NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
391618 |
1pe3   |
5771 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1pe3
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 2189
_Distance_constraint_stats_list.Viol_count 11385
_Distance_constraint_stats_list.Viol_total 65777.172
_Distance_constraint_stats_list.Viol_max 1.851
_Distance_constraint_stats_list.Viol_rms 0.0668
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0136
_Distance_constraint_stats_list.Viol_average_violations_only 0.1229
_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 7.991 0.357 20 0 "[ . 1 . 2 . 3 . 4 . ]"
1 3 TYR 20.221 0.402 46 0 "[ . 1 . 2 . 3 . 4 . ]"
1 4 VAL 22.344 0.316 33 0 "[ . 1 . 2 . 3 . 4 . ]"
1 6 LEU 22.419 0.402 46 0 "[ . 1 . 2 . 3 . 4 . ]"
1 7 SER 14.107 0.327 27 0 "[ . 1 . 2 . 3 . 4 . ]"
1 8 ALA 4.765 0.329 35 0 "[ . 1 . 2 . 3 . 4 . ]"
1 9 ASN 0.466 0.059 19 0 "[ . 1 . 2 . 3 . 4 . ]"
1 10 GLN 21.347 0.327 27 0 "[ . 1 . 2 . 3 . 4 . ]"
1 11 CYS 28.816 0.293 40 0 "[ . 1 . 2 . 3 . 4 . ]"
1 12 ALA 20.518 0.329 35 0 "[ . 1 . 2 . 3 . 4 . ]"
1 13 VAL 21.636 0.410 5 0 "[ . 1 . 2 . 3 . 4 . ]"
1 14 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . ]"
1 15 ALA 0.503 0.084 44 0 "[ . 1 . 2 . 3 . 4 . ]"
1 16 LYS 5.830 0.180 19 0 "[ . 1 . 2 . 3 . 4 . ]"
1 17 ASP 9.403 0.244 28 0 "[ . 1 . 2 . 3 . 4 . ]"
1 18 ARG 29.004 0.282 25 0 "[ . 1 . 2 . 3 . 4 . ]"
1 19 VAL 4.338 0.078 30 0 "[ . 1 . 2 . 3 . 4 . ]"
1 20 ASP 24.920 0.262 46 0 "[ . 1 . 2 . 3 . 4 . ]"
1 21 CYS 32.430 0.487 28 0 "[ . 1 . 2 . 3 . 4 . ]"
1 22 GLY 7.509 0.197 38 0 "[ . 1 . 2 . 3 . 4 . ]"
1 23 TYR 1.928 0.090 46 0 "[ . 1 . 2 . 3 . 4 . ]"
1 24 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . ]"
1 25 HIS 5.189 0.278 45 0 "[ . 1 . 2 . 3 . 4 . ]"
1 26 VAL 12.953 0.304 30 0 "[ . 1 . 2 . 3 . 4 . ]"
1 27 THR 36.482 0.318 11 0 "[ . 1 . 2 . 3 . 4 . ]"
1 28 PRO 0.023 0.019 37 0 "[ . 1 . 2 . 3 . 4 . ]"
1 29 LYS 12.876 0.304 45 0 "[ . 1 . 2 . 3 . 4 . ]"
1 30 GLU 44.584 0.318 11 0 "[ . 1 . 2 . 3 . 4 . ]"
1 31 CYS 26.431 0.274 42 0 "[ . 1 . 2 . 3 . 4 . ]"
1 32 ASN 38.674 0.375 42 0 "[ . 1 . 2 . 3 . 4 . ]"
1 33 ASN 20.032 0.240 24 0 "[ . 1 . 2 . 3 . 4 . ]"
1 34 ARG 55.349 0.304 45 0 "[ . 1 . 2 . 3 . 4 . ]"
1 35 GLY 41.478 0.295 4 0 "[ . 1 . 2 . 3 . 4 . ]"
1 36 CYS 52.125 0.487 28 0 "[ . 1 . 2 . 3 . 4 . ]"
1 37 CYS 47.545 0.276 40 0 "[ . 1 . 2 . 3 . 4 . ]"
1 38 PHE 31.290 0.375 42 0 "[ . 1 . 2 . 3 . 4 . ]"
1 39 ASP 140.645 1.851 46 27 "[****-** ** ** *****2 . * **** .* * 4** .+*]"
1 40 SER 17.907 0.263 17 0 "[ . 1 . 2 . 3 . 4 . ]"
1 41 ARG 50.191 0.910 46 27 "[****-** ** ** *****2 . * **** .* * 4** .+*]"
1 42 ILE 127.977 1.851 46 27 "[***-*** ** ** *****2 . * **** .* * 4** .+*]"
1 43 PRO 6.186 0.127 15 0 "[ . 1 . 2 . 3 . 4 . ]"
1 44 GLY 15.328 0.255 31 0 "[ . 1 . 2 . 3 . 4 . ]"
1 45 VAL 43.217 0.281 41 0 "[ . 1 . 2 . 3 . 4 . ]"
1 46 PRO 8.171 0.237 22 0 "[ . 1 . 2 . 3 . 4 . ]"
1 47 TRP 18.392 0.321 26 0 "[ . 1 . 2 . 3 . 4 . ]"
1 48 CYS 22.675 0.237 22 0 "[ . 1 . 2 . 3 . 4 . ]"
1 49 PHE 42.259 0.223 28 0 "[ . 1 . 2 . 3 . 4 . ]"
1 50 LYS 13.323 0.223 28 0 "[ . 1 . 2 . 3 . 4 . ]"
1 51 PRO 17.837 0.410 5 0 "[ . 1 . 2 . 3 . 4 . ]"
1 52 LEU 11.953 0.159 44 0 "[ . 1 . 2 . 3 . 4 . ]"
1 53 GLN 7.867 0.183 15 0 "[ . 1 . 2 . 3 . 4 . ]"
1 54 GLU 3.756 0.265 10 0 "[ . 1 . 2 . 3 . 4 . ]"
1 55 ALA 4.518 0.108 38 0 "[ . 1 . 2 . 3 . 4 . ]"
1 56 GLU 0.570 0.149 40 0 "[ . 1 . 2 . 3 . 4 . ]"
1 57 CYS 19.184 0.380 11 0 "[ . 1 . 2 . 3 . 4 . ]"
1 58 THR 8.541 0.380 11 0 "[ . 1 . 2 . 3 . 4 . ]"
1 59 PHE 12.441 0.219 24 0 "[ . 1 . 2 . 3 . 4 . ]"
2 2 GLU 2.316 0.186 38 0 "[ . 1 . 2 . 3 . 4 . ]"
2 3 TYR 16.069 0.344 8 0 "[ . 1 . 2 . 3 . 4 . ]"
2 4 VAL 19.528 0.323 34 0 "[ . 1 . 2 . 3 . 4 . ]"
2 6 LEU 19.080 0.344 8 0 "[ . 1 . 2 . 3 . 4 . ]"
2 7 SER 16.080 0.376 21 0 "[ . 1 . 2 . 3 . 4 . ]"
2 8 ALA 5.935 0.319 43 0 "[ . 1 . 2 . 3 . 4 . ]"
2 9 ASN 0.406 0.115 21 0 "[ . 1 . 2 . 3 . 4 . ]"
2 10 GLN 21.545 0.376 21 0 "[ . 1 . 2 . 3 . 4 . ]"
2 11 CYS 29.610 0.291 35 0 "[ . 1 . 2 . 3 . 4 . ]"
2 12 ALA 24.014 0.319 43 0 "[ . 1 . 2 . 3 . 4 . ]"
2 13 VAL 16.165 0.378 43 0 "[ . 1 . 2 . 3 . 4 . ]"
2 14 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . ]"
2 15 ALA 0.566 0.091 33 0 "[ . 1 . 2 . 3 . 4 . ]"
2 16 LYS 5.715 0.231 33 0 "[ . 1 . 2 . 3 . 4 . ]"
2 17 ASP 9.633 0.268 16 0 "[ . 1 . 2 . 3 . 4 . ]"
2 18 ARG 27.765 0.317 32 0 "[ . 1 . 2 . 3 . 4 . ]"
2 19 VAL 3.571 0.094 16 0 "[ . 1 . 2 . 3 . 4 . ]"
2 20 ASP 24.550 0.246 34 0 "[ . 1 . 2 . 3 . 4 . ]"
2 21 CYS 33.169 0.430 23 0 "[ . 1 . 2 . 3 . 4 . ]"
2 22 GLY 6.498 0.236 47 0 "[ . 1 . 2 . 3 . 4 . ]"
2 23 TYR 1.879 0.091 1 0 "[ . 1 . 2 . 3 . 4 . ]"
2 24 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . ]"
2 25 HIS 4.631 0.190 37 0 "[ . 1 . 2 . 3 . 4 . ]"
2 26 VAL 13.758 0.336 28 0 "[ . 1 . 2 . 3 . 4 . ]"
2 27 THR 49.242 0.347 45 0 "[ . 1 . 2 . 3 . 4 . ]"
2 28 PRO 0.092 0.060 43 0 "[ . 1 . 2 . 3 . 4 . ]"
2 29 LYS 25.109 0.321 10 0 "[ . 1 . 2 . 3 . 4 . ]"
2 30 GLU 46.001 0.347 45 0 "[ . 1 . 2 . 3 . 4 . ]"
2 31 CYS 27.507 0.279 19 0 "[ . 1 . 2 . 3 . 4 . ]"
2 32 ASN 16.188 0.279 19 0 "[ . 1 . 2 . 3 . 4 . ]"
2 33 ASN 15.152 0.225 21 0 "[ . 1 . 2 . 3 . 4 . ]"
2 34 ARG 52.762 0.304 43 0 "[ . 1 . 2 . 3 . 4 . ]"
2 35 GLY 42.589 0.317 30 0 "[ . 1 . 2 . 3 . 4 . ]"
2 36 CYS 49.563 0.430 23 0 "[ . 1 . 2 . 3 . 4 . ]"
2 37 CYS 49.333 0.317 30 0 "[ . 1 . 2 . 3 . 4 . ]"
2 38 PHE 12.396 0.353 16 0 "[ . 1 . 2 . 3 . 4 . ]"
2 39 ASP 117.748 1.847 9 21 "[ **.* +* * *. * 2 . * ** **.**- ** *** ]"
2 40 SER 17.764 0.260 33 0 "[ . 1 . 2 . 3 . 4 . ]"
2 41 ARG 43.933 0.910 33 20 "[ **.* ** * *. * 2 . * ** +*.**- ** **. ]"
2 42 ILE 109.231 1.847 9 21 "[ **.* +* * *. * 2 . * ** **.*** ** **- ]"
2 43 PRO 6.358 0.135 28 0 "[ . 1 . 2 . 3 . 4 . ]"
2 44 GLY 15.300 0.255 44 0 "[ . 1 . 2 . 3 . 4 . ]"
2 45 VAL 42.977 0.306 43 0 "[ . 1 . 2 . 3 . 4 . ]"
2 46 PRO 8.267 0.231 13 0 "[ . 1 . 2 . 3 . 4 . ]"
2 47 TRP 20.871 0.283 24 0 "[ . 1 . 2 . 3 . 4 . ]"
2 48 CYS 19.651 0.231 13 0 "[ . 1 . 2 . 3 . 4 . ]"
2 49 PHE 36.442 0.213 47 0 "[ . 1 . 2 . 3 . 4 . ]"
2 50 LYS 10.952 0.208 47 0 "[ . 1 . 2 . 3 . 4 . ]"
2 51 PRO 14.734 0.378 43 0 "[ . 1 . 2 . 3 . 4 . ]"
2 52 LEU 11.102 0.187 3 0 "[ . 1 . 2 . 3 . 4 . ]"
2 53 GLN 5.986 0.397 10 0 "[ . 1 . 2 . 3 . 4 . ]"
2 54 GLU 1.577 0.074 17 0 "[ . 1 . 2 . 3 . 4 . ]"
2 55 ALA 1.890 0.108 44 0 "[ . 1 . 2 . 3 . 4 . ]"
2 56 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3 . 4 . ]"
2 57 CYS 18.889 0.265 10 0 "[ . 1 . 2 . 3 . 4 . ]"
2 58 THR 8.124 0.397 10 0 "[ . 1 . 2 . 3 . 4 . ]"
2 59 PHE 19.836 0.436 38 0 "[ . 1 . 2 . 3 . 4 . ]"
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 H 1 3 TYR H . . 3.800 3.678 2.243 4.157 0.357 20 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2 1 2 GLU H 1 3 TYR QD . . 8.140 4.867 2.989 5.881 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
3 1 2 GLU H 1 4 VAL QG . . 8.120 4.234 2.466 5.568 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
4 1 2 GLU HA 1 3 TYR H . . 3.300 2.801 2.270 3.635 0.335 23 0 "[ . 1 . 2 . 3 . 4 . ]" 1
5 1 2 GLU HA 1 4 VAL H . . 5.000 4.777 4.033 5.249 0.249 18 0 "[ . 1 . 2 . 3 . 4 . ]" 1
6 1 3 TYR H 1 3 TYR HB2 . . 3.300 2.767 1.929 3.461 0.161 3 0 "[ . 1 . 2 . 3 . 4 . ]" 1
7 1 3 TYR H 1 3 TYR QB . . 3.050 2.454 1.917 2.828 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
8 1 3 TYR H 1 3 TYR HB3 . . 3.300 3.181 2.573 3.509 0.209 18 0 "[ . 1 . 2 . 3 . 4 . ]" 1
9 1 3 TYR H 1 4 VAL H . . 4.630 3.952 3.498 4.282 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
10 1 3 TYR H 1 4 VAL HA . . 5.960 5.312 5.045 5.757 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
11 1 3 TYR H 1 4 VAL QG . . 6.070 3.799 3.176 4.480 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
12 1 3 TYR H 1 6 LEU H . . 6.000 6.175 6.024 6.402 0.402 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
13 1 3 TYR HA 1 4 VAL H . . 2.470 2.421 2.225 2.658 0.188 37 0 "[ . 1 . 2 . 3 . 4 . ]" 1
14 1 3 TYR HA 1 6 LEU H . . 4.750 3.766 3.624 4.100 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
15 1 3 TYR HA 1 7 SER H . . 6.000 4.933 4.453 5.558 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
16 1 3 TYR QB 1 6 LEU H . . 5.280 4.523 3.576 4.889 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
17 1 3 TYR QD 1 4 VAL H . . 8.140 4.528 3.693 4.996 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
18 1 4 VAL H 1 4 VAL HA . . 2.900 2.934 2.916 2.941 0.041 16 0 "[ . 1 . 2 . 3 . 4 . ]" 1
19 1 4 VAL H 1 4 VAL HB . . 3.800 3.128 2.466 3.834 0.034 26 0 "[ . 1 . 2 . 3 . 4 . ]" 1
20 1 4 VAL H 1 6 LEU QB . . 5.510 4.921 4.554 5.152 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
21 1 4 VAL H 1 6 LEU QD . . 4.330 2.486 1.911 3.331 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
22 1 4 VAL HA 1 6 LEU H . . 3.300 3.526 3.397 3.616 0.316 33 0 "[ . 1 . 2 . 3 . 4 . ]" 1
23 1 4 VAL HA 1 7 SER H . . 3.500 3.269 2.990 3.543 0.043 44 0 "[ . 1 . 2 . 3 . 4 . ]" 1
24 1 4 VAL HA 1 8 ALA H . . 6.000 5.590 4.296 6.282 0.282 26 0 "[ . 1 . 2 . 3 . 4 . ]" 1
25 1 4 VAL HA 1 10 GLN H . . 6.000 5.752 4.697 6.266 0.266 33 0 "[ . 1 . 2 . 3 . 4 . ]" 1
26 1 4 VAL QG 1 6 LEU H . . 6.560 3.864 3.558 4.143 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
27 1 4 VAL O 1 7 SER H . . 2.000 2.039 1.802 2.137 0.137 31 0 "[ . 1 . 2 . 3 . 4 . ]" 1
28 1 4 VAL O 1 7 SER N . . 3.000 3.012 2.787 3.093 0.093 17 0 "[ . 1 . 2 . 3 . 4 . ]" 1
29 1 6 LEU H 1 6 LEU QB . . 3.680 3.076 2.773 3.328 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
30 1 6 LEU H 1 7 SER H . . 3.640 1.938 1.752 2.296 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
31 1 6 LEU H 1 9 ASN QB . . 6.880 5.959 5.177 6.379 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
32 1 6 LEU H 1 10 GLN H . . 6.000 5.263 4.785 5.628 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
33 1 6 LEU H 1 10 GLN QB . . 4.790 3.628 3.026 4.218 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
34 1 6 LEU H 2 59 PHE HA . . 6.000 6.035 5.656 6.339 0.339 33 0 "[ . 1 . 2 . 3 . 4 . ]" 1
35 1 6 LEU QB 1 7 SER H . . 4.220 3.880 3.384 4.075 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
36 1 6 LEU QB 1 52 LEU HA . . 5.360 4.509 3.731 4.945 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
37 1 6 LEU QB 2 59 PHE H . . 6.880 4.447 3.599 5.585 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
38 1 6 LEU QD 1 7 SER H . . 7.600 3.217 1.935 4.084 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
39 1 6 LEU QD 1 10 GLN H . . 8.130 5.727 5.065 6.119 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
40 1 6 LEU QD 1 10 GLN HE21 . . 7.980 4.608 2.571 5.929 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
41 1 6 LEU QD 1 10 GLN QE . . 7.630 3.978 2.423 4.826 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
42 1 6 LEU QD 1 10 GLN HE22 . . 7.980 4.553 2.961 6.056 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
43 1 7 SER H 1 8 ALA HA . . 6.000 5.475 5.127 5.989 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
44 1 7 SER H 1 10 GLN H . . 6.000 3.656 3.148 4.256 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
45 1 7 SER H 1 10 GLN HB2 . . 4.000 3.205 2.470 4.153 0.153 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
46 1 7 SER H 1 10 GLN QB . . 3.650 2.745 2.074 3.330 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
47 1 7 SER H 1 10 GLN HB3 . . 4.000 3.549 2.109 4.327 0.327 27 0 "[ . 1 . 2 . 3 . 4 . ]" 1
48 1 7 SER H 1 10 GLN HE21 . . 6.030 5.104 3.955 6.125 0.095 9 0 "[ . 1 . 2 . 3 . 4 . ]" 1
49 1 7 SER H 1 10 GLN HE22 . . 6.030 5.874 5.375 6.264 0.234 18 0 "[ . 1 . 2 . 3 . 4 . ]" 1
50 1 7 SER H 1 11 CYS H . . 6.000 5.876 5.511 6.245 0.245 22 0 "[ . 1 . 2 . 3 . 4 . ]" 1
51 1 7 SER HA 1 7 SER HB2 . . 3.040 2.609 2.285 3.040 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
52 1 7 SER HA 1 7 SER HB3 . . 3.040 2.768 2.336 3.052 0.012 15 0 "[ . 1 . 2 . 3 . 4 . ]" 1
53 1 7 SER HA 1 10 GLN H . . 5.000 4.619 3.838 5.171 0.171 7 0 "[ . 1 . 2 . 3 . 4 . ]" 1
54 1 7 SER O 1 10 GLN H . . 2.000 1.910 1.680 2.130 0.130 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
55 1 7 SER O 1 10 GLN N . . 3.000 2.858 2.607 3.055 0.055 10 0 "[ . 1 . 2 . 3 . 4 . ]" 1
56 1 8 ALA HA 1 10 GLN H . . 5.000 3.676 3.276 3.993 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
57 1 8 ALA HA 1 11 CYS H . . 5.000 4.023 3.476 4.571 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
58 1 8 ALA HA 1 12 ALA H . . 6.000 5.969 5.487 6.329 0.329 35 0 "[ . 1 . 2 . 3 . 4 . ]" 1
59 1 8 ALA MB 1 52 LEU HA . . 7.030 5.714 5.214 6.065 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
60 1 9 ASN H 1 10 GLN H . . 5.000 2.301 1.526 3.088 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
61 1 9 ASN H 1 12 ALA H . . 6.000 4.624 4.009 5.302 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
62 1 9 ASN HA 1 11 CYS H . . 5.000 4.045 3.848 4.415 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
63 1 9 ASN QD 1 10 GLN QB . . 7.740 5.449 4.038 6.047 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
64 1 9 ASN QD 1 11 CYS H . . 6.870 5.278 4.762 5.617 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
65 1 9 ASN QD 1 12 ALA MB . . 4.100 2.395 1.790 3.004 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
66 1 9 ASN QD 1 13 VAL QG . . 8.550 5.180 4.399 5.740 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
67 1 9 ASN HD21 1 13 VAL MG1 . . 10.150 6.717 4.845 7.835 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
68 1 9 ASN HD21 1 13 VAL MG2 . . 10.150 5.986 4.831 7.441 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
69 1 9 ASN HD22 1 13 VAL MG1 . . 10.150 7.656 5.925 8.505 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
70 1 9 ASN HD22 1 13 VAL MG2 . . 10.150 7.013 5.382 8.315 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
71 1 9 ASN O 1 12 ALA H . . 2.000 1.897 1.641 2.059 0.059 19 0 "[ . 1 . 2 . 3 . 4 . ]" 1
72 1 9 ASN O 1 12 ALA N . . 3.000 2.787 2.505 2.951 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
73 1 10 GLN H 1 10 GLN HB2 . . 3.300 2.708 2.017 3.518 0.218 14 0 "[ . 1 . 2 . 3 . 4 . ]" 1
74 1 10 GLN H 1 10 GLN QB . . 2.980 2.110 1.995 2.258 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
75 1 10 GLN H 1 10 GLN HB3 . . 3.300 2.487 2.022 3.150 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
76 1 10 GLN H 1 10 GLN QG . . 5.090 3.474 2.433 3.931 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
77 1 10 GLN H 1 11 CYS H . . 2.960 2.670 2.562 2.854 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
78 1 10 GLN H 1 11 CYS HA . . 6.000 5.200 5.100 5.353 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
79 1 10 GLN H 1 11 CYS QB . . 5.880 4.400 4.302 4.557 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
80 1 10 GLN H 1 12 ALA H . . 3.870 3.836 3.706 3.983 0.113 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
81 1 10 GLN H 1 12 ALA MB . . 6.030 4.656 4.342 5.034 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
82 1 10 GLN H 1 52 LEU H . . 6.000 4.991 4.585 5.478 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
83 1 10 GLN H 1 52 LEU QB . . 4.030 3.089 2.616 3.645 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
84 1 10 GLN H 1 52 LEU QD . . 8.130 3.388 2.785 4.001 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
85 1 10 GLN HA 1 10 GLN HE21 . . 6.000 4.765 4.154 5.412 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
86 1 10 GLN HA 1 10 GLN HE22 . . 6.000 5.757 5.169 6.133 0.133 35 0 "[ . 1 . 2 . 3 . 4 . ]" 1
87 1 10 GLN HA 1 12 ALA H . . 4.000 3.328 3.206 3.410 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
88 1 10 GLN QB 1 10 GLN QE . . 3.760 2.428 1.779 3.045 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
89 1 10 GLN QB 1 13 VAL H . . 6.880 4.922 4.725 5.273 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
90 1 10 GLN QB 1 52 LEU H . . 5.450 3.789 2.831 4.776 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
91 1 10 GLN HB2 1 10 GLN HE22 . . 5.000 4.129 3.672 4.744 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
92 1 10 GLN HB2 1 11 CYS H . . 4.000 3.942 3.310 4.286 0.286 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
93 1 10 GLN HB2 1 12 ALA H . . 5.000 5.063 4.862 5.170 0.170 27 0 "[ . 1 . 2 . 3 . 4 . ]" 1
94 1 10 GLN HB2 1 52 LEU H . . 6.000 5.092 3.981 5.482 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
95 1 10 GLN HB3 1 10 GLN HE22 . . 5.000 3.885 3.135 4.930 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
96 1 10 GLN HB3 1 11 CYS H . . 4.000 3.134 2.635 3.797 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
97 1 10 GLN HB3 1 12 ALA H . . 5.000 4.754 4.488 5.111 0.111 14 0 "[ . 1 . 2 . 3 . 4 . ]" 1
98 1 10 GLN HB3 1 52 LEU H . . 6.000 3.964 2.878 5.392 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
99 1 10 GLN QE 1 13 VAL H . . 6.870 6.100 5.489 6.452 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
100 1 10 GLN QE 1 13 VAL QG . . 8.550 4.405 3.446 5.054 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
101 1 10 GLN QE 1 50 LYS QG . . 6.900 5.192 4.464 5.676 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
102 1 10 GLN QE 1 52 LEU QB . . 5.470 4.092 3.342 4.592 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
103 1 10 GLN QE 2 58 THR HA . . 6.870 4.748 3.974 5.835 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
104 1 10 GLN HE21 1 13 VAL MG1 . . 10.150 6.001 3.782 7.370 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
105 1 10 GLN HE21 1 13 VAL MG2 . . 10.150 5.300 3.583 6.122 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
106 1 10 GLN HE21 1 50 LYS QG . . 7.030 6.328 5.782 6.624 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
107 1 10 GLN HE21 1 52 LEU H . . 6.000 4.226 3.453 5.073 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
108 1 10 GLN HE21 1 52 LEU QB . . 5.850 4.367 3.425 5.111 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
109 1 10 GLN HE21 1 53 GLN H . . 6.000 4.910 4.155 6.177 0.177 33 0 "[ . 1 . 2 . 3 . 4 . ]" 1
110 1 10 GLN HE21 2 59 PHE HA . . 6.000 4.524 3.266 6.049 0.049 9 0 "[ . 1 . 2 . 3 . 4 . ]" 1
111 1 10 GLN HE22 1 13 VAL MG1 . . 10.150 6.401 4.351 7.687 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
112 1 10 GLN HE22 1 13 VAL MG2 . . 10.150 5.756 4.959 7.527 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
113 1 10 GLN HE22 1 50 LYS QG . . 7.030 5.580 4.635 6.516 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
114 1 10 GLN HE22 1 52 LEU H . . 6.000 4.765 4.128 5.566 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
115 1 10 GLN HE22 1 52 LEU QB . . 5.850 5.084 4.636 5.502 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
116 1 10 GLN HE22 1 53 GLN H . . 6.000 4.826 4.226 5.604 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
117 1 10 GLN HE22 2 59 PHE HA . . 6.000 3.645 1.920 4.535 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
118 1 10 GLN QG 1 12 ALA H . . 6.000 4.395 3.912 5.103 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
119 1 10 GLN O 1 13 VAL H . . 2.000 1.900 1.723 2.100 0.100 4 0 "[ . 1 . 2 . 3 . 4 . ]" 1
120 1 10 GLN O 1 13 VAL N . . 3.000 2.768 2.541 3.007 0.007 2 0 "[ . 1 . 2 . 3 . 4 . ]" 1
121 1 11 CYS CB 1 37 CYS SG . . 3.100 3.262 3.144 3.334 0.234 37 0 "[ . 1 . 2 . 3 . 4 . ]" 1
122 1 11 CYS H 1 11 CYS HB2 . . 3.300 2.593 2.120 2.696 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
123 1 11 CYS H 1 11 CYS QB . . 2.980 2.195 2.102 2.229 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
124 1 11 CYS H 1 11 CYS HB3 . . 3.300 2.414 2.295 3.471 0.171 41 0 "[ . 1 . 2 . 3 . 4 . ]" 1
125 1 11 CYS H 1 12 ALA H . . 2.900 2.617 2.546 2.678 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
126 1 11 CYS H 1 12 ALA MB . . 5.030 4.055 3.914 4.227 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
127 1 11 CYS H 1 13 VAL QG . . 7.590 4.971 4.121 5.420 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
128 1 11 CYS H 1 52 LEU H . . 6.000 3.270 3.042 3.463 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
129 1 11 CYS H 1 52 LEU HA . . 5.000 4.855 4.610 5.010 0.010 18 0 "[ . 1 . 2 . 3 . 4 . ]" 1
130 1 11 CYS H 1 52 LEU QB . . 5.880 2.605 2.123 2.728 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
131 1 11 CYS H 1 52 LEU QD . . 8.060 2.254 1.780 3.088 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
132 1 11 CYS HA 1 12 ALA H . . 3.150 3.375 3.310 3.443 0.293 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
133 1 11 CYS HA 1 12 ALA HA . . 6.000 4.591 4.536 4.695 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
134 1 11 CYS HA 1 13 VAL H . . 4.000 3.422 3.182 3.670 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
135 1 11 CYS HA 1 13 VAL QG . . 6.800 3.971 2.496 4.761 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
136 1 11 CYS HA 1 37 CYS QB . . 6.880 3.798 3.178 4.044 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
137 1 11 CYS HA 1 52 LEU H . . 4.000 3.481 3.003 3.636 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
138 1 11 CYS HA 1 52 LEU HA . . 6.000 6.013 5.693 6.125 0.125 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
139 1 11 CYS HA 1 52 LEU QD . . 8.130 3.822 3.489 4.183 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
140 1 11 CYS HA 1 53 GLN QG . . 6.880 5.992 5.651 6.084 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
141 1 11 CYS QB 1 12 ALA H . . 4.350 3.397 3.246 3.502 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
142 1 11 CYS QB 1 12 ALA HA . . 5.880 4.515 4.137 4.618 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
143 1 11 CYS QB 1 13 VAL H . . 5.450 4.722 4.542 4.810 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
144 1 11 CYS QB 1 37 CYS H . . 6.800 6.060 5.915 6.295 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
145 1 11 CYS QB 1 38 PHE H . . 6.880 6.352 5.892 6.471 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
146 1 11 CYS QB 1 52 LEU H . . 6.880 2.177 1.990 3.610 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
147 1 11 CYS HB2 1 12 ALA H . . 5.000 4.371 3.476 4.476 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
148 1 11 CYS HB2 1 13 VAL H . . 6.000 5.455 5.257 5.571 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
149 1 11 CYS HB3 1 12 ALA H . . 5.000 3.557 3.409 4.048 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
150 1 11 CYS HB3 1 13 VAL H . . 6.000 5.172 4.968 5.296 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
151 1 11 CYS SG 1 37 CYS CB . . 3.100 3.157 2.936 3.269 0.169 11 0 "[ . 1 . 2 . 3 . 4 . ]" 1
152 1 11 CYS SG 1 37 CYS SG . . 2.100 1.902 1.710 2.376 0.276 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
153 1 12 ALA H 1 12 ALA HA . . 2.900 2.931 2.890 2.942 0.042 41 0 "[ . 1 . 2 . 3 . 4 . ]" 1
154 1 12 ALA H 1 12 ALA MB . . 3.340 2.253 2.138 2.406 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
155 1 12 ALA H 1 13 VAL H . . 3.500 2.446 2.175 2.699 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
156 1 12 ALA H 1 13 VAL MG1 . . 7.030 4.815 3.631 5.523 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
157 1 12 ALA H 1 13 VAL QG . . 5.910 4.102 3.364 4.510 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
158 1 12 ALA H 1 13 VAL MG2 . . 7.030 4.485 3.669 5.743 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
159 1 12 ALA H 1 52 LEU H . . 6.000 5.634 5.289 5.799 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
160 1 12 ALA H 1 52 LEU QB . . 5.960 5.040 4.599 5.185 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
161 1 12 ALA HA 1 13 VAL H . . 3.300 3.142 3.000 3.236 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
162 1 12 ALA HA 1 41 ARG QD . . 5.880 4.962 3.835 5.300 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
163 1 12 ALA HA 1 52 LEU QD . . 8.130 5.617 5.387 6.025 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
164 1 12 ALA MB 1 13 VAL H . . 4.440 3.567 3.461 3.680 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
165 1 13 VAL H 1 13 VAL HA . . 2.850 2.692 2.636 2.738 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
166 1 13 VAL H 1 13 VAL HB . . 3.300 2.407 1.962 3.488 0.188 24 0 "[ . 1 . 2 . 3 . 4 . ]" 1
167 1 13 VAL H 1 13 VAL MG1 . . 4.520 2.979 1.744 3.392 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
168 1 13 VAL H 1 13 VAL QG . . 3.850 2.521 1.731 2.866 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
169 1 13 VAL H 1 13 VAL MG2 . . 4.520 2.871 1.751 3.598 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
170 1 13 VAL H 1 14 PRO HD2 . . 5.430 4.893 4.871 4.968 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
171 1 13 VAL H 1 14 PRO QD . . 5.010 4.272 4.228 4.288 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
172 1 13 VAL H 1 14 PRO HD3 . . 5.430 4.711 4.578 4.742 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
173 1 13 VAL H 1 18 ARG QD . . 6.800 5.958 5.740 6.077 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
174 1 13 VAL H 1 18 ARG HE . . 4.000 4.103 3.792 4.282 0.282 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
175 1 13 VAL H 1 18 ARG HG2 . . 5.350 5.104 4.889 5.379 0.029 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
176 1 13 VAL H 1 18 ARG QG . . 5.100 4.596 4.455 4.752 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
177 1 13 VAL H 1 18 ARG HG3 . . 5.350 5.228 4.962 5.463 0.113 41 0 "[ . 1 . 2 . 3 . 4 . ]" 1
178 1 13 VAL H 1 49 PHE HD2 . . 6.000 5.706 5.468 5.935 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
179 1 13 VAL H 1 51 PRO HA . . 6.000 6.260 5.907 6.410 0.410 5 0 "[ . 1 . 2 . 3 . 4 . ]" 1
180 1 13 VAL HA 1 15 ALA H . . 4.000 3.977 3.902 4.084 0.084 44 0 "[ . 1 . 2 . 3 . 4 . ]" 1
181 1 13 VAL HA 1 16 LYS H . . 6.000 5.620 5.220 5.874 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
182 1 13 VAL HA 1 18 ARG HE . . 6.000 5.277 4.847 5.454 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
183 1 13 VAL HB 1 15 ALA HA . . 6.000 4.682 3.790 5.469 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
184 1 13 VAL HB 1 18 ARG HE . . 3.640 3.323 2.786 3.866 0.226 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
185 1 13 VAL QG 1 15 ALA H . . 7.590 2.011 1.668 2.892 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
186 1 13 VAL QG 1 15 ALA HA . . 8.590 2.651 2.337 3.421 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
187 1 13 VAL QG 1 16 LYS H . . 4.750 2.450 1.901 3.418 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
188 1 13 VAL QG 1 16 LYS HA . . 6.360 4.432 3.871 5.051 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
189 1 13 VAL QG 1 16 LYS QD . . 8.470 4.555 3.712 5.679 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
190 1 13 VAL QG 1 17 ASP HA . . 8.590 3.965 3.641 4.102 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
191 1 13 VAL QG 1 18 ARG H . . 6.160 3.155 2.432 3.569 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
192 1 13 VAL QG 1 18 ARG HE . . 8.060 1.796 1.598 1.883 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
193 1 13 VAL MG1 1 16 LYS H . . 6.190 2.710 2.041 4.151 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
194 1 13 VAL MG1 1 16 LYS HA . . 7.030 4.812 4.139 6.019 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
195 1 13 VAL MG1 1 17 ASP H . . 5.030 2.963 2.284 3.907 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
196 1 13 VAL MG2 1 16 LYS H . . 6.190 3.671 1.904 3.988 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
197 1 13 VAL MG2 1 16 LYS HA . . 7.030 5.656 3.920 5.927 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
198 1 13 VAL MG2 1 17 ASP H . . 5.030 3.719 1.939 4.064 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
199 1 14 PRO QD 1 17 ASP H . . 6.880 4.372 3.641 4.927 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
200 1 15 ALA H 1 15 ALA HA . . 2.900 2.228 2.215 2.248 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
201 1 15 ALA H 1 16 LYS H . . 3.800 2.927 2.373 3.309 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
202 1 15 ALA H 1 17 ASP H . . 6.000 4.544 3.884 5.063 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
203 1 15 ALA H 1 17 ASP QB . . 6.880 4.667 4.055 5.041 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
204 1 15 ALA H 1 18 ARG H . . 6.000 5.554 5.110 5.916 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
205 1 15 ALA H 1 18 ARG HD2 . . 6.000 4.628 4.239 4.967 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
206 1 15 ALA H 1 18 ARG QD . . 5.450 4.432 4.093 4.720 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
207 1 15 ALA H 1 18 ARG HD3 . . 6.000 5.676 5.396 5.892 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
208 1 15 ALA H 1 18 ARG HE . . 6.000 3.147 2.799 3.440 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
209 1 15 ALA H 1 18 ARG QG . . 6.880 4.332 4.100 4.650 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
210 1 15 ALA HA 1 16 LYS QD . . 6.880 5.905 5.660 6.195 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
211 1 15 ALA HA 1 17 ASP QB . . 5.880 5.219 5.053 5.301 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
212 1 15 ALA HA 1 18 ARG H . . 5.000 4.663 4.132 5.079 0.079 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
213 1 15 ALA HA 1 42 ILE MD . . 6.310 3.990 3.705 4.163 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
214 1 15 ALA HA 1 42 ILE QG . . 5.930 4.742 3.997 5.115 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
215 1 15 ALA HA 1 45 VAL MG1 . . 6.610 3.521 2.882 4.169 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
216 1 15 ALA HA 1 45 VAL QG . . 5.230 2.591 2.078 3.095 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
217 1 15 ALA HA 1 45 VAL MG2 . . 6.610 2.671 2.112 3.191 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
218 1 15 ALA MB 1 16 LYS HA . . 5.810 4.500 4.380 4.577 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
219 1 15 ALA MB 1 18 ARG HE . . 6.030 3.864 3.497 4.230 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
220 1 15 ALA MB 1 42 ILE MD . . 7.300 1.635 1.582 1.688 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
221 1 15 ALA MB 1 45 VAL H . . 7.030 4.563 4.188 4.983 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
222 1 15 ALA MB 1 45 VAL MG1 . . 7.940 1.925 1.733 2.567 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
223 1 15 ALA MB 1 45 VAL QG . . 7.470 1.679 1.572 2.094 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
224 1 15 ALA MB 1 45 VAL MG2 . . 7.940 1.891 1.687 2.273 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
225 1 16 LYS H 1 16 LYS HA . . 2.770 2.717 2.656 2.827 0.057 4 0 "[ . 1 . 2 . 3 . 4 . ]" 1
226 1 16 LYS H 1 16 LYS QG . . 3.720 2.583 2.344 2.701 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
227 1 16 LYS H 1 17 ASP H . . 2.810 1.926 1.821 2.087 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
228 1 16 LYS H 1 17 ASP HB2 . . 3.680 3.692 3.588 3.772 0.092 38 0 "[ . 1 . 2 . 3 . 4 . ]" 1
229 1 16 LYS H 1 17 ASP QB . . 3.480 3.300 3.217 3.367 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
