Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
448494 | 2nwt RC | 7362 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2nwt
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 2022
_Distance_constraint_stats_list.Viol_count 4400
_Distance_constraint_stats_list.Viol_total 37983.953
_Distance_constraint_stats_list.Viol_max 12.517
_Distance_constraint_stats_list.Viol_rms 0.5400
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0470
_Distance_constraint_stats_list.Viol_average_violations_only 0.4316
_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 3 LYS 2.499 0.243 7 0 "[ . 1 . 2]"
1 4 ILE 16.486 0.411 7 0 "[ . 1 . 2]"
1 5 ILE 5.730 0.578 12 1 "[ . 1 + . 2]"
1 6 GLU 5.189 0.243 16 0 "[ . 1 . 2]"
1 7 ALA 14.413 1.590 10 4 "[ . * + - *. 2]"
1 8 VAL 4.845 0.272 15 0 "[ . 1 . 2]"
1 9 TYR 684.246 12.517 17 20 [***************-+***]
1 10 GLU 8.408 0.528 5 1 "[ + 1 . 2]"
1 11 ASN 9.342 0.454 17 0 "[ . 1 . 2]"
1 12 GLY 3.064 0.528 5 1 "[ + 1 . 2]"
1 13 VAL 33.914 2.102 15 9 "[ *** *1*** +- 2]"
1 14 PHE 7.720 0.203 8 0 "[ . 1 . 2]"
1 15 LYS 10.473 0.456 18 0 "[ . 1 . 2]"
1 16 PRO 13.626 1.895 7 5 "[ . +- * * *. 2]"
1 17 LEU 4.744 0.577 18 1 "[ . 1 . + 2]"
1 18 GLN 23.454 1.895 7 5 "[ . +- * * *. 2]"
1 19 LYS 6.836 0.449 18 0 "[ . 1 . 2]"
1 20 VAL 169.268 8.869 18 20 [***********-*****+**]
1 21 ASP 4.128 0.326 2 0 "[ . 1 . 2]"
1 22 LEU 16.274 1.505 2 4 "[ + . - 1 * * 2]"
1 23 LYS 8.732 0.567 15 1 "[ . 1 + 2]"
1 24 GLU 146.583 7.780 15 20 [*******-******+*****]
1 25 GLY 237.912 12.517 17 20 [-***************+***]
1 26 GLU 157.033 7.790 15 20 [**************+****-]
1 27 ARG 8.735 0.476 9 0 "[ . 1 . 2]"
1 28 VAL 8.207 0.476 9 0 "[ . 1 . 2]"
1 29 LYS 12.940 0.247 9 0 "[ . 1 . 2]"
1 30 ILE 13.528 0.345 5 0 "[ . 1 . 2]"
1 31 LYS 15.831 0.467 13 0 "[ . 1 . 2]"
1 32 LEU 11.540 0.345 13 0 "[ . 1 . 2]"
1 33 GLU 8.677 0.459 19 0 "[ . 1 . 2]"
1 34 LEU 9.734 0.459 19 0 "[ . 1 . 2]"
1 35 LYS 6.901 0.325 11 0 "[ . 1 . 2]"
1 36 VAL 4.486 0.486 11 0 "[ . 1 . 2]"
1 37 GLU 7.826 0.487 18 0 "[ . 1 . 2]"
1 38 PRO 0.851 0.141 13 0 "[ . 1 . 2]"
1 39 ILE 3.961 0.253 19 0 "[ . 1 . 2]"
1 40 ASP 1.800 0.285 15 0 "[ . 1 . 2]"
1 41 LEU 0.026 0.026 17 0 "[ . 1 . 2]"
1 42 GLY 3.510 0.438 16 0 "[ . 1 . 2]"
1 43 GLU 6.461 0.438 16 0 "[ . 1 . 2]"
1 44 PRO 0.069 0.045 20 0 "[ . 1 . 2]"
1 45 VAL 3.769 0.330 15 0 "[ . 1 . 2]"
1 46 SER 7.532 0.330 15 0 "[ . 1 . 2]"
1 47 VAL 3.376 0.389 7 0 "[ . 1 . 2]"
1 48 GLU 4.595 0.280 15 0 "[ . 1 . 2]"
1 49 GLU 4.902 0.253 20 0 "[ . 1 . 2]"
1 50 ILE 4.054 0.182 12 0 "[ . 1 . 2]"
1 51 LYS 4.767 0.403 17 0 "[ . 1 . 2]"
1 52 LYS 8.629 0.959 14 3 "[* . 1 +- 2]"
1 53 ILE 5.467 0.372 15 0 "[ . 1 . 2]"
1 54 ARG 0.799 0.175 1 0 "[ . 1 . 2]"
1 55 ASP 1.732 0.162 14 0 "[ . 1 . 2]"
1 56 GLY 1.732 0.162 14 0 "[ . 1 . 2]"
1 57 THR 2.063 0.210 5 0 "[ . 1 . 2]"
1 58 TRP 2.926 0.366 12 0 "[ . 1 . 2]"
1 59 MET 0.355 0.081 14 0 "[ . 1 . 2]"
1 60 SER 2.610 0.283 6 0 "[ . 1 . 2]"
1 61 SER 1.948 0.216 4 0 "[ . 1 . 2]"
1 62 LEU 4.603 0.304 2 0 "[ . 1 . 2]"
1 63 GLU 1.090 0.205 13 0 "[ . 1 . 2]"
1 64 HIS 0.279 0.128 6 0 "[ . 1 . 2]"
1 65 HIS 0.151 0.128 6 0 "[ . 1 . 2]"
1 66 HIS 0.991 0.401 14 0 "[ . 1 . 2]"
1 67 HIS 0.665 0.401 14 0 "[ . 1 . 2]"
2 3 LYS 2.549 0.293 17 0 "[ . 1 . 2]"
2 4 ILE 17.578 0.428 1 0 "[ . 1 . 2]"
2 5 ILE 7.141 0.683 3 3 "[ + - * . 2]"
2 6 GLU 6.756 0.226 8 0 "[ . 1 . 2]"
2 7 ALA 16.040 1.927 1 4 "[+ . - * . *2]"
2 8 VAL 5.201 0.270 8 0 "[ . 1 . 2]"
2 9 TYR 692.684 12.463 13 20 [************+****-**]
2 10 GLU 9.780 0.552 3 1 "[ + . 1 . 2]"
2 11 ASN 12.024 0.626 19 1 "[ . 1 . +2]"
2 12 GLY 4.536 0.552 3 1 "[ + . 1 . 2]"
2 13 VAL 37.508 2.102 16 9 "[** .* **1 *.+ *-2]"
2 14 PHE 7.675 0.234 17 0 "[ . 1 . 2]"
2 15 LYS 9.351 0.456 15 0 "[ . 1 . 2]"
2 16 PRO 13.458 1.942 10 4 "[* . - + . *2]"
2 17 LEU 4.451 0.305 10 0 "[ . 1 . 2]"
2 18 GLN 26.753 1.942 10 4 "[* . - + . *2]"
2 19 LYS 8.542 0.420 8 0 "[ . 1 . 2]"
2 20 VAL 159.161 8.753 16 20 [*******-*******+****]
2 21 ASP 3.140 0.336 9 0 "[ . 1 . 2]"
2 22 LEU 9.457 1.378 12 1 "[ . 1 + . 2]"
2 23 LYS 6.461 0.493 2 0 "[ . 1 . 2]"
2 24 GLU 153.594 8.740 14 20 [-************+******]
2 25 GLY 236.784 12.463 13 20 [*-**********+*******]
2 26 GLU 154.123 8.026 9 20 [********+********-**]
2 27 ARG 10.907 0.577 18 1 "[ . 1 . + 2]"
2 28 VAL 7.981 0.431 14 0 "[ . 1 . 2]"
2 29 LYS 13.974 0.475 12 0 "[ . 1 . 2]"
2 30 ILE 13.515 0.475 12 0 "[ . 1 . 2]"
2 31 LYS 14.361 0.434 9 0 "[ . 1 . 2]"
2 32 LEU 10.896 0.692 17 1 "[ . 1 . + 2]"
2 33 GLU 8.881 0.383 11 0 "[ . 1 . 2]"
2 34 LEU 8.538 0.372 3 0 "[ . 1 . 2]"
2 35 LYS 7.534 0.326 18 0 "[ . 1 . 2]"
2 36 VAL 5.887 0.653 18 1 "[ . 1 . + 2]"
2 37 GLU 6.801 0.295 20 0 "[ . 1 . 2]"
2 38 PRO 1.289 0.189 11 0 "[ . 1 . 2]"
2 39 ILE 4.987 0.274 2 0 "[ . 1 . 2]"
2 40 ASP 1.544 0.295 12 0 "[ . 1 . 2]"
2 41 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 42 GLY 3.632 0.350 1 0 "[ . 1 . 2]"
2 43 GLU 6.641 0.350 1 0 "[ . 1 . 2]"
2 44 PRO 0.047 0.046 10 0 "[ . 1 . 2]"
2 45 VAL 3.338 0.328 10 0 "[ . 1 . 2]"
2 46 SER 6.873 0.328 10 0 "[ . 1 . 2]"
2 47 VAL 2.773 0.428 12 0 "[ . 1 . 2]"
2 48 GLU 3.288 0.248 6 0 "[ . 1 . 2]"
2 49 GLU 4.498 0.248 6 0 "[ . 1 . 2]"
2 50 ILE 4.202 0.186 18 0 "[ . 1 . 2]"
2 51 LYS 4.115 0.368 5 0 "[ . 1 . 2]"
2 52 LYS 4.986 0.370 9 0 "[ . 1 . 2]"
2 53 ILE 5.822 0.415 17 0 "[ . 1 . 2]"
2 54 ARG 1.831 0.366 14 0 "[ . 1 . 2]"
2 55 ASP 0.970 0.160 16 0 "[ . 1 . 2]"
2 56 GLY 0.970 0.160 16 0 "[ . 1 . 2]"
2 57 THR 1.814 0.243 11 0 "[ . 1 . 2]"
2 58 TRP 3.757 0.382 10 0 "[ . 1 . 2]"
2 59 MET 0.520 0.077 12 0 "[ . 1 . 2]"
2 60 SER 1.514 0.284 5 0 "[ . 1 . 2]"
2 61 SER 1.518 0.223 16 0 "[ . 1 . 2]"
2 62 LEU 4.836 0.303 19 0 "[ . 1 . 2]"
2 63 GLU 0.500 0.129 15 0 "[ . 1 . 2]"
2 64 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
2 65 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
2 66 HIS 0.340 0.044 7 0 "[ . 1 . 2]"
2 67 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 3 LYS HA 1 3 LYS HD2 . . 5.500 4.572 3.180 5.493 . 0 0 "[ . 1 . 2]" 1
2 1 3 LYS HA 1 3 LYS QD . . 4.980 3.975 3.073 4.480 . 0 0 "[ . 1 . 2]" 1
3 1 3 LYS HA 1 3 LYS HD3 . . 5.500 4.468 3.463 5.526 0.026 15 0 "[ . 1 . 2]" 1
4 1 3 LYS HA 1 3 LYS QG . . 3.920 2.650 2.087 3.357 . 0 0 "[ . 1 . 2]" 1
5 1 3 LYS HA 1 4 ILE H . . 3.020 2.319 2.208 2.499 . 0 0 "[ . 1 . 2]" 1
6 1 3 LYS HB2 1 4 ILE H . . 3.890 3.569 2.256 4.084 0.194 2 0 "[ . 1 . 2]" 1
7 1 3 LYS HB3 1 4 ILE H . . 3.890 3.387 2.383 3.945 0.055 19 0 "[ . 1 . 2]" 1
8 1 3 LYS QD 1 4 ILE H . . 4.550 4.210 2.411 4.793 0.243 7 0 "[ . 1 . 2]" 1
9 1 3 LYS QG 1 4 ILE H . . 4.340 3.101 1.932 4.370 0.030 18 0 "[ . 1 . 2]" 1
10 1 3 LYS HG2 1 4 ILE H . . 4.910 3.502 1.965 4.951 0.041 7 0 "[ . 1 . 2]" 1
11 1 3 LYS HG3 1 4 ILE H . . 4.910 3.805 2.594 4.965 0.055 11 0 "[ . 1 . 2]" 1
12 1 4 ILE H 1 4 ILE HB . . 3.450 3.546 2.459 3.782 0.332 7 0 "[ . 1 . 2]" 1
13 1 4 ILE H 1 4 ILE MD . . 5.440 1.731 1.663 2.097 . 0 0 "[ . 1 . 2]" 1
14 1 4 ILE H 1 4 ILE HG12 . . 3.580 2.940 2.234 3.899 0.319 2 0 "[ . 1 . 2]" 1
15 1 4 ILE H 1 4 ILE QG . . 3.390 2.786 2.217 3.176 . 0 0 "[ . 1 . 2]" 1
16 1 4 ILE H 1 4 ILE HG13 . . 3.580 3.722 3.302 3.991 0.411 7 0 "[ . 1 . 2]" 1
17 1 4 ILE H 1 5 ILE H . . 5.500 4.433 4.263 4.557 . 0 0 "[ . 1 . 2]" 1
18 1 4 ILE HA 1 4 ILE HG12 . . 4.140 3.633 3.555 3.692 . 0 0 "[ . 1 . 2]" 1
19 1 4 ILE HA 1 4 ILE QG . . 3.940 3.324 2.284 3.476 . 0 0 "[ . 1 . 2]" 1
20 1 4 ILE HA 1 4 ILE HG13 . . 4.140 4.034 2.312 4.240 0.100 16 0 "[ . 1 . 2]" 1
21 1 4 ILE HA 1 5 ILE H . . 3.050 2.167 2.020 2.250 . 0 0 "[ . 1 . 2]" 1
22 1 4 ILE HB 1 5 ILE H . . 3.890 3.111 2.821 4.145 0.255 2 0 "[ . 1 . 2]" 1
23 1 4 ILE MD 1 5 ILE H . . 6.530 4.820 4.518 5.048 . 0 0 "[ . 1 . 2]" 1
24 1 4 ILE MD 2 29 LYS QE . . 7.400 4.298 2.810 6.790 . 0 0 "[ . 1 . 2]" 1
25 1 4 ILE MD 2 31 LYS HB2 . . 6.530 5.701 4.256 6.828 0.298 15 0 "[ . 1 . 2]" 1
26 1 4 ILE MD 2 31 LYS QB . . 6.220 4.954 3.304 5.792 . 0 0 "[ . 1 . 2]" 1
27 1 4 ILE MD 2 31 LYS HB3 . . 6.530 5.769 3.443 6.609 0.079 16 0 "[ . 1 . 2]" 1
28 1 4 ILE MD 2 31 LYS QE . . 7.400 4.793 2.873 7.137 . 0 0 "[ . 1 . 2]" 1
29 1 4 ILE QG 2 29 LYS QG . . 7.250 3.588 2.486 4.859 . 0 0 "[ . 1 . 2]" 1
30 1 4 ILE QG 2 31 LYS QE . . 7.260 5.307 3.374 6.779 . 0 0 "[ . 1 . 2]" 1
31 1 4 ILE HG12 1 5 ILE H . . 5.100 4.214 3.717 5.114 0.014 2 0 "[ . 1 . 2]" 1
32 1 4 ILE HG12 2 29 LYS HA . . 5.500 5.575 5.503 5.691 0.191 11 0 "[ . 1 . 2]" 1
33 1 4 ILE HG13 1 5 ILE H . . 5.100 4.869 4.012 5.200 0.100 12 0 "[ . 1 . 2]" 1
34 1 4 ILE HG13 2 29 LYS HA . . 5.500 5.342 4.540 5.679 0.179 17 0 "[ . 1 . 2]" 1
35 1 4 ILE MG 1 5 ILE H . . 4.880 3.726 2.442 4.091 . 0 0 "[ . 1 . 2]" 1
36 1 4 ILE MG 1 6 GLU HG2 . . 6.530 6.112 3.105 6.773 0.243 16 0 "[ . 1 . 2]" 1
37 1 4 ILE MG 1 6 GLU HG3 . . 6.530 5.706 2.736 6.584 0.054 12 0 "[ . 1 . 2]" 1
38 1 4 ILE MG 2 29 LYS HA . . 6.530 5.045 2.892 6.382 . 0 0 "[ . 1 . 2]" 1
39 1 4 ILE MG 2 29 LYS HB2 . . 5.780 4.325 3.146 5.522 . 0 0 "[ . 1 . 2]" 1
40 1 4 ILE MG 2 29 LYS HB3 . . 5.780 3.285 1.911 4.454 . 0 0 "[ . 1 . 2]" 1
41 1 4 ILE MG 2 29 LYS QD . . 5.890 3.436 1.873 5.303 . 0 0 "[ . 1 . 2]" 1
42 1 4 ILE MG 2 29 LYS QE . . 6.910 4.375 3.359 5.983 . 0 0 "[ . 1 . 2]" 1
43 1 4 ILE MG 2 29 LYS HG2 . . 6.530 4.832 3.072 6.386 . 0 0 "[ . 1 . 2]" 1
44 1 4 ILE MG 2 29 LYS QG . . 5.850 4.345 2.863 5.283 . 0 0 "[ . 1 . 2]" 1
45 1 4 ILE MG 2 29 LYS HG3 . . 6.530 5.125 2.945 6.538 0.008 9 0 "[ . 1 . 2]" 1
46 1 4 ILE MG 2 30 ILE H . . 5.260 4.230 2.222 5.211 . 0 0 "[ . 1 . 2]" 1
47 1 4 ILE MG 2 30 ILE HA . . 6.530 5.125 4.088 6.118 . 0 0 "[ . 1 . 2]" 1
48 1 4 ILE MG 2 31 LYS QB . . 5.390 2.746 1.752 5.118 . 0 0 "[ . 1 . 2]" 1
49 1 5 ILE H 1 5 ILE HB . . 2.990 2.846 2.608 3.568 0.578 12 1 "[ . 1 + . 2]" 1
50 1 5 ILE H 1 5 ILE MD . . 5.570 3.607 3.136 4.029 . 0 0 "[ . 1 . 2]" 1
51 1 5 ILE H 1 5 ILE HG12 . . 3.830 2.955 1.789 3.765 . 0 0 "[ . 1 . 2]" 1
52 1 5 ILE H 1 5 ILE QG . . 3.600 2.168 1.742 2.602 . 0 0 "[ . 1 . 2]" 1
53 1 5 ILE H 1 5 ILE HG13 . . 3.830 2.639 1.885 3.848 0.018 14 0 "[ . 1 . 2]" 1
54 1 5 ILE H 1 6 GLU H . . 5.500 4.503 4.355 4.596 . 0 0 "[ . 1 . 2]" 1
55 1 5 ILE H 2 30 ILE QG . . 6.380 3.917 2.777 5.113 . 0 0 "[ . 1 . 2]" 1
56 1 5 ILE HA 1 5 ILE QG . . 3.880 2.812 2.490 3.301 . 0 0 "[ . 1 . 2]" 1
57 1 5 ILE HA 1 6 GLU H . . 3.110 2.335 2.215 2.543 . 0 0 "[ . 1 . 2]" 1
58 1 5 ILE HA 1 18 GLN QE . . 6.370 3.113 1.879 6.449 0.079 12 0 "[ . 1 . 2]" 1
59 1 5 ILE HB 1 6 GLU H . . 3.520 3.482 2.596 3.686 0.166 11 0 "[ . 1 . 2]" 1
60 1 5 ILE HB 1 18 GLN HE21 . . 5.500 5.034 4.145 5.708 0.208 3 0 "[ . 1 . 2]" 1
61 1 5 ILE HB 1 18 GLN HE22 . . 5.500 5.414 4.799 5.644 0.144 12 0 "[ . 1 . 2]" 1
62 1 5 ILE HB 1 18 GLN QG . . 6.040 5.296 3.955 6.106 0.066 20 0 "[ . 1 . 2]" 1
63 1 5 ILE HB 2 30 ILE HB . . 4.450 2.820 1.822 4.259 . 0 0 "[ . 1 . 2]" 1
64 1 5 ILE HB 2 30 ILE MD . . 6.370 3.654 1.759 6.228 . 0 0 "[ . 1 . 2]" 1
65 1 5 ILE HB 2 30 ILE HG12 . . 5.220 3.830 2.475 5.246 0.026 1 0 "[ . 1 . 2]" 1
66 1 5 ILE HB 2 30 ILE QG . . 4.860 3.059 1.846 4.678 . 0 0 "[ . 1 . 2]" 1
67 1 5 ILE HB 2 30 ILE HG13 . . 5.220 3.344 1.852 5.259 0.039 12 0 "[ . 1 . 2]" 1
68 1 5 ILE HB 2 30 ILE MG . . 5.940 4.120 3.326 5.288 . 0 0 "[ . 1 . 2]" 1
69 1 5 ILE MD 1 6 GLU H . . 5.940 4.607 3.790 5.056 . 0 0 "[ . 1 . 2]" 1
70 1 5 ILE MD 1 17 LEU H . . 6.370 5.951 4.746 6.489 0.119 9 0 "[ . 1 . 2]" 1
71 1 5 ILE MD 1 18 GLN H . . 6.530 5.698 4.900 6.669 0.139 7 0 "[ . 1 . 2]" 1
72 1 5 ILE MD 1 18 GLN QB . . 7.130 4.719 2.682 6.887 . 0 0 "[ . 1 . 2]" 1
73 1 5 ILE MD 1 18 GLN QE . . 7.400 4.015 1.888 5.438 . 0 0 "[ . 1 . 2]" 1
74 1 5 ILE MD 1 18 GLN QG . . 6.530 4.642 2.715 5.786 . 0 0 "[ . 1 . 2]" 1
75 1 5 ILE MD 2 14 PHE QD . . 8.650 5.564 4.182 7.620 . 0 0 "[ . 1 . 2]" 1
76 1 5 ILE MD 2 14 PHE QE . . 8.250 3.909 2.719 5.901 . 0 0 "[ . 1 . 2]" 1
77 1 5 ILE MD 2 14 PHE HZ . . 5.850 3.324 1.700 5.853 0.003 14 0 "[ . 1 . 2]" 1
78 1 5 ILE MD 2 30 ILE HB . . 5.540 3.557 2.023 5.189 . 0 0 "[ . 1 . 2]" 1
79 1 5 ILE MD 2 30 ILE MD . . 7.560 4.415 2.376 6.628 . 0 0 "[ . 1 . 2]" 1
80 1 5 ILE MD 2 30 ILE QG . . 7.130 4.256 2.870 6.191 . 0 0 "[ . 1 . 2]" 1
81 1 5 ILE MD 2 30 ILE MG . . 7.560 3.960 2.302 5.668 . 0 0 "[ . 1 . 2]" 1
82 1 5 ILE QG 2 30 ILE QG . . 6.320 4.172 2.686 5.294 . 0 0 "[ . 1 . 2]" 1
83 1 5 ILE HG12 1 6 GLU H . . 5.500 4.775 4.365 5.210 . 0 0 "[ . 1 . 2]" 1
84 1 5 ILE HG12 2 30 ILE MD . . 6.530 5.605 4.266 6.655 0.125 10 0 "[ . 1 . 2]" 1
85 1 5 ILE HG12 2 30 ILE HG12 . . 7.250 6.117 3.948 7.321 0.071 7 0 "[ . 1 . 2]" 1
86 1 5 ILE HG12 2 30 ILE HG13 . . 7.250 5.644 4.073 6.339 . 0 0 "[ . 1 . 2]" 1
87 1 5 ILE HG12 2 30 ILE MG . . 6.530 5.197 3.923 6.564 0.034 10 0 "[ . 1 . 2]" 1
88 1 5 ILE HG13 1 6 GLU H . . 5.500 5.011 4.113 5.323 . 0 0 "[ . 1 . 2]" 1
89 1 5 ILE HG13 2 30 ILE MD . . 6.530 4.908 3.271 6.414 . 0 0 "[ . 1 . 2]" 1
90 1 5 ILE HG13 2 30 ILE HG12 . . 7.250 5.333 3.022 7.295 0.045 14 0 "[ . 1 . 2]" 1
91 1 5 ILE HG13 2 30 ILE HG13 . . 7.250 4.868 3.078 6.345 . 0 0 "[ . 1 . 2]" 1
92 1 5 ILE HG13 2 30 ILE MG . . 6.530 4.361 3.237 5.264 . 0 0 "[ . 1 . 2]" 1
93 1 5 ILE MG 1 6 GLU H . . 4.670 2.236 1.760 3.584 . 0 0 "[ . 1 . 2]" 1
94 1 5 ILE MG 1 18 GLN H . . 6.530 3.644 2.520 5.820 . 0 0 "[ . 1 . 2]" 1
95 1 5 ILE MG 1 18 GLN QB . . 7.410 3.200 1.727 6.004 . 0 0 "[ . 1 . 2]" 1
96 1 5 ILE MG 1 18 GLN QE . . 7.400 2.653 1.856 4.163 . 0 0 "[ . 1 . 2]" 1
97 1 5 ILE MG 1 18 GLN QG . . 6.530 2.954 1.846 4.648 . 0 0 "[ . 1 . 2]" 1
98 1 5 ILE MG 2 14 PHE QE . . 8.650 3.938 2.209 6.569 . 0 0 "[ . 1 . 2]" 1
99 1 6 GLU H 1 6 GLU HB2 . . 3.580 2.517 2.425 2.618 . 0 0 "[ . 1 . 2]" 1
100 1 6 GLU H 1 6 GLU HB3 . . 3.580 3.681 3.632 3.745 0.165 13 0 "[ . 1 . 2]" 1
101 1 6 GLU H 1 6 GLU HG2 . . 4.940 3.999 3.652 4.327 . 0 0 "[ . 1 . 2]" 1
102 1 6 GLU H 1 6 GLU QG . . 4.660 2.987 2.404 3.681 . 0 0 "[ . 1 . 2]" 1
103 1 6 GLU H 1 6 GLU HG3 . . 4.940 3.098 2.438 3.997 . 0 0 "[ . 1 . 2]" 1
104 1 6 GLU H 1 7 ALA H . . 5.500 4.407 4.115 4.530 . 0 0 "[ . 1 . 2]" 1
105 1 6 GLU H 1 17 LEU QB . . 6.380 4.054 3.157 4.673 . 0 0 "[ . 1 . 2]" 1
106 1 6 GLU H 1 17 LEU QD . . 6.120 4.494 3.460 5.082 . 0 0 "[ . 1 . 2]" 1
107 1 6 GLU H 1 18 GLN QG . . 5.500 3.520 2.465 5.557 0.057 18 0 "[ . 1 . 2]" 1
108 1 6 GLU HA 1 7 ALA H . . 3.050 2.188 2.091 2.389 . 0 0 "[ . 1 . 2]" 1
109 1 6 GLU QB 1 7 ALA H . . 3.980 3.001 2.561 3.486 . 0 0 "[ . 1 . 2]" 1
110 1 6 GLU QB 1 17 LEU QB . . 4.990 2.839 1.743 3.665 . 0 0 "[ . 1 . 2]" 1
111 1 6 GLU QB 2 29 LYS QG . . 5.910 4.017 3.077 5.313 . 0 0 "[ . 1 . 2]" 1
112 1 6 GLU HB2 1 7 ALA H . . 4.230 4.086 3.655 4.308 0.078 18 0 "[ . 1 . 2]" 1
113 1 6 GLU HB2 1 17 LEU HB2 . . 5.980 2.982 1.787 3.935 . 0 0 "[ . 1 . 2]" 1
114 1 6 GLU HB2 1 17 LEU HB3 . . 5.980 4.488 3.071 5.092 . 0 0 "[ . 1 . 2]" 1
115 1 6 GLU HB2 1 17 LEU QD . . 4.880 2.667 1.879 3.337 . 0 0 "[ . 1 . 2]" 1
116 1 6 GLU HB2 2 29 LYS HG2 . . 7.250 5.338 4.269 7.230 . 0 0 "[ . 1 . 2]" 1
117 1 6 GLU HB2 2 29 LYS HG3 . . 7.250 6.316 5.113 7.454 0.204 2 0 "[ . 1 . 2]" 1
118 1 6 GLU HB3 1 7 ALA H . . 4.230 3.093 2.607 3.694 . 0 0 "[ . 1 . 2]" 1
