
1259 1 68 LEU H 1 69 ASP HB2 . . 5.450 4.567 4.250 4.764 . 0 0 "[ . 1 . 2 . ]" 1
1260 1 68 LEU H 1 69 ASP H . . 3.560 2.610 2.435 2.729 . 0 0 "[ . 1 . 2 . ]" 1
1261 1 68 LEU H 1 70 GLU HG2 . . 4.260 4.350 4.203 4.460 0.200 16 0 "[ . 1 . 2 . ]" 1
1262 1 68 LEU H 1 71 ILE MD . . 4.490 4.599 4.517 4.712 0.222 9 0 "[ . 1 . 2 . ]" 1
1263 1 68 LEU QD 2 58 TRP HE3 . . 4.530 3.509 3.045 3.961 . 0 0 "[ . 1 . 2 . ]" 1
1264 1 68 LEU QD 2 58 TRP HH2 . . 3.580 2.353 1.864 3.067 . 0 0 "[ . 1 . 2 . ]" 1
1265 1 68 LEU QD 2 58 TRP HZ3 . . 3.460 1.812 1.728 1.932 . 0 0 "[ . 1 . 2 . ]" 1
1266 1 68 LEU QD 1 69 ASP H . . 4.770 4.002 3.695 4.214 . 0 0 "[ . 1 . 2 . ]" 1
1267 1 68 LEU QD 1 71 ILE MG . . 4.140 4.119 3.925 4.296 0.156 28 0 "[ . 1 . 2 . ]" 1
1268 1 69 ASP HA 1 72 SER QB . . 4.380 2.626 1.951 3.386 . 0 0 "[ . 1 . 2 . ]" 1
1269 1 69 ASP HA 1 72 SER H . . 4.610 3.284 3.110 3.462 . 0 0 "[ . 1 . 2 . ]" 1
1270 1 69 ASP HA 1 73 THR H . . 5.330 4.008 3.726 4.367 . 0 0 "[ . 1 . 2 . ]" 1
1271 1 69 ASP HB3 1 70 GLU H . . 3.880 2.397 2.295 2.618 . 0 0 "[ . 1 . 2 . ]" 1
1272 1 69 ASP H 1 69 ASP HB2 . . 3.510 2.143 2.017 2.454 . 0 0 "[ . 1 . 2 . ]" 1
1273 1 69 ASP H 1 70 GLU H . . 3.830 2.651 2.432 2.773 . 0 0 "[ . 1 . 2 . ]" 1
1274 1 69 ASP H 1 71 ILE H . . 5.430 4.140 3.964 4.268 . 0 0 "[ . 1 . 2 . ]" 1
1275 1 70 GLU HA 1 70 GLU HG3 . . 3.780 3.548 3.443 3.638 . 0 0 "[ . 1 . 2 . ]" 1
1276 1 70 GLU HA 1 70 GLU HG2 . . 3.740 3.809 3.781 3.862 0.122 23 0 "[ . 1 . 2 . ]" 1
1277 1 70 GLU HA 1 73 THR HB . . 3.380 2.621 2.236 2.893 . 0 0 "[ . 1 . 2 . ]" 1
1278 1 70 GLU HA 1 73 THR H . . 3.830 3.519 3.242 3.767 . 0 0 "[ . 1 . 2 . ]" 1
1279 1 70 GLU HA 1 73 THR MG . . 3.700 3.686 3.444 3.791 0.091 1 0 "[ . 1 . 2 . ]" 1
1280 1 70 GLU HA 1 74 ASN HA . . 5.500 5.564 5.372 5.647 0.147 20 0 "[ . 1 . 2 . ]" 1
1281 1 70 GLU HA 1 74 ASN QD . . 5.190 3.847 3.642 4.361 . 0 0 "[ . 1 . 2 . ]" 1
1282 1 70 GLU HA 1 74 ASN H . . 4.650 4.125 4.037 4.231 . 0 0 "[ . 1 . 2 . ]" 1
1283 1 70 GLU HB3 1 70 GLU HG2 . . 2.950 2.486 2.435 2.516 . 0 0 "[ . 1 . 2 . ]" 1
1284 1 70 GLU HB3 1 71 ILE HG13 . . 4.830 4.735 4.463 5.096 0.266 16 0 "[ . 1 . 2 . ]" 1
1285 1 70 GLU HB2 1 71 ILE H . . 4.110 3.996 3.927 4.122 0.012 16 0 "[ . 1 . 2 . ]" 1
1286 1 70 GLU HG3 1 71 ILE HA . . 4.400 2.926 2.830 3.025 . 0 0 "[ . 1 . 2 . ]" 1
1287 1 70 GLU HG3 1 74 ASN QD . . 4.680 2.382 2.168 2.800 . 0 0 "[ . 1 . 2 . ]" 1
1288 1 70 GLU HG2 1 74 ASN QD . . 4.620 3.824 3.626 4.240 . 0 0 "[ . 1 . 2 . ]" 1
1289 1 70 GLU H 1 70 GLU HB2 . . 3.260 3.428 3.373 3.481 0.221 27 0 "[ . 1 . 2 . ]" 1
1290 1 70 GLU H 1 70 GLU HG3 . . 4.320 3.943 3.813 4.037 . 0 0 "[ . 1 . 2 . ]" 1
1291 1 70 GLU H 1 71 ILE H . . 3.930 2.915 2.854 2.971 . 0 0 "[ . 1 . 2 . ]" 1
1292 1 71 ILE HA 2 43 TRP HH2 . . 4.530 3.803 3.491 4.106 . 0 0 "[ . 1 . 2 . ]" 1
1293 1 71 ILE HA 2 43 TRP HZ2 . . 3.740 2.212 2.058 2.376 . 0 0 "[ . 1 . 2 . ]" 1
1294 1 71 ILE HA 1 71 ILE MD . . 3.670 3.784 3.696 3.808 0.138 21 0 "[ . 1 . 2 . ]" 1
1295 1 71 ILE HA 1 71 ILE MG . . 3.610 2.557 2.467 2.676 . 0 0 "[ . 1 . 2 . ]" 1
1296 1 71 ILE HA 1 74 ASN HB2 . . 3.940 2.086 1.935 2.353 . 0 0 "[ . 1 . 2 . ]" 1
1297 1 71 ILE HA 1 74 ASN HB3 . . 4.170 3.669 3.505 3.945 . 0 0 "[ . 1 . 2 . ]" 1
1298 1 71 ILE HA 1 74 ASN QD . . 5.130 1.892 1.848 1.932 . 0 0 "[ . 1 . 2 . ]" 1
1299 1 71 ILE HA 1 74 ASN H . . 4.230 2.955 2.880 3.055 . 0 0 "[ . 1 . 2 . ]" 1
1300 1 71 ILE HA 1 75 ILE H . . 4.870 4.560 4.303 4.767 . 0 0 "[ . 1 . 2 . ]" 1
1301 1 71 ILE HA 1 75 ILE MD . . 4.400 4.250 3.692 4.567 0.167 22 0 "[ . 1 . 2 . ]" 1
1302 1 71 ILE HB 2 36 LEU QD . . 4.740 3.969 3.768 4.160 . 0 0 "[ . 1 . 2 . ]" 1
1303 1 71 ILE HB 2 54 VAL MG1 . . 5.360 4.367 4.192 4.496 . 0 0 "[ . 1 . 2 . ]" 1
1304 1 71 ILE HB 1 71 ILE MD . . 3.660 2.291 1.982 2.407 . 0 0 "[ . 1 . 2 . ]" 1
1305 1 71 ILE HB 1 72 SER H . . 3.910 2.724 2.550 2.949 . 0 0 "[ . 1 . 2 . ]" 1
1306 1 71 ILE HG12 2 36 LEU QD . . 4.820 3.268 2.902 3.713 . 0 0 "[ . 1 . 2 . ]" 1
1307 1 71 ILE HG12 2 43 TRP HZ2 . . 4.860 2.258 1.996 2.606 . 0 0 "[ . 1 . 2 . ]" 1
1308 1 71 ILE HG12 2 54 VAL MG2 . . 5.240 3.369 2.961 3.598 . 0 0 "[ . 1 . 2 . ]" 1
1309 1 71 ILE HG12 2 54 VAL MG1 . . 4.920 1.911 1.829 2.030 . 0 0 "[ . 1 . 2 . ]" 1
1310 1 71 ILE HG12 1 74 ASN QD . . 5.090 3.474 3.156 3.715 . 0 0 "[ . 1 . 2 . ]" 1
1311 1 71 ILE HG13 2 43 TRP HZ2 . . 4.640 3.537 2.526 4.079 . 0 0 "[ . 1 . 2 . ]" 1
1312 1 71 ILE HG13 2 54 VAL MG1 . . 4.690 2.923 2.308 3.342 . 0 0 "[ . 1 . 2 . ]" 1
1313 1 71 ILE HG13 1 74 ASN QD . . 4.870 3.361 2.733 3.618 . 0 0 "[ . 1 . 2 . ]" 1
1314 1 71 ILE H 2 43 TRP HZ2 . . 5.500 4.819 4.624 4.967 . 0 0 "[ . 1 . 2 . ]" 1
1315 1 71 ILE H 1 71 ILE MD . . 4.080 3.464 3.167 3.580 . 0 0 "[ . 1 . 2 . ]" 1
1316 1 71 ILE H 1 71 ILE MG . . 4.520 3.638 3.554 3.685 . 0 0 "[ . 1 . 2 . ]" 1
1317 1 71 ILE H 1 72 SER H . . 4.240 2.590 2.484 2.744 . 0 0 "[ . 1 . 2 . ]" 1
1318 1 71 ILE H 1 73 THR H . . 5.500 3.756 3.564 3.908 . 0 0 "[ . 1 . 2 . ]" 1
1319 1 71 ILE H 1 74 ASN H . . 5.500 4.357 4.274 4.446 . 0 0 "[ . 1 . 2 . ]" 1
1320 1 71 ILE MD 2 36 LEU QD . . 3.530 2.253 2.050 2.459 . 0 0 "[ . 1 . 2 . ]" 1
1321 1 71 ILE MD 2 43 TRP HH2 . . 4.230 4.164 3.958 4.304 0.074 3 0 "[ . 1 . 2 . ]" 1
1322 1 71 ILE MD 2 43 TRP HZ2 . . 3.940 3.835 3.689 4.000 0.060 17 0 "[ . 1 . 2 . ]" 1
1323 1 71 ILE MD 2 54 VAL HB . . 4.710 4.799 4.652 4.922 0.212 9 0 "[ . 1 . 2 . ]" 1
1324 1 71 ILE MD 2 54 VAL MG2 . . 4.130 4.068 3.851 4.200 0.070 17 0 "[ . 1 . 2 . ]" 1
1325 1 71 ILE MD 2 54 VAL MG1 . . 3.690 2.266 2.088 2.418 . 0 0 "[ . 1 . 2 . ]" 1
1326 1 71 ILE MD 2 58 TRP HA . . 4.440 2.906 2.663 3.167 . 0 0 "[ . 1 . 2 . ]" 1
1327 1 71 ILE MD 2 58 TRP HB2 . . 4.680 2.103 1.876 2.466 . 0 0 "[ . 1 . 2 . ]" 1
1328 1 71 ILE MD 2 58 TRP HE3 . . 3.380 1.804 1.730 1.989 . 0 0 "[ . 1 . 2 . ]" 1
1329 1 71 ILE MD 2 58 TRP HH2 . . 5.500 5.046 4.776 5.353 . 0 0 "[ . 1 . 2 . ]" 1
1330 1 71 ILE MD 2 58 TRP H . . 5.500 3.556 3.167 3.914 . 0 0 "[ . 1 . 2 . ]" 1
1331 1 71 ILE MD 2 58 TRP HZ3 . . 3.610 3.246 3.002 3.519 . 0 0 "[ . 1 . 2 . ]" 1
1332 1 71 ILE MD 1 72 SER H . . 4.660 4.576 4.310 4.775 0.115 3 0 "[ . 1 . 2 . ]" 1
1333 1 71 ILE MG 2 36 LEU HA . . 5.230 3.979 3.764 4.188 . 0 0 "[ . 1 . 2 . ]" 1
1334 1 71 ILE MG 2 36 LEU QD . . 3.550 2.173 1.909 2.310 . 0 0 "[ . 1 . 2 . ]" 1
1335 1 71 ILE MG 2 43 TRP HH2 . . 3.490 1.920 1.823 2.001 . 0 0 "[ . 1 . 2 . ]" 1
1336 1 71 ILE MG 2 43 TRP HZ2 . . 3.440 2.534 2.097 2.955 . 0 0 "[ . 1 . 2 . ]" 1
1337 1 71 ILE MG 2 54 VAL MG2 . . 4.850 4.546 4.010 4.822 . 0 0 "[ . 1 . 2 . ]" 1
1338 1 71 ILE MG 2 54 VAL MG1 . . 4.410 2.980 2.514 3.365 . 0 0 "[ . 1 . 2 . ]" 1
1339 1 71 ILE MG 2 58 TRP HE3 . . 4.850 3.505 3.212 4.029 . 0 0 "[ . 1 . 2 . ]" 1
1340 1 71 ILE MG 2 58 TRP HZ3 . . 4.540 3.651 3.320 4.187 . 0 0 "[ . 1 . 2 . ]" 1
1341 1 71 ILE MD 1 71 ILE MG . . 3.080 2.066 1.900 2.526 . 0 0 "[ . 1 . 2 . ]" 1
1342 1 71 ILE MG 1 72 SER H . . 4.540 3.183 2.836 3.511 . 0 0 "[ . 1 . 2 . ]" 1
1343 1 71 ILE MG 1 74 ASN HB3 . . 4.590 4.304 4.108 4.622 0.032 27 0 "[ . 1 . 2 . ]" 1
1344 1 71 ILE MG 1 74 ASN QD . . 4.420 3.972 3.847 4.060 . 0 0 "[ . 1 . 2 . ]" 1
1345 1 71 ILE MG 1 74 ASN H . . 5.310 4.242 4.109 4.384 . 0 0 "[ . 1 . 2 . ]" 1
1346 1 71 ILE MG 1 75 ILE QG . . 4.410 3.510 3.192 3.842 . 0 0 "[ . 1 . 2 . ]" 1
1347 1 72 SER HA 1 75 ILE H . . 4.640 4.046 3.821 4.189 . 0 0 "[ . 1 . 2 . ]" 1
1348 1 72 SER HA 1 76 ARG H . . 5.330 5.251 4.669 5.508 0.178 13 0 "[ . 1 . 2 . ]" 1
1349 1 72 SER H 1 73 THR H . . 4.260 2.651 2.546 2.745 . 0 0 "[ . 1 . 2 . ]" 1
1350 1 73 THR HA 1 73 THR MG . . 3.070 2.599 2.510 2.707 . 0 0 "[ . 1 . 2 . ]" 1
1351 1 73 THR HA 1 76 ARG HB2 . . 3.860 2.811 1.948 3.683 . 0 0 "[ . 1 . 2 . ]" 1
1352 1 73 THR HA 1 76 ARG HD2 . . 4.510 4.016 2.687 4.569 0.059 2 0 "[ . 1 . 2 . ]" 1
1353 1 73 THR HA 1 76 ARG HD3 . . 4.350 3.367 1.843 4.611 0.261 22 0 "[ . 1 . 2 . ]" 1
1354 1 73 THR HA 1 76 ARG HG3 . . 4.560 3.310 1.947 4.711 0.151 28 0 "[ . 1 . 2 . ]" 1
1355 1 73 THR HA 1 76 ARG HG2 . . 4.480 3.875 2.916 4.670 0.190 9 0 "[ . 1 . 2 . ]" 1
1356 1 73 THR HA 1 76 ARG H . . 4.610 3.022 2.810 3.309 . 0 0 "[ . 1 . 2 . ]" 1
1357 1 73 THR HB 1 74 ASN H . . 3.510 3.089 2.930 3.250 . 0 0 "[ . 1 . 2 . ]" 1
1358 1 73 THR H 1 73 THR HB . . 3.540 2.198 2.097 2.300 . 0 0 "[ . 1 . 2 . ]" 1
1359 1 73 THR H 1 73 THR MG . . 4.270 3.631 3.486 3.709 . 0 0 "[ . 1 . 2 . ]" 1
1360 1 73 THR H 1 74 ASN HB2 . . 5.500 4.010 3.949 4.068 . 0 0 "[ . 1 . 2 . ]" 1
1361 1 73 THR H 1 74 ASN HB3 . . 5.500 5.509 5.398 5.583 0.083 6 0 "[ . 1 . 2 . ]" 1
1362 1 73 THR H 1 75 ILE H . . 5.220 4.055 3.833 4.406 . 0 0 "[ . 1 . 2 . ]" 1
1363 1 73 THR MG 1 74 ASN HA . . 4.140 3.529 3.218 3.773 . 0 0 "[ . 1 . 2 . ]" 1
1364 1 73 THR MG 1 74 ASN H . . 4.440 3.570 3.305 3.764 . 0 0 "[ . 1 . 2 . ]" 1
1365 1 73 THR MG 1 76 ARG HB2 . . 4.630 3.101 2.695 3.563 . 0 0 "[ . 1 . 2 . ]" 1
1366 1 73 THR MG 1 77 GLN HB2 . . 4.390 4.173 3.758 4.431 0.041 25 0 "[ . 1 . 2 . ]" 1
1367 1 73 THR MG 1 77 GLN HG3 . . 3.780 2.570 2.053 3.039 . 0 0 "[ . 1 . 2 . ]" 1
1368 1 73 THR MG 1 77 GLN HG2 . . 3.940 3.082 2.442 3.632 . 0 0 "[ . 1 . 2 . ]" 1
1369 1 73 THR MG 1 77 GLN H . . 5.180 3.677 3.204 4.116 . 0 0 "[ . 1 . 2 . ]" 1
1370 1 74 ASN HA 1 74 ASN QD . . 3.870 3.378 3.170 3.545 . 0 0 "[ . 1 . 2 . ]" 1
1371 1 74 ASN HA 1 77 GLN HB2 . . 3.690 2.898 2.571 3.248 . 0 0 "[ . 1 . 2 . ]" 1
1372 1 74 ASN HA 1 77 GLN HG3 . . 4.530 3.148 2.744 3.555 . 0 0 "[ . 1 . 2 . ]" 1
1373 1 74 ASN HA 1 77 GLN HG2 . . 4.610 4.528 4.225 4.678 0.068 16 0 "[ . 1 . 2 . ]" 1
1374 1 74 ASN HA 1 78 ALA H . . 5.240 4.714 4.420 4.953 . 0 0 "[ . 1 . 2 . ]" 1
1375 1 74 ASN HB2 2 43 TRP HE1 . . 5.500 3.680 3.344 4.402 . 0 0 "[ . 1 . 2 . ]" 1
1376 1 74 ASN HB2 1 75 ILE H . . 4.250 3.028 2.609 3.280 . 0 0 "[ . 1 . 2 . ]" 1
1377 1 74 ASN HB2 1 75 ILE MD . . 4.270 3.459 3.093 3.733 . 0 0 "[ . 1 . 2 . ]" 1
1378 1 74 ASN HB3 2 43 TRP HE1 . . 5.080 3.378 2.926 4.156 . 0 0 "[ . 1 . 2 . ]" 1
1379 1 74 ASN HB3 2 43 TRP HZ2 . . 4.110 3.071 2.775 3.640 . 0 0 "[ . 1 . 2 . ]" 1
1380 1 74 ASN HB3 1 75 ILE H . . 4.510 3.224 2.628 3.649 . 0 0 "[ . 1 . 2 . ]" 1
1381 1 74 ASN QD 2 43 TRP HE1 . . 5.220 2.560 1.815 3.257 . 0 0 "[ . 1 . 2 . ]" 1
1382 1 74 ASN QD 1 75 ILE QG . . 5.500 5.215 5.140 5.287 . 0 0 "[ . 1 . 2 . ]" 1
1383 1 74 ASN QD 1 75 ILE H . . 5.410 4.744 4.449 4.870 . 0 0 "[ . 1 . 2 . ]" 1
1384 1 74 ASN H 1 74 ASN HB2 . . 3.770 2.102 2.062 2.159 . 0 0 "[ . 1 . 2 . ]" 1
1385 1 74 ASN H 1 74 ASN HB3 . . 4.050 3.402 3.339 3.454 . 0 0 "[ . 1 . 2 . ]" 1
1386 1 74 ASN H 1 74 ASN QD . . 4.630 2.779 2.422 3.205 . 0 0 "[ . 1 . 2 . ]" 1
1387 1 74 ASN H 1 75 ILE H . . 3.960 2.788 2.553 2.961 . 0 0 "[ . 1 . 2 . ]" 1
1388 1 75 ILE HA 2 39 LEU QD . . 5.190 4.418 3.978 5.006 . 0 0 "[ . 1 . 2 . ]" 1
1389 1 75 ILE HA 2 42 ALA HA . . 5.220 4.310 3.934 4.761 . 0 0 "[ . 1 . 2 . ]" 1
1390 1 75 ILE HA 2 42 ALA MB . . 3.660 2.087 1.887 2.362 . 0 0 "[ . 1 . 2 . ]" 1
1391 1 75 ILE HA 1 75 ILE MD . . 4.000 2.580 1.962 3.741 . 0 0 "[ . 1 . 2 . ]" 1
1392 1 75 ILE HA 1 75 ILE MG . . 3.520 2.280 2.131 2.375 . 0 0 "[ . 1 . 2 . ]" 1
1393 1 75 ILE HA 1 77 GLN H . . 5.360 4.038 3.768 4.364 . 0 0 "[ . 1 . 2 . ]" 1
1394 1 75 ILE HA 1 78 ALA H . . 4.500 3.049 2.929 3.204 . 0 0 "[ . 1 . 2 . ]" 1
1395 1 75 ILE HA 1 78 ALA MB . . 3.460 2.213 1.910 2.630 . 0 0 "[ . 1 . 2 . ]" 1
1396 1 75 ILE HA 1 79 GLY H . . 5.500 4.995 4.813 5.132 . 0 0 "[ . 1 . 2 . ]" 1
1397 1 75 ILE HA 1 80 VAL QG . . 4.390 3.240 2.891 3.566 . 0 0 "[ . 1 . 2 . ]" 1
1398 1 75 ILE HB 2 42 ALA MB . . 4.380 4.198 3.538 4.486 0.106 3 0 "[ . 1 . 2 . ]" 1
1399 1 75 ILE HB 1 75 ILE MD . . 3.710 2.857 2.078 3.217 . 0 0 "[ . 1 . 2 . ]" 1
1400 1 75 ILE HB 1 80 VAL QG . . 4.430 3.633 3.013 4.083 . 0 0 "[ . 1 . 2 . ]" 1
1401 1 75 ILE QG 2 39 LEU QD . . 5.120 2.567 1.936 3.563 . 0 0 "[ . 1 . 2 . ]" 1
1402 1 75 ILE QG 2 42 ALA MB . . 4.190 3.201 1.886 3.884 . 0 0 "[ . 1 . 2 . ]" 1
1403 1 75 ILE QG 1 76 ARG H . . 5.050 3.836 3.593 4.222 . 0 0 "[ . 1 . 2 . ]" 1
1404 1 75 ILE H 2 42 ALA MB . . 4.260 4.092 3.584 4.396 0.136 14 0 "[ . 1 . 2 . ]" 1
1405 1 75 ILE H 2 43 TRP HZ2 . . 5.500 5.051 4.608 5.393 . 0 0 "[ . 1 . 2 . ]" 1
1406 1 75 ILE H 1 75 ILE HB . . 3.650 2.606 2.560 2.689 . 0 0 "[ . 1 . 2 . ]" 1
1407 1 75 ILE H 1 75 ILE QG . . 3.930 1.912 1.739 2.229 . 0 0 "[ . 1 . 2 . ]" 1
1408 1 75 ILE H 1 75 ILE MG . . 4.110 3.712 3.681 3.730 . 0 0 "[ . 1 . 2 . ]" 1
1409 1 75 ILE H 1 76 ARG H . . 3.940 2.654 2.506 2.823 . 0 0 "[ . 1 . 2 . ]" 1
1410 1 75 ILE H 1 78 ALA H . . 5.500 4.610 4.469 4.723 . 0 0 "[ . 1 . 2 . ]" 1
1411 1 75 ILE H 1 78 ALA MB . . 5.340 4.473 4.106 4.853 . 0 0 "[ . 1 . 2 . ]" 1
1412 1 75 ILE MD 2 36 LEU QD . . 4.650 4.081 3.902 4.197 . 0 0 "[ . 1 . 2 . ]" 1
1413 1 75 ILE MD 2 39 LEU HA . . 4.550 3.780 3.103 4.643 0.093 5 0 "[ . 1 . 2 . ]" 1
1414 1 75 ILE MD 2 39 LEU HB3 . . 3.600 2.101 1.735 2.787 . 0 0 "[ . 1 . 2 . ]" 1
1415 1 75 ILE MD 2 39 LEU HG . . 4.500 2.971 1.919 4.216 . 0 0 "[ . 1 . 2 . ]" 1
1416 1 75 ILE MD 2 39 LEU QD . . 3.640 2.255 1.789 2.940 . 0 0 "[ . 1 . 2 . ]" 1
1417 1 75 ILE MD 2 43 TRP HH2 . . 4.200 2.424 2.141 2.893 . 0 0 "[ . 1 . 2 . ]" 1
1418 1 75 ILE MD 2 43 TRP HZ2 . . 4.700 3.844 3.502 4.453 . 0 0 "[ . 1 . 2 . ]" 1
1419 1 75 ILE MD 2 43 TRP HZ3 . . 4.870 2.934 2.395 3.838 . 0 0 "[ . 1 . 2 . ]" 1
1420 1 75 ILE MD 1 76 ARG H . . 5.120 4.133 3.245 4.620 . 0 0 "[ . 1 . 2 . ]" 1
1421 1 75 ILE MD 1 77 GLN H . . 5.180 5.264 5.025 5.390 0.210 10 0 "[ . 1 . 2 . ]" 1
1422 1 75 ILE MD 1 78 ALA MB . . 4.640 3.870 3.162 4.891 0.251 23 0 "[ . 1 . 2 . ]" 1
1423 1 75 ILE MG 2 39 LEU HA . . 5.440 4.054 3.448 4.627 . 0 0 "[ . 1 . 2 . ]" 1
1424 1 75 ILE MG 2 42 ALA HA . . 4.740 4.196 3.612 4.541 . 0 0 "[ . 1 . 2 . ]" 1
1425 1 75 ILE MG 2 42 ALA MB . . 3.350 2.323 1.848 2.612 . 0 0 "[ . 1 . 2 . ]" 1
1426 1 75 ILE MG 2 43 TRP HZ3 . . 4.880 5.009 4.751 5.182 0.302 25 0 "[ . 1 . 2 . ]" 1
1427 1 75 ILE MD 1 75 ILE MG . . 3.100 2.326 1.894 3.020 . 0 0 "[ . 1 . 2 . ]" 1
1428 1 75 ILE MG 1 76 ARG HA . . 4.130 3.872 3.691 4.025 . 0 0 "[ . 1 . 2 . ]" 1
1429 1 75 ILE MG 1 76 ARG HG3 . . 5.500 5.037 4.032 5.701 0.201 23 0 "[ . 1 . 2 . ]" 1
1430 1 75 ILE MG 1 76 ARG H . . 4.500 3.681 3.465 3.863 . 0 0 "[ . 1 . 2 . ]" 1
1431 1 75 ILE MG 1 77 GLN H . . 5.450 4.950 4.703 5.255 . 0 0 "[ . 1 . 2 . ]" 1
1432 1 75 ILE MG 1 78 ALA H . . 5.070 4.084 3.793 4.276 . 0 0 "[ . 1 . 2 . ]" 1
1433 1 75 ILE MG 1 78 ALA MB . . 3.840 2.874 2.498 3.218 . 0 0 "[ . 1 . 2 . ]" 1
1434 1 75 ILE MG 1 80 VAL HA . . 4.650 4.812 4.725 5.083 0.433 11 0 "[ . 1 . 2 . ]" 1
1435 1 75 ILE MG 1 80 VAL HB . . 3.470 2.884 2.355 3.725 0.255 27 0 "[ . 1 . 2 . ]" 1
1436 1 75 ILE MG 1 80 VAL QG . . 2.760 1.767 1.567 2.003 . 0 0 "[ . 1 . 2 . ]" 1
1437 1 76 ARG HA 1 76 ARG HB3 . . 3.060 2.613 2.402 2.912 . 0 0 "[ . 1 . 2 . ]" 1
1438 1 76 ARG HA 1 76 ARG HD2 . . 4.010 3.764 2.108 4.351 0.341 22 0 "[ . 1 . 2 . ]" 1
1439 1 76 ARG HA 1 76 ARG HD3 . . 4.170 4.025 3.400 4.282 0.112 15 0 "[ . 1 . 2 . ]" 1
1440 1 76 ARG HA 1 76 ARG HG3 . . 3.810 2.887 1.986 3.810 . 0 0 "[ . 1 . 2 . ]" 1
1441 1 76 ARG HA 1 76 ARG HG2 . . 3.740 2.937 2.323 3.658 . 0 0 "[ . 1 . 2 . ]" 1
1442 1 76 ARG HB3 1 76 ARG HD2 . . 3.630 3.157 2.061 4.196 0.566 27 1 "[ . 1 . 2 . + ]" 1
1443 1 76 ARG HB3 1 76 ARG HD3 . . 4.070 3.197 2.073 3.977 . 0 0 "[ . 1 . 2 . ]" 1
1444 1 76 ARG HB3 1 79 GLY H . . 5.160 5.272 5.046 5.443 0.283 23 0 "[ . 1 . 2 . ]" 1
1445 1 76 ARG HB2 1 76 ARG HD2 . . 3.650 3.137 2.566 4.090 0.440 22 0 "[ . 1 . 2 . ]" 1
1446 1 76 ARG HB2 1 77 GLN H . . 3.760 2.969 2.641 3.236 . 0 0 "[ . 1 . 2 . ]" 1
1447 1 76 ARG HB2 1 78 ALA H . . 5.030 4.945 4.704 5.099 0.069 18 0 "[ . 1 . 2 . ]" 1
1448 1 76 ARG HG3 1 77 GLN H . . 5.160 4.627 4.050 5.149 . 0 0 "[ . 1 . 2 . ]" 1
1449 1 76 ARG HG2 1 77 GLN H . . 4.980 4.865 4.290 5.427 0.447 9 0 "[ . 1 . 2 . ]" 1
1450 1 76 ARG H 1 76 ARG HB2 . . 3.310 2.447 2.032 2.835 . 0 0 "[ . 1 . 2 . ]" 1
1451 1 76 ARG H 1 76 ARG HD3 . . 5.500 3.685 1.900 4.755 . 0 0 "[ . 1 . 2 . ]" 1
1452 1 76 ARG H 1 76 ARG HG3 . . 4.250 2.881 2.046 4.074 . 0 0 "[ . 1 . 2 . ]" 1
1453 1 76 ARG H 1 77 GLN H . . 3.680 2.785 2.662 2.852 . 0 0 "[ . 1 . 2 . ]" 1
1454 1 77 GLN HA 1 77 GLN HB3 . . 3.020 2.559 2.467 2.663 . 0 0 "[ . 1 . 2 . ]" 1
1455 1 77 GLN HA 1 77 GLN HG3 . . 3.600 3.600 3.464 3.713 0.113 16 0 "[ . 1 . 2 . ]" 1
1456 1 77 GLN HA 1 77 GLN HG2 . . 3.170 2.345 2.156 2.508 . 0 0 "[ . 1 . 2 . ]" 1
1457 1 77 GLN HB2 1 78 ALA H . . 3.930 3.190 3.069 3.331 . 0 0 "[ . 1 . 2 . ]" 1
1458 1 77 GLN HB2 1 79 GLY H . . 5.120 5.055 5.000 5.142 0.022 23 0 "[ . 1 . 2 . ]" 1
1459 1 77 GLN HG3 1 78 ALA H . . 5.110 4.946 4.682 5.101 . 0 0 "[ . 1 . 2 . ]" 1
1460 1 77 GLN HG2 1 78 ALA H . . 5.460 4.680 4.512 4.866 . 0 0 "[ . 1 . 2 . ]" 1
1461 1 77 GLN HG2 1 79 GLY H . . 5.500 5.560 5.494 5.615 0.115 15 0 "[ . 1 . 2 . ]" 1
1462 1 77 GLN H 1 77 GLN HB2 . . 3.370 2.369 2.208 2.533 . 0 0 "[ . 1 . 2 . ]" 1
1463 1 77 GLN H 1 77 GLN HG3 . . 4.090 3.028 2.679 3.295 . 0 0 "[ . 1 . 2 . ]" 1
1464 1 77 GLN H 1 77 GLN HG2 . . 5.050 2.771 2.444 3.165 . 0 0 "[ . 1 . 2 . ]" 1
1465 1 77 GLN H 1 78 ALA H . . 3.700 2.419 2.352 2.502 . 0 0 "[ . 1 . 2 . ]" 1
1466 1 77 GLN H 1 78 ALA MB . . 3.930 3.982 3.886 4.040 0.110 28 0 "[ . 1 . 2 . ]" 1
1467 1 77 GLN H 1 79 GLY H . . 5.010 4.049 3.925 4.191 . 0 0 "[ . 1 . 2 . ]" 1
1468 1 78 ALA HA 2 42 ALA MB . . 4.750 4.338 4.012 4.735 . 0 0 "[ . 1 . 2 . ]" 1
1469 1 78 ALA H 2 42 ALA MB . . 5.210 3.921 3.647 4.261 . 0 0 "[ . 1 . 2 . ]" 1
1470 1 78 ALA H 1 78 ALA MB . . 3.190 2.084 1.961 2.189 . 0 0 "[ . 1 . 2 . ]" 1
1471 1 78 ALA H 1 79 GLY HA2 . . 5.230 5.204 5.055 5.231 0.001 16 0 "[ . 1 . 2 . ]" 1
1472 1 78 ALA H 1 79 GLY H . . 3.820 2.574 2.397 2.607 . 0 0 "[ . 1 . 2 . ]" 1
1473 1 78 ALA H 1 80 VAL H . . 5.250 3.601 3.304 3.719 . 0 0 "[ . 1 . 2 . ]" 1
1474 1 78 ALA MB 2 42 ALA HA . . 3.250 2.147 1.879 2.613 . 0 0 "[ . 1 . 2 . ]" 1
1475 1 78 ALA MB 2 42 ALA MB . . 3.190 2.026 1.790 2.346 . 0 0 "[ . 1 . 2 . ]" 1
1476 1 78 ALA MB 1 79 GLY H . . 4.030 3.005 2.936 3.094 . 0 0 "[ . 1 . 2 . ]" 1
1477 1 78 ALA MB 1 80 VAL H . . 4.400 3.104 2.969 3.237 . 0 0 "[ . 1 . 2 . ]" 1
1478 1 78 ALA MB 1 80 VAL QG . . 3.400 2.004 1.888 2.170 . 0 0 "[ . 1 . 2 . ]" 1
1479 1 79 GLY HA3 1 80 VAL QG . . 4.810 4.271 4.185 4.380 . 0 0 "[ . 1 . 2 . ]" 1
1480 1 79 GLY HA2 1 80 VAL QG . . 4.200 3.963 3.717 4.408 0.208 11 0 "[ . 1 . 2 . ]" 1
1481 1 79 GLY H 1 80 VAL H . . 3.770 1.929 1.879 2.030 . 0 0 "[ . 1 . 2 . ]" 1
1482 1 80 VAL HA 1 80 VAL QG . . 3.110 2.149 1.985 2.503 . 0 0 "[ . 1 . 2 . ]" 1
1483 1 80 VAL HA 1 81 GLN H . . 3.260 2.280 2.255 2.295 . 0 0 "[ . 1 . 2 . ]" 1