230 1 16 LYS H 1 17 ASP HB3 . . 3.680 3.724 3.501 3.860 0.180 19 0 "[ . 1 . 2 . 3 . 4 . ]" 1
231 1 16 LYS H 1 18 ARG H . . 4.060 3.274 2.866 3.597 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
232 1 16 LYS H 1 18 ARG QD . . 5.880 3.433 3.186 3.780 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
233 1 16 LYS H 1 18 ARG QG . . 5.880 3.408 3.152 3.624 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
234 1 16 LYS H 1 42 ILE MD . . 7.030 5.474 5.197 5.600 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
235 1 16 LYS H 1 45 VAL QG . . 7.590 3.994 3.209 4.456 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
236 1 16 LYS H 1 46 PRO QD . . 6.880 4.708 4.463 4.965 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
237 1 16 LYS HA 1 16 LYS HE2 . . 6.000 5.162 4.212 5.999 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
238 1 16 LYS HA 1 16 LYS HE3 . . 6.000 5.327 4.149 5.970 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
239 1 16 LYS HA 1 17 ASP H . . 3.110 2.808 2.681 2.959 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
240 1 16 LYS HA 1 17 ASP HA . . 6.000 4.278 4.252 4.300 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
241 1 16 LYS HA 1 18 ARG H . . 4.000 3.729 3.495 4.142 0.142 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
242 1 16 LYS HA 1 45 VAL QG . . 8.170 3.788 3.116 4.215 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
243 1 16 LYS QB 1 17 ASP H . . 4.880 4.088 4.068 4.111 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
244 1 16 LYS QB 1 45 VAL HA . . 6.880 5.964 5.550 6.065 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
245 1 16 LYS QG 1 17 ASP H . . 4.670 3.961 3.696 4.136 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
246 1 16 LYS QG 1 18 ARG H . . 6.030 5.330 5.132 5.457 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
247 1 16 LYS QG 1 42 ILE MD . . 5.860 4.329 4.206 4.437 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
248 1 17 ASP H 1 17 ASP HA . . 2.810 2.847 2.816 2.881 0.071 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
249 1 17 ASP H 1 17 ASP HB2 . . 3.300 3.269 3.177 3.358 0.058 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
250 1 17 ASP H 1 17 ASP QB . . 2.980 2.779 2.661 2.857 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
251 1 17 ASP H 1 17 ASP HB3 . . 3.300 3.013 2.808 3.119 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
252 1 17 ASP H 1 18 ARG H . . 2.470 1.610 1.460 1.730 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
253 1 17 ASP H 1 18 ARG HA . . 5.000 4.041 3.980 4.131 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
254 1 17 ASP H 1 18 ARG HB2 . . 6.000 3.858 3.627 4.029 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
255 1 17 ASP H 1 18 ARG QB . . 5.450 3.725 3.538 3.865 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
256 1 17 ASP H 1 18 ARG HB3 . . 6.000 4.923 4.885 4.974 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
257 1 17 ASP H 1 18 ARG QD . . 5.880 3.256 3.088 3.521 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
258 1 17 ASP H 1 18 ARG HE . . 6.000 4.269 3.471 4.931 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
259 1 17 ASP H 1 18 ARG HG2 . . 5.160 4.431 4.253 4.869 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
260 1 17 ASP H 1 18 ARG QG . . 4.530 2.669 2.466 3.178 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
261 1 17 ASP H 1 18 ARG HG3 . . 5.160 2.692 2.482 3.221 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
262 1 17 ASP H 1 45 VAL MG1 . . 7.030 5.745 5.342 5.907 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
263 1 17 ASP H 1 45 VAL MG2 . . 7.030 5.062 4.031 5.606 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
264 1 17 ASP H 1 46 PRO HD2 . . 6.000 5.071 4.914 5.215 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
265 1 17 ASP H 1 46 PRO HD3 . . 6.000 5.673 5.312 5.962 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
266 1 17 ASP HA 1 17 ASP HB2 . . 3.040 2.550 2.459 2.602 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
267 1 17 ASP HA 1 17 ASP HB3 . . 3.040 3.050 3.041 3.056 0.016 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
268 1 17 ASP HA 1 18 ARG H . . 3.300 3.260 3.127 3.544 0.244 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
269 1 18 ARG H 1 18 ARG HB2 . . 3.500 2.569 2.459 2.648 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
270 1 18 ARG H 1 18 ARG QB . . 2.960 2.516 2.419 2.579 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
271 1 18 ARG H 1 18 ARG HB3 . . 3.500 3.605 3.548 3.630 0.130 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
272 1 18 ARG H 1 18 ARG HD2 . . 4.000 2.959 2.696 3.136 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
273 1 18 ARG H 1 18 ARG QD . . 3.690 2.896 2.649 3.054 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
274 1 18 ARG H 1 18 ARG HD3 . . 4.000 4.128 3.890 4.234 0.234 1 0 "[ . 1 . 2 . 3 . 4 . ]" 1
275 1 18 ARG H 1 18 ARG HE . . 5.620 4.360 3.721 4.773 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
276 1 18 ARG H 1 18 ARG HG2 . . 3.530 3.679 3.424 3.809 0.279 4 0 "[ . 1 . 2 . 3 . 4 . ]" 1
277 1 18 ARG H 1 18 ARG QG . . 3.070 2.163 1.843 2.346 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
278 1 18 ARG H 1 18 ARG HG3 . . 3.530 2.179 1.850 2.368 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
279 1 18 ARG H 1 19 VAL H . . 5.000 4.555 4.482 4.640 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
280 1 18 ARG H 1 46 PRO HD2 . . 6.000 4.834 4.700 5.080 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
281 1 18 ARG H 1 46 PRO QD . . 5.450 4.499 4.367 4.783 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
282 1 18 ARG H 1 46 PRO HD3 . . 6.000 5.361 5.173 5.836 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
283 1 18 ARG H 1 46 PRO QG . . 6.880 3.811 3.620 4.201 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
284 1 18 ARG H 1 49 PHE HB2 . . 6.000 5.647 5.411 5.830 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
285 1 18 ARG H 1 49 PHE HB3 . . 6.000 5.314 5.195 5.404 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
286 1 18 ARG HA 1 19 VAL H . . 2.900 2.655 2.570 2.747 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
287 1 18 ARG HA 1 50 LYS H . . 5.000 4.662 4.447 4.839 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
288 1 18 ARG QB 1 19 VAL H . . 3.120 2.200 2.036 2.344 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
289 1 18 ARG QB 1 20 ASP H . . 6.880 2.282 2.230 2.331 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
290 1 18 ARG QB 1 49 PHE H . . 6.880 4.840 4.752 4.921 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
291 1 18 ARG QB 1 50 LYS H . . 5.880 3.634 3.389 3.808 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
292 1 18 ARG HB2 1 19 VAL H . . 3.760 3.230 2.980 3.415 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
293 1 18 ARG HB3 1 19 VAL H . . 3.760 2.240 2.066 2.395 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
294 1 18 ARG QD 1 19 VAL H . . 5.350 4.710 4.546 4.865 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
295 1 18 ARG QD 1 20 ASP H . . 4.830 4.050 3.937 4.156 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
296 1 18 ARG QD 1 21 CYS H . . 6.880 5.490 5.351 5.655 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
297 1 18 ARG QD 1 39 ASP H . . 6.880 5.706 5.546 5.929 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
298 1 18 ARG QD 1 45 VAL H . . 6.880 6.304 6.197 6.427 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
299 1 18 ARG QD 1 49 PHE H . . 6.880 5.107 4.921 5.291 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
300 1 18 ARG QD 1 50 LYS H . . 6.880 5.789 5.567 5.957 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
301 1 18 ARG HD2 1 19 VAL H . . 5.770 5.541 5.283 5.735 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
302 1 18 ARG HD2 1 20 ASP H . . 5.000 4.756 4.484 4.979 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
303 1 18 ARG HD3 1 19 VAL H . . 5.770 5.101 4.853 5.286 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
304 1 18 ARG HD3 1 20 ASP H . . 5.000 4.395 4.277 4.625 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
305 1 18 ARG HE 1 18 ARG QG . . 3.900 2.284 2.250 2.383 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
306 1 18 ARG HE 1 42 ILE MD . . 7.030 5.774 5.558 5.860 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
307 1 18 ARG HE 1 46 PRO QD . . 5.820 4.580 3.962 4.913 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
308 1 18 ARG HE 1 49 PHE HD1 . . 6.000 5.548 5.236 6.105 0.105 24 0 "[ . 1 . 2 . 3 . 4 . ]" 1
309 1 18 ARG QG 1 20 ASP H . . 6.310 4.417 4.378 4.464 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
310 1 18 ARG QG 1 21 CYS H . . 6.880 6.114 6.001 6.192 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
311 1 18 ARG QG 1 49 PHE H . . 6.880 5.353 5.200 5.541 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
312 1 18 ARG QG 1 50 LYS H . . 6.880 4.812 4.494 5.026 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
313 1 18 ARG HG2 1 19 VAL H . . 4.860 4.268 4.116 4.424 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
314 1 18 ARG HG3 1 19 VAL H . . 4.860 4.658 4.551 4.746 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
315 1 19 VAL H 1 19 VAL HA . . 2.900 2.933 2.917 2.941 0.041 7 0 "[ . 1 . 2 . 3 . 4 . ]" 1
316 1 19 VAL H 1 19 VAL HB . . 2.690 2.620 2.420 2.748 0.058 23 0 "[ . 1 . 2 . 3 . 4 . ]" 1
317 1 19 VAL H 1 20 ASP H . . 3.950 2.493 2.365 2.667 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
318 1 19 VAL H 1 20 ASP HA . . 6.000 4.291 4.144 4.434 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
319 1 19 VAL H 1 49 PHE H . . 6.000 6.024 5.918 6.078 0.078 30 0 "[ . 1 . 2 . 3 . 4 . ]" 1
320 1 19 VAL H 1 49 PHE HA . . 6.000 4.005 3.886 4.163 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
321 1 19 VAL H 1 49 PHE HB2 . . 4.780 2.748 2.590 2.964 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
322 1 19 VAL H 1 49 PHE QB . . 4.380 2.499 2.408 2.588 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
323 1 19 VAL H 1 49 PHE HB3 . . 4.780 2.879 2.761 3.016 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
324 1 19 VAL H 1 49 PHE HD1 . . 6.000 5.515 5.343 5.710 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
325 1 19 VAL H 1 50 LYS H . . 3.490 3.025 2.900 3.113 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
326 1 19 VAL H 2 59 PHE QB . . 6.880 6.017 5.725 6.238 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
327 1 19 VAL HA 1 20 ASP H . . 3.300 3.091 3.051 3.130 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
328 1 19 VAL HB 1 20 ASP H . . 4.000 4.019 3.969 4.066 0.066 24 0 "[ . 1 . 2 . 3 . 4 . ]" 1
329 1 19 VAL HB 1 21 CYS H . . 6.000 4.788 4.644 5.028 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
330 1 19 VAL QG 1 20 ASP H . . 5.610 3.770 3.749 3.792 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
331 1 19 VAL QG 1 21 CYS H . . 7.930 4.857 4.654 5.015 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
332 1 19 VAL QG 1 50 LYS H . . 5.030 3.434 3.128 3.795 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
333 1 20 ASP H 1 20 ASP HB2 . . 2.900 3.091 3.033 3.140 0.240 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
334 1 20 ASP H 1 20 ASP HB3 . . 2.900 3.087 3.040 3.162 0.262 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
335 1 20 ASP H 1 21 CYS H . . 3.910 3.616 3.529 3.673 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
336 1 20 ASP H 1 22 GLY H . . 6.000 5.409 5.331 5.462 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
337 1 20 ASP H 1 46 PRO HD2 . . 6.000 5.382 5.159 5.547 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
338 1 20 ASP H 1 46 PRO HD3 . . 6.000 5.356 5.207 5.548 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
339 1 20 ASP H 1 46 PRO QG . . 6.880 2.834 2.713 2.982 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
340 1 20 ASP H 1 48 CYS H . . 6.000 5.701 5.557 5.811 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
341 1 20 ASP H 1 49 PHE HA . . 5.000 4.108 4.000 4.202 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
342 1 20 ASP H 1 50 LYS H . . 6.000 4.737 4.595 4.844 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
343 1 20 ASP HA 1 21 CYS H . . 2.390 2.360 2.333 2.381 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
344 1 20 ASP HA 1 22 GLY H . . 3.300 3.430 3.372 3.497 0.197 38 0 "[ . 1 . 2 . 3 . 4 . ]" 1
345 1 20 ASP HA 1 47 TRP H . . 6.000 5.568 5.416 5.750 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
346 1 20 ASP HA 1 48 CYS H . . 5.000 4.083 4.021 4.192 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
347 1 20 ASP HA 1 49 PHE HA . . 4.000 3.625 3.452 3.765 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
348 1 20 ASP QB 1 22 GLY H . . 4.880 4.162 4.074 4.252 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
349 1 20 ASP QB 1 47 TRP H . . 6.880 5.921 5.833 6.042 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
350 1 21 CYS CB 1 36 CYS SG . . 3.100 3.045 2.880 3.167 0.067 2 0 "[ . 1 . 2 . 3 . 4 . ]" 1
351 1 21 CYS H 1 21 CYS HA . . 2.900 2.718 2.695 2.753 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
352 1 21 CYS H 1 21 CYS HB2 . . 2.850 2.066 2.019 2.163 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
353 1 21 CYS H 1 21 CYS HB3 . . 2.850 3.022 2.860 3.133 0.283 10 0 "[ . 1 . 2 . 3 . 4 . ]" 1
354 1 21 CYS H 1 22 GLY H . . 4.900 2.755 2.663 2.827 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
355 1 21 CYS H 1 22 GLY QA . . 5.880 4.519 4.452 4.562 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
356 1 21 CYS H 1 23 TYR H . . 6.000 5.127 4.922 5.351 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
357 1 21 CYS H 1 23 TYR QD . . 8.000 5.729 4.887 6.811 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
358 1 21 CYS H 1 36 CYS HA . . 6.000 6.142 6.058 6.273 0.273 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
359 1 21 CYS H 1 46 PRO HA . . 6.000 5.737 5.527 5.960 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
360 1 21 CYS H 1 46 PRO HB2 . . 4.860 3.530 3.379 3.705 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
361 1 21 CYS H 1 46 PRO QB . . 4.500 3.371 3.233 3.538 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
362 1 21 CYS H 1 46 PRO HB3 . . 4.860 4.276 4.089 4.483 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
363 1 21 CYS H 1 48 CYS H . . 5.000 4.120 4.034 4.200 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
364 1 21 CYS H 1 48 CYS HA . . 6.000 4.750 4.699 4.784 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
365 1 21 CYS H 1 48 CYS QB . . 6.880 3.902 3.751 4.028 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
366 1 21 CYS H 1 48 CYS O . . 2.000 1.626 1.561 1.651 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
367 1 21 CYS H 1 49 PHE H . . 4.000 4.036 3.993 4.085 0.085 47 0 "[ . 1 . 2 . 3 . 4 . ]" 1
368 1 21 CYS H 1 49 PHE HA . . 2.810 1.812 1.703 1.880 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
369 1 21 CYS H 1 49 PHE HB2 . . 5.000 4.063 3.944 4.184 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
370 1 21 CYS H 1 49 PHE HB3 . . 5.000 2.909 2.756 3.066 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
371 1 21 CYS H 1 50 LYS H . . 5.000 4.317 4.173 4.408 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
372 1 21 CYS HA 1 23 TYR QD . . 8.140 4.634 3.514 5.732 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
373 1 21 CYS HA 1 23 TYR QE . . 8.130 5.625 3.964 7.186 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
374 1 21 CYS HA 1 49 PHE HA . . 6.000 3.353 3.237 3.461 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
375 1 21 CYS HA 1 50 LYS H . . 6.000 4.989 4.845 5.168 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
376 1 21 CYS HA 1 50 LYS QE . . 6.270 3.504 2.185 4.234 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
377 1 21 CYS HA 1 50 LYS HG2 . . 6.000 4.865 4.290 5.617 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
378 1 21 CYS HA 1 50 LYS HG3 . . 6.000 5.434 4.742 6.182 0.182 5 0 "[ . 1 . 2 . 3 . 4 . ]" 1
379 1 21 CYS QB 1 22 GLY H . . 3.520 2.834 2.703 2.890 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
380 1 21 CYS QB 1 23 TYR H . . 4.440 3.104 2.972 3.271 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
381 1 21 CYS QB 1 23 TYR QD . . 7.310 2.954 2.004 4.132 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
382 1 21 CYS QB 1 34 ARG QD . . 7.750 5.537 4.138 6.189 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
383 1 21 CYS QB 1 36 CYS H . . 6.880 5.560 5.417 5.721 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
384 1 21 CYS QB 1 37 CYS H . . 5.880 4.082 3.952 4.520 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
385 1 21 CYS QB 1 48 CYS H . . 6.880 4.368 4.220 4.438 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
386 1 21 CYS QB 1 49 PHE H . . 4.440 3.312 3.219 3.435 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
387 1 21 CYS QB 1 50 LYS H . . 5.460 4.212 4.108 4.295 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
388 1 21 CYS HB2 1 22 GLY H . . 3.800 3.607 3.465 3.739 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
389 1 21 CYS HB2 1 23 TYR H . . 5.000 4.751 4.500 5.004 0.004 47 0 "[ . 1 . 2 . 3 . 4 . ]" 1
390 1 21 CYS HB2 1 23 TYR QD . . 7.610 4.407 3.485 5.675 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
391 1 21 CYS HB2 1 23 TYR QE . . 7.640 5.661 4.737 7.058 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
392 1 21 CYS HB2 1 49 PHE H . . 5.000 3.394 3.287 3.547 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
393 1 21 CYS HB2 1 49 PHE HA . . 6.000 1.868 1.808 1.924 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
394 1 21 CYS HB2 1 50 LYS H . . 6.000 4.299 4.188 4.389 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
395 1 21 CYS HB3 1 22 GLY H . . 3.800 2.967 2.773 3.087 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
396 1 21 CYS HB3 1 23 TYR H . . 5.000 3.146 3.010 3.315 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
397 1 21 CYS HB3 1 23 TYR QD . . 7.610 3.010 2.017 4.252 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
398 1 21 CYS HB3 1 23 TYR QE . . 7.640 4.814 3.973 5.911 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
399 1 21 CYS HB3 1 49 PHE H . . 5.000 4.628 4.421 4.757 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
400 1 21 CYS HB3 1 49 PHE HA . . 6.000 3.561 3.401 3.635 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
401 1 21 CYS HB3 1 50 LYS H . . 6.000 6.026 5.930 6.098 0.098 36 0 "[ . 1 . 2 . 3 . 4 . ]" 1
402 1 21 CYS N 1 48 CYS O . . 3.000 2.397 2.283 2.465 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
403 1 21 CYS SG 1 36 CYS CB . . 3.100 3.375 3.232 3.587 0.487 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
404 1 21 CYS SG 1 36 CYS SG . . 2.100 1.909 1.804 2.005 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
405 1 22 GLY H 1 23 TYR H . . 3.230 3.015 2.869 3.171 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
406 1 22 GLY H 1 23 TYR HA . . 6.000 5.271 5.198 5.370 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
407 1 22 GLY H 1 23 TYR QD . . 8.140 4.973 4.280 5.692 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
408 1 22 GLY H 1 26 VAL QG . . 8.150 4.703 4.200 5.028 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
409 1 22 GLY H 1 46 PRO QG . . 6.880 5.534 5.280 5.755 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
410 1 22 GLY H 1 48 CYS H . . 6.000 4.610 4.417 4.752 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
411 1 22 GLY H 1 48 CYS HB2 . . 5.000 4.969 4.600 5.091 0.091 5 0 "[ . 1 . 2 . 3 . 4 . ]" 1
412 1 22 GLY H 1 48 CYS HB3 . . 5.000 3.219 2.925 3.327 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
413 1 22 GLY H 1 49 PHE HA . . 5.000 4.433 4.321 4.538 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
414 1 22 GLY H 1 49 PHE QB . . 6.880 5.184 5.063 5.335 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
415 1 22 GLY QA 1 48 CYS H . . 6.880 5.721 5.469 5.873 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
416 1 23 TYR H 1 26 VAL H . . 5.000 4.374 3.935 5.016 0.016 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
417 1 23 TYR H 1 26 VAL HA . . 6.000 4.567 4.155 4.917 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
418 1 23 TYR H 1 26 VAL HB . . 4.000 2.901 2.393 3.386 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
419 1 23 TYR H 1 26 VAL QG . . 6.260 3.434 3.107 3.816 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
420 1 23 TYR H 1 31 CYS QB . . 6.880 6.194 6.121 6.345 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
421 1 23 TYR H 1 47 TRP HE3 . . 6.000 6.034 5.871 6.090 0.090 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
422 1 23 TYR H 1 48 CYS HB2 . . 5.000 4.260 3.791 4.794 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
423 1 23 TYR H 1 48 CYS QB . . 4.220 2.954 2.543 3.420 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
424 1 23 TYR H 1 48 CYS HB3 . . 5.000 3.014 2.584 3.502 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
425 1 23 TYR HA 1 23 TYR QB . . 2.590 2.587 2.575 2.598 0.008 43 0 "[ . 1 . 2 . 3 . 4 . ]" 1
426 1 23 TYR HA 1 23 TYR QE . . 5.810 4.416 4.136 4.579 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
427 1 23 TYR HA 1 26 VAL HB . . 6.000 4.844 4.537 5.221 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
428 1 23 TYR HA 1 26 VAL QG . . 8.590 4.714 4.476 5.093 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
429 1 23 TYR QD 1 26 VAL H . . 7.990 4.211 3.681 5.145 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
430 1 23 TYR QD 1 26 VAL HA . . 7.990 3.992 3.012 4.851 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
431 1 23 TYR QD 1 26 VAL HB . . 7.680 4.526 4.300 4.706 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
432 1 23 TYR QD 1 26 VAL MG1 . . 9.170 5.005 4.754 5.193 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
433 1 23 TYR QD 1 26 VAL MG2 . . 9.170 5.123 4.877 5.404 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
434 1 23 TYR QD 1 31 CYS HA . . 8.140 4.033 3.193 5.059 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
435 1 23 TYR QD 1 34 ARG HB2 . . 8.140 4.296 3.625 4.887 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
436 1 23 TYR QD 1 34 ARG HB3 . . 8.140 4.183 3.546 5.037 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
437 1 23 TYR QD 1 34 ARG QD . . 7.200 3.021 1.875 4.631 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
438 1 23 TYR QD 1 34 ARG QG . . 9.020 3.611 2.579 4.375 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
439 1 23 TYR QD 1 35 GLY QA . . 9.020 6.760 5.948 7.050 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
440 1 23 TYR QD 1 49 PHE H . . 8.140 6.755 5.875 7.559 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
441 1 23 TYR QE 1 26 VAL HA . . 7.750 5.954 5.301 6.706 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
442 1 23 TYR QE 1 26 VAL HB . . 7.750 6.670 6.556 6.790 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
443 1 23 TYR QE 1 26 VAL MG1 . . 9.160 6.827 6.537 7.029 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
444 1 23 TYR QE 1 26 VAL MG2 . . 9.160 6.840 6.678 7.056 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
445 1 23 TYR QE 1 31 CYS HA . . 8.130 4.505 3.511 5.707 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
446 1 23 TYR QE 1 34 ARG HB2 . . 7.370 3.048 2.579 3.676 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
447 1 23 TYR QE 1 34 ARG HB3 . . 7.370 2.634 1.944 4.142 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
448 1 23 TYR QE 1 34 ARG HD2 . . 7.980 3.200 2.347 4.702 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
449 1 23 TYR QE 1 34 ARG QD . . 7.600 2.456 1.846 4.085 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
450 1 23 TYR QE 1 34 ARG HD3 . . 7.980 2.565 1.931 4.535 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
451 1 23 TYR QE 1 34 ARG HG2 . . 8.130 3.852 2.686 4.817 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
452 1 23 TYR QE 1 34 ARG HG3 . . 8.130 4.029 1.904 4.895 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
453 1 23 TYR QE 1 35 GLY QA . . 9.010 5.559 4.295 6.280 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
454 1 24 PRO QD 1 26 VAL H . . 5.880 4.415 3.980 5.026 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
455 1 25 HIS H 1 26 VAL H . . 4.020 2.409 2.056 2.936 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
456 1 25 HIS H 1 26 VAL HA . . 4.000 4.108 4.005 4.278 0.278 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
457 1 25 HIS H 1 34 ARG QB . . 6.880 6.283 6.096 6.419 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
458 1 25 HIS H 1 34 ARG QG . . 6.880 5.731 5.390 6.117 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
459 1 25 HIS HA 1 26 VAL H . . 3.190 2.990 2.650 3.198 0.008 30 0 "[ . 1 . 2 . 3 . 4 . ]" 1
460 1 25 HIS HA 1 27 THR H . . 6.000 5.880 5.701 6.040 0.040 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
461 1 25 HIS QB 1 26 VAL H . . 5.000 3.812 3.634 4.004 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
462 1 26 VAL H 1 26 VAL HA . . 2.880 2.728 2.651 2.853 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
463 1 26 VAL H 1 26 VAL HB . . 3.300 2.625 2.507 2.847 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
464 1 26 VAL H 1 27 THR H . . 5.000 4.550 4.454 4.587 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
465 1 26 VAL H 1 27 THR HA . . 6.000 5.816 5.599 5.897 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
466 1 26 VAL H 1 30 GLU QB . . 6.880 5.115 4.842 5.316 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
467 1 26 VAL H 1 31 CYS QB . . 6.880 6.329 6.176 6.435 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
468 1 26 VAL H 1 47 TRP HZ3 . . 6.000 5.530 4.926 6.035 0.035 44 0 "[ . 1 . 2 . 3 . 4 . ]" 1
469 1 26 VAL H 1 48 CYS QB . . 6.880 4.869 4.575 5.261 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
470 1 26 VAL HB 1 27 THR H . . 4.000 4.166 4.114 4.304 0.304 30 0 "[ . 1 . 2 . 3 . 4 . ]" 1
471 1 26 VAL QG 1 38 PHE QD . . 8.550 2.429 1.948 3.149 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
472 1 26 VAL QG 1 39 ASP H . . 8.050 4.767 4.139 5.301 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
473 1 26 VAL QG 1 47 TRP H . . 8.120 3.596 3.180 3.974 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
474 1 26 VAL QG 1 47 TRP HE3 . . 8.590 1.862 1.668 2.104 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
475 1 26 VAL QG 1 47 TRP HZ2 . . 8.590 5.344 5.117 5.600 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
476 1 26 VAL QG 1 48 CYS H . . 7.170 3.927 3.634 4.203 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
477 1 26 VAL QG 1 48 CYS HA . . 8.590 3.735 3.494 3.976 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
478 1 26 VAL MG1 1 38 PHE QD . . 9.150 5.022 4.554 5.686 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
479 1 26 VAL MG2 1 38 PHE QD . . 9.150 2.435 1.950 3.165 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
480 1 27 THR H 1 27 THR HA . . 2.900 2.832 2.817 2.850 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
481 1 27 THR H 1 27 THR HB . . 2.900 2.997 2.931 3.066 0.166 3 0 "[ . 1 . 2 . 3 . 4 . ]" 1
482 1 27 THR H 1 27 THR MG . . 4.000 3.462 3.363 3.576 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
483 1 27 THR H 1 28 PRO HA . . 5.000 4.643 4.619 4.674 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
484 1 27 THR H 1 28 PRO QD . . 6.270 4.193 4.166 4.223 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
485 1 27 THR H 1 29 LYS QB . . 6.880 5.915 5.802 6.061 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
486 1 27 THR H 1 30 GLU H . . 5.000 3.544 3.431 3.629 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
487 1 27 THR H 1 30 GLU HA . . 6.000 5.553 5.372 5.699 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
488 1 27 THR H 1 30 GLU HB2 . . 5.000 3.477 3.179 3.660 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
489 1 27 THR H 1 30 GLU QB . . 4.230 3.245 3.011 3.387 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
490 1 27 THR H 1 30 GLU HB3 . . 5.000 3.896 3.648 4.065 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
491 1 27 THR H 1 30 GLU QG . . 6.190 5.341 5.125 5.541 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
492 1 27 THR H 1 31 CYS H . . 4.000 2.533 2.357 2.637 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
493 1 27 THR H 1 31 CYS HA . . 6.000 4.152 3.985 4.362 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
494 1 27 THR H 1 31 CYS HB2 . . 6.000 3.063 2.730 3.504 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
495 1 27 THR H 1 31 CYS HB3 . . 6.000 4.328 4.257 4.462 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
496 1 27 THR H 1 48 CYS QB . . 6.880 4.089 3.910 4.221 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
497 1 27 THR HA 1 29 LYS H . . 5.000 4.388 4.302 4.503 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
498 1 27 THR HA 1 30 GLU H . . 6.000 4.483 4.364 4.646 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
499 1 27 THR HB 1 30 GLU H . . 6.000 3.532 3.277 3.842 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
500 1 27 THR HB 1 31 CYS H . . 6.000 4.188 3.928 4.477 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
501 1 27 THR MG 1 29 LYS H . . 7.030 2.275 2.003 2.625 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
502 1 27 THR MG 1 30 GLU H . . 5.470 1.810 1.747 1.841 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
503 1 27 THR MG 1 31 CYS H . . 4.250 3.410 3.356 3.475 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
504 1 27 THR MG 1 32 ASN H . . 6.310 4.992 4.780 5.125 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
505 1 27 THR MG 1 33 ASN H . . 7.030 5.610 5.481 5.723 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
506 1 27 THR O 1 30 GLU H . . 2.000 2.269 2.187 2.318 0.318 11 0 "[ . 1 . 2 . 3 . 4 . ]" 1
507 1 27 THR O 1 30 GLU N . . 3.000 3.116 3.078 3.138 0.138 1 0 "[ . 1 . 2 . 3 . 4 . ]" 1
508 1 27 THR O 1 31 CYS H . . 2.000 2.078 2.029 2.136 0.136 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
509 1 27 THR O 1 31 CYS N . . 3.000 3.047 3.020 3.113 0.113 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
510 1 28 PRO HA 1 30 GLU H . . 6.000 4.099 4.031 4.150 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
511 1 28 PRO HA 1 31 CYS H . . 5.000 4.394 4.266 4.487 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
512 1 28 PRO HA 1 32 ASN H . . 5.000 4.294 3.820 4.763 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
513 1 28 PRO HA 1 38 PHE H . . 5.000 4.640 4.150 5.019 0.019 37 0 "[ . 1 . 2 . 3 . 4 . ]" 1