119 1 6 GLU HB3 1 17 LEU HB2 . . 5.980 3.946 2.573 5.070 . 0 0 "[ . 1 . 2]" 1
120 1 6 GLU HB3 1 17 LEU HB3 . . 5.980 5.283 3.886 6.002 0.022 12 0 "[ . 1 . 2]" 1
121 1 6 GLU HB3 1 17 LEU QD . . 4.880 2.594 2.001 3.336 . 0 0 "[ . 1 . 2]" 1
122 1 6 GLU HB3 2 29 LYS HG2 . . 7.250 4.533 3.441 6.501 . 0 0 "[ . 1 . 2]" 1
123 1 6 GLU HB3 2 29 LYS HG3 . . 7.250 5.271 3.759 6.696 . 0 0 "[ . 1 . 2]" 1
124 1 6 GLU QG 1 7 ALA H . . 5.210 4.015 3.739 4.412 . 0 0 "[ . 1 . 2]" 1
125 1 6 GLU QG 2 29 LYS QD . . 7.250 3.001 1.801 4.115 . 0 0 "[ . 1 . 2]" 1
126 1 6 GLU QG 2 29 LYS QG . . 5.180 2.451 1.757 3.861 . 0 0 "[ . 1 . 2]" 1
127 1 6 GLU HG2 1 7 ALA H . . 5.340 4.482 3.966 5.358 0.018 18 0 "[ . 1 . 2]" 1
128 1 6 GLU HG2 1 17 LEU QD . . 5.810 4.305 3.272 5.270 . 0 0 "[ . 1 . 2]" 1
129 1 6 GLU HG2 2 29 LYS QE . . 6.380 3.360 1.932 5.086 . 0 0 "[ . 1 . 2]" 1
130 1 6 GLU HG2 2 29 LYS HG2 . . 6.380 3.064 1.787 5.037 . 0 0 "[ . 1 . 2]" 1
131 1 6 GLU HG2 2 29 LYS HG3 . . 6.380 3.894 2.665 5.847 . 0 0 "[ . 1 . 2]" 1
132 1 6 GLU HG3 1 7 ALA H . . 5.340 4.770 3.878 5.207 . 0 0 "[ . 1 . 2]" 1
133 1 6 GLU HG3 1 17 LEU QD . . 5.810 4.556 3.785 5.260 . 0 0 "[ . 1 . 2]" 1
134 1 6 GLU HG3 2 29 LYS QE . . 6.380 3.795 2.143 5.440 . 0 0 "[ . 1 . 2]" 1
135 1 6 GLU HG3 2 29 LYS HG2 . . 6.380 3.543 1.788 5.960 . 0 0 "[ . 1 . 2]" 1
136 1 6 GLU HG3 2 29 LYS HG3 . . 6.380 4.553 2.712 6.055 . 0 0 "[ . 1 . 2]" 1
137 1 7 ALA H 1 8 VAL H . . 5.500 4.396 4.273 4.488 . 0 0 "[ . 1 . 2]" 1
138 1 7 ALA H 1 16 PRO QD . . 6.380 6.453 6.145 6.593 0.213 14 0 "[ . 1 . 2]" 1
139 1 7 ALA H 1 17 LEU QD . . 5.810 4.113 3.139 5.144 . 0 0 "[ . 1 . 2]" 1
140 1 7 ALA H 2 28 VAL MG2 . . 5.750 2.847 2.345 3.379 . 0 0 "[ . 1 . 2]" 1
141 1 7 ALA H 2 30 ILE MD . . 6.530 3.752 3.089 4.492 . 0 0 "[ . 1 . 2]" 1
142 1 7 ALA HA 1 8 VAL H . . 3.020 2.355 2.226 2.455 . 0 0 "[ . 1 . 2]" 1
143 1 7 ALA HA 1 15 LYS HB2 . . 5.500 5.294 5.001 5.581 0.081 17 0 "[ . 1 . 2]" 1
144 1 7 ALA HA 1 15 LYS HB3 . . 5.500 5.551 5.242 5.641 0.141 1 0 "[ . 1 . 2]" 1
145 1 7 ALA HA 1 15 LYS QG . . 6.380 6.456 6.251 6.542 0.162 20 0 "[ . 1 . 2]" 1
146 1 7 ALA HA 1 16 PRO HA . . 3.390 1.797 1.403 2.182 . 0 0 "[ . 1 . 2]" 1
147 1 7 ALA HA 1 16 PRO QB . . 5.350 3.673 3.075 3.987 . 0 0 "[ . 1 . 2]" 1
148 1 7 ALA HA 1 17 LEU H . . 3.670 2.696 2.404 3.039 . 0 0 "[ . 1 . 2]" 1
149 1 7 ALA HA 1 17 LEU QB . . 6.380 4.134 3.435 5.036 . 0 0 "[ . 1 . 2]" 1
150 1 7 ALA HA 1 17 LEU QD . . 5.750 3.374 1.882 4.272 . 0 0 "[ . 1 . 2]" 1
151 1 7 ALA HA 1 17 LEU HG . . 4.260 2.776 2.252 4.321 0.061 15 0 "[ . 1 . 2]" 1
152 1 7 ALA HA 1 18 GLN H . . 4.290 4.752 4.369 5.880 1.590 10 4 "[ . * + - *. 2]" 1
153 1 7 ALA MB 1 8 VAL HA . . 5.720 3.967 3.898 4.123 . 0 0 "[ . 1 . 2]" 1
154 1 7 ALA MB 1 14 PHE H . . 6.530 5.397 5.104 5.697 . 0 0 "[ . 1 . 2]" 1
155 1 7 ALA MB 1 14 PHE HA . . 6.530 3.652 3.363 3.947 . 0 0 "[ . 1 . 2]" 1
156 1 7 ALA MB 1 14 PHE HB2 . . 5.540 4.042 3.616 4.464 . 0 0 "[ . 1 . 2]" 1
157 1 7 ALA MB 1 14 PHE QB . . 5.250 2.637 2.216 2.985 . 0 0 "[ . 1 . 2]" 1
158 1 7 ALA MB 1 14 PHE HB3 . . 5.540 2.673 2.236 3.032 . 0 0 "[ . 1 . 2]" 1
159 1 7 ALA MB 1 14 PHE QD . . 8.650 3.066 2.669 3.741 . 0 0 "[ . 1 . 2]" 1
160 1 7 ALA MB 1 15 LYS H . . 5.470 3.115 2.890 3.366 . 0 0 "[ . 1 . 2]" 1
161 1 7 ALA MB 1 16 PRO HA . . 4.950 2.022 1.917 2.511 . 0 0 "[ . 1 . 2]" 1
162 1 7 ALA MB 1 16 PRO QB . . 6.390 2.947 2.539 3.656 . 0 0 "[ . 1 . 2]" 1
163 1 7 ALA MB 1 16 PRO QD . . 7.410 3.112 3.006 3.373 . 0 0 "[ . 1 . 2]" 1
164 1 7 ALA MB 1 16 PRO HG2 . . 6.530 4.668 4.316 4.862 . 0 0 "[ . 1 . 2]" 1
165 1 7 ALA MB 1 16 PRO QG . . 6.150 3.756 2.950 4.072 . 0 0 "[ . 1 . 2]" 1
166 1 7 ALA MB 1 16 PRO HG3 . . 6.530 3.992 3.004 4.385 . 0 0 "[ . 1 . 2]" 1
167 1 7 ALA MB 1 17 LEU H . . 5.260 3.674 3.383 4.233 . 0 0 "[ . 1 . 2]" 1
168 1 7 ALA MB 2 14 PHE QE . . 8.060 3.490 2.512 5.085 . 0 0 "[ . 1 . 2]" 1
169 1 7 ALA MB 2 28 VAL H . . 5.850 4.224 3.912 4.500 . 0 0 "[ . 1 . 2]" 1
170 1 7 ALA MB 2 28 VAL MG2 . . 7.280 2.290 2.032 2.720 . 0 0 "[ . 1 . 2]" 1
171 1 7 ALA MB 2 30 ILE MD . . 7.250 2.003 1.772 2.698 . 0 0 "[ . 1 . 2]" 1
172 1 7 ALA MB 2 30 ILE QG . . 6.510 2.741 2.254 3.407 . 0 0 "[ . 1 . 2]" 1
173 1 7 ALA MB 2 30 ILE MG . . 7.560 4.268 3.595 4.880 . 0 0 "[ . 1 . 2]" 1
174 1 8 VAL H 1 8 VAL HB . . 3.450 3.550 2.780 3.722 0.272 15 0 "[ . 1 . 2]" 1
175 1 8 VAL H 1 9 TYR H . . 5.500 4.230 4.102 4.370 . 0 0 "[ . 1 . 2]" 1
176 1 8 VAL H 1 15 LYS H . . 3.210 3.062 2.913 3.249 0.039 13 0 "[ . 1 . 2]" 1
177 1 8 VAL H 1 15 LYS HB2 . . 4.600 3.515 3.171 3.865 . 0 0 "[ . 1 . 2]" 1
178 1 8 VAL H 1 15 LYS QB . . 4.250 3.375 3.099 3.619 . 0 0 "[ . 1 . 2]" 1
179 1 8 VAL H 1 15 LYS HB3 . . 4.600 4.396 4.221 4.556 . 0 0 "[ . 1 . 2]" 1
180 1 8 VAL H 1 16 PRO HA . . 3.670 3.474 3.026 3.801 0.131 14 0 "[ . 1 . 2]" 1
181 1 8 VAL H 2 28 VAL MG2 . . 6.530 4.230 3.833 4.918 . 0 0 "[ . 1 . 2]" 1
182 1 8 VAL HA 1 9 TYR H . . 2.710 2.111 2.073 2.153 . 0 0 "[ . 1 . 2]" 1
183 1 8 VAL HA 2 28 VAL MG1 . . 6.030 4.313 3.798 4.873 . 0 0 "[ . 1 . 2]" 1
184 1 8 VAL HA 2 28 VAL MG2 . . 6.120 3.202 2.572 3.839 . 0 0 "[ . 1 . 2]" 1
185 1 8 VAL HB 1 9 TYR H . . 3.580 3.509 3.261 3.836 0.256 10 0 "[ . 1 . 2]" 1
186 1 8 VAL HB 1 15 LYS H . . 5.410 4.773 4.072 5.029 . 0 0 "[ . 1 . 2]" 1
187 1 8 VAL HB 2 27 ARG QD . . 6.220 5.382 3.846 6.363 0.143 12 0 "[ . 1 . 2]" 1
188 1 8 VAL QG 1 9 TYR H . . 5.050 3.385 2.362 3.592 . 0 0 "[ . 1 . 2]" 1
189 1 8 VAL QG 1 15 LYS H . . 5.730 3.407 2.990 4.359 . 0 0 "[ . 1 . 2]" 1
190 1 8 VAL QG 1 15 LYS HA . . 6.720 4.693 4.307 5.883 . 0 0 "[ . 1 . 2]" 1
191 1 8 VAL QG 1 15 LYS QB . . 5.260 2.581 1.905 4.067 . 0 0 "[ . 1 . 2]" 1
192 1 8 VAL QG 1 15 LYS QD . . 7.760 4.165 3.048 4.941 . 0 0 "[ . 1 . 2]" 1
193 1 8 VAL QG 1 15 LYS QG . . 7.450 4.147 3.128 5.352 . 0 0 "[ . 1 . 2]" 1
194 1 8 VAL QG 1 18 GLN QE . . 8.960 7.256 5.361 8.963 0.003 12 0 "[ . 1 . 2]" 1
195 1 8 VAL QG 2 25 GLY H . . 8.090 3.982 2.679 4.683 . 0 0 "[ . 1 . 2]" 1
196 1 8 VAL QG 2 25 GLY QA . . 6.680 2.665 1.932 3.638 . 0 0 "[ . 1 . 2]" 1
197 1 8 VAL QG 2 26 GLU H . . 7.130 3.841 2.977 4.360 . 0 0 "[ . 1 . 2]" 1
198 1 8 VAL QG 2 27 ARG QB . . 7.960 3.799 2.738 4.565 . 0 0 "[ . 1 . 2]" 1
199 1 8 VAL QG 2 27 ARG QD . . 7.700 2.902 1.766 3.795 . 0 0 "[ . 1 . 2]" 1
200 1 8 VAL QG 2 27 ARG HE . . 8.090 4.338 3.629 5.260 . 0 0 "[ . 1 . 2]" 1
201 1 8 VAL QG 2 27 ARG QG . . 7.380 3.571 1.950 5.002 . 0 0 "[ . 1 . 2]" 1
202 1 8 VAL MG1 1 9 TYR H . . 5.540 3.629 2.377 3.940 . 0 0 "[ . 1 . 2]" 1
203 1 8 VAL MG1 1 15 LYS H . . 6.530 5.179 4.758 5.393 . 0 0 "[ . 1 . 2]" 1
204 1 8 VAL MG1 1 15 LYS HB2 . . 7.130 5.044 4.601 5.406 . 0 0 "[ . 1 . 2]" 1
205 1 8 VAL MG1 1 15 LYS HB3 . . 7.130 5.948 5.586 6.407 . 0 0 "[ . 1 . 2]" 1
206 1 8 VAL MG1 2 25 GLY HA2 . . 8.440 2.964 1.948 4.055 . 0 0 "[ . 1 . 2]" 1
207 1 8 VAL MG1 2 25 GLY HA3 . . 8.440 3.865 2.960 5.307 . 0 0 "[ . 1 . 2]" 1
208 1 8 VAL MG1 2 27 ARG HB2 . . 9.650 4.162 2.786 5.381 . 0 0 "[ . 1 . 2]" 1
209 1 8 VAL MG1 2 27 ARG HB3 . . 9.650 4.850 4.128 5.528 . 0 0 "[ . 1 . 2]" 1
210 1 8 VAL MG1 2 27 ARG HG2 . . 9.060 4.576 2.163 5.780 . 0 0 "[ . 1 . 2]" 1
211 1 8 VAL MG1 2 27 ARG HG3 . . 9.060 4.113 2.223 5.699 . 0 0 "[ . 1 . 2]" 1
212 1 8 VAL MG2 1 9 TYR H . . 5.540 4.193 4.088 4.410 . 0 0 "[ . 1 . 2]" 1
213 1 8 VAL MG2 1 15 LYS H . . 6.530 3.500 3.009 4.917 . 0 0 "[ . 1 . 2]" 1
214 1 8 VAL MG2 1 15 LYS HB2 . . 7.130 2.693 1.921 4.633 . 0 0 "[ . 1 . 2]" 1
215 1 8 VAL MG2 1 15 LYS HB3 . . 7.130 3.684 3.219 5.402 . 0 0 "[ . 1 . 2]" 1
216 1 8 VAL MG2 2 25 GLY HA2 . . 8.440 3.632 2.576 4.453 . 0 0 "[ . 1 . 2]" 1
217 1 8 VAL MG2 2 25 GLY HA3 . . 8.440 4.779 3.639 5.878 . 0 0 "[ . 1 . 2]" 1
218 1 8 VAL MG2 2 27 ARG HB2 . . 9.650 6.504 3.782 7.881 . 0 0 "[ . 1 . 2]" 1
219 1 8 VAL MG2 2 27 ARG HB3 . . 9.650 7.071 5.076 8.033 . 0 0 "[ . 1 . 2]" 1
220 1 8 VAL MG2 2 27 ARG HG2 . . 9.060 6.660 4.581 8.175 . 0 0 "[ . 1 . 2]" 1
221 1 8 VAL MG2 2 27 ARG HG3 . . 9.060 6.092 3.082 7.808 . 0 0 "[ . 1 . 2]" 1
222 1 9 TYR H 1 9 TYR HB2 . . 3.050 2.602 2.187 2.825 . 0 0 "[ . 1 . 2]" 1
223 1 9 TYR H 1 9 TYR HB3 . . 3.050 2.435 2.277 2.700 . 0 0 "[ . 1 . 2]" 1
224 1 9 TYR H 1 14 PHE QD . . 7.620 3.558 2.909 4.086 . 0 0 "[ . 1 . 2]" 1
225 1 9 TYR H 1 25 GLY H . . 5.500 17.228 16.264 18.017 12.517 17 20 [-***************+***] 1
226 1 9 TYR H 2 25 GLY H . . 5.130 4.315 3.897 4.884 . 0 0 "[ . 1 . 2]" 1
227 1 9 TYR H 2 26 GLU H . . 4.140 2.973 2.502 3.449 . 0 0 "[ . 1 . 2]" 1
228 1 9 TYR HA 1 10 GLU H . . 2.990 2.080 1.908 2.192 . 0 0 "[ . 1 . 2]" 1
229 1 9 TYR HA 1 13 VAL H . . 3.890 4.165 3.953 4.990 1.100 15 2 "[ . 1 - + 2]" 1
230 1 9 TYR HA 1 13 VAL HB . . 3.890 4.705 4.164 5.992 2.102 15 9 "[ *** *1*** +- 2]" 1
231 1 9 TYR HA 1 14 PHE HA . . 3.210 2.058 1.816 2.369 . 0 0 "[ . 1 . 2]" 1
232 1 9 TYR HA 1 14 PHE QD . . 7.620 3.405 2.921 3.721 . 0 0 "[ . 1 . 2]" 1
233 1 9 TYR HA 1 15 LYS H . . 4.600 3.121 2.835 3.666 . 0 0 "[ . 1 . 2]" 1
234 1 9 TYR HA 1 15 LYS QE . . 6.380 5.926 4.451 6.495 0.115 3 0 "[ . 1 . 2]" 1
235 1 9 TYR HA 2 26 GLU H . . 4.910 4.694 4.345 4.964 0.054 12 0 "[ . 1 . 2]" 1
236 1 9 TYR QB 1 26 GLU QB . . 5.980 13.038 12.499 13.770 7.790 15 20 [**************+****-] 1
237 1 9 TYR QB 2 22 LEU QB . . 5.790 3.431 2.678 4.645 . 0 0 "[ . 1 . 2]" 1
238 1 9 TYR QB 2 22 LEU MD1 . . 6.190 3.202 1.914 5.108 . 0 0 "[ . 1 . 2]" 1
239 1 9 TYR QB 2 22 LEU MD2 . . 7.410 4.969 3.991 6.053 . 0 0 "[ . 1 . 2]" 1
240 1 9 TYR QB 2 26 GLU H . . 4.730 2.922 2.630 3.261 . 0 0 "[ . 1 . 2]" 1
241 1 9 TYR QB 2 26 GLU QB . . 6.820 2.212 1.781 3.238 . 0 0 "[ . 1 . 2]" 1
242 1 9 TYR HB2 1 10 GLU H . . 5.190 4.359 4.225 4.542 . 0 0 "[ . 1 . 2]" 1
243 1 9 TYR HB2 1 14 PHE QE . . 7.620 2.497 2.155 3.457 . 0 0 "[ . 1 . 2]" 1
244 1 9 TYR HB2 2 22 LEU HB2 . . 7.250 4.758 3.736 6.361 . 0 0 "[ . 1 . 2]" 1
245 1 9 TYR HB2 2 22 LEU HB3 . . 7.250 5.223 3.885 6.946 . 0 0 "[ . 1 . 2]" 1
246 1 9 TYR HB2 2 22 LEU MD1 . . 6.430 3.672 2.664 5.816 . 0 0 "[ . 1 . 2]" 1
247 1 9 TYR HB2 2 26 GLU H . . 5.500 4.443 3.943 4.854 . 0 0 "[ . 1 . 2]" 1
248 1 9 TYR HB3 1 10 GLU H . . 5.190 4.340 4.092 4.463 . 0 0 "[ . 1 . 2]" 1
249 1 9 TYR HB3 1 14 PHE QE . . 7.620 3.752 3.383 4.999 . 0 0 "[ . 1 . 2]" 1
250 1 9 TYR HB3 2 22 LEU HB2 . . 7.250 4.013 3.082 5.926 . 0 0 "[ . 1 . 2]" 1
251 1 9 TYR HB3 2 22 LEU HB3 . . 7.250 4.155 3.033 5.807 . 0 0 "[ . 1 . 2]" 1
252 1 9 TYR HB3 2 22 LEU MD1 . . 6.430 3.562 1.960 5.659 . 0 0 "[ . 1 . 2]" 1
253 1 9 TYR HB3 2 26 GLU H . . 5.500 2.965 2.658 3.314 . 0 0 "[ . 1 . 2]" 1
254 1 9 TYR QD 1 10 GLU H . . 6.860 3.905 3.425 4.189 . 0 0 "[ . 1 . 2]" 1
255 1 9 TYR QD 1 13 VAL H . . 7.640 4.078 3.603 5.280 . 0 0 "[ . 1 . 2]" 1
256 1 9 TYR QD 1 14 PHE HA . . 7.640 3.166 2.668 4.490 . 0 0 "[ . 1 . 2]" 1
257 1 9 TYR QD 1 14 PHE QE . . 9.760 3.151 2.775 3.357 . 0 0 "[ . 1 . 2]" 1
258 1 9 TYR QD 1 24 GLU HA . . 7.640 14.479 13.242 15.420 7.780 15 20 [*******-******+*****] 1
259 1 9 TYR QD 2 20 VAL MG1 . . 8.670 4.011 3.342 6.394 . 0 0 "[ . 1 . 2]" 1
260 1 9 TYR QD 2 20 VAL MG2 . . 8.670 4.083 3.109 7.061 . 0 0 "[ . 1 . 2]" 1
261 1 9 TYR QD 2 22 LEU H . . 7.640 4.464 2.474 6.887 . 0 0 "[ . 1 . 2]" 1
262 1 9 TYR QD 2 22 LEU HB2 . . 7.640 3.093 1.796 5.326 . 0 0 "[ . 1 . 2]" 1
263 1 9 TYR QD 2 22 LEU HB3 . . 7.640 3.659 2.476 5.606 . 0 0 "[ . 1 . 2]" 1
264 1 9 TYR QD 2 22 LEU MD1 . . 8.670 3.662 2.293 5.649 . 0 0 "[ . 1 . 2]" 1
265 1 9 TYR QD 2 22 LEU MD2 . . 8.670 5.075 4.400 6.326 . 0 0 "[ . 1 . 2]" 1
266 1 9 TYR QD 2 23 LYS H . . 7.640 3.874 2.647 5.456 . 0 0 "[ . 1 . 2]" 1
267 1 9 TYR QD 2 24 GLU H . . 7.640 4.828 3.680 6.028 . 0 0 "[ . 1 . 2]" 1
268 1 9 TYR QD 2 24 GLU HA . . 7.550 3.552 2.161 4.578 . 0 0 "[ . 1 . 2]" 1
269 1 9 TYR QD 2 25 GLY H . . 7.640 4.485 3.724 5.693 . 0 0 "[ . 1 . 2]" 1
270 1 9 TYR QD 2 26 GLU H . . 7.520 3.874 3.380 4.634 . 0 0 "[ . 1 . 2]" 1
271 1 9 TYR QD 2 26 GLU QB . . 8.520 3.076 2.637 4.102 . 0 0 "[ . 1 . 2]" 1
272 1 9 TYR QE 1 12 GLY H . . 7.630 3.556 2.332 4.319 . 0 0 "[ . 1 . 2]" 1
273 1 9 TYR QE 1 12 GLY HA2 . . 7.630 2.887 2.326 4.437 . 0 0 "[ . 1 . 2]" 1
274 1 9 TYR QE 1 12 GLY HA3 . . 7.630 4.178 3.759 5.398 . 0 0 "[ . 1 . 2]" 1
275 1 9 TYR QE 1 13 VAL H . . 7.630 3.971 3.367 5.234 . 0 0 "[ . 1 . 2]" 1
276 1 9 TYR QE 1 13 VAL HA . . 7.630 3.860 3.300 5.058 . 0 0 "[ . 1 . 2]" 1
277 1 9 TYR QE 1 14 PHE QE . . 9.750 3.482 2.658 3.973 . 0 0 "[ . 1 . 2]" 1
278 1 9 TYR QE 1 20 VAL HB . . 7.630 15.065 13.630 16.499 8.869 18 20 [****-************+**] 1
279 1 9 TYR QE 2 16 PRO QB . . 8.510 4.402 3.815 5.039 . 0 0 "[ . 1 . 2]" 1
280 1 9 TYR QE 2 16 PRO QD . . 8.510 3.322 2.505 4.351 . 0 0 "[ . 1 . 2]" 1
281 1 9 TYR QE 2 16 PRO HG2 . . 7.630 3.661 2.207 4.679 . 0 0 "[ . 1 . 2]" 1
282 1 9 TYR QE 2 16 PRO HG3 . . 7.630 2.776 1.965 3.444 . 0 0 "[ . 1 . 2]" 1
283 1 9 TYR QE 2 20 VAL HB . . 7.630 3.449 2.467 6.451 . 0 0 "[ . 1 . 2]" 1
284 1 9 TYR QE 2 20 VAL MG1 . . 8.660 3.464 2.425 6.115 . 0 0 "[ . 1 . 2]" 1
285 1 9 TYR QE 2 20 VAL MG2 . . 8.200 3.176 2.250 6.512 . 0 0 "[ . 1 . 2]" 1
286 1 9 TYR QE 2 22 LEU H . . 7.630 3.576 2.246 6.285 . 0 0 "[ . 1 . 2]" 1
287 1 9 TYR QE 2 22 LEU HB2 . . 7.630 3.547 2.326 6.375 . 0 0 "[ . 1 . 2]" 1
288 1 9 TYR QE 2 22 LEU QB . . 7.410 3.417 2.306 5.763 . 0 0 "[ . 1 . 2]" 1
289 1 9 TYR QE 2 22 LEU HB3 . . 7.630 4.660 3.593 6.574 . 0 0 "[ . 1 . 2]" 1
290 1 9 TYR QE 2 22 LEU MD1 . . 8.660 4.429 3.665 6.117 . 0 0 "[ . 1 . 2]" 1
291 1 9 TYR QE 2 24 GLU HA . . 7.630 4.864 3.363 6.304 . 0 0 "[ . 1 . 2]" 1
292 1 10 GLU H 1 10 GLU HB2 . . 3.520 2.935 2.349 3.748 0.228 4 0 "[ . 1 . 2]" 1
293 1 10 GLU H 1 10 GLU HB3 . . 3.520 3.213 2.601 3.721 0.201 13 0 "[ . 1 . 2]" 1
294 1 10 GLU H 1 10 GLU HG2 . . 4.790 3.908 2.004 4.768 . 0 0 "[ . 1 . 2]" 1
295 1 10 GLU H 1 10 GLU QG . . 4.640 3.303 1.964 4.196 . 0 0 "[ . 1 . 2]" 1
296 1 10 GLU H 1 10 GLU HG3 . . 4.790 3.700 2.419 4.929 0.139 14 0 "[ . 1 . 2]" 1
297 1 10 GLU H 1 11 ASN H . . 4.850 4.268 3.898 4.438 . 0 0 "[ . 1 . 2]" 1
298 1 10 GLU H 1 13 VAL H . . 3.330 3.102 2.705 3.559 0.229 5 0 "[ . 1 . 2]" 1
299 1 10 GLU H 1 13 VAL MG1 . . 6.530 4.507 4.073 5.169 . 0 0 "[ . 1 . 2]" 1
300 1 10 GLU H 1 13 VAL MG2 . . 5.230 3.932 2.457 4.692 . 0 0 "[ . 1 . 2]" 1
301 1 10 GLU H 1 14 PHE HA . . 3.420 3.372 3.005 3.547 0.127 4 0 "[ . 1 . 2]" 1
302 1 10 GLU H 1 15 LYS H . . 5.500 3.626 3.339 3.894 . 0 0 "[ . 1 . 2]" 1
303 1 10 GLU HA 1 11 ASN H . . 3.080 2.270 2.046 2.883 . 0 0 "[ . 1 . 2]" 1
304 1 10 GLU HA 1 12 GLY H . . 3.800 3.766 3.473 4.328 0.528 5 1 "[ + 1 . 2]" 1
305 1 10 GLU HA 1 13 VAL H . . 4.910 4.325 4.120 4.902 . 0 0 "[ . 1 . 2]" 1
306 1 10 GLU HA 2 24 GLU HA . . 3.490 2.195 1.773 3.085 . 0 0 "[ . 1 . 2]" 1
307 1 10 GLU HA 2 24 GLU HG2 . . 4.940 3.929 2.516 5.012 0.072 4 0 "[ . 1 . 2]" 1
308 1 10 GLU HA 2 24 GLU QG . . 4.740 3.089 2.061 4.369 . 0 0 "[ . 1 . 2]" 1
309 1 10 GLU HA 2 24 GLU HG3 . . 4.940 3.588 2.070 4.983 0.043 20 0 "[ . 1 . 2]" 1
310 1 10 GLU HA 2 25 GLY H . . 3.860 2.534 1.814 3.246 . 0 0 "[ . 1 . 2]" 1
311 1 10 GLU QB 1 11 ASN H . . 3.940 3.119 1.778 3.822 . 0 0 "[ . 1 . 2]" 1