1484 1 80 VAL HA 1 82 TYR H . . 5.150 3.180 3.146 3.203 . 0 0 "[ . 1 . 2 . ]" 1
1485 1 80 VAL H 1 81 GLN H . . 4.200 4.053 3.879 4.161 . 0 0 "[ . 1 . 2 . ]" 1
1486 1 80 VAL QG 2 42 ALA MB . . 3.690 3.119 2.746 3.536 . 0 0 "[ . 1 . 2 . ]" 1
1487 1 80 VAL QG 1 81 GLN HA . . 4.180 3.868 3.311 4.126 . 0 0 "[ . 1 . 2 . ]" 1
1488 1 80 VAL QG 1 81 GLN H . . 3.900 3.361 3.281 3.408 . 0 0 "[ . 1 . 2 . ]" 1
1489 1 80 VAL QG 1 82 TYR H . . 4.910 3.360 3.235 3.516 . 0 0 "[ . 1 . 2 . ]" 1
1490 1 80 VAL QG 1 82 TYR QD . . 4.610 4.368 4.204 4.464 . 0 0 "[ . 1 . 2 . ]" 1
1491 1 80 VAL QG 1 82 TYR QE . . 5.010 4.505 4.230 4.860 . 0 0 "[ . 1 . 2 . ]" 1
1492 1 80 VAL QG 1 83 SER QB . . 4.620 3.260 2.822 4.265 . 0 0 "[ . 1 . 2 . ]" 1
1493 1 81 GLN HA 1 81 GLN QG . . 3.720 3.005 2.006 3.394 . 0 0 "[ . 1 . 2 . ]" 1
1494 1 81 GLN HA 1 82 TYR H . . 3.340 3.206 3.183 3.274 . 0 0 "[ . 1 . 2 . ]" 1
1495 1 81 GLN HA 1 82 TYR QD . . 4.700 4.332 4.159 4.456 . 0 0 "[ . 1 . 2 . ]" 1
1496 1 81 GLN HB3 1 82 TYR H . . 4.230 4.396 3.881 4.688 0.458 22 0 "[ . 1 . 2 . ]" 1
1497 1 81 GLN H 1 81 GLN HB2 . . 3.800 3.572 2.669 3.924 0.124 5 0 "[ . 1 . 2 . ]" 1
1498 1 81 GLN H 1 81 GLN HB3 . . 3.780 3.296 2.958 3.731 . 0 0 "[ . 1 . 2 . ]" 1
1499 1 81 GLN H 1 81 GLN QG . . 4.260 2.681 1.904 4.176 . 0 0 "[ . 1 . 2 . ]" 1
1500 1 81 GLN H 1 82 TYR H . . 4.560 1.832 1.789 1.894 . 0 0 "[ . 1 . 2 . ]" 1
1501 1 81 GLN QG 1 82 TYR H . . 4.710 3.564 3.003 4.650 . 0 0 "[ . 1 . 2 . ]" 1
1502 1 81 GLN QG 1 82 TYR QD . . 4.990 2.950 1.987 5.024 0.034 14 0 "[ . 1 . 2 . ]" 1
1503 1 82 TYR HB3 1 83 SER H . . 5.020 4.600 4.230 4.701 . 0 0 "[ . 1 . 2 . ]" 1
1504 1 82 TYR H 1 82 TYR HB3 . . 3.740 3.187 3.057 3.290 . 0 0 "[ . 1 . 2 . ]" 1
1505 1 82 TYR H 1 82 TYR QD . . 4.280 2.128 1.909 2.306 . 0 0 "[ . 1 . 2 . ]" 1
1506 1 82 TYR H 1 82 TYR QE . . 5.500 4.043 3.932 4.158 . 0 0 "[ . 1 . 2 . ]" 1
1507 1 82 TYR H 1 83 SER QB . . 5.170 3.957 3.456 4.705 . 0 0 "[ . 1 . 2 . ]" 1
1508 1 82 TYR QD 1 83 SER HA . . 4.580 4.396 4.267 4.580 . 0 0 "[ . 1 . 2 . ]" 1
1509 1 84 ARG HA 1 84 ARG QD . . 4.340 3.909 3.170 4.296 . 0 0 "[ . 1 . 2 . ]" 1
1510 1 84 ARG HA 1 84 ARG QG . . 3.690 2.446 1.981 3.382 . 0 0 "[ . 1 . 2 . ]" 1
1511 1 84 ARG HB2 1 84 ARG QD . . 3.360 2.480 1.971 3.176 . 0 0 "[ . 1 . 2 . ]" 1
1512 1 84 ARG HB2 1 85 ALA H . . 5.110 3.785 1.957 4.575 . 0 0 "[ . 1 . 2 . ]" 1
1513 1 84 ARG HB3 1 84 ARG QD . . 3.700 2.501 1.983 3.184 . 0 0 "[ . 1 . 2 . ]" 1
1514 1 84 ARG HB3 1 85 ALA H . . 5.130 3.746 1.981 4.590 . 0 0 "[ . 1 . 2 . ]" 1
1515 1 84 ARG H 1 84 ARG QG . . 4.980 3.113 1.983 4.030 . 0 0 "[ . 1 . 2 . ]" 1
1516 1 84 ARG QG 1 85 ALA H . . 5.300 4.096 2.326 4.672 . 0 0 "[ . 1 . 2 . ]" 1
1517 1 86 ASP HB3 1 87 GLU H . . 4.230 3.671 2.052 4.652 0.422 6 0 "[ . 1 . 2 . ]" 1
1518 1 87 GLU HB2 1 87 GLU QG . . 2.760 2.334 2.181 2.567 . 0 0 "[ . 1 . 2 . ]" 1
1519 1 87 GLU H 1 87 GLU HB2 . . 4.160 2.524 2.022 3.669 . 0 0 "[ . 1 . 2 . ]" 1
1520 1 87 GLU H 1 87 GLU QG . . 4.320 3.184 2.000 4.026 . 0 0 "[ . 1 . 2 . ]" 1
1521 1 88 GLU HA 1 88 GLU HG2 . . 3.950 2.953 2.045 3.837 . 0 0 "[ . 1 . 2 . ]" 1
1522 1 88 GLU HA 1 88 GLU HG3 . . 3.710 2.865 2.087 3.648 . 0 0 "[ . 1 . 2 . ]" 1
1523 1 88 GLU HB2 1 88 GLU HG3 . . 2.610 2.647 2.264 3.056 0.446 21 0 "[ . 1 . 2 . ]" 1
1524 1 88 GLU HB3 1 88 GLU HG3 . . 2.860 2.768 2.494 3.032 0.172 24 0 "[ . 1 . 2 . ]" 1
1525 1 88 GLU H 1 88 GLU HB3 . . 3.610 2.900 2.258 3.461 . 0 0 "[ . 1 . 2 . ]" 1
1526 1 88 GLU H 1 88 GLU HG2 . . 4.730 4.192 2.125 4.647 . 0 0 "[ . 1 . 2 . ]" 1
1527 1 89 GLN HA 1 89 GLN QG . . 3.570 2.432 1.940 3.370 . 0 0 "[ . 1 . 2 . ]" 1
1528 1 89 GLN H 1 89 GLN HB3 . . 3.780 2.937 2.444 3.585 . 0 0 "[ . 1 . 2 . ]" 1
1529 1 89 GLN H 1 89 GLN QG . . 4.690 3.365 2.035 4.076 . 0 0 "[ . 1 . 2 . ]" 1
1530 1 90 GLN H 1 90 GLN HB2 . . 4.100 2.640 2.019 3.564 . 0 0 "[ . 1 . 2 . ]" 1
1531 1 90 GLN H 1 90 GLN QG . . 4.430 3.349 1.947 4.033 . 0 0 "[ . 1 . 2 . ]" 1
1532 1 93 LEU HA 1 93 LEU QD . . 3.910 2.737 1.905 3.460 . 0 0 "[ . 1 . 2 . ]" 1
1533 1 93 LEU H 1 93 LEU HB3 . . 4.050 2.787 2.191 3.708 . 0 0 "[ . 1 . 2 . ]" 1
1534 1 93 LEU QD 1 97 MET QB . . 3.990 3.231 2.084 3.992 0.002 20 0 "[ . 1 . 2 . ]" 1
1535 1 93 LEU QD 1 97 MET H . . 4.940 3.732 2.651 4.967 0.027 19 0 "[ . 1 . 2 . ]" 1
1536 1 97 MET H 1 97 MET QB . . 3.670 2.210 1.958 2.913 . 0 0 "[ . 1 . 2 . ]" 1
1537 2 1 MET HA 2 4 GLN HA . . 4.730 4.554 4.265 4.725 . 0 0 "[ . 1 . 2 . ]" 1
1538 2 1 MET HA 2 4 GLN H . . 5.490 5.416 5.197 5.514 0.024 12 0 "[ . 1 . 2 . ]" 1
1539 2 2 THR HA 2 2 THR MG . . 3.370 2.752 2.292 3.246 . 0 0 "[ . 1 . 2 . ]" 1
1540 2 2 THR MG 2 3 GLU HA . . 5.060 4.060 3.617 4.478 . 0 0 "[ . 1 . 2 . ]" 1
1541 2 2 THR MG 2 3 GLU QG . . 5.130 2.823 1.953 3.828 . 0 0 "[ . 1 . 2 . ]" 1
1542 2 3 GLU HA 2 3 GLU QG . . 3.890 2.628 2.026 3.524 . 0 0 "[ . 1 . 2 . ]" 1
1543 2 3 GLU QB 2 5 GLN HA . . 5.500 4.993 4.582 5.351 . 0 0 "[ . 1 . 2 . ]" 1
1544 2 3 GLU QB 2 5 GLN QG . . 3.530 2.981 1.972 3.452 . 0 0 "[ . 1 . 2 . ]" 1
1545 2 4 GLN HA 2 4 GLN QG . . 3.970 2.585 1.941 3.379 . 0 0 "[ . 1 . 2 . ]" 1
1546 2 4 GLN HA 2 7 ASN HB2 . . 5.500 5.007 3.916 5.551 0.051 20 0 "[ . 1 . 2 . ]" 1
1547 2 4 GLN HA 2 7 ASN HB3 . . 5.500 5.216 3.722 5.564 0.064 28 0 "[ . 1 . 2 . ]" 1
1548 2 5 GLN HA 2 5 GLN QG . . 4.000 2.527 2.122 3.330 . 0 0 "[ . 1 . 2 . ]" 1
1549 2 5 GLN HA 2 6 TRP HD1 . . 5.270 4.938 4.387 5.271 0.001 15 0 "[ . 1 . 2 . ]" 1
1550 2 5 GLN HB2 2 6 TRP HD1 . . 5.500 2.975 2.137 4.464 . 0 0 "[ . 1 . 2 . ]" 1
1551 2 5 GLN QG 2 6 TRP HD1 . . 5.470 4.346 2.131 5.428 . 0 0 "[ . 1 . 2 . ]" 1
1552 2 5 GLN QG 2 6 TRP H . . 5.500 3.645 1.951 4.413 . 0 0 "[ . 1 . 2 . ]" 1
1553 2 6 TRP HA 2 6 TRP HE3 . . 5.480 3.966 2.996 4.410 . 0 0 "[ . 1 . 2 . ]" 1
1554 2 6 TRP QB 2 11 ILE HB . . 5.270 3.961 2.534 5.147 . 0 0 "[ . 1 . 2 . ]" 1
1555 2 6 TRP QB 2 11 ILE MD . . 4.880 4.580 3.994 4.813 . 0 0 "[ . 1 . 2 . ]" 1
1556 2 6 TRP HE3 2 7 ASN HA . . 5.500 5.140 3.908 5.688 0.188 28 0 "[ . 1 . 2 . ]" 1
1557 2 6 TRP HE3 2 11 ILE HA . . 6.000 5.250 4.390 6.085 0.085 21 0 "[ . 1 . 2 . ]" 1
1558 2 6 TRP HE3 2 11 ILE QG . . 5.500 3.849 2.725 4.711 . 0 0 "[ . 1 . 2 . ]" 1
1559 2 6 TRP HE3 2 11 ILE MD . . 4.660 3.510 3.071 4.089 . 0 0 "[ . 1 . 2 . ]" 1
1560 2 6 TRP HE3 2 11 ILE MG . . 5.250 2.004 1.769 2.762 . 0 0 "[ . 1 . 2 . ]" 1
1561 2 6 TRP HH2 2 11 ILE MD . . 4.960 4.887 4.101 5.090 0.130 5 0 "[ . 1 . 2 . ]" 1
1562 2 6 TRP H 2 6 TRP HD1 . . 5.500 3.487 2.674 5.059 . 0 0 "[ . 1 . 2 . ]" 1
1563 2 9 ALA HA 2 10 GLY HA3 . . 4.580 4.667 4.637 4.753 0.173 25 0 "[ . 1 . 2 . ]" 1
1564 2 9 ALA H 2 10 GLY H . . 5.500 2.587 2.291 2.696 . 0 0 "[ . 1 . 2 . ]" 1
1565 2 9 ALA MB 2 10 GLY HA3 . . 4.840 4.068 3.996 4.125 . 0 0 "[ . 1 . 2 . ]" 1
1566 2 9 ALA MB 2 10 GLY HA2 . . 4.840 4.442 4.340 4.559 . 0 0 "[ . 1 . 2 . ]" 1
1567 2 9 ALA MB 2 10 GLY H . . 5.070 3.199 3.056 3.335 . 0 0 "[ . 1 . 2 . ]" 1
1568 2 9 ALA MB 2 11 ILE H . . 5.500 5.223 5.017 5.352 . 0 0 "[ . 1 . 2 . ]" 1
1569 2 10 GLY HA3 2 14 ALA H . . 5.230 4.243 3.812 4.962 . 0 0 "[ . 1 . 2 . ]" 1
1570 2 11 ILE HA 2 11 ILE MD . . 4.150 3.485 3.059 3.903 . 0 0 "[ . 1 . 2 . ]" 1
1571 2 11 ILE HA 2 11 ILE MG . . 3.600 3.200 3.179 3.214 . 0 0 "[ . 1 . 2 . ]" 1
1572 2 11 ILE HA 2 14 ALA HA . . 5.370 4.415 4.179 4.802 . 0 0 "[ . 1 . 2 . ]" 1
1573 2 11 ILE HA 2 14 ALA H . . 4.580 3.106 2.802 3.388 . 0 0 "[ . 1 . 2 . ]" 1
1574 2 11 ILE HA 2 14 ALA MB . . 3.690 1.882 1.756 1.982 . 0 0 "[ . 1 . 2 . ]" 1
1575 2 11 ILE HA 2 15 ALA H . . 5.500 4.399 4.291 4.532 . 0 0 "[ . 1 . 2 . ]" 1
1576 2 11 ILE HA 2 15 ALA MB . . 5.300 5.388 5.288 5.535 0.235 14 0 "[ . 1 . 2 . ]" 1
1577 2 11 ILE HB 2 14 ALA MB . . 5.070 3.810 3.529 4.084 . 0 0 "[ . 1 . 2 . ]" 1
1578 2 11 ILE QG 2 12 GLU H . . 5.500 4.352 3.879 4.636 . 0 0 "[ . 1 . 2 . ]" 1
1579 2 11 ILE H 2 11 ILE QG . . 4.820 3.939 3.858 4.049 . 0 0 "[ . 1 . 2 . ]" 1
1580 2 11 ILE H 2 11 ILE MD . . 4.820 4.100 3.659 4.264 . 0 0 "[ . 1 . 2 . ]" 1
1581 2 11 ILE H 2 11 ILE MG . . 4.400 2.060 1.811 2.342 . 0 0 "[ . 1 . 2 . ]" 1
1582 2 11 ILE H 2 12 GLU H . . 5.130 2.600 2.244 2.820 . 0 0 "[ . 1 . 2 . ]" 1
1583 2 11 ILE MD 2 12 GLU HA . . 5.140 3.441 2.759 4.636 . 0 0 "[ . 1 . 2 . ]" 1
1584 2 11 ILE MD 2 14 ALA H . . 5.400 4.969 4.386 5.563 0.163 25 0 "[ . 1 . 2 . ]" 1
1585 2 11 ILE MD 2 14 ALA MB . . 3.800 3.713 3.064 4.030 0.230 28 0 "[ . 1 . 2 . ]" 1
1586 2 11 ILE MD 2 15 ALA H . . 5.240 4.658 3.843 5.292 0.052 16 0 "[ . 1 . 2 . ]" 1
1587 2 11 ILE MD 2 79 ALA HA . . 4.460 4.044 3.450 4.492 0.032 6 0 "[ . 1 . 2 . ]" 1
1588 2 11 ILE MD 2 79 ALA MB . . 3.570 2.373 1.900 2.848 . 0 0 "[ . 1 . 2 . ]" 1
1589 2 11 ILE MD 2 83 MET HB3 . . 4.950 4.849 4.080 5.775 0.825 25 3 "[ . 1 .* 2 + - ]" 1
1590 2 11 ILE MD 2 83 MET HG2 . . 5.220 4.963 3.621 5.521 0.301 17 0 "[ . 1 . 2 . ]" 1
1591 2 11 ILE MD 2 83 MET HG3 . . 5.420 4.355 3.467 5.374 . 0 0 "[ . 1 . 2 . ]" 1
1592 2 11 ILE MD 2 11 ILE MG . . 2.960 1.787 1.690 1.876 . 0 0 "[ . 1 . 2 . ]" 1
1593 2 12 GLU H 2 13 ALA H . . 5.160 2.695 2.568 2.763 . 0 0 "[ . 1 . 2 . ]" 1
1594 2 12 GLU QG 2 13 ALA MB . . 4.770 3.697 3.233 4.562 . 0 0 "[ . 1 . 2 . ]" 1
1595 2 12 GLU QG 2 16 SER HB2 . . 4.900 4.836 4.367 5.050 0.150 6 0 "[ . 1 . 2 . ]" 1
1596 2 13 ALA HA 2 15 ALA H . . 5.350 4.201 4.042 4.431 . 0 0 "[ . 1 . 2 . ]" 1
1597 2 13 ALA HA 2 16 SER HB2 . . 3.820 2.437 2.263 2.593 . 0 0 "[ . 1 . 2 . ]" 1
1598 2 13 ALA HA 2 16 SER HB3 . . 3.960 3.459 3.268 3.648 . 0 0 "[ . 1 . 2 . ]" 1
1599 2 13 ALA H 2 14 ALA H . . 4.020 2.354 2.264 2.548 . 0 0 "[ . 1 . 2 . ]" 1
1600 2 13 ALA MB 2 16 SER HB2 . . 4.240 3.592 3.269 3.854 . 0 0 "[ . 1 . 2 . ]" 1
1601 2 13 ALA MB 2 16 SER H . . 4.500 4.320 4.113 4.525 0.025 20 0 "[ . 1 . 2 . ]" 1
1602 2 14 ALA HA 2 15 ALA HA . . 4.590 4.811 4.791 4.836 0.246 9 0 "[ . 1 . 2 . ]" 1
1603 2 14 ALA HA 2 17 ALA MB . . 3.520 2.505 2.390 2.674 . 0 0 "[ . 1 . 2 . ]" 1
1604 2 14 ALA HA 2 18 ILE MD . . 5.410 4.895 4.733 5.059 . 0 0 "[ . 1 . 2 . ]" 1
1605 2 14 ALA HA 2 76 ILE MG . . 5.460 5.242 5.153 5.380 . 0 0 "[ . 1 . 2 . ]" 1
1606 2 14 ALA H 2 14 ALA MB . . 3.210 2.134 2.012 2.169 . 0 0 "[ . 1 . 2 . ]" 1
1607 2 14 ALA H 2 15 ALA H . . 3.960 2.900 2.733 2.973 . 0 0 "[ . 1 . 2 . ]" 1
1608 2 14 ALA MB 2 15 ALA H . . 3.670 2.428 2.320 2.620 . 0 0 "[ . 1 . 2 . ]" 1
1609 2 14 ALA MB 2 17 ALA H . . 5.260 4.399 4.352 4.482 . 0 0 "[ . 1 . 2 . ]" 1
1610 2 14 ALA MB 2 17 ALA MB . . 3.870 3.775 3.670 3.892 0.022 26 0 "[ . 1 . 2 . ]" 1
1611 2 14 ALA MB 2 18 ILE HG13 . . 5.340 4.364 4.114 4.605 . 0 0 "[ . 1 . 2 . ]" 1
1612 2 14 ALA MB 2 18 ILE MD . . 4.140 4.180 4.070 4.307 0.167 21 0 "[ . 1 . 2 . ]" 1
1613 2 14 ALA MB 2 76 ILE MG . . 3.650 3.669 3.545 3.803 0.153 6 0 "[ . 1 . 2 . ]" 1
1614 2 15 ALA HA 2 17 ALA MB . . 5.110 4.652 4.599 4.705 . 0 0 "[ . 1 . 2 . ]" 1
1615 2 15 ALA HA 2 18 ILE HB . . 4.060 2.709 2.642 2.791 . 0 0 "[ . 1 . 2 . ]" 1
1616 2 15 ALA HA 2 18 ILE HG13 . . 5.040 2.906 2.759 3.133 . 0 0 "[ . 1 . 2 . ]" 1
1617 2 15 ALA HA 2 18 ILE H . . 4.910 3.077 2.979 3.127 . 0 0 "[ . 1 . 2 . ]" 1
1618 2 15 ALA HA 2 18 ILE MD . . 4.270 4.248 4.116 4.324 0.054 17 0 "[ . 1 . 2 . ]" 1
1619 2 15 ALA HA 2 18 ILE MG . . 4.120 4.032 3.989 4.075 . 0 0 "[ . 1 . 2 . ]" 1
1620 2 15 ALA HA 2 76 ILE MD . . 4.530 3.961 3.838 4.053 . 0 0 "[ . 1 . 2 . ]" 1
1621 2 15 ALA HA 2 76 ILE MG . . 4.020 1.806 1.771 1.856 . 0 0 "[ . 1 . 2 . ]" 1
1622 2 15 ALA H 2 15 ALA MB . . 3.400 1.978 1.932 2.146 . 0 0 "[ . 1 . 2 . ]" 1
1623 2 15 ALA H 2 16 SER H . . 3.990 2.817 2.740 2.901 . 0 0 "[ . 1 . 2 . ]" 1
1624 2 15 ALA H 2 17 ALA H . . 5.500 3.942 3.885 4.007 . 0 0 "[ . 1 . 2 . ]" 1
1625 2 15 ALA H 2 18 ILE HB . . 5.210 5.336 5.254 5.391 0.181 22 0 "[ . 1 . 2 . ]" 1
1626 2 15 ALA H 2 18 ILE HG12 . . 5.500 4.546 4.434 4.635 . 0 0 "[ . 1 . 2 . ]" 1
1627 2 15 ALA MB 2 16 SER HB2 . . 3.960 4.002 3.925 4.067 0.107 12 0 "[ . 1 . 2 . ]" 1
1628 2 15 ALA MB 2 16 SER H . . 4.210 2.506 2.414 2.595 . 0 0 "[ . 1 . 2 . ]" 1
1629 2 15 ALA MB 2 18 ILE HB . . 4.140 3.899 3.750 4.004 . 0 0 "[ . 1 . 2 . ]" 1
1630 2 15 ALA MB 2 18 ILE MG . . 4.690 4.651 4.503 4.745 0.055 9 0 "[ . 1 . 2 . ]" 1
1631 2 15 ALA MB 2 19 GLN QG . . 4.780 4.629 4.380 4.844 0.064 3 0 "[ . 1 . 2 . ]" 1
1632 2 15 ALA MB 2 76 ILE HA . . 5.070 3.756 3.574 3.832 . 0 0 "[ . 1 . 2 . ]" 1
1633 2 15 ALA MB 2 76 ILE H . . 5.500 4.862 4.693 5.008 . 0 0 "[ . 1 . 2 . ]" 1
1634 2 15 ALA MB 2 76 ILE MD . . 4.330 4.441 4.256 4.494 0.164 12 0 "[ . 1 . 2 . ]" 1
1635 2 15 ALA MB 2 76 ILE MG . . 3.370 1.960 1.873 2.112 . 0 0 "[ . 1 . 2 . ]" 1
1636 2 15 ALA MB 2 77 SER HA . . 3.930 1.941 1.831 2.082 . 0 0 "[ . 1 . 2 . ]" 1
1637 2 15 ALA MB 2 77 SER QB . . 3.990 3.665 3.389 3.795 . 0 0 "[ . 1 . 2 . ]" 1
1638 2 15 ALA MB 2 77 SER H . . 4.640 3.470 3.252 3.736 . 0 0 "[ . 1 . 2 . ]" 1
1639 2 15 ALA MB 2 78 GLU QG . . 4.670 4.447 4.348 4.585 . 0 0 "[ . 1 . 2 . ]" 1
1640 2 16 SER HA 2 17 ALA HA . . 4.800 4.759 4.745 4.780 . 0 0 "[ . 1 . 2 . ]" 1
1641 2 16 SER HA 2 19 GLN HB3 . . 4.070 4.111 4.065 4.214 0.144 6 0 "[ . 1 . 2 . ]" 1
1642 2 16 SER HA 2 19 GLN HB2 . . 4.070 2.691 2.643 2.798 . 0 0 "[ . 1 . 2 . ]" 1
1643 2 16 SER HA 2 19 GLN QG . . 4.170 3.882 3.788 4.013 . 0 0 "[ . 1 . 2 . ]" 1
1644 2 16 SER HB2 2 17 ALA MB . . 4.690 4.732 4.686 4.782 0.092 23 0 "[ . 1 . 2 . ]" 1
1645 2 16 SER HB2 2 19 GLN HB2 . . 5.380 5.456 5.401 5.522 0.142 6 0 "[ . 1 . 2 . ]" 1
1646 2 16 SER HB3 2 17 ALA H . . 4.180 3.137 3.035 3.181 . 0 0 "[ . 1 . 2 . ]" 1
1647 2 16 SER HB3 2 17 ALA MB . . 4.110 4.051 3.989 4.137 0.027 18 0 "[ . 1 . 2 . ]" 1
1648 2 16 SER H 2 16 SER HB2 . . 3.780 2.025 2.018 2.037 . 0 0 "[ . 1 . 2 . ]" 1
1649 2 16 SER H 2 16 SER HB3 . . 3.780 3.137 3.091 3.174 . 0 0 "[ . 1 . 2 . ]" 1
1650 2 16 SER H 2 18 ILE HB . . 5.500 5.292 5.217 5.354 . 0 0 "[ . 1 . 2 . ]" 1
1651 2 16 SER H 2 18 ILE H . . 5.500 4.209 4.120 4.295 . 0 0 "[ . 1 . 2 . ]" 1
1652 2 16 SER H 2 19 GLN HB2 . . 5.500 5.066 4.987 5.190 . 0 0 "[ . 1 . 2 . ]" 1
1653 2 17 ALA HA 2 18 ILE HA . . 5.110 4.797 4.755 4.831 . 0 0 "[ . 1 . 2 . ]" 1
1654 2 17 ALA HA 2 20 GLY HA2 . . 4.680 4.132 3.861 4.326 . 0 0 "[ . 1 . 2 . ]" 1
1655 2 17 ALA HA 2 20 GLY H . . 5.030 3.639 3.260 3.909 . 0 0 "[ . 1 . 2 . ]" 1
1656 2 17 ALA H 2 17 ALA MB . . 3.620 2.014 1.950 2.045 . 0 0 "[ . 1 . 2 . ]" 1
1657 2 17 ALA H 2 18 ILE HB . . 5.500 4.613 4.551 4.661 . 0 0 "[ . 1 . 2 . ]" 1
1658 2 17 ALA H 2 18 ILE HG12 . . 5.410 3.906 3.779 4.032 . 0 0 "[ . 1 . 2 . ]" 1
1659 2 17 ALA H 2 18 ILE H . . 4.330 2.478 2.420 2.576 . 0 0 "[ . 1 . 2 . ]" 1
1660 2 17 ALA MB 2 18 ILE HA . . 5.030 3.746 3.709 3.790 . 0 0 "[ . 1 . 2 . ]" 1
1661 2 17 ALA MB 2 18 ILE H . . 4.230 2.750 2.680 2.859 . 0 0 "[ . 1 . 2 . ]" 1
1662 2 17 ALA MB 2 18 ILE MD . . 4.830 3.387 3.173 3.588 . 0 0 "[ . 1 . 2 . ]" 1
1663 2 17 ALA MB 2 18 ILE MG . . 5.500 4.977 4.950 5.022 . 0 0 "[ . 1 . 2 . ]" 1
1664 2 17 ALA MB 2 19 GLN H . . 5.500 4.635 4.541 4.765 . 0 0 "[ . 1 . 2 . ]" 1
1665 2 17 ALA MB 2 20 GLY H . . 5.500 4.893 4.531 5.126 . 0 0 "[ . 1 . 2 . ]" 1
1666 2 18 ILE HA 2 18 ILE MD . . 4.430 1.990 1.926 2.112 . 0 0 "[ . 1 . 2 . ]" 1
1667 2 18 ILE HA 2 20 GLY H . . 5.400 4.940 4.571 5.130 . 0 0 "[ . 1 . 2 . ]" 1
1668 2 18 ILE HA 2 21 ASN HA . . 5.100 5.214 5.155 5.269 0.169 15 0 "[ . 1 . 2 . ]" 1
1669 2 18 ILE HA 2 21 ASN HB2 . . 4.670 2.241 2.159 2.415 . 0 0 "[ . 1 . 2 . ]" 1
1670 2 18 ILE HA 2 21 ASN HB3 . . 4.870 3.687 3.514 4.033 . 0 0 "[ . 1 . 2 . ]" 1
1671 2 18 ILE HA 2 21 ASN H . . 4.350 3.427 3.310 3.511 . 0 0 "[ . 1 . 2 . ]" 1
1672 2 18 ILE HA 2 22 VAL H . . 5.180 3.891 3.698 4.031 . 0 0 "[ . 1 . 2 . ]" 1
1673 2 18 ILE HA 2 22 VAL MG2 . . 5.060 3.459 3.372 3.588 . 0 0 "[ . 1 . 2 . ]" 1
1674 2 18 ILE HB 2 19 GLN H . . 4.360 2.656 2.547 2.734 . 0 0 "[ . 1 . 2 . ]" 1
1675 2 18 ILE HB 2 20 GLY H . . 5.500 5.456 5.238 5.565 0.065 18 0 "[ . 1 . 2 . ]" 1
1676 2 18 ILE HB 2 22 VAL MG2 . . 5.040 3.886 3.809 3.936 . 0 0 "[ . 1 . 2 . ]" 1
1677 2 18 ILE HB 2 73 ALA HA . . 5.120 3.483 3.223 3.688 . 0 0 "[ . 1 . 2 . ]" 1
1678 2 18 ILE HB 2 73 ALA MB . . 4.900 3.104 2.948 3.242 . 0 0 "[ . 1 . 2 . ]" 1
1679 2 18 ILE HB 2 76 ILE MD . . 3.630 3.676 3.551 3.746 0.116 18 0 "[ . 1 . 2 . ]" 1
1680 2 18 ILE HB 2 76 ILE MG . . 4.370 2.183 2.059 2.370 . 0 0 "[ . 1 . 2 . ]" 1
1681 2 18 ILE HB 2 77 SER HA . . 5.280 4.396 4.252 4.570 . 0 0 "[ . 1 . 2 . ]" 1
1682 2 18 ILE HB 2 77 SER QB . . 4.940 4.469 4.276 4.603 . 0 0 "[ . 1 . 2 . ]" 1
1683 2 18 ILE HG13 2 72 LEU QD . . 4.430 2.971 2.686 3.257 . 0 0 "[ . 1 . 2 . ]" 1
1684 2 18 ILE HG13 2 73 ALA HA . . 5.140 4.217 4.112 4.345 . 0 0 "[ . 1 . 2 . ]" 1
1685 2 18 ILE HG13 2 76 ILE MD . . 3.580 2.097 1.939 2.240 . 0 0 "[ . 1 . 2 . ]" 1
1686 2 18 ILE HG13 2 76 ILE QG . . 3.970 3.977 3.896 4.047 0.077 14 0 "[ . 1 . 2 . ]" 1
1687 2 18 ILE HG13 2 76 ILE MG . . 4.120 1.817 1.747 1.889 . 0 0 "[ . 1 . 2 . ]" 1
1688 2 18 ILE HG13 2 77 SER H . . 5.130 5.269 5.203 5.325 0.195 17 0 "[ . 1 . 2 . ]" 1
1689 2 18 ILE H 2 18 ILE HB . . 3.990 2.413 2.350 2.457 . 0 0 "[ . 1 . 2 . ]" 1
1690 2 18 ILE H 2 18 ILE HG12 . . 4.490 2.034 1.941 2.196 . 0 0 "[ . 1 . 2 . ]" 1
1691 2 18 ILE H 2 18 ILE MD . . 5.100 3.282 3.009 3.412 . 0 0 "[ . 1 . 2 . ]" 1
1692 2 18 ILE H 2 18 ILE MG . . 4.710 3.704 3.695 3.710 . 0 0 "[ . 1 . 2 . ]" 1
1693 2 18 ILE H 2 19 GLN H . . 4.230 2.701 2.619 2.789 . 0 0 "[ . 1 . 2 . ]" 1
1694 2 18 ILE H 2 20 GLY H . . 5.500 4.574 4.331 4.752 . 0 0 "[ . 1 . 2 . ]" 1
1695 2 18 ILE H 2 73 ALA MB . . 5.500 4.984 4.753 5.181 . 0 0 "[ . 1 . 2 . ]" 1
1696 2 18 ILE MD 2 22 VAL MG2 . . 4.920 3.808 3.716 3.964 . 0 0 "[ . 1 . 2 . ]" 1
1697 2 18 ILE MD 2 72 LEU HG . . 5.160 4.072 3.492 4.622 . 0 0 "[ . 1 . 2 . ]" 1
1698 2 18 ILE MD 2 72 LEU QD . . 4.040 2.170 1.853 2.608 . 0 0 "[ . 1 . 2 . ]" 1
1699 2 18 ILE MD 2 73 ALA HA . . 4.700 4.768 4.564 4.884 0.184 16 0 "[ . 1 . 2 . ]" 1
1700 2 18 ILE MD 2 76 ILE MG . . 4.330 3.227 3.130 3.331 . 0 0 "[ . 1 . 2 . ]" 1
1701 2 18 ILE MD 2 18 ILE MG . . 3.390 1.904 1.869 1.989 . 0 0 "[ . 1 . 2 . ]" 1
1702 2 18 ILE MG 2 19 GLN HA . . 4.580 3.461 3.362 3.599 . 0 0 "[ . 1 . 2 . ]" 1
1703 2 18 ILE MG 2 19 GLN H . . 4.650 3.449 3.356 3.555 . 0 0 "[ . 1 . 2 . ]" 1
1704 2 18 ILE MG 2 19 GLN QG . . 5.110 4.218 4.020 5.008 . 0 0 "[ . 1 . 2 . ]" 1
1705 2 18 ILE MG 2 20 GLY H . . 5.500 5.373 5.173 5.493 . 0 0 "[ . 1 . 2 . ]" 1
1706 2 18 ILE MG 2 21 ASN HB2 . . 5.290 3.765 3.628 3.885 . 0 0 "[ . 1 . 2 . ]" 1
1707 2 18 ILE MG 2 21 ASN HB3 . . 5.390 4.586 4.359 4.835 . 0 0 "[ . 1 . 2 . ]" 1
1708 2 18 ILE MG 2 21 ASN H . . 5.210 4.604 4.450 4.698 . 0 0 "[ . 1 . 2 . ]" 1
1709 2 18 ILE MG 2 22 VAL HA . . 5.110 4.475 4.385 4.566 . 0 0 "[ . 1 . 2 . ]" 1