514 1 28 PRO QD 1 29 LYS H . . 5.020 3.924 3.834 4.037 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
515 1 28 PRO QD 1 30 GLU H . . 6.880 4.378 4.240 4.546 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
516 1 28 PRO QD 1 31 CYS H . . 6.880 5.265 5.203 5.329 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
517 1 29 LYS H 1 29 LYS HB2 . . 3.500 3.434 3.292 3.708 0.208 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
518 1 29 LYS H 1 29 LYS QB . . 3.050 3.031 3.004 3.102 0.052 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
519 1 29 LYS H 1 29 LYS HB3 . . 3.500 3.402 3.236 3.576 0.076 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
520 1 29 LYS H 1 30 GLU H . . 4.000 1.588 1.501 1.687 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
521 1 29 LYS H 1 30 GLU HB2 . . 6.000 3.696 3.591 3.797 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
522 1 29 LYS H 1 30 GLU HB3 . . 6.000 4.803 4.682 4.956 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
523 1 29 LYS H 1 30 GLU QG . . 6.000 5.148 4.887 5.373 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
524 1 29 LYS H 1 31 CYS H . . 6.000 2.719 2.601 2.809 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
525 1 29 LYS H 1 31 CYS QB . . 6.880 3.717 3.609 3.859 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
526 1 29 LYS H 1 32 ASN H . . 6.000 3.356 3.113 3.603 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
527 1 29 LYS H 1 32 ASN QB . . 6.880 3.886 3.533 4.421 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
528 1 29 LYS H 1 33 ASN QB . . 6.880 4.840 4.638 5.015 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
529 1 29 LYS HA 1 29 LYS QD . . 4.370 3.351 2.936 3.917 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
530 1 29 LYS HA 1 31 CYS QB . . 6.880 5.597 5.413 5.834 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
531 1 29 LYS HA 1 32 ASN HA . . 6.000 6.147 6.070 6.235 0.235 26 0 "[ . 1 . 2 . 3 . 4 . ]" 1
532 1 29 LYS HA 1 33 ASN H . . 5.000 4.886 4.617 5.197 0.197 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
533 1 29 LYS QB 1 30 GLU H . . 3.650 3.117 3.009 3.231 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
534 1 29 LYS QB 1 31 CYS H . . 6.880 5.043 4.942 5.130 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
535 1 29 LYS QB 1 32 ASN H . . 6.880 5.522 5.475 5.595 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
536 1 29 LYS HB2 1 30 GLU H . . 4.000 4.023 3.858 4.304 0.304 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
537 1 29 LYS HB3 1 30 GLU H . . 4.000 3.256 3.091 3.432 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
538 1 29 LYS QG 1 30 GLU H . . 5.430 4.317 3.943 4.579 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
539 1 29 LYS QG 1 31 CYS H . . 6.880 5.956 5.631 6.164 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
540 1 29 LYS QG 1 32 ASN H . . 6.880 5.746 5.474 5.927 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
541 1 29 LYS QG 1 33 ASN H . . 6.880 5.689 5.329 5.981 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
542 1 29 LYS QG 1 33 ASN HD21 . . 6.610 5.278 4.885 5.608 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
543 1 29 LYS QG 1 33 ASN QD . . 6.460 4.952 4.674 5.137 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
544 1 29 LYS QG 1 33 ASN HD22 . . 6.610 6.009 5.944 6.086 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
545 1 30 GLU H 1 30 GLU HA . . 2.770 2.896 2.888 2.905 0.135 31 0 "[ . 1 . 2 . 3 . 4 . ]" 1
546 1 30 GLU H 1 30 GLU HB2 . . 3.300 2.183 2.154 2.215 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
547 1 30 GLU H 1 30 GLU QB . . 2.920 2.156 2.128 2.186 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
548 1 30 GLU H 1 30 GLU HB3 . . 3.300 3.331 3.236 3.411 0.111 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
549 1 30 GLU H 1 30 GLU QG . . 4.710 3.773 3.490 3.991 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
550 1 30 GLU H 1 31 CYS H . . 2.770 2.221 2.170 2.275 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
551 1 30 GLU H 1 31 CYS HA . . 5.000 4.819 4.767 4.874 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
552 1 30 GLU H 1 31 CYS HB2 . . 6.000 4.112 4.028 4.281 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
553 1 30 GLU H 1 31 CYS QB . . 5.450 4.014 3.936 4.167 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
554 1 30 GLU H 1 31 CYS HB3 . . 6.000 5.605 5.537 5.718 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
555 1 30 GLU H 1 32 ASN H . . 5.000 3.840 3.715 3.978 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
556 1 30 GLU H 1 32 ASN QB . . 6.880 4.701 4.564 4.996 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
557 1 30 GLU H 1 33 ASN H . . 5.000 4.391 4.254 4.617 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
558 1 30 GLU H 1 33 ASN QB . . 5.880 4.194 4.101 4.315 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
559 1 30 GLU HA 1 31 CYS H . . 3.500 3.614 3.596 3.625 0.125 36 0 "[ . 1 . 2 . 3 . 4 . ]" 1
560 1 30 GLU HA 1 33 ASN H . . 3.500 3.384 3.275 3.503 0.003 11 0 "[ . 1 . 2 . 3 . 4 . ]" 1
561 1 30 GLU HA 1 33 ASN HB2 . . 5.000 2.781 2.208 3.430 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
562 1 30 GLU HA 1 33 ASN QB . . 4.440 2.116 1.934 2.206 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
563 1 30 GLU HA 1 33 ASN HB3 . . 5.000 2.284 1.952 2.688 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
564 1 30 GLU HA 1 33 ASN HD21 . . 5.090 2.983 2.663 3.187 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
565 1 30 GLU HA 1 33 ASN QD . . 4.810 2.949 2.641 3.141 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
566 1 30 GLU HA 1 33 ASN HD22 . . 5.090 4.641 4.333 4.834 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
567 1 30 GLU HA 1 34 ARG H . . 4.000 4.144 4.075 4.201 0.201 36 0 "[ . 1 . 2 . 3 . 4 . ]" 1
568 1 30 GLU QB 1 31 CYS H . . 2.910 2.713 2.644 2.804 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
569 1 30 GLU QB 1 32 ASN H . . 5.450 4.856 4.763 4.951 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
570 1 30 GLU QB 1 33 ASN H . . 6.880 4.458 4.382 4.560 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
571 1 30 GLU QB 1 33 ASN QD . . 6.300 4.590 4.079 4.843 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
572 1 30 GLU HB2 1 31 CYS H . . 3.110 3.006 2.879 3.169 0.059 30 0 "[ . 1 . 2 . 3 . 4 . ]" 1
573 1 30 GLU HB2 1 32 ASN H . . 6.000 5.439 5.315 5.582 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
574 1 30 GLU HB3 1 31 CYS H . . 3.110 3.093 3.006 3.205 0.095 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
575 1 30 GLU HB3 1 32 ASN H . . 6.000 5.465 5.372 5.562 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
576 1 30 GLU QG 1 31 CYS H . . 5.000 4.503 4.443 4.565 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
577 1 30 GLU QG 1 33 ASN H . . 6.000 5.013 4.851 5.214 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
578 1 30 GLU QG 1 33 ASN HD21 . . 6.760 3.197 2.722 3.601 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
579 1 30 GLU QG 1 33 ASN HD22 . . 6.760 4.630 4.051 5.054 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
580 1 30 GLU QG 1 34 ARG H . . 6.880 5.160 4.951 5.506 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
581 1 30 GLU O 1 33 ASN H . . 2.000 1.949 1.694 2.209 0.209 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
582 1 30 GLU O 1 33 ASN N . . 3.000 2.776 2.561 3.025 0.025 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
583 1 30 GLU O 1 34 ARG H . . 2.000 1.783 1.742 1.858 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
584 1 30 GLU O 1 34 ARG N . . 3.000 2.502 2.424 2.666 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
585 1 31 CYS CB 1 48 CYS SG . . 3.100 3.005 2.863 3.175 0.075 11 0 "[ . 1 . 2 . 3 . 4 . ]" 1
586 1 31 CYS H 1 31 CYS HA . . 2.730 2.763 2.734 2.797 0.067 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
587 1 31 CYS H 1 31 CYS HB2 . . 3.500 2.247 2.148 2.407 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
588 1 31 CYS H 1 31 CYS HB3 . . 3.500 3.507 3.461 3.551 0.051 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
589 1 31 CYS H 1 32 ASN H . . 5.000 2.785 2.700 2.867 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
590 1 31 CYS H 1 32 ASN HA . . 6.000 5.270 5.200 5.327 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
591 1 31 CYS H 1 32 ASN HB2 . . 6.000 4.595 4.488 4.959 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
592 1 31 CYS H 1 32 ASN QB . . 5.450 4.460 4.359 4.782 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
593 1 31 CYS H 1 32 ASN HB3 . . 6.000 6.028 5.907 6.274 0.274 42 0 "[ . 1 . 2 . 3 . 4 . ]" 1
594 1 31 CYS H 1 33 ASN H . . 6.000 3.628 3.564 3.747 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
595 1 31 CYS H 1 33 ASN QB . . 5.880 4.416 4.261 4.498 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
596 1 31 CYS H 1 34 ARG H . . 5.000 4.434 4.289 4.715 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
597 1 31 CYS H 1 34 ARG QG . . 6.880 4.064 3.652 4.706 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
598 1 31 CYS H 1 38 PHE H . . 6.000 5.858 5.437 6.036 0.036 29 0 "[ . 1 . 2 . 3 . 4 . ]" 1
599 1 31 CYS H 1 38 PHE QB . . 6.880 4.099 3.607 4.462 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
600 1 31 CYS H 1 38 PHE QD . . 8.120 4.305 3.645 4.680 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
601 1 31 CYS HA 1 33 ASN H . . 6.000 3.518 3.458 3.560 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
602 1 31 CYS HA 1 34 ARG H . . 3.640 3.038 2.905 3.370 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
603 1 31 CYS HA 1 35 GLY H . . 4.480 3.997 3.713 4.217 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
604 1 31 CYS HA 1 36 CYS H . . 5.000 3.544 3.246 3.729 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
605 1 31 CYS HA 1 37 CYS H . . 6.000 5.835 5.590 6.070 0.070 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
606 1 31 CYS HA 1 38 PHE QD . . 8.120 5.640 4.987 6.054 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
607 1 31 CYS QB 1 32 ASN H . . 3.060 2.465 2.337 2.537 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
608 1 31 CYS QB 1 32 ASN QD . . 5.350 2.902 2.676 3.651 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
609 1 31 CYS QB 1 33 ASN H . . 4.480 4.090 4.046 4.124 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
610 1 31 CYS QB 1 34 ARG H . . 5.450 4.500 4.370 4.865 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
611 1 31 CYS QB 1 35 GLY H . . 5.450 4.697 4.496 4.855 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
612 1 31 CYS QB 1 37 CYS H . . 4.440 3.626 3.469 3.834 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
613 1 31 CYS QB 1 38 PHE H . . 6.420 3.514 3.082 3.685 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
614 1 31 CYS QB 1 38 PHE QD . . 8.010 3.041 2.726 3.369 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
615 1 31 CYS QB 1 48 CYS H . . 6.880 5.691 5.381 5.902 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
616 1 31 CYS HB2 1 32 ASN H . . 3.610 2.558 2.385 2.655 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
617 1 31 CYS HB2 1 32 ASN HD21 . . 6.000 3.269 2.821 4.937 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
618 1 31 CYS HB2 1 32 ASN HD22 . . 6.000 4.700 4.246 4.968 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
619 1 31 CYS HB2 1 33 ASN H . . 4.820 4.497 4.414 4.555 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
620 1 31 CYS HB2 1 34 ARG H . . 6.000 5.226 5.089 5.615 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
621 1 31 CYS HB2 1 35 GLY H . . 6.000 5.868 5.703 6.006 0.006 22 0 "[ . 1 . 2 . 3 . 4 . ]" 1
622 1 31 CYS HB2 1 36 CYS H . . 5.000 4.909 4.631 5.043 0.043 36 0 "[ . 1 . 2 . 3 . 4 . ]" 1
623 1 31 CYS HB2 1 37 CYS H . . 5.000 5.185 5.082 5.259 0.259 38 0 "[ . 1 . 2 . 3 . 4 . ]" 1
624 1 31 CYS HB3 1 32 ASN H . . 3.610 3.244 3.030 3.376 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
625 1 31 CYS HB3 1 32 ASN HD21 . . 6.000 3.450 3.271 4.386 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
626 1 31 CYS HB3 1 32 ASN HD22 . . 6.000 4.660 4.330 4.827 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
627 1 31 CYS HB3 1 33 ASN H . . 4.820 4.703 4.606 4.787 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
628 1 31 CYS HB3 1 34 ARG H . . 6.000 4.911 4.759 5.331 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
629 1 31 CYS HB3 1 35 GLY H . . 6.000 4.943 4.701 5.135 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
630 1 31 CYS HB3 1 36 CYS H . . 5.000 3.625 3.346 3.807 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
631 1 31 CYS HB3 1 37 CYS H . . 5.000 3.703 3.531 3.948 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
632 1 31 CYS O 1 35 GLY H . . 2.000 1.876 1.665 2.033 0.033 13 0 "[ . 1 . 2 . 3 . 4 . ]" 1
633 1 31 CYS O 1 35 GLY N . . 3.000 2.781 2.589 2.915 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
634 1 31 CYS O 1 36 CYS H . . 2.000 1.594 1.400 1.667 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
635 1 31 CYS O 1 36 CYS N . . 3.000 2.583 2.356 2.656 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
636 1 31 CYS SG 1 48 CYS CB . . 3.100 2.851 2.780 2.900 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
637 1 31 CYS SG 1 48 CYS SG . . 2.100 1.972 1.809 2.113 0.013 35 0 "[ . 1 . 2 . 3 . 4 . ]" 1
638 1 32 ASN H 1 32 ASN HA . . 2.900 2.774 2.743 2.818 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
639 1 32 ASN H 1 32 ASN HB2 . . 3.500 2.097 2.058 2.518 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
640 1 32 ASN H 1 32 ASN QB . . 2.880 2.078 2.041 2.468 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
641 1 32 ASN H 1 32 ASN HB3 . . 3.500 3.412 3.378 3.553 0.053 42 0 "[ . 1 . 2 . 3 . 4 . ]" 1
642 1 32 ASN H 1 33 ASN H . . 2.920 2.665 2.633 2.705 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
643 1 32 ASN H 1 33 ASN HA . . 6.000 5.085 4.979 5.159 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
644 1 32 ASN H 1 33 ASN QB . . 4.880 4.246 4.152 4.349 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
645 1 32 ASN H 1 34 ARG H . . 5.000 4.150 4.063 4.453 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
646 1 32 ASN H 1 34 ARG HG2 . . 6.000 5.707 4.658 5.938 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
647 1 32 ASN H 1 34 ARG HG3 . . 6.000 5.127 4.913 6.032 0.032 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
648 1 32 ASN H 1 35 GLY H . . 5.000 4.815 4.713 4.913 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
649 1 32 ASN H 1 36 CYS H . . 5.000 4.404 4.259 4.509 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
650 1 32 ASN H 1 37 CYS HA . . 6.000 4.545 4.170 4.723 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
651 1 32 ASN H 1 38 PHE H . . 5.240 4.217 3.890 4.376 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
652 1 32 ASN H 1 38 PHE QB . . 6.650 3.557 3.319 3.665 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
653 1 32 ASN H 1 38 PHE QD . . 7.970 5.092 4.582 5.340 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
654 1 32 ASN HA 1 32 ASN HD21 . . 3.500 2.661 1.934 2.951 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
655 1 32 ASN HA 1 32 ASN QD . . 3.140 2.585 1.924 2.840 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
656 1 32 ASN HA 1 32 ASN HD22 . . 3.500 3.536 3.444 3.697 0.197 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
657 1 32 ASN HA 1 33 ASN H . . 3.500 3.366 3.241 3.410 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
658 1 32 ASN HA 1 33 ASN HA . . 6.000 4.584 4.561 4.636 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
659 1 32 ASN HA 1 34 ARG H . . 5.000 4.251 4.167 4.458 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
660 1 32 ASN HA 1 35 GLY H . . 3.640 3.520 3.407 3.636 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
661 1 32 ASN HA 1 36 CYS H . . 3.500 3.051 2.930 3.185 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
662 1 32 ASN HA 1 37 CYS H . . 6.000 5.141 5.055 5.291 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
663 1 32 ASN HA 1 37 CYS HA . . 6.000 3.537 3.405 3.700 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
664 1 32 ASN QB 1 36 CYS H . . 5.450 5.048 4.970 5.138 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
665 1 32 ASN QB 1 38 PHE H . . 6.880 4.307 4.218 4.597 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
666 1 32 ASN HB2 1 36 CYS H . . 6.000 5.654 5.577 5.820 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
667 1 32 ASN HB3 1 36 CYS H . . 6.000 5.681 5.525 5.802 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
668 1 32 ASN QD 1 33 ASN H . . 5.450 4.549 4.396 4.851 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
669 1 32 ASN QD 1 36 CYS H . . 6.870 4.567 4.240 4.745 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
670 1 32 ASN QD 1 37 CYS H . . 5.870 4.252 4.126 4.358 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
671 1 32 ASN QD 1 37 CYS HA . . 4.420 1.857 1.774 1.899 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
672 1 32 ASN QD 1 37 CYS QB . . 6.820 3.656 3.499 3.754 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
673 1 32 ASN QD 1 38 PHE QB . . 4.280 2.641 2.529 2.939 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
674 1 32 ASN HD21 1 33 ASN H . . 6.000 4.683 4.511 5.090 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
675 1 32 ASN HD21 1 37 CYS HA . . 4.670 2.532 2.030 2.659 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
676 1 32 ASN HD21 1 37 CYS HB2 . . 7.750 5.070 4.139 5.262 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
677 1 32 ASN HD21 1 37 CYS HB3 . . 7.750 5.397 4.977 5.534 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
678 1 32 ASN HD21 1 38 PHE HB2 . . 5.390 3.003 2.720 4.558 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
679 1 32 ASN HD21 1 38 PHE HB3 . . 5.390 3.520 3.319 4.914 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
680 1 32 ASN HD22 1 33 ASN H . . 6.000 6.184 6.045 6.240 0.240 24 0 "[ . 1 . 2 . 3 . 4 . ]" 1
681 1 32 ASN HD22 1 37 CYS HA . . 4.670 1.913 1.832 1.961 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
682 1 32 ASN HD22 1 37 CYS HB2 . . 7.750 4.173 3.866 4.310 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
683 1 32 ASN HD22 1 37 CYS HB3 . . 7.750 4.464 4.139 4.572 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
684 1 32 ASN HD22 1 38 PHE HB2 . . 5.390 3.741 3.393 3.952 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
685 1 32 ASN HD22 1 38 PHE HB3 . . 5.390 3.543 3.250 3.721 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
686 1 32 ASN ND2 1 38 PHE H . . 2.000 2.249 2.203 2.375 0.375 42 0 "[ . 1 . 2 . 3 . 4 . ]" 1
687 1 32 ASN ND2 1 38 PHE N . . 3.000 3.153 3.098 3.256 0.256 42 0 "[ . 1 . 2 . 3 . 4 . ]" 1
688 1 33 ASN H 1 33 ASN HA . . 2.900 2.903 2.884 2.908 0.008 30 0 "[ . 1 . 2 . 3 . 4 . ]" 1
689 1 33 ASN H 1 33 ASN HB2 . . 2.900 2.746 2.352 3.014 0.114 16 0 "[ . 1 . 2 . 3 . 4 . ]" 1
690 1 33 ASN H 1 33 ASN QB . . 2.560 2.324 2.246 2.373 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
691 1 33 ASN H 1 33 ASN HB3 . . 2.900 2.581 2.366 2.847 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
692 1 33 ASN H 1 33 ASN HD21 . . 6.000 4.655 4.250 4.891 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
693 1 33 ASN H 1 33 ASN HD22 . . 6.000 5.807 5.564 5.959 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
694 1 33 ASN H 1 34 ARG H . . 2.900 1.987 1.938 2.149 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
695 1 33 ASN H 1 34 ARG HA . . 6.000 4.625 4.582 4.771 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
696 1 33 ASN H 1 34 ARG HB2 . . 6.000 4.893 4.393 5.505 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
697 1 33 ASN H 1 34 ARG QB . . 5.450 4.182 3.837 4.580 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
698 1 33 ASN H 1 34 ARG HB3 . . 6.000 4.963 3.925 5.695 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
699 1 33 ASN H 1 34 ARG HG2 . . 5.000 4.104 2.966 5.117 0.117 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
700 1 33 ASN H 1 34 ARG HG3 . . 5.000 3.913 3.624 4.692 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
701 1 33 ASN H 1 35 GLY H . . 4.250 3.403 3.284 3.468 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
702 1 33 ASN H 1 35 GLY QA . . 6.880 5.193 4.987 5.253 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
703 1 33 ASN H 1 36 CYS H . . 6.000 4.043 3.759 4.120 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
704 1 33 ASN H 1 38 PHE QB . . 6.880 5.941 5.678 6.083 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
705 1 33 ASN HA 1 34 ARG H . . 3.500 3.553 3.530 3.611 0.111 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
706 1 33 ASN HA 1 35 GLY H . . 5.000 4.204 4.071 4.618 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
707 1 33 ASN HA 1 36 CYS H . . 6.000 5.538 5.468 5.670 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
708 1 33 ASN QB 1 34 ARG H . . 3.340 2.839 2.558 2.939 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
709 1 33 ASN QB 1 35 GLY H . . 5.450 4.648 4.464 4.803 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
710 1 33 ASN HB2 1 34 ARG H . . 4.000 3.939 3.558 4.177 0.177 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
711 1 33 ASN HB2 1 35 GLY H . . 6.000 5.609 5.282 5.883 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
712 1 33 ASN HB3 1 34 ARG H . . 4.000 2.914 2.594 3.004 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
713 1 33 ASN HB3 1 35 GLY H . . 6.000 4.963 4.814 5.093 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
714 1 33 ASN QD 1 34 ARG QB . . 7.740 5.281 3.809 6.200 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
715 1 33 ASN QD 1 34 ARG QG . . 6.820 4.804 4.177 5.434 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
716 1 33 ASN HD21 1 34 ARG HG2 . . 7.750 5.423 4.454 6.539 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
717 1 33 ASN HD21 1 34 ARG HG3 . . 7.750 6.212 5.893 7.038 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
718 1 33 ASN HD22 1 34 ARG HG2 . . 7.750 6.589 5.682 7.775 0.025 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
719 1 33 ASN HD22 1 34 ARG HG3 . . 7.750 7.434 7.226 7.843 0.093 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
720 1 34 ARG H 1 34 ARG HA . . 2.880 2.852 2.836 2.866 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
721 1 34 ARG H 1 34 ARG HB2 . . 3.500 3.038 2.605 3.586 0.086 16 0 "[ . 1 . 2 . 3 . 4 . ]" 1
722 1 34 ARG H 1 34 ARG QB . . 3.290 2.518 2.278 2.819 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
723 1 34 ARG H 1 34 ARG HB3 . . 3.500 3.116 2.306 3.601 0.101 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
724 1 34 ARG H 1 34 ARG QD . . 4.670 4.056 2.472 4.399 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
725 1 34 ARG H 1 34 ARG HG2 . . 4.000 2.680 1.579 3.593 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
726 1 34 ARG H 1 34 ARG HG3 . . 4.000 2.551 2.298 3.220 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
727 1 34 ARG H 1 35 GLY H . . 2.850 2.312 2.256 2.382 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
728 1 34 ARG H 1 35 GLY HA2 . . 5.000 4.687 4.623 4.757 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
729 1 34 ARG H 1 35 GLY HA3 . . 5.000 4.997 4.950 5.053 0.053 13 0 "[ . 1 . 2 . 3 . 4 . ]" 1
730 1 34 ARG H 1 36 CYS H . . 3.500 3.369 3.270 3.446 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
731 1 34 ARG H 1 36 CYS HA . . 6.000 6.241 6.173 6.304 0.304 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
732 1 34 ARG HA 1 34 ARG HD2 . . 4.780 4.499 3.374 5.052 0.272 30 0 "[ . 1 . 2 . 3 . 4 . ]" 1
733 1 34 ARG HA 1 34 ARG QD . . 4.420 3.465 3.303 4.262 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
734 1 34 ARG HA 1 34 ARG HD3 . . 4.780 3.768 3.425 4.971 0.191 8 0 "[ . 1 . 2 . 3 . 4 . ]" 1
735 1 34 ARG HA 1 35 GLY H . . 3.300 3.530 3.503 3.590 0.290 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
736 1 34 ARG HA 1 36 CYS H . . 5.000 5.052 4.909 5.119 0.119 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
737 1 34 ARG QB 1 35 GLY H . . 3.840 3.206 2.873 3.572 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
738 1 34 ARG QB 1 36 CYS H . . 4.720 3.730 3.173 4.355 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
739 1 34 ARG HB2 1 34 ARG HD2 . . 4.220 3.280 2.047 3.629 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
740 1 34 ARG HB2 1 34 ARG HD3 . . 4.220 2.974 2.172 4.180 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
741 1 34 ARG HB2 1 35 GLY H . . 4.000 3.497 2.928 4.295 0.295 4 0 "[ . 1 . 2 . 3 . 4 . ]" 1
742 1 34 ARG HB2 1 36 CYS H . . 5.000 4.072 3.218 5.165 0.165 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
743 1 34 ARG HB3 1 34 ARG HD2 . . 4.220 3.386 2.051 4.216 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
744 1 34 ARG HB3 1 34 ARG HD3 . . 4.220 2.654 1.985 3.874 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
745 1 34 ARG HB3 1 35 GLY H . . 4.000 4.071 3.743 4.275 0.275 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
746 1 34 ARG HB3 1 36 CYS H . . 5.000 4.867 4.443 5.221 0.221 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
747 1 34 ARG QG 1 35 GLY H . . 5.600 3.105 1.882 3.903 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
748 1 34 ARG QG 1 36 CYS H . . 5.460 3.469 2.130 4.451 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
749 1 34 ARG QG 1 50 LYS QE . . 7.760 6.233 5.724 6.508 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
750 1 34 ARG HG2 1 35 GLY H . . 6.000 4.044 2.020 4.379 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
751 1 34 ARG HG2 1 36 CYS H . . 5.850 4.614 2.553 5.377 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
752 1 34 ARG HG3 1 35 GLY H . . 6.000 3.407 1.894 4.407 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
753 1 34 ARG HG3 1 36 CYS H . . 5.850 3.660 2.143 4.762 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
754 1 35 GLY H 1 35 GLY HA2 . . 2.770 2.473 2.436 2.574 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
755 1 35 GLY H 1 35 GLY QA . . 2.530 2.355 2.329 2.420 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
756 1 35 GLY H 1 35 GLY HA3 . . 2.770 2.959 2.945 2.962 0.192 31 0 "[ . 1 . 2 . 3 . 4 . ]" 1
757 1 35 GLY H 1 36 CYS H . . 2.880 1.786 1.620 1.862 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
758 1 35 GLY H 1 36 CYS HA . . 5.000 4.506 4.343 4.572 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
759 1 35 GLY H 1 37 CYS H . . 6.000 6.195 6.090 6.264 0.264 9 0 "[ . 1 . 2 . 3 . 4 . ]" 1
760 1 35 GLY QA 1 36 CYS H . . 3.190 2.913 2.893 2.951 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
761 1 35 GLY QA 1 36 CYS HA . . 4.880 4.003 4.001 4.008 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
762 1 35 GLY QA 1 37 CYS H . . 6.880 6.065 5.867 6.113 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
763 1 35 GLY QA 1 50 LYS HA . . 5.880 5.451 5.369 5.529 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
764 1 35 GLY HA2 1 36 CYS H . . 3.500 3.099 3.062 3.183 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
765 1 35 GLY HA3 1 36 CYS H . . 3.500 3.540 3.493 3.559 0.059 38 0 "[ . 1 . 2 . 3 . 4 . ]" 1
766 1 36 CYS H 1 37 CYS H . . 5.000 4.423 4.383 4.484 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
767 1 36 CYS H 1 37 CYS QB . . 6.880 5.460 5.396 5.639 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
768 1 36 CYS H 1 49 PHE H . . 6.000 5.935 5.806 6.075 0.075 11 0 "[ . 1 . 2 . 3 . 4 . ]" 1
769 1 36 CYS HA 1 37 CYS H . . 2.900 2.662 2.433 2.739 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
770 1 36 CYS HA 1 37 CYS HA . . 6.000 4.452 4.367 4.482 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
771 1 36 CYS HA 1 38 PHE H . . 6.000 6.260 6.094 6.345 0.345 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
772 1 36 CYS HA 1 48 CYS QB . . 6.880 6.195 5.965 6.288 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
773 1 36 CYS HA 1 49 PHE H . . 6.000 4.108 4.033 4.204 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
774 1 36 CYS HA 1 50 LYS H . . 6.000 4.708 4.557 4.879 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
775 1 36 CYS QB 1 37 CYS H . . 3.300 2.162 2.041 2.596 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
776 1 36 CYS HB2 1 37 CYS H . . 3.530 3.274 3.016 3.747 0.217 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
777 1 36 CYS HB2 1 49 PHE H . . 6.000 4.054 3.818 4.546 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
778 1 36 CYS HB3 1 37 CYS H . . 3.530 2.194 2.062 2.662 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
779 1 36 CYS HB3 1 49 PHE H . . 6.000 2.619 2.458 2.847 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
780 1 37 CYS H 1 37 CYS HA . . 2.900 2.929 2.915 2.932 0.032 23 0 "[ . 1 . 2 . 3 . 4 . ]" 1
781 1 37 CYS H 1 37 CYS HB2 . . 3.500 2.846 2.395 2.955 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
782 1 37 CYS H 1 37 CYS HB3 . . 3.500 2.844 2.629 2.989 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
783 1 37 CYS H 1 38 PHE HA . . 5.000 4.679 4.589 4.958 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
784 1 37 CYS H 1 38 PHE QD . . 7.130 6.406 6.273 6.671 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
785 1 37 CYS H 1 39 ASP H . . 6.000 6.032 5.918 6.176 0.176 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
786 1 37 CYS H 1 48 CYS HA . . 4.710 3.332 3.193 3.955 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
787 1 37 CYS H 1 48 CYS QB . . 6.880 4.996 4.828 5.624 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
788 1 37 CYS H 1 49 PHE H . . 2.850 1.923 1.839 2.391 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
789 1 37 CYS H 1 49 PHE HA . . 5.000 4.013 3.942 4.274 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
790 1 37 CYS H 1 49 PHE HD1 . . 6.000 4.524 4.209 4.788 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
791 1 37 CYS H 1 49 PHE HD2 . . 5.430 4.541 4.369 4.684 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
792 1 37 CYS H 1 49 PHE O . . 2.000 1.708 1.628 1.786 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
793 1 37 CYS H 1 50 LYS H . . 6.000 4.641 4.480 4.691 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
794 1 37 CYS H 1 50 LYS HA . . 3.680 3.652 3.211 3.746 0.066 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
795 1 37 CYS H 1 50 LYS QG . . 6.880 5.717 5.411 6.023 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
796 1 37 CYS H 1 51 PRO HD2 . . 5.200 3.230 2.586 3.404 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
797 1 37 CYS H 1 51 PRO QD . . 4.550 2.680 2.252 2.790 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