312 1 10 GLU QB 1 13 VAL MG1 . . 5.990 4.889 3.183 5.555 . 0 0 "[ . 1 . 2]" 1
313 1 10 GLU HB2 1 11 ASN H . . 4.140 3.842 1.784 4.362 0.222 15 0 "[ . 1 . 2]" 1
314 1 10 GLU HB2 1 13 VAL MG1 . . 6.190 5.590 3.262 6.448 0.258 15 0 "[ . 1 . 2]" 1
315 1 10 GLU HB2 1 13 VAL MG2 . . 6.530 4.627 2.154 6.562 0.032 9 0 "[ . 1 . 2]" 1
316 1 10 GLU HB2 2 25 GLY H . . 5.500 3.846 2.603 5.132 . 0 0 "[ . 1 . 2]" 1
317 1 10 GLU HB3 1 11 ASN H . . 4.140 3.523 1.816 4.226 0.086 15 0 "[ . 1 . 2]" 1
318 1 10 GLU HB3 1 13 VAL MG1 . . 6.190 5.637 3.487 6.351 0.161 7 0 "[ . 1 . 2]" 1
319 1 10 GLU HB3 1 13 VAL MG2 . . 6.530 4.441 2.063 5.774 . 0 0 "[ . 1 . 2]" 1
320 1 10 GLU HB3 2 25 GLY H . . 5.500 4.072 1.814 5.539 0.039 17 0 "[ . 1 . 2]" 1
321 1 10 GLU QG 1 11 ASN H . . 5.280 3.441 1.748 4.452 . 0 0 "[ . 1 . 2]" 1
322 1 10 GLU HG2 1 11 ASN H . . 5.500 3.887 1.760 5.201 . 0 0 "[ . 1 . 2]" 1
323 1 10 GLU HG3 1 11 ASN H . . 5.500 4.200 2.905 5.260 . 0 0 "[ . 1 . 2]" 1
324 1 11 ASN H 1 11 ASN HB2 . . 3.980 2.982 1.912 3.627 . 0 0 "[ . 1 . 2]" 1
325 1 11 ASN H 1 11 ASN HB3 . . 3.980 3.654 2.592 4.065 0.085 14 0 "[ . 1 . 2]" 1
326 1 11 ASN H 1 12 GLY H . . 3.420 2.839 2.502 3.625 0.205 19 0 "[ . 1 . 2]" 1
327 1 11 ASN H 1 13 VAL H . . 4.690 4.055 3.517 4.570 . 0 0 "[ . 1 . 2]" 1
328 1 11 ASN H 2 24 GLU HG2 . . 5.500 3.282 1.911 4.864 . 0 0 "[ . 1 . 2]" 1
329 1 11 ASN H 2 24 GLU HG3 . . 5.500 3.032 1.731 5.328 . 0 0 "[ . 1 . 2]" 1
330 1 11 ASN H 2 25 GLY H . . 5.470 4.577 3.574 5.483 0.013 17 0 "[ . 1 . 2]" 1
331 1 11 ASN HA 1 11 ASN QD . . 4.630 3.354 1.786 4.009 . 0 0 "[ . 1 . 2]" 1
332 1 11 ASN HA 1 11 ASN HD22 . . 5.190 4.161 3.315 4.859 . 0 0 "[ . 1 . 2]" 1
333 1 11 ASN HA 1 12 GLY H . . 3.110 2.914 2.444 3.142 0.032 7 0 "[ . 1 . 2]" 1
334 1 11 ASN HA 1 13 VAL H . . 4.380 4.349 2.680 4.754 0.374 15 0 "[ . 1 . 2]" 1
335 1 11 ASN QB 1 12 GLY H . . 4.390 3.742 3.566 3.834 . 0 0 "[ . 1 . 2]" 1
336 1 11 ASN QB 1 13 VAL H . . 4.370 3.698 3.320 4.326 . 0 0 "[ . 1 . 2]" 1
337 1 11 ASN QB 1 13 VAL MG2 . . 5.460 2.892 2.135 5.327 . 0 0 "[ . 1 . 2]" 1
338 1 11 ASN HB2 1 12 GLY H . . 4.690 4.362 4.002 4.514 . 0 0 "[ . 1 . 2]" 1
339 1 11 ASN HB2 1 13 VAL H . . 4.540 4.585 3.577 4.994 0.454 17 0 "[ . 1 . 2]" 1
340 1 11 ASN HB2 1 13 VAL MG1 . . 6.530 5.800 4.290 6.609 0.079 17 0 "[ . 1 . 2]" 1
341 1 11 ASN HB2 1 13 VAL MG2 . . 5.810 3.915 2.763 6.067 0.257 5 0 "[ . 1 . 2]" 1
342 1 11 ASN HB3 1 12 GLY H . . 4.690 4.100 3.776 4.442 . 0 0 "[ . 1 . 2]" 1
343 1 11 ASN HB3 1 13 VAL H . . 4.540 4.025 3.401 4.951 0.411 5 0 "[ . 1 . 2]" 1
344 1 11 ASN HB3 1 13 VAL MG1 . . 6.530 5.136 2.725 6.940 0.410 5 0 "[ . 1 . 2]" 1
345 1 11 ASN HB3 1 13 VAL MG2 . . 5.810 3.109 2.150 5.900 0.090 5 0 "[ . 1 . 2]" 1
346 1 11 ASN HD21 1 13 VAL MG2 . . 6.530 4.631 2.337 6.058 . 0 0 "[ . 1 . 2]" 1
347 1 11 ASN HD22 1 13 VAL MG2 . . 6.530 5.649 3.740 6.660 0.130 19 0 "[ . 1 . 2]" 1
348 1 12 GLY H 1 13 VAL H . . 3.360 2.313 1.686 3.151 . 0 0 "[ . 1 . 2]" 1
349 1 12 GLY H 1 13 VAL MG1 . . 6.530 5.351 3.115 5.902 . 0 0 "[ . 1 . 2]" 1
350 1 12 GLY H 1 13 VAL MG2 . . 6.530 3.805 2.437 4.637 . 0 0 "[ . 1 . 2]" 1
351 1 12 GLY HA2 1 13 VAL H . . 3.360 3.177 3.003 3.530 0.170 13 0 "[ . 1 . 2]" 1
352 1 12 GLY HA2 1 13 VAL MG1 . . 6.530 5.442 3.652 5.910 . 0 0 "[ . 1 . 2]" 1
353 1 12 GLY HA3 1 13 VAL H . . 3.360 3.289 2.509 3.426 0.066 9 0 "[ . 1 . 2]" 1
354 1 12 GLY HA3 1 13 VAL MG1 . . 6.530 4.987 2.502 5.743 . 0 0 "[ . 1 . 2]" 1
355 1 13 VAL H 1 13 VAL MG2 . . 4.760 2.345 1.986 2.763 . 0 0 "[ . 1 . 2]" 1
356 1 13 VAL H 1 14 PHE H . . 5.500 4.466 4.301 4.597 . 0 0 "[ . 1 . 2]" 1
357 1 13 VAL HA 1 13 VAL HB . . 3.020 2.848 2.334 3.022 0.002 9 0 "[ . 1 . 2]" 1
358 1 13 VAL HA 1 14 PHE H . . 2.990 2.295 2.225 2.385 . 0 0 "[ . 1 . 2]" 1
359 1 13 VAL HA 2 15 LYS HA . . 3.860 3.636 3.099 3.970 0.110 12 0 "[ . 1 . 2]" 1
360 1 13 VAL HA 2 16 PRO HD2 . . 5.500 3.634 3.104 4.183 . 0 0 "[ . 1 . 2]" 1
361 1 13 VAL HA 2 16 PRO HD3 . . 5.500 3.719 2.993 4.302 . 0 0 "[ . 1 . 2]" 1
362 1 13 VAL HA 2 16 PRO HG2 . . 5.500 5.235 4.468 5.620 0.120 12 0 "[ . 1 . 2]" 1
363 1 13 VAL HA 2 16 PRO HG3 . . 5.500 4.947 4.112 5.544 0.044 10 0 "[ . 1 . 2]" 1
364 1 13 VAL HB 1 14 PHE H . . 3.670 3.496 2.446 3.821 0.151 4 0 "[ . 1 . 2]" 1
365 1 13 VAL MG1 1 14 PHE H . . 5.750 2.705 2.096 4.137 . 0 0 "[ . 1 . 2]" 1
366 1 13 VAL MG1 2 15 LYS H . . 6.530 5.175 4.273 5.906 . 0 0 "[ . 1 . 2]" 1
367 1 13 VAL MG1 2 15 LYS HA . . 5.230 3.819 3.347 4.314 . 0 0 "[ . 1 . 2]" 1
368 1 13 VAL MG1 2 15 LYS QB . . 7.250 4.668 3.750 5.313 . 0 0 "[ . 1 . 2]" 1
369 1 13 VAL MG1 2 15 LYS QD . . 7.410 4.205 2.270 5.263 . 0 0 "[ . 1 . 2]" 1
370 1 13 VAL MG1 2 15 LYS QE . . 7.190 4.227 2.264 6.066 . 0 0 "[ . 1 . 2]" 1
371 1 13 VAL MG1 2 15 LYS HG2 . . 5.970 3.543 2.446 4.700 . 0 0 "[ . 1 . 2]" 1
372 1 13 VAL MG1 2 15 LYS HG3 . . 5.970 3.812 3.048 4.846 . 0 0 "[ . 1 . 2]" 1
373 1 13 VAL MG1 2 16 PRO HD2 . . 5.880 4.545 3.368 5.148 . 0 0 "[ . 1 . 2]" 1
374 1 13 VAL MG1 2 16 PRO QD . . 5.700 4.106 3.239 4.449 . 0 0 "[ . 1 . 2]" 1
375 1 13 VAL MG1 2 16 PRO HD3 . . 5.880 4.742 4.204 5.227 . 0 0 "[ . 1 . 2]" 1
376 1 13 VAL MG1 2 16 PRO HG2 . . 6.530 6.200 4.902 6.612 0.082 4 0 "[ . 1 . 2]" 1
377 1 13 VAL MG1 2 16 PRO HG3 . . 6.530 6.102 4.999 6.432 . 0 0 "[ . 1 . 2]" 1
378 1 13 VAL MG2 1 14 PHE H . . 5.100 4.034 3.389 4.278 . 0 0 "[ . 1 . 2]" 1
379 1 13 VAL MG2 1 15 LYS H . . 6.530 5.238 3.480 5.941 . 0 0 "[ . 1 . 2]" 1
380 1 13 VAL MG2 2 15 LYS HA . . 5.540 5.148 4.325 5.629 0.089 5 0 "[ . 1 . 2]" 1
381 1 13 VAL MG2 2 15 LYS QE . . 7.000 5.107 2.338 7.037 0.037 5 0 "[ . 1 . 2]" 1
382 1 13 VAL MG2 2 16 PRO QD . . 7.410 4.895 4.364 5.430 . 0 0 "[ . 1 . 2]" 1
383 1 14 PHE H 1 14 PHE HB2 . . 3.550 2.427 2.344 2.524 . 0 0 "[ . 1 . 2]" 1
384 1 14 PHE H 1 14 PHE HB3 . . 3.550 3.636 3.593 3.697 0.147 17 0 "[ . 1 . 2]" 1
385 1 14 PHE H 1 15 LYS H . . 5.500 4.309 4.223 4.386 . 0 0 "[ . 1 . 2]" 1
386 1 14 PHE H 1 30 ILE MD . . 6.530 5.680 4.794 6.261 . 0 0 "[ . 1 . 2]" 1
387 1 14 PHE H 2 15 LYS HA . . 3.580 3.632 3.436 3.783 0.203 8 0 "[ . 1 . 2]" 1
388 1 14 PHE H 2 16 PRO HD2 . . 5.310 4.259 3.821 4.729 . 0 0 "[ . 1 . 2]" 1
389 1 14 PHE H 2 16 PRO QD . . 4.690 3.290 3.020 3.543 . 0 0 "[ . 1 . 2]" 1
390 1 14 PHE H 2 16 PRO HD3 . . 5.310 3.436 3.074 3.755 . 0 0 "[ . 1 . 2]" 1
391 1 14 PHE HA 1 15 LYS H . . 2.990 2.132 2.096 2.167 . 0 0 "[ . 1 . 2]" 1
392 1 14 PHE HA 1 30 ILE MD . . 6.530 5.559 4.790 6.126 . 0 0 "[ . 1 . 2]" 1
393 1 14 PHE QB 1 15 LYS H . . 3.890 3.402 3.358 3.476 . 0 0 "[ . 1 . 2]" 1
394 1 14 PHE QB 1 30 ILE MD . . 6.250 3.473 2.819 4.463 . 0 0 "[ . 1 . 2]" 1
395 1 14 PHE HB2 1 15 LYS H . . 4.290 4.372 4.311 4.458 0.168 2 0 "[ . 1 . 2]" 1
396 1 14 PHE HB2 1 30 ILE MD . . 6.530 3.940 3.079 4.896 . 0 0 "[ . 1 . 2]" 1
397 1 14 PHE HB2 2 30 ILE MD . . 5.850 4.162 3.255 4.950 . 0 0 "[ . 1 . 2]" 1
398 1 14 PHE HB3 1 15 LYS H . . 4.290 3.547 3.497 3.627 . 0 0 "[ . 1 . 2]" 1
399 1 14 PHE HB3 1 30 ILE MD . . 6.530 3.869 3.268 5.145 . 0 0 "[ . 1 . 2]" 1
400 1 14 PHE HB3 2 30 ILE MD . . 5.850 3.278 2.257 4.010 . 0 0 "[ . 1 . 2]" 1
401 1 14 PHE QD 1 15 LYS H . . 7.620 4.120 3.867 4.367 . 0 0 "[ . 1 . 2]" 1
402 1 14 PHE QD 1 28 VAL MG2 . . 8.650 5.362 4.816 7.120 . 0 0 "[ . 1 . 2]" 1
403 1 14 PHE QD 1 30 ILE MD . . 8.650 3.363 2.724 3.865 . 0 0 "[ . 1 . 2]" 1
404 1 14 PHE QD 2 5 ILE MD . . 8.650 5.341 4.185 6.556 . 0 0 "[ . 1 . 2]" 1
405 1 14 PHE QD 2 16 PRO QG . . 8.500 3.270 2.592 3.841 . 0 0 "[ . 1 . 2]" 1
406 1 14 PHE QD 2 30 ILE MD . . 8.340 3.788 3.116 4.921 . 0 0 "[ . 1 . 2]" 1
407 1 14 PHE QD 2 30 ILE MG . . 8.650 5.429 4.661 6.136 . 0 0 "[ . 1 . 2]" 1
408 1 14 PHE QE 1 32 LEU MD1 . . 8.430 5.106 3.688 5.957 . 0 0 "[ . 1 . 2]" 1
409 1 14 PHE QE 1 32 LEU MD2 . . 8.280 4.834 3.622 5.697 . 0 0 "[ . 1 . 2]" 1
410 1 14 PHE QE 2 5 ILE MD . . 8.250 3.573 2.286 4.830 . 0 0 "[ . 1 . 2]" 1
411 1 14 PHE QE 2 5 ILE MG . . 8.650 3.489 2.257 5.201 . 0 0 "[ . 1 . 2]" 1
412 1 14 PHE QE 2 7 ALA MB . . 8.060 3.309 2.426 4.305 . 0 0 "[ . 1 . 2]" 1
413 1 14 PHE QE 2 16 PRO QB . . 7.310 2.554 1.768 3.593 . 0 0 "[ . 1 . 2]" 1
414 1 14 PHE QE 2 16 PRO HD2 . . 7.620 4.357 3.691 5.102 . 0 0 "[ . 1 . 2]" 1
415 1 14 PHE QE 2 16 PRO HD3 . . 7.620 2.972 2.149 3.668 . 0 0 "[ . 1 . 2]" 1
416 1 14 PHE QE 2 16 PRO HG2 . . 7.500 3.930 3.357 4.656 . 0 0 "[ . 1 . 2]" 1
417 1 14 PHE QE 2 16 PRO QG . . 7.370 2.304 1.767 3.044 . 0 0 "[ . 1 . 2]" 1
418 1 14 PHE QE 2 16 PRO HG3 . . 7.500 2.322 1.772 3.086 . 0 0 "[ . 1 . 2]" 1
419 1 14 PHE QE 2 20 VAL MG1 . . 8.650 3.718 2.135 5.506 . 0 0 "[ . 1 . 2]" 1
420 1 14 PHE QE 2 20 VAL MG2 . . 8.650 2.946 2.072 5.503 . 0 0 "[ . 1 . 2]" 1
421 1 14 PHE QE 2 22 LEU MD1 . . 8.590 3.095 2.229 4.316 . 0 0 "[ . 1 . 2]" 1
422 1 14 PHE QE 2 22 LEU MD2 . . 8.650 5.363 3.541 6.189 . 0 0 "[ . 1 . 2]" 1
423 1 14 PHE QE 2 28 VAL MG1 . . 8.650 1.947 1.712 2.521 . 0 0 "[ . 1 . 2]" 1
424 1 14 PHE QE 2 28 VAL MG2 . . 8.530 2.241 1.785 3.033 . 0 0 "[ . 1 . 2]" 1
425 1 14 PHE HZ 1 32 LEU MD1 . . 5.850 5.580 4.582 6.027 0.177 9 0 "[ . 1 . 2]" 1
426 1 14 PHE HZ 1 32 LEU MD2 . . 5.850 5.311 3.834 5.997 0.147 13 0 "[ . 1 . 2]" 1
427 1 14 PHE HZ 2 5 ILE MD . . 5.850 2.871 1.773 4.235 . 0 0 "[ . 1 . 2]" 1
428 1 14 PHE HZ 2 20 VAL MG1 . . 6.530 3.135 2.127 4.953 . 0 0 "[ . 1 . 2]" 1
429 1 14 PHE HZ 2 20 VAL MG2 . . 6.530 2.982 1.883 4.971 . 0 0 "[ . 1 . 2]" 1
430 1 14 PHE HZ 2 22 LEU MD1 . . 6.370 3.057 2.275 4.356 . 0 0 "[ . 1 . 2]" 1
431 1 15 LYS H 1 15 LYS HB2 . . 3.520 2.447 2.376 2.510 . 0 0 "[ . 1 . 2]" 1
432 1 15 LYS H 1 15 LYS QB . . 3.310 2.411 2.345 2.468 . 0 0 "[ . 1 . 2]" 1
433 1 15 LYS H 1 15 LYS HB3 . . 3.520 3.636 3.544 3.667 0.147 6 0 "[ . 1 . 2]" 1
434 1 15 LYS H 1 15 LYS HD2 . . 5.500 4.780 4.214 5.347 . 0 0 "[ . 1 . 2]" 1
435 1 15 LYS H 1 15 LYS HD3 . . 5.500 4.614 2.770 5.612 0.112 2 0 "[ . 1 . 2]" 1
436 1 15 LYS H 1 15 LYS HG2 . . 5.280 3.825 2.595 4.637 . 0 0 "[ . 1 . 2]" 1
437 1 15 LYS H 1 15 LYS QG . . 4.720 2.946 2.547 3.932 . 0 0 "[ . 1 . 2]" 1
438 1 15 LYS H 1 15 LYS HG3 . . 5.280 3.242 2.604 4.249 . 0 0 "[ . 1 . 2]" 1
439 1 15 LYS H 1 16 PRO HD2 . . 5.500 4.766 4.605 5.168 . 0 0 "[ . 1 . 2]" 1
440 1 15 LYS H 1 16 PRO HD3 . . 5.500 4.454 4.147 4.723 . 0 0 "[ . 1 . 2]" 1
441 1 15 LYS H 1 17 LEU QD . . 6.000 5.680 5.277 6.456 0.456 18 0 "[ . 1 . 2]" 1
442 1 15 LYS H 2 13 VAL MG1 . . 6.530 5.239 4.140 6.008 . 0 0 "[ . 1 . 2]" 1
443 1 15 LYS HA 1 15 LYS HD2 . . 5.500 4.245 2.635 4.870 . 0 0 "[ . 1 . 2]" 1
444 1 15 LYS HA 1 15 LYS HD3 . . 5.500 4.036 2.333 4.855 . 0 0 "[ . 1 . 2]" 1
445 1 15 LYS HA 1 15 LYS HG2 . . 3.950 2.714 2.217 3.548 . 0 0 "[ . 1 . 2]" 1
446 1 15 LYS HA 1 15 LYS QG . . 3.740 2.470 2.184 2.941 . 0 0 "[ . 1 . 2]" 1
447 1 15 LYS HA 1 15 LYS HG3 . . 3.950 3.104 2.245 3.875 . 0 0 "[ . 1 . 2]" 1
448 1 15 LYS HA 1 16 PRO HD2 . . 3.860 2.063 1.863 2.525 . 0 0 "[ . 1 . 2]" 1
449 1 15 LYS HA 1 16 PRO HD3 . . 3.860 2.466 1.949 2.675 . 0 0 "[ . 1 . 2]" 1
450 1 15 LYS HA 1 16 PRO HG2 . . 5.500 4.230 4.034 4.447 . 0 0 "[ . 1 . 2]" 1
451 1 15 LYS HA 1 16 PRO QG . . 5.070 3.843 3.736 3.932 . 0 0 "[ . 1 . 2]" 1
452 1 15 LYS HA 1 16 PRO HG3 . . 5.500 4.422 4.136 4.538 . 0 0 "[ . 1 . 2]" 1
453 1 15 LYS HA 1 17 LEU QD . . 6.530 6.015 5.548 6.483 . 0 0 "[ . 1 . 2]" 1
454 1 15 LYS HA 2 13 VAL HA . . 3.860 3.645 3.234 3.946 0.086 14 0 "[ . 1 . 2]" 1
455 1 15 LYS HA 2 13 VAL MG1 . . 5.230 3.734 2.287 4.570 . 0 0 "[ . 1 . 2]" 1
456 1 15 LYS HA 2 13 VAL MG2 . . 5.540 5.137 3.938 5.619 0.079 12 0 "[ . 1 . 2]" 1
457 1 15 LYS HA 2 14 PHE H . . 3.580 3.633 3.372 3.750 0.170 15 0 "[ . 1 . 2]" 1
458 1 15 LYS QB 1 17 LEU QD . . 7.410 4.397 3.857 4.885 . 0 0 "[ . 1 . 2]" 1
459 1 15 LYS QB 2 13 VAL MG1 . . 7.250 4.585 3.255 5.635 . 0 0 "[ . 1 . 2]" 1
460 1 15 LYS QD 1 17 LEU QD . . 6.940 6.003 4.976 6.579 . 0 0 "[ . 1 . 2]" 1
461 1 15 LYS QD 2 13 VAL MG1 . . 7.410 3.921 1.855 5.871 . 0 0 "[ . 1 . 2]" 1
462 1 15 LYS QE 2 13 VAL MG1 . . 7.190 4.233 2.444 5.670 . 0 0 "[ . 1 . 2]" 1
463 1 15 LYS QE 2 13 VAL MG2 . . 7.000 5.174 2.801 6.505 . 0 0 "[ . 1 . 2]" 1
464 1 15 LYS HG2 2 13 VAL MG1 . . 5.970 3.442 2.116 4.842 . 0 0 "[ . 1 . 2]" 1
465 1 15 LYS HG3 2 13 VAL MG1 . . 5.970 3.946 2.487 5.114 . 0 0 "[ . 1 . 2]" 1
466 1 16 PRO HA 1 17 LEU H . . 3.330 2.254 2.044 2.341 . 0 0 "[ . 1 . 2]" 1
467 1 16 PRO HA 1 18 GLN H . . 3.490 3.933 3.512 5.385 1.895 7 5 "[ . +- * * *. 2]" 1
468 1 16 PRO QB 1 17 LEU H . . 3.610 2.587 2.489 2.689 . 0 0 "[ . 1 . 2]" 1
469 1 16 PRO QB 1 18 GLN H . . 3.590 2.527 1.760 3.733 0.143 7 0 "[ . 1 . 2]" 1
470 1 16 PRO QB 1 20 VAL MG1 . . 6.530 4.517 2.748 5.746 . 0 0 "[ . 1 . 2]" 1
471 1 16 PRO QB 1 20 VAL MG2 . . 5.180 3.626 2.352 4.846 . 0 0 "[ . 1 . 2]" 1
472 1 16 PRO QB 2 9 TYR QE . . 8.510 4.643 3.506 7.376 . 0 0 "[ . 1 . 2]" 1
473 1 16 PRO QB 2 14 PHE QE . . 7.310 2.821 1.934 6.117 . 0 0 "[ . 1 . 2]" 1
474 1 16 PRO QD 2 9 TYR QE . . 8.510 3.847 2.446 7.070 . 0 0 "[ . 1 . 2]" 1
475 1 16 PRO QD 2 13 VAL MG1 . . 5.700 3.987 2.414 4.620 . 0 0 "[ . 1 . 2]" 1
476 1 16 PRO QD 2 13 VAL MG2 . . 7.410 4.873 3.523 5.489 . 0 0 "[ . 1 . 2]" 1
477 1 16 PRO QD 2 14 PHE H . . 4.690 3.326 2.852 3.661 . 0 0 "[ . 1 . 2]" 1
478 1 16 PRO HD2 1 17 LEU H . . 5.500 5.554 5.260 5.640 0.140 20 0 "[ . 1 . 2]" 1
479 1 16 PRO HD2 2 13 VAL HA . . 5.500 3.573 2.919 4.459 . 0 0 "[ . 1 . 2]" 1
480 1 16 PRO HD2 2 13 VAL MG1 . . 5.880 4.368 2.536 5.434 . 0 0 "[ . 1 . 2]" 1
481 1 16 PRO HD2 2 14 PHE H . . 5.310 4.226 3.825 4.803 . 0 0 "[ . 1 . 2]" 1
482 1 16 PRO HD2 2 14 PHE QE . . 7.620 4.250 3.595 7.554 . 0 0 "[ . 1 . 2]" 1
483 1 16 PRO HD3 1 17 LEU H . . 5.500 5.433 5.176 5.706 0.206 17 0 "[ . 1 . 2]" 1
484 1 16 PRO HD3 2 13 VAL HA . . 5.500 3.749 2.727 4.357 . 0 0 "[ . 1 . 2]" 1
485 1 16 PRO HD3 2 13 VAL MG1 . . 5.880 4.692 3.029 5.429 . 0 0 "[ . 1 . 2]" 1
486 1 16 PRO HD3 2 14 PHE H . . 5.310 3.497 2.939 3.973 . 0 0 "[ . 1 . 2]" 1
487 1 16 PRO HD3 2 14 PHE QE . . 7.620 2.912 2.206 6.336 . 0 0 "[ . 1 . 2]" 1
488 1 16 PRO QG 1 18 GLN H . . 6.380 4.379 3.418 5.618 . 0 0 "[ . 1 . 2]" 1
489 1 16 PRO QG 1 20 VAL MG1 . . 6.360 4.088 1.935 5.387 . 0 0 "[ . 1 . 2]" 1
490 1 16 PRO QG 2 14 PHE QD . . 8.500 3.330 2.285 3.963 . 0 0 "[ . 1 . 2]" 1
491 1 16 PRO QG 2 14 PHE QE . . 7.370 2.289 1.750 4.951 . 0 0 "[ . 1 . 2]" 1
492 1 16 PRO HG2 1 17 LEU H . . 5.500 4.734 4.487 5.097 . 0 0 "[ . 1 . 2]" 1
493 1 16 PRO HG2 1 20 VAL MG1 . . 6.530 5.008 2.767 6.609 0.079 3 0 "[ . 1 . 2]" 1
494 1 16 PRO HG2 1 20 VAL MG2 . . 5.570 4.281 2.843 5.639 0.069 2 0 "[ . 1 . 2]" 1
495 1 16 PRO HG2 2 9 TYR QE . . 7.630 3.955 1.854 7.268 . 0 0 "[ . 1 . 2]" 1
496 1 16 PRO HG2 2 13 VAL HA . . 5.500 5.105 3.842 5.565 0.065 2 0 "[ . 1 . 2]" 1
497 1 16 PRO HG2 2 13 VAL MG1 . . 6.530 5.989 4.191 6.644 0.114 20 0 "[ . 1 . 2]" 1
498 1 16 PRO HG2 2 14 PHE QE . . 7.500 3.845 2.872 6.304 . 0 0 "[ . 1 . 2]" 1
499 1 16 PRO HG3 1 17 LEU H . . 5.500 4.976 4.296 5.138 . 0 0 "[ . 1 . 2]" 1
500 1 16 PRO HG3 1 20 VAL MG1 . . 6.530 4.415 1.961 5.919 . 0 0 "[ . 1 . 2]" 1
501 1 16 PRO HG3 1 20 VAL MG2 . . 5.570 3.680 2.086 5.603 0.033 18 0 "[ . 1 . 2]" 1