1710 2 18 ILE MG 2 22 VAL H . . 4.900 3.818 3.662 3.953 . 0 0 "[ . 1 . 2 . ]" 1
1711 2 18 ILE MG 2 22 VAL MG2 . . 3.680 1.909 1.863 1.983 . 0 0 "[ . 1 . 2 . ]" 1
1712 2 18 ILE MG 2 22 VAL MG1 . . 4.040 4.109 4.068 4.204 0.164 26 0 "[ . 1 . 2 . ]" 1
1713 2 18 ILE MG 2 72 LEU QD . . 4.180 1.706 1.590 1.907 . 0 0 "[ . 1 . 2 . ]" 1
1714 2 18 ILE MG 2 73 ALA HA . . 3.950 2.125 1.912 2.427 . 0 0 "[ . 1 . 2 . ]" 1
1715 2 18 ILE MG 2 73 ALA MB . . 3.450 1.854 1.788 1.944 . 0 0 "[ . 1 . 2 . ]" 1
1716 2 18 ILE MG 2 77 SER QB . . 4.960 4.341 4.172 4.494 . 0 0 "[ . 1 . 2 . ]" 1
1717 2 19 GLN HA 2 19 GLN QG . . 3.680 2.381 2.266 2.608 . 0 0 "[ . 1 . 2 . ]" 1
1718 2 19 GLN HA 2 22 VAL HA . . 5.250 5.170 5.087 5.282 0.032 6 0 "[ . 1 . 2 . ]" 1
1719 2 19 GLN HA 2 22 VAL HB . . 3.870 2.455 2.366 2.536 . 0 0 "[ . 1 . 2 . ]" 1
1720 2 19 GLN HA 2 22 VAL H . . 4.150 3.264 3.167 3.399 . 0 0 "[ . 1 . 2 . ]" 1
1721 2 19 GLN HA 2 22 VAL MG2 . . 3.770 2.598 2.365 2.739 . 0 0 "[ . 1 . 2 . ]" 1
1722 2 19 GLN HA 2 22 VAL MG1 . . 4.120 3.767 3.694 3.854 . 0 0 "[ . 1 . 2 . ]" 1
1723 2 19 GLN HA 2 73 ALA MB . . 4.220 2.790 2.413 2.976 . 0 0 "[ . 1 . 2 . ]" 1
1724 2 19 GLN HB3 2 20 GLY H . . 4.750 2.626 2.427 2.945 . 0 0 "[ . 1 . 2 . ]" 1
1725 2 19 GLN HB3 2 22 VAL HB . . 4.770 4.713 4.635 4.820 0.050 6 0 "[ . 1 . 2 . ]" 1
1726 2 19 GLN HB3 2 22 VAL MG2 . . 5.080 5.088 4.885 5.194 0.114 12 0 "[ . 1 . 2 . ]" 1
1727 2 19 GLN HB3 2 73 ALA MB . . 5.140 4.912 4.441 5.155 0.015 3 0 "[ . 1 . 2 . ]" 1
1728 2 19 GLN HB2 2 20 GLY H . . 4.670 2.799 2.722 3.022 . 0 0 "[ . 1 . 2 . ]" 1
1729 2 19 GLN HB2 2 22 VAL MG2 . . 5.270 4.957 4.791 5.070 . 0 0 "[ . 1 . 2 . ]" 1
1730 2 19 GLN HB2 2 73 ALA MB . . 4.780 4.420 4.007 4.737 . 0 0 "[ . 1 . 2 . ]" 1
1731 2 19 GLN HE22 2 22 VAL MG1 . . 4.980 3.629 3.120 4.393 . 0 0 "[ . 1 . 2 . ]" 1
1732 2 19 GLN HE22 2 77 SER QB . . 5.010 4.597 2.084 4.767 . 0 0 "[ . 1 . 2 . ]" 1
1733 2 19 GLN HE21 2 22 VAL MG1 . . 5.180 4.021 3.591 4.648 . 0 0 "[ . 1 . 2 . ]" 1
1734 2 19 GLN HE21 2 73 ALA HA . . 5.320 4.973 4.537 5.332 0.012 3 0 "[ . 1 . 2 . ]" 1
1735 2 19 GLN HE21 2 77 SER QB . . 5.490 3.182 2.888 3.340 . 0 0 "[ . 1 . 2 . ]" 1
1736 2 19 GLN H 2 19 GLN QG . . 4.180 3.111 2.984 3.615 . 0 0 "[ . 1 . 2 . ]" 1
1737 2 19 GLN H 2 20 GLY H . . 4.410 2.973 2.776 3.132 . 0 0 "[ . 1 . 2 . ]" 1
1738 2 19 GLN H 2 21 ASN H . . 5.400 3.937 3.840 4.058 . 0 0 "[ . 1 . 2 . ]" 1
1739 2 19 GLN H 2 22 VAL H . . 5.500 4.394 4.353 4.457 . 0 0 "[ . 1 . 2 . ]" 1
1740 2 19 GLN H 2 22 VAL MG2 . . 5.500 3.964 3.849 4.038 . 0 0 "[ . 1 . 2 . ]" 1
1741 2 19 GLN H 2 73 ALA MB . . 5.350 3.622 3.211 3.863 . 0 0 "[ . 1 . 2 . ]" 1
1742 2 19 GLN QG 2 20 GLY H . . 5.190 4.333 4.252 4.502 . 0 0 "[ . 1 . 2 . ]" 1
1743 2 19 GLN QG 2 22 VAL MG2 . . 4.380 4.007 3.794 4.405 0.025 3 0 "[ . 1 . 2 . ]" 1
1744 2 19 GLN QG 2 22 VAL MG1 . . 4.790 4.811 4.745 4.880 0.090 22 0 "[ . 1 . 2 . ]" 1
1745 2 19 GLN QG 2 23 THR MG . . 4.940 4.588 3.950 4.888 . 0 0 "[ . 1 . 2 . ]" 1
1746 2 19 GLN QG 2 73 ALA MB . . 4.280 2.892 2.334 3.879 . 0 0 "[ . 1 . 2 . ]" 1
1747 2 19 GLN QG 2 77 SER QB . . 4.510 2.442 2.091 2.990 . 0 0 "[ . 1 . 2 . ]" 1
1748 2 19 GLN QG 2 77 SER H . . 5.500 4.473 4.204 5.380 . 0 0 "[ . 1 . 2 . ]" 1
1749 2 20 GLY H 2 21 ASN H . . 4.350 2.758 2.616 2.824 . 0 0 "[ . 1 . 2 . ]" 1
1750 2 20 GLY H 2 22 VAL H . . 5.500 4.056 3.906 4.190 . 0 0 "[ . 1 . 2 . ]" 1
1751 2 20 GLY H 2 22 VAL MG2 . . 5.500 5.078 4.927 5.173 . 0 0 "[ . 1 . 2 . ]" 1
1752 2 21 ASN HA 2 21 ASN HD22 . . 4.620 3.353 3.221 3.531 . 0 0 "[ . 1 . 2 . ]" 1
1753 2 21 ASN HA 2 21 ASN HD21 . . 4.420 2.133 1.901 2.449 . 0 0 "[ . 1 . 2 . ]" 1
1754 2 21 ASN HA 2 24 SER HA . . 5.070 4.994 4.840 5.149 0.079 2 0 "[ . 1 . 2 . ]" 1
1755 2 21 ASN HA 2 24 SER HB2 . . 4.030 2.269 2.035 2.557 . 0 0 "[ . 1 . 2 . ]" 1
1756 2 21 ASN HA 2 24 SER HB3 . . 4.280 3.597 3.017 3.906 . 0 0 "[ . 1 . 2 . ]" 1
1757 2 21 ASN HA 2 24 SER H . . 4.550 3.372 3.281 3.475 . 0 0 "[ . 1 . 2 . ]" 1
1758 2 21 ASN HA 2 25 ILE HB . . 5.500 5.599 5.503 5.644 0.144 4 0 "[ . 1 . 2 . ]" 1
1759 2 21 ASN HA 2 25 ILE H . . 5.500 4.350 4.281 4.405 . 0 0 "[ . 1 . 2 . ]" 1
1760 2 21 ASN HA 2 25 ILE MD . . 4.870 3.787 3.587 4.095 . 0 0 "[ . 1 . 2 . ]" 1
1761 2 21 ASN HB2 2 22 VAL H . . 4.730 2.881 2.700 2.982 . 0 0 "[ . 1 . 2 . ]" 1
1762 2 21 ASN HB2 2 25 ILE MD . . 5.040 4.570 4.214 4.846 . 0 0 "[ . 1 . 2 . ]" 1
1763 2 21 ASN HB3 2 22 VAL H . . 4.890 3.599 3.490 3.711 . 0 0 "[ . 1 . 2 . ]" 1
1764 2 21 ASN HB3 2 25 ILE MD . . 4.860 3.262 3.072 3.458 . 0 0 "[ . 1 . 2 . ]" 1
1765 2 21 ASN HD22 2 24 SER HB2 . . 5.500 4.932 4.738 5.199 . 0 0 "[ . 1 . 2 . ]" 1
1766 2 21 ASN HD21 2 24 SER HB2 . . 5.500 3.469 3.201 3.885 . 0 0 "[ . 1 . 2 . ]" 1
1767 2 21 ASN HD21 2 24 SER HB3 . . 4.130 4.101 3.807 4.211 0.081 10 0 "[ . 1 . 2 . ]" 1
1768 2 21 ASN HD21 2 24 SER H . . 5.500 5.236 4.992 5.491 . 0 0 "[ . 1 . 2 . ]" 1
1769 2 21 ASN HD21 2 69 LEU MD2 . . 5.100 5.179 5.114 5.290 0.190 18 0 "[ . 1 . 2 . ]" 1
1770 2 21 ASN H 2 21 ASN HB2 . . 4.180 2.211 2.132 2.370 . 0 0 "[ . 1 . 2 . ]" 1
1771 2 21 ASN H 2 21 ASN HD22 . . 5.500 4.799 4.515 4.962 . 0 0 "[ . 1 . 2 . ]" 1
1772 2 21 ASN H 2 21 ASN HD21 . . 5.500 4.295 4.115 4.482 . 0 0 "[ . 1 . 2 . ]" 1
1773 2 21 ASN H 2 22 VAL HA . . 5.500 5.012 4.967 5.101 . 0 0 "[ . 1 . 2 . ]" 1
1774 2 21 ASN H 2 22 VAL HB . . 5.390 4.425 4.378 4.518 . 0 0 "[ . 1 . 2 . ]" 1
1775 2 21 ASN H 2 22 VAL H . . 4.080 2.439 2.392 2.544 . 0 0 "[ . 1 . 2 . ]" 1
1776 2 21 ASN H 2 22 VAL MG2 . . 5.020 4.103 4.010 4.205 . 0 0 "[ . 1 . 2 . ]" 1
1777 2 21 ASN H 2 69 LEU MD2 . . 4.780 4.765 4.652 4.851 0.071 27 0 "[ . 1 . 2 . ]" 1
1778 2 22 VAL HA 2 22 VAL MG2 . . 3.500 2.264 2.184 2.287 . 0 0 "[ . 1 . 2 . ]" 1
1779 2 22 VAL HA 2 25 ILE HB . . 4.550 3.328 3.249 3.413 . 0 0 "[ . 1 . 2 . ]" 1
1780 2 22 VAL HA 2 25 ILE H . . 5.350 3.670 3.621 3.719 . 0 0 "[ . 1 . 2 . ]" 1
1781 2 22 VAL HA 2 25 ILE MD . . 4.190 3.350 3.156 3.553 . 0 0 "[ . 1 . 2 . ]" 1
1782 2 22 VAL HA 2 69 LEU HA . . 5.490 5.062 4.822 5.283 . 0 0 "[ . 1 . 2 . ]" 1
1783 2 22 VAL HA 2 69 LEU HB2 . . 5.500 4.040 3.813 4.223 . 0 0 "[ . 1 . 2 . ]" 1
1784 2 22 VAL HA 2 69 LEU HB3 . . 5.160 2.798 2.516 3.030 . 0 0 "[ . 1 . 2 . ]" 1
1785 2 22 VAL HA 2 69 LEU HG . . 5.230 4.435 4.263 4.592 . 0 0 "[ . 1 . 2 . ]" 1
1786 2 22 VAL HA 2 69 LEU MD1 . . 4.210 2.418 2.095 2.697 . 0 0 "[ . 1 . 2 . ]" 1
1787 2 22 VAL HA 2 69 LEU MD2 . . 3.390 1.981 1.890 2.143 . 0 0 "[ . 1 . 2 . ]" 1
1788 2 22 VAL HA 2 73 ALA MB . . 5.270 4.635 4.442 4.830 . 0 0 "[ . 1 . 2 . ]" 1
1789 2 22 VAL HB 2 23 THR H . . 3.790 2.476 2.424 2.518 . 0 0 "[ . 1 . 2 . ]" 1
1790 2 22 VAL HB 2 69 LEU MD1 . . 5.240 5.067 4.810 5.282 0.042 10 0 "[ . 1 . 2 . ]" 1
1791 2 22 VAL HB 2 73 ALA MB . . 5.230 3.370 3.250 3.474 . 0 0 "[ . 1 . 2 . ]" 1
1792 2 22 VAL H 2 22 VAL HB . . 3.740 2.242 2.212 2.289 . 0 0 "[ . 1 . 2 . ]" 1
1793 2 22 VAL H 2 22 VAL MG2 . . 3.590 2.434 2.319 2.527 . 0 0 "[ . 1 . 2 . ]" 1
1794 2 22 VAL H 2 23 THR H . . 3.940 2.753 2.694 2.843 . 0 0 "[ . 1 . 2 . ]" 1
1795 2 22 VAL H 2 24 SER H . . 5.090 3.843 3.731 3.966 . 0 0 "[ . 1 . 2 . ]" 1
1796 2 22 VAL H 2 69 LEU MD2 . . 4.030 3.340 3.193 3.442 . 0 0 "[ . 1 . 2 . ]" 1
1797 2 22 VAL H 2 73 ALA MB . . 5.470 4.327 4.227 4.445 . 0 0 "[ . 1 . 2 . ]" 1
1798 2 22 VAL MG2 2 23 THR H . . 4.490 3.949 3.912 3.981 . 0 0 "[ . 1 . 2 . ]" 1
1799 2 22 VAL MG2 2 25 ILE HB . . 5.290 4.990 4.907 5.101 . 0 0 "[ . 1 . 2 . ]" 1
1800 2 22 VAL MG2 2 25 ILE MD . . 4.180 4.345 4.253 4.458 0.278 17 0 "[ . 1 . 2 . ]" 1
1801 2 22 VAL MG2 2 69 LEU HA . . 4.360 3.264 3.021 3.484 . 0 0 "[ . 1 . 2 . ]" 1
1802 2 22 VAL MG2 2 69 LEU HB2 . . 4.440 3.693 3.507 3.922 . 0 0 "[ . 1 . 2 . ]" 1
1803 2 22 VAL MG2 2 69 LEU HB3 . . 4.330 2.168 1.950 2.399 . 0 0 "[ . 1 . 2 . ]" 1
1804 2 22 VAL MG2 2 69 LEU HG . . 4.450 3.823 3.739 3.912 . 0 0 "[ . 1 . 2 . ]" 1
1805 2 22 VAL MG2 2 69 LEU MD2 . . 3.030 1.661 1.616 1.730 . 0 0 "[ . 1 . 2 . ]" 1
1806 2 22 VAL MG2 2 70 GLN QB . . 5.180 4.882 4.587 5.179 . 0 0 "[ . 1 . 2 . ]" 1
1807 2 22 VAL MG2 2 73 ALA HA . . 5.060 3.779 3.707 3.862 . 0 0 "[ . 1 . 2 . ]" 1
1808 2 22 VAL MG2 2 73 ALA MB . . 3.350 1.735 1.649 1.855 . 0 0 "[ . 1 . 2 . ]" 1
1809 2 22 VAL MG2 2 76 ILE HB . . 5.260 5.148 5.070 5.246 . 0 0 "[ . 1 . 2 . ]" 1
1810 2 22 VAL MG2 2 76 ILE MD . . 4.840 4.887 4.816 4.996 0.156 18 0 "[ . 1 . 2 . ]" 1
1811 2 22 VAL MG1 2 23 THR HA . . 4.920 3.231 3.182 3.293 . 0 0 "[ . 1 . 2 . ]" 1
1812 2 22 VAL MG1 2 23 THR HB . . 4.730 4.903 4.851 4.974 0.244 26 0 "[ . 1 . 2 . ]" 1
1813 2 22 VAL MG1 2 23 THR H . . 4.200 2.959 2.893 3.022 . 0 0 "[ . 1 . 2 . ]" 1
1814 2 22 VAL MG1 2 23 THR MG . . 4.420 2.811 2.703 2.974 . 0 0 "[ . 1 . 2 . ]" 1
1815 2 22 VAL MG1 2 24 SER H . . 4.930 4.772 4.689 4.842 . 0 0 "[ . 1 . 2 . ]" 1
1816 2 22 VAL MG1 2 25 ILE HB . . 4.310 4.454 4.400 4.494 0.184 4 0 "[ . 1 . 2 . ]" 1
1817 2 22 VAL MG1 2 26 HIS HB3 . . 4.760 4.701 4.548 4.813 0.053 26 0 "[ . 1 . 2 . ]" 1
1818 2 22 VAL MG1 2 69 LEU HB2 . . 4.380 3.574 3.363 3.828 . 0 0 "[ . 1 . 2 . ]" 1
1819 2 22 VAL MG1 2 70 GLN HE21 . . 4.960 3.376 2.081 4.981 0.021 3 0 "[ . 1 . 2 . ]" 1
1820 2 22 VAL MG1 2 70 GLN HE22 . . 4.920 4.541 2.819 4.959 0.039 9 0 "[ . 1 . 2 . ]" 1
1821 2 22 VAL MG1 2 70 GLN QG . . 4.450 2.444 1.991 3.119 . 0 0 "[ . 1 . 2 . ]" 1
1822 2 22 VAL MG1 2 70 GLN QB . . 4.910 3.978 3.591 4.321 . 0 0 "[ . 1 . 2 . ]" 1
1823 2 22 VAL MG1 2 73 ALA HA . . 5.500 5.519 5.445 5.565 0.065 28 0 "[ . 1 . 2 . ]" 1
1824 2 22 VAL MG1 2 73 ALA MB . . 3.890 2.843 2.769 2.890 . 0 0 "[ . 1 . 2 . ]" 1
1825 2 23 THR HA 2 23 THR MG . . 3.100 2.417 2.316 2.513 . 0 0 "[ . 1 . 2 . ]" 1
1826 2 23 THR HA 2 26 HIS HB3 . . 5.410 2.341 2.244 2.451 . 0 0 "[ . 1 . 2 . ]" 1
1827 2 23 THR HA 2 26 HIS H . . 5.140 2.952 2.903 3.059 . 0 0 "[ . 1 . 2 . ]" 1
1828 2 23 THR HB 2 24 SER H . . 3.750 3.871 3.823 3.939 0.189 21 0 "[ . 1 . 2 . ]" 1
1829 2 23 THR HB 2 26 HIS HB3 . . 4.020 3.757 3.666 3.885 . 0 0 "[ . 1 . 2 . ]" 1
1830 2 23 THR HB 2 26 HIS H . . 5.000 4.901 4.813 4.993 . 0 0 "[ . 1 . 2 . ]" 1
1831 2 23 THR H 2 23 THR HB . . 3.990 3.490 3.483 3.494 . 0 0 "[ . 1 . 2 . ]" 1
1832 2 23 THR H 2 23 THR MG . . 4.510 2.016 1.880 2.220 . 0 0 "[ . 1 . 2 . ]" 1
1833 2 23 THR H 2 24 SER H . . 3.950 2.675 2.607 2.732 . 0 0 "[ . 1 . 2 . ]" 1
1834 2 23 THR H 2 25 ILE H . . 5.500 4.422 4.321 4.599 . 0 0 "[ . 1 . 2 . ]" 1
1835 2 23 THR MG 2 24 SER H . . 4.530 3.894 3.768 4.031 . 0 0 "[ . 1 . 2 . ]" 1
1836 2 23 THR MG 2 26 HIS HB3 . . 5.160 4.094 3.929 4.267 . 0 0 "[ . 1 . 2 . ]" 1
1837 2 24 SER HA 2 27 SER QB . . 3.670 3.303 2.994 3.526 . 0 0 "[ . 1 . 2 . ]" 1
1838 2 24 SER HA 2 28 LEU HB2 . . 4.620 4.609 4.516 4.679 0.059 25 0 "[ . 1 . 2 . ]" 1
1839 2 24 SER HA 2 28 LEU QD . . 5.150 3.336 3.031 3.579 . 0 0 "[ . 1 . 2 . ]" 1
1840 2 24 SER HB2 2 25 ILE H . . 4.760 2.805 2.474 3.360 . 0 0 "[ . 1 . 2 . ]" 1
1841 2 24 SER HB2 2 25 ILE MD . . 5.220 3.275 2.857 3.939 . 0 0 "[ . 1 . 2 . ]" 1
1842 2 24 SER HB2 2 28 LEU QD . . 4.970 3.500 3.131 3.774 . 0 0 "[ . 1 . 2 . ]" 1
1843 2 24 SER HB3 2 25 ILE H . . 5.080 3.208 2.641 3.653 . 0 0 "[ . 1 . 2 . ]" 1
1844 2 24 SER HB3 2 25 ILE MD . . 5.240 3.449 2.509 4.158 . 0 0 "[ . 1 . 2 . ]" 1
1845 2 24 SER HB3 2 28 LEU HB2 . . 5.470 4.353 4.133 4.596 . 0 0 "[ . 1 . 2 . ]" 1
1846 2 24 SER HB3 2 28 LEU QD . . 4.560 2.157 1.935 2.573 . 0 0 "[ . 1 . 2 . ]" 1
1847 2 24 SER H 2 24 SER HB3 . . 4.050 3.427 3.070 3.551 . 0 0 "[ . 1 . 2 . ]" 1
1848 2 24 SER H 2 25 ILE HB . . 5.200 4.740 4.626 4.802 . 0 0 "[ . 1 . 2 . ]" 1
1849 2 24 SER H 2 25 ILE H . . 4.140 2.856 2.775 2.936 . 0 0 "[ . 1 . 2 . ]" 1
1850 2 24 SER H 2 25 ILE MD . . 4.980 4.394 4.124 4.727 . 0 0 "[ . 1 . 2 . ]" 1
1851 2 24 SER H 2 26 HIS HB2 . . 5.500 5.197 4.897 5.508 0.008 24 0 "[ . 1 . 2 . ]" 1
1852 2 24 SER H 2 26 HIS HB3 . . 5.500 5.074 4.910 5.241 . 0 0 "[ . 1 . 2 . ]" 1
1853 2 25 ILE HA 2 27 SER H . . 5.400 4.418 4.321 4.570 . 0 0 "[ . 1 . 2 . ]" 1
1854 2 25 ILE HA 2 28 LEU HA . . 5.500 4.824 4.773 4.866 . 0 0 "[ . 1 . 2 . ]" 1
1855 2 25 ILE HA 2 28 LEU HB3 . . 4.520 3.179 3.026 3.291 . 0 0 "[ . 1 . 2 . ]" 1
1856 2 25 ILE HA 2 28 LEU HB2 . . 5.250 1.898 1.852 1.941 . 0 0 "[ . 1 . 2 . ]" 1
1857 2 25 ILE HA 2 28 LEU HG . . 5.270 4.236 3.918 4.369 . 0 0 "[ . 1 . 2 . ]" 1
1858 2 25 ILE HA 2 28 LEU H . . 5.500 3.288 3.172 3.363 . 0 0 "[ . 1 . 2 . ]" 1
1859 2 25 ILE HA 2 28 LEU QD . . 4.190 2.413 2.168 2.615 . 0 0 "[ . 1 . 2 . ]" 1
1860 2 25 ILE HA 2 29 LEU HG . . 5.500 5.670 5.571 5.756 0.256 17 0 "[ . 1 . 2 . ]" 1
1861 2 25 ILE HA 2 29 LEU H . . 5.500 3.388 3.277 3.606 . 0 0 "[ . 1 . 2 . ]" 1
1862 2 25 ILE HB 2 25 ILE MD . . 3.640 2.079 1.909 2.152 . 0 0 "[ . 1 . 2 . ]" 1
1863 2 25 ILE HB 2 26 HIS H . . 4.130 3.130 2.977 3.198 . 0 0 "[ . 1 . 2 . ]" 1
1864 2 25 ILE HB 2 28 LEU QD . . 5.190 4.408 4.283 4.518 . 0 0 "[ . 1 . 2 . ]" 1
1865 2 25 ILE HB 2 29 LEU QD . . 5.000 4.661 4.376 4.925 . 0 0 "[ . 1 . 2 . ]" 1
1866 2 25 ILE HB 2 69 LEU MD1 . . 4.500 2.274 1.981 2.512 . 0 0 "[ . 1 . 2 . ]" 1
1867 2 25 ILE HB 2 69 LEU MD2 . . 3.880 3.957 3.877 4.042 0.162 24 0 "[ . 1 . 2 . ]" 1
1868 2 25 ILE H 2 25 ILE HB . . 3.820 2.090 2.061 2.122 . 0 0 "[ . 1 . 2 . ]" 1
1869 2 25 ILE H 2 26 HIS H . . 4.170 2.487 2.449 2.571 . 0 0 "[ . 1 . 2 . ]" 1
1870 2 25 ILE H 2 27 SER H . . 5.360 4.308 4.157 4.522 . 0 0 "[ . 1 . 2 . ]" 1
1871 2 25 ILE H 2 28 LEU H . . 5.500 4.519 4.341 4.658 . 0 0 "[ . 1 . 2 . ]" 1
1872 2 25 ILE MD 2 28 LEU QD . . 5.230 3.327 3.149 3.608 . 0 0 "[ . 1 . 2 . ]" 1
1873 2 25 ILE MD 2 69 LEU HB3 . . 4.970 4.568 4.375 4.684 . 0 0 "[ . 1 . 2 . ]" 1
1874 2 25 ILE MD 2 69 LEU HG . . 5.050 4.017 3.885 4.197 . 0 0 "[ . 1 . 2 . ]" 1
1875 2 25 ILE MG 2 26 HIS HA . . 4.470 3.183 3.089 3.256 . 0 0 "[ . 1 . 2 . ]" 1
1876 2 25 ILE MG 2 26 HIS HB2 . . 4.920 4.077 3.841 4.231 . 0 0 "[ . 1 . 2 . ]" 1
1877 2 25 ILE MG 2 26 HIS HD2 . . 5.360 4.858 4.758 5.042 . 0 0 "[ . 1 . 2 . ]" 1
1878 2 25 ILE MG 2 26 HIS H . . 4.040 3.168 2.932 3.303 . 0 0 "[ . 1 . 2 . ]" 1
1879 2 25 ILE MG 2 27 SER H . . 4.890 4.929 4.825 4.993 0.103 2 0 "[ . 1 . 2 . ]" 1
1880 2 25 ILE MG 2 28 LEU HB3 . . 4.370 4.601 4.505 4.710 0.340 25 0 "[ . 1 . 2 . ]" 1
1881 2 25 ILE MG 2 28 LEU H . . 5.500 4.797 4.560 4.929 . 0 0 "[ . 1 . 2 . ]" 1
1882 2 25 ILE MG 2 29 LEU HB3 . . 4.530 4.558 4.504 4.641 0.111 19 0 "[ . 1 . 2 . ]" 1
1883 2 25 ILE MG 2 29 LEU HB2 . . 4.820 3.197 3.151 3.280 . 0 0 "[ . 1 . 2 . ]" 1
1884 2 25 ILE MG 2 29 LEU HG . . 4.170 3.610 3.279 4.238 0.068 21 0 "[ . 1 . 2 . ]" 1
1885 2 25 ILE MG 2 29 LEU H . . 4.030 3.568 3.501 3.685 . 0 0 "[ . 1 . 2 . ]" 1
1886 2 25 ILE MG 2 29 LEU QD . . 4.160 2.165 1.882 2.446 . 0 0 "[ . 1 . 2 . ]" 1
1887 2 25 ILE MG 2 65 LEU HG . . 4.850 4.153 3.839 4.549 . 0 0 "[ . 1 . 2 . ]" 1
1888 2 25 ILE MG 2 66 ASN HA . . 4.410 2.762 2.643 3.071 . 0 0 "[ . 1 . 2 . ]" 1
1889 2 25 ILE MG 2 66 ASN HB2 . . 5.420 3.763 3.585 4.004 . 0 0 "[ . 1 . 2 . ]" 1
1890 2 25 ILE MG 2 66 ASN HB3 . . 5.500 4.602 4.384 4.908 . 0 0 "[ . 1 . 2 . ]" 1
1891 2 25 ILE MG 2 66 ASN HD21 . . 4.950 3.351 2.009 4.067 . 0 0 "[ . 1 . 2 . ]" 1
1892 2 25 ILE MG 2 66 ASN HD22 . . 4.830 3.141 2.308 3.681 . 0 0 "[ . 1 . 2 . ]" 1
1893 2 25 ILE MG 2 66 ASN H . . 4.200 4.059 3.846 4.196 . 0 0 "[ . 1 . 2 . ]" 1
1894 2 25 ILE MG 2 67 ASN H . . 5.500 5.621 5.501 5.872 0.372 7 0 "[ . 1 . 2 . ]" 1
1895 2 25 ILE MG 2 69 LEU HB3 . . 4.880 4.501 4.337 4.683 . 0 0 "[ . 1 . 2 . ]" 1
1896 2 25 ILE MG 2 69 LEU MD1 . . 3.340 2.364 2.146 2.547 . 0 0 "[ . 1 . 2 . ]" 1
1897 2 26 HIS HA 2 29 LEU HB3 . . 4.690 4.618 4.364 4.781 0.091 2 0 "[ . 1 . 2 . ]" 1
1898 2 26 HIS HA 2 29 LEU HB2 . . 4.840 3.478 3.249 3.644 . 0 0 "[ . 1 . 2 . ]" 1
1899 2 26 HIS HA 2 29 LEU HG . . 5.810 5.343 4.892 6.118 0.308 23 0 "[ . 1 . 2 . ]" 1
1900 2 26 HIS HA 2 29 LEU QD . . 5.000 4.362 3.624 4.798 . 0 0 "[ . 1 . 2 . ]" 1
1901 2 26 HIS HA 2 66 ASN HD21 . . 5.500 3.586 3.131 4.066 . 0 0 "[ . 1 . 2 . ]" 1
1902 2 26 HIS HA 2 66 ASN HD22 . . 5.500 1.990 1.889 2.365 . 0 0 "[ . 1 . 2 . ]" 1
1903 2 26 HIS HB3 2 27 SER HA . . 5.270 4.203 4.144 4.278 . 0 0 "[ . 1 . 2 . ]" 1
1904 2 26 HIS HB3 2 27 SER QB . . 5.100 4.097 3.704 4.285 . 0 0 "[ . 1 . 2 . ]" 1
1905 2 26 HIS HB3 2 27 SER H . . 4.980 2.552 2.450 2.619 . 0 0 "[ . 1 . 2 . ]" 1
1906 2 26 HIS HD2 2 27 SER HA . . 5.150 5.029 4.818 5.182 0.032 7 0 "[ . 1 . 2 . ]" 1
1907 2 26 HIS HD2 2 27 SER H . . 5.500 5.053 4.917 5.146 . 0 0 "[ . 1 . 2 . ]" 1
1908 2 26 HIS HD2 2 66 ASN HB3 . . 5.500 5.363 4.910 5.830 0.330 27 0 "[ . 1 . 2 . ]" 1
1909 2 26 HIS H 2 26 HIS HB3 . . 3.570 2.643 2.529 2.732 . 0 0 "[ . 1 . 2 . ]" 1
1910 2 26 HIS H 2 26 HIS HD2 . . 5.500 4.811 4.761 4.877 . 0 0 "[ . 1 . 2 . ]" 1
1911 2 26 HIS H 2 27 SER H . . 4.000 2.756 2.688 2.840 . 0 0 "[ . 1 . 2 . ]" 1
1912 2 26 HIS H 2 28 LEU HB2 . . 5.500 4.558 4.461 4.653 . 0 0 "[ . 1 . 2 . ]" 1
1913 2 26 HIS H 2 28 LEU H . . 5.500 4.014 3.794 4.133 . 0 0 "[ . 1 . 2 . ]" 1
1914 2 26 HIS H 2 29 LEU H . . 5.500 4.751 4.641 4.807 . 0 0 "[ . 1 . 2 . ]" 1
1915 2 27 SER HA 2 28 LEU HB2 . . 5.400 5.548 5.516 5.588 0.188 25 0 "[ . 1 . 2 . ]" 1
1916 2 27 SER HA 2 29 LEU HB2 . . 5.290 5.289 4.993 5.494 0.204 21 0 "[ . 1 . 2 . ]" 1
1917 2 27 SER HA 2 30 ASP HB2 . . 4.100 2.436 1.994 3.188 . 0 0 "[ . 1 . 2 . ]" 1
1918 2 27 SER HA 2 30 ASP HB3 . . 4.260 3.278 2.355 3.971 . 0 0 "[ . 1 . 2 . ]" 1
1919 2 27 SER HA 2 30 ASP H . . 4.210 3.132 2.946 3.187 . 0 0 "[ . 1 . 2 . ]" 1
1920 2 27 SER QB 2 28 LEU HB2 . . 5.310 4.483 4.435 4.592 . 0 0 "[ . 1 . 2 . ]" 1
1921 2 27 SER QB 2 28 LEU HG . . 5.080 4.086 3.853 4.204 . 0 0 "[ . 1 . 2 . ]" 1
1922 2 27 SER QB 2 28 LEU QD . . 5.040 4.224 4.087 4.307 . 0 0 "[ . 1 . 2 . ]" 1
1923 2 27 SER QB 2 30 ASP HB2 . . 4.960 4.274 3.892 5.011 0.051 12 0 "[ . 1 . 2 . ]" 1
1924 2 27 SER QB 2 28 LEU H . . 5.040 2.650 2.458 2.841 . 0 0 "[ . 1 . 2 . ]" 1
1925 2 27 SER QB 2 30 ASP HB3 . . 5.270 4.528 3.744 5.051 . 0 0 "[ . 1 . 2 . ]" 1
1926 2 27 SER QB 2 31 GLU QG . . 5.410 3.907 3.554 5.245 . 0 0 "[ . 1 . 2 . ]" 1
1927 2 27 SER H 2 27 SER QB . . 3.340 2.137 2.063 2.255 . 0 0 "[ . 1 . 2 . ]" 1
1928 2 27 SER H 2 28 LEU HA . . 4.910 5.011 4.985 5.062 0.152 24 0 "[ . 1 . 2 . ]" 1
1929 2 27 SER H 2 28 LEU HB3 . . 5.730 5.729 5.672 5.861 0.131 24 0 "[ . 1 . 2 . ]" 1
1930 2 27 SER H 2 28 LEU HB2 . . 4.930 4.210 4.156 4.343 . 0 0 "[ . 1 . 2 . ]" 1
1931 2 27 SER H 2 28 LEU HG . . 5.040 5.116 4.853 5.187 0.147 2 0 "[ . 1 . 2 . ]" 1
1932 2 27 SER H 2 28 LEU H . . 3.850 2.459 2.433 2.510 . 0 0 "[ . 1 . 2 . ]" 1
1933 2 27 SER H 2 28 LEU QD . . 5.270 4.674 4.495 4.825 . 0 0 "[ . 1 . 2 . ]" 1