798 1 37 CYS H 1 51 PRO HD3 . . 5.200 2.863 2.478 2.994 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
799 1 37 CYS H 1 53 GLN QB . . 6.880 5.802 5.421 5.962 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
800 1 37 CYS H 1 53 GLN QG . . 5.820 3.922 3.532 4.084 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
801 1 37 CYS HA 1 37 CYS QB . . 2.650 2.437 2.379 2.511 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
802 1 37 CYS HA 1 38 PHE H . . 2.900 2.231 2.223 2.245 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
803 1 37 CYS HA 1 38 PHE HA . . 6.000 4.384 4.369 4.391 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
804 1 37 CYS HA 1 39 ASP H . . 6.000 5.937 5.871 6.066 0.066 44 0 "[ . 1 . 2 . 3 . 4 . ]" 1
805 1 37 CYS HA 1 49 PHE H . . 5.000 4.342 4.267 4.504 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
806 1 37 CYS HA 1 53 GLN QB . . 6.880 6.381 6.302 6.493 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
807 1 37 CYS HA 1 53 GLN QG . . 5.880 4.939 4.469 5.211 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
808 1 37 CYS QB 1 38 PHE H . . 4.180 3.784 3.653 3.848 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
809 1 37 CYS QB 1 39 ASP H . . 6.880 5.227 4.933 5.491 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
810 1 37 CYS QB 1 49 PHE H . . 3.890 3.225 2.999 3.562 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
811 1 37 CYS QB 1 49 PHE HA . . 6.880 5.228 4.991 5.546 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
812 1 37 CYS HB2 1 38 PHE H . . 5.000 4.457 4.373 4.522 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
813 1 37 CYS HB2 1 49 PHE H . . 4.100 4.187 4.096 4.294 0.194 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
814 1 37 CYS HB3 1 38 PHE H . . 5.000 4.094 3.857 4.200 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
815 1 37 CYS HB3 1 49 PHE H . . 4.100 3.356 3.071 3.847 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
816 1 37 CYS N 1 49 PHE O . . 3.000 2.458 2.369 2.583 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
817 1 37 CYS O 1 49 PHE H . . 2.000 2.161 2.072 2.213 0.213 37 0 "[ . 1 . 2 . 3 . 4 . ]" 1
818 1 37 CYS O 1 49 PHE N . . 3.000 3.038 2.941 3.124 0.124 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
819 1 38 PHE H 1 38 PHE HB2 . . 2.880 2.463 2.324 2.551 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
820 1 38 PHE H 1 38 PHE QB . . 2.690 2.161 2.127 2.189 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
821 1 38 PHE H 1 38 PHE HB3 . . 2.880 2.397 2.324 2.480 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
822 1 38 PHE H 1 39 ASP H . . 5.000 4.491 4.449 4.569 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
823 1 38 PHE H 1 39 ASP QB . . 6.880 5.714 5.626 5.994 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
824 1 38 PHE HA 1 39 ASP H . . 2.900 2.196 2.192 2.212 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
825 1 38 PHE HA 1 40 SER H . . 6.000 4.963 4.808 5.425 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
826 1 38 PHE HA 1 48 CYS QB . . 6.880 3.775 3.444 4.268 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
827 1 38 PHE QB 1 39 ASP H . . 4.440 3.891 3.813 3.923 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
828 1 38 PHE QB 1 48 CYS HA . . 6.880 4.256 4.046 4.723 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
829 1 38 PHE HB2 1 39 ASP H . . 5.000 4.458 4.385 4.511 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
830 1 38 PHE HB3 1 39 ASP H . . 5.000 4.289 4.163 4.355 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
831 1 38 PHE QD 1 39 ASP H . . 5.800 3.841 3.673 3.911 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
832 1 38 PHE QD 1 39 ASP HA . . 8.050 4.504 4.297 4.878 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
833 1 38 PHE QD 1 39 ASP QB . . 6.080 4.967 4.535 5.065 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
834 1 38 PHE QD 1 41 ARG H . . 8.120 5.725 5.346 5.989 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
835 1 38 PHE QD 1 47 TRP HE3 . . 6.720 4.827 4.410 5.706 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
836 1 38 PHE QD 1 48 CYS H . . 7.890 5.577 5.327 6.021 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
837 1 38 PHE QD 1 48 CYS QB . . 8.660 3.391 2.930 4.369 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
838 1 38 PHE QD 1 49 PHE H . . 7.410 6.092 5.872 6.379 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
839 1 38 PHE QE 1 39 ASP H . . 7.590 4.881 4.660 4.987 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
840 1 38 PHE QE 1 40 SER H . . 5.000 4.696 4.121 4.906 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
841 1 38 PHE QE 1 41 ARG H . . 7.590 5.776 5.584 6.003 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
842 1 38 PHE QE 1 47 TRP HE3 . . 5.990 3.792 3.201 4.857 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
843 1 38 PHE QE 1 48 CYS H . . 7.740 6.547 6.273 6.973 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
844 1 38 PHE HZ 1 47 TRP HE3 . . 6.000 5.285 4.318 5.992 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
845 1 39 ASP H 1 39 ASP HB2 . . 3.040 2.843 2.628 3.132 0.092 39 0 "[ . 1 . 2 . 3 . 4 . ]" 1
846 1 39 ASP H 1 39 ASP HB3 . . 3.040 2.252 2.078 2.368 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
847 1 39 ASP H 1 40 SER H . . 5.000 2.983 2.846 3.477 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
848 1 39 ASP H 1 41 ARG H . . 6.000 4.872 4.749 5.082 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
849 1 39 ASP H 1 46 PRO QB . . 6.880 5.929 5.767 6.041 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
850 1 39 ASP H 1 47 TRP H . . 6.000 4.861 4.492 5.000 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
851 1 39 ASP H 1 47 TRP HA . . 3.420 2.168 1.704 2.400 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
852 1 39 ASP H 1 48 CYS HA . . 5.890 3.973 3.784 4.288 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
853 1 39 ASP H 1 48 CYS QB . . 6.880 4.793 4.583 4.945 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
854 1 39 ASP H 1 49 PHE H . . 5.000 5.084 4.883 5.207 0.207 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
855 1 39 ASP H 1 49 PHE HD1 . . 6.000 4.440 4.213 4.592 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
856 1 39 ASP HA 1 40 SER H . . 3.500 3.614 3.541 3.632 0.132 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
857 1 39 ASP HA 1 41 ARG H . . 4.000 3.561 3.496 3.613 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
858 1 39 ASP QB 1 41 ARG H . . 4.490 3.352 3.127 3.595 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
859 1 39 ASP QB 1 42 ILE H . . 6.880 3.764 3.443 4.008 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
860 1 39 ASP QB 1 47 TRP H . . 5.450 4.404 3.631 4.685 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
861 1 39 ASP HB2 1 47 TRP H . . 6.000 5.810 4.157 6.162 0.162 22 0 "[ . 1 . 2 . 3 . 4 . ]" 1
862 1 39 ASP HB3 1 47 TRP H . . 6.000 4.571 3.952 4.884 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
863 1 39 ASP OD1 1 41 ARG H . . 2.000 2.404 1.700 2.910 0.910 46 27 "[***-*** ** ** *****2 . * **** .* * 4** .+*]" 1
864 1 39 ASP OD1 1 41 ARG N . . 3.000 3.218 2.443 3.796 0.796 46 24 "[*** -** ** * *****2 . * *3** .* * 4** .+*]" 1
865 1 39 ASP OD1 1 42 ILE H . . 2.000 3.050 2.085 3.851 1.851 46 27 "[***-*** ** ** *****2 . * **** .* * 4** .+*]" 1
866 1 39 ASP OD1 1 42 ILE N . . 3.000 3.865 3.022 4.601 1.601 46 27 "[***-*** ** ** *****2 . * **** .* * 4** .+*]" 1
867 1 40 SER H 1 41 ARG H . . 3.500 2.746 2.522 3.027 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
868 1 40 SER H 1 41 ARG HA . . 5.000 5.120 4.955 5.262 0.262 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
869 1 40 SER H 1 41 ARG QG . . 5.880 4.408 4.117 4.682 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
870 1 40 SER H 1 45 VAL H . . 6.000 6.143 6.013 6.263 0.263 17 0 "[ . 1 . 2 . 3 . 4 . ]" 1
871 1 41 ARG H 1 41 ARG HA . . 2.810 2.768 2.700 2.873 0.063 44 0 "[ . 1 . 2 . 3 . 4 . ]" 1
872 1 41 ARG H 1 41 ARG QB . . 3.870 2.479 2.320 2.650 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
873 1 41 ARG H 1 41 ARG HG2 . . 2.770 2.591 1.980 2.868 0.098 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
874 1 41 ARG H 1 41 ARG HG3 . . 2.770 2.390 1.910 2.722 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
875 1 41 ARG H 1 42 ILE H . . 2.920 2.693 2.410 2.961 0.041 18 0 "[ . 1 . 2 . 3 . 4 . ]" 1
876 1 41 ARG H 1 42 ILE HG12 . . 5.010 4.978 4.514 5.098 0.088 22 0 "[ . 1 . 2 . 3 . 4 . ]" 1
877 1 41 ARG H 1 42 ILE QG . . 4.760 4.107 3.940 4.224 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
878 1 41 ARG H 1 42 ILE HG13 . . 5.010 4.386 4.111 4.617 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
879 1 41 ARG HA 1 41 ARG QB . . 2.670 2.388 2.318 2.467 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
880 1 41 ARG HA 1 41 ARG HD2 . . 5.540 4.576 3.888 4.927 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
881 1 41 ARG HA 1 41 ARG QD . . 4.960 3.928 3.646 4.193 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
882 1 41 ARG HA 1 41 ARG HD3 . . 5.540 4.334 3.796 4.900 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
883 1 41 ARG HA 1 41 ARG QG . . 3.580 2.370 2.182 2.575 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
884 1 41 ARG HA 1 42 ILE H . . 3.500 3.622 3.601 3.650 0.150 24 0 "[ . 1 . 2 . 3 . 4 . ]" 1
885 1 41 ARG QB 1 45 VAL QG . . 7.680 4.148 3.617 4.527 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
886 1 41 ARG QD 1 42 ILE H . . 6.880 5.081 4.677 5.352 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
887 1 41 ARG QG 1 42 ILE H . . 4.880 3.847 3.563 4.060 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
888 1 42 ILE H 1 42 ILE HA . . 2.900 2.938 2.934 2.940 0.040 24 0 "[ . 1 . 2 . 3 . 4 . ]" 1
889 1 42 ILE H 1 42 ILE HB . . 2.900 2.883 2.796 3.017 0.117 29 0 "[ . 1 . 2 . 3 . 4 . ]" 1
890 1 42 ILE H 1 42 ILE MD . . 4.900 3.990 3.673 4.143 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
891 1 42 ILE H 1 42 ILE HG12 . . 3.800 3.037 2.729 3.249 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
892 1 42 ILE H 1 42 ILE QG . . 3.380 2.321 1.900 2.526 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
893 1 42 ILE H 1 42 ILE HG13 . . 3.800 2.423 1.933 2.776 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
894 1 42 ILE H 1 42 ILE MG . . 4.520 3.884 3.794 3.906 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
895 1 42 ILE H 1 43 PRO QG . . 6.880 5.682 5.476 5.948 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
896 1 42 ILE H 1 45 VAL H . . 6.000 4.688 4.336 4.911 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
897 1 42 ILE H 1 47 TRP HE1 . . 5.700 5.878 5.738 6.021 0.321 26 0 "[ . 1 . 2 . 3 . 4 . ]" 1
898 1 42 ILE HA 1 42 ILE HG12 . . 3.640 2.744 2.603 2.971 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
899 1 42 ILE HA 1 42 ILE QG . . 3.460 2.657 2.543 2.829 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
900 1 42 ILE HA 1 42 ILE HG13 . . 3.640 3.568 3.469 3.758 0.118 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
901 1 42 ILE HA 1 43 PRO HD2 . . 3.380 2.264 2.204 2.410 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
902 1 42 ILE HA 1 43 PRO QD . . 3.150 1.874 1.841 1.917 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
903 1 42 ILE HA 1 43 PRO HD3 . . 3.380 2.004 1.911 2.107 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
904 1 42 ILE HA 1 43 PRO QG . . 5.080 3.810 3.797 3.838 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
905 1 42 ILE HB 1 43 PRO HA . . 6.000 5.004 4.902 5.072 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
906 1 42 ILE HB 1 45 VAL H . . 5.000 2.981 2.562 3.226 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
907 1 42 ILE HB 1 45 VAL MG1 . . 6.120 2.141 1.824 3.098 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
908 1 42 ILE HB 1 45 VAL QG . . 5.100 1.976 1.693 2.887 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
909 1 42 ILE HB 1 45 VAL MG2 . . 6.120 2.398 1.906 3.576 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
910 1 42 ILE HB 1 47 TRP HE1 . . 6.000 5.682 5.412 5.908 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
911 1 42 ILE QG 1 43 PRO HA . . 6.880 5.905 5.815 5.955 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
912 1 42 ILE MG 1 43 PRO HA . . 6.460 4.601 4.480 4.801 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
913 1 42 ILE MG 1 44 GLY H . . 7.030 2.109 1.915 2.646 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
914 1 42 ILE MG 1 45 VAL HA . . 7.030 4.776 4.530 5.176 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
915 1 42 ILE MG 1 45 VAL QG . . 8.630 2.316 1.736 3.727 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
916 1 42 ILE MG 1 47 TRP HE1 . . 7.030 5.415 5.246 5.708 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
917 1 42 ILE O 1 45 VAL H . . 2.000 2.222 2.191 2.281 0.281 41 0 "[ . 1 . 2 . 3 . 4 . ]" 1
918 1 42 ILE O 1 45 VAL N . . 3.000 3.190 3.169 3.224 0.224 41 0 "[ . 1 . 2 . 3 . 4 . ]" 1
919 1 43 PRO HA 1 44 GLY QA . . 6.880 4.278 4.257 4.300 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
920 1 43 PRO HA 1 45 VAL QG . . 8.590 4.337 4.138 4.806 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
921 1 43 PRO HA 1 47 TRP HE1 . . 5.000 1.867 1.812 1.913 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
922 1 43 PRO HA 1 47 TRP HZ2 . . 4.750 4.340 4.097 4.467 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
923 1 43 PRO QB 1 45 VAL H . . 5.880 4.794 4.750 4.823 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
924 1 43 PRO QB 1 47 TRP HE1 . . 5.620 3.300 3.117 3.456 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
925 1 43 PRO HB2 1 47 TRP HE1 . . 6.000 3.674 3.468 3.864 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
926 1 43 PRO HB3 1 47 TRP HE1 . . 6.000 3.736 3.532 3.895 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
927 1 43 PRO QG 1 45 VAL H . . 5.880 5.265 5.146 5.338 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
928 1 43 PRO QG 1 47 TRP HE1 . . 6.880 4.844 4.728 4.946 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
929 1 43 PRO O 1 47 TRP HE1 . . 2.000 2.038 1.993 2.091 0.091 44 0 "[ . 1 . 2 . 3 . 4 . ]" 1
930 1 43 PRO O 1 47 TRP NE1 . . 3.000 3.093 3.049 3.127 0.127 15 0 "[ . 1 . 2 . 3 . 4 . ]" 1
931 1 44 GLY H 1 45 VAL H . . 3.450 2.329 2.286 2.369 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
932 1 44 GLY H 1 45 VAL HA . . 5.000 4.889 4.848 4.926 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
933 1 44 GLY H 1 45 VAL QG . . 8.590 3.328 2.822 4.314 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
934 1 44 GLY H 1 47 TRP HE1 . . 6.000 4.017 3.884 4.233 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
935 1 44 GLY QA 1 45 VAL HA . . 4.880 4.022 4.020 4.026 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
936 1 44 GLY HA2 1 45 VAL H . . 3.190 3.409 3.372 3.445 0.255 31 0 "[ . 1 . 2 . 3 . 4 . ]" 1
937 1 44 GLY HA3 1 45 VAL H . . 3.190 3.297 3.254 3.341 0.151 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
938 1 45 VAL H 1 45 VAL HA . . 2.900 2.938 2.928 2.941 0.041 10 0 "[ . 1 . 2 . 3 . 4 . ]" 1
939 1 45 VAL H 1 45 VAL MG1 . . 3.990 2.465 2.175 2.945 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
940 1 45 VAL H 1 45 VAL QG . . 3.430 2.303 2.048 2.836 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
941 1 45 VAL H 1 45 VAL MG2 . . 3.990 2.833 2.413 3.699 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
942 1 45 VAL H 1 46 PRO QB . . 6.850 6.199 6.155 6.307 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
943 1 45 VAL H 1 46 PRO HD2 . . 5.010 4.730 4.637 4.858 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
944 1 45 VAL H 1 46 PRO QD . . 4.720 4.247 4.196 4.312 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
945 1 45 VAL H 1 46 PRO HD3 . . 5.010 4.807 4.791 4.824 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
946 1 45 VAL H 1 47 TRP HE1 . . 4.970 3.352 3.172 3.605 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
947 1 45 VAL HA 1 47 TRP H . . 6.000 5.842 5.701 5.977 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
948 1 45 VAL QG 1 47 TRP H . . 8.590 4.078 3.831 4.252 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
949 1 45 VAL QG 1 47 TRP QB . . 9.470 4.432 4.153 4.611 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
950 1 45 VAL QG 1 47 TRP HE1 . . 7.370 4.274 4.062 4.547 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
951 1 46 PRO HA 1 47 TRP H . . 2.900 2.151 2.148 2.161 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
952 1 46 PRO HA 1 48 CYS H . . 3.260 3.434 3.385 3.497 0.237 22 0 "[ . 1 . 2 . 3 . 4 . ]" 1
953 1 46 PRO QB 1 47 TRP H . . 4.300 3.546 3.445 3.643 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
954 1 46 PRO QB 1 48 CYS H . . 3.650 2.545 2.494 2.609 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
955 1 46 PRO HB2 1 48 CYS H . . 4.000 2.579 2.526 2.647 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
956 1 46 PRO HB3 1 48 CYS H . . 4.000 3.909 3.849 3.951 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
957 1 46 PRO QD 1 47 TRP H . . 5.470 4.899 4.837 4.951 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
958 1 46 PRO QG 1 47 TRP H . . 5.370 4.940 4.903 4.968 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
959 1 46 PRO HG2 1 48 CYS H . . 6.000 4.350 4.213 4.422 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
960 1 46 PRO HG3 1 48 CYS H . . 6.000 5.309 5.235 5.362 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
961 1 47 TRP H 1 47 TRP HD1 . . 3.990 3.560 3.290 3.817 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
962 1 47 TRP H 1 47 TRP HE1 . . 6.000 4.514 4.324 4.740 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
963 1 47 TRP H 1 47 TRP HE3 . . 5.280 3.316 3.076 3.580 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
964 1 47 TRP H 1 47 TRP HZ3 . . 6.000 4.958 4.699 5.218 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
965 1 47 TRP H 1 48 CYS H . . 3.500 2.864 2.755 2.951 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
966 1 47 TRP H 1 48 CYS HA . . 6.000 5.135 5.039 5.206 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
967 1 47 TRP H 1 48 CYS HB2 . . 5.000 4.509 4.282 4.647 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
968 1 47 TRP H 1 48 CYS QB . . 4.440 4.000 3.902 4.069 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
969 1 47 TRP H 1 48 CYS HB3 . . 5.000 4.482 4.320 4.776 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
970 1 47 TRP HA 1 47 TRP HE1 . . 6.000 5.713 5.649 5.849 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
971 1 47 TRP HA 1 48 CYS H . . 3.570 2.998 2.971 3.038 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
972 1 47 TRP HA 1 48 CYS QB . . 6.880 4.539 4.515 4.570 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
973 1 47 TRP HE3 1 48 CYS H . . 6.000 5.056 4.705 5.263 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
974 1 47 TRP HE3 1 48 CYS QB . . 6.880 3.817 3.458 3.953 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
975 1 47 TRP HZ3 1 48 CYS QB . . 6.040 5.331 4.868 5.493 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
976 1 48 CYS H 1 48 CYS HB2 . . 3.300 3.440 3.294 3.535 0.235 36 0 "[ . 1 . 2 . 3 . 4 . ]" 1
977 1 48 CYS H 1 48 CYS HB3 . . 3.300 3.162 3.112 3.281 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
978 1 48 CYS H 1 49 PHE H . . 5.000 3.623 3.431 3.740 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
979 1 48 CYS H 1 49 PHE HA . . 5.000 4.534 4.452 4.611 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
980 1 48 CYS H 1 49 PHE QB . . 5.880 4.056 3.947 4.154 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
981 1 48 CYS H 1 49 PHE HD2 . . 6.000 6.121 6.055 6.181 0.181 10 0 "[ . 1 . 2 . 3 . 4 . ]" 1
982 1 48 CYS HA 1 49 PHE H . . 2.310 2.241 2.222 2.290 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
983 1 48 CYS HA 1 49 PHE HA . . 6.000 4.386 4.378 4.392 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
984 1 48 CYS QB 1 49 PHE H . . 4.440 3.992 3.941 4.034 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
985 1 48 CYS HB2 1 49 PHE H . . 5.000 4.541 4.448 4.666 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
986 1 48 CYS HB3 1 49 PHE H . . 5.000 4.427 4.352 4.468 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
987 1 49 PHE H 1 49 PHE HA . . 2.900 2.910 2.892 2.924 0.024 11 0 "[ . 1 . 2 . 3 . 4 . ]" 1
988 1 49 PHE H 1 49 PHE HB2 . . 3.500 3.583 3.492 3.642 0.142 2 0 "[ . 1 . 2 . 3 . 4 . ]" 1
989 1 49 PHE H 1 49 PHE HB3 . . 3.500 3.547 3.477 3.599 0.099 22 0 "[ . 1 . 2 . 3 . 4 . ]" 1
990 1 49 PHE H 1 49 PHE HD1 . . 3.380 2.653 2.420 2.916 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
991 1 49 PHE H 1 49 PHE HD2 . . 4.060 4.046 3.979 4.157 0.097 41 0 "[ . 1 . 2 . 3 . 4 . ]" 1
992 1 49 PHE H 1 50 LYS H . . 5.000 4.340 4.320 4.386 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
993 1 49 PHE H 1 50 LYS HA . . 5.000 4.627 4.582 4.677 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
994 1 49 PHE HA 1 49 PHE HB2 . . 3.070 2.732 2.704 2.766 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
995 1 49 PHE HA 1 49 PHE HB3 . . 3.070 2.355 2.340 2.368 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
996 1 49 PHE HA 1 50 LYS H . . 2.900 2.772 2.693 2.808 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
997 1 49 PHE HA 1 50 LYS QG . . 6.880 3.778 3.304 4.343 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
998 1 49 PHE QB 1 50 LYS H . . 4.490 1.919 1.863 2.056 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
999 1 49 PHE HD1 1 50 LYS H . . 5.090 5.262 5.223 5.313 0.223 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1000 1 49 PHE HD2 1 50 LYS H . . 5.540 3.673 3.571 3.833 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1001 1 50 LYS H 1 50 LYS QB . . 3.500 3.091 3.036 3.138 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1002 1 50 LYS H 1 50 LYS QD . . 4.000 2.730 2.345 3.745 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1003 1 50 LYS H 1 50 LYS QE . . 4.600 3.966 2.050 4.248 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1004 1 50 LYS H 1 50 LYS QG . . 5.000 1.800 1.689 2.018 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1005 1 50 LYS H 1 51 PRO HD2 . . 5.540 4.223 4.141 4.286 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1006 1 50 LYS H 1 51 PRO QD . . 5.270 2.957 2.855 3.034 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1007 1 50 LYS H 1 51 PRO HD3 . . 5.540 3.019 2.910 3.103 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1008 1 50 LYS H 2 57 CYS HA . . 6.000 5.993 5.320 6.158 0.158 21 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1009 1 50 LYS H 2 59 PHE QB . . 6.880 5.849 5.221 6.338 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1010 1 50 LYS HA 1 50 LYS QG . . 3.710 3.337 3.295 3.379 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1011 1 50 LYS HA 1 53 GLN QB . . 5.880 3.363 2.844 3.586 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1012 1 50 LYS QG 1 53 GLN QE . . 7.750 6.103 5.917 6.354 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1013 1 50 LYS QG 2 59 PHE H . . 6.880 5.318 4.490 6.071 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1014 1 51 PRO HA 1 52 LEU H . . 3.300 3.417 3.377 3.459 0.159 44 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1015 1 52 LEU H 1 52 LEU HA . . 2.900 2.906 2.891 2.912 0.012 22 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1016 1 52 LEU H 1 52 LEU QB . . 2.900 2.397 2.277 2.507 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1017 1 52 LEU H 1 52 LEU QD . . 4.000 2.521 1.800 3.100 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1018 1 52 LEU H 1 53 GLN H . . 3.500 2.969 2.682 3.096 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1019 1 52 LEU H 1 53 GLN QB . . 6.880 5.079 4.765 5.205 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1020 1 52 LEU H 1 53 GLN QG . . 5.880 3.869 3.802 4.011 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1021 1 52 LEU H 1 54 GLU H . . 5.000 4.919 4.750 5.025 0.025 30 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1022 1 52 LEU H 1 55 ALA H . . 6.000 5.844 5.786 5.909 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1023 1 52 LEU H 1 55 ALA MB . . 7.030 5.772 5.661 5.897 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1024 1 52 LEU HA 1 55 ALA MB . . 7.030 5.300 5.001 5.504 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1025 1 52 LEU QB 1 53 GLN H . . 5.880 4.098 4.037 4.110 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1026 1 52 LEU QB 1 54 GLU H . . 5.880 4.231 4.080 4.529 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1027 1 52 LEU QB 1 55 ALA H . . 6.880 4.401 4.269 4.584 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1028 1 52 LEU QD 1 53 GLN H . . 8.130 3.996 2.889 4.352 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1029 1 52 LEU QD 1 53 GLN HE21 . . 8.130 4.361 2.244 6.149 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1030 1 52 LEU QD 1 53 GLN HE22 . . 8.130 4.478 2.644 5.879 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1031 1 52 LEU QD 1 54 GLU H . . 6.130 4.289 3.912 4.736 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1032 1 52 LEU QD 1 55 ALA H . . 8.130 3.226 2.695 3.806 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1033 1 52 LEU O 1 55 ALA H . . 2.000 2.048 1.937 2.096 0.096 19 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1034 1 52 LEU O 1 55 ALA N . . 3.000 3.038 2.920 3.088 0.088 19 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1035 1 53 GLN H 1 53 GLN HB2 . . 3.500 2.464 2.349 2.502 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1036 1 53 GLN H 1 53 GLN HB3 . . 3.500 3.548 3.539 3.552 0.052 10 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1037 1 53 GLN H 1 53 GLN HE21 . . 6.000 3.332 2.279 4.748 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1038 1 53 GLN H 1 53 GLN HE22 . . 6.000 4.580 3.967 5.480 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1039 1 53 GLN H 1 53 GLN HG2 . . 3.500 2.056 1.989 2.261 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1040 1 53 GLN H 1 53 GLN HG3 . . 3.500 3.551 3.503 3.668 0.168 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1041 1 53 GLN H 1 54 GLU HA . . 6.000 5.112 5.064 5.180 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1042 1 53 GLN H 1 55 ALA H . . 5.000 4.469 4.354 4.531 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1043 1 53 GLN H 1 55 ALA MB . . 6.880 5.093 4.983 5.199 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1044 1 53 GLN H 2 57 CYS HA . . 6.000 5.744 5.444 6.169 0.169 44 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1045 1 53 GLN H 2 58 THR HA . . 6.000 3.938 3.485 4.461 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1046 1 53 GLN QB 1 57 CYS H . . 5.880 4.052 3.920 4.323 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1047 1 53 GLN HB2 1 55 ALA H . . 5.000 4.969 4.918 5.004 0.004 21 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1048 1 53 GLN HB2 1 58 THR H . . 6.000 4.915 4.677 5.425 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1049 1 53 GLN HB3 1 55 ALA H . . 5.000 4.862 4.794 4.945 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1050 1 53 GLN HB3 1 58 THR H . . 6.000 4.843 4.656 5.185 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1051 1 53 GLN QE 1 54 GLU H . . 6.870 4.948 4.343 5.354 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1052 1 53 GLN QE 1 55 ALA MB . . 7.900 4.405 4.111 4.680 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1053 1 53 GLN QE 1 56 GLU H . . 6.870 5.318 4.198 6.103 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1054 1 53 GLN QG 1 54 GLU H . . 4.880 4.273 4.181 4.418 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1055 1 53 GLN QG 1 55 ALA H . . 6.880 5.525 5.450 5.567 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1056 1 53 GLN QG 1 58 THR H . . 6.880 6.344 6.195 6.589 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1057 1 53 GLN O 1 57 CYS H . . 2.000 2.052 1.802 2.183 0.183 15 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1058 1 53 GLN O 1 57 CYS N . . 3.000 2.752 2.540 2.943 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1059 1 54 GLU H 1 54 GLU HA . . 2.900 2.653 2.614 2.705 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1060 1 54 GLU H 1 54 GLU HB2 . . 3.500 3.391 2.616 3.563 0.063 11 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1061 1 54 GLU H 1 54 GLU HB3 . . 3.500 2.217 2.078 2.718 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1062 1 54 GLU H 1 58 THR H . . 6.000 4.266 4.103 4.389 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1063 1 54 GLU H 2 57 CYS HA . . 6.000 6.062 5.866 6.265 0.265 10 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1064 1 54 GLU H 2 58 THR H . . 6.000 4.938 4.501 5.261 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1065 1 54 GLU H 2 58 THR HA . . 6.000 2.417 2.200 2.600 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1066 1 54 GLU H 2 58 THR MG . . 6.030 5.009 4.842 5.189 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1067 1 54 GLU QB 1 57 CYS H . . 5.880 4.664 4.429 4.907 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1068 1 54 GLU QB 1 59 PHE H . . 6.880 4.514 3.878 5.377 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1069 1 55 ALA H 1 55 ALA HA . . 2.900 2.672 2.639 2.769 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1070 1 55 ALA H 1 57 CYS H . . 6.000 3.730 3.364 3.850 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1071 1 55 ALA H 1 58 THR H . . 6.000 4.670 4.129 5.070 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1072 1 55 ALA H 1 58 THR HB . . 6.000 5.602 4.552 6.108 0.108 38 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1073 1 55 ALA H 1 58 THR MG . . 7.030 4.692 4.310 5.647 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1074 1 55 ALA H 2 58 THR HA . . 6.000 5.157 4.839 5.548 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1075 1 55 ALA MB 1 57 CYS H . . 6.030 3.826 3.625 4.012 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1076 1 55 ALA MB 1 57 CYS HA . . 7.030 5.854 5.703 6.032 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1077 1 55 ALA MB 1 58 THR H . . 6.990 5.388 4.966 5.861 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1078 1 55 ALA MB 1 59 PHE H . . 7.030 5.645 5.085 5.894 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1079 1 56 GLU H 1 57 CYS HA . . 5.000 4.429 4.223 4.964 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1080 1 56 GLU H 1 57 CYS QB . . 4.560 3.522 3.293 4.113 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1081 1 56 GLU H 1 58 THR H . . 