502 1 16 PRO HG3 2 9 TYR QE . . 7.630 3.179 1.753 6.509 . 0 0 "[ . 1 . 2]" 1
503 1 16 PRO HG3 2 13 VAL HA . . 5.500 4.938 4.227 5.562 0.062 17 0 "[ . 1 . 2]" 1
504 1 16 PRO HG3 2 13 VAL MG1 . . 6.530 6.000 4.764 6.592 0.062 2 0 "[ . 1 . 2]" 1
505 1 16 PRO HG3 2 14 PHE QE . . 7.500 2.316 1.765 5.176 . 0 0 "[ . 1 . 2]" 1
506 1 17 LEU H 1 17 LEU HB2 . . 4.140 2.522 2.417 2.655 . 0 0 "[ . 1 . 2]" 1
507 1 17 LEU H 1 17 LEU QB . . 3.920 2.480 2.384 2.605 . 0 0 "[ . 1 . 2]" 1
508 1 17 LEU H 1 17 LEU HB3 . . 4.140 3.668 3.577 3.766 . 0 0 "[ . 1 . 2]" 1
509 1 17 LEU H 1 17 LEU HG . . 4.790 2.750 2.334 3.915 . 0 0 "[ . 1 . 2]" 1
510 1 17 LEU H 1 18 GLN H . . 3.610 2.264 1.780 3.928 0.318 7 0 "[ . 1 . 2]" 1
511 1 17 LEU HA 1 18 GLN H . . 3.360 3.128 1.926 3.467 0.107 12 0 "[ . 1 . 2]" 1
512 1 17 LEU QB 1 18 GLN H . . 4.120 2.944 1.876 3.659 . 0 0 "[ . 1 . 2]" 1
513 1 17 LEU HB2 1 18 GLN H . . 4.320 3.135 1.889 4.355 0.035 10 0 "[ . 1 . 2]" 1
514 1 17 LEU HB3 1 18 GLN H . . 4.320 3.879 3.120 4.241 . 0 0 "[ . 1 . 2]" 1
515 1 17 LEU QD 1 18 GLN H . . 6.530 3.988 3.430 4.290 . 0 0 "[ . 1 . 2]" 1
516 1 17 LEU QD 2 27 ARG QD . . 5.950 3.416 2.379 5.099 . 0 0 "[ . 1 . 2]" 1
517 1 17 LEU QD 2 27 ARG HE . . 6.530 3.898 2.720 5.282 . 0 0 "[ . 1 . 2]" 1
518 1 17 LEU QD 2 27 ARG HG2 . . 6.090 4.839 2.741 6.449 0.359 18 0 "[ . 1 . 2]" 1
519 1 17 LEU QD 2 27 ARG QG . . 5.800 4.047 2.683 5.837 0.037 18 0 "[ . 1 . 2]" 1
520 1 17 LEU QD 2 27 ARG HG3 . . 6.090 4.447 2.909 6.667 0.577 18 1 "[ . 1 . + 2]" 1
521 1 17 LEU HG 1 18 GLN H . . 5.500 4.384 3.718 5.114 . 0 0 "[ . 1 . 2]" 1
522 1 18 GLN H 1 18 GLN HB2 . . 3.860 3.244 2.367 4.085 0.225 7 0 "[ . 1 . 2]" 1
523 1 18 GLN H 1 18 GLN QB . . 3.600 2.845 2.217 3.236 . 0 0 "[ . 1 . 2]" 1
524 1 18 GLN H 1 18 GLN HB3 . . 3.860 3.492 2.370 4.070 0.210 18 0 "[ . 1 . 2]" 1
525 1 18 GLN H 1 18 GLN QG . . 3.930 2.776 1.998 3.938 0.008 19 0 "[ . 1 . 2]" 1
526 1 18 GLN H 1 19 LYS H . . 5.500 4.278 1.753 4.652 . 0 0 "[ . 1 . 2]" 1
527 1 18 GLN HA 1 19 LYS H . . 3.020 2.371 2.043 3.302 0.282 18 0 "[ . 1 . 2]" 1
528 1 18 GLN HB2 1 19 LYS H . . 4.010 3.410 1.972 4.243 0.233 12 0 "[ . 1 . 2]" 1
529 1 18 GLN HB3 1 19 LYS H . . 4.010 3.406 1.714 4.335 0.325 12 0 "[ . 1 . 2]" 1
530 1 18 GLN QG 1 19 LYS H . . 5.500 3.864 2.453 4.455 . 0 0 "[ . 1 . 2]" 1
531 1 19 LYS H 1 19 LYS HB2 . . 3.550 2.633 2.214 3.606 0.056 2 0 "[ . 1 . 2]" 1
532 1 19 LYS H 1 19 LYS HB3 . . 3.550 3.043 2.323 3.999 0.449 18 0 "[ . 1 . 2]" 1
533 1 19 LYS H 1 19 LYS HD2 . . 5.500 4.729 2.928 5.272 . 0 0 "[ . 1 . 2]" 1
534 1 19 LYS H 1 19 LYS HD3 . . 5.500 4.503 3.093 5.423 . 0 0 "[ . 1 . 2]" 1
535 1 19 LYS H 1 19 LYS HG2 . . 4.380 3.582 1.865 4.524 0.144 15 0 "[ . 1 . 2]" 1
536 1 19 LYS H 1 19 LYS QG . . 4.230 3.139 1.846 3.972 . 0 0 "[ . 1 . 2]" 1
537 1 19 LYS H 1 19 LYS HG3 . . 4.380 3.753 2.184 4.522 0.142 3 0 "[ . 1 . 2]" 1
538 1 19 LYS H 1 20 VAL H . . 5.500 4.529 4.422 4.636 . 0 0 "[ . 1 . 2]" 1
539 1 19 LYS HA 1 19 LYS HG2 . . 3.980 2.974 2.245 3.817 . 0 0 "[ . 1 . 2]" 1
540 1 19 LYS HA 1 19 LYS QG . . 3.810 2.594 2.214 3.338 . 0 0 "[ . 1 . 2]" 1
541 1 19 LYS HA 1 19 LYS HG3 . . 3.980 3.140 2.415 3.827 . 0 0 "[ . 1 . 2]" 1
542 1 19 LYS HA 1 20 VAL H . . 3.020 2.194 2.040 2.947 . 0 0 "[ . 1 . 2]" 1
543 1 19 LYS QB 1 20 VAL H . . 3.770 3.108 1.768 3.719 . 0 0 "[ . 1 . 2]" 1
544 1 19 LYS HB2 1 20 VAL H . . 4.040 3.874 2.652 4.268 0.228 3 0 "[ . 1 . 2]" 1
545 1 19 LYS HB3 1 20 VAL H . . 4.040 3.429 1.783 4.229 0.189 15 0 "[ . 1 . 2]" 1
546 1 19 LYS HD2 1 20 VAL H . . 5.500 4.727 2.184 5.699 0.199 13 0 "[ . 1 . 2]" 1
547 1 19 LYS HD3 1 20 VAL H . . 5.500 4.647 1.915 5.618 0.118 2 0 "[ . 1 . 2]" 1
548 1 19 LYS HG2 1 20 VAL H . . 4.880 3.923 2.713 4.986 0.106 2 0 "[ . 1 . 2]" 1
549 1 19 LYS HG3 1 20 VAL H . . 4.880 4.073 2.899 5.027 0.147 17 0 "[ . 1 . 2]" 1
550 1 20 VAL H 1 20 VAL HB . . 2.990 3.039 2.747 3.647 0.657 18 2 "[ . 1 - . + 2]" 1
551 1 20 VAL H 1 20 VAL MG2 . . 4.420 2.838 1.780 3.975 . 0 0 "[ . 1 . 2]" 1
552 1 20 VAL H 1 21 ASP H . . 5.500 4.359 4.084 4.536 . 0 0 "[ . 1 . 2]" 1
553 1 20 VAL HA 1 21 ASP H . . 2.990 2.145 2.025 2.450 . 0 0 "[ . 1 . 2]" 1
554 1 20 VAL HA 1 21 ASP QB . . 4.350 3.881 3.655 4.007 . 0 0 "[ . 1 . 2]" 1
555 1 20 VAL HA 1 22 LEU H . . 4.380 4.272 3.438 4.825 0.445 1 0 "[ . 1 . 2]" 1
556 1 20 VAL HB 1 21 ASP H . . 3.550 3.672 2.335 3.876 0.326 2 0 "[ . 1 . 2]" 1
557 1 20 VAL HB 1 21 ASP QB . . 6.380 5.391 4.612 5.986 . 0 0 "[ . 1 . 2]" 1
558 1 20 VAL HB 1 22 LEU H . . 3.830 3.856 2.777 5.335 1.505 2 3 "[ + . - 1 * 2]" 1
559 1 20 VAL HB 1 22 LEU MD1 . . 6.530 3.990 2.944 5.536 . 0 0 "[ . 1 . 2]" 1
560 1 20 VAL HB 1 22 LEU HG . . 5.030 4.163 2.758 6.498 1.468 17 1 "[ . 1 . + 2]" 1
561 1 20 VAL HB 2 9 TYR QE . . 7.630 3.623 1.817 5.755 . 0 0 "[ . 1 . 2]" 1
562 1 20 VAL MG1 1 21 ASP H . . 5.540 2.731 2.017 3.923 . 0 0 "[ . 1 . 2]" 1
563 1 20 VAL MG1 1 22 LEU H . . 4.760 2.832 1.745 4.310 . 0 0 "[ . 1 . 2]" 1
564 1 20 VAL MG1 1 22 LEU MD1 . . 6.100 2.771 1.763 4.739 . 0 0 "[ . 1 . 2]" 1
565 1 20 VAL MG1 2 9 TYR QD . . 8.670 3.939 2.572 5.456 . 0 0 "[ . 1 . 2]" 1
566 1 20 VAL MG1 2 9 TYR QE . . 8.660 3.287 1.777 4.839 . 0 0 "[ . 1 . 2]" 1
567 1 20 VAL MG1 2 14 PHE QE . . 8.650 3.930 1.847 5.100 . 0 0 "[ . 1 . 2]" 1
568 1 20 VAL MG1 2 14 PHE HZ . . 6.530 3.679 1.765 6.649 0.119 17 0 "[ . 1 . 2]" 1
569 1 20 VAL MG2 1 21 ASP H . . 6.530 3.439 1.767 4.198 . 0 0 "[ . 1 . 2]" 1
570 1 20 VAL MG2 1 22 LEU H . . 5.160 3.955 1.652 5.213 0.053 14 0 "[ . 1 . 2]" 1
571 1 20 VAL MG2 2 9 TYR QD . . 8.670 4.451 3.141 6.982 . 0 0 "[ . 1 . 2]" 1
572 1 20 VAL MG2 2 9 TYR QE . . 8.200 3.627 2.026 6.099 . 0 0 "[ . 1 . 2]" 1
573 1 20 VAL MG2 2 14 PHE QE . . 8.650 3.638 2.265 5.556 . 0 0 "[ . 1 . 2]" 1
574 1 20 VAL MG2 2 14 PHE HZ . . 6.530 3.440 1.732 6.567 0.037 17 0 "[ . 1 . 2]" 1
575 1 21 ASP H 1 21 ASP QB . . 3.420 2.460 2.268 2.906 . 0 0 "[ . 1 . 2]" 1
576 1 21 ASP H 1 22 LEU H . . 4.230 2.885 1.781 3.746 . 0 0 "[ . 1 . 2]" 1
577 1 21 ASP HA 1 22 LEU H . . 2.990 2.573 2.103 3.093 0.103 17 0 "[ . 1 . 2]" 1
578 1 21 ASP QB 1 22 LEU H . . 3.970 3.755 3.489 3.906 . 0 0 "[ . 1 . 2]" 1
579 1 22 LEU H 1 22 LEU HB2 . . 3.420 2.484 2.172 3.678 0.258 2 0 "[ . 1 . 2]" 1
580 1 22 LEU H 1 22 LEU HB3 . . 3.420 3.563 2.798 3.690 0.270 13 0 "[ . 1 . 2]" 1
581 1 22 LEU H 1 22 LEU MD2 . . 5.750 3.637 3.229 3.930 . 0 0 "[ . 1 . 2]" 1
582 1 22 LEU H 1 22 LEU HG . . 4.070 2.890 2.257 4.167 0.097 17 0 "[ . 1 . 2]" 1
583 1 22 LEU H 1 23 LYS H . . 5.500 4.221 2.035 4.617 . 0 0 "[ . 1 . 2]" 1
584 1 22 LEU H 2 9 TYR QD . . 7.640 4.572 3.407 6.095 . 0 0 "[ . 1 . 2]" 1
585 1 22 LEU H 2 9 TYR QE . . 7.630 3.659 2.493 5.587 . 0 0 "[ . 1 . 2]" 1
586 1 22 LEU HA 1 22 LEU HG . . 3.950 3.088 2.596 4.225 0.275 2 0 "[ . 1 . 2]" 1
587 1 22 LEU HA 1 23 LYS H . . 3.050 2.676 2.141 3.221 0.171 12 0 "[ . 1 . 2]" 1
588 1 22 LEU QB 1 26 GLU QB . . 5.040 2.805 2.143 3.832 . 0 0 "[ . 1 . 2]" 1
589 1 22 LEU QB 1 26 GLU QG . . 6.320 2.736 1.657 4.528 . 0 0 "[ . 1 . 2]" 1
590 1 22 LEU QB 2 9 TYR QB . . 5.790 3.449 2.573 5.366 . 0 0 "[ . 1 . 2]" 1
591 1 22 LEU QB 2 9 TYR QE . . 7.410 3.204 1.753 5.366 . 0 0 "[ . 1 . 2]" 1
592 1 22 LEU HB2 1 23 LYS H . . 4.040 3.262 2.346 4.226 0.186 17 0 "[ . 1 . 2]" 1
593 1 22 LEU HB2 1 26 GLU HB2 . . 6.040 4.270 3.068 6.011 . 0 0 "[ . 1 . 2]" 1
594 1 22 LEU HB2 1 26 GLU HB3 . . 6.040 4.333 2.894 5.372 . 0 0 "[ . 1 . 2]" 1
595 1 22 LEU HB2 1 26 GLU HG2 . . 7.250 4.504 1.799 6.554 . 0 0 "[ . 1 . 2]" 1
596 1 22 LEU HB2 1 26 GLU HG3 . . 7.250 4.952 2.806 7.319 0.069 18 0 "[ . 1 . 2]" 1
597 1 22 LEU HB2 2 9 TYR HB2 . . 7.250 4.688 3.295 6.256 . 0 0 "[ . 1 . 2]" 1
598 1 22 LEU HB2 2 9 TYR HB3 . . 7.250 4.162 3.103 7.020 . 0 0 "[ . 1 . 2]" 1
599 1 22 LEU HB2 2 9 TYR QD . . 7.640 3.173 1.825 4.720 . 0 0 "[ . 1 . 2]" 1
600 1 22 LEU HB2 2 9 TYR QE . . 7.630 3.343 1.809 5.608 . 0 0 "[ . 1 . 2]" 1
601 1 22 LEU HB3 1 23 LYS H . . 4.040 2.336 1.716 4.162 0.122 12 0 "[ . 1 . 2]" 1
602 1 22 LEU HB3 1 26 GLU HB2 . . 6.040 3.293 2.238 4.779 . 0 0 "[ . 1 . 2]" 1
603 1 22 LEU HB3 1 26 GLU HB3 . . 6.040 3.546 2.888 4.672 . 0 0 "[ . 1 . 2]" 1
604 1 22 LEU HB3 1 26 GLU HG2 . . 7.250 3.304 1.771 5.295 . 0 0 "[ . 1 . 2]" 1
605 1 22 LEU HB3 1 26 GLU HG3 . . 7.250 3.774 2.070 5.745 . 0 0 "[ . 1 . 2]" 1
606 1 22 LEU HB3 2 9 TYR HB2 . . 7.250 5.033 3.568 7.243 . 0 0 "[ . 1 . 2]" 1
607 1 22 LEU HB3 2 9 TYR HB3 . . 7.250 4.250 2.952 7.297 0.047 18 0 "[ . 1 . 2]" 1
608 1 22 LEU HB3 2 9 TYR QD . . 7.640 3.682 2.623 5.767 . 0 0 "[ . 1 . 2]" 1
609 1 22 LEU HB3 2 9 TYR QE . . 7.630 4.372 2.354 6.845 . 0 0 "[ . 1 . 2]" 1
610 1 22 LEU MD1 1 23 LYS H . . 6.530 4.079 3.784 5.154 . 0 0 "[ . 1 . 2]" 1
611 1 22 LEU MD1 1 26 GLU HB2 . . 6.530 4.065 2.851 5.764 . 0 0 "[ . 1 . 2]" 1
612 1 22 LEU MD1 1 26 GLU QB . . 5.970 3.263 2.007 4.689 . 0 0 "[ . 1 . 2]" 1
613 1 22 LEU MD1 1 26 GLU HB3 . . 6.530 3.462 2.051 5.386 . 0 0 "[ . 1 . 2]" 1
614 1 22 LEU MD1 1 26 GLU HG2 . . 6.530 3.629 1.769 6.545 0.015 2 0 "[ . 1 . 2]" 1
615 1 22 LEU MD1 1 26 GLU QG . . 6.190 3.104 1.757 5.858 . 0 0 "[ . 1 . 2]" 1
616 1 22 LEU MD1 1 26 GLU HG3 . . 6.530 3.785 2.601 6.607 0.077 2 0 "[ . 1 . 2]" 1
617 1 22 LEU MD1 2 9 TYR HB2 . . 6.430 4.026 2.400 6.434 0.004 12 0 "[ . 1 . 2]" 1
618 1 22 LEU MD1 2 9 TYR QB . . 6.190 3.570 2.311 5.563 . 0 0 "[ . 1 . 2]" 1
619 1 22 LEU MD1 2 9 TYR HB3 . . 6.430 4.043 2.458 6.286 . 0 0 "[ . 1 . 2]" 1
620 1 22 LEU MD1 2 9 TYR QD . . 8.670 3.687 2.424 5.910 . 0 0 "[ . 1 . 2]" 1
621 1 22 LEU MD1 2 9 TYR QE . . 8.660 4.081 2.280 6.608 . 0 0 "[ . 1 . 2]" 1
622 1 22 LEU MD1 2 14 PHE QE . . 8.590 3.447 2.179 6.176 . 0 0 "[ . 1 . 2]" 1
623 1 22 LEU MD1 2 14 PHE HZ . . 6.370 3.468 2.057 6.449 0.079 12 0 "[ . 1 . 2]" 1
624 1 22 LEU MD2 1 23 LYS H . . 5.940 3.421 2.668 4.685 . 0 0 "[ . 1 . 2]" 1
625 1 22 LEU MD2 1 26 GLU QB . . 6.880 3.734 2.497 5.109 . 0 0 "[ . 1 . 2]" 1
626 1 22 LEU MD2 1 26 GLU HG2 . . 5.660 3.592 1.809 4.874 . 0 0 "[ . 1 . 2]" 1
627 1 22 LEU MD2 1 26 GLU QG . . 5.450 3.005 1.797 4.582 . 0 0 "[ . 1 . 2]" 1
628 1 22 LEU MD2 1 26 GLU HG3 . . 5.660 3.757 1.907 5.572 . 0 0 "[ . 1 . 2]" 1
629 1 22 LEU MD2 2 9 TYR QB . . 7.410 4.865 2.276 7.118 . 0 0 "[ . 1 . 2]" 1
630 1 22 LEU MD2 2 9 TYR QD . . 8.670 4.856 2.351 6.169 . 0 0 "[ . 1 . 2]" 1
631 1 22 LEU MD2 2 14 PHE QE . . 8.650 5.320 2.096 7.743 . 0 0 "[ . 1 . 2]" 1
632 1 22 LEU HG 1 23 LYS H . . 5.500 4.572 3.640 4.771 . 0 0 "[ . 1 . 2]" 1
633 1 23 LYS H 1 23 LYS HB2 . . 3.520 2.921 2.303 3.699 0.179 19 0 "[ . 1 . 2]" 1
634 1 23 LYS H 1 23 LYS HB3 . . 3.520 3.423 2.466 4.087 0.567 15 1 "[ . 1 + 2]" 1
635 1 23 LYS H 1 23 LYS HD2 . . 5.500 4.599 2.709 5.546 0.046 12 0 "[ . 1 . 2]" 1
636 1 23 LYS H 1 23 LYS QD . . 5.180 3.935 1.965 5.013 . 0 0 "[ . 1 . 2]" 1
637 1 23 LYS H 1 23 LYS HD3 . . 5.500 4.433 1.976 5.718 0.218 12 0 "[ . 1 . 2]" 1
638 1 23 LYS H 1 23 LYS HG2 . . 5.000 3.627 1.957 4.963 . 0 0 "[ . 1 . 2]" 1
639 1 23 LYS H 1 23 LYS QG . . 4.820 2.953 1.931 4.240 . 0 0 "[ . 1 . 2]" 1
640 1 23 LYS H 1 23 LYS HG3 . . 5.000 3.383 2.133 4.751 . 0 0 "[ . 1 . 2]" 1
641 1 23 LYS H 1 24 GLU H . . 5.500 4.475 4.355 4.570 . 0 0 "[ . 1 . 2]" 1
642 1 23 LYS H 1 26 GLU HB2 . . 3.920 3.012 2.584 4.096 0.176 15 0 "[ . 1 . 2]" 1
643 1 23 LYS H 1 26 GLU QB . . 3.740 2.899 2.554 3.704 . 0 0 "[ . 1 . 2]" 1
644 1 23 LYS H 1 26 GLU HB3 . . 3.920 3.956 3.633 4.226 0.306 15 0 "[ . 1 . 2]" 1
645 1 23 LYS H 1 26 GLU HG2 . . 4.940 3.450 2.149 4.946 0.006 8 0 "[ . 1 . 2]" 1
646 1 23 LYS H 1 26 GLU QG . . 4.410 3.102 1.846 4.312 . 0 0 "[ . 1 . 2]" 1
647 1 23 LYS H 1 26 GLU HG3 . . 4.940 3.884 1.923 5.369 0.429 15 0 "[ . 1 . 2]" 1
648 1 23 LYS H 2 9 TYR QD . . 7.640 3.948 2.644 5.965 . 0 0 "[ . 1 . 2]" 1
649 1 23 LYS HA 1 23 LYS HD2 . . 5.280 4.396 2.858 4.938 . 0 0 "[ . 1 . 2]" 1
650 1 23 LYS HA 1 23 LYS QD . . 4.990 3.848 2.781 4.271 . 0 0 "[ . 1 . 2]" 1
651 1 23 LYS HA 1 23 LYS HD3 . . 5.280 4.345 2.876 4.760 . 0 0 "[ . 1 . 2]" 1
652 1 23 LYS HA 1 24 GLU H . . 3.110 2.431 2.306 2.688 . 0 0 "[ . 1 . 2]" 1
653 1 23 LYS HA 1 26 GLU QB . . 4.580 4.604 4.267 4.850 0.270 13 0 "[ . 1 . 2]" 1
654 1 23 LYS HA 1 26 GLU QG . . 5.850 5.280 3.680 6.108 0.258 18 0 "[ . 1 . 2]" 1
655 1 23 LYS QB 1 24 GLU H . . 3.760 2.512 1.890 3.551 . 0 0 "[ . 1 . 2]" 1
656 1 23 LYS HB2 1 24 GLU H . . 3.920 3.349 2.399 4.022 0.102 7 0 "[ . 1 . 2]" 1
657 1 23 LYS HB3 1 24 GLU H . . 3.920 2.868 1.905 3.952 0.032 7 0 "[ . 1 . 2]" 1
658 1 23 LYS QD 1 24 GLU H . . 5.220 4.469 3.374 4.957 . 0 0 "[ . 1 . 2]" 1
659 1 23 LYS HD2 1 24 GLU H . . 5.500 5.150 4.552 5.802 0.302 15 0 "[ . 1 . 2]" 1
660 1 23 LYS HD3 1 24 GLU H . . 5.500 5.004 3.429 5.613 0.113 2 0 "[ . 1 . 2]" 1
661 1 23 LYS HG2 1 24 GLU H . . 5.500 3.856 2.032 5.010 . 0 0 "[ . 1 . 2]" 1
662 1 23 LYS HG3 1 24 GLU H . . 5.500 4.024 2.365 4.916 . 0 0 "[ . 1 . 2]" 1
663 1 24 GLU H 1 24 GLU HB2 . . 3.330 2.741 2.256 3.583 0.253 7 0 "[ . 1 . 2]" 1
664 1 24 GLU H 1 24 GLU HB3 . . 3.330 3.386 2.694 3.598 0.268 1 0 "[ . 1 . 2]" 1
665 1 24 GLU H 1 24 GLU HG2 . . 3.830 3.365 1.888 3.998 0.168 4 0 "[ . 1 . 2]" 1
666 1 24 GLU H 1 24 GLU QG . . 3.590 2.575 1.813 3.495 . 0 0 "[ . 1 . 2]" 1
667 1 24 GLU H 1 24 GLU HG3 . . 3.830 2.869 1.858 3.858 0.028 4 0 "[ . 1 . 2]" 1
668 1 24 GLU H 1 25 GLY H . . 5.500 4.493 4.323 4.578 . 0 0 "[ . 1 . 2]" 1
669 1 24 GLU H 2 9 TYR QD . . 7.640 4.872 3.977 6.172 . 0 0 "[ . 1 . 2]" 1
670 1 24 GLU HA 1 25 GLY H . . 2.990 2.174 2.039 2.904 . 0 0 "[ . 1 . 2]" 1
671 1 24 GLU HA 1 26 GLU H . . 3.420 3.484 3.144 3.750 0.330 1 0 "[ . 1 . 2]" 1
672 1 24 GLU HA 2 9 TYR QD . . 7.550 3.570 2.745 4.764 . 0 0 "[ . 1 . 2]" 1
673 1 24 GLU HA 2 9 TYR QE . . 7.630 5.032 3.729 6.274 . 0 0 "[ . 1 . 2]" 1
674 1 24 GLU HA 2 10 GLU HA . . 3.490 2.384 1.710 3.186 . 0 0 "[ . 1 . 2]" 1
675 1 24 GLU HB2 1 25 GLY H . . 3.980 3.707 1.767 4.198 0.218 6 0 "[ . 1 . 2]" 1
676 1 24 GLU HB3 1 25 GLY H . . 3.980 3.214 2.306 4.076 0.096 7 0 "[ . 1 . 2]" 1
677 1 24 GLU QG 2 10 GLU HA . . 4.740 3.101 1.796 4.269 . 0 0 "[ . 1 . 2]" 1
678 1 24 GLU HG2 1 25 GLY H . . 5.410 4.711 4.056 5.406 . 0 0 "[ . 1 . 2]" 1
679 1 24 GLU HG2 2 10 GLU HA . . 4.940 3.841 2.253 4.956 0.016 7 0 "[ . 1 . 2]" 1
680 1 24 GLU HG2 2 11 ASN H . . 5.500 3.490 1.748 5.567 0.067 19 0 "[ . 1 . 2]" 1
681 1 24 GLU HG3 1 25 GLY H . . 5.410 4.525 3.689 5.152 . 0 0 "[ . 1 . 2]" 1
682 1 24 GLU HG3 2 10 GLU HA . . 4.940 3.682 1.801 5.022 0.082 2 0 "[ . 1 . 2]" 1
683 1 24 GLU HG3 2 11 ASN H . . 5.500 3.434 1.967 5.531 0.031 20 0 "[ . 1 . 2]" 1
684 1 25 GLY H 1 26 GLU H . . 3.330 2.647 2.046 3.622 0.292 8 0 "[ . 1 . 2]" 1
685 1 25 GLY H 2 8 VAL QG . . 8.090 3.910 2.654 4.503 . 0 0 "[ . 1 . 2]" 1
686 1 25 GLY H 2 9 TYR H . . 5.130 4.195 3.549 4.889 . 0 0 "[ . 1 . 2]" 1
687 1 25 GLY H 2 9 TYR QD . . 7.640 4.607 3.775 5.491 . 0 0 "[ . 1 . 2]" 1
688 1 25 GLY H 2 10 GLU HA . . 3.860 2.880 2.083 3.430 . 0 0 "[ . 1 . 2]" 1
689 1 25 GLY H 2 10 GLU HB2 . . 5.500 4.323 2.335 5.526 0.026 19 0 "[ . 1 . 2]" 1
690 1 25 GLY H 2 10 GLU HB3 . . 5.500 4.528 1.953 5.668 0.168 8 0 "[ . 1 . 2]" 1