1934 2 27 SER H 2 29 LEU H . . 5.340 4.237 4.007 4.305 . 0 0 "[ . 1 . 2 . ]" 1
1935 2 27 SER H 2 30 ASP HB2 . . 5.500 4.981 4.477 5.680 0.180 1 0 "[ . 1 . 2 . ]" 1
1936 2 27 SER H 2 30 ASP H . . 5.500 4.676 4.535 4.809 . 0 0 "[ . 1 . 2 . ]" 1
1937 2 28 LEU HA 2 28 LEU QD . . 3.830 2.337 2.103 2.496 . 0 0 "[ . 1 . 2 . ]" 1
1938 2 28 LEU HA 2 30 ASP H . . 5.500 4.343 4.124 4.453 . 0 0 "[ . 1 . 2 . ]" 1
1939 2 28 LEU HA 2 31 GLU HA . . 5.360 5.144 4.858 5.508 0.148 7 0 "[ . 1 . 2 . ]" 1
1940 2 28 LEU HA 2 31 GLU QB . . 4.420 2.308 1.974 2.998 . 0 0 "[ . 1 . 2 . ]" 1
1941 2 28 LEU HA 2 31 GLU QG . . 5.080 3.608 2.296 4.036 . 0 0 "[ . 1 . 2 . ]" 1
1942 2 28 LEU HA 2 31 GLU H . . 4.470 3.204 3.067 3.364 . 0 0 "[ . 1 . 2 . ]" 1
1943 2 28 LEU HA 2 32 GLY H . . 5.470 4.049 3.740 4.280 . 0 0 "[ . 1 . 2 . ]" 1
1944 2 28 LEU HB3 2 29 LEU H . . 4.790 3.086 2.967 3.300 . 0 0 "[ . 1 . 2 . ]" 1
1945 2 28 LEU HB3 2 30 ASP H . . 5.180 5.239 5.056 5.388 0.208 18 0 "[ . 1 . 2 . ]" 1
1946 2 28 LEU H 2 28 LEU HG . . 4.750 2.923 2.763 3.108 . 0 0 "[ . 1 . 2 . ]" 1
1947 2 28 LEU H 2 28 LEU QD . . 5.060 3.214 3.083 3.313 . 0 0 "[ . 1 . 2 . ]" 1
1948 2 28 LEU H 2 29 LEU H . . 4.300 2.960 2.727 3.053 . 0 0 "[ . 1 . 2 . ]" 1
1949 2 28 LEU QD 2 29 LEU H . . 5.360 4.052 3.987 4.194 . 0 0 "[ . 1 . 2 . ]" 1
1950 2 28 LEU QD 2 31 GLU QB . . 4.470 3.298 2.950 4.003 . 0 0 "[ . 1 . 2 . ]" 1
1951 2 28 LEU QD 2 31 GLU QG . . 5.100 4.154 2.771 4.562 . 0 0 "[ . 1 . 2 . ]" 1
1952 2 28 LEU QD 2 31 GLU H . . 5.500 4.647 4.446 4.977 . 0 0 "[ . 1 . 2 . ]" 1
1953 2 28 LEU QD 2 29 LEU QD . . 4.450 4.096 3.941 4.400 . 0 0 "[ . 1 . 2 . ]" 1
1954 2 29 LEU HA 2 29 LEU QD . . 3.790 2.253 1.912 2.890 . 0 0 "[ . 1 . 2 . ]" 1
1955 2 29 LEU HA 2 30 ASP HA . . 4.900 4.742 4.716 4.769 . 0 0 "[ . 1 . 2 . ]" 1
1956 2 29 LEU HA 2 31 GLU H . . 4.780 4.064 3.948 4.666 . 0 0 "[ . 1 . 2 . ]" 1
1957 2 29 LEU HA 2 32 GLY H . . 4.920 3.242 3.048 3.431 . 0 0 "[ . 1 . 2 . ]" 1
1958 2 29 LEU HA 2 33 LYS H . . 5.400 3.689 3.473 3.848 . 0 0 "[ . 1 . 2 . ]" 1
1959 2 29 LEU HA 2 58 TRP HH2 . . 4.810 4.024 3.774 4.460 . 0 0 "[ . 1 . 2 . ]" 1
1960 2 29 LEU HA 2 58 TRP HZ2 . . 3.760 2.183 1.874 2.571 . 0 0 "[ . 1 . 2 . ]" 1
1961 2 29 LEU HA 2 62 ALA MB . . 5.190 4.829 4.429 5.263 0.073 26 0 "[ . 1 . 2 . ]" 1
1962 2 29 LEU HB3 2 58 TRP HZ2 . . 5.500 4.311 3.725 4.832 . 0 0 "[ . 1 . 2 . ]" 1
1963 2 29 LEU HB3 2 62 ALA MB . . 4.900 3.828 3.471 3.956 . 0 0 "[ . 1 . 2 . ]" 1
1964 2 29 LEU HB2 2 30 ASP H . . 4.630 3.168 3.094 3.278 . 0 0 "[ . 1 . 2 . ]" 1
1965 2 29 LEU HB2 2 58 TRP HE1 . . 5.500 5.138 4.775 5.501 0.001 8 0 "[ . 1 . 2 . ]" 1
1966 2 29 LEU HB2 2 58 TRP HZ2 . . 5.450 4.853 4.346 5.311 . 0 0 "[ . 1 . 2 . ]" 1
1967 2 29 LEU HB2 2 62 ALA MB . . 4.800 4.417 3.979 4.557 . 0 0 "[ . 1 . 2 . ]" 1
1968 2 29 LEU HG 2 30 ASP H . . 5.090 5.176 5.060 5.321 0.231 22 0 "[ . 1 . 2 . ]" 1
1969 2 29 LEU HG 2 58 TRP HZ2 . . 5.500 4.193 2.207 5.329 . 0 0 "[ . 1 . 2 . ]" 1
1970 2 29 LEU HG 2 62 ALA MB . . 5.130 2.913 1.939 3.890 . 0 0 "[ . 1 . 2 . ]" 1
1971 2 29 LEU H 2 29 LEU HG . . 4.010 3.931 3.563 4.126 0.116 18 0 "[ . 1 . 2 . ]" 1
1972 2 29 LEU H 2 29 LEU QD . . 4.640 2.695 2.406 3.060 . 0 0 "[ . 1 . 2 . ]" 1
1973 2 29 LEU H 2 30 ASP H . . 4.150 2.739 2.544 2.835 . 0 0 "[ . 1 . 2 . ]" 1
1974 2 29 LEU H 2 31 GLU H . . 5.500 3.961 3.861 4.291 . 0 0 "[ . 1 . 2 . ]" 1
1975 2 29 LEU QD 2 30 ASP H . . 4.860 4.094 3.979 4.309 . 0 0 "[ . 1 . 2 . ]" 1
1976 2 29 LEU QD 2 32 GLY QA . . 5.020 4.292 3.910 4.741 . 0 0 "[ . 1 . 2 . ]" 1
1977 2 29 LEU QD 2 33 LYS HB2 . . 4.030 3.446 3.207 3.770 . 0 0 "[ . 1 . 2 . ]" 1
1978 2 29 LEU QD 2 33 LYS HD2 . . 4.540 3.691 3.440 3.860 . 0 0 "[ . 1 . 2 . ]" 1
1979 2 29 LEU QD 2 33 LYS QG . . 4.390 4.527 4.453 4.626 0.236 22 0 "[ . 1 . 2 . ]" 1
1980 2 29 LEU QD 2 58 TRP HZ2 . . 3.700 2.583 2.316 2.888 . 0 0 "[ . 1 . 2 . ]" 1
1981 2 29 LEU QD 2 62 ALA HA . . 3.800 2.681 2.392 2.914 . 0 0 "[ . 1 . 2 . ]" 1
1982 2 29 LEU QD 2 62 ALA MB . . 3.450 1.603 1.581 1.648 . 0 0 "[ . 1 . 2 . ]" 1
1983 2 29 LEU QD 2 63 THR HB . . 5.500 5.296 5.181 5.406 . 0 0 "[ . 1 . 2 . ]" 1
1984 2 29 LEU QD 2 63 THR H . . 5.500 3.909 3.831 3.975 . 0 0 "[ . 1 . 2 . ]" 1
1985 2 29 LEU QD 2 63 THR MG . . 5.000 4.826 4.723 4.926 . 0 0 "[ . 1 . 2 . ]" 1
1986 2 29 LEU QD 2 58 TRP HE1 . . 5.500 1.934 1.876 2.049 . 0 0 "[ . 1 . 2 . ]" 1
1987 2 29 LEU QD 2 58 TRP HH2 . . 4.430 3.589 3.158 3.927 . 0 0 "[ . 1 . 2 . ]" 1
1988 2 29 LEU QD 2 58 TRP HZ3 . . 5.460 4.370 4.056 4.544 . 0 0 "[ . 1 . 2 . ]" 1
1989 2 29 LEU QD 2 62 ALA H . . 5.500 3.886 3.749 4.025 . 0 0 "[ . 1 . 2 . ]" 1
1990 2 30 ASP HA 2 31 GLU HA . . 5.430 4.738 4.714 4.791 . 0 0 "[ . 1 . 2 . ]" 1
1991 2 30 ASP HA 2 33 LYS HA . . 5.180 5.292 5.201 5.445 0.265 25 0 "[ . 1 . 2 . ]" 1
1992 2 30 ASP HA 2 33 LYS HB3 . . 4.120 2.854 2.638 3.130 . 0 0 "[ . 1 . 2 . ]" 1
1993 2 30 ASP HA 2 33 LYS HB2 . . 4.460 2.988 2.861 3.104 . 0 0 "[ . 1 . 2 . ]" 1
1994 2 30 ASP HA 2 33 LYS HD3 . . 5.430 5.497 5.424 5.580 0.150 23 0 "[ . 1 . 2 . ]" 1
1995 2 30 ASP HA 2 33 LYS HD2 . . 5.330 5.471 5.371 5.573 0.243 14 0 "[ . 1 . 2 . ]" 1
1996 2 30 ASP HA 2 33 LYS QG . . 4.900 4.071 3.914 4.296 . 0 0 "[ . 1 . 2 . ]" 1
1997 2 30 ASP HB2 2 31 GLU HA . . 5.500 5.029 4.612 5.560 0.060 1 0 "[ . 1 . 2 . ]" 1
1998 2 30 ASP HB2 2 31 GLU H . . 4.120 3.384 2.836 4.071 . 0 0 "[ . 1 . 2 . ]" 1
1999 2 30 ASP HB3 2 31 GLU HA . . 5.460 3.990 3.722 4.235 . 0 0 "[ . 1 . 2 . ]" 1
2000 2 30 ASP HB3 2 31 GLU H . . 4.230 3.176 2.332 3.614 . 0 0 "[ . 1 . 2 . ]" 1
2001 2 30 ASP H 2 30 ASP HB2 . . 3.760 2.182 2.004 2.507 . 0 0 "[ . 1 . 2 . ]" 1
2002 2 30 ASP H 2 30 ASP HB3 . . 3.940 3.067 2.409 3.443 . 0 0 "[ . 1 . 2 . ]" 1
2003 2 30 ASP H 2 31 GLU HA . . 5.500 5.098 5.043 5.186 . 0 0 "[ . 1 . 2 . ]" 1
2004 2 30 ASP H 2 31 GLU QB . . 4.190 4.287 4.184 4.458 0.268 22 0 "[ . 1 . 2 . ]" 1
2005 2 30 ASP H 2 31 GLU QG . . 5.500 5.113 4.673 5.359 . 0 0 "[ . 1 . 2 . ]" 1
2006 2 30 ASP H 2 31 GLU H . . 3.840 2.568 2.516 2.669 . 0 0 "[ . 1 . 2 . ]" 1
2007 2 30 ASP H 2 32 GLY H . . 5.500 4.198 3.842 4.413 . 0 0 "[ . 1 . 2 . ]" 1
2008 2 30 ASP H 2 33 LYS H . . 5.500 4.563 4.425 4.620 . 0 0 "[ . 1 . 2 . ]" 1
2009 2 31 GLU HA 2 32 GLY QA . . 5.500 4.479 4.461 4.494 . 0 0 "[ . 1 . 2 . ]" 1
2010 2 31 GLU HA 2 34 GLN QB . . 4.660 3.346 3.057 3.799 . 0 0 "[ . 1 . 2 . ]" 1
2011 2 31 GLU HA 2 34 GLN QG . . 4.950 3.276 2.490 4.933 . 0 0 "[ . 1 . 2 . ]" 1
2012 2 31 GLU QB 2 32 GLY H . . 4.460 2.750 2.589 3.454 . 0 0 "[ . 1 . 2 . ]" 1
2013 2 31 GLU H 2 31 GLU QB . . 3.730 2.067 2.002 2.177 . 0 0 "[ . 1 . 2 . ]" 1
2014 2 31 GLU H 2 31 GLU QG . . 4.070 3.193 2.818 3.420 . 0 0 "[ . 1 . 2 . ]" 1
2015 2 31 GLU H 2 32 GLY QA . . 5.500 4.394 4.323 4.509 . 0 0 "[ . 1 . 2 . ]" 1
2016 2 31 GLU H 2 32 GLY H . . 4.110 2.526 2.432 2.657 . 0 0 "[ . 1 . 2 . ]" 1
2017 2 31 GLU H 2 33 LYS H . . 5.500 3.847 3.749 4.160 . 0 0 "[ . 1 . 2 . ]" 1
2018 2 31 GLU H 2 34 GLN H . . 5.500 4.883 4.767 5.005 . 0 0 "[ . 1 . 2 . ]" 1
2019 2 32 GLY QA 2 34 GLN QB . . 4.570 4.394 4.327 4.493 . 0 0 "[ . 1 . 2 . ]" 1
2020 2 32 GLY QA 2 35 SER HA . . 5.360 5.024 4.901 5.126 . 0 0 "[ . 1 . 2 . ]" 1
2021 2 32 GLY QA 2 35 SER QB . . 4.460 2.447 2.304 2.585 . 0 0 "[ . 1 . 2 . ]" 1
2022 2 32 GLY QA 2 58 TRP HH2 . . 5.460 3.147 2.376 3.787 . 0 0 "[ . 1 . 2 . ]" 1
2023 2 32 GLY QA 2 58 TRP HZ2 . . 5.200 2.544 2.232 2.972 . 0 0 "[ . 1 . 2 . ]" 1
2024 2 32 GLY QA 2 35 SER H . . 5.050 3.016 2.906 3.169 . 0 0 "[ . 1 . 2 . ]" 1
2025 2 32 GLY H 2 33 LYS HB2 . . 5.500 4.548 4.453 4.670 . 0 0 "[ . 1 . 2 . ]" 1
2026 2 32 GLY H 2 33 LYS H . . 4.350 2.541 2.471 2.610 . 0 0 "[ . 1 . 2 . ]" 1
2027 2 32 GLY H 2 34 GLN H . . 5.500 4.068 3.939 4.147 . 0 0 "[ . 1 . 2 . ]" 1
2028 2 32 GLY H 2 35 SER H . . 5.500 4.893 4.806 4.969 . 0 0 "[ . 1 . 2 . ]" 1
2029 2 32 GLY H 2 58 TRP HZ2 . . 5.050 3.352 2.875 3.775 . 0 0 "[ . 1 . 2 . ]" 1
2030 2 33 LYS HA 2 33 LYS HD3 . . 4.750 3.501 3.453 3.553 . 0 0 "[ . 1 . 2 . ]" 1
2031 2 33 LYS HA 2 33 LYS HD2 . . 4.890 1.926 1.859 1.986 . 0 0 "[ . 1 . 2 . ]" 1
2032 2 33 LYS HA 2 33 LYS HE2 . . 4.750 3.935 3.319 4.342 . 0 0 "[ . 1 . 2 . ]" 1
2033 2 33 LYS HA 2 33 LYS HE3 . . 5.260 2.966 2.755 3.238 . 0 0 "[ . 1 . 2 . ]" 1
2034 2 33 LYS HA 2 33 LYS QG . . 3.900 2.702 2.648 2.781 . 0 0 "[ . 1 . 2 . ]" 1
2035 2 33 LYS HA 2 35 SER H . . 5.500 3.947 3.689 4.253 . 0 0 "[ . 1 . 2 . ]" 1
2036 2 33 LYS HA 2 36 LEU HA . . 5.500 4.865 4.763 4.953 . 0 0 "[ . 1 . 2 . ]" 1
2037 2 33 LYS HA 2 36 LEU HB2 . . 4.540 2.244 2.110 2.413 . 0 0 "[ . 1 . 2 . ]" 1
2038 2 33 LYS HA 2 36 LEU HB3 . . 4.440 3.792 3.635 3.988 . 0 0 "[ . 1 . 2 . ]" 1
2039 2 33 LYS HA 2 36 LEU HG . . 5.100 3.205 3.105 3.297 . 0 0 "[ . 1 . 2 . ]" 1
2040 2 33 LYS HA 2 36 LEU H . . 4.860 3.096 2.991 3.236 . 0 0 "[ . 1 . 2 . ]" 1
2041 2 33 LYS HA 2 36 LEU QD . . 4.370 2.982 2.822 3.116 . 0 0 "[ . 1 . 2 . ]" 1
2042 2 33 LYS HA 2 37 THR H . . 5.170 4.670 4.528 5.020 . 0 0 "[ . 1 . 2 . ]" 1
2043 2 33 LYS HA 2 55 GLN HE22 . . 5.480 5.186 4.884 5.472 . 0 0 "[ . 1 . 2 . ]" 1
2044 2 33 LYS HA 2 58 TRP HD1 . . 4.690 3.932 3.781 4.131 . 0 0 "[ . 1 . 2 . ]" 1
2045 2 33 LYS HA 2 58 TRP HE1 . . 5.320 3.020 2.888 3.127 . 0 0 "[ . 1 . 2 . ]" 1
2046 2 33 LYS HB3 2 33 LYS HE2 . . 5.350 4.735 4.395 5.143 . 0 0 "[ . 1 . 2 . ]" 1
2047 2 33 LYS HB3 2 33 LYS HE3 . . 5.470 4.716 4.391 5.114 . 0 0 "[ . 1 . 2 . ]" 1
2048 2 33 LYS HB3 2 58 TRP HD1 . . 5.260 5.457 5.360 5.561 0.301 21 0 "[ . 1 . 2 . ]" 1
2049 2 33 LYS HB3 2 58 TRP HE1 . . 4.690 3.979 3.690 4.225 . 0 0 "[ . 1 . 2 . ]" 1
2050 2 33 LYS HB2 2 33 LYS HE2 . . 5.500 4.601 4.412 4.799 . 0 0 "[ . 1 . 2 . ]" 1
2051 2 33 LYS HB2 2 33 LYS HE3 . . 5.250 4.441 4.341 4.555 . 0 0 "[ . 1 . 2 . ]" 1
2052 2 33 LYS HB2 2 34 GLN H . . 4.210 3.902 3.818 3.980 . 0 0 "[ . 1 . 2 . ]" 1
2053 2 33 LYS HB2 2 36 LEU HB2 . . 4.900 4.767 4.650 4.929 0.029 24 0 "[ . 1 . 2 . ]" 1
2054 2 33 LYS HB2 2 36 LEU QD . . 4.950 4.802 4.636 4.904 . 0 0 "[ . 1 . 2 . ]" 1
2055 2 33 LYS HB2 2 58 TRP HD1 . . 5.110 4.107 3.949 4.322 . 0 0 "[ . 1 . 2 . ]" 1
2056 2 33 LYS HB2 2 58 TRP HE1 . . 4.510 2.276 1.952 2.568 . 0 0 "[ . 1 . 2 . ]" 1
2057 2 33 LYS HD3 2 36 LEU QD . . 4.970 4.694 4.574 4.843 . 0 0 "[ . 1 . 2 . ]" 1
2058 2 33 LYS HD3 2 58 TRP HD1 . . 4.070 2.055 1.967 2.197 . 0 0 "[ . 1 . 2 . ]" 1
2059 2 33 LYS HD2 2 34 GLN H . . 5.500 5.209 5.166 5.251 . 0 0 "[ . 1 . 2 . ]" 1
2060 2 33 LYS HD2 2 36 LEU QD . . 4.740 3.571 3.491 3.675 . 0 0 "[ . 1 . 2 . ]" 1
2061 2 33 LYS HD2 2 58 TRP HD1 . . 4.290 2.138 2.034 2.331 . 0 0 "[ . 1 . 2 . ]" 1
2062 2 33 LYS HD2 2 58 TRP HE1 . . 5.500 2.118 1.905 2.320 . 0 0 "[ . 1 . 2 . ]" 1
2063 2 33 LYS HE2 2 36 LEU HB3 . . 4.930 3.961 3.284 4.310 . 0 0 "[ . 1 . 2 . ]" 1
2064 2 33 LYS HE2 2 37 THR MG . . 5.310 5.042 4.172 5.534 0.224 1 0 "[ . 1 . 2 . ]" 1
2065 2 33 LYS HE2 2 58 TRP HD1 . . 4.910 3.712 3.430 4.000 . 0 0 "[ . 1 . 2 . ]" 1
2066 2 33 LYS HE3 2 36 LEU HB3 . . 4.870 2.636 2.220 2.982 . 0 0 "[ . 1 . 2 . ]" 1
2067 2 33 LYS HE3 2 55 GLN HE22 . . 5.500 2.721 2.186 3.615 . 0 0 "[ . 1 . 2 . ]" 1
2068 2 33 LYS HE3 2 55 GLN HE21 . . 5.500 2.642 1.938 3.369 . 0 0 "[ . 1 . 2 . ]" 1
2069 2 33 LYS HE3 2 58 TRP HD1 . . 4.980 3.426 2.546 4.158 . 0 0 "[ . 1 . 2 . ]" 1
2070 2 33 LYS H 2 33 LYS HB3 . . 3.730 2.731 2.631 2.810 . 0 0 "[ . 1 . 2 . ]" 1
2071 2 33 LYS H 2 33 LYS HB2 . . 3.810 2.220 2.163 2.300 . 0 0 "[ . 1 . 2 . ]" 1
2072 2 33 LYS H 2 33 LYS HD2 . . 5.300 3.792 3.646 3.948 . 0 0 "[ . 1 . 2 . ]" 1
2073 2 33 LYS H 2 33 LYS QG . . 4.330 4.020 4.015 4.025 . 0 0 "[ . 1 . 2 . ]" 1
2074 2 33 LYS H 2 34 GLN HA . . 5.100 5.237 5.190 5.311 0.211 7 0 "[ . 1 . 2 . ]" 1
2075 2 33 LYS H 2 34 GLN H . . 4.030 2.735 2.681 2.824 . 0 0 "[ . 1 . 2 . ]" 1
2076 2 33 LYS H 2 35 SER H . . 5.500 4.041 3.934 4.170 . 0 0 "[ . 1 . 2 . ]" 1
2077 2 33 LYS H 2 58 TRP HD1 . . 5.500 5.480 5.314 5.545 0.045 5 0 "[ . 1 . 2 . ]" 1
2078 2 33 LYS H 2 58 TRP HE1 . . 5.220 3.192 3.005 3.321 . 0 0 "[ . 1 . 2 . ]" 1
2079 2 33 LYS H 2 58 TRP HH2 . . 5.500 5.331 4.687 5.726 0.226 19 0 "[ . 1 . 2 . ]" 1
2080 2 33 LYS H 2 58 TRP HZ2 . . 4.660 3.183 2.633 3.564 . 0 0 "[ . 1 . 2 . ]" 1
2081 2 33 LYS QG 2 34 GLN HA . . 5.250 4.225 4.024 4.346 . 0 0 "[ . 1 . 2 . ]" 1
2082 2 33 LYS QG 2 34 GLN H . . 4.640 4.195 4.064 4.284 . 0 0 "[ . 1 . 2 . ]" 1
2083 2 33 LYS QG 2 35 SER H . . 5.500 5.372 5.156 5.598 0.098 7 0 "[ . 1 . 2 . ]" 1
2084 2 33 LYS QG 2 36 LEU QD . . 5.360 4.523 4.460 4.575 . 0 0 "[ . 1 . 2 . ]" 1
2085 2 33 LYS QG 2 37 THR MG . . 3.910 4.037 3.830 4.192 0.282 17 0 "[ . 1 . 2 . ]" 1
2086 2 33 LYS QG 2 55 GLN HE22 . . 4.900 3.306 2.935 3.561 . 0 0 "[ . 1 . 2 . ]" 1
2087 2 33 LYS QG 2 55 GLN HE21 . . 4.410 4.059 3.665 4.326 . 0 0 "[ . 1 . 2 . ]" 1
2088 2 33 LYS QG 2 58 TRP HD1 . . 4.320 3.915 3.868 3.975 . 0 0 "[ . 1 . 2 . ]" 1
2089 2 33 LYS QG 2 58 TRP HE1 . . 5.360 3.694 3.505 3.830 . 0 0 "[ . 1 . 2 . ]" 1
2090 2 34 GLN HA 2 34 GLN HE21 . . 5.200 4.129 2.628 4.977 . 0 0 "[ . 1 . 2 . ]" 1
2091 2 34 GLN HA 2 34 GLN HE22 . . 5.500 4.889 3.785 5.485 . 0 0 "[ . 1 . 2 . ]" 1
2092 2 34 GLN HA 2 34 GLN QG . . 4.010 2.342 2.131 2.642 . 0 0 "[ . 1 . 2 . ]" 1
2093 2 34 GLN HA 2 37 THR H . . 4.530 3.906 3.669 4.155 . 0 0 "[ . 1 . 2 . ]" 1
2094 2 34 GLN HA 2 37 THR MG . . 4.070 2.575 2.418 2.809 . 0 0 "[ . 1 . 2 . ]" 1
2095 2 34 GLN HA 2 38 LYS H . . 5.500 4.866 4.453 5.217 . 0 0 "[ . 1 . 2 . ]" 1
2096 2 34 GLN HA 2 38 LYS QE . . 5.300 4.914 4.160 5.593 0.293 23 0 "[ . 1 . 2 . ]" 1
2097 2 34 GLN QB 2 35 SER QB . . 4.910 4.064 4.014 4.212 . 0 0 "[ . 1 . 2 . ]" 1
2098 2 34 GLN QB 2 35 SER H . . 3.940 2.986 2.768 3.155 . 0 0 "[ . 1 . 2 . ]" 1
2099 2 34 GLN QB 2 36 LEU H . . 5.500 4.712 4.476 4.896 . 0 0 "[ . 1 . 2 . ]" 1
2100 2 34 GLN QB 2 38 LYS QE . . 4.840 3.451 2.850 4.569 . 0 0 "[ . 1 . 2 . ]" 1
2101 2 34 GLN QG 2 35 SER H . . 5.440 4.285 3.401 4.426 . 0 0 "[ . 1 . 2 . ]" 1
2102 2 34 GLN H 2 34 GLN QB . . 3.310 2.283 2.124 2.549 . 0 0 "[ . 1 . 2 . ]" 1
2103 2 34 GLN H 2 34 GLN QG . . 4.040 2.555 2.018 3.798 . 0 0 "[ . 1 . 2 . ]" 1
2104 2 34 GLN H 2 35 SER H . . 3.990 2.540 2.491 2.606 . 0 0 "[ . 1 . 2 . ]" 1
2105 2 34 GLN H 2 36 LEU H . . 5.500 3.916 3.789 4.084 . 0 0 "[ . 1 . 2 . ]" 1
2106 2 34 GLN H 2 58 TRP HE1 . . 5.500 5.538 5.388 5.707 0.207 25 0 "[ . 1 . 2 . ]" 1
2107 2 35 SER HA 2 37 THR MG . . 4.500 3.815 3.267 4.284 . 0 0 "[ . 1 . 2 . ]" 1
2108 2 35 SER HA 2 38 LYS HB2 . . 4.820 2.358 1.943 4.480 . 0 0 "[ . 1 . 2 . ]" 1
2109 2 35 SER HA 2 38 LYS HB3 . . 4.900 3.758 3.521 4.229 . 0 0 "[ . 1 . 2 . ]" 1
2110 2 35 SER HA 2 38 LYS QG . . 4.920 2.945 1.724 3.688 . 0 0 "[ . 1 . 2 . ]" 1
2111 2 35 SER HA 2 38 LYS QD . . 4.450 3.338 1.837 4.460 0.010 2 0 "[ . 1 . 2 . ]" 1
2112 2 35 SER HA 2 38 LYS QE . . 4.350 2.724 1.890 3.945 . 0 0 "[ . 1 . 2 . ]" 1
2113 2 35 SER HA 2 39 LEU QD . . 5.450 3.078 2.545 3.444 . 0 0 "[ . 1 . 2 . ]" 1
2114 2 35 SER QB 2 36 LEU H . . 4.500 3.027 2.826 3.175 . 0 0 "[ . 1 . 2 . ]" 1
2115 2 35 SER QB 2 39 LEU QD . . 4.010 1.817 1.737 1.964 . 0 0 "[ . 1 . 2 . ]" 1
2116 2 35 SER QB 2 36 LEU HB2 . . 5.480 4.626 4.559 4.679 . 0 0 "[ . 1 . 2 . ]" 1
2117 2 35 SER QB 2 36 LEU QD . . 4.430 3.339 3.218 3.501 . 0 0 "[ . 1 . 2 . ]" 1
2118 2 35 SER H 2 36 LEU H . . 4.240 2.297 2.156 2.467 . 0 0 "[ . 1 . 2 . ]" 1
2119 2 35 SER H 2 37 THR H . . 5.430 4.355 3.986 4.551 . 0 0 "[ . 1 . 2 . ]" 1
2120 2 35 SER H 2 37 THR MG . . 5.500 4.188 3.762 4.430 . 0 0 "[ . 1 . 2 . ]" 1
2121 2 35 SER H 2 38 LYS QG . . 5.500 4.864 4.021 5.327 . 0 0 "[ . 1 . 2 . ]" 1
2122 2 35 SER H 2 38 LYS H . . 5.500 4.718 4.606 5.190 . 0 0 "[ . 1 . 2 . ]" 1
2123 2 35 SER H 2 39 LEU H . . 5.500 5.656 5.567 5.787 0.287 17 0 "[ . 1 . 2 . ]" 1
2124 2 36 LEU HA 2 36 LEU QD . . 4.010 1.913 1.827 2.022 . 0 0 "[ . 1 . 2 . ]" 1
2125 2 36 LEU HA 2 37 THR HA . . 5.500 4.730 4.705 4.766 . 0 0 "[ . 1 . 2 . ]" 1
2126 2 36 LEU HA 2 38 LYS H . . 5.500 4.303 3.914 5.263 . 0 0 "[ . 1 . 2 . ]" 1
2127 2 36 LEU HA 2 39 LEU HA . . 5.330 5.490 5.381 5.554 0.224 3 0 "[ . 1 . 2 . ]" 1
2128 2 36 LEU HA 2 39 LEU HB3 . . 4.550 4.362 3.905 4.503 . 0 0 "[ . 1 . 2 . ]" 1
2129 2 36 LEU HA 2 39 LEU HB2 . . 4.840 2.748 2.555 2.829 . 0 0 "[ . 1 . 2 . ]" 1
2130 2 36 LEU HA 2 39 LEU HG . . 5.260 4.777 4.494 5.340 0.080 21 0 "[ . 1 . 2 . ]" 1
2131 2 36 LEU HA 2 39 LEU H . . 4.390 3.366 3.211 3.686 . 0 0 "[ . 1 . 2 . ]" 1
2132 2 36 LEU HA 2 39 LEU QD . . 4.090 2.974 2.692 3.107 . 0 0 "[ . 1 . 2 . ]" 1
2133 2 36 LEU HA 2 40 ALA HA . . 5.190 5.056 4.749 5.260 0.070 25 0 "[ . 1 . 2 . ]" 1
2134 2 36 LEU HA 2 40 ALA H . . 5.350 4.133 4.024 4.264 . 0 0 "[ . 1 . 2 . ]" 1
2135 2 36 LEU HA 2 40 ALA MB . . 4.660 4.637 4.446 4.751 0.091 11 0 "[ . 1 . 2 . ]" 1
2136 2 36 LEU HA 2 43 TRP HH2 . . 5.500 3.971 3.820 4.168 . 0 0 "[ . 1 . 2 . ]" 1
2137 2 36 LEU HA 2 43 TRP HZ3 . . 5.100 3.741 3.598 3.899 . 0 0 "[ . 1 . 2 . ]" 1
2138 2 36 LEU HA 2 51 TYR QE . . 5.500 3.742 3.577 3.945 . 0 0 "[ . 1 . 2 . ]" 1
2139 2 36 LEU HA 2 54 VAL MG1 . . 5.460 4.720 4.329 4.890 . 0 0 "[ . 1 . 2 . ]" 1
2140 2 36 LEU HA 2 55 GLN HE21 . . 5.500 5.253 4.799 5.505 0.005 4 0 "[ . 1 . 2 . ]" 1
2141 2 36 LEU HB2 2 37 THR H . . 4.170 3.016 2.929 3.198 . 0 0 "[ . 1 . 2 . ]" 1
2142 2 36 LEU HB2 2 39 LEU H . . 5.270 5.428 5.358 5.607 0.337 22 0 "[ . 1 . 2 . ]" 1
2143 2 36 LEU HB2 2 39 LEU QD . . 4.900 4.870 4.676 4.965 0.065 14 0 "[ . 1 . 2 . ]" 1
2144 2 36 LEU HB2 2 51 TYR QE . . 5.010 4.308 4.045 4.498 . 0 0 "[ . 1 . 2 . ]" 1
2145 2 36 LEU HB2 2 58 TRP HD1 . . 5.160 4.842 4.681 5.088 . 0 0 "[ . 1 . 2 . ]" 1
2146 2 36 LEU HB3 2 39 LEU QD . . 5.480 5.251 4.987 5.396 . 0 0 "[ . 1 . 2 . ]" 1
2147 2 36 LEU HB3 2 51 TYR QE . . 4.720 2.642 2.330 2.915 . 0 0 "[ . 1 . 2 . ]" 1
2148 2 36 LEU HB3 2 55 GLN HE22 . . 4.640 3.891 3.493 4.217 . 0 0 "[ . 1 . 2 . ]" 1
2149 2 36 LEU HB3 2 55 GLN HE21 . . 4.520 2.564 2.094 2.888 . 0 0 "[ . 1 . 2 . ]" 1
2150 2 36 LEU HB3 2 58 TRP HD1 . . 5.490 5.295 5.087 5.578 0.088 12 0 "[ . 1 . 2 . ]" 1
2151 2 36 LEU HG 2 51 TYR QE . . 4.580 4.492 4.305 4.620 0.040 27 0 "[ . 1 . 2 . ]" 1
2152 2 36 LEU HG 2 54 VAL MG1 . . 4.820 4.128 3.812 4.314 . 0 0 "[ . 1 . 2 . ]" 1
2153 2 36 LEU HG 2 58 TRP HD1 . . 4.980 3.456 3.305 3.691 . 0 0 "[ . 1 . 2 . ]" 1
2154 2 36 LEU H 2 36 LEU HB2 . . 3.810 2.014 1.990 2.063 . 0 0 "[ . 1 . 2 . ]" 1
2155 2 36 LEU H 2 36 LEU QD . . 4.860 2.592 2.253 2.849 . 0 0 "[ . 1 . 2 . ]" 1
2156 2 36 LEU H 2 37 THR HA . . 5.500 5.361 5.262 5.493 . 0 0 "[ . 1 . 2 . ]" 1
2157 2 36 LEU H 2 37 THR H . . 4.090 2.835 2.709 3.015 . 0 0 "[ . 1 . 2 . ]" 1
2158 2 36 LEU H 2 38 LYS H . . 5.500 3.913 3.677 4.772 . 0 0 "[ . 1 . 2 . ]" 1
2159 2 36 LEU H 2 39 LEU HB2 . . 5.500 4.756 4.372 4.943 . 0 0 "[ . 1 . 2 . ]" 1