5.000 4.630 4.213 5.149 0.149 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1082 1 57 CYS CB 2 57 CYS SG . . 3.100 3.150 2.865 3.241 0.141 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1083 1 57 CYS H 1 57 CYS HA . . 2.900 2.918 2.893 2.925 0.025 42 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1084 1 57 CYS H 1 57 CYS HB2 . . 3.500 2.715 2.157 3.677 0.177 20 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1085 1 57 CYS H 1 57 CYS HB3 . . 3.500 2.697 2.329 3.342 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1086 1 57 CYS H 1 58 THR H . . 3.380 2.408 2.111 3.023 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1087 1 57 CYS H 1 58 THR HA . . 5.000 4.895 4.730 5.263 0.263 10 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1088 1 57 CYS H 1 58 THR MG . . 6.000 3.903 3.601 4.781 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1089 1 57 CYS H 2 53 GLN QG . . 6.880 6.251 6.017 6.454 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1090 1 57 CYS H 2 58 THR HA . . 6.000 5.865 5.252 6.294 0.294 30 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1091 1 57 CYS HA 1 58 THR HA . . 6.000 4.735 4.625 4.846 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1092 1 57 CYS HA 1 58 THR MG . . 7.030 5.475 5.133 5.969 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1093 1 57 CYS HA 1 59 PHE H . . 6.000 4.493 3.996 4.980 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1094 1 57 CYS HB2 1 58 THR H . . 3.490 3.491 2.502 3.870 0.380 11 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1095 1 57 CYS HB3 1 58 THR H . . 3.490 2.287 1.889 3.491 0.001 20 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1096 1 57 CYS SG 2 57 CYS CB . . 3.100 3.216 2.988 3.295 0.195 4 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1097 1 57 CYS SG 2 57 CYS SG . . 2.100 1.804 1.645 2.129 0.029 20 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1098 1 58 THR H 1 58 THR HB . . 3.490 2.199 1.968 2.411 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1099 1 58 THR H 1 59 PHE H . . 3.640 2.592 2.207 3.063 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1100 1 58 THR HA 1 59 PHE H . . 3.500 3.560 3.347 3.619 0.119 7 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1101 1 58 THR HB 1 59 PHE H . . 4.000 3.784 3.325 4.074 0.074 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1102 1 58 THR MG 1 59 PHE H . . 5.360 2.243 1.903 3.115 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1103 1 59 PHE H 1 59 PHE HA . . 2.430 2.626 2.603 2.649 0.219 24 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1104 1 59 PHE H 1 59 PHE HB2 . . 3.340 2.098 1.938 3.304 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1105 1 59 PHE H 1 59 PHE QB . . 2.980 2.011 1.922 2.155 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1106 1 59 PHE H 1 59 PHE HB3 . . 3.340 2.865 1.992 3.207 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1107 2 2 GLU H 2 3 TYR H . . 3.800 3.679 2.302 3.986 0.186 38 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1108 2 2 GLU H 2 3 TYR QD . . 8.140 4.385 2.918 6.092 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1109 2 2 GLU H 2 4 VAL QG . . 8.120 4.294 2.497 5.523 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1110 2 2 GLU HA 2 3 TYR H . . 3.300 2.852 2.426 3.448 0.148 20 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1111 2 2 GLU HA 2 4 VAL H . . 5.000 4.582 3.962 5.009 0.009 44 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1112 2 3 TYR H 2 3 TYR HB2 . . 3.300 2.805 1.943 3.478 0.178 2 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1113 2 3 TYR H 2 3 TYR QB . . 3.050 2.413 1.929 2.821 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1114 2 3 TYR H 2 3 TYR HB3 . . 3.300 3.085 2.518 3.480 0.180 39 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1115 2 3 TYR H 2 4 VAL H . . 4.630 3.874 3.631 4.114 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1116 2 3 TYR H 2 4 VAL HA . . 5.960 5.174 5.072 5.418 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1117 2 3 TYR H 2 4 VAL QG . . 6.070 3.524 3.169 4.121 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1118 2 3 TYR H 2 6 LEU H . . 6.000 6.180 6.045 6.344 0.344 8 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1119 2 3 TYR HA 2 4 VAL H . . 2.470 2.447 2.301 2.601 0.131 21 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1120 2 3 TYR HA 2 6 LEU H . . 4.750 3.741 3.648 3.900 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1121 2 3 TYR HA 2 7 SER H . . 6.000 4.875 4.558 5.116 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1122 2 3 TYR QB 2 6 LEU H . . 5.280 4.671 4.223 4.893 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1123 2 3 TYR QD 2 4 VAL H . . 8.140 4.560 3.622 4.948 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1124 2 4 VAL H 2 4 VAL HA . . 2.900 2.936 2.920 2.941 0.041 41 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1125 2 4 VAL H 2 4 VAL HB . . 3.800 3.244 2.476 3.779 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1126 2 4 VAL H 2 6 LEU QB . . 5.510 4.986 4.736 5.122 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1127 2 4 VAL H 2 6 LEU QD . . 4.330 2.290 1.901 3.176 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1128 2 4 VAL HA 2 6 LEU H . . 3.300 3.526 3.446 3.623 0.323 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1129 2 4 VAL HA 2 7 SER H . . 3.500 3.302 2.958 3.560 0.060 39 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1130 2 4 VAL HA 2 8 ALA H . . 6.000 5.630 4.867 6.102 0.102 36 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1131 2 4 VAL HA 2 10 GLN H . . 6.000 5.714 4.846 6.094 0.094 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1132 2 4 VAL QG 2 6 LEU H . . 6.560 3.838 3.568 4.122 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1133 2 4 VAL O 2 7 SER H . . 2.000 2.055 2.006 2.144 0.144 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1134 2 4 VAL O 2 7 SER N . . 3.000 3.034 2.927 3.109 0.109 29 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1135 2 6 LEU H 2 6 LEU QB . . 3.680 3.157 2.762 3.340 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1136 2 6 LEU H 2 7 SER H . . 3.640 1.942 1.695 2.289 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1137 2 6 LEU H 2 9 ASN QB . . 6.880 5.831 4.952 6.371 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1138 2 6 LEU H 2 10 GLN H . . 6.000 5.225 4.750 5.648 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1139 2 6 LEU H 2 10 GLN QB . . 4.790 3.727 3.138 4.237 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1140 2 6 LEU QB 2 7 SER H . . 4.220 3.961 3.426 4.087 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1141 2 6 LEU QB 2 52 LEU HA . . 5.360 4.493 3.518 4.989 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1142 2 6 LEU QD 2 7 SER H . . 7.600 3.081 2.552 3.920 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1143 2 6 LEU QD 2 10 GLN H . . 8.130 5.612 5.048 6.033 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1144 2 6 LEU QD 2 10 GLN HE21 . . 7.980 4.718 3.487 5.938 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1145 2 6 LEU QD 2 10 GLN QE . . 7.630 4.025 2.591 4.878 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1146 2 6 LEU QD 2 10 GLN HE22 . . 7.980 4.525 2.650 5.625 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1147 2 7 SER H 2 8 ALA HA . . 6.000 5.396 5.208 6.003 0.003 21 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1148 2 7 SER H 2 10 GLN H . . 6.000 3.622 3.196 4.185 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1149 2 7 SER H 2 10 GLN HB2 . . 4.000 3.064 2.510 3.843 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1150 2 7 SER H 2 10 GLN QB . . 3.650 2.872 2.489 3.237 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1151 2 7 SER H 2 10 GLN HB3 . . 4.000 3.979 2.537 4.376 0.376 21 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1152 2 7 SER H 2 10 GLN HE21 . . 6.030 4.931 3.544 6.114 0.084 27 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1153 2 7 SER H 2 10 GLN HE22 . . 6.030 5.675 4.871 6.249 0.219 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1154 2 7 SER H 2 11 CYS H . . 6.000 5.892 5.591 6.273 0.273 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1155 2 7 SER HA 2 7 SER HB2 . . 3.040 2.564 2.249 2.881 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1156 2 7 SER HA 2 7 SER HB3 . . 3.040 2.771 2.394 3.051 0.011 24 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1157 2 7 SER HA 2 10 GLN H . . 5.000 4.765 3.795 5.189 0.189 11 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1158 2 7 SER O 2 10 GLN H . . 2.000 1.950 1.736 2.081 0.081 36 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1159 2 7 SER O 2 10 GLN N . . 3.000 2.923 2.675 3.051 0.051 36 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1160 2 8 ALA HA 2 10 GLN H . . 5.000 3.755 3.237 4.037 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1161 2 8 ALA HA 2 11 CYS H . . 5.000 4.160 3.336 4.527 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1162 2 8 ALA HA 2 12 ALA H . . 6.000 6.077 4.852 6.319 0.319 43 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1163 2 8 ALA MB 2 52 LEU HA . . 7.030 5.726 5.225 6.038 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1164 2 9 ASN H 2 10 GLN H . . 5.000 2.036 1.758 2.955 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1165 2 9 ASN H 2 12 ALA H . . 6.000 4.420 4.020 5.210 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1166 2 9 ASN HA 2 11 CYS H . . 5.000 3.967 3.813 4.586 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1167 2 9 ASN QD 2 10 GLN QB . . 7.740 5.536 4.189 6.119 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1168 2 9 ASN QD 2 11 CYS H . . 6.870 5.284 4.849 5.702 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1169 2 9 ASN QD 2 12 ALA MB . . 4.100 2.496 1.878 2.942 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1170 2 9 ASN QD 2 13 VAL QG . . 8.550 5.120 4.464 5.673 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1171 2 9 ASN HD21 2 13 VAL MG1 . . 10.150 6.957 4.946 8.037 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1172 2 9 ASN HD21 2 13 VAL MG2 . . 10.150 5.911 4.934 7.366 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1173 2 9 ASN HD22 2 13 VAL MG1 . . 10.150 7.657 5.982 8.493 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1174 2 9 ASN HD22 2 13 VAL MG2 . . 10.150 6.669 4.986 8.082 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1175 2 9 ASN O 2 12 ALA H . . 2.000 1.891 1.697 2.115 0.115 21 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1176 2 9 ASN O 2 12 ALA N . . 3.000 2.790 2.540 2.987 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1177 2 10 GLN H 2 10 GLN HB2 . . 3.300 2.425 2.003 3.396 0.096 27 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1178 2 10 GLN H 2 10 GLN QB . . 2.980 2.114 1.985 2.218 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1179 2 10 GLN H 2 10 GLN HB3 . . 3.300 2.654 2.019 3.293 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1180 2 10 GLN H 2 10 GLN QG . . 5.090 3.677 2.975 3.931 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1181 2 10 GLN H 2 11 CYS H . . 2.960 2.646 2.564 2.881 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1182 2 10 GLN H 2 11 CYS HA . . 6.000 5.175 5.087 5.372 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1183 2 10 GLN H 2 11 CYS QB . . 5.880 4.387 4.313 4.566 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1184 2 10 GLN H 2 12 ALA H . . 3.870 3.873 3.636 3.978 0.108 35 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1185 2 10 GLN H 2 12 ALA MB . . 6.030 4.766 4.380 5.092 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1186 2 10 GLN H 2 52 LEU H . . 6.000 4.823 4.310 5.533 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1187 2 10 GLN H 2 52 LEU QB . . 4.030 2.876 2.347 3.692 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1188 2 10 GLN H 2 52 LEU QD . . 8.130 3.311 2.339 4.306 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1189 2 10 GLN HA 2 10 GLN HE21 . . 6.000 4.666 4.292 5.109 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1190 2 10 GLN HA 2 10 GLN HE22 . . 6.000 5.709 5.130 6.074 0.074 27 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1191 2 10 GLN HA 2 12 ALA H . . 4.000 3.312 3.214 3.461 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1192 2 10 GLN QB 2 10 GLN QE . . 3.760 2.199 1.849 3.043 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1193 2 10 GLN QB 2 13 VAL H . . 6.880 4.843 4.604 5.206 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1194 2 10 GLN QB 2 52 LEU H . . 5.450 3.441 2.734 4.550 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1195 2 10 GLN HB2 2 10 GLN HE22 . . 5.000 4.127 3.813 4.852 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1196 2 10 GLN HB2 2 11 CYS H . . 4.000 3.878 3.206 4.234 0.234 37 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1197 2 10 GLN HB2 2 12 ALA H . . 5.000 5.084 4.814 5.210 0.210 35 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1198 2 10 GLN HB2 2 52 LEU H . . 6.000 4.923 3.635 5.472 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1199 2 10 GLN HB3 2 10 GLN HE22 . . 5.000 3.591 3.143 4.687 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1200 2 10 GLN HB3 2 11 CYS H . . 4.000 3.036 2.547 3.528 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1201 2 10 GLN HB3 2 12 ALA H . . 5.000 4.691 4.432 4.986 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1202 2 10 GLN HB3 2 52 LEU H . . 6.000 3.531 2.778 4.888 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1203 2 10 GLN QE 2 13 VAL H . . 6.870 6.152 5.705 6.384 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1204 2 10 GLN QE 2 13 VAL QG . . 8.550 4.511 3.670 5.079 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1205 2 10 GLN QE 2 50 LYS QG . . 6.900 5.196 4.379 5.784 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1206 2 10 GLN QE 2 52 LEU QB . . 5.470 3.958 3.398 4.504 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1207 2 10 GLN HE21 2 13 VAL MG1 . . 10.150 6.304 4.014 7.356 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1208 2 10 GLN HE21 2 13 VAL MG2 . . 10.150 5.266 4.176 5.884 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1209 2 10 GLN HE21 2 50 LYS QG . . 7.030 6.281 5.714 6.701 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1210 2 10 GLN HE21 2 52 LEU H . . 6.000 4.043 3.131 5.241 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1211 2 10 GLN HE21 2 52 LEU QB . . 5.850 4.149 3.523 5.022 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1212 2 10 GLN HE21 2 53 GLN H . . 6.000 4.778 4.054 6.000 0.000 31 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1213 2 10 GLN HE22 2 13 VAL MG1 . . 10.150 6.681 4.469 7.485 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1214 2 10 GLN HE22 2 13 VAL MG2 . . 10.150 5.709 4.610 6.321 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1215 2 10 GLN HE22 2 50 LYS QG . . 7.030 5.602 4.523 6.418 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1216 2 10 GLN HE22 2 52 LEU H . . 6.000 4.964 4.189 5.524 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1217 2 10 GLN HE22 2 52 LEU QB . . 5.850 5.145 4.397 5.523 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1218 2 10 GLN HE22 2 53 GLN H . . 6.000 5.044 4.285 5.779 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1219 2 10 GLN QG 2 12 ALA H . . 6.000 4.563 3.929 5.121 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1220 2 10 GLN O 2 13 VAL H . . 2.000 1.906 1.687 2.105 0.105 14 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1221 2 10 GLN O 2 13 VAL N . . 3.000 2.811 2.563 3.033 0.033 47 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1222 2 11 CYS CB 2 37 CYS SG . . 3.100 3.272 3.137 3.370 0.270 21 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1223 2 11 CYS H 2 11 CYS HB2 . . 3.300 2.560 2.133 2.741 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1224 2 11 CYS H 2 11 CYS QB . . 2.980 2.197 2.114 2.235 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1225 2 11 CYS H 2 11 CYS HB3 . . 3.300 2.496 2.293 3.486 0.186 35 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1226 2 11 CYS H 2 12 ALA H . . 2.900 2.599 2.535 2.659 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1227 2 11 CYS H 2 12 ALA MB . . 5.030 4.042 3.891 4.247 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1228 2 11 CYS H 2 13 VAL QG . . 7.590 5.051 4.157 5.400 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1229 2 11 CYS H 2 52 LEU H . . 6.000 3.205 2.808 3.586 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1230 2 11 CYS H 2 52 LEU HA . . 5.000 4.844 4.553 5.015 0.015 17 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1231 2 11 CYS H 2 52 LEU QB . . 5.880 2.538 2.195 2.867 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1232 2 11 CYS H 2 52 LEU QD . . 8.060 2.166 1.716 3.132 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1233 2 11 CYS HA 2 12 ALA H . . 3.150 3.370 3.314 3.441 0.291 35 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1234 2 11 CYS HA 2 12 ALA HA . . 6.000 4.569 4.521 4.630 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1235 2 11 CYS HA 2 13 VAL H . . 4.000 3.505 3.327 3.697 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1236 2 11 CYS HA 2 13 VAL QG . . 6.800 4.253 2.784 4.761 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1237 2 11 CYS HA 2 37 CYS QB . . 6.880 3.628 3.101 3.966 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1238 2 11 CYS HA 2 52 LEU H . . 4.000 3.402 2.981 3.603 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1239 2 11 CYS HA 2 52 LEU HA . . 6.000 6.024 5.674 6.187 0.187 3 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1240 2 11 CYS HA 2 52 LEU QD . . 8.130 3.771 3.277 4.085 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1241 2 11 CYS HA 2 53 GLN QG . . 6.880 6.054 5.853 6.202 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1242 2 11 CYS QB 2 12 ALA H . . 4.350 3.400 3.240 3.520 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1243 2 11 CYS QB 2 12 ALA HA . . 5.880 4.506 4.164 4.640 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1244 2 11 CYS QB 2 13 VAL H . . 5.450 4.745 4.635 4.829 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1245 2 11 CYS QB 2 37 CYS H . . 6.800 5.982 5.801 6.284 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1246 2 11 CYS QB 2 38 PHE H . . 6.880 6.277 5.858 6.425 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1247 2 11 CYS QB 2 52 LEU H . . 6.880 2.247 1.882 3.671 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1248 2 11 CYS HB2 2 12 ALA H . . 5.000 4.309 3.429 4.495 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1249 2 11 CYS HB2 2 13 VAL H . . 6.000 5.480 5.235 5.604 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1250 2 11 CYS HB3 2 12 ALA H . . 5.000 3.604 3.421 4.043 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1251 2 11 CYS HB3 2 13 VAL H . . 6.000 5.200 5.082 5.295 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1252 2 11 CYS SG 2 37 CYS CB . . 3.100 3.169 2.966 3.293 0.193 22 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1253 2 11 CYS SG 2 37 CYS SG . . 2.100 1.926 1.774 2.338 0.238 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1254 2 12 ALA H 2 12 ALA HA . . 2.900 2.936 2.920 2.943 0.043 1 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1255 2 12 ALA H 2 12 ALA MB . . 3.340 2.303 2.131 2.450 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1256 2 12 ALA H 2 13 VAL H . . 3.500 2.353 2.056 2.668 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1257 2 12 ALA H 2 13 VAL MG1 . . 7.030 4.929 3.864 5.470 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1258 2 12 ALA H 2 13 VAL QG . . 5.910 4.154 3.332 4.496 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1259 2 12 ALA H 2 13 VAL MG2 . . 7.030 4.486 3.640 4.908 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1260 2 12 ALA H 2 52 LEU H . . 6.000 5.537 5.203 5.869 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1261 2 12 ALA H 2 52 LEU QB . . 5.960 4.946 4.620 5.194 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1262 2 12 ALA HA 2 13 VAL H . . 3.300 3.156 3.031 3.267 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1263 2 12 ALA HA 2 41 ARG QD . . 5.880 4.939 4.196 5.336 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1264 2 12 ALA HA 2 52 LEU QD . . 8.130 5.561 5.340 6.038 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1265 2 12 ALA MB 2 13 VAL H . . 4.440 3.554 3.427 3.652 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1266 2 13 VAL H 2 13 VAL HA . . 2.850 2.690 2.663 2.739 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1267 2 13 VAL H 2 13 VAL HB . . 3.300 2.233 1.964 3.479 0.179 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1268 2 13 VAL H 2 13 VAL MG1 . . 4.520 3.086 2.577 3.605 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1269 2 13 VAL H 2 13 VAL QG . . 3.850 2.653 1.717 2.869 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1270 2 13 VAL H 2 13 VAL MG2 . . 4.520 2.990 1.733 3.360 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1271 2 13 VAL H 2 14 PRO HD2 . . 5.430 4.895 4.867 4.965 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1272 2 13 VAL H 2 14 PRO QD . . 5.010 4.272 4.254 4.290 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1273 2 13 VAL H 2 14 PRO HD3 . . 5.430 4.710 4.627 4.742 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1274 2 13 VAL H 2 18 ARG QD . . 6.800 5.944 5.678 6.072 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1275 2 13 VAL H 2 18 ARG HE . . 4.000 4.056 3.708 4.317 0.317 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1276 2 13 VAL H 2 18 ARG HG2 . . 5.350 5.095 4.821 5.380 0.030 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1277 2 13 VAL H 2 18 ARG QG . . 5.100 4.601 4.405 4.727 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1278 2 13 VAL H 2 18 ARG HG3 . . 5.350 5.252 4.873 5.474 0.124 35 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1279 2 13 VAL H 2 49 PHE HD2 . . 6.000 5.638 5.332 5.881 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1280 2 13 VAL H 2 51 PRO HA . . 6.000 6.185 5.856 6.378 0.378 43 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1281 2 13 VAL HA 2 15 ALA H . . 4.000 3.986 3.899 4.091 0.091 33 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1282 2 13 VAL HA 2 16 LYS H . . 6.000 5.672 5.299 5.881 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1283 2 13 VAL HA 2 18 ARG HE . . 6.000 5.266 4.823 5.457 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1284 2 13 VAL HB 2 15 ALA HA . . 6.000 4.763 3.762 5.041 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1285 2 13 VAL HB 2 18 ARG HE . . 3.640 3.259 2.509 3.657 0.017 10 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1286 2 13 VAL QG 2 15 ALA H . . 7.590 1.889 1.652 2.935 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1287 2 13 VAL QG 2 15 ALA HA . . 8.590 2.557 2.344 3.486 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1288 2 13 VAL QG 2 16 LYS H . . 4.750 2.336 1.951 3.464 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1289 2 13 VAL QG 2 16 LYS HA . . 6.360 4.351 3.943 5.084 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1290 2 13 VAL QG 2 16 LYS QD . . 8.470 4.502 3.734 5.671 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1291 2 13 VAL QG 2 17 ASP HA . . 8.590 3.939 3.482 4.110 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1292 2 13 VAL QG 2 18 ARG H . . 6.160 3.150 2.336 3.539 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1293 2 13 VAL QG 2 18 ARG HE . . 8.060 1.817 1.686 2.000 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1294 2 13 VAL MG1 2 16 LYS H . . 6.190 2.464 1.954 4.073 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1295 2 13 VAL MG1 2 16 LYS HA . . 7.030 4.593 3.996 5.942 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1296 2 13 VAL MG1 2 17 ASP H . . 5.030 2.774 2.224 3.812 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1297 2 13 VAL MG2 2 16 LYS H . . 6.190 3.784 3.441 4.229 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1298 2 13 VAL MG2 2 16 LYS HA . . 7.030 5.771 5.351 6.046 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1299 2 13 VAL MG2 2 17 ASP H . . 5.030 3.818 3.364 4.068 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1300 2 14 PRO QD 2 17 ASP H . . 6.880 4.396 3.551 4.926 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1301 2 15 ALA H 2 15 ALA HA . . 2.900 2.226 2.216 2.251 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1302 2 15 ALA H 2 16 LYS H . . 3.800 3.003 2.369 3.238 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1303 2 15 ALA H 2 17 ASP H . . 6.000 4.595 3.862 5.039 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1304 2 15 ALA H 2 17 ASP QB . . 6.880 4.733 4.069 5.030 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1305 2 15 ALA H 2 18 ARG H . . 6.000 5.621 5.142 5.895 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1306 2 15 ALA H 2 18 ARG HD2 . . 6.000 4.606 4.294 4.902 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1307 2 15 ALA H 2 18 ARG QD . . 5.450 4.416 4.146 4.669 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1308 2 15 ALA H 2 18 ARG HD3 . . 6.000 5.672 5.401 5.880 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1309 2 15 ALA H 2 18 ARG HE . . 6.000 3.190 2.770 3.470 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1310 2 15 ALA H 2 18 ARG QG . . 6.880 4.335 4.147 4.631 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1311 2 15 ALA HA 2 16 LYS QD . . 6.880 5.928 5.708 6.317 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1312 2 15 ALA HA 2 17 ASP QB . . 5.880 5.220 5.084 5.304 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1313 2 15 ALA HA 2 18 ARG H . . 5.000 4.660 4.183 5.081 0.081 20 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1314 2 15 ALA HA 2 42 ILE MD . . 6.310 3.985 3.666 4.171 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1315 2 15 ALA HA 2 42 ILE QG . . 5.930 4.880 4.270 5.146 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1316 2 15 ALA HA 2 45 VAL MG1 . . 6.610 3.574 2.809 4.133 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1317 2 15 ALA HA 2 45 VAL QG . . 5.230 2.592 2.068 3.088 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1318 2 15 ALA HA 2 45 VAL MG2 . . 6.610 2.665 2.095 3.203 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1319 2 15 ALA MB 2 16 LYS HA . . 5.810 4.495 4.394 4.578 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1320 2 15 ALA MB 2 18 ARG HE . . 6.030 3.884 3.475 4.183 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1321 2 15 ALA MB 2 42 ILE MD . . 7.300 1.634 1.573 1.685 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1322 2 15 ALA MB 2 45 VAL H . . 7.030 4.532 4.196 5.131 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1323 2 15 ALA MB 2 45 VAL MG1 . . 7.940 1.942 1.712 2.859 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1324 2 15 ALA MB 2 45 VAL QG . . 7.470 1.683 1.563 2.191 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1325 2 15 ALA MB 2 45 VAL MG2 . . 7.940 1.882 1.705 2.403 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1326 2 16 LYS H 2 16 LYS HA . . 2.770 2.710 2.658 2.801 0.031 3 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1327 2 16 LYS H 2 16 LYS QG . . 3.720 2.598 2.375 2.779 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1328 2 16 LYS H 2 17 ASP H . . 2.810 1.892 1.806 2.130 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1329 2 16 LYS H 2 17 ASP HB2 . . 3.680 3.697 3.597 3.753 0.073 22 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1330 2 16 LYS H 2 17 ASP QB . . 3.480 3.314 3.220 3.372 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1331 2 16 LYS H 2 17 ASP HB3 . . 3.680 3.750 3.519 3.911 0.231 33 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1332 2 16 LYS H 2 18 ARG H . . 4.060 3.252 2.892 3.557 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1333 2 16 LYS H 2 18 ARG QD . . 5.880 3.389 3.119 3.880 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1334 2 16 LYS H 2 18 ARG QG . . 5.880 3.361 3.130 3.708 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1335 2 16 LYS H 2 42 ILE MD . . 7.030 5.480 5.045 5.604 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1336 2 16 LYS H 2 45 VAL QG . . 7.590 3.982 3.182 4.506 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1337 2 16 LYS H 2 46 PRO QD . . 5.880 4.678 4.436 4.961 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1338 2 16 LYS HA 2 16 LYS HE2 . . 6.000 5.201 4.216 6.011 0.011 9 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1339 2 16 LYS HA 2 16 LYS HE3 . . 6.000 5.166 4.037 6.119 0.119 38 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1340 2 16 LYS HA 2 17 ASP H . . 3.110 2.818 2.656 2.926 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1341 2 16 LYS HA 2 17 ASP HA . . 6.000 4.278 4.248 4.305 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1342 2 16 LYS HA 2 18 ARG H . . 5.000 3.739 3.493 4.269 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1343 2 16 LYS HA 2 45 VAL QG . . 8.170 3.774 3.132 4.147 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1344 2 16 LYS QB 2 17 ASP H . . 4.880 4.090 4.071 4.117 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1345 2 16 LYS QB 2 45 VAL HA . . 6.880 5.972 5.576 6.088 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1346 2 16 LYS QG 2 17 ASP H . . 4.670 3.946 3.734 4.142 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1347 2 16 LYS QG 2 18 ARG H . . 6.030 5.332 5.193 5.451 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1348 2 16 LYS QG 2 42 ILE MD . . 5.860 4.349 4.146 4.441 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1349 2 17 ASP H 2 17 ASP HA . . 2.810 2.844 2.811 2.885 0.075 18 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1350 2 17 ASP H 2 17 ASP HB2 . . 3.300 3.261 3.176 3.329 0.029 42 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1351 2 17 ASP H 2 17 ASP QB . . 2.980 2.788 2.647 2.863 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1352 2 17 ASP H 2 17 ASP HB3 . . 3.300 3.032 2.790 3.137 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1353 2 17 ASP H 2 18 ARG H . . 2.470 1.616 1.537 1.743 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1354 2 17 ASP H 2 18 ARG HA . . 5.000 4.035 3.971 4.165 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1355 2 17 ASP H 2 18 ARG HB2 . . 6.000 3.851 3.592 4.045 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1356 2 17 ASP H 2 18 ARG QB . . 5.450 3.718 3.512 3.877 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1357 2 17 ASP H 2 18 ARG HB3 . . 6.000 4.919 4.882 4.985 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1358 2 17 ASP H 2 18 ARG QD . . 