691 1 25 GLY H 2 11 ASN H . . 5.470 4.882 3.794 5.548 0.078 12 0 "[ . 1 . 2]" 1
692 1 25 GLY QA 1 26 GLU H . . 3.210 2.649 2.296 2.919 . 0 0 "[ . 1 . 2]" 1
693 1 25 GLY QA 2 8 VAL QG . . 6.680 2.622 1.887 3.537 . 0 0 "[ . 1 . 2]" 1
694 1 25 GLY HA2 1 26 GLU H . . 3.390 2.783 2.332 3.185 . 0 0 "[ . 1 . 2]" 1
695 1 25 GLY HA2 2 8 VAL MG1 . . 8.440 2.913 1.902 3.803 . 0 0 "[ . 1 . 2]" 1
696 1 25 GLY HA2 2 8 VAL MG2 . . 8.440 3.514 2.831 4.611 . 0 0 "[ . 1 . 2]" 1
697 1 25 GLY HA3 1 26 GLU H . . 3.390 3.458 3.387 3.526 0.136 3 0 "[ . 1 . 2]" 1
698 1 25 GLY HA3 2 8 VAL MG1 . . 8.440 3.767 3.090 5.114 . 0 0 "[ . 1 . 2]" 1
699 1 25 GLY HA3 2 8 VAL MG2 . . 8.440 4.585 3.108 6.070 . 0 0 "[ . 1 . 2]" 1
700 1 26 GLU H 1 26 GLU HB2 . . 3.490 2.404 2.117 2.810 . 0 0 "[ . 1 . 2]" 1
701 1 26 GLU H 1 26 GLU HB3 . . 3.490 2.803 2.415 3.462 . 0 0 "[ . 1 . 2]" 1
702 1 26 GLU H 1 26 GLU HG2 . . 4.290 4.233 3.185 4.640 0.350 15 0 "[ . 1 . 2]" 1
703 1 26 GLU H 1 26 GLU QG . . 3.970 3.787 3.105 4.000 0.030 15 0 "[ . 1 . 2]" 1
704 1 26 GLU H 1 26 GLU HG3 . . 4.290 4.370 4.248 4.494 0.204 14 0 "[ . 1 . 2]" 1
705 1 26 GLU H 1 27 ARG H . . 5.500 4.527 4.389 4.633 . 0 0 "[ . 1 . 2]" 1
706 1 26 GLU H 2 8 VAL QG . . 7.130 3.818 2.364 4.684 . 0 0 "[ . 1 . 2]" 1
707 1 26 GLU H 2 9 TYR H . . 4.140 2.872 2.210 3.450 . 0 0 "[ . 1 . 2]" 1
708 1 26 GLU H 2 9 TYR HA . . 4.910 4.789 4.262 5.047 0.137 13 0 "[ . 1 . 2]" 1
709 1 26 GLU H 2 9 TYR HB2 . . 5.500 4.305 2.169 5.408 . 0 0 "[ . 1 . 2]" 1
710 1 26 GLU H 2 9 TYR QB . . 4.730 2.969 2.158 4.804 0.074 18 0 "[ . 1 . 2]" 1
711 1 26 GLU H 2 9 TYR HB3 . . 5.500 3.127 2.650 5.377 . 0 0 "[ . 1 . 2]" 1
712 1 26 GLU H 2 9 TYR QD . . 7.520 3.984 2.570 4.724 . 0 0 "[ . 1 . 2]" 1
713 1 26 GLU HA 1 26 GLU HG2 . . 4.010 3.212 2.511 3.791 . 0 0 "[ . 1 . 2]" 1
714 1 26 GLU HA 1 26 GLU QG . . 3.850 2.639 2.219 3.078 . 0 0 "[ . 1 . 2]" 1
715 1 26 GLU HA 1 26 GLU HG3 . . 4.010 3.004 2.279 3.587 . 0 0 "[ . 1 . 2]" 1
716 1 26 GLU HA 1 27 ARG H . . 3.050 2.251 2.112 2.428 . 0 0 "[ . 1 . 2]" 1
717 1 26 GLU QB 1 27 ARG H . . 3.930 3.479 2.969 3.821 . 0 0 "[ . 1 . 2]" 1
718 1 26 GLU QB 1 28 VAL MG1 . . 6.210 3.282 2.846 4.117 . 0 0 "[ . 1 . 2]" 1
719 1 26 GLU QB 2 9 TYR QB . . 6.820 2.387 1.740 4.716 . 0 0 "[ . 1 . 2]" 1
720 1 26 GLU QB 2 9 TYR QD . . 8.520 3.289 2.305 4.313 . 0 0 "[ . 1 . 2]" 1
721 1 26 GLU HB2 1 27 ARG H . . 4.410 4.284 4.110 4.445 0.035 7 0 "[ . 1 . 2]" 1
722 1 26 GLU HB2 1 28 VAL MG1 . . 6.530 4.653 3.971 5.617 . 0 0 "[ . 1 . 2]" 1
723 1 26 GLU HB3 1 27 ARG H . . 4.410 3.723 3.039 4.231 . 0 0 "[ . 1 . 2]" 1
724 1 26 GLU HB3 1 28 VAL MG1 . . 6.530 3.356 2.895 4.235 . 0 0 "[ . 1 . 2]" 1
725 1 26 GLU QG 1 27 ARG H . . 4.420 3.136 2.223 4.083 . 0 0 "[ . 1 . 2]" 1
726 1 26 GLU QG 1 28 VAL MG2 . . 7.410 4.979 3.176 6.348 . 0 0 "[ . 1 . 2]" 1
727 1 26 GLU HG2 1 27 ARG H . . 4.570 3.999 2.350 4.643 0.073 9 0 "[ . 1 . 2]" 1
728 1 26 GLU HG2 1 28 VAL MG1 . . 5.470 4.208 2.618 5.625 0.155 10 0 "[ . 1 . 2]" 1
729 1 26 GLU HG3 1 27 ARG H . . 4.570 3.455 2.284 4.679 0.109 13 0 "[ . 1 . 2]" 1
730 1 26 GLU HG3 1 28 VAL MG1 . . 5.470 3.926 2.136 5.500 0.030 17 0 "[ . 1 . 2]" 1
731 1 27 ARG H 1 27 ARG HB2 . . 3.580 2.406 2.111 2.774 . 0 0 "[ . 1 . 2]" 1
732 1 27 ARG H 1 27 ARG HB3 . . 3.580 3.247 2.517 3.677 0.097 6 0 "[ . 1 . 2]" 1
733 1 27 ARG H 1 27 ARG HD2 . . 5.500 4.396 2.662 5.610 0.110 16 0 "[ . 1 . 2]" 1
734 1 27 ARG H 1 27 ARG HD3 . . 5.500 3.702 2.409 5.215 . 0 0 "[ . 1 . 2]" 1
735 1 27 ARG H 1 27 ARG HG2 . . 5.160 4.375 3.650 4.667 . 0 0 "[ . 1 . 2]" 1
736 1 27 ARG H 1 27 ARG QG . . 4.510 3.789 2.762 4.081 . 0 0 "[ . 1 . 2]" 1
737 1 27 ARG H 1 27 ARG HG3 . . 5.160 4.183 2.859 4.557 . 0 0 "[ . 1 . 2]" 1
738 1 27 ARG H 1 28 VAL H . . 5.500 4.339 4.142 4.501 . 0 0 "[ . 1 . 2]" 1
739 1 27 ARG H 1 28 VAL MG1 . . 6.400 4.028 3.820 4.971 . 0 0 "[ . 1 . 2]" 1
740 1 27 ARG HA 1 27 ARG QD . . 4.490 2.885 1.981 3.988 . 0 0 "[ . 1 . 2]" 1
741 1 27 ARG HA 1 27 ARG HG2 . . 4.110 3.390 2.309 3.761 . 0 0 "[ . 1 . 2]" 1
742 1 27 ARG HA 1 27 ARG QG . . 3.780 2.382 2.118 2.828 . 0 0 "[ . 1 . 2]" 1
743 1 27 ARG HA 1 27 ARG HG3 . . 4.110 2.494 2.139 3.192 . 0 0 "[ . 1 . 2]" 1
744 1 27 ARG HA 1 28 VAL H . . 3.240 1.999 1.912 2.125 . 0 0 "[ . 1 . 2]" 1
745 1 27 ARG QB 2 8 VAL QG . . 7.960 3.901 2.523 4.599 . 0 0 "[ . 1 . 2]" 1
746 1 27 ARG HB2 1 28 VAL H . . 3.980 4.253 4.113 4.456 0.476 9 0 "[ . 1 . 2]" 1
747 1 27 ARG HB2 2 8 VAL MG1 . . 9.650 4.364 2.565 5.317 . 0 0 "[ . 1 . 2]" 1
748 1 27 ARG HB2 2 8 VAL MG2 . . 9.650 6.760 5.040 7.771 . 0 0 "[ . 1 . 2]" 1
749 1 27 ARG HB3 1 28 VAL H . . 3.980 3.578 2.996 4.139 0.159 17 0 "[ . 1 . 2]" 1
750 1 27 ARG HB3 2 8 VAL MG1 . . 9.650 4.797 3.868 5.418 . 0 0 "[ . 1 . 2]" 1
751 1 27 ARG HB3 2 8 VAL MG2 . . 9.650 7.017 5.181 7.833 . 0 0 "[ . 1 . 2]" 1
752 1 27 ARG QD 1 28 VAL H . . 5.330 4.326 2.823 5.008 . 0 0 "[ . 1 . 2]" 1
753 1 27 ARG QD 2 8 VAL HB . . 6.220 5.187 4.180 6.310 0.090 15 0 "[ . 1 . 2]" 1
754 1 27 ARG QD 2 8 VAL QG . . 7.700 2.824 1.863 3.658 . 0 0 "[ . 1 . 2]" 1
755 1 27 ARG QD 2 17 LEU QD . . 6.530 3.761 2.748 4.469 . 0 0 "[ . 1 . 2]" 1
756 1 27 ARG HD2 1 28 VAL H . . 5.500 5.084 2.856 5.721 0.221 19 0 "[ . 1 . 2]" 1
757 1 27 ARG HD2 2 17 LEU MD1 . . 8.280 4.462 3.547 5.318 . 0 0 "[ . 1 . 2]" 1
758 1 27 ARG HD2 2 17 LEU MD2 . . 8.280 4.774 2.891 6.632 . 0 0 "[ . 1 . 2]" 1
759 1 27 ARG HD3 1 28 VAL H . . 5.500 4.914 3.364 5.655 0.155 10 0 "[ . 1 . 2]" 1
760 1 27 ARG HD3 2 17 LEU MD1 . . 8.280 5.106 3.418 6.376 . 0 0 "[ . 1 . 2]" 1
761 1 27 ARG HD3 2 17 LEU MD2 . . 8.280 5.539 3.517 6.795 . 0 0 "[ . 1 . 2]" 1
762 1 27 ARG HE 2 8 VAL QG . . 8.090 4.314 2.725 5.329 . 0 0 "[ . 1 . 2]" 1
763 1 27 ARG HE 2 17 LEU QD . . 8.100 4.551 3.286 6.164 . 0 0 "[ . 1 . 2]" 1
764 1 27 ARG QG 2 8 VAL QG . . 7.380 3.132 2.025 4.463 . 0 0 "[ . 1 . 2]" 1
765 1 27 ARG QG 2 17 LEU QD . . 7.380 3.595 2.593 4.783 . 0 0 "[ . 1 . 2]" 1
766 1 27 ARG HG2 1 28 VAL H . . 5.380 4.467 3.142 5.295 . 0 0 "[ . 1 . 2]" 1
767 1 27 ARG HG2 2 8 VAL MG1 . . 9.060 4.344 2.051 5.363 . 0 0 "[ . 1 . 2]" 1
768 1 27 ARG HG2 2 8 VAL MG2 . . 9.060 6.544 4.119 7.848 . 0 0 "[ . 1 . 2]" 1
769 1 27 ARG HG2 2 17 LEU MD1 . . 9.230 4.937 2.827 6.062 . 0 0 "[ . 1 . 2]" 1
770 1 27 ARG HG2 2 17 LEU MD2 . . 9.230 5.505 3.461 8.389 . 0 0 "[ . 1 . 2]" 1
771 1 27 ARG HG3 1 28 VAL H . . 5.380 3.612 2.887 4.993 . 0 0 "[ . 1 . 2]" 1
772 1 27 ARG HG3 2 8 VAL MG1 . . 9.060 3.415 2.473 4.972 . 0 0 "[ . 1 . 2]" 1
773 1 27 ARG HG3 2 8 VAL MG2 . . 9.060 5.540 3.171 7.289 . 0 0 "[ . 1 . 2]" 1
774 1 27 ARG HG3 2 17 LEU MD1 . . 9.230 4.060 3.056 5.518 . 0 0 "[ . 1 . 2]" 1
775 1 27 ARG HG3 2 17 LEU MD2 . . 9.230 4.908 3.836 7.524 . 0 0 "[ . 1 . 2]" 1
776 1 28 VAL H 1 28 VAL HB . . 4.070 3.815 3.484 3.884 . 0 0 "[ . 1 . 2]" 1
777 1 28 VAL H 1 29 LYS H . . 5.500 4.424 4.382 4.462 . 0 0 "[ . 1 . 2]" 1
778 1 28 VAL H 2 7 ALA MB . . 5.850 4.225 3.924 4.496 . 0 0 "[ . 1 . 2]" 1
779 1 28 VAL HA 1 29 LYS H . . 3.240 2.345 2.246 2.480 . 0 0 "[ . 1 . 2]" 1
780 1 28 VAL HB 1 29 LYS H . . 4.110 2.592 2.156 3.126 . 0 0 "[ . 1 . 2]" 1
781 1 28 VAL HB 1 30 ILE MG . . 6.190 5.830 5.088 6.277 0.087 10 0 "[ . 1 . 2]" 1
782 1 28 VAL HB 2 32 LEU MD1 . . 6.530 5.207 3.430 6.404 . 0 0 "[ . 1 . 2]" 1
783 1 28 VAL HB 2 32 LEU MD2 . . 5.940 4.242 3.186 5.582 . 0 0 "[ . 1 . 2]" 1
784 1 28 VAL MG1 1 29 LYS H . . 6.160 3.642 2.578 3.886 . 0 0 "[ . 1 . 2]" 1
785 1 28 VAL MG1 2 8 VAL HA . . 6.030 4.464 3.998 5.835 . 0 0 "[ . 1 . 2]" 1
786 1 28 VAL MG1 2 14 PHE QE . . 8.650 2.051 1.769 3.061 . 0 0 "[ . 1 . 2]" 1
787 1 28 VAL MG1 2 30 ILE HA . . 6.530 4.971 4.429 5.331 . 0 0 "[ . 1 . 2]" 1
788 1 28 VAL MG2 1 29 LYS H . . 6.090 3.583 3.326 4.270 . 0 0 "[ . 1 . 2]" 1
789 1 28 VAL MG2 1 30 ILE MD . . 7.560 2.739 1.942 5.500 . 0 0 "[ . 1 . 2]" 1
790 1 28 VAL MG2 1 30 ILE MG . . 7.560 4.878 4.236 6.389 . 0 0 "[ . 1 . 2]" 1
791 1 28 VAL MG2 2 7 ALA H . . 5.750 2.860 2.547 4.114 . 0 0 "[ . 1 . 2]" 1
792 1 28 VAL MG2 2 7 ALA MB . . 7.280 2.395 2.131 3.744 . 0 0 "[ . 1 . 2]" 1
793 1 28 VAL MG2 2 8 VAL H . . 6.530 4.308 4.003 4.886 . 0 0 "[ . 1 . 2]" 1
794 1 28 VAL MG2 2 8 VAL HA . . 6.120 3.269 2.639 3.622 . 0 0 "[ . 1 . 2]" 1
795 1 28 VAL MG2 2 14 PHE QE . . 8.530 2.323 1.760 2.803 . 0 0 "[ . 1 . 2]" 1
796 1 28 VAL MG2 2 30 ILE HA . . 6.530 4.609 4.159 6.130 . 0 0 "[ . 1 . 2]" 1
797 1 29 LYS H 1 29 LYS HB2 . . 3.520 2.513 2.353 2.661 . 0 0 "[ . 1 . 2]" 1
798 1 29 LYS H 1 29 LYS QB . . 3.340 2.473 2.320 2.609 . 0 0 "[ . 1 . 2]" 1
799 1 29 LYS H 1 29 LYS HB3 . . 3.520 3.674 3.531 3.767 0.247 9 0 "[ . 1 . 2]" 1
800 1 29 LYS H 1 29 LYS HD2 . . 5.500 4.645 3.194 5.431 . 0 0 "[ . 1 . 2]" 1
801 1 29 LYS H 1 29 LYS HD3 . . 5.500 5.120 3.271 5.564 0.064 9 0 "[ . 1 . 2]" 1
802 1 29 LYS H 1 29 LYS HG2 . . 4.230 3.857 2.843 4.358 0.128 20 0 "[ . 1 . 2]" 1
803 1 29 LYS H 1 29 LYS HG3 . . 4.230 3.384 2.917 4.378 0.148 20 0 "[ . 1 . 2]" 1
804 1 29 LYS H 1 30 ILE H . . 5.500 4.378 4.302 4.444 . 0 0 "[ . 1 . 2]" 1
805 1 29 LYS H 2 30 ILE HA . . 4.230 4.359 4.274 4.436 0.206 8 0 "[ . 1 . 2]" 1
806 1 29 LYS HA 1 29 LYS HD2 . . 5.440 4.087 1.906 4.595 . 0 0 "[ . 1 . 2]" 1
807 1 29 LYS HA 1 29 LYS QD . . 4.740 3.487 1.898 4.035 . 0 0 "[ . 1 . 2]" 1
808 1 29 LYS HA 1 29 LYS HD3 . . 5.440 3.969 2.071 4.478 . 0 0 "[ . 1 . 2]" 1
809 1 29 LYS HA 1 29 LYS HG2 . . 3.950 2.558 2.241 3.628 . 0 0 "[ . 1 . 2]" 1
810 1 29 LYS HA 1 29 LYS HG3 . . 3.950 3.161 2.478 3.738 . 0 0 "[ . 1 . 2]" 1
811 1 29 LYS HA 1 30 ILE H . . 3.020 2.158 2.075 2.250 . 0 0 "[ . 1 . 2]" 1
812 1 29 LYS HA 2 4 ILE HG12 . . 5.500 5.585 5.507 5.687 0.187 20 0 "[ . 1 . 2]" 1
813 1 29 LYS HA 2 4 ILE HG13 . . 5.500 5.271 4.166 5.647 0.147 17 0 "[ . 1 . 2]" 1
814 1 29 LYS HA 2 4 ILE MG . . 6.530 5.046 2.965 6.096 . 0 0 "[ . 1 . 2]" 1
815 1 29 LYS QB 1 30 ILE H . . 3.720 2.820 2.648 2.948 . 0 0 "[ . 1 . 2]" 1
816 1 29 LYS HB2 1 30 ILE H . . 3.920 3.998 3.913 4.125 0.205 20 0 "[ . 1 . 2]" 1
817 1 29 LYS HB2 2 4 ILE MG . . 5.780 4.348 3.383 5.733 . 0 0 "[ . 1 . 2]" 1
818 1 29 LYS HB3 1 30 ILE H . . 3.920 2.883 2.690 3.026 . 0 0 "[ . 1 . 2]" 1
819 1 29 LYS HB3 2 4 ILE MG . . 5.780 3.337 2.079 4.530 . 0 0 "[ . 1 . 2]" 1
820 1 29 LYS QD 2 4 ILE MG . . 5.890 3.427 1.964 5.232 . 0 0 "[ . 1 . 2]" 1
821 1 29 LYS QD 2 6 GLU QG . . 7.250 3.080 1.806 4.152 . 0 0 "[ . 1 . 2]" 1
822 1 29 LYS HD2 1 30 ILE H . . 5.500 5.219 3.627 5.728 0.228 10 0 "[ . 1 . 2]" 1
823 1 29 LYS HD3 1 30 ILE H . . 5.500 4.946 3.765 5.621 0.121 10 0 "[ . 1 . 2]" 1
824 1 29 LYS QE 2 4 ILE MD . . 7.400 4.223 2.970 5.748 . 0 0 "[ . 1 . 2]" 1
825 1 29 LYS QE 2 4 ILE MG . . 6.910 4.332 3.022 5.921 . 0 0 "[ . 1 . 2]" 1
826 1 29 LYS QE 2 6 GLU HG2 . . 6.380 3.645 1.868 5.069 . 0 0 "[ . 1 . 2]" 1
827 1 29 LYS QE 2 6 GLU HG3 . . 6.380 3.903 1.939 5.409 . 0 0 "[ . 1 . 2]" 1
828 1 29 LYS QG 1 30 ILE H . . 4.780 3.883 3.360 4.516 . 0 0 "[ . 1 . 2]" 1
829 1 29 LYS QG 2 4 ILE QG . . 7.250 3.660 2.910 4.596 . 0 0 "[ . 1 . 2]" 1
830 1 29 LYS QG 2 4 ILE MG . . 5.850 4.313 1.880 5.358 . 0 0 "[ . 1 . 2]" 1
831 1 29 LYS QG 2 6 GLU QB . . 5.910 3.996 3.308 5.230 . 0 0 "[ . 1 . 2]" 1
832 1 29 LYS QG 2 6 GLU QG . . 5.180 2.387 1.774 3.784 . 0 0 "[ . 1 . 2]" 1
833 1 29 LYS HG2 1 30 ILE H . . 5.000 4.143 3.478 5.008 0.008 2 0 "[ . 1 . 2]" 1
834 1 29 LYS HG2 2 4 ILE MG . . 6.530 4.838 2.438 6.420 . 0 0 "[ . 1 . 2]" 1
835 1 29 LYS HG2 2 6 GLU HB2 . . 7.250 5.287 4.376 7.274 0.024 20 0 "[ . 1 . 2]" 1
836 1 29 LYS HG2 2 6 GLU HB3 . . 7.250 4.496 3.478 6.644 . 0 0 "[ . 1 . 2]" 1
837 1 29 LYS HG2 2 6 GLU HG2 . . 6.380 3.228 1.800 4.850 . 0 0 "[ . 1 . 2]" 1
838 1 29 LYS HG2 2 6 GLU HG3 . . 6.380 3.255 1.813 5.565 . 0 0 "[ . 1 . 2]" 1
839 1 29 LYS HG3 1 30 ILE H . . 5.000 4.878 3.608 5.157 0.157 7 0 "[ . 1 . 2]" 1
840 1 29 LYS HG3 2 4 ILE MG . . 6.530 5.055 1.911 6.647 0.117 19 0 "[ . 1 . 2]" 1
841 1 29 LYS HG3 2 6 GLU HB2 . . 7.250 6.376 5.233 7.426 0.176 2 0 "[ . 1 . 2]" 1
842 1 29 LYS HG3 2 6 GLU HB3 . . 7.250 5.366 4.036 6.732 . 0 0 "[ . 1 . 2]" 1
843 1 29 LYS HG3 2 6 GLU HG2 . . 6.380 4.167 2.511 5.757 . 0 0 "[ . 1 . 2]" 1
844 1 29 LYS HG3 2 6 GLU HG3 . . 6.380 4.334 2.781 5.881 . 0 0 "[ . 1 . 2]" 1
845 1 30 ILE H 1 30 ILE HB . . 3.450 2.850 2.692 3.124 . 0 0 "[ . 1 . 2]" 1
846 1 30 ILE H 1 30 ILE HG12 . . 4.040 2.546 2.093 3.738 . 0 0 "[ . 1 . 2]" 1
847 1 30 ILE H 1 30 ILE QG . . 3.710 2.238 1.963 2.604 . 0 0 "[ . 1 . 2]" 1
848 1 30 ILE H 1 30 ILE HG13 . . 4.040 3.410 1.980 3.964 . 0 0 "[ . 1 . 2]" 1
849 1 30 ILE H 1 31 LYS H . . 5.500 4.392 4.302 4.463 . 0 0 "[ . 1 . 2]" 1
850 1 30 ILE H 2 4 ILE MG . . 5.260 4.330 2.279 5.170 . 0 0 "[ . 1 . 2]" 1
851 1 30 ILE HA 1 30 ILE HG12 . . 4.010 3.215 2.708 3.459 . 0 0 "[ . 1 . 2]" 1
852 1 30 ILE HA 1 30 ILE QG . . 3.660 3.043 2.583 3.275 . 0 0 "[ . 1 . 2]" 1
853 1 30 ILE HA 1 30 ILE HG13 . . 4.010 3.762 3.186 4.051 0.041 8 0 "[ . 1 . 2]" 1
854 1 30 ILE HA 1 31 LYS H . . 3.050 2.131 2.020 2.218 . 0 0 "[ . 1 . 2]" 1
855 1 30 ILE HA 2 4 ILE MG . . 6.530 5.309 4.489 6.412 . 0 0 "[ . 1 . 2]" 1
856 1 30 ILE HA 2 28 VAL MG1 . . 6.530 5.080 4.455 5.631 . 0 0 "[ . 1 . 2]" 1
857 1 30 ILE HA 2 28 VAL MG2 . . 6.530 4.562 3.904 5.262 . 0 0 "[ . 1 . 2]" 1
858 1 30 ILE HA 2 29 LYS H . . 4.230 4.353 4.277 4.449 0.219 10 0 "[ . 1 . 2]" 1
859 1 30 ILE HB 1 31 LYS H . . 3.490 3.698 3.539 3.835 0.345 5 0 "[ . 1 . 2]" 1
860 1 30 ILE HB 2 5 ILE HB . . 4.450 2.712 1.785 4.539 0.089 10 0 "[ . 1 . 2]" 1
861 1 30 ILE HB 2 5 ILE MD . . 5.540 3.381 2.364 4.785 . 0 0 "[ . 1 . 2]" 1
862 1 30 ILE MD 1 31 LYS H . . 6.000 4.318 3.845 5.083 . 0 0 "[ . 1 . 2]" 1
863 1 30 ILE MD 1 32 LEU MD1 . . 7.560 6.481 4.036 7.695 0.135 6 0 "[ . 1 . 2]" 1
864 1 30 ILE MD 1 32 LEU MD2 . . 7.560 6.222 4.999 7.480 . 0 0 "[ . 1 . 2]" 1
865 1 30 ILE MD 2 5 ILE HB . . 6.370 3.881 1.763 5.834 . 0 0 "[ . 1 . 2]" 1
866 1 30 ILE MD 2 5 ILE MD . . 7.560 4.535 2.922 5.927 . 0 0 "[ . 1 . 2]" 1
867 1 30 ILE MD 2 5 ILE HG12 . . 6.530 5.617 3.312 6.688 0.158 19 0 "[ . 1 . 2]" 1
868 1 30 ILE MD 2 5 ILE HG13 . . 6.530 4.903 2.951 5.799 . 0 0 "[ . 1 . 2]" 1
869 1 30 ILE MD 2 7 ALA H . . 6.530 3.815 3.200 4.455 . 0 0 "[ . 1 . 2]" 1
870 1 30 ILE MD 2 7 ALA MB . . 7.250 2.175 1.803 2.583 . 0 0 "[ . 1 . 2]" 1
871 1 30 ILE MD 2 14 PHE HB2 . . 5.850 4.224 3.593 5.243 . 0 0 "[ . 1 . 2]" 1
872 1 30 ILE MD 2 14 PHE HB3 . . 5.850 3.419 2.716 4.489 . 0 0 "[ . 1 . 2]" 1
873 1 30 ILE MD 2 14 PHE QD . . 8.340 3.725 2.412 5.349 . 0 0 "[ . 1 . 2]" 1
874 1 30 ILE MD 2 30 ILE QG . . 6.790 3.428 1.957 4.569 . 0 0 "[ . 1 . 2]" 1
875 1 30 ILE QG 1 32 LEU MD2 . . 6.760 6.287 4.439 7.086 0.326 17 0 "[ . 1 . 2]" 1
876 1 30 ILE QG 2 5 ILE H . . 6.380 3.810 3.150 4.557 . 0 0 "[ . 1 . 2]" 1
877 1 30 ILE QG 2 5 ILE HB . . 4.860 2.850 2.097 4.254 . 0 0 "[ . 1 . 2]" 1
878 1 30 ILE QG 2 5 ILE MD . . 7.130 3.880 2.462 5.860 . 0 0 "[ . 1 . 2]" 1
879 1 30 ILE QG 2 5 ILE QG . . 6.320 3.815 2.095 4.943 . 0 0 "[ . 1 . 2]" 1
880 1 30 ILE QG 2 7 ALA MB . . 6.510 2.814 2.324 3.551 . 0 0 "[ . 1 . 2]" 1
881 1 30 ILE QG 2 30 ILE MD . . 6.790 3.878 1.939 5.719 . 0 0 "[ . 1 . 2]" 1
882 1 30 ILE HG12 1 31 LYS H . . 5.500 4.988 4.500 5.179 . 0 0 "[ . 1 . 2]" 1