2160 2 36 LEU H 2 39 LEU H . . 5.500 4.423 4.293 4.584 . 0 0 "[ . 1 . 2 . ]" 1
2161 2 36 LEU H 2 39 LEU QD . . 5.500 3.713 3.448 3.932 . 0 0 "[ . 1 . 2 . ]" 1
2162 2 36 LEU QD 2 37 THR H . . 5.150 3.991 3.937 4.085 . 0 0 "[ . 1 . 2 . ]" 1
2163 2 36 LEU QD 2 39 LEU HB3 . . 5.500 4.351 4.028 4.525 . 0 0 "[ . 1 . 2 . ]" 1
2164 2 36 LEU QD 2 39 LEU HB2 . . 5.500 3.416 3.243 3.498 . 0 0 "[ . 1 . 2 . ]" 1
2165 2 36 LEU QD 2 39 LEU QD . . 4.220 3.099 2.886 3.288 . 0 0 "[ . 1 . 2 . ]" 1
2166 2 36 LEU QD 2 40 ALA H . . 4.720 4.418 4.331 4.533 . 0 0 "[ . 1 . 2 . ]" 1
2167 2 36 LEU QD 2 40 ALA MB . . 4.980 4.038 3.872 4.144 . 0 0 "[ . 1 . 2 . ]" 1
2168 2 36 LEU QD 2 43 TRP HH2 . . 4.000 2.923 2.732 3.089 . 0 0 "[ . 1 . 2 . ]" 1
2169 2 36 LEU QD 2 43 TRP HZ2 . . 4.720 3.792 3.651 3.987 . 0 0 "[ . 1 . 2 . ]" 1
2170 2 36 LEU QD 2 43 TRP HZ3 . . 4.290 3.479 3.184 3.658 . 0 0 "[ . 1 . 2 . ]" 1
2171 2 36 LEU QD 2 51 TYR QD . . 5.280 3.185 2.983 3.349 . 0 0 "[ . 1 . 2 . ]" 1
2172 2 36 LEU QD 2 51 TYR QE . . 4.330 2.392 2.120 2.575 . 0 0 "[ . 1 . 2 . ]" 1
2173 2 36 LEU QD 2 54 VAL MG1 . . 3.670 1.997 1.735 2.136 . 0 0 "[ . 1 . 2 . ]" 1
2174 2 36 LEU QD 2 55 GLN HA . . 4.520 2.386 2.125 2.616 . 0 0 "[ . 1 . 2 . ]" 1
2175 2 36 LEU QD 2 55 GLN HG2 . . 5.130 2.313 1.999 2.638 . 0 0 "[ . 1 . 2 . ]" 1
2176 2 36 LEU QD 2 58 TRP HA . . 4.740 4.300 4.185 4.363 . 0 0 "[ . 1 . 2 . ]" 1
2177 2 36 LEU QD 2 58 TRP HB3 . . 4.670 3.045 2.789 3.222 . 0 0 "[ . 1 . 2 . ]" 1
2178 2 36 LEU QD 2 58 TRP HD1 . . 4.430 3.924 3.776 4.046 . 0 0 "[ . 1 . 2 . ]" 1
2179 2 36 LEU QD 2 58 TRP HE3 . . 3.990 2.930 2.597 3.187 . 0 0 "[ . 1 . 2 . ]" 1
2180 2 36 LEU QD 2 58 TRP HH2 . . 5.500 4.121 3.830 4.377 . 0 0 "[ . 1 . 2 . ]" 1
2181 2 36 LEU QD 2 58 TRP HZ3 . . 4.920 3.638 3.182 3.964 . 0 0 "[ . 1 . 2 . ]" 1
2182 2 36 LEU QD 2 37 THR HA . . 5.500 4.505 4.334 4.664 . 0 0 "[ . 1 . 2 . ]" 1
2183 2 36 LEU QD 2 39 LEU H . . 5.500 4.284 4.153 4.564 . 0 0 "[ . 1 . 2 . ]" 1
2184 2 36 LEU QD 2 40 ALA HA . . 5.500 4.156 3.953 4.293 . 0 0 "[ . 1 . 2 . ]" 1
2185 2 36 LEU QD 2 55 GLN HB3 . . 4.830 4.526 4.360 4.684 . 0 0 "[ . 1 . 2 . ]" 1
2186 2 36 LEU QD 2 55 GLN HE22 . . 5.440 4.687 4.362 4.936 . 0 0 "[ . 1 . 2 . ]" 1
2187 2 36 LEU QD 2 55 GLN HE21 . . 5.290 3.600 3.124 3.997 . 0 0 "[ . 1 . 2 . ]" 1
2188 2 36 LEU QD 2 55 GLN HG3 . . 5.500 3.615 3.387 3.860 . 0 0 "[ . 1 . 2 . ]" 1
2189 2 36 LEU QD 2 58 TRP HB2 . . 4.320 2.609 2.450 2.733 . 0 0 "[ . 1 . 2 . ]" 1
2190 2 36 LEU QD 2 58 TRP H . . 5.090 4.086 3.906 4.208 . 0 0 "[ . 1 . 2 . ]" 1
2191 2 36 LEU QD 2 59 ASP H . . 5.500 4.889 4.728 5.024 . 0 0 "[ . 1 . 2 . ]" 1
2192 2 37 THR HA 2 37 THR MG . . 3.340 3.196 2.767 3.232 . 0 0 "[ . 1 . 2 . ]" 1
2193 2 37 THR HA 2 40 ALA HA . . 5.500 4.401 4.198 4.528 . 0 0 "[ . 1 . 2 . ]" 1
2194 2 37 THR HA 2 40 ALA MB . . 4.040 1.981 1.921 2.108 . 0 0 "[ . 1 . 2 . ]" 1
2195 2 37 THR HA 2 51 TYR QD . . 5.430 4.563 4.292 4.710 . 0 0 "[ . 1 . 2 . ]" 1
2196 2 37 THR HA 2 51 TYR QE . . 3.890 2.981 2.689 3.289 . 0 0 "[ . 1 . 2 . ]" 1
2197 2 37 THR HB 2 38 LYS QG . . 5.390 4.996 4.587 5.295 . 0 0 "[ . 1 . 2 . ]" 1
2198 2 37 THR HB 2 40 ALA MB . . 5.140 4.002 3.748 4.118 . 0 0 "[ . 1 . 2 . ]" 1
2199 2 37 THR HB 2 51 TYR QE . . 5.400 4.125 3.855 4.443 . 0 0 "[ . 1 . 2 . ]" 1
2200 2 37 THR H 2 37 THR MG . . 3.810 1.818 1.673 1.902 . 0 0 "[ . 1 . 2 . ]" 1
2201 2 37 THR H 2 38 LYS HA . . 4.970 5.139 5.071 5.304 0.334 28 0 "[ . 1 . 2 . ]" 1
2202 2 37 THR H 2 38 LYS HB2 . . 5.250 4.892 4.572 6.197 0.947 28 3 "[ . 1 -. 2 * . +]" 1
2203 2 37 THR H 2 38 LYS QG . . 5.200 4.020 3.451 4.292 . 0 0 "[ . 1 . 2 . ]" 1
2204 2 37 THR H 2 39 LEU HB2 . . 5.420 5.286 4.617 5.525 0.105 8 0 "[ . 1 . 2 . ]" 1
2205 2 37 THR H 2 39 LEU H . . 5.160 3.917 3.462 4.283 . 0 0 "[ . 1 . 2 . ]" 1
2206 2 37 THR H 2 40 ALA MB . . 5.430 4.232 4.095 4.356 . 0 0 "[ . 1 . 2 . ]" 1
2207 2 37 THR H 2 51 TYR QE . . 5.500 4.054 3.800 4.311 . 0 0 "[ . 1 . 2 . ]" 1
2208 2 37 THR H 2 55 GLN HE22 . . 5.500 4.778 4.345 5.318 . 0 0 "[ . 1 . 2 . ]" 1
2209 2 37 THR H 2 55 GLN HE21 . . 5.340 3.844 3.488 4.288 . 0 0 "[ . 1 . 2 . ]" 1
2210 2 37 THR MG 2 38 LYS HA . . 4.760 3.947 3.701 5.111 0.351 24 0 "[ . 1 . 2 . ]" 1
2211 2 37 THR MG 2 38 LYS QG . . 4.270 2.437 1.995 3.585 . 0 0 "[ . 1 . 2 . ]" 1
2212 2 37 THR MG 2 38 LYS H . . 4.770 2.202 1.811 3.263 . 0 0 "[ . 1 . 2 . ]" 1
2213 2 37 THR MG 2 38 LYS QE . . 4.800 4.218 3.752 4.824 0.024 23 0 "[ . 1 . 2 . ]" 1
2214 2 37 THR MG 2 39 LEU H . . 5.500 4.233 3.751 4.795 . 0 0 "[ . 1 . 2 . ]" 1
2215 2 37 THR MG 2 40 ALA H . . 5.460 4.755 4.506 4.894 . 0 0 "[ . 1 . 2 . ]" 1
2216 2 37 THR MG 2 40 ALA MB . . 4.460 4.374 4.014 4.461 0.001 7 0 "[ . 1 . 2 . ]" 1
2217 2 37 THR MG 2 51 TYR QE . . 4.700 4.692 3.763 4.820 0.120 17 0 "[ . 1 . 2 . ]" 1
2218 2 38 LYS HA 2 38 LYS QD . . 4.440 3.867 2.891 4.215 . 0 0 "[ . 1 . 2 . ]" 1
2219 2 38 LYS HA 2 38 LYS QE . . 5.220 4.643 4.243 5.421 0.201 22 0 "[ . 1 . 2 . ]" 1
2220 2 38 LYS HA 2 40 ALA H . . 4.770 3.936 3.799 4.100 . 0 0 "[ . 1 . 2 . ]" 1
2221 2 38 LYS HA 2 40 ALA MB . . 5.240 4.364 4.191 4.493 . 0 0 "[ . 1 . 2 . ]" 1
2222 2 38 LYS HB2 2 38 LYS QE . . 4.800 2.880 1.941 4.025 . 0 0 "[ . 1 . 2 . ]" 1
2223 2 38 LYS HB3 2 38 LYS QE . . 4.810 3.045 2.317 4.028 . 0 0 "[ . 1 . 2 . ]" 1
2224 2 38 LYS H 2 38 LYS HB3 . . 4.160 3.455 2.605 3.584 . 0 0 "[ . 1 . 2 . ]" 1
2225 2 38 LYS H 2 38 LYS QG . . 3.970 2.348 1.757 2.662 . 0 0 "[ . 1 . 2 . ]" 1
2226 2 38 LYS H 2 38 LYS QE . . 5.500 4.224 3.498 5.157 . 0 0 "[ . 1 . 2 . ]" 1
2227 2 38 LYS H 2 39 LEU H . . 4.020 2.409 2.255 2.743 . 0 0 "[ . 1 . 2 . ]" 1
2228 2 38 LYS H 2 39 LEU QD . . 5.500 3.918 3.255 4.792 . 0 0 "[ . 1 . 2 . ]" 1
2229 2 38 LYS H 2 40 ALA H . . 5.140 3.586 3.414 3.935 . 0 0 "[ . 1 . 2 . ]" 1
2230 2 38 LYS H 2 40 ALA MB . . 5.280 4.286 4.079 4.581 . 0 0 "[ . 1 . 2 . ]" 1
2231 2 39 LEU HA 2 39 LEU QD . . 3.650 2.033 1.817 2.382 . 0 0 "[ . 1 . 2 . ]" 1
2232 2 39 LEU HA 2 41 ALA H . . 5.500 3.688 3.389 3.875 . 0 0 "[ . 1 . 2 . ]" 1
2233 2 39 LEU HA 2 41 ALA MB . . 4.720 4.030 3.870 4.139 . 0 0 "[ . 1 . 2 . ]" 1
2234 2 39 LEU HA 2 42 ALA H . . 5.500 3.089 2.920 3.236 . 0 0 "[ . 1 . 2 . ]" 1
2235 2 39 LEU HA 2 42 ALA MB . . 5.500 2.821 2.526 3.088 . 0 0 "[ . 1 . 2 . ]" 1
2236 2 39 LEU HA 2 43 TRP HZ3 . . 5.500 3.700 3.622 3.889 . 0 0 "[ . 1 . 2 . ]" 1
2237 2 39 LEU HB3 2 42 ALA MB . . 4.660 2.769 2.502 3.053 . 0 0 "[ . 1 . 2 . ]" 1
2238 2 39 LEU HB3 2 43 TRP HZ3 . . 5.100 2.027 1.913 2.351 . 0 0 "[ . 1 . 2 . ]" 1
2239 2 39 LEU HB2 2 40 ALA H . . 4.700 3.399 3.235 3.590 . 0 0 "[ . 1 . 2 . ]" 1
2240 2 39 LEU HB2 2 43 TRP HH2 . . 5.500 3.390 3.058 3.815 . 0 0 "[ . 1 . 2 . ]" 1
2241 2 39 LEU HB2 2 43 TRP HZ3 . . 5.160 2.233 2.002 2.658 . 0 0 "[ . 1 . 2 . ]" 1
2242 2 39 LEU HG 2 40 ALA H . . 5.480 5.212 4.607 5.743 0.263 9 0 "[ . 1 . 2 . ]" 1
2243 2 39 LEU HG 2 42 ALA MB . . 5.240 4.423 3.827 5.039 . 0 0 "[ . 1 . 2 . ]" 1
2244 2 39 LEU H 2 39 LEU HB2 . . 3.940 2.347 2.257 2.457 . 0 0 "[ . 1 . 2 . ]" 1
2245 2 39 LEU H 2 39 LEU HG . . 4.100 3.563 2.752 4.346 0.246 21 0 "[ . 1 . 2 . ]" 1
2246 2 39 LEU H 2 39 LEU QD . . 4.160 2.786 2.107 3.371 . 0 0 "[ . 1 . 2 . ]" 1
2247 2 39 LEU H 2 40 ALA H . . 3.670 2.209 2.057 2.463 . 0 0 "[ . 1 . 2 . ]" 1
2248 2 39 LEU QD 2 42 ALA MB . . 4.200 2.857 2.432 3.163 . 0 0 "[ . 1 . 2 . ]" 1
2249 2 39 LEU QD 2 43 TRP HH2 . . 5.180 3.832 3.308 4.276 . 0 0 "[ . 1 . 2 . ]" 1
2250 2 39 LEU QD 2 43 TRP HZ3 . . 4.940 3.525 3.255 3.774 . 0 0 "[ . 1 . 2 . ]" 1
2251 2 39 LEU QD 2 40 ALA H . . 5.010 4.119 3.793 4.454 . 0 0 "[ . 1 . 2 . ]" 1
2252 2 39 LEU QD 2 40 ALA MB . . 5.720 4.973 4.721 5.238 . 0 0 "[ . 1 . 2 . ]" 1
2253 2 40 ALA HA 2 42 ALA MB . . 5.390 4.326 4.180 4.475 . 0 0 "[ . 1 . 2 . ]" 1
2254 2 40 ALA HA 2 43 TRP HB3 . . 5.430 4.885 4.604 5.409 . 0 0 "[ . 1 . 2 . ]" 1
2255 2 40 ALA HA 2 43 TRP HB2 . . 4.980 3.207 2.924 3.712 . 0 0 "[ . 1 . 2 . ]" 1
2256 2 40 ALA HA 2 43 TRP HE3 . . 3.660 2.004 1.828 2.444 . 0 0 "[ . 1 . 2 . ]" 1
2257 2 40 ALA HA 2 43 TRP HZ3 . . 4.430 3.149 2.994 3.375 . 0 0 "[ . 1 . 2 . ]" 1
2258 2 40 ALA HA 2 46 SER HA . . 5.280 4.220 3.882 4.507 . 0 0 "[ . 1 . 2 . ]" 1
2259 2 40 ALA HA 2 46 SER QB . . 5.150 4.741 4.374 5.035 . 0 0 "[ . 1 . 2 . ]" 1
2260 2 40 ALA HA 2 51 TYR HB2 . . 5.500 2.922 2.579 3.193 . 0 0 "[ . 1 . 2 . ]" 1
2261 2 40 ALA HA 2 51 TYR QD . . 3.850 2.303 2.004 2.695 . 0 0 "[ . 1 . 2 . ]" 1
2262 2 40 ALA HA 2 51 TYR QE . . 3.750 3.527 3.269 3.780 0.030 21 0 "[ . 1 . 2 . ]" 1
2263 2 40 ALA H 2 40 ALA MB . . 3.210 2.098 1.949 2.167 . 0 0 "[ . 1 . 2 . ]" 1
2264 2 40 ALA H 2 41 ALA H . . 4.300 2.874 2.826 2.942 . 0 0 "[ . 1 . 2 . ]" 1
2265 2 40 ALA H 2 41 ALA MB . . 4.620 4.381 4.331 4.487 . 0 0 "[ . 1 . 2 . ]" 1
2266 2 40 ALA H 2 42 ALA H . . 5.500 4.093 4.040 4.174 . 0 0 "[ . 1 . 2 . ]" 1
2267 2 40 ALA H 2 43 TRP HE3 . . 4.900 3.930 3.798 4.384 . 0 0 "[ . 1 . 2 . ]" 1
2268 2 40 ALA H 2 43 TRP HZ3 . . 5.160 3.546 3.248 3.957 . 0 0 "[ . 1 . 2 . ]" 1
2269 2 40 ALA H 2 51 TYR QE . . 4.910 3.912 3.633 4.178 . 0 0 "[ . 1 . 2 . ]" 1
2270 2 40 ALA MB 2 41 ALA HA . . 4.190 3.809 3.687 3.900 . 0 0 "[ . 1 . 2 . ]" 1
2271 2 40 ALA MB 2 41 ALA H . . 4.000 2.621 2.463 2.807 . 0 0 "[ . 1 . 2 . ]" 1
2272 2 40 ALA MB 2 41 ALA MB . . 3.690 3.743 3.646 3.828 0.138 7 0 "[ . 1 . 2 . ]" 1
2273 2 40 ALA MB 2 42 ALA H . . 4.270 4.337 4.265 4.428 0.158 7 0 "[ . 1 . 2 . ]" 1
2274 2 40 ALA MB 2 42 ALA MB . . 5.030 5.008 4.909 5.134 0.104 7 0 "[ . 1 . 2 . ]" 1
2275 2 40 ALA MB 2 43 TRP HB2 . . 4.850 4.012 3.812 4.402 . 0 0 "[ . 1 . 2 . ]" 1
2276 2 40 ALA MB 2 43 TRP HE3 . . 4.150 3.711 3.588 3.992 . 0 0 "[ . 1 . 2 . ]" 1
2277 2 40 ALA MB 2 43 TRP H . . 5.170 4.334 4.220 4.543 . 0 0 "[ . 1 . 2 . ]" 1
2278 2 40 ALA MB 2 43 TRP HZ3 . . 4.950 4.330 4.150 4.562 . 0 0 "[ . 1 . 2 . ]" 1
2279 2 40 ALA MB 2 44 GLY H . . 5.500 4.983 4.494 5.598 0.098 14 0 "[ . 1 . 2 . ]" 1
2280 2 40 ALA MB 2 45 GLY H . . 4.700 4.295 3.873 4.848 0.148 21 0 "[ . 1 . 2 . ]" 1
2281 2 40 ALA MB 2 46 SER HA . . 3.940 1.909 1.773 2.126 . 0 0 "[ . 1 . 2 . ]" 1
2282 2 40 ALA MB 2 46 SER QB . . 3.990 1.991 1.817 2.242 . 0 0 "[ . 1 . 2 . ]" 1
2283 2 40 ALA MB 2 51 TYR HB2 . . 5.080 2.926 2.622 3.129 . 0 0 "[ . 1 . 2 . ]" 1
2284 2 40 ALA MB 2 51 TYR QD . . 3.760 2.611 2.526 2.688 . 0 0 "[ . 1 . 2 . ]" 1
2285 2 40 ALA MB 2 51 TYR QE . . 3.390 2.557 2.325 2.788 . 0 0 "[ . 1 . 2 . ]" 1
2286 2 41 ALA HA 2 42 ALA MB . . 5.150 4.968 4.955 4.984 . 0 0 "[ . 1 . 2 . ]" 1
2287 2 41 ALA HA 2 43 TRP H . . 4.710 3.701 3.377 4.332 . 0 0 "[ . 1 . 2 . ]" 1
2288 2 41 ALA HA 2 45 GLY HA2 . . 4.540 3.664 3.253 4.175 . 0 0 "[ . 1 . 2 . ]" 1
2289 2 41 ALA HA 2 45 GLY HA3 . . 4.310 2.286 1.796 2.928 . 0 0 "[ . 1 . 2 . ]" 1
2290 2 41 ALA HA 2 45 GLY H . . 3.850 2.033 1.643 3.023 . 0 0 "[ . 1 . 2 . ]" 1
2291 2 41 ALA HA 2 46 SER HA . . 4.770 4.788 4.149 4.959 0.189 26 0 "[ . 1 . 2 . ]" 1
2292 2 41 ALA H 2 41 ALA MB . . 3.370 1.993 1.940 2.162 . 0 0 "[ . 1 . 2 . ]" 1
2293 2 41 ALA H 2 42 ALA H . . 4.440 2.673 2.567 2.753 . 0 0 "[ . 1 . 2 . ]" 1
2294 2 41 ALA H 2 42 ALA MB . . 5.450 4.224 4.101 4.299 . 0 0 "[ . 1 . 2 . ]" 1
2295 2 41 ALA H 2 43 TRP HE3 . . 5.500 4.193 4.038 4.365 . 0 0 "[ . 1 . 2 . ]" 1
2296 2 41 ALA H 2 43 TRP H . . 5.500 4.118 3.969 4.408 . 0 0 "[ . 1 . 2 . ]" 1
2297 2 41 ALA H 2 45 GLY H . . 5.500 4.373 3.921 5.137 . 0 0 "[ . 1 . 2 . ]" 1
2298 2 41 ALA MB 2 42 ALA H . . 3.940 2.883 2.787 2.944 . 0 0 "[ . 1 . 2 . ]" 1
2299 2 41 ALA MB 2 42 ALA MB . . 4.950 3.898 3.829 3.989 . 0 0 "[ . 1 . 2 . ]" 1
2300 2 41 ALA MB 2 43 TRP H . . 5.200 4.346 4.165 4.730 . 0 0 "[ . 1 . 2 . ]" 1
2301 2 41 ALA MB 2 44 GLY HA3 . . 4.750 4.823 4.668 4.975 0.225 2 0 "[ . 1 . 2 . ]" 1
2302 2 41 ALA MB 2 44 GLY H . . 5.090 4.093 3.820 4.362 . 0 0 "[ . 1 . 2 . ]" 1
2303 2 41 ALA MB 2 45 GLY HA2 . . 5.170 4.552 3.336 5.040 . 0 0 "[ . 1 . 2 . ]" 1
2304 2 41 ALA MB 2 45 GLY HA3 . . 4.920 3.123 1.952 3.648 . 0 0 "[ . 1 . 2 . ]" 1
2305 2 41 ALA MB 2 45 GLY H . . 4.680 3.646 3.119 4.597 . 0 0 "[ . 1 . 2 . ]" 1
2306 2 42 ALA H 2 42 ALA MB . . 3.450 2.048 2.003 2.129 . 0 0 "[ . 1 . 2 . ]" 1
2307 2 42 ALA H 2 43 TRP HE3 . . 4.370 3.079 2.974 3.230 . 0 0 "[ . 1 . 2 . ]" 1
2308 2 42 ALA H 2 43 TRP H . . 3.970 2.647 2.565 2.771 . 0 0 "[ . 1 . 2 . ]" 1
2309 2 42 ALA H 2 43 TRP HZ3 . . 5.500 4.016 3.736 4.169 . 0 0 "[ . 1 . 2 . ]" 1
2310 2 42 ALA H 2 44 GLY H . . 5.140 3.895 3.688 4.117 . 0 0 "[ . 1 . 2 . ]" 1
2311 2 42 ALA H 2 45 GLY H . . 5.500 4.671 3.998 5.764 0.264 2 0 "[ . 1 . 2 . ]" 1
2312 2 42 ALA MB 2 43 TRP HA . . 4.990 3.923 3.754 4.040 . 0 0 "[ . 1 . 2 . ]" 1
2313 2 42 ALA MB 2 43 TRP HB3 . . 5.440 5.331 5.223 5.412 . 0 0 "[ . 1 . 2 . ]" 1
2314 2 42 ALA MB 2 43 TRP HE3 . . 4.190 2.845 2.415 3.066 . 0 0 "[ . 1 . 2 . ]" 1
2315 2 42 ALA MB 2 43 TRP HH2 . . 4.770 4.300 3.737 4.578 . 0 0 "[ . 1 . 2 . ]" 1
2316 2 42 ALA MB 2 43 TRP H . . 4.430 2.936 2.543 3.106 . 0 0 "[ . 1 . 2 . ]" 1
2317 2 42 ALA MB 2 43 TRP HZ2 . . 4.970 5.089 4.680 5.311 0.341 3 0 "[ . 1 . 2 . ]" 1
2318 2 42 ALA MB 2 43 TRP HZ3 . . 4.300 3.103 2.443 3.394 . 0 0 "[ . 1 . 2 . ]" 1
2319 2 42 ALA MB 2 44 GLY H . . 5.280 4.391 4.079 4.724 . 0 0 "[ . 1 . 2 . ]" 1
2320 2 43 TRP HA 2 43 TRP HD1 . . 5.100 3.350 3.261 3.466 . 0 0 "[ . 1 . 2 . ]" 1
2321 2 43 TRP HA 2 50 ALA MB . . 4.110 4.034 3.774 4.220 0.110 10 0 "[ . 1 . 2 . ]" 1
2322 2 43 TRP HA 2 54 VAL MG2 . . 5.220 5.154 5.035 5.266 0.046 8 0 "[ . 1 . 2 . ]" 1
2323 2 43 TRP HB3 2 44 GLY H . . 5.110 3.961 3.583 4.336 . 0 0 "[ . 1 . 2 . ]" 1
2324 2 43 TRP HB3 2 45 GLY H . . 5.430 4.938 4.168 5.810 0.380 27 0 "[ . 1 . 2 . ]" 1
2325 2 43 TRP HB3 2 50 ALA MB . . 3.940 2.236 1.928 2.539 . 0 0 "[ . 1 . 2 . ]" 1
2326 2 43 TRP HB3 2 51 TYR H . . 4.060 2.792 2.556 3.006 . 0 0 "[ . 1 . 2 . ]" 1
2327 2 43 TRP HB2 2 44 GLY H . . 4.980 3.275 2.850 3.878 . 0 0 "[ . 1 . 2 . ]" 1
2328 2 43 TRP HB2 2 45 GLY H . . 5.060 4.052 3.312 4.979 . 0 0 "[ . 1 . 2 . ]" 1
2329 2 43 TRP HB2 2 54 VAL MG2 . . 4.770 4.486 4.116 4.690 . 0 0 "[ . 1 . 2 . ]" 1
2330 2 43 TRP HB2 2 54 VAL MG1 . . 5.160 5.237 5.095 5.360 0.200 26 0 "[ . 1 . 2 . ]" 1
2331 2 43 TRP HD1 2 50 ALA HA . . 4.920 4.749 4.525 4.921 0.001 11 0 "[ . 1 . 2 . ]" 1
2332 2 43 TRP HD1 2 50 ALA MB . . 3.340 3.037 2.588 3.363 0.023 2 0 "[ . 1 . 2 . ]" 1
2333 2 43 TRP HD1 2 51 TYR H . . 5.500 4.497 4.198 4.826 . 0 0 "[ . 1 . 2 . ]" 1
2334 2 43 TRP HD1 2 54 VAL HB . . 5.500 4.596 4.379 4.862 . 0 0 "[ . 1 . 2 . ]" 1
2335 2 43 TRP HD1 2 54 VAL MG2 . . 3.750 2.542 2.373 2.764 . 0 0 "[ . 1 . 2 . ]" 1
2336 2 43 TRP HD1 2 54 VAL MG1 . . 4.770 4.568 4.396 4.875 0.105 25 0 "[ . 1 . 2 . ]" 1
2337 2 43 TRP HE1 2 54 VAL MG2 . . 4.600 1.843 1.780 1.980 . 0 0 "[ . 1 . 2 . ]" 1
2338 2 43 TRP HE3 2 54 VAL MG2 . . 5.300 5.043 4.731 5.299 . 0 0 "[ . 1 . 2 . ]" 1
2339 2 43 TRP HE3 2 54 VAL MG1 . . 5.170 4.650 4.428 4.829 . 0 0 "[ . 1 . 2 . ]" 1
2340 2 43 TRP HH2 2 54 VAL MG2 . . 5.310 4.926 4.436 5.295 . 0 0 "[ . 1 . 2 . ]" 1
2341 2 43 TRP HH2 2 54 VAL MG1 . . 4.700 3.297 2.895 3.591 . 0 0 "[ . 1 . 2 . ]" 1
2342 2 43 TRP H 2 43 TRP HD1 . . 5.500 5.187 4.974 5.300 . 0 0 "[ . 1 . 2 . ]" 1
2343 2 43 TRP H 2 43 TRP HE3 . . 3.600 2.136 1.869 2.352 . 0 0 "[ . 1 . 2 . ]" 1
2344 2 43 TRP H 2 43 TRP HZ3 . . 5.260 4.411 4.121 4.627 . 0 0 "[ . 1 . 2 . ]" 1
2345 2 43 TRP H 2 44 GLY HA3 . . 5.500 4.667 4.457 4.927 . 0 0 "[ . 1 . 2 . ]" 1
2346 2 43 TRP H 2 50 ALA MB . . 5.500 5.287 5.031 5.511 0.011 27 0 "[ . 1 . 2 . ]" 1
2347 2 43 TRP HZ2 2 54 VAL MG2 . . 4.300 3.132 2.634 3.537 . 0 0 "[ . 1 . 2 . ]" 1
2348 2 43 TRP HZ2 2 54 VAL MG1 . . 4.370 2.339 2.228 2.554 . 0 0 "[ . 1 . 2 . ]" 1
2349 2 43 TRP HZ3 2 54 VAL MG1 . . 5.000 4.277 3.856 4.573 . 0 0 "[ . 1 . 2 . ]" 1
2350 2 44 GLY HA3 2 45 GLY HA2 . . 5.150 4.570 4.341 4.878 . 0 0 "[ . 1 . 2 . ]" 1
2351 2 44 GLY HA3 2 45 GLY HA3 . . 5.430 4.643 4.521 4.882 . 0 0 "[ . 1 . 2 . ]" 1
2352 2 44 GLY HA2 2 48 SER QB . . 4.840 4.092 3.166 4.418 . 0 0 "[ . 1 . 2 . ]" 1
2353 2 44 GLY HA2 2 50 ALA MB . . 5.210 4.364 3.931 4.635 . 0 0 "[ . 1 . 2 . ]" 1
2354 2 44 GLY H 2 45 GLY HA3 . . 5.500 4.278 3.921 4.892 . 0 0 "[ . 1 . 2 . ]" 1
2355 2 44 GLY H 2 45 GLY H . . 3.800 2.192 1.784 2.800 . 0 0 "[ . 1 . 2 . ]" 1
2356 2 44 GLY H 2 50 ALA MB . . 5.500 5.104 4.651 5.418 . 0 0 "[ . 1 . 2 . ]" 1
2357 2 46 SER HA 2 51 TYR HB2 . . 5.100 3.829 3.383 4.227 . 0 0 "[ . 1 . 2 . ]" 1
2358 2 46 SER HA 2 51 TYR HB3 . . 4.820 3.547 2.895 3.900 . 0 0 "[ . 1 . 2 . ]" 1
2359 2 46 SER HA 2 51 TYR QD . . 3.610 2.657 2.117 3.128 . 0 0 "[ . 1 . 2 . ]" 1
2360 2 46 SER HA 2 51 TYR QE . . 3.790 3.384 2.974 3.829 0.039 21 0 "[ . 1 . 2 . ]" 1
2361 2 46 SER QB 2 51 TYR QD . . 4.600 3.858 3.274 4.153 . 0 0 "[ . 1 . 2 . ]" 1
2362 2 46 SER QB 2 51 TYR QE . . 4.220 3.176 2.529 3.697 . 0 0 "[ . 1 . 2 . ]" 1
2363 2 47 GLY HA3 2 52 GLN HE21 . . 4.940 3.197 1.929 4.322 . 0 0 "[ . 1 . 2 . ]" 1
2364 2 47 GLY HA3 2 52 GLN HE22 . . 5.450 4.478 3.406 5.371 . 0 0 "[ . 1 . 2 . ]" 1
2365 2 47 GLY H 2 48 SER H . . 5.470 2.341 1.829 2.927 . 0 0 "[ . 1 . 2 . ]" 1
2366 2 48 SER HA 2 50 ALA MB . . 5.400 4.863 4.596 5.231 . 0 0 "[ . 1 . 2 . ]" 1
2367 2 48 SER QB 2 49 GLU HB3 . . 5.410 4.992 4.397 5.237 . 0 0 "[ . 1 . 2 . ]" 1
2368 2 48 SER QB 2 50 ALA H . . 5.500 2.508 2.208 3.312 . 0 0 "[ . 1 . 2 . ]" 1
2369 2 48 SER QB 2 50 ALA MB . . 4.580 2.566 2.217 3.473 . 0 0 "[ . 1 . 2 . ]" 1
2370 2 48 SER QB 2 51 TYR HB2 . . 4.600 4.232 4.006 4.456 . 0 0 "[ . 1 . 2 . ]" 1
2371 2 48 SER QB 2 51 TYR HB3 . . 4.390 3.322 3.030 3.553 . 0 0 "[ . 1 . 2 . ]" 1
2372 2 48 SER QB 2 51 TYR H . . 4.660 3.061 2.868 3.669 . 0 0 "[ . 1 . 2 . ]" 1
2373 2 48 SER QB 2 51 TYR QD . . 4.820 4.359 3.929 4.554 . 0 0 "[ . 1 . 2 . ]" 1
2374 2 48 SER H 2 49 GLU H . . 5.500 4.606 4.478 4.669 . 0 0 "[ . 1 . 2 . ]" 1
2375 2 48 SER H 2 50 ALA MB . . 5.500 5.125 4.886 5.478 . 0 0 "[ . 1 . 2 . ]" 1
2376 2 48 SER H 2 51 TYR HB3 . . 4.720 3.307 2.628 3.782 . 0 0 "[ . 1 . 2 . ]" 1
2377 2 48 SER H 2 51 TYR H . . 5.480 4.385 4.027 4.731 . 0 0 "[ . 1 . 2 . ]" 1
2378 2 48 SER H 2 51 TYR QD . . 4.980 3.212 2.149 3.658 . 0 0 "[ . 1 . 2 . ]" 1
2379 2 48 SER H 2 51 TYR QE . . 5.500 5.219 4.279 5.588 0.088 8 0 "[ . 1 . 2 . ]" 1
2380 2 48 SER H 2 52 GLN HG2 . . 5.500 4.652 3.812 5.114 . 0 0 "[ . 1 . 2 . ]" 1
2381 2 48 SER H 2 52 GLN H . . 5.500 4.645 4.048 5.123 . 0 0 "[ . 1 . 2 . ]" 1
2382 2 49 GLU HA 2 49 GLU HG2 . . 4.280 3.674 2.617 4.183 . 0 0 "[ . 1 . 2 . ]" 1
2383 2 49 GLU HA 2 49 GLU HG3 . . 3.910 3.508 2.441 4.038 0.128 17 0 "[ . 1 . 2 . ]" 1
2384 2 49 GLU HA 2 52 GLN HA . . 4.840 4.890 4.837 5.071 0.231 26 0 "[ . 1 . 2 . ]" 1