5.880 3.270 3.015 3.550 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1359 2 17 ASP H 2 18 ARG HE . . 6.000 4.346 3.602 4.880 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1360 2 17 ASP H 2 18 ARG HG2 . . 5.160 4.424 4.218 4.960 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1361 2 17 ASP H 2 18 ARG QG . . 4.530 2.660 2.431 3.282 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1362 2 17 ASP H 2 18 ARG HG3 . . 5.160 2.682 2.446 3.330 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1363 2 17 ASP H 2 45 VAL MG1 . . 7.030 5.728 5.436 5.916 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1364 2 17 ASP H 2 45 VAL MG2 . . 7.030 5.076 4.010 5.623 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1365 2 17 ASP H 2 46 PRO HD2 . . 6.000 5.074 4.907 5.247 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1366 2 17 ASP H 2 46 PRO HD3 . . 6.000 5.673 5.289 5.970 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1367 2 17 ASP HA 2 17 ASP HB2 . . 3.040 2.560 2.466 2.626 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1368 2 17 ASP HA 2 17 ASP HB3 . . 3.040 3.048 3.035 3.056 0.016 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1369 2 17 ASP HA 2 18 ARG H . . 3.300 3.244 3.100 3.568 0.268 16 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1370 2 18 ARG H 2 18 ARG HB2 . . 3.500 2.558 2.441 2.625 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1371 2 18 ARG H 2 18 ARG QB . . 2.960 2.508 2.403 2.567 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1372 2 18 ARG H 2 18 ARG HB3 . . 3.500 3.608 3.551 3.632 0.132 36 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1373 2 18 ARG H 2 18 ARG HD2 . . 4.000 2.997 2.781 3.162 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1374 2 18 ARG H 2 18 ARG QD . . 3.690 2.930 2.737 3.073 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1375 2 18 ARG H 2 18 ARG HD3 . . 4.000 4.141 4.030 4.287 0.287 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1376 2 18 ARG H 2 18 ARG HE . . 5.620 4.440 3.780 4.781 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1377 2 18 ARG H 2 18 ARG HG2 . . 3.530 3.697 3.429 3.841 0.311 3 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1378 2 18 ARG H 2 18 ARG QG . . 3.070 2.186 1.855 2.391 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1379 2 18 ARG H 2 18 ARG HG3 . . 3.530 2.203 1.862 2.415 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1380 2 18 ARG H 2 19 VAL H . . 5.000 4.549 4.470 4.656 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1381 2 18 ARG H 2 46 PRO HD2 . . 6.000 4.823 4.684 5.023 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1382 2 18 ARG H 2 46 PRO QD . . 5.450 4.485 4.341 4.740 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1383 2 18 ARG H 2 46 PRO HD3 . . 6.000 5.338 5.119 5.814 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1384 2 18 ARG H 2 46 PRO QG . . 6.880 3.811 3.575 4.276 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1385 2 18 ARG H 2 49 PHE HB2 . . 6.000 5.647 5.345 5.825 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1386 2 18 ARG H 2 49 PHE HB3 . . 6.000 5.306 5.237 5.368 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1387 2 18 ARG HA 2 19 VAL H . . 2.900 2.661 2.581 2.764 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1388 2 18 ARG HA 2 50 LYS H . . 5.000 4.631 4.473 4.838 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1389 2 18 ARG QB 2 19 VAL H . . 3.120 2.186 2.062 2.322 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1390 2 18 ARG QB 2 20 ASP H . . 6.880 2.277 2.212 2.337 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1391 2 18 ARG QB 2 49 PHE H . . 6.880 4.835 4.743 4.944 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1392 2 18 ARG QB 2 50 LYS H . . 5.880 3.600 3.443 3.744 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1393 2 18 ARG HB2 2 19 VAL H . . 3.760 3.225 2.956 3.480 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1394 2 18 ARG HB3 2 19 VAL H . . 3.760 2.224 2.100 2.366 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1395 2 18 ARG QD 2 19 VAL H . . 5.350 4.692 4.538 4.813 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1396 2 18 ARG QD 2 20 ASP H . . 4.830 4.041 3.933 4.236 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1397 2 18 ARG QD 2 21 CYS H . . 6.880 5.462 5.303 5.649 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1398 2 18 ARG QD 2 39 ASP H . . 6.880 5.651 5.442 5.979 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1399 2 18 ARG QD 2 45 VAL H . . 6.880 6.296 6.204 6.413 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1400 2 18 ARG QD 2 49 PHE H . . 6.880 5.064 4.828 5.323 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1401 2 18 ARG QD 2 50 LYS H . . 6.880 5.728 5.523 5.992 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1402 2 18 ARG HD2 2 19 VAL H . . 5.770 5.547 5.246 5.738 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1403 2 18 ARG HD2 2 20 ASP H . . 5.000 4.771 4.477 4.979 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1404 2 18 ARG HD3 2 19 VAL H . . 5.770 5.065 4.867 5.264 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1405 2 18 ARG HD3 2 20 ASP H . . 5.000 4.371 4.206 4.700 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1406 2 18 ARG HE 2 18 ARG QG . . 3.900 2.277 2.218 2.333 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1407 2 18 ARG HE 2 42 ILE MD . . 7.030 5.776 5.519 5.866 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1408 2 18 ARG HE 2 46 PRO QD . . 5.820 4.627 4.086 4.882 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1409 2 18 ARG HE 2 49 PHE HD1 . . 6.000 5.536 5.144 6.047 0.047 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1410 2 18 ARG QG 2 20 ASP H . . 6.310 4.412 4.352 4.479 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1411 2 18 ARG QG 2 21 CYS H . . 6.880 6.106 5.958 6.152 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1412 2 18 ARG QG 2 49 PHE H . . 6.880 5.356 5.106 5.581 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1413 2 18 ARG QG 2 50 LYS H . . 6.880 4.755 4.410 4.974 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1414 2 18 ARG HG2 2 19 VAL H . . 4.860 4.250 4.099 4.407 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1415 2 18 ARG HG3 2 19 VAL H . . 4.860 4.655 4.588 4.734 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1416 2 19 VAL H 2 19 VAL HA . . 2.900 2.933 2.910 2.940 0.040 31 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1417 2 19 VAL H 2 19 VAL HB . . 2.690 2.604 2.435 2.756 0.066 16 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1418 2 19 VAL H 2 20 ASP H . . 3.950 2.487 2.352 2.604 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1419 2 19 VAL H 2 20 ASP HA . . 6.000 4.291 4.155 4.457 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1420 2 19 VAL H 2 49 PHE H . . 6.000 6.010 5.927 6.094 0.094 16 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1421 2 19 VAL H 2 49 PHE HA . . 6.000 3.983 3.883 4.123 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1422 2 19 VAL H 2 49 PHE HB2 . . 4.780 2.756 2.510 2.899 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1423 2 19 VAL H 2 49 PHE QB . . 4.380 2.499 2.333 2.644 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1424 2 19 VAL H 2 49 PHE HB3 . . 4.780 2.866 2.746 3.085 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1425 2 19 VAL H 2 49 PHE HD1 . . 6.000 5.526 5.320 5.781 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1426 2 19 VAL H 2 50 LYS H . . 3.490 3.012 2.871 3.101 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1427 2 19 VAL HA 2 20 ASP H . . 3.300 3.097 3.040 3.165 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1428 2 19 VAL HB 2 20 ASP H . . 4.000 4.009 3.910 4.082 0.082 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1429 2 19 VAL HB 2 21 CYS H . . 6.000 4.733 4.430 4.994 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1430 2 19 VAL QG 2 20 ASP H . . 5.610 3.770 3.747 3.793 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1431 2 19 VAL QG 2 21 CYS H . . 7.930 4.809 4.577 4.966 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1432 2 19 VAL QG 2 50 LYS H . . 5.030 3.437 2.854 3.783 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1433 2 20 ASP H 2 20 ASP HB2 . . 2.900 3.088 3.045 3.128 0.228 38 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1434 2 20 ASP H 2 20 ASP HB3 . . 2.900 3.091 3.053 3.146 0.246 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1435 2 20 ASP H 2 21 CYS H . . 3.910 3.594 3.474 3.661 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1436 2 20 ASP H 2 22 GLY H . . 6.000 5.401 5.328 5.480 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1437 2 20 ASP H 2 46 PRO HD2 . . 6.000 5.352 5.196 5.467 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1438 2 20 ASP H 2 46 PRO HD3 . . 6.000 5.329 5.188 5.483 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1439 2 20 ASP H 2 46 PRO QG . . 6.880 2.810 2.711 2.915 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1440 2 20 ASP H 2 48 CYS H . . 6.000 5.696 5.552 5.839 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1441 2 20 ASP H 2 49 PHE HA . . 5.000 4.103 3.983 4.177 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1442 2 20 ASP H 2 50 LYS H . . 5.000 4.740 4.606 4.838 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1443 2 20 ASP HA 2 21 CYS H . . 2.390 2.371 2.332 2.424 0.034 30 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1444 2 20 ASP HA 2 22 GLY H . . 3.300 3.424 3.359 3.536 0.236 47 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1445 2 20 ASP HA 2 47 TRP H . . 6.000 5.545 5.401 5.694 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1446 2 20 ASP HA 2 48 CYS H . . 5.000 4.074 3.977 4.195 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1447 2 20 ASP HA 2 49 PHE HA . . 4.000 3.648 3.435 3.885 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1448 2 20 ASP QB 2 22 GLY H . . 4.880 4.182 4.056 4.301 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1449 2 20 ASP QB 2 47 TRP H . . 6.880 5.924 5.853 6.008 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1450 2 21 CYS CB 2 36 CYS SG . . 3.100 3.010 2.905 3.165 0.065 1 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1451 2 21 CYS H 2 21 CYS HA . . 2.900 2.715 2.664 2.751 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1452 2 21 CYS H 2 21 CYS HB2 . . 2.850 2.098 2.021 2.266 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1453 2 21 CYS H 2 21 CYS HB3 . . 2.850 2.971 2.742 3.127 0.277 33 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1454 2 21 CYS H 2 22 GLY H . . 4.900 2.763 2.667 2.902 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1455 2 21 CYS H 2 22 GLY QA . . 5.880 4.525 4.459 4.616 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1456 2 21 CYS H 2 23 TYR H . . 6.000 5.086 4.811 5.387 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1457 2 21 CYS H 2 23 TYR QD . . 8.000 5.863 4.890 6.794 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1458 2 21 CYS H 2 36 CYS HA . . 6.000 6.139 5.940 6.229 0.229 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1459 2 21 CYS H 2 46 PRO HA . . 6.000 5.726 5.531 5.890 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1460 2 21 CYS H 2 46 PRO HB2 . . 4.860 3.501 3.341 3.605 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1461 2 21 CYS H 2 46 PRO QB . . 4.500 3.347 3.189 3.454 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1462 2 21 CYS H 2 46 PRO HB3 . . 4.860 4.255 4.034 4.424 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1463 2 21 CYS H 2 48 CYS H . . 5.000 4.112 4.009 4.176 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1464 2 21 CYS H 2 48 CYS HA . . 6.000 4.760 4.681 4.833 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1465 2 21 CYS H 2 48 CYS QB . . 6.880 3.880 3.663 4.019 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1466 2 21 CYS H 2 48 CYS O . . 2.000 1.633 1.554 1.694 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1467 2 21 CYS H 2 49 PHE H . . 4.000 4.043 3.963 4.099 0.099 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1468 2 21 CYS H 2 49 PHE HA . . 2.810 1.817 1.681 1.941 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1469 2 21 CYS H 2 49 PHE HB2 . . 5.000 4.064 3.961 4.143 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1470 2 21 CYS H 2 49 PHE HB3 . . 5.000 2.904 2.735 3.037 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1471 2 21 CYS H 2 50 LYS H . . 5.000 4.331 4.166 4.449 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1472 2 21 CYS HA 2 23 TYR QD . . 8.140 4.796 3.273 5.655 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1473 2 21 CYS HA 2 23 TYR QE . . 8.130 5.752 3.658 7.155 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1474 2 21 CYS HA 2 49 PHE HA . . 6.000 3.381 3.218 3.456 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1475 2 21 CYS HA 2 50 LYS H . . 6.000 5.069 4.784 5.259 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1476 2 21 CYS HA 2 50 LYS QE . . 6.270 3.317 1.921 4.309 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1477 2 21 CYS HA 2 50 LYS HG2 . . 6.000 4.994 4.297 6.206 0.206 1 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1478 2 21 CYS HA 2 50 LYS HG3 . . 6.000 5.481 4.754 6.161 0.161 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1479 2 21 CYS QB 2 22 GLY H . . 3.520 2.817 2.670 2.933 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1480 2 21 CYS QB 2 23 TYR H . . 4.440 3.064 2.869 3.227 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1481 2 21 CYS QB 2 23 TYR QD . . 7.310 3.138 1.971 4.356 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1482 2 21 CYS QB 2 34 ARG QD . . 7.750 5.537 4.478 6.242 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1483 2 21 CYS QB 2 36 CYS H . . 6.880 5.522 5.321 5.609 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1484 2 21 CYS QB 2 37 CYS H . . 5.880 4.172 4.004 4.464 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1485 2 21 CYS QB 2 48 CYS H . . 6.880 4.347 4.222 4.456 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1486 2 21 CYS QB 2 49 PHE H . . 4.440 3.339 3.194 3.464 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1487 2 21 CYS QB 2 50 LYS H . . 5.460 4.192 3.946 4.346 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1488 2 21 CYS HB2 2 22 GLY H . . 3.800 3.656 3.497 3.868 0.068 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1489 2 21 CYS HB2 2 23 TYR H . . 5.000 4.740 4.538 5.011 0.011 35 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1490 2 21 CYS HB2 2 23 TYR QD . . 7.610 4.527 3.441 5.668 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1491 2 21 CYS HB2 2 23 TYR QE . . 7.640 5.725 4.706 7.057 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1492 2 21 CYS HB2 2 49 PHE H . . 5.000 3.437 3.277 3.597 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1493 2 21 CYS HB2 2 49 PHE HA . . 6.000 1.861 1.762 2.129 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1494 2 21 CYS HB2 2 50 LYS H . . 6.000 4.278 4.018 4.443 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1495 2 21 CYS HB3 2 22 GLY H . . 3.800 2.936 2.722 3.127 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1496 2 21 CYS HB3 2 23 TYR H . . 5.000 3.103 2.896 3.267 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1497 2 21 CYS HB3 2 23 TYR QD . . 7.610 3.214 1.982 4.527 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1498 2 21 CYS HB3 2 23 TYR QE . . 7.640 4.956 3.965 6.202 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1499 2 21 CYS HB3 2 49 PHE H . . 5.000 4.558 4.261 4.732 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1500 2 21 CYS HB3 2 49 PHE HA . . 6.000 3.505 3.224 3.654 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1501 2 21 CYS HB3 2 50 LYS H . . 6.000 6.012 5.756 6.169 0.169 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1502 2 21 CYS N 2 48 CYS O . . 3.000 2.381 2.274 2.434 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1503 2 21 CYS SG 2 36 CYS CB . . 3.100 3.402 3.294 3.530 0.430 23 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1504 2 21 CYS SG 2 36 CYS SG . . 2.100 1.896 1.826 2.042 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1505 2 22 GLY H 2 23 TYR H . . 3.230 2.982 2.733 3.232 0.002 37 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1506 2 22 GLY H 2 23 TYR HA . . 6.000 5.261 5.164 5.407 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1507 2 22 GLY H 2 23 TYR QD . . 8.140 5.100 4.206 5.708 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1508 2 22 GLY H 2 26 VAL QG . . 8.150 4.675 3.918 5.053 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1509 2 22 GLY H 2 46 PRO QG . . 6.880 5.487 5.302 5.656 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1510 2 22 GLY H 2 48 CYS H . . 6.000 4.544 4.348 4.768 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1511 2 22 GLY H 2 48 CYS HB2 . . 5.000 4.876 4.624 5.073 0.073 10 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1512 2 22 GLY H 2 48 CYS HB3 . . 5.000 3.145 2.941 3.322 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1513 2 22 GLY H 2 49 PHE HA . . 5.000 4.436 4.282 4.590 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1514 2 22 GLY H 2 49 PHE QB . . 6.880 5.177 5.067 5.307 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1515 2 22 GLY QA 2 48 CYS H . . 6.880 5.651 5.434 6.021 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1516 2 23 TYR H 2 26 VAL H . . 5.000 4.246 3.755 4.616 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1517 2 23 TYR H 2 26 VAL HA . . 6.000 4.530 4.107 4.845 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1518 2 23 TYR H 2 26 VAL HB . . 4.000 2.884 2.184 3.378 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1519 2 23 TYR H 2 26 VAL QG . . 6.260 3.417 2.885 3.816 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1520 2 23 TYR H 2 31 CYS QB . . 6.880 6.249 6.161 6.381 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1521 2 23 TYR H 2 47 TRP HE3 . . 6.000 6.029 5.751 6.091 0.091 1 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1522 2 23 TYR H 2 48 CYS HB2 . . 5.000 4.128 3.719 4.587 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1523 2 23 TYR H 2 48 CYS QB . . 4.220 2.834 2.502 3.282 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1524 2 23 TYR H 2 48 CYS HB3 . . 5.000 2.888 2.538 3.363 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1525 2 23 TYR HA 2 23 TYR QB . . 2.590 2.584 2.555 2.597 0.007 14 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1526 2 23 TYR HA 2 23 TYR QE . . 5.810 4.366 4.145 4.574 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1527 2 23 TYR HA 2 26 VAL HB . . 6.000 4.821 4.430 5.091 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1528 2 23 TYR HA 2 26 VAL QG . . 8.590 4.658 4.323 4.887 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1529 2 23 TYR QD 2 26 VAL H . . 7.990 4.101 3.589 4.886 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1530 2 23 TYR QD 2 26 VAL HA . . 7.990 3.888 2.941 4.942 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1531 2 23 TYR QD 2 26 VAL HB . . 7.680 4.479 4.296 4.665 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1532 2 23 TYR QD 2 26 VAL MG1 . . 9.170 4.963 4.645 5.196 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1533 2 23 TYR QD 2 26 VAL MG2 . . 9.170 5.078 4.859 5.304 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1534 2 23 TYR QD 2 31 CYS HA . . 8.140 3.819 2.941 4.999 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1535 2 23 TYR QD 2 34 ARG HB2 . . 8.140 4.177 2.940 4.780 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1536 2 23 TYR QD 2 34 ARG HB3 . . 8.140 4.095 3.401 4.444 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1537 2 23 TYR QD 2 34 ARG QD . . 7.200 3.210 1.881 4.668 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1538 2 23 TYR QD 2 34 ARG QG . . 9.020 3.469 2.739 4.052 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1539 2 23 TYR QD 2 35 GLY QA . . 9.020 6.732 6.013 7.309 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1540 2 23 TYR QD 2 49 PHE H . . 8.140 6.746 5.901 7.527 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1541 2 23 TYR QE 2 26 VAL HA . . 7.750 5.918 5.218 6.802 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1542 2 23 TYR QE 2 26 VAL HB . . 7.750 6.652 6.552 6.746 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1543 2 23 TYR QE 2 26 VAL MG1 . . 9.160 6.774 6.436 6.992 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1544 2 23 TYR QE 2 26 VAL MG2 . . 9.160 6.833 6.685 7.010 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1545 2 23 TYR QE 2 31 CYS HA . . 8.130 4.374 3.593 5.843 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1546 2 23 TYR QE 2 34 ARG HB2 . . 7.370 2.934 1.928 3.994 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1547 2 23 TYR QE 2 34 ARG HB3 . . 7.370 2.509 1.953 3.103 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1548 2 23 TYR QE 2 34 ARG HD2 . . 7.980 3.399 2.162 4.721 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1549 2 23 TYR QE 2 34 ARG QD . . 7.600 2.684 1.828 3.815 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1550 2 23 TYR QE 2 34 ARG HD3 . . 7.980 2.820 1.944 4.028 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1551 2 23 TYR QE 2 34 ARG HG2 . . 8.130 3.814 2.717 4.744 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1552 2 23 TYR QE 2 34 ARG HG3 . . 8.130 3.971 3.533 4.236 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1553 2 23 TYR QE 2 35 GLY QA . . 9.010 5.571 4.354 6.401 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1554 2 24 PRO QD 2 26 VAL H . . 5.880 4.272 3.937 4.595 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1555 2 25 HIS H 2 26 VAL H . . 4.020 2.231 2.023 2.595 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1556 2 25 HIS H 2 26 VAL HA . . 4.000 4.094 4.039 4.190 0.190 37 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1557 2 25 HIS H 2 34 ARG QB . . 6.880 6.257 6.121 6.382 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1558 2 25 HIS H 2 34 ARG QG . . 6.880 5.597 4.879 5.977 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1559 2 25 HIS HA 2 26 VAL H . . 3.190 3.103 2.870 3.251 0.061 37 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1560 2 25 HIS HA 2 27 THR H . . 6.000 5.854 5.630 6.001 0.001 23 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1561 2 25 HIS QB 2 26 VAL H . . 5.000 3.730 3.571 3.917 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1562 2 26 VAL H 2 26 VAL HA . . 2.880 2.688 2.644 2.764 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1563 2 26 VAL H 2 26 VAL HB . . 3.300 2.593 2.513 2.706 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1564 2 26 VAL H 2 27 THR H . . 5.000 4.524 4.440 4.594 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1565 2 26 VAL H 2 27 THR HA . . 6.000 5.870 5.785 5.920 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1566 2 26 VAL H 2 30 GLU QB . . 6.880 4.883 4.344 5.208 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1567 2 26 VAL H 2 31 CYS QB . . 6.880 6.357 6.263 6.428 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1568 2 26 VAL H 2 47 TRP HZ3 . . 6.000 5.612 5.161 6.042 0.042 8 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1569 2 26 VAL H 2 48 CYS QB . . 6.880 4.711 4.435 5.057 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1570 2 26 VAL HB 2 27 THR H . . 4.000 4.193 4.096 4.336 0.336 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1571 2 26 VAL QG 2 38 PHE QD . . 8.550 2.301 1.940 2.884 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1572 2 26 VAL QG 2 39 ASP H . . 8.050 4.725 4.281 5.298 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1573 2 26 VAL QG 2 47 TRP H . . 8.120 3.527 3.262 3.840 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1574 2 26 VAL QG 2 47 TRP HE3 . . 8.590 1.829 1.699 2.090 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1575 2 26 VAL QG 2 47 TRP HZ2 . . 8.590 5.343 5.170 5.621 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1576 2 26 VAL QG 2 48 CYS H . . 7.170 3.879 3.656 4.032 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1577 2 26 VAL QG 2 48 CYS HA . . 8.590 3.691 3.538 3.823 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1578 2 26 VAL MG1 2 38 PHE QD . . 9.150 4.920 4.592 5.375 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1579 2 26 VAL MG2 2 38 PHE QD . . 9.150 2.305 1.942 2.896 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1580 2 27 THR H 2 27 THR HA . . 2.900 2.832 2.814 2.854 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1581 2 27 THR H 2 27 THR HB . . 2.900 3.002 2.928 3.060 0.160 4 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1582 2 27 THR H 2 27 THR MG . . 4.000 3.467 3.307 3.575 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1583 2 27 THR H 2 28 PRO HA . . 5.000 4.653 4.617 4.722 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1584 2 27 THR H 2 28 PRO QD . . 6.270 4.204 4.165 4.261 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1585 2 27 THR H 2 29 LYS QB . . 6.880 5.909 5.773 6.003 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1586 2 27 THR H 2 30 GLU H . . 5.000 3.459 3.217 3.650 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1587 2 27 THR H 2 30 GLU HA . . 6.000 5.453 5.118 5.659 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1588 2 27 THR H 2 30 GLU HB2 . . 5.000 3.339 3.002 3.661 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1589 2 27 THR H 2 30 GLU QB . . 4.230 3.134 2.846 3.346 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1590 2 27 THR H 2 30 GLU HB3 . . 5.000 3.805 3.476 3.969 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1591 2 27 THR H 2 30 GLU QG . . 6.190 5.195 4.843 5.487 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1592 2 27 THR H 2 31 CYS H . . 4.000 2.492 2.279 2.662 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1593 2 27 THR H 2 31 CYS HA . . 6.000 4.128 3.852 4.328 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1594 2 27 THR H 2 31 CYS HB2 . . 6.000 3.227 2.870 3.562 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1595 2 27 THR H 2 31 CYS HB3 . . 6.000 4.384 4.279 4.472 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1596 2 27 THR H 2 48 CYS QB . . 6.880 4.104 3.937 4.339 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1597 2 27 THR HA 2 29 LYS H . . 4.000 4.271 4.228 4.321 0.321 10 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1598 2 27 THR HA 2 30 GLU H . . 6.000 4.420 4.340 4.551 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1599 2 27 THR HB 2 30 GLU H . . 6.000 3.475 3.252 3.712 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1600 2 27 THR HB 2 31 CYS H . . 6.000 4.195 3.973 4.447 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1601 2 27 THR MG 2 29 LYS H . . 7.030 2.207 1.932 2.320 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1602 2 27 THR MG 2 30 GLU H . . 5.470 1.792 1.758 1.855 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1603 2 27 THR MG 2 31 CYS H . . 4.250 3.433 3.392 3.490 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1604 2 27 THR MG 2 32 ASN H . . 6.310 5.052 4.887 5.159 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1605 2 27 THR MG 2 33 ASN H . . 7.030 5.508 5.447 5.594 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1606 2 27 THR O 2 30 GLU H . . 2.000 2.253 2.181 2.347 0.347 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1607 2 27 THR O 2 30 GLU N . . 3.000 3.109 3.079 3.149 0.149 8 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1608 2 27 THR O 2 31 CYS H . . 2.000 2.074 2.048 2.129 0.129 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1609 2 27 THR O 2 31 CYS N . . 3.000 3.047 3.017 3.098 0.098 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1610 2 28 PRO HA 2 30 GLU H . . 6.000 4.099 4.036 4.182 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1611 2 28 PRO HA 2 31 CYS H . . 5.000 4.401 4.308 4.493 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1612 2 28 PRO HA 2 32 ASN H . . 5.000 4.351 3.857 4.705 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1613 2 28 PRO HA 2 38 PHE H . . 5.000 4.598 4.202 5.060 0.060 43 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1614 2 28 PRO QD 2 29 LYS H . . 5.020 3.796 3.753 3.858 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1615 2 28 PRO QD 2 30 GLU H . . 6.880 4.322 4.199 4.471 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1616 2 28 PRO QD 2 31 CYS H . . 6.880 5.250 5.196 5.302 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1617 2 29 LYS H 2 29 LYS HB2 . . 3.500 3.410 3.282 3.571 0.071 17 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1618 2 29 LYS H 2 29 LYS QB . . 3.050 2.999 2.939 3.024 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1619 2 29 LYS H 2 29 LYS HB3 . . 3.500 3.352 3.153 3.530 0.030 15 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1620 2 29 LYS H 2 30 GLU H . . 4.000 1.505 1.435 1.596 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1621 2 29 LYS H 2 30 GLU HB2 . . 6.000 3.597 3.533 3.669 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1622 2 29 LYS H 2 30 GLU HB3 . . 6.000 4.764 4.695 4.834 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1623 2 29 LYS H 2 30 GLU QG . . 6.000 5.105 4.707 5.289 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1624 2 29 LYS H 2 31 CYS H . . 6.000 2.746 2.692 2.820 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1625 2 29 LYS H 2 31 CYS QB . . 6.880 3.827 3.732 3.951 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1626 2 29 LYS H 2 32 ASN H . . 6.000 3.547 3.280 3.693 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1627 2 29 LYS H 2 32 ASN QB . . 6.880 4.084 3.803 4.478 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1628 2 29 LYS H 2 33 ASN QB . . 6.880 4.872 4.695 5.027 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1629 2 29 LYS HA 2 29 LYS QD . . 4.370 3.431 3.203 3.839 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1630 2 29 LYS HA 2 31 CYS QB . . 6.880 5.564 5.382 5.759 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1631 2 29 LYS HA 2 32 ASN HA . . 6.000 6.162 6.054 6.254 0.254 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1632 2 29 LYS HA 2 33 ASN H . . 5.000 4.751 4.620 4.852 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1633 2 29 LYS QB 2 30 GLU H . . 3.650 3.168 3.054 3.270 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1634 2 29 LYS QB 2 31 CYS H . . 6.880 5.080 5.004 5.170 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1635 2 29 LYS QB 2 32 ASN H . . 6.880 5.598 5.466 5.672 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1636 2 29 LYS HB2 2 30 GLU H . . 