883 1 30 ILE HG12 2 5 ILE HB . . 5.220 3.388 2.234 4.820 . 0 0 "[ . 1 . 2]" 1
884 1 30 ILE HG12 2 5 ILE HG12 . . 7.250 5.528 3.642 7.352 0.102 1 0 "[ . 1 . 2]" 1
885 1 30 ILE HG12 2 5 ILE HG13 . . 7.250 4.761 2.425 6.835 . 0 0 "[ . 1 . 2]" 1
886 1 30 ILE HG13 1 31 LYS H . . 5.500 5.280 5.005 5.511 0.011 8 0 "[ . 1 . 2]" 1
887 1 30 ILE HG13 2 5 ILE HB . . 5.220 3.187 2.452 4.930 . 0 0 "[ . 1 . 2]" 1
888 1 30 ILE HG13 2 5 ILE HG12 . . 7.250 5.248 3.534 6.282 . 0 0 "[ . 1 . 2]" 1
889 1 30 ILE HG13 2 5 ILE HG13 . . 7.250 4.468 2.348 5.999 . 0 0 "[ . 1 . 2]" 1
890 1 30 ILE MG 1 31 LYS H . . 5.160 2.385 2.159 2.579 . 0 0 "[ . 1 . 2]" 1
891 1 30 ILE MG 1 32 LEU H . . 6.530 4.636 3.827 5.301 . 0 0 "[ . 1 . 2]" 1
892 1 30 ILE MG 1 32 LEU HA . . 5.660 4.372 3.638 5.005 . 0 0 "[ . 1 . 2]" 1
893 1 30 ILE MG 1 32 LEU HB2 . . 6.530 5.782 4.082 6.471 . 0 0 "[ . 1 . 2]" 1
894 1 30 ILE MG 1 32 LEU HB3 . . 6.530 5.857 3.866 6.596 0.066 20 0 "[ . 1 . 2]" 1
895 1 30 ILE MG 1 32 LEU MD1 . . 7.560 4.321 2.796 5.649 . 0 0 "[ . 1 . 2]" 1
896 1 30 ILE MG 1 32 LEU MD2 . . 7.310 4.096 3.240 5.349 . 0 0 "[ . 1 . 2]" 1
897 1 30 ILE MG 1 32 LEU HG . . 6.120 5.059 3.576 6.289 0.169 20 0 "[ . 1 . 2]" 1
898 1 30 ILE MG 1 33 GLU H . . 6.470 5.899 5.215 6.569 0.099 4 0 "[ . 1 . 2]" 1
899 1 30 ILE MG 2 5 ILE HB . . 5.940 4.013 3.391 5.516 . 0 0 "[ . 1 . 2]" 1
900 1 30 ILE MG 2 5 ILE MD . . 7.560 3.696 2.600 5.251 . 0 0 "[ . 1 . 2]" 1
901 1 30 ILE MG 2 5 ILE HG12 . . 6.530 4.851 3.348 6.393 . 0 0 "[ . 1 . 2]" 1
902 1 30 ILE MG 2 5 ILE HG13 . . 6.530 4.118 3.430 5.113 . 0 0 "[ . 1 . 2]" 1
903 1 30 ILE MG 2 7 ALA MB . . 7.560 4.441 4.071 4.854 . 0 0 "[ . 1 . 2]" 1
904 1 30 ILE MG 2 14 PHE QD . . 8.650 5.642 4.571 6.479 . 0 0 "[ . 1 . 2]" 1
905 1 31 LYS H 1 31 LYS HB2 . . 3.520 3.377 2.430 3.908 0.388 10 0 "[ . 1 . 2]" 1
906 1 31 LYS H 1 31 LYS HB3 . . 3.520 3.314 2.643 3.790 0.270 9 0 "[ . 1 . 2]" 1
907 1 31 LYS H 1 31 LYS HD2 . . 5.500 4.227 1.781 5.631 0.131 2 0 "[ . 1 . 2]" 1
908 1 31 LYS H 1 31 LYS HD3 . . 5.500 4.701 3.455 5.527 0.027 19 0 "[ . 1 . 2]" 1
909 1 31 LYS H 1 31 LYS HG2 . . 4.910 3.553 2.181 4.883 . 0 0 "[ . 1 . 2]" 1
910 1 31 LYS H 1 31 LYS HG3 . . 4.910 3.822 2.912 4.812 . 0 0 "[ . 1 . 2]" 1
911 1 31 LYS H 1 32 LEU H . . 5.500 4.277 4.013 4.444 . 0 0 "[ . 1 . 2]" 1
912 1 31 LYS HA 1 31 LYS HD2 . . 5.500 4.346 2.081 5.503 0.003 6 0 "[ . 1 . 2]" 1
913 1 31 LYS HA 1 31 LYS QD . . 4.980 3.868 2.054 4.522 . 0 0 "[ . 1 . 2]" 1
914 1 31 LYS HA 1 31 LYS HD3 . . 5.500 4.598 3.151 5.492 . 0 0 "[ . 1 . 2]" 1
915 1 31 LYS HA 1 31 LYS HG2 . . 3.700 3.461 2.487 3.864 0.164 17 0 "[ . 1 . 2]" 1
916 1 31 LYS HA 1 31 LYS HG3 . . 3.700 3.258 2.212 4.167 0.467 13 0 "[ . 1 . 2]" 1
917 1 31 LYS HA 1 32 LEU H . . 3.050 2.280 2.099 2.509 . 0 0 "[ . 1 . 2]" 1
918 1 31 LYS QB 1 32 LEU H . . 3.820 2.777 2.243 3.796 . 0 0 "[ . 1 . 2]" 1
919 1 31 LYS QB 2 4 ILE MD . . 6.220 5.190 3.444 5.882 . 0 0 "[ . 1 . 2]" 1
920 1 31 LYS QB 2 4 ILE MG . . 5.390 3.163 2.339 5.396 0.006 1 0 "[ . 1 . 2]" 1
921 1 31 LYS HB2 1 32 LEU H . . 4.260 3.217 2.262 4.333 0.073 5 0 "[ . 1 . 2]" 1
922 1 31 LYS HB2 2 4 ILE MD . . 6.530 6.050 4.260 6.733 0.203 9 0 "[ . 1 . 2]" 1
923 1 31 LYS HB3 1 32 LEU H . . 4.260 3.609 2.588 4.243 . 0 0 "[ . 1 . 2]" 1
924 1 31 LYS HB3 2 4 ILE MD . . 6.530 5.812 3.616 6.676 0.146 12 0 "[ . 1 . 2]" 1
925 1 31 LYS HD2 1 32 LEU H . . 5.500 5.240 2.649 5.813 0.313 16 0 "[ . 1 . 2]" 1
926 1 31 LYS HD3 1 32 LEU H . . 5.500 5.209 4.188 5.821 0.321 13 0 "[ . 1 . 2]" 1
927 1 31 LYS QE 2 4 ILE MD . . 7.400 4.668 2.501 6.942 . 0 0 "[ . 1 . 2]" 1
928 1 31 LYS QE 2 4 ILE QG . . 7.260 4.984 2.247 7.347 0.087 17 0 "[ . 1 . 2]" 1
929 1 31 LYS QG 1 32 LEU H . . 4.370 3.362 2.232 3.911 . 0 0 "[ . 1 . 2]" 1
930 1 31 LYS HG2 1 32 LEU H . . 4.570 4.111 2.356 4.745 0.175 20 0 "[ . 1 . 2]" 1
931 1 31 LYS HG3 1 32 LEU H . . 4.570 3.752 2.765 4.740 0.170 8 0 "[ . 1 . 2]" 1
932 1 32 LEU H 1 32 LEU HB2 . . 3.520 2.611 2.314 3.635 0.115 19 0 "[ . 1 . 2]" 1
933 1 32 LEU H 1 32 LEU HB3 . . 3.520 3.433 2.315 3.661 0.141 4 0 "[ . 1 . 2]" 1
934 1 32 LEU H 1 32 LEU MD1 . . 5.600 3.354 1.789 4.191 . 0 0 "[ . 1 . 2]" 1
935 1 32 LEU H 1 32 LEU HG . . 4.010 3.356 2.313 4.355 0.345 13 0 "[ . 1 . 2]" 1
936 1 32 LEU H 1 33 GLU H . . 5.500 4.452 4.318 4.620 . 0 0 "[ . 1 . 2]" 1
937 1 32 LEU HA 1 32 LEU HG . . 3.670 3.190 2.434 3.777 0.107 16 0 "[ . 1 . 2]" 1
938 1 32 LEU HA 1 33 GLU H . . 3.050 2.200 2.116 2.306 . 0 0 "[ . 1 . 2]" 1
939 1 32 LEU QB 1 33 GLU H . . 3.810 3.154 2.759 3.738 . 0 0 "[ . 1 . 2]" 1
940 1 32 LEU HB2 1 33 GLU H . . 4.110 4.032 2.912 4.275 0.165 15 0 "[ . 1 . 2]" 1
941 1 32 LEU HB3 1 33 GLU H . . 4.110 3.389 2.812 4.196 0.086 17 0 "[ . 1 . 2]" 1
942 1 32 LEU MD1 1 33 GLU H . . 6.430 4.282 1.808 5.360 . 0 0 "[ . 1 . 2]" 1
943 1 32 LEU MD1 2 28 VAL HB . . 6.530 4.719 3.234 6.244 . 0 0 "[ . 1 . 2]" 1
944 1 32 LEU MD2 1 33 GLU H . . 5.780 4.350 3.459 4.989 . 0 0 "[ . 1 . 2]" 1
945 1 32 LEU MD2 2 28 VAL HB . . 5.940 4.465 3.228 5.727 . 0 0 "[ . 1 . 2]" 1
946 1 32 LEU HG 1 33 GLU H . . 5.250 4.703 3.294 5.353 0.103 20 0 "[ . 1 . 2]" 1
947 1 33 GLU H 1 33 GLU HB2 . . 3.390 2.555 2.171 3.543 0.153 5 0 "[ . 1 . 2]" 1
948 1 33 GLU H 1 33 GLU HB3 . . 3.390 3.056 2.382 3.635 0.245 18 0 "[ . 1 . 2]" 1
949 1 33 GLU H 1 33 GLU HG2 . . 4.510 3.737 1.752 4.647 0.137 8 0 "[ . 1 . 2]" 1
950 1 33 GLU H 1 33 GLU HG3 . . 4.510 4.014 2.401 4.772 0.262 11 0 "[ . 1 . 2]" 1
951 1 33 GLU H 1 34 LEU H . . 5.500 4.503 4.312 4.604 . 0 0 "[ . 1 . 2]" 1
952 1 33 GLU HA 1 34 LEU H . . 3.050 2.185 1.980 2.620 . 0 0 "[ . 1 . 2]" 1
953 1 33 GLU QB 1 34 LEU H . . 3.560 3.100 1.954 3.582 0.022 14 0 "[ . 1 . 2]" 1
954 1 33 GLU HB2 1 34 LEU H . . 3.800 3.890 3.049 4.259 0.459 19 0 "[ . 1 . 2]" 1
955 1 33 GLU HB3 1 34 LEU H . . 3.800 3.354 1.971 4.078 0.278 14 0 "[ . 1 . 2]" 1
956 1 33 GLU HG2 1 34 LEU H . . 5.500 4.127 2.264 5.080 . 0 0 "[ . 1 . 2]" 1
957 1 33 GLU HG3 1 34 LEU H . . 5.500 3.640 2.296 5.340 . 0 0 "[ . 1 . 2]" 1
958 1 34 LEU H 1 34 LEU HB2 . . 3.670 2.984 2.304 3.963 0.293 17 0 "[ . 1 . 2]" 1
959 1 34 LEU H 1 34 LEU QB . . 3.320 2.745 2.277 3.314 . 0 0 "[ . 1 . 2]" 1
960 1 34 LEU H 1 34 LEU HB3 . . 3.670 3.611 2.778 3.977 0.307 2 0 "[ . 1 . 2]" 1
961 1 34 LEU H 1 34 LEU MD2 . . 5.470 3.446 1.761 4.510 . 0 0 "[ . 1 . 2]" 1
962 1 34 LEU H 1 34 LEU HG . . 3.730 3.145 1.899 4.044 0.314 19 0 "[ . 1 . 2]" 1
963 1 34 LEU H 1 35 LYS H . . 5.500 4.414 4.268 4.604 . 0 0 "[ . 1 . 2]" 1
964 1 34 LEU HA 1 34 LEU HG . . 3.450 3.078 2.485 3.693 0.243 9 0 "[ . 1 . 2]" 1
965 1 34 LEU HA 1 35 LYS H . . 3.050 2.513 2.196 2.821 . 0 0 "[ . 1 . 2]" 1
966 1 34 LEU QB 1 35 LYS H . . 3.620 2.128 1.736 2.660 . 0 0 "[ . 1 . 2]" 1
967 1 34 LEU HB2 1 35 LYS H . . 3.800 3.084 1.755 3.854 0.054 7 0 "[ . 1 . 2]" 1
968 1 34 LEU HB3 1 35 LYS H . . 3.800 2.497 1.752 3.851 0.051 1 0 "[ . 1 . 2]" 1
969 1 34 LEU MD1 1 35 LYS H . . 5.350 3.922 2.884 4.828 . 0 0 "[ . 1 . 2]" 1
970 1 34 LEU MD2 1 35 LYS H . . 5.630 3.535 2.709 4.706 . 0 0 "[ . 1 . 2]" 1
971 1 34 LEU HG 1 35 LYS H . . 4.320 4.291 2.848 4.553 0.233 11 0 "[ . 1 . 2]" 1
972 1 35 LYS H 1 35 LYS HB2 . . 3.360 2.846 2.281 3.609 0.249 14 0 "[ . 1 . 2]" 1
973 1 35 LYS H 1 35 LYS QB . . 3.150 2.513 2.254 3.120 . 0 0 "[ . 1 . 2]" 1
974 1 35 LYS H 1 35 LYS HB3 . . 3.360 3.208 2.453 3.685 0.325 11 0 "[ . 1 . 2]" 1
975 1 35 LYS H 1 35 LYS HG2 . . 4.850 3.741 2.058 4.896 0.046 17 0 "[ . 1 . 2]" 1
976 1 35 LYS H 1 35 LYS QG . . 4.350 3.145 1.748 4.153 . 0 0 "[ . 1 . 2]" 1
977 1 35 LYS H 1 35 LYS HG3 . . 4.850 3.575 1.754 4.739 . 0 0 "[ . 1 . 2]" 1
978 1 35 LYS H 1 36 VAL H . . 5.500 4.436 3.917 4.543 . 0 0 "[ . 1 . 2]" 1
979 1 35 LYS HA 1 35 LYS HG2 . . 4.140 3.242 2.392 3.871 . 0 0 "[ . 1 . 2]" 1
980 1 35 LYS HA 1 35 LYS HG3 . . 4.140 3.087 2.401 3.804 . 0 0 "[ . 1 . 2]" 1
981 1 35 LYS HA 1 36 VAL H . . 3.020 2.467 2.242 3.108 0.088 8 0 "[ . 1 . 2]" 1
982 1 35 LYS QB 1 36 VAL H . . 3.500 2.528 1.870 3.371 . 0 0 "[ . 1 . 2]" 1
983 1 35 LYS HB2 1 36 VAL H . . 3.700 3.387 2.178 3.887 0.187 19 0 "[ . 1 . 2]" 1
984 1 35 LYS HB3 1 36 VAL H . . 3.700 2.911 1.883 3.735 0.035 18 0 "[ . 1 . 2]" 1
985 1 35 LYS QG 1 36 VAL H . . 4.980 3.291 1.730 4.541 . 0 0 "[ . 1 . 2]" 1
986 1 35 LYS HG2 1 36 VAL H . . 5.220 3.953 1.737 5.328 0.108 12 0 "[ . 1 . 2]" 1
987 1 35 LYS HG3 1 36 VAL H . . 5.220 3.812 2.093 5.067 . 0 0 "[ . 1 . 2]" 1
988 1 36 VAL H 1 36 VAL HB . . 2.830 2.753 2.555 3.316 0.486 11 0 "[ . 1 . 2]" 1
989 1 36 VAL H 1 37 GLU H . . 5.500 4.520 4.228 4.623 . 0 0 "[ . 1 . 2]" 1
990 1 36 VAL HA 1 37 GLU H . . 2.520 2.233 2.085 2.505 . 0 0 "[ . 1 . 2]" 1
991 1 36 VAL HB 1 37 GLU H . . 3.800 3.905 3.438 4.032 0.232 12 0 "[ . 1 . 2]" 1
992 1 36 VAL QG 1 37 GLU H . . 5.580 2.255 1.771 2.612 . 0 0 "[ . 1 . 2]" 1
993 1 36 VAL MG1 1 37 GLU H . . 6.500 3.027 1.774 4.151 . 0 0 "[ . 1 . 2]" 1
994 1 36 VAL MG2 1 37 GLU H . . 6.500 3.116 1.799 4.170 . 0 0 "[ . 1 . 2]" 1
995 1 37 GLU H 1 37 GLU HB2 . . 3.330 2.995 2.140 3.817 0.487 18 0 "[ . 1 . 2]" 1
996 1 37 GLU H 1 37 GLU QB . . 2.980 2.528 2.120 3.027 0.047 12 0 "[ . 1 . 2]" 1
997 1 37 GLU H 1 37 GLU HB3 . . 3.330 3.137 2.592 3.607 0.277 9 0 "[ . 1 . 2]" 1
998 1 37 GLU H 1 37 GLU HG2 . . 4.720 2.935 1.816 4.436 . 0 0 "[ . 1 . 2]" 1
999 1 37 GLU H 1 37 GLU QG . . 4.520 2.585 1.799 4.066 . 0 0 "[ . 1 . 2]" 1
1000 1 37 GLU H 1 37 GLU HG3 . . 4.720 3.322 2.157 4.723 0.003 3 0 "[ . 1 . 2]" 1
1001 1 37 GLU HA 1 37 GLU HG2 . . 3.830 3.267 2.326 3.796 . 0 0 "[ . 1 . 2]" 1
1002 1 37 GLU HA 1 37 GLU HG3 . . 3.830 3.465 2.524 4.191 0.361 14 0 "[ . 1 . 2]" 1
1003 1 38 PRO HA 1 39 ILE H . . 2.990 2.563 2.398 2.845 . 0 0 "[ . 1 . 2]" 1
1004 1 38 PRO HB2 1 39 ILE H . . 3.700 2.344 1.837 2.952 . 0 0 "[ . 1 . 2]" 1
1005 1 38 PRO HB3 1 39 ILE H . . 3.700 3.099 2.466 3.466 . 0 0 "[ . 1 . 2]" 1
1006 1 38 PRO HD2 1 39 ILE H . . 5.500 5.151 4.402 5.527 0.027 20 0 "[ . 1 . 2]" 1
1007 1 38 PRO HD3 1 39 ILE H . . 5.500 5.525 5.387 5.641 0.141 13 0 "[ . 1 . 2]" 1
1008 1 38 PRO HG2 1 39 ILE H . . 5.500 4.301 3.863 4.914 . 0 0 "[ . 1 . 2]" 1
1009 1 38 PRO HG3 1 39 ILE H . . 5.500 4.793 4.558 5.003 . 0 0 "[ . 1 . 2]" 1
1010 1 39 ILE H 1 39 ILE HB . . 3.450 3.335 2.623 3.703 0.253 19 0 "[ . 1 . 2]" 1
1011 1 39 ILE H 1 39 ILE MD . . 5.630 3.352 1.753 3.915 . 0 0 "[ . 1 . 2]" 1
1012 1 39 ILE H 1 39 ILE HG12 . . 3.980 2.733 1.868 3.964 . 0 0 "[ . 1 . 2]" 1
1013 1 39 ILE H 1 39 ILE HG13 . . 3.980 2.496 1.710 3.159 . 0 0 "[ . 1 . 2]" 1
1014 1 39 ILE HA 1 39 ILE HG12 . . 4.260 3.544 2.652 4.230 . 0 0 "[ . 1 . 2]" 1
1015 1 39 ILE HA 1 39 ILE HG13 . . 4.260 3.494 2.529 3.756 . 0 0 "[ . 1 . 2]" 1
1016 1 39 ILE HA 1 40 ASP H . . 2.460 2.327 2.154 2.512 0.052 11 0 "[ . 1 . 2]" 1
1017 1 39 ILE HB 1 40 ASP H . . 3.580 2.849 2.099 3.779 0.199 3 0 "[ . 1 . 2]" 1
1018 1 39 ILE MD 1 40 ASP H . . 5.880 4.369 3.570 5.000 . 0 0 "[ . 1 . 2]" 1
1019 1 39 ILE QG 1 40 ASP H . . 5.350 3.976 3.337 4.631 . 0 0 "[ . 1 . 2]" 1
1020 1 39 ILE HG12 1 40 ASP H . . 5.500 4.758 4.401 5.297 . 0 0 "[ . 1 . 2]" 1
1021 1 39 ILE HG13 1 40 ASP H . . 5.500 4.375 3.436 5.111 . 0 0 "[ . 1 . 2]" 1
1022 1 39 ILE MG 1 40 ASP H . . 5.940 3.061 1.986 3.655 . 0 0 "[ . 1 . 2]" 1
1023 1 40 ASP H 1 40 ASP HB2 . . 3.300 2.891 2.199 3.585 0.285 15 0 "[ . 1 . 2]" 1
1024 1 40 ASP H 1 40 ASP QB . . 3.010 2.477 2.176 2.817 . 0 0 "[ . 1 . 2]" 1
1025 1 40 ASP H 1 40 ASP HB3 . . 3.300 2.820 2.453 3.549 0.249 2 0 "[ . 1 . 2]" 1
1026 1 41 LEU H 1 41 LEU QB . . 3.920 2.574 2.163 3.173 . 0 0 "[ . 1 . 2]" 1
1027 1 41 LEU HA 1 41 LEU MD2 . . 4.330 3.571 1.983 4.073 . 0 0 "[ . 1 . 2]" 1
1028 1 41 LEU HA 1 42 GLY H . . 3.050 2.375 2.136 2.839 . 0 0 "[ . 1 . 2]" 1
1029 1 41 LEU HB2 1 42 GLY H . . 4.510 3.236 1.832 4.536 0.026 17 0 "[ . 1 . 2]" 1
1030 1 41 LEU HB3 1 42 GLY H . . 4.510 3.590 2.066 4.222 . 0 0 "[ . 1 . 2]" 1
1031 1 41 LEU MD1 1 42 GLY H . . 6.530 3.470 2.085 4.982 . 0 0 "[ . 1 . 2]" 1
1032 1 41 LEU MD2 1 42 GLY H . . 6.530 4.122 2.718 4.881 . 0 0 "[ . 1 . 2]" 1
1033 1 42 GLY H 1 43 GLU H . . 4.010 4.081 3.503 4.448 0.438 16 0 "[ . 1 . 2]" 1
1034 1 42 GLY QA 1 43 GLU H . . 2.890 2.104 2.020 2.178 . 0 0 "[ . 1 . 2]" 1
1035 1 42 GLY HA2 1 43 GLU H . . 3.140 2.541 2.041 3.271 0.131 8 0 "[ . 1 . 2]" 1
1036 1 42 GLY HA3 1 43 GLU H . . 3.140 2.668 2.085 3.280 0.140 3 0 "[ . 1 . 2]" 1
1037 1 43 GLU H 1 43 GLU HB2 . . 3.490 3.052 2.307 3.716 0.226 10 0 "[ . 1 . 2]" 1
1038 1 43 GLU H 1 43 GLU QB . . 3.070 2.639 2.279 3.112 0.042 10 0 "[ . 1 . 2]" 1
1039 1 43 GLU H 1 43 GLU HB3 . . 3.490 3.255 2.507 3.747 0.257 17 0 "[ . 1 . 2]" 1
1040 1 43 GLU H 1 43 GLU HG2 . . 5.470 3.049 1.860 4.440 . 0 0 "[ . 1 . 2]" 1
1041 1 43 GLU H 1 43 GLU HG3 . . 5.470 3.017 2.086 4.553 . 0 0 "[ . 1 . 2]" 1
1042 1 43 GLU HA 1 43 GLU HB2 . . 2.960 2.755 2.453 3.013 0.053 17 0 "[ . 1 . 2]" 1
1043 1 43 GLU HA 1 43 GLU HB3 . . 2.960 2.442 2.323 3.015 0.055 14 0 "[ . 1 . 2]" 1
1044 1 44 PRO HA 1 45 VAL H . . 3.050 2.319 2.130 2.597 . 0 0 "[ . 1 . 2]" 1
1045 1 44 PRO QB 1 45 VAL H . . 3.820 2.900 2.113 3.554 . 0 0 "[ . 1 . 2]" 1
1046 1 44 PRO HB2 1 45 VAL H . . 4.010 3.201 2.135 4.022 0.012 14 0 "[ . 1 . 2]" 1
1047 1 44 PRO HB3 1 45 VAL H . . 4.010 3.471 2.639 4.055 0.045 20 0 "[ . 1 . 2]" 1
1048 1 44 PRO QD 1 45 VAL H . . 5.590 4.852 4.651 4.986 . 0 0 "[ . 1 . 2]" 1
1049 1 45 VAL H 1 45 VAL HB . . 3.140 2.818 2.629 3.170 0.030 15 0 "[ . 1 . 2]" 1
1050 1 45 VAL HA 1 46 SER H . . 2.490 2.293 2.156 2.394 . 0 0 "[ . 1 . 2]" 1
1051 1 45 VAL HB 1 46 SER H . . 3.450 3.634 3.497 3.780 0.330 15 0 "[ . 1 . 2]" 1
1052 1 45 VAL MG1 1 46 SER H . . 4.980 2.673 1.903 3.939 . 0 0 "[ . 1 . 2]" 1
1053 1 45 VAL MG2 1 46 SER H . . 6.000 3.222 1.756 4.092 . 0 0 "[ . 1 . 2]" 1
1054 1 46 SER H 1 46 SER HB2 . . 3.490 2.696 2.404 3.611 0.121 4 0 "[ . 1 . 2]" 1
1055 1 46 SER H 1 46 SER QB . . 3.220 2.571 2.371 3.104 . 0 0 "[ . 1 . 2]" 1
1056 1 46 SER H 1 46 SER HB3 . . 3.490 3.571 3.037 3.722 0.232 15 0 "[ . 1 . 2]" 1
1057 1 46 SER HA 1 47 VAL H . . 2.650 2.508 2.281 2.705 0.055 11 0 "[ . 1 . 2]" 1
1058 1 46 SER HB2 1 47 VAL H . . 3.330 3.159 2.086 3.476 0.146 19 0 "[ . 1 . 2]" 1
1059 1 46 SER HB3 1 47 VAL H . . 3.330 2.446 1.900 3.449 0.119 20 0 "[ . 1 . 2]" 1
1060 1 47 VAL H 1 47 VAL HB . . 2.990 2.890 2.456 3.379 0.389 7 0 "[ . 1 . 2]" 1
1061 1 47 VAL HA 1 48 GLU H . . 3.080 2.272 2.081 3.198 0.118 6 0 "[ . 1 . 2]" 1
1062 1 47 VAL HB 1 48 GLU H . . 4.070 4.066 3.812 4.284 0.214 20 0 "[ . 1 . 2]" 1
1063 1 47 VAL QG 1 48 GLU H . . 6.210 2.410 1.777 3.185 . 0 0 "[ . 1 . 2]" 1
1064 1 47 VAL MG1 1 48 GLU H . . 6.530 3.251 2.196 4.116 . 0 0 "[ . 1 . 2]" 1
1065 1 47 VAL MG2 1 48 GLU H . . 6.530 3.020 1.787 4.318 . 0 0 "[ . 1 . 2]" 1
1066 1 48 GLU H 1 48 GLU HB2 . . 3.760 2.908 2.341 3.725 . 0 0 "[ . 1 . 2]" 1
1067 1 48 GLU H 1 48 GLU HB3 . . 3.760 3.289 2.464 4.040 0.280 15 0 "[ . 1 . 2]" 1
1068 1 48 GLU H 1 48 GLU HG2 . . 4.820 3.454 1.839 4.863 0.043 12 0 "[ . 1 . 2]" 1
1069 1 48 GLU H 1 48 GLU HG3 . . 4.820 3.362 2.113 5.007 0.187 2 0 "[ . 1 . 2]" 1
1070 1 48 GLU H 1 49 GLU H . . 4.480 3.781 1.704 4.553 0.073 13 0 "[ . 1 . 2]" 1