2385 2 49 GLU HA 2 52 GLN HG2 . . 4.590 3.983 3.854 4.196 . 0 0 "[ . 1 . 2 . ]" 1
2386 2 49 GLU HA 2 52 GLN HG3 . . 3.640 2.464 2.296 2.717 . 0 0 "[ . 1 . 2 . ]" 1
2387 2 49 GLU HA 2 52 GLN H . . 4.200 3.373 3.277 3.541 . 0 0 "[ . 1 . 2 . ]" 1
2388 2 49 GLU HA 2 52 GLN QB . . 3.270 2.043 1.954 2.157 . 0 0 "[ . 1 . 2 . ]" 1
2389 2 49 GLU HA 2 53 GLY H . . 5.330 3.950 3.761 4.125 . 0 0 "[ . 1 . 2 . ]" 1
2390 2 49 GLU HB3 2 49 GLU HG3 . . 2.960 2.953 2.583 3.057 0.097 8 0 "[ . 1 . 2 . ]" 1
2391 2 49 GLU HB3 2 50 ALA H . . 4.960 3.718 2.537 4.180 . 0 0 "[ . 1 . 2 . ]" 1
2392 2 49 GLU HB3 2 52 GLN HG3 . . 4.560 4.823 4.571 5.412 0.852 26 8 "[ * . ** * * - *+ ]" 1
2393 2 49 GLU HG3 2 50 ALA H . . 5.500 3.040 1.933 5.191 . 0 0 "[ . 1 . 2 . ]" 1
2394 2 50 ALA HA 2 52 GLN QB . . 4.960 4.776 4.637 4.913 . 0 0 "[ . 1 . 2 . ]" 1
2395 2 50 ALA HA 2 53 GLY H . . 5.000 3.710 3.653 3.762 . 0 0 "[ . 1 . 2 . ]" 1
2396 2 50 ALA HA 2 54 VAL H . . 5.500 4.905 4.815 4.998 . 0 0 "[ . 1 . 2 . ]" 1
2397 2 50 ALA H 2 51 TYR H . . 5.200 3.110 2.918 3.242 . 0 0 "[ . 1 . 2 . ]" 1
2398 2 50 ALA MB 2 51 TYR HB2 . . 5.130 4.007 3.944 4.102 . 0 0 "[ . 1 . 2 . ]" 1
2399 2 50 ALA MB 2 51 TYR HB3 . . 4.190 3.912 3.817 4.041 . 0 0 "[ . 1 . 2 . ]" 1
2400 2 50 ALA MB 2 51 TYR H . . 3.960 2.230 2.161 2.400 . 0 0 "[ . 1 . 2 . ]" 1
2401 2 50 ALA MB 2 51 TYR QD . . 5.060 5.141 5.089 5.218 0.158 12 0 "[ . 1 . 2 . ]" 1
2402 2 50 ALA MB 2 52 GLN H . . 5.230 4.111 4.021 4.180 . 0 0 "[ . 1 . 2 . ]" 1
2403 2 50 ALA MB 2 52 GLN QB . . 5.010 5.092 5.010 5.180 0.170 3 0 "[ . 1 . 2 . ]" 1
2404 2 50 ALA MB 2 53 GLY H . . 5.500 4.749 4.698 4.840 . 0 0 "[ . 1 . 2 . ]" 1
2405 2 50 ALA MB 2 54 VAL HB . . 5.250 5.340 5.270 5.408 0.158 23 0 "[ . 1 . 2 . ]" 1
2406 2 50 ALA MB 2 54 VAL H . . 5.500 5.177 5.095 5.236 . 0 0 "[ . 1 . 2 . ]" 1
2407 2 50 ALA MB 2 54 VAL MG2 . . 4.370 3.962 3.787 4.069 . 0 0 "[ . 1 . 2 . ]" 1
2408 2 51 TYR HB2 2 52 GLN H . . 4.690 4.119 4.039 4.171 . 0 0 "[ . 1 . 2 . ]" 1
2409 2 51 TYR HB2 2 54 VAL HB . . 5.220 4.585 4.501 4.663 . 0 0 "[ . 1 . 2 . ]" 1
2410 2 51 TYR HB2 2 54 VAL H . . 5.500 5.503 5.455 5.538 0.038 12 0 "[ . 1 . 2 . ]" 1
2411 2 51 TYR HB2 2 54 VAL MG2 . . 4.870 4.644 4.560 4.722 . 0 0 "[ . 1 . 2 . ]" 1
2412 2 51 TYR HB3 2 52 GLN H . . 4.180 2.819 2.690 2.903 . 0 0 "[ . 1 . 2 . ]" 1
2413 2 51 TYR HB3 2 53 GLY H . . 5.500 5.424 5.307 5.539 0.039 11 0 "[ . 1 . 2 . ]" 1
2414 2 51 TYR HB3 2 54 VAL HB . . 5.080 5.166 5.094 5.231 0.151 14 0 "[ . 1 . 2 . ]" 1
2415 2 51 TYR H 2 51 TYR HB2 . . 4.160 2.625 2.554 2.658 . 0 0 "[ . 1 . 2 . ]" 1
2416 2 51 TYR H 2 51 TYR HB3 . . 3.850 2.068 2.035 2.136 . 0 0 "[ . 1 . 2 . ]" 1
2417 2 51 TYR H 2 51 TYR QD . . 4.520 3.980 3.943 4.032 . 0 0 "[ . 1 . 2 . ]" 1
2418 2 51 TYR H 2 52 GLN HG2 . . 5.500 5.232 5.038 5.390 . 0 0 "[ . 1 . 2 . ]" 1
2419 2 51 TYR H 2 52 GLN H . . 4.110 2.805 2.689 2.866 . 0 0 "[ . 1 . 2 . ]" 1
2420 2 51 TYR H 2 52 GLN QB . . 5.030 4.709 4.565 4.793 . 0 0 "[ . 1 . 2 . ]" 1
2421 2 51 TYR H 2 54 VAL HB . . 5.500 5.029 4.975 5.093 . 0 0 "[ . 1 . 2 . ]" 1
2422 2 51 TYR H 2 54 VAL H . . 5.500 4.942 4.888 4.988 . 0 0 "[ . 1 . 2 . ]" 1
2423 2 51 TYR H 2 54 VAL MG2 . . 5.500 4.500 4.369 4.579 . 0 0 "[ . 1 . 2 . ]" 1
2424 2 51 TYR QD 2 52 GLN HA . . 4.470 3.748 3.531 3.885 . 0 0 "[ . 1 . 2 . ]" 1
2425 2 51 TYR QD 2 52 GLN HG2 . . 4.640 3.009 2.755 3.214 . 0 0 "[ . 1 . 2 . ]" 1
2426 2 51 TYR QD 2 52 GLN HG3 . . 4.730 3.960 3.818 4.098 . 0 0 "[ . 1 . 2 . ]" 1
2427 2 51 TYR QD 2 52 GLN H . . 4.540 3.454 3.290 3.603 . 0 0 "[ . 1 . 2 . ]" 1
2428 2 51 TYR QD 2 52 GLN QB . . 5.500 4.660 4.510 4.780 . 0 0 "[ . 1 . 2 . ]" 1
2429 2 51 TYR QD 2 54 VAL HB . . 4.640 3.321 3.169 3.495 . 0 0 "[ . 1 . 2 . ]" 1
2430 2 51 TYR QD 2 54 VAL H . . 5.500 4.756 4.642 4.898 . 0 0 "[ . 1 . 2 . ]" 1
2431 2 51 TYR QD 2 54 VAL MG2 . . 4.540 4.240 4.176 4.321 . 0 0 "[ . 1 . 2 . ]" 1
2432 2 51 TYR QD 2 54 VAL MG1 . . 4.330 3.499 3.358 3.583 . 0 0 "[ . 1 . 2 . ]" 1
2433 2 51 TYR QD 2 55 GLN HG3 . . 5.210 3.891 3.671 4.041 . 0 0 "[ . 1 . 2 . ]" 1
2434 2 51 TYR QD 2 55 GLN HG2 . . 5.240 4.222 4.056 4.530 . 0 0 "[ . 1 . 2 . ]" 1
2435 2 51 TYR QD 2 55 GLN H . . 5.500 4.212 4.023 4.463 . 0 0 "[ . 1 . 2 . ]" 1
2436 2 51 TYR QE 2 52 GLN HA . . 4.910 4.345 4.208 4.469 . 0 0 "[ . 1 . 2 . ]" 1
2437 2 51 TYR QE 2 52 GLN HG2 . . 5.410 3.962 3.822 4.102 . 0 0 "[ . 1 . 2 . ]" 1
2438 2 51 TYR QE 2 52 GLN HG3 . . 5.320 5.389 5.313 5.510 0.190 26 0 "[ . 1 . 2 . ]" 1
2439 2 51 TYR QE 2 52 GLN H . . 5.500 5.265 5.174 5.390 . 0 0 "[ . 1 . 2 . ]" 1
2440 2 51 TYR QE 2 54 VAL HB . . 5.440 4.856 4.773 4.949 . 0 0 "[ . 1 . 2 . ]" 1
2441 2 51 TYR QE 2 54 VAL MG2 . . 5.790 5.796 5.749 5.848 0.058 7 0 "[ . 1 . 2 . ]" 1
2442 2 51 TYR QE 2 54 VAL MG1 . . 4.420 4.245 4.121 4.380 . 0 0 "[ . 1 . 2 . ]" 1
2443 2 51 TYR QE 2 55 GLN HA . . 5.360 4.317 4.118 4.531 . 0 0 "[ . 1 . 2 . ]" 1
2444 2 51 TYR QE 2 55 GLN HB3 . . 5.370 5.002 4.898 5.234 . 0 0 "[ . 1 . 2 . ]" 1
2445 2 51 TYR QE 2 55 GLN HB2 . . 5.220 4.306 4.154 4.499 . 0 0 "[ . 1 . 2 . ]" 1
2446 2 51 TYR QE 2 55 GLN HE22 . . 4.920 4.540 4.338 4.799 . 0 0 "[ . 1 . 2 . ]" 1
2447 2 51 TYR QE 2 55 GLN HE21 . . 4.980 3.117 2.879 3.509 . 0 0 "[ . 1 . 2 . ]" 1
2448 2 51 TYR QE 2 55 GLN HG3 . . 4.300 2.792 2.531 3.003 . 0 0 "[ . 1 . 2 . ]" 1
2449 2 51 TYR QE 2 55 GLN HG2 . . 4.560 2.779 2.535 3.183 . 0 0 "[ . 1 . 2 . ]" 1
2450 2 52 GLN HA 2 52 GLN HG2 . . 4.240 2.205 2.129 2.288 . 0 0 "[ . 1 . 2 . ]" 1
2451 2 52 GLN HA 2 52 GLN HG3 . . 4.060 3.473 3.385 3.556 . 0 0 "[ . 1 . 2 . ]" 1
2452 2 52 GLN HA 2 54 VAL MG2 . . 5.500 5.659 5.600 5.702 0.202 27 0 "[ . 1 . 2 . ]" 1
2453 2 52 GLN HA 2 55 GLN HA . . 5.050 5.220 5.185 5.274 0.224 26 0 "[ . 1 . 2 . ]" 1
2454 2 52 GLN HA 2 55 GLN HB3 . . 4.530 4.014 3.886 4.130 . 0 0 "[ . 1 . 2 . ]" 1
2455 2 52 GLN HA 2 55 GLN HB2 . . 4.310 2.486 2.432 2.544 . 0 0 "[ . 1 . 2 . ]" 1
2456 2 52 GLN HA 2 55 GLN HG3 . . 4.720 3.643 3.483 3.845 . 0 0 "[ . 1 . 2 . ]" 1
2457 2 52 GLN HA 2 55 GLN HG2 . . 4.800 4.837 4.771 4.892 0.092 14 0 "[ . 1 . 2 . ]" 1
2458 2 52 GLN HA 2 55 GLN H . . 4.560 3.200 3.137 3.252 . 0 0 "[ . 1 . 2 . ]" 1
2459 2 52 GLN HA 2 56 GLN HE22 . . 5.500 4.776 3.964 5.563 0.063 19 0 "[ . 1 . 2 . ]" 1
2460 2 52 GLN HA 2 56 GLN HE21 . . 5.500 4.923 3.932 5.590 0.090 25 0 "[ . 1 . 2 . ]" 1
2461 2 52 GLN HG2 2 53 GLY H . . 5.500 4.719 4.638 4.788 . 0 0 "[ . 1 . 2 . ]" 1
2462 2 52 GLN HG3 2 53 GLY H . . 5.500 4.604 4.467 4.704 . 0 0 "[ . 1 . 2 . ]" 1
2463 2 52 GLN H 2 52 GLN HG2 . . 4.020 2.831 2.618 3.032 . 0 0 "[ . 1 . 2 . ]" 1
2464 2 52 GLN H 2 52 GLN HG3 . . 4.270 2.873 2.677 3.061 . 0 0 "[ . 1 . 2 . ]" 1
2465 2 52 GLN H 2 52 GLN QB . . 3.550 2.290 2.231 2.358 . 0 0 "[ . 1 . 2 . ]" 1
2466 2 52 GLN H 2 53 GLY HA2 . . 4.930 5.034 4.986 5.066 0.136 26 0 "[ . 1 . 2 . ]" 1
2467 2 52 GLN H 2 54 VAL HB . . 5.260 4.846 4.766 4.892 . 0 0 "[ . 1 . 2 . ]" 1
2468 2 52 GLN H 2 54 VAL H . . 5.500 3.863 3.817 3.900 . 0 0 "[ . 1 . 2 . ]" 1
2469 2 52 GLN H 2 54 VAL MG2 . . 5.500 5.000 4.883 5.085 . 0 0 "[ . 1 . 2 . ]" 1
2470 2 52 GLN QB 2 53 GLY H . . 4.100 2.430 2.391 2.467 . 0 0 "[ . 1 . 2 . ]" 1
2471 2 52 GLN QB 2 54 VAL H . . 5.220 4.319 4.275 4.343 . 0 0 "[ . 1 . 2 . ]" 1
2472 2 52 GLN QB 2 55 GLN H . . 4.890 4.708 4.600 4.782 . 0 0 "[ . 1 . 2 . ]" 1
2473 2 52 GLN QB 2 56 GLN HE22 . . 4.960 3.141 2.496 3.866 . 0 0 "[ . 1 . 2 . ]" 1
2474 2 53 GLY HA2 2 56 GLN HE22 . . 5.500 4.428 4.023 5.177 . 0 0 "[ . 1 . 2 . ]" 1
2475 2 53 GLY HA2 2 56 GLN H . . 4.970 5.015 4.874 5.128 0.158 11 0 "[ . 1 . 2 . ]" 1
2476 2 53 GLY H 2 54 VAL HA . . 5.500 5.253 5.230 5.277 . 0 0 "[ . 1 . 2 . ]" 1
2477 2 53 GLY H 2 54 VAL HB . . 5.500 4.765 4.729 4.798 . 0 0 "[ . 1 . 2 . ]" 1
2478 2 53 GLY H 2 54 VAL H . . 4.000 2.732 2.710 2.759 . 0 0 "[ . 1 . 2 . ]" 1
2479 2 53 GLY H 2 54 VAL MG2 . . 5.500 4.335 4.219 4.419 . 0 0 "[ . 1 . 2 . ]" 1
2480 2 53 GLY H 2 55 GLN H . . 5.500 4.364 4.281 4.423 . 0 0 "[ . 1 . 2 . ]" 1
2481 2 54 VAL HA 2 54 VAL MG2 . . 3.300 2.253 2.174 2.330 . 0 0 "[ . 1 . 2 . ]" 1
2482 2 54 VAL HA 2 54 VAL MG1 . . 3.700 2.557 2.506 2.596 . 0 0 "[ . 1 . 2 . ]" 1
2483 2 54 VAL HA 2 56 GLN H . . 5.500 4.451 4.124 4.739 . 0 0 "[ . 1 . 2 . ]" 1
2484 2 54 VAL HA 2 57 LYS HA . . 5.220 5.051 4.969 5.167 . 0 0 "[ . 1 . 2 . ]" 1
2485 2 54 VAL HA 2 57 LYS HB3 . . 4.270 3.778 3.442 3.964 . 0 0 "[ . 1 . 2 . ]" 1
2486 2 54 VAL HA 2 57 LYS HB2 . . 4.320 2.211 2.022 2.347 . 0 0 "[ . 1 . 2 . ]" 1
2487 2 54 VAL HA 2 57 LYS HE2 . . 5.330 4.485 2.390 6.022 0.692 8 1 "[ . + 1 . 2 . ]" 1
2488 2 54 VAL HA 2 57 LYS H . . 4.610 3.168 3.013 3.362 . 0 0 "[ . 1 . 2 . ]" 1
2489 2 54 VAL HA 2 57 LYS QD . . 5.000 3.011 1.952 4.469 . 0 0 "[ . 1 . 2 . ]" 1
2490 2 54 VAL HA 2 57 LYS QG . . 4.920 3.509 3.132 3.944 . 0 0 "[ . 1 . 2 . ]" 1
2491 2 54 VAL HA 2 58 TRP H . . 5.250 4.130 4.007 4.293 . 0 0 "[ . 1 . 2 . ]" 1
2492 2 54 VAL HB 2 55 GLN HG3 . . 5.500 5.232 4.964 5.488 . 0 0 "[ . 1 . 2 . ]" 1
2493 2 54 VAL HB 2 55 GLN H . . 3.990 2.689 2.609 2.789 . 0 0 "[ . 1 . 2 . ]" 1
2494 2 54 VAL H 2 54 VAL HB . . 3.670 2.235 2.202 2.271 . 0 0 "[ . 1 . 2 . ]" 1
2495 2 54 VAL H 2 54 VAL MG2 . . 3.780 2.607 2.525 2.684 . 0 0 "[ . 1 . 2 . ]" 1
2496 2 54 VAL H 2 54 VAL MG1 . . 4.320 3.653 3.632 3.675 . 0 0 "[ . 1 . 2 . ]" 1
2497 2 54 VAL H 2 55 GLN HB3 . . 5.500 5.594 5.538 5.651 0.151 7 0 "[ . 1 . 2 . ]" 1
2498 2 54 VAL H 2 55 GLN HB2 . . 5.500 4.148 4.124 4.167 . 0 0 "[ . 1 . 2 . ]" 1
2499 2 54 VAL H 2 55 GLN H . . 4.000 2.415 2.377 2.458 . 0 0 "[ . 1 . 2 . ]" 1
2500 2 54 VAL H 2 56 GLN H . . 5.500 4.101 3.933 4.277 . 0 0 "[ . 1 . 2 . ]" 1
2501 2 54 VAL MG2 2 55 GLN HA . . 6.000 5.416 5.406 5.428 . 0 0 "[ . 1 . 2 . ]" 1
2502 2 54 VAL MG2 2 55 GLN H . . 4.580 4.023 3.978 4.071 . 0 0 "[ . 1 . 2 . ]" 1
2503 2 54 VAL MG2 2 57 LYS HB3 . . 5.010 4.977 4.639 5.116 0.106 3 0 "[ . 1 . 2 . ]" 1
2504 2 54 VAL MG2 2 57 LYS HB2 . . 5.120 3.943 3.761 4.045 . 0 0 "[ . 1 . 2 . ]" 1
2505 2 54 VAL MG2 2 57 LYS H . . 5.500 4.908 4.801 5.017 . 0 0 "[ . 1 . 2 . ]" 1
2506 2 54 VAL MG2 2 57 LYS QD . . 5.290 3.634 2.842 4.975 . 0 0 "[ . 1 . 2 . ]" 1
2507 2 54 VAL MG2 2 57 LYS QG . . 5.490 4.625 4.251 4.907 . 0 0 "[ . 1 . 2 . ]" 1
2508 2 54 VAL MG1 2 55 GLN HA . . 4.520 3.195 3.120 3.273 . 0 0 "[ . 1 . 2 . ]" 1
2509 2 54 VAL MG1 2 55 GLN HB3 . . 5.380 5.409 5.332 5.492 0.112 17 0 "[ . 1 . 2 . ]" 1
2510 2 54 VAL MG1 2 55 GLN HB2 . . 5.500 4.726 4.657 4.824 . 0 0 "[ . 1 . 2 . ]" 1
2511 2 54 VAL MG1 2 55 GLN HG3 . . 5.390 4.997 4.750 5.246 . 0 0 "[ . 1 . 2 . ]" 1
2512 2 54 VAL MG1 2 55 GLN HG2 . . 5.000 4.044 3.950 4.171 . 0 0 "[ . 1 . 2 . ]" 1
2513 2 54 VAL MG1 2 55 GLN H . . 4.480 3.231 3.134 3.338 . 0 0 "[ . 1 . 2 . ]" 1
2514 2 54 VAL MG1 2 56 GLN H . . 5.500 4.960 4.759 5.186 . 0 0 "[ . 1 . 2 . ]" 1
2515 2 54 VAL MG1 2 57 LYS HB3 . . 5.310 4.519 4.305 4.742 . 0 0 "[ . 1 . 2 . ]" 1
2516 2 54 VAL MG1 2 57 LYS HB2 . . 5.050 3.557 3.305 3.928 . 0 0 "[ . 1 . 2 . ]" 1
2517 2 54 VAL MG1 2 57 LYS H . . 5.500 4.388 4.205 4.730 . 0 0 "[ . 1 . 2 . ]" 1
2518 2 54 VAL MG1 2 58 TRP HA . . 5.440 4.778 4.686 4.876 . 0 0 "[ . 1 . 2 . ]" 1
2519 2 54 VAL MG1 2 58 TRP HB3 . . 4.970 3.929 3.718 4.117 . 0 0 "[ . 1 . 2 . ]" 1
2520 2 54 VAL MG1 2 58 TRP HB2 . . 4.940 3.277 3.172 3.377 . 0 0 "[ . 1 . 2 . ]" 1
2521 2 54 VAL MG1 2 58 TRP HE3 . . 4.970 4.529 4.307 4.702 . 0 0 "[ . 1 . 2 . ]" 1
2522 2 54 VAL MG1 2 58 TRP H . . 5.230 3.847 3.649 4.081 . 0 0 "[ . 1 . 2 . ]" 1
2523 2 55 GLN HA 2 55 GLN HG3 . . 4.280 3.342 3.254 3.434 . 0 0 "[ . 1 . 2 . ]" 1
2524 2 55 GLN HA 2 55 GLN HG2 . . 4.150 2.012 1.977 2.084 . 0 0 "[ . 1 . 2 . ]" 1
2525 2 55 GLN HA 2 58 TRP HA . . 5.260 5.387 5.310 5.468 0.208 25 0 "[ . 1 . 2 . ]" 1
2526 2 55 GLN HA 2 58 TRP HB3 . . 4.060 2.674 2.512 2.796 . 0 0 "[ . 1 . 2 . ]" 1
2527 2 55 GLN HA 2 58 TRP HB2 . . 4.190 3.628 3.509 3.763 . 0 0 "[ . 1 . 2 . ]" 1
2528 2 55 GLN HA 2 58 TRP HD1 . . 4.840 4.515 4.313 4.645 . 0 0 "[ . 1 . 2 . ]" 1
2529 2 55 GLN HA 2 58 TRP H . . 4.460 3.377 3.284 3.507 . 0 0 "[ . 1 . 2 . ]" 1
2530 2 55 GLN HA 2 59 ASP H . . 4.810 4.066 3.854 4.352 . 0 0 "[ . 1 . 2 . ]" 1
2531 2 55 GLN HB3 2 56 GLN H . . 4.430 2.996 2.811 3.214 . 0 0 "[ . 1 . 2 . ]" 1
2532 2 55 GLN HB3 2 59 ASP H . . 5.500 4.909 4.716 5.174 . 0 0 "[ . 1 . 2 . ]" 1
2533 2 55 GLN HB2 2 56 GLN H . . 4.340 2.947 2.831 3.114 . 0 0 "[ . 1 . 2 . ]" 1
2534 2 55 GLN H 2 55 GLN HB2 . . 3.710 2.075 2.042 2.103 . 0 0 "[ . 1 . 2 . ]" 1
2535 2 55 GLN H 2 55 GLN HG3 . . 3.940 3.514 3.301 3.721 . 0 0 "[ . 1 . 2 . ]" 1
2536 2 55 GLN H 2 56 GLN HA . . 5.500 5.356 5.305 5.404 . 0 0 "[ . 1 . 2 . ]" 1
2537 2 55 GLN H 2 56 GLN H . . 3.900 2.882 2.815 2.954 . 0 0 "[ . 1 . 2 . ]" 1
2538 2 55 GLN H 2 57 LYS H . . 5.500 4.061 3.947 4.153 . 0 0 "[ . 1 . 2 . ]" 1
2539 2 55 GLN H 2 58 TRP H . . 5.500 4.620 4.506 4.685 . 0 0 "[ . 1 . 2 . ]" 1
2540 2 56 GLN HA 2 56 GLN HG2 . . 4.280 3.420 2.969 3.673 . 0 0 "[ . 1 . 2 . ]" 1
2541 2 56 GLN HA 2 56 GLN HG3 . . 3.930 2.915 1.987 4.228 0.298 11 0 "[ . 1 . 2 . ]" 1
2542 2 56 GLN HA 2 58 TRP HB3 . . 5.500 4.973 4.705 5.138 . 0 0 "[ . 1 . 2 . ]" 1
2543 2 56 GLN HA 2 59 ASP HB2 . . 4.160 3.238 2.603 4.481 0.321 7 0 "[ . 1 . 2 . ]" 1
2544 2 56 GLN HA 2 59 ASP HB3 . . 4.340 3.260 2.731 4.260 . 0 0 "[ . 1 . 2 . ]" 1
2545 2 56 GLN HA 2 59 ASP H . . 4.410 3.342 3.235 3.472 . 0 0 "[ . 1 . 2 . ]" 1
2546 2 56 GLN HB2 2 57 LYS H . . 3.830 3.432 2.940 4.111 0.281 23 0 "[ . 1 . 2 . ]" 1
2547 2 56 GLN HB3 2 58 TRP H . . 5.490 5.400 5.060 5.673 0.183 25 0 "[ . 1 . 2 . ]" 1
2548 2 56 GLN HE21 2 57 LYS QG . . 4.910 4.967 4.557 5.043 0.133 2 0 "[ . 1 . 2 . ]" 1
2549 2 56 GLN HG2 2 60 ALA MB . . 5.330 4.933 4.460 5.280 . 0 0 "[ . 1 . 2 . ]" 1
2550 2 56 GLN HG3 2 60 ALA MB . . 4.950 4.637 3.511 5.439 0.489 21 0 "[ . 1 . 2 . ]" 1
2551 2 56 GLN H 2 56 GLN HB2 . . 3.560 2.777 2.064 3.553 . 0 0 "[ . 1 . 2 . ]" 1
2552 2 56 GLN H 2 56 GLN HG2 . . 4.310 3.310 1.842 4.393 0.083 26 0 "[ . 1 . 2 . ]" 1
2553 2 56 GLN H 2 56 GLN HG3 . . 4.970 3.525 2.878 3.840 . 0 0 "[ . 1 . 2 . ]" 1
2554 2 56 GLN H 2 58 TRP H . . 5.500 3.953 3.842 4.084 . 0 0 "[ . 1 . 2 . ]" 1
2555 2 56 GLN H 2 59 ASP H . . 5.500 4.763 4.662 4.852 . 0 0 "[ . 1 . 2 . ]" 1
2556 2 56 GLN H 2 60 ALA H . . 5.460 5.544 5.428 5.660 0.200 15 0 "[ . 1 . 2 . ]" 1
2557 2 57 LYS HA 2 57 LYS HE2 . . 5.380 4.964 4.566 5.336 . 0 0 "[ . 1 . 2 . ]" 1
2558 2 57 LYS HA 2 57 LYS HE3 . . 5.500 5.148 4.769 5.443 . 0 0 "[ . 1 . 2 . ]" 1
2559 2 57 LYS HA 2 57 LYS QD . . 4.650 3.881 3.202 4.071 . 0 0 "[ . 1 . 2 . ]" 1
2560 2 57 LYS HA 2 57 LYS QG . . 3.500 2.236 2.034 2.369 . 0 0 "[ . 1 . 2 . ]" 1
2561 2 57 LYS HA 2 60 ALA MB . . 3.390 1.982 1.890 2.088 . 0 0 "[ . 1 . 2 . ]" 1
2562 2 57 LYS HA 2 61 THR H . . 4.040 3.850 3.580 4.033 . 0 0 "[ . 1 . 2 . ]" 1
2563 2 57 LYS HA 2 61 THR MG . . 4.430 3.894 3.707 4.113 . 0 0 "[ . 1 . 2 . ]" 1
2564 2 57 LYS HB3 2 57 LYS HE2 . . 4.810 4.254 2.892 4.771 . 0 0 "[ . 1 . 2 . ]" 1
2565 2 57 LYS HB3 2 57 LYS HE3 . . 5.250 4.156 2.809 4.877 . 0 0 "[ . 1 . 2 . ]" 1
2566 2 57 LYS HB3 2 58 TRP H . . 4.420 3.822 3.691 3.979 . 0 0 "[ . 1 . 2 . ]" 1
2567 2 57 LYS HB3 2 60 ALA MB . . 4.690 3.959 3.811 4.098 . 0 0 "[ . 1 . 2 . ]" 1
2568 2 57 LYS HB3 2 61 THR MG . . 4.230 4.117 3.942 4.295 0.065 11 0 "[ . 1 . 2 . ]" 1
2569 2 57 LYS HB2 2 57 LYS HE2 . . 4.710 4.061 2.643 4.815 0.105 8 0 "[ . 1 . 2 . ]" 1
2570 2 57 LYS HB2 2 57 LYS HE3 . . 5.220 3.654 2.188 4.564 . 0 0 "[ . 1 . 2 . ]" 1
2571 2 57 LYS HB2 2 58 TRP H . . 4.610 3.077 2.883 3.192 . 0 0 "[ . 1 . 2 . ]" 1
2572 2 57 LYS HB2 2 60 ALA MB . . 4.590 4.516 4.420 4.617 0.027 19 0 "[ . 1 . 2 . ]" 1
2573 2 57 LYS H 2 57 LYS HB3 . . 3.770 3.500 3.443 3.539 . 0 0 "[ . 1 . 2 . ]" 1
2574 2 57 LYS H 2 57 LYS HB2 . . 3.740 2.257 2.143 2.360 . 0 0 "[ . 1 . 2 . ]" 1
2575 2 57 LYS H 2 57 LYS QD . . 5.280 3.954 3.387 4.515 . 0 0 "[ . 1 . 2 . ]" 1
2576 2 57 LYS H 2 57 LYS QG . . 3.930 2.524 2.307 2.875 . 0 0 "[ . 1 . 2 . ]" 1
2577 2 57 LYS H 2 58 TRP HA . . 5.500 5.120 5.016 5.175 . 0 0 "[ . 1 . 2 . ]" 1
2578 2 57 LYS H 2 58 TRP HB3 . . 5.500 4.607 4.487 4.730 . 0 0 "[ . 1 . 2 . ]" 1
2579 2 57 LYS H 2 58 TRP HB2 . . 5.500 5.044 4.852 5.164 . 0 0 "[ . 1 . 2 . ]" 1
2580 2 57 LYS H 2 58 TRP H . . 4.000 2.551 2.435 2.636 . 0 0 "[ . 1 . 2 . ]" 1
2581 2 57 LYS H 2 59 ASP H . . 5.500 4.356 4.280 4.468 . 0 0 "[ . 1 . 2 . ]" 1
2582 2 57 LYS HE2 2 57 LYS QG . . 3.880 2.325 2.072 2.738 . 0 0 "[ . 1 . 2 . ]" 1
2583 2 57 LYS QG 2 58 TRP H . . 4.910 4.374 4.269 4.490 . 0 0 "[ . 1 . 2 . ]" 1
2584 2 57 LYS QG 2 60 ALA MB . . 4.220 3.516 3.384 3.643 . 0 0 "[ . 1 . 2 . ]" 1
2585 2 57 LYS QG 2 61 THR MG . . 4.990 4.559 4.243 4.862 . 0 0 "[ . 1 . 2 . ]" 1
2586 2 58 TRP HA 2 61 THR H . . 5.490 4.585 4.385 4.670 . 0 0 "[ . 1 . 2 . ]" 1
2587 2 58 TRP HA 2 62 ALA H . . 5.040 4.195 4.092 4.312 . 0 0 "[ . 1 . 2 . ]" 1
2588 2 58 TRP HA 2 62 ALA MB . . 5.420 3.931 3.852 4.071 . 0 0 "[ . 1 . 2 . ]" 1
2589 2 58 TRP HB3 2 59 ASP HA . . 5.490 4.445 4.348 4.574 . 0 0 "[ . 1 . 2 . ]" 1
2590 2 58 TRP HB3 2 59 ASP H . . 4.060 2.481 2.406 2.539 . 0 0 "[ . 1 . 2 . ]" 1
2591 2 58 TRP HB2 2 59 ASP HA . . 5.500 5.586 5.574 5.592 0.092 13 0 "[ . 1 . 2 . ]" 1
2592 2 58 TRP HB2 2 59 ASP H . . 4.350 3.896 3.837 3.939 . 0 0 "[ . 1 . 2 . ]" 1
2593 2 58 TRP HD1 2 59 ASP HA . . 3.490 3.302 2.993 3.525 0.035 19 0 "[ . 1 . 2 . ]" 1
2594 2 58 TRP HD1 2 59 ASP HB2 . . 5.310 3.786 3.057 5.187 . 0 0 "[ . 1 . 2 . ]" 1
2595 2 58 TRP HD1 2 59 ASP HB3 . . 5.380 5.062 3.695 5.417 0.037 27 0 "[ . 1 . 2 . ]" 1
2596 2 58 TRP HD1 2 59 ASP H . . 4.780 3.202 2.834 3.438 . 0 0 "[ . 1 . 2 . ]" 1
2597 2 58 TRP HD1 2 62 ALA MB . . 3.820 3.789 3.611 3.925 0.105 7 0 "[ . 1 . 2 . ]" 1
2598 2 58 TRP HE1 2 59 ASP HA . . 5.310 4.765 4.378 5.040 . 0 0 "[ . 1 . 2 . ]" 1
2599 2 58 TRP HE1 2 62 ALA MB . . 4.790 3.979 3.861 4.128 . 0 0 "[ . 1 . 2 . ]" 1
2600 2 58 TRP H 2 58 TRP HB3 . . 3.930 2.276 2.200 2.337 . 0 0 "[ . 1 . 2 . ]" 1
2601 2 58 TRP H 2 58 TRP HB2 . . 3.910 2.725 2.618 2.841 . 0 0 "[ . 1 . 2 . ]" 1
2602 2 58 TRP H 2 58 TRP HD1 . . 5.340 4.676 4.475 4.811 . 0 0 "[ . 1 . 2 . ]" 1
2603 2 58 TRP H 2 58 TRP HE3 . . 5.160 4.912 4.752 5.100 . 0 0 "[ . 1 . 2 . ]" 1
2604 2 58 TRP H 2 59 ASP H . . 4.240 2.594 2.541 2.701 . 0 0 "[ . 1 . 2 . ]" 1
2605 2 58 TRP H 2 60 ALA H . . 5.470 3.531 3.411 3.683 . 0 0 "[ . 1 . 2 . ]" 1
2606 2 58 TRP H 2 60 ALA MB . . 5.500 4.026 3.936 4.158 . 0 0 "[ . 1 . 2 . ]" 1
2607 2 58 TRP HZ2 2 62 ALA MB . . 5.160 4.897 4.734 5.059 . 0 0 "[ . 1 . 2 . ]" 1
2608 2 59 ASP HA 2 62 ALA HA . . 5.500 4.773 4.741 4.842 . 0 0 "[ . 1 . 2 . ]" 1
2609 2 59 ASP HA 2 62 ALA H . . 5.140 3.623 3.543 3.672 . 0 0 "[ . 1 . 2 . ]" 1