4.000 4.065 3.849 4.234 0.234 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1637 2 29 LYS HB3 2 30 GLU H . . 4.000 3.313 3.138 3.476 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1638 2 29 LYS QG 2 30 GLU H . . 5.430 4.344 4.030 4.575 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1639 2 29 LYS QG 2 31 CYS H . . 6.880 5.954 5.700 6.146 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1640 2 29 LYS QG 2 32 ASN H . . 6.880 5.760 5.628 5.902 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1641 2 29 LYS QG 2 33 ASN H . . 6.880 5.549 5.256 5.752 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1642 2 29 LYS QG 2 33 ASN HD21 . . 6.610 5.291 4.891 5.745 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1643 2 29 LYS QG 2 33 ASN QD . . 6.460 4.938 4.664 5.179 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1644 2 29 LYS QG 2 33 ASN HD22 . . 6.610 5.948 5.726 6.077 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1645 2 30 GLU H 2 30 GLU HA . . 2.770 2.897 2.886 2.905 0.135 19 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1646 2 30 GLU H 2 30 GLU HB2 . . 3.300 2.189 2.150 2.217 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1647 2 30 GLU H 2 30 GLU QB . . 2.920 2.162 2.122 2.189 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1648 2 30 GLU H 2 30 GLU HB3 . . 3.300 3.343 3.255 3.414 0.114 46 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1649 2 30 GLU H 2 30 GLU QG . . 4.710 3.806 3.483 3.942 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1650 2 30 GLU H 2 31 CYS H . . 2.770 2.208 2.158 2.275 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1651 2 30 GLU H 2 31 CYS HA . . 5.000 4.808 4.763 4.874 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1652 2 30 GLU H 2 31 CYS HB2 . . 6.000 4.150 4.034 4.271 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1653 2 30 GLU H 2 31 CYS QB . . 5.450 4.047 3.942 4.157 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1654 2 30 GLU H 2 31 CYS HB3 . . 6.000 5.626 5.540 5.716 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1655 2 30 GLU H 2 32 ASN H . . 5.000 3.893 3.759 4.046 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1656 2 30 GLU H 2 32 ASN QB . . 6.880 4.725 4.605 4.898 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1657 2 30 GLU H 2 33 ASN H . . 5.000 4.318 4.254 4.378 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1658 2 30 GLU H 2 33 ASN QB . . 5.880 4.171 4.028 4.300 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1659 2 30 GLU HA 2 31 CYS H . . 3.500 3.613 3.606 3.619 0.119 1 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1660 2 30 GLU HA 2 33 ASN H . . 3.500 3.338 3.212 3.469 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1661 2 30 GLU HA 2 33 ASN HB2 . . 5.000 2.697 1.978 3.289 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1662 2 30 GLU HA 2 33 ASN QB . . 4.440 2.081 1.933 2.215 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1663 2 30 GLU HA 2 33 ASN HB3 . . 5.000 2.336 1.953 2.755 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1664 2 30 GLU HA 2 33 ASN HD21 . . 5.090 2.942 2.549 3.195 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1665 2 30 GLU HA 2 33 ASN QD . . 4.810 2.909 2.529 3.146 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1666 2 30 GLU HA 2 33 ASN HD22 . . 5.090 4.586 4.249 4.839 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1667 2 30 GLU HA 2 34 ARG H . . 4.000 4.171 4.075 4.304 0.304 43 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1668 2 30 GLU QB 2 31 CYS H . . 2.910 2.717 2.667 2.750 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1669 2 30 GLU QB 2 32 ASN H . . 5.450 4.911 4.853 4.963 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1670 2 30 GLU QB 2 33 ASN H . . 6.880 4.459 4.382 4.552 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1671 2 30 GLU QB 2 33 ASN QD . . 6.300 4.531 4.117 4.841 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1672 2 30 GLU HB2 2 31 CYS H . . 3.110 2.996 2.871 3.121 0.011 29 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1673 2 30 GLU HB2 2 32 ASN H . . 6.000 5.494 5.409 5.591 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1674 2 30 GLU HB3 2 31 CYS H . . 3.110 3.115 3.027 3.171 0.061 19 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1675 2 30 GLU HB3 2 32 ASN H . . 6.000 5.532 5.475 5.578 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1676 2 30 GLU QG 2 31 CYS H . . 5.000 4.521 4.453 4.573 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1677 2 30 GLU QG 2 33 ASN H . . 6.000 5.046 4.844 5.252 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1678 2 30 GLU QG 2 33 ASN HD21 . . 6.760 3.124 2.680 3.629 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1679 2 30 GLU QG 2 33 ASN HD22 . . 6.760 4.586 4.070 5.183 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1680 2 30 GLU QG 2 34 ARG H . . 6.880 5.242 5.023 5.510 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1681 2 30 GLU O 2 33 ASN H . . 2.000 2.014 1.883 2.185 0.185 4 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1682 2 30 GLU O 2 33 ASN N . . 3.000 2.801 2.656 3.009 0.009 18 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1683 2 30 GLU O 2 34 ARG H . . 2.000 1.810 1.769 1.943 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1684 2 30 GLU O 2 34 ARG N . . 3.000 2.539 2.443 2.748 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1685 2 31 CYS CB 2 48 CYS SG . . 3.100 3.013 2.859 3.171 0.071 18 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1686 2 31 CYS H 2 31 CYS HA . . 2.730 2.761 2.737 2.795 0.065 18 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1687 2 31 CYS H 2 31 CYS HB2 . . 3.500 2.307 2.178 2.436 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1688 2 31 CYS H 2 31 CYS HB3 . . 3.500 3.527 3.480 3.555 0.055 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1689 2 31 CYS H 2 32 ASN H . . 5.000 2.819 2.690 2.890 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1690 2 31 CYS H 2 32 ASN HA . . 6.000 5.291 5.195 5.345 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1691 2 31 CYS H 2 32 ASN HB2 . . 6.000 4.628 4.511 4.942 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1692 2 31 CYS H 2 32 ASN QB . . 5.450 4.493 4.375 4.769 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1693 2 31 CYS H 2 32 ASN HB3 . . 6.000 6.081 5.888 6.279 0.279 19 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1694 2 31 CYS H 2 33 ASN H . . 6.000 3.610 3.553 3.657 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1695 2 31 CYS H 2 33 ASN QB . . 5.880 4.380 4.259 4.502 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1696 2 31 CYS H 2 34 ARG H . . 5.000 4.446 4.327 4.685 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1697 2 31 CYS H 2 34 ARG QG . . 6.880 4.177 3.733 4.760 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1698 2 31 CYS H 2 38 PHE H . . 6.000 5.867 5.575 6.078 0.078 16 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1699 2 31 CYS H 2 38 PHE QB . . 6.880 4.069 3.902 4.333 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1700 2 31 CYS H 2 38 PHE QD . . 8.120 4.297 3.729 4.878 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1701 2 31 CYS HA 2 33 ASN H . . 6.000 3.601 3.518 3.698 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1702 2 31 CYS HA 2 34 ARG H . . 3.640 3.053 2.951 3.262 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1703 2 31 CYS HA 2 35 GLY H . . 4.480 3.926 3.677 4.199 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1704 2 31 CYS HA 2 36 CYS H . . 5.000 3.416 3.220 3.610 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1705 2 31 CYS HA 2 37 CYS H . . 6.000 5.891 5.739 6.029 0.029 39 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1706 2 31 CYS HA 2 38 PHE QD . . 8.120 5.584 5.165 6.089 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1707 2 31 CYS QB 2 32 ASN H . . 3.060 2.388 2.313 2.496 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1708 2 31 CYS QB 2 32 ASN QD . . 5.350 2.811 2.620 3.542 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1709 2 31 CYS QB 2 33 ASN H . . 4.480 4.093 4.045 4.129 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1710 2 31 CYS QB 2 34 ARG H . . 5.450 4.481 4.370 4.654 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1711 2 31 CYS QB 2 35 GLY H . . 5.450 4.561 4.439 4.715 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1712 2 31 CYS QB 2 36 CYS H . . 5.880 3.349 3.214 3.512 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1713 2 31 CYS QB 2 37 CYS H . . 4.440 3.657 3.529 3.799 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1714 2 31 CYS QB 2 38 PHE H . . 6.420 3.471 3.220 3.647 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1715 2 31 CYS QB 2 38 PHE QD . . 8.010 3.176 2.757 3.637 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1716 2 31 CYS QB 2 48 CYS H . . 6.880 5.749 5.478 5.987 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1717 2 31 CYS HB2 2 32 ASN H . . 3.610 2.458 2.357 2.606 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1718 2 31 CYS HB2 2 32 ASN HD21 . . 6.000 3.141 2.772 4.776 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1719 2 31 CYS HB2 2 32 ASN HD22 . . 6.000 4.472 4.167 5.125 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1720 2 31 CYS HB2 2 33 ASN H . . 4.820 4.456 4.386 4.523 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1721 2 31 CYS HB2 2 34 ARG H . . 6.000 5.196 5.098 5.387 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1722 2 31 CYS HB2 2 35 GLY H . . 6.000 5.683 5.577 5.824 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1723 2 31 CYS HB2 2 37 CYS H . . 5.000 5.161 5.103 5.241 0.241 1 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1724 2 31 CYS HB3 2 32 ASN H . . 3.610 3.260 3.084 3.410 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1725 2 31 CYS HB3 2 32 ASN HD21 . . 6.000 3.408 3.119 4.423 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1726 2 31 CYS HB3 2 32 ASN HD22 . . 6.000 4.601 4.362 4.865 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1727 2 31 CYS HB3 2 33 ASN H . . 4.820 4.772 4.654 4.882 0.062 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1728 2 31 CYS HB3 2 34 ARG H . . 6.000 4.894 4.754 5.089 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1729 2 31 CYS HB3 2 35 GLY H . . 6.000 4.805 4.649 4.984 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1730 2 31 CYS HB3 2 37 CYS H . . 5.000 3.741 3.597 3.908 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1731 2 31 CYS O 2 35 GLY H . . 2.000 1.733 1.628 1.874 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1732 2 31 CYS O 2 35 GLY N . . 3.000 2.649 2.545 2.757 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1733 2 31 CYS O 2 36 CYS H . . 2.000 1.591 1.508 1.680 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1734 2 31 CYS O 2 36 CYS N . . 3.000 2.590 2.506 2.673 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1735 2 31 CYS SG 2 48 CYS CB . . 3.100 2.865 2.794 2.927 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1736 2 31 CYS SG 2 48 CYS SG . . 2.100 1.977 1.822 2.128 0.028 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1737 2 32 ASN H 2 32 ASN HA . . 2.900 2.756 2.736 2.773 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1738 2 32 ASN H 2 32 ASN HB2 . . 3.500 2.141 2.042 2.523 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1739 2 32 ASN H 2 32 ASN QB . . 2.880 2.121 2.025 2.473 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1740 2 32 ASN H 2 32 ASN HB3 . . 3.500 3.447 3.359 3.553 0.053 4 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1741 2 32 ASN H 2 33 ASN H . . 2.920 2.663 2.637 2.693 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1742 2 32 ASN H 2 33 ASN HA . . 6.000 5.110 5.067 5.151 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1743 2 32 ASN H 2 33 ASN QB . . 4.880 4.290 4.222 4.367 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1744 2 32 ASN H 2 34 ARG H . . 5.000 4.162 4.039 4.346 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1745 2 32 ASN H 2 34 ARG HG2 . . 6.000 5.832 5.604 6.083 0.083 1 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1746 2 32 ASN H 2 34 ARG HG3 . . 6.000 5.230 4.903 5.884 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1747 2 32 ASN H 2 35 GLY H . . 5.000 4.691 4.642 4.734 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1748 2 32 ASN H 2 36 CYS H . . 5.000 4.293 4.192 4.370 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1749 2 32 ASN H 2 37 CYS HA . . 6.000 4.506 4.231 4.860 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1750 2 32 ASN H 2 38 PHE H . . 5.240 4.358 4.091 4.628 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1751 2 32 ASN H 2 38 PHE QB . . 6.650 3.700 3.581 3.876 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1752 2 32 ASN H 2 38 PHE QD . . 7.970 5.236 4.822 5.652 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1753 2 32 ASN HA 2 32 ASN HD21 . . 3.500 2.454 1.914 2.771 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1754 2 32 ASN HA 2 32 ASN QD . . 3.140 2.402 1.905 2.685 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1755 2 32 ASN HA 2 32 ASN HD22 . . 3.500 3.458 3.194 3.594 0.094 29 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1756 2 32 ASN HA 2 33 ASN H . . 3.500 3.415 3.359 3.459 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1757 2 32 ASN HA 2 33 ASN HA . . 6.000 4.629 4.579 4.705 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1758 2 32 ASN HA 2 34 ARG H . . 5.000 4.245 4.133 4.325 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1759 2 32 ASN HA 2 35 GLY H . . 3.640 3.407 3.219 3.560 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1760 2 32 ASN HA 2 36 CYS H . . 3.500 3.057 2.924 3.185 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1761 2 32 ASN HA 2 37 CYS H . . 6.000 5.329 5.223 5.535 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1762 2 32 ASN HA 2 37 CYS HA . . 6.000 3.754 3.559 4.112 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1763 2 32 ASN QB 2 36 CYS H . . 5.450 5.029 4.943 5.116 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1764 2 32 ASN QB 2 38 PHE H . . 6.880 4.683 4.417 4.978 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1765 2 32 ASN HB2 2 36 CYS H . . 6.000 5.626 5.532 5.814 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1766 2 32 ASN HB3 2 36 CYS H . . 6.000 5.667 5.535 5.795 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1767 2 32 ASN QD 2 33 ASN H . . 5.450 4.414 4.315 4.814 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1768 2 32 ASN QD 2 36 CYS H . . 6.870 4.303 3.882 4.588 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1769 2 32 ASN QD 2 37 CYS H . . 5.870 4.303 4.095 4.427 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1770 2 32 ASN QD 2 37 CYS HA . . 4.420 1.899 1.778 2.097 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1771 2 32 ASN QD 2 37 CYS QB . . 6.820 3.702 3.417 3.899 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1772 2 32 ASN QD 2 38 PHE QB . . 4.280 2.970 2.665 3.472 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1773 2 32 ASN HD21 2 33 ASN H . . 6.000 4.534 4.420 5.050 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1774 2 32 ASN HD21 2 37 CYS HA . . 4.670 2.533 2.123 2.708 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1775 2 32 ASN HD21 2 37 CYS HB2 . . 7.750 5.035 4.227 5.361 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1776 2 32 ASN HD21 2 37 CYS HB3 . . 7.750 5.449 5.105 5.678 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1777 2 32 ASN HD21 2 38 PHE HB2 . . 5.390 3.448 2.922 4.958 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1778 2 32 ASN HD21 2 38 PHE HB3 . . 5.390 4.050 3.614 5.323 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1779 2 32 ASN HD22 2 33 ASN H . . 6.000 6.080 6.023 6.225 0.225 21 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1780 2 32 ASN HD22 2 37 CYS HA . . 4.670 1.964 1.896 2.184 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1781 2 32 ASN HD22 2 37 CYS HB2 . . 7.750 4.232 3.807 4.514 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1782 2 32 ASN HD22 2 37 CYS HB3 . . 7.750 4.577 4.060 4.978 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1783 2 32 ASN HD22 2 38 PHE HB2 . . 5.390 3.964 3.514 4.664 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1784 2 32 ASN HD22 2 38 PHE HB3 . . 5.390 3.894 3.582 4.612 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1785 2 33 ASN H 2 33 ASN HA . . 2.900 2.886 2.850 2.905 0.005 4 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1786 2 33 ASN H 2 33 ASN HB2 . . 2.900 2.641 2.216 3.004 0.104 38 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1787 2 33 ASN H 2 33 ASN QB . . 2.560 2.257 2.151 2.321 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1788 2 33 ASN H 2 33 ASN HB3 . . 2.900 2.593 2.322 2.907 0.007 8 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1789 2 33 ASN H 2 33 ASN HD21 . . 6.000 4.624 4.300 4.836 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1790 2 33 ASN H 2 33 ASN HD22 . . 6.000 5.758 5.567 5.909 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1791 2 33 ASN H 2 34 ARG H . . 2.900 2.105 1.966 2.328 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1792 2 33 ASN H 2 34 ARG HA . . 6.000 4.731 4.612 4.923 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1793 2 33 ASN H 2 34 ARG HB2 . . 6.000 5.013 4.360 5.574 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1794 2 33 ASN H 2 34 ARG QB . . 5.450 4.278 3.880 4.634 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1795 2 33 ASN H 2 34 ARG HB3 . . 6.000 5.071 3.971 5.889 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1796 2 33 ASN H 2 34 ARG HG2 . . 5.000 4.268 3.589 5.112 0.112 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1797 2 33 ASN H 2 34 ARG HG3 . . 5.000 4.067 3.849 4.561 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1798 2 33 ASN H 2 35 GLY H . . 4.250 3.469 3.375 3.549 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1799 2 33 ASN H 2 35 GLY QA . . 6.880 5.214 5.152 5.310 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1800 2 33 ASN H 2 36 CYS H . . 6.000 4.147 4.018 4.288 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1801 2 33 ASN H 2 38 PHE QB . . 6.880 6.051 5.941 6.150 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1802 2 33 ASN HA 2 34 ARG H . . 3.500 3.562 3.531 3.604 0.104 43 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1803 2 33 ASN HA 2 35 GLY H . . 5.000 4.272 4.129 4.466 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1804 2 33 ASN HA 2 36 CYS H . . 6.000 5.667 5.597 5.767 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1805 2 33 ASN QB 2 34 ARG H . . 3.340 2.815 2.641 2.927 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1806 2 33 ASN QB 2 35 GLY H . . 5.450 4.629 4.479 4.760 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1807 2 33 ASN HB2 2 34 ARG H . . 4.000 3.888 3.503 4.174 0.174 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1808 2 33 ASN HB2 2 35 GLY H . . 6.000 5.584 5.267 5.877 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1809 2 33 ASN HB3 2 34 ARG H . . 4.000 2.892 2.727 2.989 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1810 2 33 ASN HB3 2 35 GLY H . . 6.000 4.946 4.825 5.031 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1811 2 33 ASN QD 2 34 ARG QB . . 7.740 5.253 3.861 6.189 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1812 2 33 ASN QD 2 34 ARG QG . . 6.820 4.784 4.230 5.462 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1813 2 33 ASN HD21 2 34 ARG HG2 . . 7.750 5.417 4.512 6.584 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1814 2 33 ASN HD21 2 34 ARG HG3 . . 7.750 6.170 5.755 6.491 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1815 2 33 ASN HD22 2 34 ARG HG2 . . 7.750 6.581 5.499 7.725 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1816 2 33 ASN HD22 2 34 ARG HG3 . . 7.750 7.398 6.922 7.589 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1817 2 34 ARG H 2 34 ARG HA . . 2.880 2.857 2.839 2.869 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1818 2 34 ARG H 2 34 ARG HB2 . . 3.500 3.036 2.482 3.590 0.090 31 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1819 2 34 ARG H 2 34 ARG QB . . 3.290 2.502 2.305 2.682 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1820 2 34 ARG H 2 34 ARG HB3 . . 3.500 3.107 2.335 3.608 0.108 47 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1821 2 34 ARG H 2 34 ARG QD . . 4.670 4.092 3.935 4.405 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1822 2 34 ARG H 2 34 ARG HG2 . . 4.000 2.736 1.853 3.580 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1823 2 34 ARG H 2 34 ARG HG3 . . 4.000 2.591 2.389 2.881 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1824 2 34 ARG H 2 35 GLY H . . 2.850 2.287 2.227 2.366 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1825 2 34 ARG H 2 35 GLY HA2 . . 5.000 4.653 4.607 4.734 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1826 2 34 ARG H 2 35 GLY HA3 . . 5.000 4.977 4.928 5.040 0.040 8 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1827 2 34 ARG H 2 36 CYS H . . 3.500 3.366 3.264 3.464 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1828 2 34 ARG H 2 36 CYS HA . . 6.000 6.244 6.162 6.301 0.301 20 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1829 2 34 ARG HA 2 34 ARG HD2 . . 4.780 4.510 3.402 4.786 0.006 35 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1830 2 34 ARG HA 2 34 ARG QD . . 4.420 3.397 3.064 3.661 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1831 2 34 ARG HA 2 34 ARG HD3 . . 4.780 3.639 3.122 4.936 0.156 21 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1832 2 34 ARG HA 2 35 GLY H . . 3.300 3.534 3.515 3.571 0.271 31 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1833 2 34 ARG HA 2 36 CYS H . . 6.000 5.046 4.937 5.136 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1834 2 34 ARG QB 2 35 GLY H . . 3.840 3.193 2.914 3.568 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1835 2 34 ARG QB 2 36 CYS H . . 4.720 3.682 3.139 4.348 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1836 2 34 ARG HB2 2 34 ARG HD2 . . 4.220 3.383 2.065 3.787 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1837 2 34 ARG HB2 2 34 ARG HD3 . . 4.220 2.931 2.195 3.390 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1838 2 34 ARG HB2 2 35 GLY H . . 4.000 3.497 2.974 4.303 0.303 21 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1839 2 34 ARG HB2 2 36 CYS H . . 5.000 4.037 3.183 5.113 0.113 33 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1840 2 34 ARG HB3 2 34 ARG HD2 . . 4.220 3.472 3.016 4.220 0.000 31 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1841 2 34 ARG HB3 2 34 ARG HD3 . . 4.220 2.657 1.982 3.875 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1842 2 34 ARG HB3 2 35 GLY H . . 4.000 4.042 3.754 4.242 0.242 15 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1843 2 34 ARG HB3 2 36 CYS H . . 5.000 4.795 4.431 5.078 0.078 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1844 2 34 ARG QG 2 35 GLY H . . 5.600 3.103 1.941 4.052 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1845 2 34 ARG QG 2 36 CYS H . . 5.460 3.451 2.095 4.640 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1846 2 34 ARG QG 2 50 LYS QE . . 7.760 6.136 5.440 6.497 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1847 2 34 ARG HG2 2 35 GLY H . . 6.000 4.062 3.704 4.528 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1848 2 34 ARG HG2 2 36 CYS H . . 5.850 4.599 3.637 5.544 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1849 2 34 ARG HG3 2 35 GLY H . . 6.000 3.409 1.948 4.570 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1850 2 34 ARG HG3 2 36 CYS H . . 5.850 3.638 2.107 4.977 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1851 2 35 GLY H 2 35 GLY HA2 . . 2.770 2.464 2.434 2.517 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1852 2 35 GLY H 2 35 GLY QA . . 2.530 2.349 2.327 2.385 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1853 2 35 GLY H 2 35 GLY HA3 . . 2.770 2.960 2.956 2.961 0.191 13 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1854 2 35 GLY H 2 36 CYS H . . 2.880 1.803 1.699 1.865 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1855 2 35 GLY H 2 36 CYS HA . . 5.000 4.522 4.430 4.577 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1856 2 35 GLY H 2 37 CYS H . . 6.000 6.242 6.141 6.317 0.317 30 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1857 2 35 GLY QA 2 36 CYS H . . 3.190 2.913 2.891 2.940 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1858 2 35 GLY QA 2 36 CYS HA . . 4.880 4.004 3.999 4.020 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1859 2 35 GLY QA 2 37 CYS H . . 6.880 6.002 5.917 6.073 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1860 2 35 GLY QA 2 50 LYS HA . . 5.880 5.440 5.346 5.497 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1861 2 35 GLY HA2 2 36 CYS H . . 3.500 3.099 3.059 3.156 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1862 2 35 GLY HA3 2 36 CYS H . . 3.500 3.540 3.509 3.559 0.059 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1863 2 36 CYS H 2 37 CYS H . . 5.000 4.461 4.427 4.482 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1864 2 36 CYS H 2 37 CYS QB . . 6.880 5.534 5.456 5.690 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1865 2 36 CYS H 2 49 PHE H . . 6.000 5.934 5.735 6.107 0.107 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1866 2 36 CYS HA 2 37 CYS H . . 3.190 2.571 2.480 2.670 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1867 2 36 CYS HA 2 37 CYS HA . . 6.000 4.414 4.386 4.457 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1868 2 36 CYS HA 2 38 PHE H . . 6.000 6.255 6.112 6.353 0.353 16 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1869 2 36 CYS HA 2 48 CYS QB . . 6.880 6.149 6.004 6.257 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1870 2 36 CYS HA 2 49 PHE H . . 6.000 4.074 3.956 4.233 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1871 2 36 CYS HA 2 50 LYS H . . 6.000 4.723 4.607 4.877 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1872 2 36 CYS QB 2 37 CYS H . . 3.300 2.305 2.121 2.480 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1873 2 36 CYS HB2 2 37 CYS H . . 3.530 3.476 3.086 3.669 0.139 35 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1874 2 36 CYS HB2 2 49 PHE H . . 6.000 4.114 3.744 4.467 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1875 2 36 CYS HB3 2 37 CYS H . . 3.530 2.340 2.143 2.524 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1876 2 36 CYS HB3 2 49 PHE H . . 6.000 2.626 2.407 2.841 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1877 2 37 CYS H 2 37 CYS HA . . 2.900 2.930 2.924 2.933 0.033 43 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1878 2 37 CYS H 2 37 CYS HB2 . . 3.500 2.699 2.364 2.865 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1879 2 37 CYS H 2 37 CYS HB3 . . 3.500 2.850 2.726 3.187 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1880 2 37 CYS H 2 38 PHE HA . . 5.000 4.790 4.663 4.917 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1881 2 37 CYS H 2 38 PHE QD . . 7.130 6.475 6.331 6.633 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1882 2 37 CYS H 2 39 ASP H . . 6.000 6.096 5.975 6.201 0.201 16 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1883 2 37 CYS H 2 48 CYS HA . . 4.710 3.481 3.244 3.815 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1884 2 37 CYS H 2 48 CYS QB . . 6.880 5.151 4.957 5.471 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1885 2 37 CYS H 2 49 PHE H . . 2.850 2.021 1.830 2.287 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1886 2 37 CYS H 2 49 PHE HA . . 5.000 4.050 3.955 4.234 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1887 2 37 CYS H 2 49 PHE HD1 . . 6.000 4.552 4.184 4.764 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1888 2 37 CYS H 2 49 PHE HD2 . . 5.430 4.483 4.216 4.725 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1889 2 37 CYS H 2 49 PHE O . . 2.000 1.661 1.581 1.758 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1890 2 37 CYS H 2 50 LYS H . . 6.000 4.561 4.462 4.725 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1891 2 37 CYS H 2 50 LYS HA . . 3.680 3.518 3.299 3.743 0.063 1 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1892 2 37 CYS H 2 50 LYS QG . . 6.880 5.546 4.301 5.946 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1893 2 37 CYS H 2 51 PRO HD2 . . 5.200 3.052 2.737 3.277 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1894 2 37 CYS H 2 51 PRO QD . . 4.550 2.558 2.370 2.695 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1895 2 37 CYS H 2 51 PRO HD3 . . 5.200 2.748 2.583 2.879 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1896 2 37 CYS H 2 53 GLN QB . . 6.880 5.695 4.359 6.019 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1897 2 37 CYS H 2 53 GLN QG . . 5.820 4.063 3.774 4.474 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1898 2 37 CYS HA 2 37 CYS QB . . 2.650 2.456 2.420 2.535 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1899 2 37 CYS HA 2 38 PHE H . . 2.900 2.244 2.224 2.286 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1900 2 37 CYS HA 2 38 PHE HA . . 6.000 4.381 4.369 4.389 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1901 2 37 CYS HA 2 39 ASP H . . 6.000 5.922 5.836 6.036 0.036 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1902 2 37 CYS HA 2 49 PHE H . . 5.000 4.362 4.278 4.502 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1903 2 37 CYS HA 2 53 GLN QB . . 6.880 6.243 4.543 6.519 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1904 2 37 CYS HA 2 53 GLN QG . . 5.880 5.192 4.940 5.563 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1905 2 37 CYS QB 2 38 PHE H . . 4.180 3.711 3.403 3.792 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1906 2 37 CYS QB 2 39 ASP H . . 6.880 5.119 4.938 5.344 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1907 2 37 CYS QB 2 49 PHE H . . 3.890 3.279 3.111 3.572 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1908 2 37 CYS QB 2 49 PHE HA . . 6.880 5.287 5.120 5.523 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1909 2 37 CYS HB2 2 38 PHE H . . 5.000 4.440 4.362 4.551 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1910 2 37 CYS HB2 2 49 PHE H . . 4.100 4.161 3.792 4.253 0.153 42 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1911 2 37 CYS HB3 2 38 PHE H . . 5.000 3.982 3.537 4.115 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1912 2 37 CYS HB3 2 49 PHE H . . 4.100 3.442 3.211 3.918 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1913 2 37 CYS N 2 49 PHE O . . 