1071 1 48 GLU HA 1 49 GLU H . . 3.360 2.559 2.027 3.495 0.135 15 0 "[ . 1 . 2]" 1
1072 1 48 GLU QB 1 49 GLU H . . 3.820 3.087 1.975 3.773 . 0 0 "[ . 1 . 2]" 1
1073 1 48 GLU HB2 1 49 GLU H . . 4.010 3.888 2.841 4.263 0.253 20 0 "[ . 1 . 2]" 1
1074 1 48 GLU HB3 1 49 GLU H . . 4.010 3.371 1.988 4.208 0.198 20 0 "[ . 1 . 2]" 1
1075 1 48 GLU QG 1 49 GLU H . . 5.330 3.773 2.222 4.478 . 0 0 "[ . 1 . 2]" 1
1076 1 48 GLU HG2 1 49 GLU H . . 5.500 4.285 2.723 5.562 0.062 6 0 "[ . 1 . 2]" 1
1077 1 48 GLU HG3 1 49 GLU H . . 5.500 4.319 2.355 5.272 . 0 0 "[ . 1 . 2]" 1
1078 1 49 GLU H 1 49 GLU HB2 . . 4.070 2.955 2.443 3.665 . 0 0 "[ . 1 . 2]" 1
1079 1 49 GLU H 1 49 GLU QB . . 3.880 2.478 2.229 2.802 . 0 0 "[ . 1 . 2]" 1
1080 1 49 GLU H 1 49 GLU HB3 . . 4.070 2.878 2.409 3.628 . 0 0 "[ . 1 . 2]" 1
1081 1 49 GLU HA 1 50 ILE H . . 3.330 3.425 3.386 3.482 0.152 1 0 "[ . 1 . 2]" 1
1082 1 49 GLU QB 1 50 ILE H . . 4.390 3.138 2.689 3.675 . 0 0 "[ . 1 . 2]" 1
1083 1 49 GLU HB2 1 50 ILE H . . 4.690 3.749 3.001 4.087 . 0 0 "[ . 1 . 2]" 1
1084 1 49 GLU HB3 1 50 ILE H . . 4.690 3.615 2.742 4.222 . 0 0 "[ . 1 . 2]" 1
1085 1 49 GLU QG 1 50 ILE H . . 6.380 3.510 2.299 4.425 . 0 0 "[ . 1 . 2]" 1
1086 1 50 ILE H 1 50 ILE HB . . 3.980 2.773 2.494 3.619 . 0 0 "[ . 1 . 2]" 1
1087 1 50 ILE H 1 50 ILE HG12 . . 4.850 3.169 1.864 4.541 . 0 0 "[ . 1 . 2]" 1
1088 1 50 ILE H 1 50 ILE QG . . 4.700 2.571 1.792 4.029 . 0 0 "[ . 1 . 2]" 1
1089 1 50 ILE H 1 50 ILE HG13 . . 4.850 3.189 1.804 4.566 . 0 0 "[ . 1 . 2]" 1
1090 1 50 ILE HA 1 51 LYS H . . 3.210 3.287 3.067 3.392 0.182 12 0 "[ . 1 . 2]" 1
1091 1 50 ILE HB 1 51 LYS H . . 4.230 3.792 3.179 4.318 0.088 3 0 "[ . 1 . 2]" 1
1092 1 50 ILE MD 1 51 LYS H . . 6.530 4.974 4.504 5.325 . 0 0 "[ . 1 . 2]" 1
1093 1 50 ILE HG12 1 51 LYS H . . 5.500 4.553 3.568 5.167 . 0 0 "[ . 1 . 2]" 1
1094 1 50 ILE HG13 1 51 LYS H . . 5.500 4.641 3.244 5.526 0.026 14 0 "[ . 1 . 2]" 1
1095 1 50 ILE MG 1 51 LYS H . . 6.530 3.738 2.730 4.312 . 0 0 "[ . 1 . 2]" 1
1096 1 51 LYS H 1 51 LYS HB2 . . 3.170 2.670 2.050 3.549 0.379 12 0 "[ . 1 . 2]" 1
1097 1 51 LYS H 1 51 LYS QB . . 2.980 2.303 2.010 2.556 . 0 0 "[ . 1 . 2]" 1
1098 1 51 LYS H 1 51 LYS HB3 . . 3.170 2.699 2.235 3.573 0.403 17 0 "[ . 1 . 2]" 1
1099 1 51 LYS H 1 51 LYS HG2 . . 5.030 4.274 2.134 4.681 . 0 0 "[ . 1 . 2]" 1
1100 1 51 LYS H 1 51 LYS QG . . 4.800 3.739 2.096 4.107 . 0 0 "[ . 1 . 2]" 1
1101 1 51 LYS H 1 51 LYS HG3 . . 5.030 4.229 2.689 4.803 . 0 0 "[ . 1 . 2]" 1
1102 1 51 LYS HA 1 51 LYS HG2 . . 4.170 3.044 2.306 3.823 . 0 0 "[ . 1 . 2]" 1
1103 1 51 LYS HA 1 51 LYS QG . . 3.980 2.548 2.212 3.428 . 0 0 "[ . 1 . 2]" 1
1104 1 51 LYS HA 1 51 LYS HG3 . . 4.170 2.887 2.296 4.218 0.048 13 0 "[ . 1 . 2]" 1
1105 1 51 LYS HA 1 52 LYS H . . 3.140 2.325 2.159 3.251 0.111 9 0 "[ . 1 . 2]" 1
1106 1 51 LYS QB 1 52 LYS H . . 3.850 3.444 2.668 3.750 . 0 0 "[ . 1 . 2]" 1
1107 1 51 LYS HB2 1 52 LYS H . . 4.200 4.087 3.106 4.337 0.137 20 0 "[ . 1 . 2]" 1
1108 1 51 LYS HB3 1 52 LYS H . . 4.200 3.820 2.713 4.245 0.045 13 0 "[ . 1 . 2]" 1
1109 1 51 LYS QG 1 52 LYS H . . 5.110 3.095 1.787 4.345 . 0 0 "[ . 1 . 2]" 1
1110 1 51 LYS HG2 1 52 LYS H . . 5.340 3.456 1.802 5.423 0.083 1 0 "[ . 1 . 2]" 1
1111 1 51 LYS HG3 1 52 LYS H . . 5.340 3.771 2.815 5.412 0.072 9 0 "[ . 1 . 2]" 1
1112 1 52 LYS H 1 52 LYS HB2 . . 3.390 3.426 2.315 3.816 0.426 4 0 "[ . 1 . 2]" 1
1113 1 52 LYS H 1 52 LYS HB3 . . 3.390 3.277 2.328 4.046 0.656 1 2 "[+ . 1 - 2]" 1
1114 1 52 LYS H 1 52 LYS HD2 . . 5.500 4.497 2.343 5.635 0.135 14 0 "[ . 1 . 2]" 1
1115 1 52 LYS H 1 52 LYS HD3 . . 5.500 4.358 1.727 6.459 0.959 14 1 "[ . 1 +. 2]" 1
1116 1 52 LYS H 1 52 LYS HG2 . . 5.500 3.209 1.978 5.203 . 0 0 "[ . 1 . 2]" 1
1117 1 52 LYS H 1 52 LYS HG3 . . 5.500 3.488 2.430 4.860 . 0 0 "[ . 1 . 2]" 1
1118 1 52 LYS HA 1 52 LYS HD2 . . 5.500 4.483 2.938 5.514 0.014 4 0 "[ . 1 . 2]" 1
1119 1 52 LYS HA 1 52 LYS HD3 . . 5.500 4.545 1.942 5.536 0.036 5 0 "[ . 1 . 2]" 1
1120 1 52 LYS HA 1 53 ILE H . . 2.870 2.296 2.107 2.934 0.064 7 0 "[ . 1 . 2]" 1
1121 1 52 LYS QB 1 53 ILE H . . 3.970 2.963 1.769 3.922 . 0 0 "[ . 1 . 2]" 1
1122 1 52 LYS HB2 1 53 ILE H . . 4.350 3.338 1.776 4.436 0.086 1 0 "[ . 1 . 2]" 1
1123 1 52 LYS HB3 1 53 ILE H . . 4.350 3.762 2.422 4.419 0.069 14 0 "[ . 1 . 2]" 1
1124 1 52 LYS QG 1 53 ILE H . . 6.380 3.583 2.104 4.468 . 0 0 "[ . 1 . 2]" 1
1125 1 53 ILE H 1 53 ILE HB . . 3.240 2.925 2.346 3.535 0.295 3 0 "[ . 1 . 2]" 1
1126 1 53 ILE H 1 53 ILE HG12 . . 4.110 3.781 1.923 4.480 0.370 14 0 "[ . 1 . 2]" 1
1127 1 53 ILE H 1 53 ILE QG . . 3.930 3.052 1.848 3.873 . 0 0 "[ . 1 . 2]" 1
1128 1 53 ILE H 1 53 ILE HG13 . . 4.110 3.394 1.868 4.482 0.372 15 0 "[ . 1 . 2]" 1
1129 1 53 ILE HA 1 53 ILE HG12 . . 3.800 3.098 2.396 4.029 0.229 19 0 "[ . 1 . 2]" 1
1130 1 53 ILE HA 1 53 ILE QG . . 3.560 2.511 2.264 3.271 . 0 0 "[ . 1 . 2]" 1
1131 1 53 ILE HA 1 53 ILE HG13 . . 3.800 2.827 2.356 3.763 . 0 0 "[ . 1 . 2]" 1
1132 1 54 ARG H 1 54 ARG HB2 . . 3.670 3.024 2.245 3.845 0.175 1 0 "[ . 1 . 2]" 1
1133 1 54 ARG H 1 54 ARG HB3 . . 3.670 2.986 2.327 3.687 0.017 3 0 "[ . 1 . 2]" 1
1134 1 54 ARG H 1 54 ARG HG2 . . 4.630 3.667 2.069 4.622 . 0 0 "[ . 1 . 2]" 1
1135 1 54 ARG H 1 54 ARG QG . . 4.390 3.184 2.010 4.156 . 0 0 "[ . 1 . 2]" 1
1136 1 54 ARG H 1 54 ARG HG3 . . 4.630 3.710 2.154 4.711 0.081 13 0 "[ . 1 . 2]" 1
1137 1 54 ARG HA 1 54 ARG HD2 . . 5.500 4.438 2.007 5.511 0.011 10 0 "[ . 1 . 2]" 1
1138 1 54 ARG HA 1 54 ARG HD3 . . 5.500 4.612 3.571 5.535 0.035 15 0 "[ . 1 . 2]" 1
1139 1 55 ASP HA 1 56 GLY H . . 3.020 2.358 2.163 2.764 . 0 0 "[ . 1 . 2]" 1
1140 1 55 ASP QB 1 56 GLY H . . 3.470 2.809 1.986 3.438 . 0 0 "[ . 1 . 2]" 1
1141 1 55 ASP HB2 1 56 GLY H . . 3.760 3.430 2.191 3.922 0.162 14 0 "[ . 1 . 2]" 1
1142 1 55 ASP HB3 1 56 GLY H . . 3.760 3.328 1.999 3.910 0.150 13 0 "[ . 1 . 2]" 1
1143 1 56 GLY HA2 1 57 THR H . . 3.580 2.497 2.125 3.563 . 0 0 "[ . 1 . 2]" 1
1144 1 56 GLY HA3 1 57 THR H . . 3.580 3.214 2.204 3.550 . 0 0 "[ . 1 . 2]" 1
1145 1 57 THR H 1 57 THR HB . . 3.390 3.055 2.564 3.600 0.210 5 0 "[ . 1 . 2]" 1
1146 1 57 THR HA 1 58 TRP H . . 3.020 2.261 2.116 2.795 . 0 0 "[ . 1 . 2]" 1
1147 1 57 THR HB 1 58 TRP H . . 3.830 3.821 3.350 3.967 0.137 13 0 "[ . 1 . 2]" 1
1148 1 57 THR MG 1 58 TRP H . . 6.530 3.098 2.288 4.015 . 0 0 "[ . 1 . 2]" 1
1149 1 58 TRP H 1 58 TRP HB2 . . 3.140 2.900 2.292 3.443 0.303 2 0 "[ . 1 . 2]" 1
1150 1 58 TRP H 1 58 TRP QB . . 2.950 2.528 2.263 2.921 . 0 0 "[ . 1 . 2]" 1
1151 1 58 TRP H 1 58 TRP HB3 . . 3.140 2.881 2.560 3.506 0.366 12 0 "[ . 1 . 2]" 1
1152 1 58 TRP H 1 58 TRP HD1 . . 5.500 4.868 2.790 5.452 . 0 0 "[ . 1 . 2]" 1
1153 1 58 TRP HA 1 59 MET H . . 2.930 2.277 2.161 2.553 . 0 0 "[ . 1 . 2]" 1
1154 1 58 TRP QB 1 59 MET H . . 3.940 3.344 2.263 3.684 . 0 0 "[ . 1 . 2]" 1
1155 1 58 TRP HB2 1 59 MET H . . 4.170 3.999 2.301 4.251 0.081 14 0 "[ . 1 . 2]" 1
1156 1 58 TRP HB3 1 59 MET H . . 4.170 3.655 2.537 4.102 . 0 0 "[ . 1 . 2]" 1
1157 1 59 MET H 1 59 MET HB2 . . 4.110 2.963 2.424 4.002 . 0 0 "[ . 1 . 2]" 1
1158 1 59 MET H 1 59 MET QB . . 3.680 2.554 2.231 3.278 . 0 0 "[ . 1 . 2]" 1
1159 1 59 MET H 1 59 MET HB3 . . 4.110 3.017 2.415 4.153 0.043 2 0 "[ . 1 . 2]" 1
1160 1 59 MET H 1 59 MET HG2 . . 5.100 3.912 2.167 4.921 . 0 0 "[ . 1 . 2]" 1
1161 1 59 MET H 1 59 MET QG . . 4.760 3.441 2.118 4.183 . 0 0 "[ . 1 . 2]" 1
1162 1 59 MET H 1 59 MET HG3 . . 5.100 4.027 2.590 4.863 . 0 0 "[ . 1 . 2]" 1
1163 1 59 MET HA 1 60 SER H . . 3.050 2.252 2.106 2.843 . 0 0 "[ . 1 . 2]" 1
1164 1 59 MET QB 1 60 SER H . . 3.790 3.194 1.761 3.809 0.019 17 0 "[ . 1 . 2]" 1
1165 1 59 MET HB2 1 60 SER H . . 4.380 3.843 2.847 4.306 . 0 0 "[ . 1 . 2]" 1
1166 1 59 MET HB3 1 60 SER H . . 4.380 3.616 1.775 4.315 . 0 0 "[ . 1 . 2]" 1
1167 1 59 MET QG 1 60 SER H . . 6.380 3.272 1.869 4.258 . 0 0 "[ . 1 . 2]" 1
1168 1 60 SER H 1 60 SER HB2 . . 3.700 2.925 2.524 3.679 . 0 0 "[ . 1 . 2]" 1
1169 1 60 SER H 1 60 SER QB . . 3.500 2.677 2.294 3.378 . 0 0 "[ . 1 . 2]" 1
1170 1 60 SER H 1 60 SER HB3 . . 3.700 3.364 2.479 3.983 0.283 6 0 "[ . 1 . 2]" 1
1171 1 60 SER QB 1 61 SER H . . 4.010 3.302 2.244 3.764 . 0 0 "[ . 1 . 2]" 1
1172 1 60 SER HB2 1 61 SER H . . 4.170 3.958 2.274 4.377 0.207 11 0 "[ . 1 . 2]" 1
1173 1 60 SER HB3 1 61 SER H . . 4.170 3.641 2.397 4.386 0.216 4 0 "[ . 1 . 2]" 1
1174 1 61 SER H 1 61 SER QB . . 3.860 2.541 2.287 2.900 . 0 0 "[ . 1 . 2]" 1
1175 1 61 SER H 1 62 LEU H . . 3.760 2.598 2.186 2.863 . 0 0 "[ . 1 . 2]" 1
1176 1 61 SER HA 1 62 LEU H . . 3.170 3.118 2.980 3.280 0.110 17 0 "[ . 1 . 2]" 1
1177 1 61 SER QB 1 62 LEU H . . 4.300 3.639 3.323 3.980 . 0 0 "[ . 1 . 2]" 1
1178 1 61 SER HB2 1 62 LEU H . . 4.510 3.936 3.458 4.426 . 0 0 "[ . 1 . 2]" 1
1179 1 61 SER HB3 1 62 LEU H . . 4.510 4.373 3.628 4.541 0.031 3 0 "[ . 1 . 2]" 1
1180 1 62 LEU H 1 62 LEU HB2 . . 3.760 2.989 2.257 3.596 . 0 0 "[ . 1 . 2]" 1
1181 1 62 LEU H 1 62 LEU QB . . 3.470 2.767 2.153 3.357 . 0 0 "[ . 1 . 2]" 1
1182 1 62 LEU H 1 62 LEU HB3 . . 3.760 3.460 2.319 4.064 0.304 2 0 "[ . 1 . 2]" 1
1183 1 62 LEU H 1 62 LEU HG . . 4.200 3.650 2.215 4.474 0.274 11 0 "[ . 1 . 2]" 1
1184 1 62 LEU HA 1 62 LEU HG . . 3.830 3.068 2.419 3.705 . 0 0 "[ . 1 . 2]" 1
1185 1 62 LEU HA 1 63 GLU H . . 3.170 2.395 2.134 3.375 0.205 13 0 "[ . 1 . 2]" 1
1186 1 62 LEU QB 1 63 GLU H . . 4.280 3.222 1.791 3.963 . 0 0 "[ . 1 . 2]" 1
1187 1 62 LEU HB2 1 63 GLU H . . 4.540 4.087 2.961 4.595 0.055 15 0 "[ . 1 . 2]" 1
1188 1 62 LEU HB3 1 63 GLU H . . 4.540 3.458 1.801 4.432 . 0 0 "[ . 1 . 2]" 1
1189 1 62 LEU MD1 1 63 GLU H . . 6.530 4.164 2.379 5.646 . 0 0 "[ . 1 . 2]" 1
1190 1 62 LEU MD2 1 63 GLU H . . 6.530 4.106 2.799 5.413 . 0 0 "[ . 1 . 2]" 1
1191 1 62 LEU HG 1 63 GLU H . . 5.500 4.443 1.989 5.647 0.147 5 0 "[ . 1 . 2]" 1
1192 1 63 GLU H 1 63 GLU HB2 . . 3.580 2.861 2.170 3.713 0.133 14 0 "[ . 1 . 2]" 1
1193 1 63 GLU H 1 63 GLU QB . . 3.360 2.504 2.114 3.132 . 0 0 "[ . 1 . 2]" 1
1194 1 63 GLU H 1 63 GLU HB3 . . 3.580 3.085 2.416 3.670 0.090 6 0 "[ . 1 . 2]" 1
1195 1 63 GLU H 1 63 GLU HG2 . . 5.470 3.927 2.111 4.729 . 0 0 "[ . 1 . 2]" 1
1196 1 63 GLU H 1 63 GLU HG3 . . 5.470 3.658 1.950 5.113 . 0 0 "[ . 1 . 2]" 1
1197 1 63 GLU H 1 64 HIS H . . 4.850 4.218 2.149 4.603 . 0 0 "[ . 1 . 2]" 1
1198 1 63 GLU HA 1 64 HIS H . . 3.300 2.289 2.094 3.428 0.128 19 0 "[ . 1 . 2]" 1
1199 1 63 GLU HB2 1 64 HIS H . . 5.500 3.879 1.767 4.541 . 0 0 "[ . 1 . 2]" 1
1200 1 63 GLU HB3 1 64 HIS H . . 5.500 3.886 3.227 4.367 . 0 0 "[ . 1 . 2]" 1
1201 1 64 HIS HA 1 65 HIS H . . 3.390 2.490 2.126 3.518 0.128 6 0 "[ . 1 . 2]" 1
1202 1 64 HIS QB 1 65 HIS H . . 4.610 3.333 1.843 4.033 . 0 0 "[ . 1 . 2]" 1
1203 1 64 HIS HB2 1 65 HIS H . . 4.760 3.909 2.837 4.626 . 0 0 "[ . 1 . 2]" 1
1204 1 64 HIS HB3 1 65 HIS H . . 4.760 3.837 1.854 4.440 . 0 0 "[ . 1 . 2]" 1
1205 1 66 HIS H 1 66 HIS HA . . 2.900 2.865 2.241 2.944 0.044 4 0 "[ . 1 . 2]" 1
1206 1 66 HIS HA 1 67 HIS H . . 3.050 2.431 2.075 3.451 0.401 14 0 "[ . 1 . 2]" 1
1207 2 3 LYS HA 2 3 LYS HD2 . . 5.500 4.520 2.771 5.540 0.040 20 0 "[ . 1 . 2]" 1
1208 2 3 LYS HA 2 3 LYS QD . . 4.980 3.892 2.122 4.472 . 0 0 "[ . 1 . 2]" 1
1209 2 3 LYS HA 2 3 LYS HD3 . . 5.500 4.362 2.167 4.915 . 0 0 "[ . 1 . 2]" 1
1210 2 3 LYS HA 2 3 LYS QG . . 3.920 2.631 2.320 3.354 . 0 0 "[ . 1 . 2]" 1
1211 2 3 LYS HA 2 4 ILE H . . 3.020 2.327 2.156 2.553 . 0 0 "[ . 1 . 2]" 1
1212 2 3 LYS HB2 2 4 ILE H . . 3.890 3.561 2.076 3.990 0.100 12 0 "[ . 1 . 2]" 1
1213 2 3 LYS HB3 2 4 ILE H . . 3.890 3.025 2.219 4.000 0.110 5 0 "[ . 1 . 2]" 1
1214 2 3 LYS QD 2 4 ILE H . . 4.550 4.424 3.221 4.843 0.293 17 0 "[ . 1 . 2]" 1
1215 2 3 LYS QG 2 4 ILE H . . 4.340 3.532 1.877 4.306 . 0 0 "[ . 1 . 2]" 1
1216 2 3 LYS HG2 2 4 ILE H . . 4.910 3.991 1.889 4.984 0.074 9 0 "[ . 1 . 2]" 1
1217 2 3 LYS HG3 2 4 ILE H . . 4.910 4.239 2.780 4.970 0.060 10 0 "[ . 1 . 2]" 1
1218 2 4 ILE H 2 4 ILE HB . . 3.450 3.539 2.369 3.778 0.328 19 0 "[ . 1 . 2]" 1
1219 2 4 ILE H 2 4 ILE MD . . 5.440 1.874 1.660 4.501 . 0 0 "[ . 1 . 2]" 1
1220 2 4 ILE H 2 4 ILE HG12 . . 3.580 2.958 2.333 4.008 0.428 1 0 "[ . 1 . 2]" 1
1221 2 4 ILE H 2 4 ILE QG . . 3.390 2.809 2.306 3.396 0.006 1 0 "[ . 1 . 2]" 1
1222 2 4 ILE H 2 4 ILE HG13 . . 3.580 3.742 3.469 3.898 0.318 19 0 "[ . 1 . 2]" 1
1223 2 4 ILE H 2 5 ILE H . . 5.500 4.433 4.284 4.538 . 0 0 "[ . 1 . 2]" 1
1224 2 4 ILE HA 2 4 ILE HG12 . . 4.140 3.647 3.545 3.856 . 0 0 "[ . 1 . 2]" 1
1225 2 4 ILE HA 2 4 ILE QG . . 3.940 3.306 2.271 3.473 . 0 0 "[ . 1 . 2]" 1
1226 2 4 ILE HA 2 4 ILE HG13 . . 4.140 3.982 2.298 4.240 0.100 18 0 "[ . 1 . 2]" 1
1227 2 4 ILE HA 2 5 ILE H . . 3.050 2.169 2.029 2.252 . 0 0 "[ . 1 . 2]" 1
1228 2 4 ILE HB 2 5 ILE H . . 3.890 3.120 2.827 4.140 0.250 20 0 "[ . 1 . 2]" 1
1229 2 4 ILE MD 2 5 ILE H . . 6.530 4.780 3.938 5.089 . 0 0 "[ . 1 . 2]" 1
1230 2 4 ILE HG12 2 5 ILE H . . 5.100 4.230 3.736 4.990 . 0 0 "[ . 1 . 2]" 1
1231 2 4 ILE HG13 2 5 ILE H . . 5.100 4.753 2.680 5.174 0.074 5 0 "[ . 1 . 2]" 1
1232 2 4 ILE MG 2 5 ILE H . . 4.880 3.732 2.450 4.325 . 0 0 "[ . 1 . 2]" 1
1233 2 4 ILE MG 2 6 GLU HG2 . . 6.530 6.166 3.173 6.752 0.222 13 0 "[ . 1 . 2]" 1
1234 2 4 ILE MG 2 6 GLU HG3 . . 6.530 5.557 2.614 6.584 0.054 10 0 "[ . 1 . 2]" 1
1235 2 5 ILE H 2 5 ILE HB . . 2.990 2.879 2.629 3.673 0.683 3 3 "[ + - * . 2]" 1
1236 2 5 ILE H 2 5 ILE MD . . 5.570 3.625 3.132 4.118 . 0 0 "[ . 1 . 2]" 1
1237 2 5 ILE H 2 5 ILE HG12 . . 3.830 2.910 1.848 3.786 . 0 0 "[ . 1 . 2]" 1
1238 2 5 ILE H 2 5 ILE QG . . 3.600 2.192 1.826 2.698 . 0 0 "[ . 1 . 2]" 1
1239 2 5 ILE H 2 5 ILE HG13 . . 3.830 2.723 1.957 3.857 0.027 17 0 "[ . 1 . 2]" 1
1240 2 5 ILE H 2 6 GLU H . . 5.500 4.489 4.381 4.592 . 0 0 "[ . 1 . 2]" 1
1241 2 5 ILE HA 2 5 ILE QG . . 3.880 2.830 2.476 3.319 . 0 0 "[ . 1 . 2]" 1
1242 2 5 ILE HA 2 6 GLU H . . 3.110 2.304 2.172 2.490 . 0 0 "[ . 1 . 2]" 1
1243 2 5 ILE HA 2 18 GLN QE . . 6.370 2.825 1.774 5.431 . 0 0 "[ . 1 . 2]" 1
1244 2 5 ILE HB 2 6 GLU H . . 3.520 3.489 2.440 3.698 0.178 7 0 "[ . 1 . 2]" 1
1245 2 5 ILE HB 2 18 GLN HE21 . . 5.500 4.995 4.098 5.690 0.190 14 0 "[ . 1 . 2]" 1
1246 2 5 ILE HB 2 18 GLN HE22 . . 5.500 5.445 5.008 5.734 0.234 5 0 "[ . 1 . 2]" 1
1247 2 5 ILE HB 2 18 GLN QG . . 6.040 4.929 1.729 6.075 0.035 7 0 "[ . 1 . 2]" 1
1248 2 5 ILE MD 2 6 GLU H . . 5.940 4.581 3.872 4.988 . 0 0 "[ . 1 . 2]" 1
1249 2 5 ILE MD 2 17 LEU H . . 6.370 5.868 4.321 6.431 0.061 4 0 "[ . 1 . 2]" 1
1250 2 5 ILE MD 2 18 GLN H . . 6.530 5.549 4.138 6.559 0.029 19 0 "[ . 1 . 2]" 1
1251 2 5 ILE MD 2 18 GLN QB . . 7.130 4.347 2.761 6.238 . 0 0 "[ . 1 . 2]" 1
1252 2 5 ILE MD 2 18 GLN QE . . 7.400 4.242 1.787 6.014 . 0 0 "[ . 1 . 2]" 1
1253 2 5 ILE MD 2 18 GLN HG2 . . 6.530 4.820 3.135 6.614 0.084 20 0 "[ . 1 . 2]" 1
1254 2 5 ILE MD 2 18 GLN HG3 . . 6.530 4.819 2.494 6.640 0.110 15 0 "[ . 1 . 2]" 1
1255 2 5 ILE HG12 2 6 GLU H . . 5.500 4.759 4.366 5.143 . 0 0 "[ . 1 . 2]" 1
1256 2 5 ILE HG13 2 6 GLU H . . 5.500 4.953 3.716 5.325 . 0 0 "[ . 1 . 2]" 1
1257 2 5 ILE MG 2 6 GLU H . . 4.670 2.357 1.784 3.884 . 0 0 "[ . 1 . 2]" 1
1258 2 5 ILE MG 2 18 GLN H . . 6.530 3.688 2.919 6.556 0.026 10 0 "[ . 1 . 2]" 1