2610 2 59 ASP HA 2 62 ALA MB . . 3.780 1.818 1.736 1.879 . 0 0 "[ . 1 . 2 . ]" 1
2611 2 59 ASP HA 2 63 THR H . . 5.060 3.372 3.080 3.491 . 0 0 "[ . 1 . 2 . ]" 1
2612 2 59 ASP HB2 2 60 ALA MB . . 5.360 5.001 4.453 5.325 . 0 0 "[ . 1 . 2 . ]" 1
2613 2 59 ASP HB2 2 62 ALA MB . . 5.110 4.140 3.681 4.267 . 0 0 "[ . 1 . 2 . ]" 1
2614 2 59 ASP HB2 2 63 THR MG . . 5.190 4.714 3.030 4.929 . 0 0 "[ . 1 . 2 . ]" 1
2615 2 59 ASP HB3 2 60 ALA MB . . 4.880 4.288 4.035 5.530 0.650 7 1 "[ . + 1 . 2 . ]" 1
2616 2 59 ASP HB3 2 62 ALA MB . . 5.220 4.057 3.824 4.222 . 0 0 "[ . 1 . 2 . ]" 1
2617 2 59 ASP HB3 2 63 THR MG . . 5.070 3.658 2.975 4.497 . 0 0 "[ . 1 . 2 . ]" 1
2618 2 59 ASP H 2 59 ASP HB2 . . 4.070 2.172 2.003 3.536 . 0 0 "[ . 1 . 2 . ]" 1
2619 2 59 ASP H 2 60 ALA H . . 3.920 2.582 2.523 2.614 . 0 0 "[ . 1 . 2 . ]" 1
2620 2 59 ASP H 2 60 ALA MB . . 5.030 4.132 4.056 4.188 . 0 0 "[ . 1 . 2 . ]" 1
2621 2 59 ASP H 2 62 ALA MB . . 5.260 3.764 3.704 3.899 . 0 0 "[ . 1 . 2 . ]" 1
2622 2 60 ALA HA 2 63 THR H . . 4.580 4.584 4.423 4.637 0.057 28 0 "[ . 1 . 2 . ]" 1
2623 2 60 ALA HA 2 63 THR MG . . 4.210 2.968 2.798 3.083 . 0 0 "[ . 1 . 2 . ]" 1
2624 2 60 ALA H 2 60 ALA MB . . 3.350 2.064 1.958 2.148 . 0 0 "[ . 1 . 2 . ]" 1
2625 2 60 ALA H 2 61 THR H . . 3.890 3.389 3.255 3.467 . 0 0 "[ . 1 . 2 . ]" 1
2626 2 60 ALA H 2 62 ALA H . . 5.500 3.627 3.576 3.907 . 0 0 "[ . 1 . 2 . ]" 1
2627 2 60 ALA MB 2 61 THR HB . . 4.710 4.796 4.709 4.902 0.192 20 0 "[ . 1 . 2 . ]" 1
2628 2 60 ALA MB 2 61 THR H . . 3.930 1.982 1.859 2.029 . 0 0 "[ . 1 . 2 . ]" 1
2629 2 60 ALA MB 2 61 THR MG . . 4.770 2.686 2.541 3.110 . 0 0 "[ . 1 . 2 . ]" 1
2630 2 60 ALA MB 2 62 ALA H . . 5.500 3.757 3.700 3.907 . 0 0 "[ . 1 . 2 . ]" 1
2631 2 60 ALA MB 2 63 THR MG . . 4.330 4.110 3.987 4.193 . 0 0 "[ . 1 . 2 . ]" 1
2632 2 60 ALA MB 2 64 GLU HB3 . . 5.270 5.020 4.882 5.167 . 0 0 "[ . 1 . 2 . ]" 1
2633 2 60 ALA MB 2 64 GLU H . . 5.500 5.078 4.953 5.154 . 0 0 "[ . 1 . 2 . ]" 1
2634 2 61 THR HA 2 61 THR MG . . 3.320 2.444 2.208 2.491 . 0 0 "[ . 1 . 2 . ]" 1
2635 2 61 THR HA 2 62 ALA HA . . 4.760 4.836 4.803 4.852 0.092 26 0 "[ . 1 . 2 . ]" 1
2636 2 61 THR HA 2 62 ALA MB . . 5.170 4.913 4.894 4.949 . 0 0 "[ . 1 . 2 . ]" 1
2637 2 61 THR HA 2 63 THR H . . 5.500 5.409 5.316 5.465 . 0 0 "[ . 1 . 2 . ]" 1
2638 2 61 THR HA 2 64 GLU HB3 . . 3.600 1.982 1.919 2.060 . 0 0 "[ . 1 . 2 . ]" 1
2639 2 61 THR HA 2 64 GLU HB2 . . 5.500 2.768 2.534 2.854 . 0 0 "[ . 1 . 2 . ]" 1
2640 2 61 THR HA 2 64 GLU QG . . 5.410 3.151 3.077 3.250 . 0 0 "[ . 1 . 2 . ]" 1
2641 2 61 THR HA 2 64 GLU H . . 4.780 3.462 3.362 3.538 . 0 0 "[ . 1 . 2 . ]" 1
2642 2 61 THR HA 2 65 LEU HB2 . . 5.470 4.784 4.633 5.094 . 0 0 "[ . 1 . 2 . ]" 1
2643 2 61 THR HB 2 62 ALA MB . . 5.500 5.288 4.999 5.372 . 0 0 "[ . 1 . 2 . ]" 1
2644 2 61 THR HB 2 64 GLU HB3 . . 4.010 3.793 3.612 3.934 . 0 0 "[ . 1 . 2 . ]" 1
2645 2 61 THR HB 2 64 GLU HB2 . . 5.130 5.108 4.838 5.241 0.111 20 0 "[ . 1 . 2 . ]" 1
2646 2 61 THR HB 2 64 GLU QG . . 4.970 4.459 4.214 4.628 . 0 0 "[ . 1 . 2 . ]" 1
2647 2 61 THR HB 2 65 LEU HB2 . . 5.260 4.341 4.135 4.703 . 0 0 "[ . 1 . 2 . ]" 1
2648 2 61 THR H 2 61 THR MG . . 4.580 1.929 1.829 2.411 . 0 0 "[ . 1 . 2 . ]" 1
2649 2 61 THR H 2 62 ALA H . . 4.230 2.795 2.781 2.813 . 0 0 "[ . 1 . 2 . ]" 1
2650 2 61 THR H 2 62 ALA MB . . 5.190 4.341 4.322 4.367 . 0 0 "[ . 1 . 2 . ]" 1
2651 2 61 THR H 2 63 THR H . . 5.500 5.531 5.413 5.580 0.080 18 0 "[ . 1 . 2 . ]" 1
2652 2 61 THR H 2 64 GLU HB2 . . 5.500 4.829 4.674 4.968 . 0 0 "[ . 1 . 2 . ]" 1
2653 2 61 THR H 2 64 GLU H . . 5.500 4.905 4.798 4.949 . 0 0 "[ . 1 . 2 . ]" 1
2654 2 61 THR MG 2 62 ALA HA . . 5.470 5.427 5.372 5.518 0.048 20 0 "[ . 1 . 2 . ]" 1
2655 2 61 THR MG 2 62 ALA H . . 4.840 3.892 3.736 4.215 . 0 0 "[ . 1 . 2 . ]" 1
2656 2 61 THR MG 2 62 ALA MB . . 4.810 4.979 4.851 5.238 0.428 20 0 "[ . 1 . 2 . ]" 1
2657 2 61 THR MG 2 64 GLU HB3 . . 4.080 4.104 3.887 4.212 0.132 10 0 "[ . 1 . 2 . ]" 1
2658 2 62 ALA HA 2 63 THR MG . . 4.810 4.717 4.663 4.809 . 0 0 "[ . 1 . 2 . ]" 1
2659 2 62 ALA HA 2 65 LEU HB2 . . 4.370 4.424 4.340 4.520 0.150 20 0 "[ . 1 . 2 . ]" 1
2660 2 62 ALA HA 2 65 LEU HB3 . . 5.350 3.653 3.584 3.769 . 0 0 "[ . 1 . 2 . ]" 1
2661 2 62 ALA HA 2 65 LEU HG . . 6.000 5.781 5.564 6.394 0.394 27 0 "[ . 1 . 2 . ]" 1
2662 2 62 ALA HA 2 65 LEU H . . 4.650 3.555 3.514 3.608 . 0 0 "[ . 1 . 2 . ]" 1
2663 2 62 ALA HA 2 65 LEU QD . . 5.140 4.794 4.187 5.038 . 0 0 "[ . 1 . 2 . ]" 1
2664 2 62 ALA HA 2 66 ASN H . . 4.740 4.082 3.950 4.174 . 0 0 "[ . 1 . 2 . ]" 1
2665 2 62 ALA H 2 62 ALA MB . . 3.580 2.072 2.020 2.146 . 0 0 "[ . 1 . 2 . ]" 1
2666 2 62 ALA H 2 63 THR H . . 4.030 3.289 3.202 3.322 . 0 0 "[ . 1 . 2 . ]" 1
2667 2 62 ALA H 2 64 GLU H . . 5.500 3.672 3.581 3.799 . 0 0 "[ . 1 . 2 . ]" 1
2668 2 62 ALA MB 2 63 THR HB . . 4.630 3.916 3.840 3.964 . 0 0 "[ . 1 . 2 . ]" 1
2669 2 62 ALA MB 2 63 THR H . . 3.530 2.052 1.961 2.077 . 0 0 "[ . 1 . 2 . ]" 1
2670 2 62 ALA MB 2 65 LEU HB2 . . 5.690 5.714 5.648 5.805 0.115 20 0 "[ . 1 . 2 . ]" 1
2671 2 62 ALA MB 2 66 ASN HB2 . . 5.120 3.929 3.841 4.050 . 0 0 "[ . 1 . 2 . ]" 1
2672 2 62 ALA MB 2 66 ASN HB3 . . 5.230 5.182 5.043 5.317 0.087 8 0 "[ . 1 . 2 . ]" 1
2673 2 62 ALA MB 2 66 ASN HD21 . . 5.500 3.772 3.411 4.467 . 0 0 "[ . 1 . 2 . ]" 1
2674 2 62 ALA MB 2 66 ASN HD22 . . 5.500 5.039 4.696 5.355 . 0 0 "[ . 1 . 2 . ]" 1
2675 2 62 ALA MB 2 66 ASN H . . 5.180 4.544 4.425 4.616 . 0 0 "[ . 1 . 2 . ]" 1
2676 2 63 THR HA 2 63 THR MG . . 3.130 3.215 3.201 3.226 0.096 13 0 "[ . 1 . 2 . ]" 1
2677 2 63 THR HA 2 64 GLU HA . . 4.970 4.746 4.718 4.791 . 0 0 "[ . 1 . 2 . ]" 1
2678 2 63 THR HA 2 66 ASN HD21 . . 5.500 3.458 3.027 4.424 . 0 0 "[ . 1 . 2 . ]" 1
2679 2 63 THR HA 2 66 ASN HD22 . . 5.500 4.907 4.625 5.371 . 0 0 "[ . 1 . 2 . ]" 1
2680 2 63 THR HA 2 67 ASN H . . 5.180 3.310 3.031 3.681 . 0 0 "[ . 1 . 2 . ]" 1
2681 2 63 THR HB 2 66 ASN HB2 . . 4.160 4.412 4.302 4.562 0.402 19 0 "[ . 1 . 2 . ]" 1
2682 2 63 THR HB 2 66 ASN HB3 . . 4.340 4.450 4.326 4.568 0.228 25 0 "[ . 1 . 2 . ]" 1
2683 2 63 THR H 2 64 GLU HB2 . . 5.200 5.202 5.001 5.297 0.097 4 0 "[ . 1 . 2 . ]" 1
2684 2 63 THR H 2 64 GLU H . . 4.040 2.864 2.820 2.906 . 0 0 "[ . 1 . 2 . ]" 1
2685 2 63 THR H 2 66 ASN H . . 5.500 4.509 4.459 4.566 . 0 0 "[ . 1 . 2 . ]" 1
2686 2 63 THR MG 2 64 GLU HA . . 4.590 3.747 3.556 3.866 . 0 0 "[ . 1 . 2 . ]" 1
2687 2 63 THR MG 2 64 GLU H . . 4.390 2.186 1.993 2.321 . 0 0 "[ . 1 . 2 . ]" 1
2688 2 63 THR MG 2 66 ASN HB3 . . 5.450 5.117 4.967 5.298 . 0 0 "[ . 1 . 2 . ]" 1
2689 2 63 THR MG 2 67 ASN QB . . 5.400 4.862 4.527 5.214 . 0 0 "[ . 1 . 2 . ]" 1
2690 2 63 THR MG 2 67 ASN QD . . 4.070 3.636 3.090 4.038 . 0 0 "[ . 1 . 2 . ]" 1
2691 2 63 THR MG 2 67 ASN H . . 5.500 4.960 4.843 5.087 . 0 0 "[ . 1 . 2 . ]" 1
2692 2 64 GLU HA 2 65 LEU HA . . 5.200 4.682 4.674 4.700 . 0 0 "[ . 1 . 2 . ]" 1
2693 2 64 GLU HA 2 67 ASN QB . . 4.220 3.521 3.163 3.803 . 0 0 "[ . 1 . 2 . ]" 1
2694 2 64 GLU HA 2 67 ASN QD . . 4.060 2.130 1.743 2.705 . 0 0 "[ . 1 . 2 . ]" 1
2695 2 64 GLU HA 2 67 ASN H . . 4.770 3.773 3.685 3.887 . 0 0 "[ . 1 . 2 . ]" 1
2696 2 64 GLU HA 2 68 ALA H . . 5.240 4.082 3.892 4.379 . 0 0 "[ . 1 . 2 . ]" 1
2697 2 64 GLU HB3 2 65 LEU H . . 3.820 2.532 2.491 2.577 . 0 0 "[ . 1 . 2 . ]" 1
2698 2 64 GLU QG 2 65 LEU HA . . 5.500 3.507 3.320 3.810 . 0 0 "[ . 1 . 2 . ]" 1
2699 2 64 GLU QG 2 67 ASN QD . . 5.500 4.178 3.421 5.088 . 0 0 "[ . 1 . 2 . ]" 1
2700 2 64 GLU QG 2 68 ALA MB . . 5.000 3.587 3.452 3.953 . 0 0 "[ . 1 . 2 . ]" 1
2701 2 64 GLU QG 2 65 LEU QD . . 5.500 3.977 3.845 4.160 . 0 0 "[ . 1 . 2 . ]" 1
2702 2 64 GLU H 2 64 GLU HB2 . . 3.830 2.537 2.440 2.628 . 0 0 "[ . 1 . 2 . ]" 1
2703 2 64 GLU H 2 64 GLU QG . . 4.790 3.986 3.941 4.034 . 0 0 "[ . 1 . 2 . ]" 1
2704 2 64 GLU H 2 65 LEU HB3 . . 5.310 5.086 5.041 5.184 . 0 0 "[ . 1 . 2 . ]" 1
2705 2 64 GLU H 2 65 LEU H . . 4.180 2.733 2.671 2.840 . 0 0 "[ . 1 . 2 . ]" 1
2706 2 64 GLU H 2 66 ASN H . . 5.500 3.672 3.574 3.889 . 0 0 "[ . 1 . 2 . ]" 1
2707 2 64 GLU H 2 67 ASN QB . . 5.500 5.164 5.037 5.343 . 0 0 "[ . 1 . 2 . ]" 1
2708 2 65 LEU HA 2 65 LEU QD . . 3.710 2.122 1.877 2.733 . 0 0 "[ . 1 . 2 . ]" 1
2709 2 65 LEU HA 2 66 ASN HA . . 5.210 4.746 4.710 4.819 . 0 0 "[ . 1 . 2 . ]" 1
2710 2 65 LEU HA 2 68 ALA MB . . 3.790 2.417 2.250 2.602 . 0 0 "[ . 1 . 2 . ]" 1
2711 2 65 LEU HA 2 69 LEU MD1 . . 4.990 4.386 4.037 4.578 . 0 0 "[ . 1 . 2 . ]" 1
2712 2 65 LEU HB2 2 66 ASN H . . 4.150 4.017 3.906 4.072 . 0 0 "[ . 1 . 2 . ]" 1
2713 2 65 LEU HB3 2 66 ASN H . . 4.510 3.052 2.826 3.182 . 0 0 "[ . 1 . 2 . ]" 1
2714 2 65 LEU HG 2 69 LEU MD1 . . 4.290 3.505 1.982 4.049 . 0 0 "[ . 1 . 2 . ]" 1
2715 2 65 LEU H 2 65 LEU HB3 . . 3.910 2.543 2.485 2.582 . 0 0 "[ . 1 . 2 . ]" 1
2716 2 65 LEU H 2 65 LEU HG . . 4.780 4.548 4.418 4.588 . 0 0 "[ . 1 . 2 . ]" 1
2717 2 65 LEU H 2 66 ASN H . . 4.200 2.369 2.340 2.425 . 0 0 "[ . 1 . 2 . ]" 1
2718 2 65 LEU H 2 67 ASN H . . 5.500 4.222 3.973 4.412 . 0 0 "[ . 1 . 2 . ]" 1
2719 2 65 LEU H 2 68 ALA H . . 5.500 4.644 4.481 4.826 . 0 0 "[ . 1 . 2 . ]" 1
2720 2 65 LEU QD 2 66 ASN HA . . 4.430 3.275 2.987 4.202 . 0 0 "[ . 1 . 2 . ]" 1
2721 2 65 LEU QD 2 68 ALA MB . . 4.000 2.657 2.484 3.119 . 0 0 "[ . 1 . 2 . ]" 1
2722 2 65 LEU QD 2 69 LEU HB2 . . 3.760 3.052 2.749 3.792 0.032 4 0 "[ . 1 . 2 . ]" 1
2723 2 65 LEU QD 2 69 LEU H . . 4.500 3.370 3.080 4.103 . 0 0 "[ . 1 . 2 . ]" 1
2724 2 65 LEU QD 2 68 ALA H . . 5.490 4.240 3.951 4.775 . 0 0 "[ . 1 . 2 . ]" 1
2725 2 65 LEU QD 2 69 LEU HG . . 4.330 2.477 2.091 3.335 . 0 0 "[ . 1 . 2 . ]" 1
2726 2 65 LEU QD 2 69 LEU MD1 . . 3.830 1.660 1.595 1.837 . 0 0 "[ . 1 . 2 . ]" 1
2727 2 66 ASN HA 2 68 ALA MB . . 5.140 5.031 4.872 5.229 0.089 27 0 "[ . 1 . 2 . ]" 1
2728 2 66 ASN HA 2 69 LEU HB2 . . 4.170 2.682 2.574 2.822 . 0 0 "[ . 1 . 2 . ]" 1
2729 2 66 ASN HA 2 69 LEU HB3 . . 4.300 3.945 3.833 4.043 . 0 0 "[ . 1 . 2 . ]" 1
2730 2 66 ASN HA 2 69 LEU HG . . 5.140 4.913 4.664 5.210 0.070 7 0 "[ . 1 . 2 . ]" 1
2731 2 66 ASN HA 2 69 LEU H . . 4.860 3.532 3.398 3.737 . 0 0 "[ . 1 . 2 . ]" 1
2732 2 66 ASN HA 2 69 LEU MD1 . . 4.200 2.923 2.677 3.331 . 0 0 "[ . 1 . 2 . ]" 1
2733 2 66 ASN HA 2 69 LEU MD2 . . 4.960 5.096 4.983 5.189 0.229 10 0 "[ . 1 . 2 . ]" 1
2734 2 66 ASN HA 2 70 GLN QG . . 5.160 4.732 4.363 4.980 . 0 0 "[ . 1 . 2 . ]" 1
2735 2 66 ASN HB2 2 69 LEU HB2 . . 5.500 5.374 5.287 5.498 . 0 0 "[ . 1 . 2 . ]" 1
2736 2 66 ASN HB3 2 67 ASN H . . 3.930 2.514 2.242 2.753 . 0 0 "[ . 1 . 2 . ]" 1
2737 2 66 ASN HB3 2 69 LEU HB2 . . 5.500 5.249 5.071 5.501 0.001 13 0 "[ . 1 . 2 . ]" 1
2738 2 66 ASN H 2 66 ASN HB2 . . 3.920 2.094 2.028 2.187 . 0 0 "[ . 1 . 2 . ]" 1
2739 2 66 ASN H 2 66 ASN HB3 . . 4.050 2.992 2.837 3.148 . 0 0 "[ . 1 . 2 . ]" 1
2740 2 66 ASN H 2 66 ASN HD21 . . 5.500 4.029 3.314 4.396 . 0 0 "[ . 1 . 2 . ]" 1
2741 2 66 ASN H 2 66 ASN HD22 . . 5.500 5.303 4.828 5.500 . 0 0 "[ . 1 . 2 . ]" 1
2742 2 66 ASN H 2 67 ASN H . . 3.860 2.641 2.560 2.741 . 0 0 "[ . 1 . 2 . ]" 1
2743 2 66 ASN H 2 68 ALA H . . 5.500 3.956 3.750 4.222 . 0 0 "[ . 1 . 2 . ]" 1
2744 2 66 ASN H 2 68 ALA MB . . 4.880 4.586 4.396 4.813 . 0 0 "[ . 1 . 2 . ]" 1
2745 2 66 ASN H 2 69 LEU HB2 . . 5.500 4.733 4.663 4.816 . 0 0 "[ . 1 . 2 . ]" 1
2746 2 67 ASN HA 2 68 ALA HA . . 5.040 4.862 4.814 4.899 . 0 0 "[ . 1 . 2 . ]" 1
2747 2 67 ASN HA 2 70 GLN QG . . 4.940 3.529 3.074 4.112 . 0 0 "[ . 1 . 2 . ]" 1
2748 2 67 ASN HA 2 70 GLN H . . 4.210 3.273 3.145 3.443 . 0 0 "[ . 1 . 2 . ]" 1
2749 2 67 ASN HA 2 70 GLN QB . . 3.830 2.419 2.268 2.536 . 0 0 "[ . 1 . 2 . ]" 1
2750 2 67 ASN QB 2 68 ALA H . . 4.380 2.927 2.261 3.461 . 0 0 "[ . 1 . 2 . ]" 1
2751 2 67 ASN QD 2 68 ALA H . . 5.500 3.550 2.973 4.172 . 0 0 "[ . 1 . 2 . ]" 1
2752 2 67 ASN H 2 67 ASN QD . . 5.500 2.985 2.789 3.273 . 0 0 "[ . 1 . 2 . ]" 1
2753 2 67 ASN H 2 68 ALA HA . . 5.500 5.192 5.015 5.331 . 0 0 "[ . 1 . 2 . ]" 1
2754 2 67 ASN H 2 68 ALA H . . 4.050 2.643 2.420 2.824 . 0 0 "[ . 1 . 2 . ]" 1
2755 2 67 ASN H 2 68 ALA MB . . 5.160 4.202 4.016 4.324 . 0 0 "[ . 1 . 2 . ]" 1
2756 2 67 ASN H 2 69 LEU HB2 . . 5.500 4.967 4.813 5.099 . 0 0 "[ . 1 . 2 . ]" 1
2757 2 67 ASN H 2 69 LEU H . . 5.500 4.060 3.879 4.231 . 0 0 "[ . 1 . 2 . ]" 1
2758 2 68 ALA HA 2 71 ASN HB2 . . 4.150 3.360 3.078 3.615 . 0 0 "[ . 1 . 2 . ]" 1
2759 2 68 ALA HA 2 71 ASN HB3 . . 4.070 3.202 2.836 3.626 . 0 0 "[ . 1 . 2 . ]" 1
2760 2 68 ALA H 2 68 ALA MB . . 3.460 2.063 1.961 2.149 . 0 0 "[ . 1 . 2 . ]" 1
2761 2 68 ALA H 2 69 LEU HB2 . . 5.500 4.496 4.354 4.632 . 0 0 "[ . 1 . 2 . ]" 1
2762 2 68 ALA H 2 69 LEU H . . 4.280 2.720 2.592 2.862 . 0 0 "[ . 1 . 2 . ]" 1
2763 2 68 ALA H 2 70 GLN H . . 5.500 4.131 3.959 4.262 . 0 0 "[ . 1 . 2 . ]" 1
2764 2 68 ALA MB 2 69 LEU HG . . 4.200 4.012 3.896 4.126 . 0 0 "[ . 1 . 2 . ]" 1
2765 2 68 ALA MB 2 69 LEU H . . 4.080 2.603 2.468 2.764 . 0 0 "[ . 1 . 2 . ]" 1
2766 2 68 ALA MB 2 69 LEU MD1 . . 5.080 4.410 4.177 4.557 . 0 0 "[ . 1 . 2 . ]" 1
2767 2 68 ALA MB 2 70 GLN H . . 5.500 4.545 4.390 4.683 . 0 0 "[ . 1 . 2 . ]" 1
2768 2 68 ALA MB 2 71 ASN HB2 . . 4.870 4.881 4.653 5.089 0.219 9 0 "[ . 1 . 2 . ]" 1
2769 2 68 ALA MB 2 71 ASN HB3 . . 4.620 4.529 4.295 4.770 0.150 8 0 "[ . 1 . 2 . ]" 1
2770 2 68 ALA MB 2 71 ASN H . . 5.500 4.724 4.623 4.846 . 0 0 "[ . 1 . 2 . ]" 1
2771 2 68 ALA MB 2 72 LEU QD . . 5.010 4.386 4.088 4.657 . 0 0 "[ . 1 . 2 . ]" 1
2772 2 69 LEU HA 2 69 LEU MD1 . . 4.000 3.724 3.688 3.761 . 0 0 "[ . 1 . 2 . ]" 1
2773 2 69 LEU HA 2 69 LEU MD2 . . 3.760 2.411 2.228 2.534 . 0 0 "[ . 1 . 2 . ]" 1
2774 2 69 LEU HA 2 72 LEU HB2 . . 4.780 3.418 3.116 3.749 . 0 0 "[ . 1 . 2 . ]" 1
2775 2 69 LEU HA 2 72 LEU HB3 . . 4.920 2.124 1.900 2.335 . 0 0 "[ . 1 . 2 . ]" 1
2776 2 69 LEU HA 2 72 LEU H . . 4.350 3.324 3.185 3.439 . 0 0 "[ . 1 . 2 . ]" 1
2777 2 69 LEU HA 2 72 LEU QD . . 4.410 2.704 2.385 2.973 . 0 0 "[ . 1 . 2 . ]" 1
2778 2 69 LEU HA 2 73 ALA H . . 4.430 3.738 3.538 3.959 . 0 0 "[ . 1 . 2 . ]" 1
2779 2 69 LEU HB3 2 70 GLN H . . 4.140 3.178 3.040 3.311 . 0 0 "[ . 1 . 2 . ]" 1
2780 2 69 LEU HG 2 72 LEU QD . . 5.500 3.620 3.302 3.813 . 0 0 "[ . 1 . 2 . ]" 1
2781 2 69 LEU H 2 69 LEU HB2 . . 3.980 2.018 2.002 2.036 . 0 0 "[ . 1 . 2 . ]" 1
2782 2 69 LEU H 2 69 LEU HB3 . . 4.140 3.310 3.272 3.349 . 0 0 "[ . 1 . 2 . ]" 1
2783 2 69 LEU H 2 70 GLN H . . 4.000 2.652 2.534 2.748 . 0 0 "[ . 1 . 2 . ]" 1
2784 2 69 LEU H 2 71 ASN H . . 5.500 4.320 4.149 4.436 . 0 0 "[ . 1 . 2 . ]" 1
2785 2 69 LEU H 2 72 LEU HB2 . . 5.500 5.159 4.838 5.553 0.053 17 0 "[ . 1 . 2 . ]" 1
2786 2 69 LEU MD1 2 70 GLN H . . 5.030 4.741 4.638 4.873 . 0 0 "[ . 1 . 2 . ]" 1
2787 2 69 LEU MD1 2 72 LEU QD . . 4.530 4.426 4.245 4.579 0.049 8 0 "[ . 1 . 2 . ]" 1
2788 2 69 LEU MD2 2 70 GLN H . . 4.620 4.610 4.523 4.661 0.041 4 0 "[ . 1 . 2 . ]" 1
2789 2 69 LEU MD2 2 72 LEU QD . . 4.140 2.386 2.184 2.502 . 0 0 "[ . 1 . 2 . ]" 1
2790 2 69 LEU MD2 2 73 ALA H . . 5.500 4.059 3.822 4.385 . 0 0 "[ . 1 . 2 . ]" 1
2791 2 70 GLN HA 2 70 GLN HE21 . . 5.500 3.833 2.562 4.388 . 0 0 "[ . 1 . 2 . ]" 1
2792 2 70 GLN HA 2 70 GLN HE22 . . 5.440 4.872 3.457 5.516 0.076 8 0 "[ . 1 . 2 . ]" 1
2793 2 70 GLN HA 2 70 GLN QG . . 3.540 2.130 1.987 2.632 . 0 0 "[ . 1 . 2 . ]" 1
2794 2 70 GLN HA 2 71 ASN HA . . 4.950 4.741 4.692 4.790 . 0 0 "[ . 1 . 2 . ]" 1
2795 2 70 GLN HA 2 73 ALA MB . . 3.590 2.996 2.677 3.221 . 0 0 "[ . 1 . 2 . ]" 1
2796 2 70 GLN QG 2 71 ASN H . . 5.500 4.334 4.195 4.415 . 0 0 "[ . 1 . 2 . ]" 1
2797 2 70 GLN QG 2 74 ARG HG3 . . 5.160 4.786 4.378 4.879 . 0 0 "[ . 1 . 2 . ]" 1
2798 2 70 GLN H 2 70 GLN QG . . 4.260 2.869 2.479 3.045 . 0 0 "[ . 1 . 2 . ]" 1
2799 2 70 GLN H 2 70 GLN QB . . 3.310 2.133 2.054 2.260 . 0 0 "[ . 1 . 2 . ]" 1
2800 2 70 GLN H 2 71 ASN HB3 . . 5.050 5.341 5.112 5.665 0.615 8 6 "[ * . + 1 * . *-2 * ]" 1
2801 2 70 GLN H 2 71 ASN H . . 3.900 2.777 2.701 2.869 . 0 0 "[ . 1 . 2 . ]" 1
2802 2 70 GLN H 2 72 LEU H . . 5.500 3.731 3.636 3.881 . 0 0 "[ . 1 . 2 . ]" 1
2803 2 70 GLN H 2 73 ALA MB . . 5.500 4.673 4.471 4.780 . 0 0 "[ . 1 . 2 . ]" 1
2804 2 70 GLN QB 2 71 ASN HA . . 4.110 3.745 3.694 3.797 . 0 0 "[ . 1 . 2 . ]" 1
2805 2 70 GLN QB 2 71 ASN H . . 3.880 2.534 2.467 2.577 . 0 0 "[ . 1 . 2 . ]" 1
2806 2 70 GLN QB 2 73 ALA MB . . 4.900 4.679 4.389 4.851 . 0 0 "[ . 1 . 2 . ]" 1
2807 2 70 GLN QB 2 74 ARG HG3 . . 5.370 3.103 2.913 3.308 . 0 0 "[ . 1 . 2 . ]" 1
2808 2 71 ASN HA 2 74 ARG HA . . 4.790 4.866 4.705 4.957 0.167 6 0 "[ . 1 . 2 . ]" 1
2809 2 71 ASN HA 2 74 ARG HB3 . . 4.310 3.481 3.289 3.644 . 0 0 "[ . 1 . 2 . ]" 1
2810 2 71 ASN HA 2 74 ARG HB2 . . 4.070 2.051 1.878 2.203 . 0 0 "[ . 1 . 2 . ]" 1
2811 2 71 ASN HA 2 74 ARG HD2 . . 5.330 4.212 3.294 5.108 . 0 0 "[ . 1 . 2 . ]" 1
2812 2 71 ASN HA 2 74 ARG HD3 . . 5.310 4.834 4.177 5.212 . 0 0 "[ . 1 . 2 . ]" 1
2813 2 71 ASN HA 2 74 ARG HG2 . . 5.080 3.970 3.646 4.247 . 0 0 "[ . 1 . 2 . ]" 1
2814 2 71 ASN HA 2 74 ARG HG3 . . 5.190 2.551 2.271 2.831 . 0 0 "[ . 1 . 2 . ]" 1
2815 2 71 ASN HA 2 74 ARG H . . 5.140 3.281 3.147 3.443 . 0 0 "[ . 1 . 2 . ]" 1
2816 2 71 ASN HA 2 75 THR H . . 5.500 4.502 4.263 4.658 . 0 0 "[ . 1 . 2 . ]" 1
2817 2 71 ASN HB3 2 72 LEU H . . 4.550 3.010 2.836 3.203 . 0 0 "[ . 1 . 2 . ]" 1
2818 2 71 ASN H 2 71 ASN HB2 . . 3.910 2.164 2.042 2.266 . 0 0 "[ . 1 . 2 . ]" 1
2819 2 71 ASN H 2 71 ASN HB3 . . 4.080 2.874 2.708 3.085 . 0 0 "[ . 1 . 2 . ]" 1
2820 2 71 ASN H 2 72 LEU H . . 4.400 2.565 2.442 2.692 . 0 0 "[ . 1 . 2 . ]" 1
2821 2 71 ASN H 2 73 ALA MB . . 5.500 5.170 4.999 5.256 . 0 0 "[ . 1 . 2 . ]" 1
2822 2 71 ASN H 2 74 ARG HB2 . . 5.490 4.456 4.211 4.605 . 0 0 "[ . 1 . 2 . ]" 1
2823 2 72 LEU HA 2 72 LEU QD . . 3.720 2.600 2.113 3.079 . 0 0 "[ . 1 . 2 . ]" 1
2824 2 72 LEU HB2 2 73 ALA H . . 4.380 4.039 3.884 4.138 . 0 0 "[ . 1 . 2 . ]" 1
2825 2 72 LEU HB2 2 76 ILE MD . . 4.810 4.328 3.991 4.682 . 0 0 "[ . 1 . 2 . ]" 1
2826 2 72 LEU HG 2 73 ALA HA . . 5.540 4.511 3.461 5.606 0.066 8 0 "[ . 1 . 2 . ]" 1
2827 2 72 LEU HG 2 76 ILE MD . . 3.880 2.571 1.801 3.550 . 0 0 "[ . 1 . 2 . ]" 1
2828 2 72 LEU H 2 72 LEU QD . . 4.770 3.562 3.481 3.649 . 0 0 "[ . 1 . 2 . ]" 1
2829 2 72 LEU H 2 73 ALA H . . 4.340 2.521 2.453 2.649 . 0 0 "[ . 1 . 2 . ]" 1
2830 2 72 LEU H 2 73 ALA MB . . 3.960 4.115 4.088 4.161 0.201 27 0 "[ . 1 . 2 . ]" 1
2831 2 72 LEU H 2 74 ARG H . . 4.340 3.499 3.448 3.616 . 0 0 "[ . 1 . 2 . ]" 1
2832 2 72 LEU QD 2 76 ILE HB . . 4.990 3.139 2.617 3.655 . 0 0 "[ . 1 . 2 . ]" 1
2833 2 72 LEU QD 2 76 ILE QG . . 4.660 2.576 1.962 3.241 . 0 0 "[ . 1 . 2 . ]" 1
2834 2 72 LEU QD 2 76 ILE MG . . 4.390 3.265 3.066 3.542 . 0 0 "[ . 1 . 2 . ]" 1
2835 2 72 LEU QD 2 73 ALA H . . 5.310 2.943 2.747 3.445 . 0 0 "[ . 1 . 2 . ]" 1
2836 2 72 LEU QD 2 73 ALA MB . . 5.120 3.061 2.690 3.583 . 0 0 "[ . 1 . 2 . ]" 1