3.000 2.473 2.382 2.588 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1914 2 37 CYS O 2 49 PHE H . . 2.000 2.127 2.014 2.213 0.213 47 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1915 2 37 CYS O 2 49 PHE N . . 3.000 3.006 2.911 3.100 0.100 39 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1916 2 38 PHE H 2 38 PHE HB2 . . 2.880 2.489 2.346 2.652 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1917 2 38 PHE H 2 38 PHE QB . . 2.690 2.180 2.141 2.220 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1918 2 38 PHE H 2 38 PHE HB3 . . 2.880 2.416 2.279 2.521 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1919 2 38 PHE H 2 39 ASP H . . 5.000 4.462 4.402 4.528 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1920 2 38 PHE H 2 39 ASP QB . . 6.880 5.702 5.594 5.935 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1921 2 38 PHE HA 2 39 ASP H . . 2.900 2.195 2.192 2.202 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1922 2 38 PHE HA 2 40 SER H . . 6.000 4.945 4.793 5.367 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1923 2 38 PHE HA 2 48 CYS QB . . 6.880 3.825 3.484 4.275 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1924 2 38 PHE QB 2 39 ASP H . . 4.440 3.904 3.840 3.951 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1925 2 38 PHE QB 2 48 CYS HA . . 6.880 4.227 4.009 4.667 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1926 2 38 PHE HB2 2 39 ASP H . . 5.000 4.481 4.415 4.537 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1927 2 38 PHE HB3 2 39 ASP H . . 5.000 4.297 4.173 4.423 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1928 2 38 PHE QD 2 39 ASP H . . 5.800 3.851 3.427 3.966 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1929 2 38 PHE QD 2 39 ASP HA . . 8.050 4.581 4.035 5.017 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1930 2 38 PHE QD 2 39 ASP QB . . 6.080 4.968 4.466 5.080 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1931 2 38 PHE QD 2 41 ARG H . . 8.120 5.720 5.150 6.111 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1932 2 38 PHE QD 2 47 TRP HE3 . . 6.720 4.767 4.094 5.514 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1933 2 38 PHE QD 2 48 CYS H . . 7.890 5.480 5.111 5.978 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1934 2 38 PHE QD 2 48 CYS QB . . 8.660 3.332 2.624 4.242 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1935 2 38 PHE QD 2 49 PHE H . . 7.410 6.015 5.751 6.362 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1936 2 38 PHE QE 2 39 ASP H . . 7.590 4.922 4.663 5.057 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1937 2 38 PHE QE 2 40 SER H . . 5.000 4.663 3.970 4.915 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1938 2 38 PHE QE 2 41 ARG H . . 7.590 5.825 5.443 6.137 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1939 2 38 PHE QE 2 47 TRP HE3 . . 5.990 3.610 2.968 4.636 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1940 2 38 PHE QE 2 48 CYS H . . 7.740 6.431 6.042 6.956 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1941 2 38 PHE HZ 2 47 TRP HE3 . . 6.000 5.025 4.166 6.008 0.008 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1942 2 39 ASP H 2 39 ASP HB2 . . 3.040 2.878 2.644 3.134 0.094 8 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1943 2 39 ASP H 2 39 ASP HB3 . . 3.040 2.210 2.072 2.371 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1944 2 39 ASP H 2 40 SER H . . 5.000 3.008 2.848 3.481 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1945 2 39 ASP H 2 41 ARG H . . 6.000 4.887 4.764 5.086 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1946 2 39 ASP H 2 46 PRO QB . . 6.880 5.899 5.716 6.052 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1947 2 39 ASP H 2 47 TRP H . . 6.000 4.855 4.472 4.990 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1948 2 39 ASP H 2 47 TRP HA . . 3.420 2.142 1.690 2.385 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1949 2 39 ASP H 2 48 CYS HA . . 5.890 3.998 3.726 4.245 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1950 2 39 ASP H 2 48 CYS QB . . 6.880 4.844 4.579 5.045 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1951 2 39 ASP H 2 49 PHE H . . 5.000 5.048 4.870 5.209 0.209 47 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1952 2 39 ASP H 2 49 PHE HD1 . . 6.000 4.388 4.240 4.572 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1953 2 39 ASP HA 2 40 SER H . . 3.500 3.615 3.547 3.634 0.134 3 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1954 2 39 ASP HA 2 41 ARG H . . 4.000 3.558 3.502 3.623 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1955 2 39 ASP QB 2 41 ARG H . . 4.490 3.371 3.099 3.551 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1956 2 39 ASP QB 2 42 ILE H . . 6.880 3.739 3.508 3.951 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1957 2 39 ASP QB 2 47 TRP H . . 5.450 4.417 3.687 4.764 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1958 2 39 ASP HB2 2 47 TRP H . . 6.000 5.884 4.281 6.190 0.190 8 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1959 2 39 ASP HB3 2 47 TRP H . . 6.000 4.575 3.976 4.982 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1960 2 39 ASP OD1 2 41 ARG H . . 2.000 2.357 1.990 2.910 0.910 33 20 "[ **.* *- * *. * 2 . * ** +*.*** ** **. ]" 1
1961 2 39 ASP OD1 2 41 ARG N . . 3.000 3.146 2.679 3.798 0.798 33 19 "[ **.* *1 * *. * 2 . * ** +*.**- ** **. ]" 1
1962 2 39 ASP OD1 2 42 ILE H . . 2.000 2.843 2.061 3.847 1.847 9 21 "[ **.* +* * *. * 2 . * ** **.*** ** **- ]" 1
1963 2 39 ASP OD1 2 42 ILE N . . 3.000 3.668 3.026 4.598 1.598 3 21 "[ +*.* ** * *. * 2 . * ** **.*** ** **- ]" 1
1964 2 40 SER H 2 41 ARG H . . 3.500 2.753 2.530 2.878 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1965 2 40 SER H 2 41 ARG HA . . 5.000 5.122 4.947 5.204 0.204 8 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1966 2 40 SER H 2 41 ARG QG . . 5.880 4.347 4.164 4.573 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1967 2 40 SER H 2 45 VAL H . . 6.000 6.136 6.021 6.260 0.260 33 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1968 2 41 ARG H 2 41 ARG HA . . 2.810 2.778 2.722 2.874 0.064 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1969 2 41 ARG H 2 41 ARG QB . . 3.870 2.520 2.356 2.653 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1970 2 41 ARG H 2 41 ARG HG2 . . 2.770 2.501 2.002 2.860 0.090 14 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1971 2 41 ARG H 2 41 ARG HG3 . . 2.770 2.344 1.928 2.630 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1972 2 41 ARG H 2 42 ILE H . . 2.920 2.656 2.431 2.959 0.039 14 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1973 2 41 ARG H 2 42 ILE HG12 . . 5.010 5.020 4.795 5.120 0.110 43 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1974 2 41 ARG H 2 42 ILE QG . . 4.760 4.079 3.907 4.250 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1975 2 41 ARG H 2 42 ILE HG13 . . 5.010 4.320 4.111 4.542 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1976 2 41 ARG HA 2 41 ARG QB . . 2.670 2.368 2.314 2.443 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1977 2 41 ARG HA 2 41 ARG HD2 . . 5.540 4.710 4.030 4.948 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1978 2 41 ARG HA 2 41 ARG QD . . 4.960 3.936 3.629 4.137 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1979 2 41 ARG HA 2 41 ARG HD3 . . 5.540 4.250 3.762 4.795 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1980 2 41 ARG HA 2 41 ARG QG . . 3.580 2.416 2.226 2.576 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1981 2 41 ARG HA 2 42 ILE H . . 3.500 3.619 3.602 3.649 0.149 14 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1982 2 41 ARG QB 2 45 VAL QG . . 7.680 4.234 3.718 4.527 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1983 2 41 ARG QD 2 42 ILE H . . 6.880 5.034 4.747 5.302 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1984 2 41 ARG QG 2 42 ILE H . . 4.880 3.780 3.592 4.087 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1985 2 42 ILE H 2 42 ILE HA . . 2.900 2.938 2.934 2.940 0.040 39 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1986 2 42 ILE H 2 42 ILE HB . . 2.900 2.866 2.698 2.998 0.098 14 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1987 2 42 ILE H 2 42 ILE MD . . 4.900 3.989 3.695 4.161 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1988 2 42 ILE H 2 42 ILE HG12 . . 3.800 3.100 2.737 3.225 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1989 2 42 ILE H 2 42 ILE QG . . 3.380 2.325 1.928 2.563 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1990 2 42 ILE H 2 42 ILE HG13 . . 3.800 2.408 1.961 2.695 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1991 2 42 ILE H 2 42 ILE MG . . 4.520 3.884 3.793 3.903 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1992 2 42 ILE H 2 43 PRO QG . . 6.880 5.659 5.528 5.935 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1993 2 42 ILE H 2 45 VAL H . . 6.000 4.728 4.413 4.907 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1994 2 42 ILE H 2 47 TRP HE1 . . 5.700 5.893 5.762 5.983 0.283 24 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1995 2 42 ILE HA 2 42 ILE HG12 . . 3.640 2.729 2.560 2.965 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1996 2 42 ILE HA 2 42 ILE QG . . 3.460 2.641 2.503 2.831 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1997 2 42 ILE HA 2 42 ILE HG13 . . 3.640 3.535 3.471 3.657 0.017 42 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1998 2 42 ILE HA 2 43 PRO HD2 . . 3.380 2.252 2.212 2.367 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
1999 2 42 ILE HA 2 43 PRO QD . . 3.150 1.878 1.841 1.905 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2000 2 42 ILE HA 2 43 PRO HD3 . . 3.380 2.015 1.919 2.078 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2001 2 42 ILE HA 2 43 PRO QG . . 5.080 3.811 3.795 3.827 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2002 2 42 ILE HB 2 43 PRO HA . . 6.000 5.015 4.896 5.104 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2003 2 42 ILE HB 2 45 VAL H . . 5.000 3.030 2.566 3.310 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2004 2 42 ILE HB 2 45 VAL MG1 . . 6.120 2.092 1.822 2.971 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2005 2 42 ILE HB 2 45 VAL QG . . 5.100 1.944 1.671 2.816 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2006 2 42 ILE HB 2 45 VAL MG2 . . 6.120 2.377 1.889 3.569 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2007 2 42 ILE HB 2 47 TRP HE1 . . 6.000 5.701 5.389 5.868 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2008 2 42 ILE QG 2 43 PRO HA . . 6.880 5.913 5.808 5.981 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2009 2 42 ILE MG 2 43 PRO HA . . 6.460 4.594 4.364 4.801 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2010 2 42 ILE MG 2 44 GLY H . . 7.030 2.101 1.888 2.621 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2011 2 42 ILE MG 2 45 VAL HA . . 7.030 4.734 4.095 5.150 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2012 2 42 ILE MG 2 45 VAL QG . . 8.630 2.262 1.781 3.665 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2013 2 42 ILE MG 2 47 TRP HE1 . . 7.030 5.390 5.187 5.703 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2014 2 42 ILE O 2 45 VAL H . . 2.000 2.222 2.196 2.306 0.306 43 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2015 2 42 ILE O 2 45 VAL N . . 3.000 3.192 3.170 3.240 0.240 43 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2016 2 43 PRO HA 2 44 GLY QA . . 6.880 4.279 4.262 4.306 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2017 2 43 PRO HA 2 45 VAL QG . . 8.590 4.333 4.143 4.714 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2018 2 43 PRO HA 2 47 TRP HE1 . . 5.000 1.863 1.811 1.907 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2019 2 43 PRO HA 2 47 TRP HZ2 . . 4.750 4.320 4.118 4.473 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2020 2 43 PRO QB 2 45 VAL H . . 5.880 4.793 4.755 4.833 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2021 2 43 PRO QB 2 47 TRP HE1 . . 5.620 3.290 3.151 3.458 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2022 2 43 PRO HB2 2 47 TRP HE1 . . 6.000 3.662 3.505 3.864 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2023 2 43 PRO HB3 2 47 TRP HE1 . . 6.000 3.725 3.571 3.900 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2024 2 43 PRO QG 2 45 VAL H . . 5.880 5.274 5.095 5.351 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2025 2 43 PRO QG 2 47 TRP HE1 . . 6.880 4.838 4.745 4.934 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2026 2 43 PRO O 2 47 TRP HE1 . . 2.000 2.040 2.012 2.083 0.083 47 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2027 2 43 PRO O 2 47 TRP NE1 . . 3.000 3.095 3.038 3.135 0.135 28 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2028 2 44 GLY H 2 45 VAL H . . 3.450 2.333 2.291 2.362 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2029 2 44 GLY H 2 45 VAL HA . . 5.000 4.896 4.835 4.932 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2030 2 44 GLY H 2 45 VAL QG . . 8.590 3.355 2.789 4.293 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2031 2 44 GLY H 2 47 TRP HE1 . . 6.000 4.015 3.902 4.256 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2032 2 44 GLY QA 2 45 VAL HA . . 4.880 4.022 4.020 4.024 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2033 2 44 GLY HA2 2 45 VAL H . . 3.190 3.412 3.355 3.445 0.255 44 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2034 2 44 GLY HA3 2 45 VAL H . . 3.190 3.293 3.252 3.357 0.167 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2035 2 45 VAL H 2 45 VAL HA . . 2.900 2.938 2.930 2.941 0.041 20 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2036 2 45 VAL H 2 45 VAL MG1 . . 3.990 2.507 2.191 2.942 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2037 2 45 VAL H 2 45 VAL QG . . 3.430 2.315 2.064 2.826 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2038 2 45 VAL H 2 45 VAL MG2 . . 3.990 2.801 2.400 3.712 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2039 2 45 VAL H 2 46 PRO QB . . 6.850 6.197 6.158 6.299 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2040 2 45 VAL H 2 46 PRO HD2 . . 5.010 4.726 4.662 4.856 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2041 2 45 VAL H 2 46 PRO QD . . 4.720 4.245 4.210 4.311 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2042 2 45 VAL H 2 46 PRO HD3 . . 5.010 4.807 4.796 4.825 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2043 2 45 VAL H 2 47 TRP HE1 . . 4.970 3.343 3.141 3.690 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2044 2 45 VAL HA 2 47 TRP H . . 6.000 5.848 5.722 5.927 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2045 2 45 VAL QG 2 47 TRP H . . 7.600 4.090 3.858 4.208 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2046 2 45 VAL QG 2 47 TRP QB . . 9.470 4.442 4.200 4.577 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2047 2 45 VAL QG 2 47 TRP HE1 . . 7.370 4.272 4.029 4.585 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2048 2 46 PRO HA 2 47 TRP H . . 2.900 2.150 2.148 2.159 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2049 2 46 PRO HA 2 48 CYS H . . 3.260 3.436 3.389 3.491 0.231 13 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2050 2 46 PRO QB 2 47 TRP H . . 4.300 3.542 3.484 3.632 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2051 2 46 PRO QB 2 48 CYS H . . 3.650 2.541 2.504 2.594 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2052 2 46 PRO HB2 2 48 CYS H . . 4.000 2.575 2.536 2.631 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2053 2 46 PRO HB3 2 48 CYS H . . 4.000 3.907 3.867 3.974 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2054 2 46 PRO QD 2 47 TRP H . . 5.470 4.902 4.847 4.934 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2055 2 46 PRO QG 2 47 TRP H . . 5.370 4.939 4.919 4.966 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2056 2 46 PRO HG2 2 48 CYS H . . 6.000 4.346 4.248 4.418 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2057 2 46 PRO HG3 2 48 CYS H . . 6.000 5.306 5.251 5.361 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2058 2 47 TRP H 2 47 TRP HD1 . . 3.990 3.536 3.343 3.680 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2059 2 47 TRP H 2 47 TRP HE1 . . 6.000 4.503 4.350 4.627 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2060 2 47 TRP H 2 47 TRP HE3 . . 5.280 3.357 3.144 3.538 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2061 2 47 TRP H 2 47 TRP HZ3 . . 6.000 5.000 4.749 5.175 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2062 2 47 TRP H 2 48 CYS H . . 3.500 2.862 2.794 2.983 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2063 2 47 TRP H 2 48 CYS HA . . 6.000 5.132 5.065 5.214 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2064 2 47 TRP H 2 48 CYS HB2 . . 5.000 4.452 4.251 4.595 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2065 2 47 TRP H 2 48 CYS QB . . 4.440 3.996 3.910 4.060 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2066 2 47 TRP H 2 48 CYS HB3 . . 5.000 4.534 4.366 4.843 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2067 2 47 TRP HA 2 47 TRP HE1 . . 6.000 5.705 5.656 5.882 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2068 2 47 TRP HA 2 48 CYS H . . 3.570 2.998 2.956 3.029 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2069 2 47 TRP HA 2 48 CYS QB . . 6.880 4.538 4.493 4.566 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2070 2 47 TRP HE3 2 48 CYS H . . 6.000 5.103 4.705 5.230 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2071 2 47 TRP HE3 2 48 CYS QB . . 6.880 3.838 3.345 3.938 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2072 2 47 TRP HZ3 2 48 CYS QB . . 6.040 5.373 4.742 5.497 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2073 2 48 CYS H 2 48 CYS HB2 . . 3.300 3.406 3.268 3.488 0.188 40 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2074 2 48 CYS H 2 48 CYS HB3 . . 3.300 3.184 3.124 3.321 0.021 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2075 2 48 CYS H 2 49 PHE H . . 5.000 3.599 3.373 3.803 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2076 2 48 CYS H 2 49 PHE HA . . 5.000 4.521 4.404 4.654 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2077 2 48 CYS H 2 49 PHE QB . . 5.880 4.056 3.927 4.122 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2078 2 48 CYS H 2 49 PHE HD2 . . 6.000 6.111 6.045 6.193 0.193 45 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2079 2 48 CYS HA 2 49 PHE H . . 2.310 2.246 2.219 2.294 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2080 2 48 CYS HA 2 49 PHE HA . . 6.000 4.386 4.379 4.399 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2081 2 48 CYS QB 2 49 PHE H . . 4.440 3.995 3.914 4.032 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2082 2 48 CYS HB2 2 49 PHE H . . 5.000 4.569 4.441 4.679 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2083 2 48 CYS HB3 2 49 PHE H . . 5.000 4.411 4.323 4.467 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2084 2 49 PHE H 2 49 PHE HA . . 2.900 2.912 2.881 2.928 0.028 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2085 2 49 PHE H 2 49 PHE HB2 . . 3.500 3.574 3.499 3.663 0.163 43 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2086 2 49 PHE H 2 49 PHE HB3 . . 3.500 3.540 3.453 3.631 0.131 37 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2087 2 49 PHE H 2 49 PHE HD1 . . 3.380 2.600 2.317 2.918 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2088 2 49 PHE H 2 49 PHE HD2 . . 4.060 4.061 3.993 4.129 0.069 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2089 2 49 PHE H 2 50 LYS H . . 5.000 4.334 4.312 4.385 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2090 2 49 PHE H 2 50 LYS HA . . 5.000 4.631 4.557 4.696 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2091 2 49 PHE HA 2 49 PHE HB2 . . 3.070 2.734 2.707 2.761 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2092 2 49 PHE HA 2 49 PHE HB3 . . 3.070 2.354 2.341 2.368 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2093 2 49 PHE HA 2 50 LYS H . . 2.900 2.785 2.703 2.819 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2094 2 49 PHE HA 2 50 LYS QG . . 6.880 3.808 3.132 4.754 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2095 2 49 PHE QB 2 50 LYS H . . 4.490 1.897 1.832 2.042 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2096 2 49 PHE HD1 2 50 LYS H . . 5.090 5.243 5.189 5.298 0.208 47 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2097 2 49 PHE HD2 2 50 LYS H . . 5.540 3.660 3.511 3.865 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2098 2 50 LYS H 2 50 LYS QB . . 3.500 3.052 2.364 3.157 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2099 2 50 LYS H 2 50 LYS QD . . 4.000 2.837 2.427 3.805 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2100 2 50 LYS H 2 50 LYS QE . . 4.600 3.922 2.390 4.240 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2101 2 50 LYS H 2 50 LYS QG . . 5.000 1.944 1.634 3.844 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2102 2 50 LYS H 2 51 PRO HD2 . . 5.540 4.195 4.096 4.305 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2103 2 50 LYS H 2 51 PRO QD . . 5.270 2.923 2.800 3.060 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2104 2 50 LYS H 2 51 PRO HD3 . . 5.540 2.983 2.851 3.131 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2105 2 50 LYS HA 2 50 LYS QG . . 3.710 3.250 1.984 3.384 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2106 2 50 LYS HA 2 53 GLN QB . . 5.880 3.619 3.138 3.873 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2107 2 50 LYS QG 2 53 GLN QE . . 7.750 5.958 3.886 6.354 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2108 2 51 PRO HA 2 52 LEU H . . 3.300 3.425 3.344 3.472 0.172 44 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2109 2 52 LEU H 2 52 LEU HA . . 2.900 2.920 2.906 2.932 0.032 22 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2110 2 52 LEU H 2 52 LEU QB . . 2.900 2.448 2.317 2.555 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2111 2 52 LEU H 2 52 LEU QD . . 4.000 2.612 1.629 3.170 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2112 2 52 LEU H 2 53 GLN H . . 3.500 2.994 2.654 3.135 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2113 2 52 LEU H 2 53 GLN QB . . 6.880 5.132 4.835 5.398 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2114 2 52 LEU H 2 53 GLN QG . . 5.880 3.920 3.651 4.135 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2115 2 52 LEU H 2 54 GLU H . . 5.000 4.870 4.647 5.018 0.018 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2116 2 52 LEU H 2 55 ALA H . . 6.000 5.720 5.417 5.838 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2117 2 52 LEU H 2 55 ALA MB . . 7.030 5.702 5.376 5.894 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2118 2 52 LEU HA 2 55 ALA MB . . 7.030 5.546 5.228 5.681 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2119 2 52 LEU QB 2 53 GLN H . . 5.880 4.106 4.064 4.116 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2120 2 52 LEU QB 2 54 GLU H . . 5.880 4.031 3.880 4.213 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2121 2 52 LEU QB 2 55 ALA H . . 6.880 4.444 4.274 4.650 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2122 2 52 LEU QD 2 53 GLN H . . 8.130 4.031 2.813 4.385 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2123 2 52 LEU QD 2 53 GLN HE21 . . 8.130 5.393 2.468 6.186 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2124 2 52 LEU QD 2 53 GLN HE22 . . 8.130 5.432 3.037 6.032 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2125 2 52 LEU QD 2 54 GLU H . . 6.130 3.925 3.434 4.478 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2126 2 52 LEU QD 2 55 ALA H . . 8.130 2.838 2.420 3.517 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2127 2 52 LEU O 2 55 ALA H . . 2.000 2.010 1.793 2.079 0.079 18 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2128 2 52 LEU O 2 55 ALA N . . 3.000 2.980 2.752 3.045 0.045 18 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2129 2 53 GLN H 2 53 GLN HB2 . . 3.500 2.595 2.435 3.428 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2130 2 53 GLN H 2 53 GLN HB3 . . 3.500 3.502 3.007 3.561 0.061 43 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2131 2 53 GLN H 2 53 GLN HE21 . . 6.000 3.941 1.846 4.723 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2132 2 53 GLN H 2 53 GLN HE22 . . 6.000 4.793 2.898 5.351 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2133 2 53 GLN H 2 53 GLN HG2 . . 3.500 2.145 1.879 3.191 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2134 2 53 GLN H 2 53 GLN HG3 . . 3.500 3.270 1.638 3.565 0.065 21 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2135 2 53 GLN H 2 54 GLU HA . . 6.000 5.155 5.070 5.271 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2136 2 53 GLN H 2 55 ALA H . . 5.000 4.496 4.363 4.567 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2137 2 53 GLN H 2 55 ALA MB . . 6.880 5.103 4.970 5.205 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2138 2 53 GLN QB 2 55 ALA H . . 5.450 4.345 4.283 4.399 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2139 2 53 GLN QB 2 57 CYS H . . 5.880 3.960 3.762 4.137 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2140 2 53 GLN HB2 2 55 ALA H . . 6.000 4.918 4.662 5.006 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2141 2 53 GLN HB2 2 58 THR H . . 6.000 4.650 3.714 4.889 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2142 2 53 GLN HB3 2 55 ALA H . . 6.000 4.850 4.738 5.235 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2143 2 53 GLN HB3 2 58 THR H . . 6.000 4.813 4.036 6.397 0.397 10 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2144 2 53 GLN QE 2 54 GLU H . . 6.870 4.722 1.791 5.435 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2145 2 53 GLN QE 2 55 ALA MB . . 7.900 4.292 3.919 5.304 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2146 2 53 GLN QE 2 56 GLU H . . 6.870 4.900 4.224 6.114 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2147 2 53 GLN QG 2 54 GLU H . . 4.880 4.225 3.722 4.317 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2148 2 53 GLN QG 2 55 ALA H . . 6.880 5.468 5.297 5.529 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2149 2 53 GLN QG 2 58 THR H . . 6.880 6.123 5.158 6.356 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2150 2 53 GLN O 2 57 CYS H . . 2.000 2.054 1.930 2.158 0.158 8 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2151 2 53 GLN O 2 57 CYS N . . 3.000 2.884 2.757 3.018 0.018 22 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2152 2 54 GLU H 2 54 GLU HA . . 2.900 2.654 2.606 2.712 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2153 2 54 GLU H 2 54 GLU HB2 . . 3.500 3.273 2.139 3.568 0.068 32 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2154 2 54 GLU H 2 54 GLU HB3 . . 3.500 2.590 2.096 3.574 0.074 17 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2155 2 54 GLU H 2 58 THR H . . 6.000 4.227 3.956 4.374 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2156 2 54 GLU QB 2 57 CYS H . . 5.880 4.684 4.499 4.899 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2157 2 54 GLU QB 2 59 PHE H . . 6.880 4.519 3.787 5.340 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2158 2 55 ALA H 2 55 ALA HA . . 2.900 2.634 2.600 2.672 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2159 2 55 ALA H 2 57 CYS H . . 6.000 3.774 3.631 3.888 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2160 2 55 ALA H 2 58 THR H . . 6.000 4.737 4.418 5.046 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2161 2 55 ALA H 2 58 THR HB . . 6.000 5.635 5.219 6.108 0.108 44 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2162 2 55 ALA H 2 58 THR MG . . 7.030 4.515 4.211 5.075 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2163 2 55 ALA MB 2 57 CYS H . . 6.030 3.710 3.468 3.848 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2164 2 55 ALA MB 2 57 CYS HA . . 7.030 5.743 5.597 5.891 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2165 2 55 ALA MB 2 58 THR H . . 6.990 5.364 5.146 5.744 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2166 2 55 ALA MB 2 59 PHE H . . 7.030 5.848 5.406 5.989 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2167 2 56 GLU H 2 57 CYS HA . . 5.000 4.256 4.152 4.531 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2168 2 56 GLU H 2 57 CYS QB . . 4.560 3.341 3.153 3.699 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2169 2 56 GLU H 2 58 THR H . . 5.000 4.403 4.022 4.919 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2170 2 57 CYS H 2 57 CYS HA . . 2.900 2.900 2.874 2.922 0.022 34 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2171 2 57 CYS H 2 57 CYS HB2 . . 3.500 2.349 2.119 2.698 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2172 2 57 CYS H 2 57 CYS HB3 . . 3.500 2.936 2.527 3.280 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2173 2 57 CYS H 2 58 THR H . . 3.380 2.472 2.209 2.917 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2174 2 57 CYS H 2 58 THR HA . . 5.000 4.985 4.811 5.199 0.199 25 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2175 2 57 CYS H 2 58 THR MG . . 6.000 3.725 3.283 4.184 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2176 2 57 CYS HA 2 58 THR HA . . 6.000 4.786 4.708 4.868 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2177 2 57 CYS HA 2 58 THR MG . . 7.030 5.280 5.023 5.614 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2178 2 57 CYS HA 2 59 PHE H . . 6.000 4.431 3.819 5.012 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2179 2 57 CYS HB2 2 58 THR H . . 3.490 3.218 2.615 3.472 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2180 2 57 CYS HB3 2 58 THR H . . 3.490 2.298 1.874 2.636 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2181 2 58 THR H 2 58 THR HB . . 3.490 2.230 2.028 2.400 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2182 2 58 THR H 2 59 PHE H . . 3.640 2.716 2.479 2.978 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2183 2 58 THR HA 2 59 PHE H . . 3.500 3.575 3.495 3.623 0.123 41 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2184 2 58 THR HB 2 59 PHE H . . 4.000 3.857 3.504 4.089 0.089 38 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2185 2 58 THR MG 2 59 PHE H . . 5.360 2.129 1.849 2.535 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2186 2 59 PHE H 2 59 PHE HA . . 2.430 2.681 2.603 2.866 0.436 38 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2187 2 59 PHE H 2 59 PHE HB2 . . 3.340 1.988 1.919 2.067 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2188 2 59 PHE H 2 59 PHE QB . . 2.980 1.972 1.906 2.050 . 0 0 "[ . 1 . 2 . 3 . 4 . ]" 1
2189 2 59 PHE H 2 59 PHE HB3 . . 3.340 3.308 3.102 3.406 0.066 24 0 "[ . 1 . 2 . 3 . 4 . ]" 1
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