2837 2 72 LEU QD 2 76 ILE MD . . 3.860 1.657 1.563 1.778 . 0 0 "[ . 1 . 2 . ]" 1
2838 2 73 ALA HA 2 74 ARG HA . . 4.840 4.726 4.704 4.761 . 0 0 "[ . 1 . 2 . ]" 1
2839 2 73 ALA HA 2 76 ILE HA . . 5.020 4.707 4.643 4.782 . 0 0 "[ . 1 . 2 . ]" 1
2840 2 73 ALA HA 2 76 ILE HB . . 4.340 1.933 1.869 1.982 . 0 0 "[ . 1 . 2 . ]" 1
2841 2 73 ALA HA 2 76 ILE MD . . 4.230 3.449 3.202 3.722 . 0 0 "[ . 1 . 2 . ]" 1
2842 2 73 ALA HA 2 76 ILE QG . . 5.490 3.747 3.556 3.872 . 0 0 "[ . 1 . 2 . ]" 1
2843 2 73 ALA HA 2 76 ILE MG . . 4.560 3.006 2.838 3.161 . 0 0 "[ . 1 . 2 . ]" 1
2844 2 73 ALA HA 2 77 SER H . . 5.000 2.567 2.250 2.832 . 0 0 "[ . 1 . 2 . ]" 1
2845 2 73 ALA H 2 73 ALA MB . . 3.490 2.022 1.937 2.142 . 0 0 "[ . 1 . 2 . ]" 1
2846 2 73 ALA H 2 74 ARG H . . 4.360 2.431 2.299 2.606 . 0 0 "[ . 1 . 2 . ]" 1
2847 2 73 ALA H 2 76 ILE HB . . 5.420 4.285 4.048 4.502 . 0 0 "[ . 1 . 2 . ]" 1
2848 2 73 ALA H 2 76 ILE MD . . 4.780 4.694 4.570 4.864 0.084 22 0 "[ . 1 . 2 . ]" 1
2849 2 73 ALA MB 2 74 ARG HG2 . . 4.230 4.025 3.677 4.292 0.062 19 0 "[ . 1 . 2 . ]" 1
2850 2 73 ALA MB 2 74 ARG H . . 4.050 3.101 2.952 3.155 . 0 0 "[ . 1 . 2 . ]" 1
2851 2 73 ALA MB 2 75 THR H . . 5.500 4.580 4.443 4.690 . 0 0 "[ . 1 . 2 . ]" 1
2852 2 74 ARG HA 2 74 ARG HD2 . . 4.880 3.921 2.734 4.624 . 0 0 "[ . 1 . 2 . ]" 1
2853 2 74 ARG HA 2 74 ARG HD3 . . 4.910 3.460 2.716 4.363 . 0 0 "[ . 1 . 2 . ]" 1
2854 2 74 ARG HA 2 74 ARG HG2 . . 3.890 2.179 2.082 2.300 . 0 0 "[ . 1 . 2 . ]" 1
2855 2 74 ARG HA 2 74 ARG HG3 . . 4.110 3.450 3.225 3.584 . 0 0 "[ . 1 . 2 . ]" 1
2856 2 74 ARG HB3 2 74 ARG HD3 . . 4.270 2.758 2.023 3.587 . 0 0 "[ . 1 . 2 . ]" 1
2857 2 74 ARG HB2 2 75 THR H . . 4.620 3.017 2.924 3.124 . 0 0 "[ . 1 . 2 . ]" 1
2858 2 74 ARG HG2 2 75 THR H . . 5.500 4.871 4.767 4.984 . 0 0 "[ . 1 . 2 . ]" 1
2859 2 74 ARG H 2 74 ARG HB3 . . 3.890 3.475 3.452 3.509 . 0 0 "[ . 1 . 2 . ]" 1
2860 2 74 ARG H 2 74 ARG HB2 . . 3.840 2.191 2.156 2.260 . 0 0 "[ . 1 . 2 . ]" 1
2861 2 74 ARG H 2 74 ARG HG2 . . 5.230 3.125 2.807 3.431 . 0 0 "[ . 1 . 2 . ]" 1
2862 2 74 ARG H 2 74 ARG HG3 . . 5.300 3.228 2.987 3.528 . 0 0 "[ . 1 . 2 . ]" 1
2863 2 74 ARG H 2 75 THR HB . . 5.170 4.813 4.672 5.085 . 0 0 "[ . 1 . 2 . ]" 1
2864 2 74 ARG H 2 75 THR H . . 4.510 2.524 2.470 2.598 . 0 0 "[ . 1 . 2 . ]" 1
2865 2 74 ARG H 2 76 ILE H . . 5.500 3.590 3.494 3.718 . 0 0 "[ . 1 . 2 . ]" 1
2866 2 74 ARG H 2 77 SER H . . 5.250 4.487 4.371 4.617 . 0 0 "[ . 1 . 2 . ]" 1
2867 2 75 THR HA 2 76 ILE HA . . 4.510 4.569 4.554 4.585 0.075 1 0 "[ . 1 . 2 . ]" 1
2868 2 75 THR HA 2 78 GLU H . . 5.090 3.852 3.789 3.923 . 0 0 "[ . 1 . 2 . ]" 1
2869 2 75 THR HB 2 76 ILE HA . . 5.250 4.591 4.435 4.723 . 0 0 "[ . 1 . 2 . ]" 1
2870 2 75 THR HB 2 76 ILE HB . . 5.290 4.947 4.857 5.043 . 0 0 "[ . 1 . 2 . ]" 1
2871 2 75 THR HB 2 76 ILE H . . 4.790 3.461 3.408 3.507 . 0 0 "[ . 1 . 2 . ]" 1
2872 2 75 THR HB 2 78 GLU QG . . 5.220 4.615 4.370 5.011 . 0 0 "[ . 1 . 2 . ]" 1
2873 2 75 THR H 2 75 THR HB . . 4.200 2.501 2.399 2.693 . 0 0 "[ . 1 . 2 . ]" 1
2874 2 75 THR H 2 76 ILE HA . . 5.500 4.653 4.627 4.701 . 0 0 "[ . 1 . 2 . ]" 1
2875 2 75 THR H 2 76 ILE H . . 5.090 2.074 2.044 2.112 . 0 0 "[ . 1 . 2 . ]" 1
2876 2 75 THR H 2 76 ILE MD . . 5.500 5.059 4.934 5.158 . 0 0 "[ . 1 . 2 . ]" 1
2877 2 75 THR H 2 77 SER H . . 3.950 4.031 3.971 4.081 0.131 21 0 "[ . 1 . 2 . ]" 1
2878 2 75 THR MG 2 77 SER H . . 5.740 5.838 5.762 5.985 0.245 22 0 "[ . 1 . 2 . ]" 1
2879 2 76 ILE HA 2 76 ILE MD . . 3.980 3.671 3.605 3.716 . 0 0 "[ . 1 . 2 . ]" 1
2880 2 76 ILE HA 2 76 ILE MG . . 3.630 2.568 2.533 2.613 . 0 0 "[ . 1 . 2 . ]" 1
2881 2 76 ILE HA 2 77 SER HA . . 5.080 4.850 4.827 4.879 . 0 0 "[ . 1 . 2 . ]" 1
2882 2 76 ILE HA 2 79 ALA HA . . 4.950 4.946 4.726 5.064 0.114 19 0 "[ . 1 . 2 . ]" 1
2883 2 76 ILE HB 2 76 ILE MD . . 3.650 2.422 2.357 2.515 . 0 0 "[ . 1 . 2 . ]" 1
2884 2 76 ILE HB 2 77 SER QB . . 5.040 4.334 4.231 4.526 . 0 0 "[ . 1 . 2 . ]" 1
2885 2 76 ILE HB 2 77 SER H . . 3.850 2.600 2.537 2.666 . 0 0 "[ . 1 . 2 . ]" 1
2886 2 76 ILE HB 2 78 GLU H . . 4.660 4.822 4.783 4.913 0.253 1 0 "[ . 1 . 2 . ]" 1
2887 2 76 ILE H 2 76 ILE HB . . 3.770 2.262 2.227 2.292 . 0 0 "[ . 1 . 2 . ]" 1
2888 2 76 ILE H 2 76 ILE MD . . 4.860 4.089 4.029 4.170 . 0 0 "[ . 1 . 2 . ]" 1
2889 2 76 ILE H 2 76 ILE QG . . 4.960 2.890 2.803 2.979 . 0 0 "[ . 1 . 2 . ]" 1
2890 2 76 ILE H 2 77 SER H . . 3.910 2.309 2.253 2.363 . 0 0 "[ . 1 . 2 . ]" 1
2891 2 76 ILE MD 2 77 SER H . . 4.810 4.613 4.551 4.663 . 0 0 "[ . 1 . 2 . ]" 1
2892 2 76 ILE MD 2 76 ILE MG . . 2.870 1.819 1.771 1.870 . 0 0 "[ . 1 . 2 . ]" 1
2893 2 76 ILE MG 2 77 SER HA . . 4.380 3.204 3.137 3.292 . 0 0 "[ . 1 . 2 . ]" 1
2894 2 76 ILE MG 2 77 SER QB . . 4.700 3.978 3.857 4.124 . 0 0 "[ . 1 . 2 . ]" 1
2895 2 76 ILE MG 2 78 GLU QG . . 4.750 4.445 4.384 4.537 . 0 0 "[ . 1 . 2 . ]" 1
2896 2 76 ILE MG 2 79 ALA HA . . 5.170 5.306 5.196 5.413 0.243 8 0 "[ . 1 . 2 . ]" 1
2897 2 76 ILE MG 2 79 ALA MB . . 5.290 2.852 2.721 2.939 . 0 0 "[ . 1 . 2 . ]" 1
2898 2 77 SER HA 2 78 GLU QG . . 4.850 4.756 4.641 4.944 0.094 18 0 "[ . 1 . 2 . ]" 1
2899 2 77 SER QB 2 78 GLU H . . 4.000 3.066 2.742 3.623 . 0 0 "[ . 1 . 2 . ]" 1
2900 2 77 SER H 2 77 SER QB . . 3.390 2.237 2.175 2.410 . 0 0 "[ . 1 . 2 . ]" 1
2901 2 77 SER H 2 78 GLU H . . 4.340 2.864 2.833 2.900 . 0 0 "[ . 1 . 2 . ]" 1
2902 2 77 SER H 2 79 ALA H . . 5.500 4.227 4.119 4.408 . 0 0 "[ . 1 . 2 . ]" 1
2903 2 78 GLU HA 2 82 ALA H . . 4.180 3.419 1.945 4.031 . 0 0 "[ . 1 . 2 . ]" 1
2904 2 78 GLU HA 2 90 VAL QG . . 4.600 4.138 2.809 4.632 0.032 15 0 "[ . 1 . 2 . ]" 1
2905 2 78 GLU QG 2 79 ALA HA . . 5.150 3.668 3.174 4.004 . 0 0 "[ . 1 . 2 . ]" 1
2906 2 78 GLU QG 2 79 ALA MB . . 5.210 3.537 3.191 3.802 . 0 0 "[ . 1 . 2 . ]" 1
2907 2 78 GLU QG 2 90 VAL QG . . 5.040 4.076 2.461 4.712 . 0 0 "[ . 1 . 2 . ]" 1
2908 2 78 GLU QG 2 94 PHE QE . . 5.500 4.571 3.309 5.264 . 0 0 "[ . 1 . 2 . ]" 1
2909 2 78 GLU H 2 78 GLU QG . . 4.800 1.852 1.785 2.007 . 0 0 "[ . 1 . 2 . ]" 1
2910 2 78 GLU H 2 79 ALA H . . 4.810 2.609 2.524 2.704 . 0 0 "[ . 1 . 2 . ]" 1
2911 2 78 GLU H 2 79 ALA MB . . 5.500 4.198 4.041 4.299 . 0 0 "[ . 1 . 2 . ]" 1
2912 2 78 GLU H 2 80 GLY H . . 5.500 4.358 4.128 5.094 . 0 0 "[ . 1 . 2 . ]" 1
2913 2 78 GLU QB 2 79 ALA HA . . 4.880 4.346 4.220 4.536 . 0 0 "[ . 1 . 2 . ]" 1
2914 2 78 GLU QB 2 79 ALA MB . . 4.730 4.763 4.668 4.894 0.164 22 0 "[ . 1 . 2 . ]" 1
2915 2 78 GLU QB 2 82 ALA HA . . 5.000 4.320 3.661 4.637 . 0 0 "[ . 1 . 2 . ]" 1
2916 2 78 GLU QB 2 82 ALA H . . 4.240 3.780 2.392 4.218 . 0 0 "[ . 1 . 2 . ]" 1
2917 2 78 GLU QB 2 82 ALA MB . . 4.600 1.829 1.729 2.022 . 0 0 "[ . 1 . 2 . ]" 1
2918 2 78 GLU QB 2 90 VAL QG . . 5.010 2.831 2.252 3.747 . 0 0 "[ . 1 . 2 . ]" 1
2919 2 78 GLU QB 2 94 PHE QE . . 5.190 3.149 2.012 4.288 . 0 0 "[ . 1 . 2 . ]" 1
2920 2 80 GLY H 2 81 GLN H . . 4.550 3.326 2.278 3.516 . 0 0 "[ . 1 . 2 . ]" 1
2921 2 81 GLN HA 2 81 GLN HG2 . . 4.090 2.869 1.967 3.775 . 0 0 "[ . 1 . 2 . ]" 1
2922 2 81 GLN HA 2 81 GLN HG3 . . 3.870 2.638 2.008 3.621 . 0 0 "[ . 1 . 2 . ]" 1
2923 2 81 GLN HB2 2 82 ALA HA . . 5.260 4.947 4.311 5.695 0.435 27 0 "[ . 1 . 2 . ]" 1
2924 2 81 GLN HB2 2 82 ALA H . . 5.310 3.327 2.830 4.163 . 0 0 "[ . 1 . 2 . ]" 1
2925 2 81 GLN H 2 81 GLN HB3 . . 4.060 3.315 2.659 3.682 . 0 0 "[ . 1 . 2 . ]" 1
2926 2 81 GLN H 2 81 GLN HG2 . . 4.690 4.361 2.478 4.862 0.172 19 0 "[ . 1 . 2 . ]" 1
2927 2 81 GLN H 2 82 ALA H . . 4.530 1.947 1.820 2.642 . 0 0 "[ . 1 . 2 . ]" 1
2928 2 82 ALA HA 2 83 MET HA . . 4.640 4.838 4.707 4.916 0.276 16 0 "[ . 1 . 2 . ]" 1
2929 2 82 ALA HA 2 84 ALA H . . 4.830 3.821 3.186 4.140 . 0 0 "[ . 1 . 2 . ]" 1
2930 2 82 ALA HA 2 84 ALA MB . . 4.690 4.708 4.380 4.911 0.221 26 0 "[ . 1 . 2 . ]" 1
2931 2 82 ALA HA 2 85 SER HA . . 5.160 4.867 4.455 5.144 . 0 0 "[ . 1 . 2 . ]" 1
2932 2 82 ALA HA 2 94 PHE QE . . 4.720 4.581 2.800 4.877 0.157 15 0 "[ . 1 . 2 . ]" 1
2933 2 82 ALA MB 2 83 MET HA . . 5.500 3.692 3.550 4.223 . 0 0 "[ . 1 . 2 . ]" 1
2934 2 82 ALA MB 2 85 SER HA . . 5.970 5.869 4.379 6.169 0.199 14 0 "[ . 1 . 2 . ]" 1
2935 2 82 ALA MB 2 85 SER HB2 . . 5.500 4.022 3.579 5.241 . 0 0 "[ . 1 . 2 . ]" 1
2936 2 82 ALA MB 2 85 SER HB3 . . 5.140 5.119 4.814 5.591 0.451 16 0 "[ . 1 . 2 . ]" 1
2937 2 82 ALA MB 2 94 PHE QD . . 5.200 3.825 2.426 4.896 . 0 0 "[ . 1 . 2 . ]" 1
2938 2 82 ALA MB 2 94 PHE QE . . 4.620 2.502 1.900 3.450 . 0 0 "[ . 1 . 2 . ]" 1
2939 2 83 MET HA 2 83 MET HG2 . . 4.100 2.739 2.251 3.813 . 0 0 "[ . 1 . 2 . ]" 1
2940 2 83 MET HA 2 83 MET HG3 . . 3.850 3.266 2.137 3.682 . 0 0 "[ . 1 . 2 . ]" 1
2941 2 83 MET HB2 2 84 ALA H . . 4.750 3.827 3.083 4.187 . 0 0 "[ . 1 . 2 . ]" 1
2942 2 83 MET H 2 83 MET HG2 . . 5.160 4.170 3.207 4.596 . 0 0 "[ . 1 . 2 . ]" 1
2943 2 83 MET H 2 83 MET HG3 . . 5.330 4.337 3.113 4.606 . 0 0 "[ . 1 . 2 . ]" 1
2944 2 83 MET H 2 84 ALA H . . 4.580 2.929 2.578 3.059 . 0 0 "[ . 1 . 2 . ]" 1
2945 2 84 ALA H 2 84 ALA MB . . 3.670 2.188 1.992 2.310 . 0 0 "[ . 1 . 2 . ]" 1
2946 2 85 SER HA 2 86 THR HB . . 4.690 4.327 3.924 4.689 . 0 0 "[ . 1 . 2 . ]" 1
2947 2 85 SER HB2 2 86 THR HA . . 4.780 4.664 4.481 4.802 0.022 15 0 "[ . 1 . 2 . ]" 1
2948 2 85 SER HB2 2 86 THR HB . . 4.780 4.480 3.848 4.855 0.075 21 0 "[ . 1 . 2 . ]" 1
2949 2 85 SER HB3 2 86 THR HA . . 4.840 4.662 4.373 4.853 0.013 8 0 "[ . 1 . 2 . ]" 1
2950 2 85 SER HB3 2 86 THR HB . . 4.580 3.512 3.224 4.009 . 0 0 "[ . 1 . 2 . ]" 1
2951 2 88 GLY HA2 2 89 ASN HA . . 5.180 4.422 4.305 4.644 . 0 0 "[ . 1 . 2 . ]" 1
2952 2 89 ASN HA 2 90 VAL HA . . 5.500 4.698 4.611 4.858 . 0 0 "[ . 1 . 2 . ]" 1
2953 2 90 VAL HB 2 93 MET H . . 4.890 4.358 2.706 5.209 0.319 15 0 "[ . 1 . 2 . ]" 1
2954 2 90 VAL QG 2 93 MET H . . 5.500 3.567 1.910 4.901 . 0 0 "[ . 1 . 2 . ]" 1
2955 2 91 THR HA 2 91 THR MG . . 3.540 2.668 2.228 3.246 . 0 0 "[ . 1 . 2 . ]" 1
2956 2 92 GLY HA3 2 93 MET HA . . 5.100 4.680 4.506 4.851 . 0 0 "[ . 1 . 2 . ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 72
_Distance_constraint_stats_list.Viol_count 463
_Distance_constraint_stats_list.Viol_total 1025.821
_Distance_constraint_stats_list.Viol_max 0.296
_Distance_constraint_stats_list.Viol_rms 0.0426
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0182
_Distance_constraint_stats_list.Viol_average_violations_only 0.0791
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 17 PHE 0.032 0.032 16 0 "[ . 1 . 2 . ]"
1 18 GLU 0.382 0.059 13 0 "[ . 1 . 2 . ]"
1 19 ARG 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 20 ILE 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 21 SER 1.117 0.122 15 0 "[ . 1 . 2 . ]"
1 22 GLY 0.382 0.059 13 0 "[ . 1 . 2 . ]"
1 23 ASP 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 24 LEU 1.749 0.107 23 0 "[ . 1 . 2 . ]"
1 25 LYS 1.085 0.122 15 0 "[ . 1 . 2 . ]"
1 26 THR 0.759 0.101 6 0 "[ . 1 . 2 . ]"
1 27 GLN 0.624 0.101 13 0 "[ . 1 . 2 . ]"
1 28 ILE 1.756 0.107 23 0 "[ . 1 . 2 . ]"
1 29 ASP 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 30 GLN 0.759 0.101 6 0 "[ . 1 . 2 . ]"
1 31 VAL 0.624 0.101 13 0 "[ . 1 . 2 . ]"
1 32 GLU 0.006 0.004 28 0 "[ . 1 . 2 . ]"
1 53 ALA 0.552 0.081 4 0 "[ . 1 . 2 . ]"
1 54 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 56 ARG 4.846 0.238 13 0 "[ . 1 . 2 . ]"
1 57 PHE 0.552 0.081 4 0 "[ . 1 . 2 . ]"
1 58 GLN 0.000 0.000 . 0 "[ . 1 . 2 . ]"
1 60 ALA 5.460 0.238 13 0 "[ . 1 . 2 . ]"
1 61 ALA 0.144 0.059 25 0 "[ . 1 . 2 . ]"
1 63 LYS 5.438 0.185 10 0 "[ . 1 . 2 . ]"
1 64 GLN 0.738 0.141 15 0 "[ . 1 . 2 . ]"
1 65 LYS 0.144 0.059 25 0 "[ . 1 . 2 . ]"
1 67 GLU 10.880 0.296 5 0 "[ . 1 . 2 . ]"
1 68 LEU 0.125 0.117 12 0 "[ . 1 . 2 . ]"
1 71 ILE 5.443 0.296 5 0 "[ . 1 . 2 . ]"
2 24 SER 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 25 ILE 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 27 SER 0.057 0.031 27 0 "[ . 1 . 2 . ]"
2 28 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 29 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 31 GLU 0.057 0.031 27 0 "[ . 1 . 2 . ]"
2 32 GLY 1.103 0.206 18 0 "[ . 1 . 2 . ]"
2 33 LYS 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 35 SER 0.030 0.030 1 0 "[ . 1 . 2 . ]"
2 36 LEU 1.072 0.206 18 0 "[ . 1 . 2 . ]"
2 39 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 58 TRP 4.062 0.227 12 0 "[ . 1 . 2 . ]"
2 59 ASP 1.687 0.143 18 0 "[ . 1 . 2 . ]"
2 61 THR 0.067 0.067 20 0 "[ . 1 . 2 . ]"
2 62 ALA 4.062 0.227 12 0 "[ . 1 . 2 . ]"
2 63 THR 1.687 0.143 18 0 "[ . 1 . 2 . ]"
2 64 GLU 5.899 0.257 10 0 "[ . 1 . 2 . ]"
2 65 LEU 1.043 0.104 5 0 "[ . 1 . 2 . ]"
2 66 ASN 0.987 0.101 13 0 "[ . 1 . 2 . ]"
2 67 ASN 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 68 ALA 5.899 0.257 10 0 "[ . 1 . 2 . ]"
2 69 LEU 0.976 0.104 5 0 "[ . 1 . 2 . ]"
2 70 GLN 0.987 0.101 13 0 "[ . 1 . 2 . ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 17 PHE O 1 21 SER H . . 2.000 1.901 1.786 2.032 0.032 16 0 "[ . 1 . 2 . ]" 2
2 1 17 PHE O 1 21 SER N . . 3.000 2.834 2.729 2.935 . 0 0 "[ . 1 . 2 . ]" 2
3 1 18 GLU O 1 22 GLY H . . 2.000 1.945 1.788 2.059 0.059 13 0 "[ . 1 . 2 . ]" 2
4 1 18 GLU O 1 22 GLY N . . 3.000 2.917 2.774 3.040 0.040 25 0 "[ . 1 . 2 . ]" 2
5 1 19 ARG O 1 23 ASP H . . 2.000 1.782 1.696 1.872 . 0 0 "[ . 1 . 2 . ]" 2
6 1 19 ARG O 1 23 ASP N . . 3.000 2.762 2.678 2.871 . 0 0 "[ . 1 . 2 . ]" 2
7 1 20 ILE O 1 24 LEU H . . 2.000 1.713 1.610 1.813 . 0 0 "[ . 1 . 2 . ]" 2
8 1 20 ILE O 1 24 LEU N . . 3.000 2.641 2.562 2.703 . 0 0 "[ . 1 . 2 . ]" 2
9 1 21 SER O 1 25 LYS H . . 2.000 2.003 1.748 2.122 0.122 15 0 "[ . 1 . 2 . ]" 2
10 1 21 SER O 1 25 LYS N . . 3.000 2.896 2.693 3.007 0.007 23 0 "[ . 1 . 2 . ]" 2
11 1 23 ASP O 1 27 GLN H . . 2.000 1.853 1.725 1.970 . 0 0 "[ . 1 . 2 . ]" 2
12 1 23 ASP O 1 27 GLN N . . 3.000 2.808 2.683 2.921 . 0 0 "[ . 1 . 2 . ]" 2
13 1 24 LEU O 1 28 ILE H . . 2.000 2.036 1.940 2.107 0.107 23 0 "[ . 1 . 2 . ]" 2
14 1 24 LEU O 1 28 ILE N . . 3.000 3.006 2.902 3.094 0.094 23 0 "[ . 1 . 2 . ]" 2
15 1 25 LYS O 1 29 ASP H . . 2.000 1.807 1.687 1.996 . 0 0 "[ . 1 . 2 . ]" 2
16 1 25 LYS O 1 29 ASP N . . 3.000 2.765 2.655 2.916 . 0 0 "[ . 1 . 2 . ]" 2
17 1 26 THR O 1 30 GLN H . . 2.000 2.010 1.884 2.101 0.101 6 0 "[ . 1 . 2 . ]" 2
18 1 26 THR O 1 30 GLN N . . 3.000 2.902 2.796 3.011 0.011 6 0 "[ . 1 . 2 . ]" 2
19 1 27 GLN O 1 31 VAL H . . 2.000 1.982 1.752 2.101 0.101 13 0 "[ . 1 . 2 . ]" 2
20 1 27 GLN O 1 31 VAL N . . 3.000 2.905 2.715 3.038 0.038 13 0 "[ . 1 . 2 . ]" 2
21 1 28 ILE O 1 32 GLU H . . 2.000 1.864 1.750 2.004 0.004 28 0 "[ . 1 . 2 . ]" 2
22 1 28 ILE O 1 32 GLU N . . 3.000 2.856 2.749 2.998 . 0 0 "[ . 1 . 2 . ]" 2
23 1 53 ALA O 1 57 PHE H . . 2.000 1.872 1.615 2.081 0.081 4 0 "[ . 1 . 2 . ]" 2
24 1 53 ALA O 1 57 PHE N . . 3.000 2.838 2.615 3.021 0.021 3 0 "[ . 1 . 2 . ]" 2
25 1 54 VAL O 1 58 GLN H . . 2.000 1.639 1.485 1.750 . 0 0 "[ . 1 . 2 . ]" 2
26 1 54 VAL O 1 58 GLN N . . 3.000 2.570 2.468 2.704 . 0 0 "[ . 1 . 2 . ]" 2
27 1 56 ARG O 1 60 ALA H . . 2.000 2.158 2.071 2.238 0.238 13 0 "[ . 1 . 2 . ]" 2
28 1 56 ARG O 1 60 ALA N . . 3.000 2.989 2.866 3.094 0.094 13 0 "[ . 1 . 2 . ]" 2
29 1 57 PHE O 1 61 ALA H . . 2.000 1.881 1.767 1.983 . 0 0 "[ . 1 . 2 . ]" 2
30 1 57 PHE O 1 61 ALA N . . 3.000 2.619 2.500 2.738 . 0 0 "[ . 1 . 2 . ]" 2
31 1 60 ALA O 1 64 GLN H . . 2.000 1.961 1.748 2.141 0.141 15 0 "[ . 1 . 2 . ]" 2
32 1 60 ALA O 1 64 GLN N . . 3.000 2.830 2.638 2.962 . 0 0 "[ . 1 . 2 . ]" 2
33 1 61 ALA O 1 65 LYS H . . 2.000 1.839 1.714 2.059 0.059 25 0 "[ . 1 . 2 . ]" 2
34 1 61 ALA O 1 65 LYS N . . 3.000 2.732 2.564 3.030 0.030 25 0 "[ . 1 . 2 . ]" 2
35 1 63 LYS O 1 67 GLU H . . 2.000 2.105 2.014 2.185 0.185 10 0 "[ . 1 . 2 . ]" 2
36 1 63 LYS O 1 67 GLU N . . 3.000 3.090 3.006 3.170 0.170 20 0 "[ . 1 . 2 . ]" 2
37 1 64 GLN O 1 68 LEU H . . 2.000 1.861 1.740 2.117 0.117 12 0 "[ . 1 . 2 . ]" 2
38 1 64 GLN O 1 68 LEU N . . 3.000 2.660 2.572 2.954 . 0 0 "[ . 1 . 2 . ]" 2
39 1 67 GLU O 1 71 ILE H . . 2.000 2.137 2.060 2.296 0.296 5 0 "[ . 1 . 2 . ]" 2
40 1 67 GLU O 1 71 ILE N . . 3.000 3.054 2.956 3.168 0.168 5 0 "[ . 1 . 2 . ]" 2
41 2 24 SER O 2 28 LEU H . . 2.000 1.715 1.630 1.825 . 0 0 "[ . 1 . 2 . ]" 2
42 2 24 SER O 2 28 LEU N . . 3.000 2.655 2.605 2.713 . 0 0 "[ . 1 . 2 . ]" 2
43 2 25 ILE O 2 29 LEU H . . 2.000 1.876 1.729 1.984 . 0 0 "[ . 1 . 2 . ]" 2
44 2 25 ILE O 2 29 LEU N . . 3.000 2.861 2.725 2.936 . 0 0 "[ . 1 . 2 . ]" 2
45 2 27 SER O 2 31 GLU H . . 2.000 1.853 1.531 2.031 0.031 27 0 "[ . 1 . 2 . ]" 2
46 2 27 SER O 2 31 GLU N . . 3.000 2.647 2.486 2.828 . 0 0 "[ . 1 . 2 . ]" 2
47 2 28 LEU O 2 32 GLY H . . 2.000 1.796 1.666 1.997 . 0 0 "[ . 1 . 2 . ]" 2
48 2 28 LEU O 2 32 GLY N . . 3.000 2.722 2.606 2.906 . 0 0 "[ . 1 . 2 . ]" 2
49 2 29 LEU O 2 33 LYS H . . 2.000 1.696 1.552 1.789 . 0 0 "[ . 1 . 2 . ]" 2
50 2 29 LEU O 2 33 LYS N . . 3.000 2.638 2.507 2.719 . 0 0 "[ . 1 . 2 . ]" 2
51 2 32 GLY O 2 35 SER H . . 2.000 1.825 1.727 2.030 0.030 1 0 "[ . 1 . 2 . ]" 2
52 2 32 GLY O 2 35 SER N . . 3.000 2.617 2.511 2.684 . 0 0 "[ . 1 . 2 . ]" 2
53 2 32 GLY O 2 36 LEU H . . 2.000 2.001 1.804 2.206 0.206 18 0 "[ . 1 . 2 . ]" 2
54 2 32 GLY O 2 36 LEU N . . 3.000 2.796 2.676 2.939 . 0 0 "[ . 1 . 2 . ]" 2
55 2 35 SER O 2 39 LEU H . . 2.000 1.683 1.536 1.809 . 0 0 "[ . 1 . 2 . ]" 2
56 2 35 SER O 2 39 LEU N . . 3.000 2.467 2.419 2.539 . 0 0 "[ . 1 . 2 . ]" 2
57 2 58 TRP O 2 62 ALA H . . 2.000 2.141 2.053 2.227 0.227 12 0 "[ . 1 . 2 . ]" 2
58 2 58 TRP O 2 62 ALA N . . 3.000 2.934 2.806 3.070 0.070 4 0 "[ . 1 . 2 . ]" 2
59 2 59 ASP O 2 63 THR H . . 2.000 2.048 1.838 2.143 0.143 18 0 "[ . 1 . 2 . ]" 2
60 2 59 ASP O 2 63 THR N . . 3.000 2.909 2.613 3.007 0.007 26 0 "[ . 1 . 2 . ]" 2
61 2 61 THR O 2 65 LEU H . . 2.000 1.837 1.729 2.067 0.067 20 0 "[ . 1 . 2 . ]" 2
62 2 61 THR O 2 65 LEU N . . 3.000 2.752 2.656 2.976 . 0 0 "[ . 1 . 2 . ]" 2
63 2 62 ALA O 2 66 ASN H . . 2.000 1.747 1.680 1.803 . 0 0 "[ . 1 . 2 . ]" 2
64 2 62 ALA O 2 66 ASN N . . 3.000 2.691 2.656 2.772 . 0 0 "[ . 1 . 2 . ]" 2
65 2 63 THR O 2 67 ASN H . . 2.000 1.658 1.602 1.778 . 0 0 "[ . 1 . 2 . ]" 2
66 2 63 THR O 2 67 ASN N . . 3.000 2.626 2.585 2.698 . 0 0 "[ . 1 . 2 . ]" 2
67 2 64 GLU O 2 68 ALA H . . 2.000 2.136 2.071 2.257 0.257 10 0 "[ . 1 . 2 . ]" 2
68 2 64 GLU O 2 68 ALA N . . 3.000 3.074 3.038 3.141 0.141 22 0 "[ . 1 . 2 . ]" 2
69 2 65 LEU O 2 69 LEU H . . 2.000 1.937 1.528 2.104 0.104 5 0 "[ . 1 . 2 . ]" 2
70 2 65 LEU O 2 69 LEU N . . 3.000 2.830 2.512 2.990 . 0 0 "[ . 1 . 2 . ]" 2
71 2 66 ASN O 2 70 GLN H . . 2.000 2.017 1.916 2.101 0.101 13 0 "[ . 1 . 2 . ]" 2
72 2 66 ASN O 2 70 GLN N . . 3.000 2.931 2.831 3.050 0.050 13 0 "[ . 1 . 2 . ]" 2
stop_
save_
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