1259 2 5 ILE MG 2 18 GLN QB . . 7.410 2.929 1.728 5.050 . 0 0 "[ . 1 . 2]" 1
1260 2 5 ILE MG 2 18 GLN QE . . 7.400 2.885 1.746 4.474 . 0 0 "[ . 1 . 2]" 1
1261 2 5 ILE MG 2 18 GLN HG2 . . 6.530 3.290 1.872 4.238 . 0 0 "[ . 1 . 2]" 1
1262 2 5 ILE MG 2 18 GLN HG3 . . 6.530 3.235 1.794 4.553 . 0 0 "[ . 1 . 2]" 1
1263 2 6 GLU H 2 6 GLU HB2 . . 3.580 2.522 2.393 2.711 . 0 0 "[ . 1 . 2]" 1
1264 2 6 GLU H 2 6 GLU HB3 . . 3.580 3.683 3.607 3.765 0.185 14 0 "[ . 1 . 2]" 1
1265 2 6 GLU H 2 6 GLU HG2 . . 4.940 4.091 3.716 4.382 . 0 0 "[ . 1 . 2]" 1
1266 2 6 GLU H 2 6 GLU QG . . 4.660 3.168 2.571 3.801 . 0 0 "[ . 1 . 2]" 1
1267 2 6 GLU H 2 6 GLU HG3 . . 4.940 3.326 2.622 4.169 . 0 0 "[ . 1 . 2]" 1
1268 2 6 GLU H 2 7 ALA H . . 5.500 4.410 4.108 4.551 . 0 0 "[ . 1 . 2]" 1
1269 2 6 GLU H 2 17 LEU QB . . 6.380 4.238 3.425 4.759 . 0 0 "[ . 1 . 2]" 1
1270 2 6 GLU H 2 17 LEU MD1 . . 6.280 4.379 3.698 5.421 . 0 0 "[ . 1 . 2]" 1
1271 2 6 GLU H 2 17 LEU QD . . 6.000 4.255 3.606 5.164 . 0 0 "[ . 1 . 2]" 1
1272 2 6 GLU H 2 17 LEU MD2 . . 6.280 5.848 4.945 6.492 0.212 9 0 "[ . 1 . 2]" 1
1273 2 6 GLU H 2 18 GLN HG2 . . 5.500 4.053 2.144 5.726 0.226 8 0 "[ . 1 . 2]" 1
1274 2 6 GLU H 2 18 GLN HG3 . . 5.500 4.072 2.256 5.601 0.101 10 0 "[ . 1 . 2]" 1
1275 2 6 GLU HA 2 7 ALA H . . 3.050 2.187 2.106 2.346 . 0 0 "[ . 1 . 2]" 1
1276 2 6 GLU QB 2 7 ALA H . . 3.980 2.990 2.581 3.382 . 0 0 "[ . 1 . 2]" 1
1277 2 6 GLU QB 2 17 LEU QB . . 4.990 2.966 2.365 3.346 . 0 0 "[ . 1 . 2]" 1
1278 2 6 GLU QB 2 17 LEU QD . . 6.360 2.432 1.721 3.158 . 0 0 "[ . 1 . 2]" 1
1279 2 6 GLU HB2 2 7 ALA H . . 4.230 4.092 3.766 4.271 0.041 11 0 "[ . 1 . 2]" 1
1280 2 6 GLU HB2 2 17 LEU HB2 . . 5.980 3.135 2.442 3.690 . 0 0 "[ . 1 . 2]" 1
1281 2 6 GLU HB2 2 17 LEU HB3 . . 5.980 4.714 3.851 5.355 . 0 0 "[ . 1 . 2]" 1
1282 2 6 GLU HB2 2 17 LEU MD1 . . 8.020 2.974 1.792 3.831 . 0 0 "[ . 1 . 2]" 1
1283 2 6 GLU HB2 2 17 LEU MD2 . . 8.020 4.138 2.865 5.663 . 0 0 "[ . 1 . 2]" 1
1284 2 6 GLU HB3 2 7 ALA H . . 4.230 3.076 2.629 3.545 . 0 0 "[ . 1 . 2]" 1
1285 2 6 GLU HB3 2 17 LEU HB2 . . 5.980 3.995 3.418 4.422 . 0 0 "[ . 1 . 2]" 1
1286 2 6 GLU HB3 2 17 LEU HB3 . . 5.980 5.525 4.862 6.006 0.026 5 0 "[ . 1 . 2]" 1
1287 2 6 GLU HB3 2 17 LEU MD1 . . 8.020 2.688 2.211 3.411 . 0 0 "[ . 1 . 2]" 1
1288 2 6 GLU HB3 2 17 LEU MD2 . . 8.020 4.196 3.183 5.811 . 0 0 "[ . 1 . 2]" 1
1289 2 6 GLU QG 2 7 ALA H . . 5.210 3.976 3.715 4.280 . 0 0 "[ . 1 . 2]" 1
1290 2 6 GLU QG 2 17 LEU QD . . 7.280 4.042 3.327 4.954 . 0 0 "[ . 1 . 2]" 1
1291 2 6 GLU HG2 2 7 ALA H . . 5.340 4.599 4.035 5.020 . 0 0 "[ . 1 . 2]" 1
1292 2 6 GLU HG2 2 17 LEU MD1 . . 8.950 4.678 3.889 5.596 . 0 0 "[ . 1 . 2]" 1
1293 2 6 GLU HG2 2 17 LEU MD2 . . 8.950 5.659 4.016 7.786 . 0 0 "[ . 1 . 2]" 1
1294 2 6 GLU HG3 2 7 ALA H . . 5.340 4.578 3.833 5.219 . 0 0 "[ . 1 . 2]" 1
1295 2 6 GLU HG3 2 17 LEU MD1 . . 8.950 4.902 4.343 5.824 . 0 0 "[ . 1 . 2]" 1
1296 2 6 GLU HG3 2 17 LEU MD2 . . 8.950 6.068 5.048 7.659 . 0 0 "[ . 1 . 2]" 1
1297 2 7 ALA H 2 8 VAL H . . 5.500 4.398 4.337 4.450 . 0 0 "[ . 1 . 2]" 1
1298 2 7 ALA H 2 16 PRO QD . . 6.380 6.454 6.387 6.557 0.177 1 0 "[ . 1 . 2]" 1
1299 2 7 ALA H 2 17 LEU QD . . 7.380 3.367 3.103 4.202 . 0 0 "[ . 1 . 2]" 1
1300 2 7 ALA HA 2 8 VAL H . . 3.020 2.350 2.238 2.449 . 0 0 "[ . 1 . 2]" 1
1301 2 7 ALA HA 2 15 LYS HB2 . . 5.500 5.306 5.093 5.956 0.456 15 0 "[ . 1 . 2]" 1
1302 2 7 ALA HA 2 15 LYS HB3 . . 5.500 5.499 4.687 5.638 0.138 8 0 "[ . 1 . 2]" 1
1303 2 7 ALA HA 2 15 LYS QG . . 6.380 6.362 4.962 6.552 0.172 16 0 "[ . 1 . 2]" 1
1304 2 7 ALA HA 2 16 PRO HA . . 3.390 1.797 1.547 2.328 . 0 0 "[ . 1 . 2]" 1
1305 2 7 ALA HA 2 16 PRO QB . . 5.350 3.691 3.295 4.190 . 0 0 "[ . 1 . 2]" 1
1306 2 7 ALA HA 2 17 LEU H . . 3.670 2.801 2.413 2.991 . 0 0 "[ . 1 . 2]" 1
1307 2 7 ALA HA 2 17 LEU QB . . 6.380 4.150 3.606 4.642 . 0 0 "[ . 1 . 2]" 1
1308 2 7 ALA HA 2 17 LEU MD1 . . 6.530 2.098 1.865 3.299 . 0 0 "[ . 1 . 2]" 1
1309 2 7 ALA HA 2 17 LEU QD . . 5.950 2.085 1.863 3.087 . 0 0 "[ . 1 . 2]" 1
1310 2 7 ALA HA 2 17 LEU MD2 . . 6.530 4.694 3.718 5.028 . 0 0 "[ . 1 . 2]" 1
1311 2 7 ALA HA 2 17 LEU HG . . 4.260 4.100 2.346 4.456 0.196 7 0 "[ . 1 . 2]" 1
1312 2 7 ALA HA 2 18 GLN H . . 4.290 4.815 4.412 6.217 1.927 1 4 "[+ . - * . *2]" 1
1313 2 7 ALA MB 2 8 VAL HA . . 5.720 3.995 3.872 4.085 . 0 0 "[ . 1 . 2]" 1
1314 2 7 ALA MB 2 14 PHE H . . 6.530 5.295 4.895 5.590 . 0 0 "[ . 1 . 2]" 1
1315 2 7 ALA MB 2 14 PHE HA . . 6.530 3.617 3.393 3.793 . 0 0 "[ . 1 . 2]" 1
1316 2 7 ALA MB 2 14 PHE HB2 . . 5.540 3.904 3.169 4.725 . 0 0 "[ . 1 . 2]" 1
1317 2 7 ALA MB 2 14 PHE QB . . 5.250 2.561 1.992 3.649 . 0 0 "[ . 1 . 2]" 1
1318 2 7 ALA MB 2 14 PHE HB3 . . 5.540 2.600 2.013 3.797 . 0 0 "[ . 1 . 2]" 1
1319 2 7 ALA MB 2 14 PHE QD . . 8.650 3.060 2.373 3.560 . 0 0 "[ . 1 . 2]" 1
1320 2 7 ALA MB 2 15 LYS H . . 5.470 3.101 2.795 3.371 . 0 0 "[ . 1 . 2]" 1
1321 2 7 ALA MB 2 16 PRO HA . . 4.950 2.049 1.867 2.265 . 0 0 "[ . 1 . 2]" 1
1322 2 7 ALA MB 2 16 PRO QB . . 6.390 2.869 2.048 3.796 . 0 0 "[ . 1 . 2]" 1
1323 2 7 ALA MB 2 16 PRO QD . . 7.410 3.093 2.991 3.216 . 0 0 "[ . 1 . 2]" 1
1324 2 7 ALA MB 2 16 PRO HG2 . . 6.530 4.661 4.307 4.820 . 0 0 "[ . 1 . 2]" 1
1325 2 7 ALA MB 2 16 PRO QG . . 6.150 3.785 3.044 4.079 . 0 0 "[ . 1 . 2]" 1
1326 2 7 ALA MB 2 16 PRO HG3 . . 6.530 4.030 3.107 4.402 . 0 0 "[ . 1 . 2]" 1
1327 2 7 ALA MB 2 17 LEU H . . 5.260 3.737 3.428 3.928 . 0 0 "[ . 1 . 2]" 1
1328 2 8 VAL H 2 8 VAL HB . . 3.450 3.592 2.772 3.720 0.270 8 0 "[ . 1 . 2]" 1
1329 2 8 VAL H 2 9 TYR H . . 5.500 4.275 4.168 4.415 . 0 0 "[ . 1 . 2]" 1
1330 2 8 VAL H 2 15 LYS H . . 3.210 2.990 2.679 3.307 0.097 18 0 "[ . 1 . 2]" 1
1331 2 8 VAL H 2 15 LYS HB2 . . 4.600 3.554 3.212 4.529 . 0 0 "[ . 1 . 2]" 1
1332 2 8 VAL H 2 15 LYS QB . . 4.250 3.355 3.064 3.705 . 0 0 "[ . 1 . 2]" 1
1333 2 8 VAL H 2 15 LYS HB3 . . 4.600 4.342 3.116 4.632 0.032 12 0 "[ . 1 . 2]" 1
1334 2 8 VAL H 2 16 PRO HA . . 3.670 3.491 3.181 3.864 0.194 19 0 "[ . 1 . 2]" 1
1335 2 8 VAL HA 2 9 TYR H . . 2.710 2.120 2.080 2.199 . 0 0 "[ . 1 . 2]" 1
1336 2 8 VAL HB 2 9 TYR H . . 3.580 3.412 3.079 3.830 0.250 11 0 "[ . 1 . 2]" 1
1337 2 8 VAL HB 2 15 LYS H . . 5.410 4.764 3.723 5.258 . 0 0 "[ . 1 . 2]" 1
1338 2 8 VAL QG 2 9 TYR H . . 5.050 3.410 2.263 3.592 . 0 0 "[ . 1 . 2]" 1
1339 2 8 VAL QG 2 15 LYS H . . 5.730 3.283 2.896 4.155 . 0 0 "[ . 1 . 2]" 1
1340 2 8 VAL QG 2 15 LYS HA . . 6.720 4.614 4.216 5.507 . 0 0 "[ . 1 . 2]" 1
1341 2 8 VAL QG 2 15 LYS QB . . 5.260 2.486 1.935 3.639 . 0 0 "[ . 1 . 2]" 1
1342 2 8 VAL QG 2 15 LYS QD . . 7.760 3.893 3.143 4.815 . 0 0 "[ . 1 . 2]" 1
1343 2 8 VAL QG 2 15 LYS QG . . 7.450 4.058 3.370 4.922 . 0 0 "[ . 1 . 2]" 1
1344 2 8 VAL QG 2 18 GLN QE . . 8.960 7.158 5.919 8.611 . 0 0 "[ . 1 . 2]" 1
1345 2 8 VAL MG1 2 9 TYR H . . 5.540 3.669 2.275 3.886 . 0 0 "[ . 1 . 2]" 1
1346 2 8 VAL MG1 2 15 LYS H . . 6.530 5.126 4.636 5.558 . 0 0 "[ . 1 . 2]" 1
1347 2 8 VAL MG1 2 15 LYS HB2 . . 7.130 5.079 4.626 6.193 . 0 0 "[ . 1 . 2]" 1
1348 2 8 VAL MG1 2 15 LYS HB3 . . 7.130 5.877 4.855 6.295 . 0 0 "[ . 1 . 2]" 1
1349 2 8 VAL MG2 2 9 TYR H . . 5.540 4.150 3.965 4.247 . 0 0 "[ . 1 . 2]" 1
1350 2 8 VAL MG2 2 15 LYS H . . 6.530 3.353 2.914 4.545 . 0 0 "[ . 1 . 2]" 1
1351 2 8 VAL MG2 2 15 LYS HB2 . . 7.130 2.630 1.954 4.019 . 0 0 "[ . 1 . 2]" 1
1352 2 8 VAL MG2 2 15 LYS HB3 . . 7.130 3.575 2.435 4.914 . 0 0 "[ . 1 . 2]" 1
1353 2 9 TYR H 2 9 TYR HB2 . . 3.050 2.615 2.097 3.588 0.538 18 1 "[ . 1 . + 2]" 1
1354 2 9 TYR H 2 9 TYR HB3 . . 3.050 2.522 2.274 3.487 0.437 8 0 "[ . 1 . 2]" 1
1355 2 9 TYR H 2 14 PHE QD . . 7.620 3.641 2.440 4.557 . 0 0 "[ . 1 . 2]" 1
1356 2 9 TYR H 2 25 GLY H . . 5.500 17.174 16.391 17.963 12.463 13 20 [*-**********+*******] 1
1357 2 9 TYR HA 2 10 GLU H . . 2.990 2.085 1.910 2.209 . 0 0 "[ . 1 . 2]" 1
1358 2 9 TYR HA 2 13 VAL H . . 3.890 4.274 3.975 4.999 1.109 16 4 "[ .- 1 *.+ * 2]" 1
1359 2 9 TYR HA 2 13 VAL HB . . 3.890 4.708 4.113 5.992 2.102 16 7 "[*- .* **1 *.+ 2]" 1
1360 2 9 TYR HA 2 14 PHE HA . . 3.210 2.127 1.827 2.424 . 0 0 "[ . 1 . 2]" 1
1361 2 9 TYR HA 2 14 PHE QD . . 7.620 3.432 2.929 4.316 . 0 0 "[ . 1 . 2]" 1
1362 2 9 TYR HA 2 15 LYS H . . 4.600 3.267 2.504 3.693 . 0 0 "[ . 1 . 2]" 1
1363 2 9 TYR HA 2 15 LYS QE . . 6.380 5.944 4.683 6.546 0.166 9 0 "[ . 1 . 2]" 1
1364 2 9 TYR QB 2 26 GLU QB . . 5.980 13.068 11.758 14.006 8.026 9 20 [********+********-**] 1
1365 2 9 TYR HB2 2 10 GLU H . . 5.190 4.258 2.904 4.582 . 0 0 "[ . 1 . 2]" 1
1366 2 9 TYR HB2 2 14 PHE QE . . 7.620 2.744 2.101 5.957 . 0 0 "[ . 1 . 2]" 1
1367 2 9 TYR HB3 2 10 GLU H . . 5.190 4.238 2.707 4.450 . 0 0 "[ . 1 . 2]" 1
1368 2 9 TYR HB3 2 14 PHE QE . . 7.620 3.898 3.315 5.342 . 0 0 "[ . 1 . 2]" 1
1369 2 9 TYR QD 2 10 GLU H . . 6.860 3.893 3.431 4.203 . 0 0 "[ . 1 . 2]" 1
1370 2 9 TYR QD 2 13 VAL H . . 7.640 4.265 3.663 5.237 . 0 0 "[ . 1 . 2]" 1
1371 2 9 TYR QD 2 14 PHE HA . . 7.640 3.570 2.560 4.723 . 0 0 "[ . 1 . 2]" 1
1372 2 9 TYR QD 2 14 PHE QE . . 9.760 3.111 2.705 3.754 . 0 0 "[ . 1 . 2]" 1
1373 2 9 TYR QD 2 24 GLU HA . . 7.640 14.862 13.911 16.380 8.740 14 20 [-************+******] 1
1374 2 9 TYR QE 2 12 GLY H . . 7.630 3.517 2.288 5.764 . 0 0 "[ . 1 . 2]" 1
1375 2 9 TYR QE 2 12 GLY HA2 . . 7.630 2.985 2.045 4.983 . 0 0 "[ . 1 . 2]" 1
1376 2 9 TYR QE 2 12 GLY HA3 . . 7.630 4.399 3.629 6.454 . 0 0 "[ . 1 . 2]" 1
1377 2 9 TYR QE 2 13 VAL H . . 7.630 4.421 3.471 6.787 . 0 0 "[ . 1 . 2]" 1
1378 2 9 TYR QE 2 13 VAL HA . . 7.630 4.504 3.070 7.726 0.096 18 0 "[ . 1 . 2]" 1
1379 2 9 TYR QE 2 14 PHE QE . . 9.750 3.560 2.737 5.011 . 0 0 "[ . 1 . 2]" 1
1380 2 9 TYR QE 2 20 VAL HB . . 7.630 14.937 13.250 16.383 8.753 16 20 [***-***********+****] 1
1381 2 10 GLU H 2 10 GLU HB2 . . 3.520 2.837 2.189 3.773 0.253 15 0 "[ . 1 . 2]" 1
1382 2 10 GLU H 2 10 GLU HB3 . . 3.520 3.269 2.390 3.720 0.200 17 0 "[ . 1 . 2]" 1
1383 2 10 GLU H 2 10 GLU HG2 . . 4.790 3.901 2.121 4.902 0.112 8 0 "[ . 1 . 2]" 1
1384 2 10 GLU H 2 10 GLU QG . . 4.640 3.280 2.057 4.155 . 0 0 "[ . 1 . 2]" 1
1385 2 10 GLU H 2 10 GLU HG3 . . 4.790 3.639 2.581 4.864 0.074 5 0 "[ . 1 . 2]" 1
1386 2 10 GLU H 2 11 ASN H . . 4.850 4.206 3.687 4.422 . 0 0 "[ . 1 . 2]" 1
1387 2 10 GLU H 2 13 VAL H . . 3.330 3.099 2.532 3.440 0.110 6 0 "[ . 1 . 2]" 1
1388 2 10 GLU H 2 13 VAL MG1 . . 6.530 4.456 3.904 5.191 . 0 0 "[ . 1 . 2]" 1
1389 2 10 GLU H 2 13 VAL MG2 . . 5.230 3.830 3.025 4.894 . 0 0 "[ . 1 . 2]" 1
1390 2 10 GLU H 2 14 PHE HA . . 3.420 3.313 2.869 3.606 0.186 10 0 "[ . 1 . 2]" 1
1391 2 10 GLU H 2 15 LYS H . . 5.500 3.717 3.156 4.337 . 0 0 "[ . 1 . 2]" 1
1392 2 10 GLU HA 2 11 ASN H . . 3.080 2.266 2.051 2.747 . 0 0 "[ . 1 . 2]" 1
1393 2 10 GLU HA 2 12 GLY H . . 3.800 3.883 3.379 4.352 0.552 3 1 "[ + . 1 . 2]" 1
1394 2 10 GLU HA 2 13 VAL H . . 4.910 4.404 4.123 4.915 0.005 6 0 "[ . 1 . 2]" 1
1395 2 10 GLU QB 2 11 ASN H . . 3.940 3.062 1.767 3.863 . 0 0 "[ . 1 . 2]" 1
1396 2 10 GLU QB 2 13 VAL MG1 . . 5.990 4.633 2.848 5.583 . 0 0 "[ . 1 . 2]" 1
1397 2 10 GLU HB2 2 11 ASN H . . 4.140 3.863 2.929 4.427 0.287 9 0 "[ . 1 . 2]" 1
1398 2 10 GLU HB2 2 13 VAL MG1 . . 6.190 5.288 3.181 6.324 0.134 14 0 "[ . 1 . 2]" 1
1399 2 10 GLU HB2 2 13 VAL MG2 . . 6.530 4.104 2.414 6.602 0.072 14 0 "[ . 1 . 2]" 1
1400 2 10 GLU HB3 2 11 ASN H . . 4.140 3.374 1.776 4.351 0.211 8 0 "[ . 1 . 2]" 1
1401 2 10 GLU HB3 2 13 VAL MG1 . . 6.190 5.405 2.937 6.429 0.239 2 0 "[ . 1 . 2]" 1
1402 2 10 GLU HB3 2 13 VAL MG2 . . 6.530 4.086 2.299 5.857 . 0 0 "[ . 1 . 2]" 1
1403 2 10 GLU QG 2 11 ASN H . . 5.280 3.568 1.722 4.335 . 0 0 "[ . 1 . 2]" 1
1404 2 10 GLU HG2 2 11 ASN H . . 5.500 4.050 2.792 5.297 . 0 0 "[ . 1 . 2]" 1
1405 2 10 GLU HG3 2 11 ASN H . . 5.500 4.254 1.728 5.293 . 0 0 "[ . 1 . 2]" 1
1406 2 11 ASN H 2 11 ASN HB2 . . 3.980 2.819 1.928 3.416 . 0 0 "[ . 1 . 2]" 1
1407 2 11 ASN H 2 11 ASN HB3 . . 3.980 3.631 2.661 4.036 0.056 9 0 "[ . 1 . 2]" 1
1408 2 11 ASN H 2 12 GLY H . . 3.420 2.928 2.587 3.559 0.139 12 0 "[ . 1 . 2]" 1
1409 2 11 ASN H 2 13 VAL H . . 4.690 4.066 3.602 4.650 . 0 0 "[ . 1 . 2]" 1
1410 2 11 ASN HA 2 11 ASN QD . . 4.630 2.923 1.735 3.980 . 0 0 "[ . 1 . 2]" 1
1411 2 11 ASN HA 2 11 ASN HD22 . . 5.190 3.856 3.202 4.571 . 0 0 "[ . 1 . 2]" 1
1412 2 11 ASN HA 2 12 GLY H . . 3.110 2.871 2.489 3.129 0.019 13 0 "[ . 1 . 2]" 1
1413 2 11 ASN HA 2 13 VAL H . . 4.380 4.438 3.918 4.801 0.421 9 0 "[ . 1 . 2]" 1
1414 2 11 ASN QB 2 12 GLY H . . 4.390 3.761 3.599 3.853 . 0 0 "[ . 1 . 2]" 1
1415 2 11 ASN QB 2 13 VAL H . . 4.370 3.770 3.210 4.308 . 0 0 "[ . 1 . 2]" 1
1416 2 11 ASN QB 2 13 VAL MG2 . . 5.460 3.059 1.932 3.686 . 0 0 "[ . 1 . 2]" 1
1417 2 11 ASN HB2 2 12 GLY H . . 4.690 4.402 4.224 4.557 . 0 0 "[ . 1 . 2]" 1
1418 2 11 ASN HB2 2 13 VAL H . . 4.540 4.657 3.715 5.166 0.626 19 1 "[ . 1 . +2]" 1
1419 2 11 ASN HB2 2 13 VAL MG1 . . 6.530 6.045 4.714 6.719 0.189 19 0 "[ . 1 . 2]" 1
1420 2 11 ASN HB2 2 13 VAL MG2 . . 5.810 4.042 3.462 5.111 . 0 0 "[ . 1 . 2]" 1
1421 2 11 ASN HB3 2 12 GLY H . . 4.690 4.093 3.851 4.434 . 0 0 "[ . 1 . 2]" 1
1422 2 11 ASN HB3 2 13 VAL H . . 4.540 4.062 3.281 4.775 0.235 18 0 "[ . 1 . 2]" 1
1423 2 11 ASN HB3 2 13 VAL MG1 . . 6.530 5.320 4.305 6.748 0.218 18 0 "[ . 1 . 2]" 1
1424 2 11 ASN HB3 2 13 VAL MG2 . . 5.810 3.293 1.941 4.615 . 0 0 "[ . 1 . 2]" 1
1425 2 11 ASN HD21 2 13 VAL MG2 . . 6.530 5.022 3.116 6.272 . 0 0 "[ . 1 . 2]" 1
1426 2 11 ASN HD22 2 13 VAL MG2 . . 6.530 6.056 4.539 6.685 0.155 3 0 "[ . 1 . 2]" 1
1427 2 12 GLY H 2 13 VAL H . . 3.360 2.405 1.820 3.190 . 0 0 "[ . 1 . 2]" 1
1428 2 12 GLY H 2 13 VAL MG1 . . 6.530 5.387 4.437 6.253 . 0 0 "[ . 1 . 2]" 1
1429 2 12 GLY H 2 13 VAL MG2 . . 6.530 3.915 3.257 4.836 . 0 0 "[ . 1 . 2]" 1
1430 2 12 GLY HA2 2 13 VAL H . . 3.360 3.272 3.024 3.530 0.170 2 0 "[ . 1 . 2]" 1
1431 2 12 GLY HA2 2 13 VAL MG1 . . 6.530 5.378 3.904 5.945 . 0 0 "[ . 1 . 2]" 1
1432 2 12 GLY HA3 2 13 VAL H . . 3.360 3.103 2.523 3.391 0.031 11 0 "[ . 1 . 2]" 1
1433 2 12 GLY HA3 2 13 VAL MG1 . . 6.530 4.790 2.660 5.729 . 0 0 "[ . 1 . 2]" 1
1434 2 13 VAL H 2 13 VAL MG2 . . 4.760 2.180 1.865 2.405 . 0 0 "[ . 1 . 2]" 1
1435 2 13 VAL H 2 14 PHE H . . 5.500 4.507 4.441 4.585 . 0 0 "[ . 1 . 2]" 1
1436 2 13 VAL HA 2 13 VAL HB . . 3.020 2.826 2.371 3.013 . 0 0 "[ . 1 . 2]" 1
1437 2 13 VAL HA 2 14 PHE H . . 2.990 2.292 2.226 2.476 . 0 0 "[ . 1 . 2]" 1
1438 2 13 VAL HB 2 14 PHE H . . 3.670 3.410 2.283 3.838 0.168 10 0 "[ . 1 . 2]" 1
1439 2 13 VAL MG1 2 14 PHE H . . 5.750 2.765 2.049 3.921 . 0 0 "[ . 1 . 2]" 1
1440 2 13 VAL MG2 2 14 PHE H . . 5.100 4.018 3.350 4.391 . 0 0 "[ . 1 . 2]" 1
1441 2 13 VAL MG2 2 15 LYS H . . 6.530 5.279 3.434 6.397 . 0 0 "[ . 1 . 2]" 1
1442 2 14 PHE H 2 14 PHE HB2 . . 3.550 2.457 2.360 2.547 . 0 0 "[ . 1 . 2]" 1
1443 2 14 PHE H 2 14 PHE HB3 . . 3.550 3.615 2.951 3.710 0.160 19 0 "[ . 1 . 2]" 1
1444 2 14 PHE H 2 15 LYS H . . 5.500 4.306 4.171 4.439 . 0 0 "[ . 1 . 2]" 1
1445 2 14 PHE H 2 30 ILE MD . . 6.530 5.614 4.457 6.433 . 0 0 "[ . 1 . 2]" 1
1446 2 14 PHE HA 2 15 LYS H . . 2.990 2.128 2.102 2.159 . 0 0 "[ . 1 . 2]" 1
1447 2 14 PHE HA 2 30 ILE MD . . 6.530 5.624 4.850 6.557 0.027 2 0 "[ . 1 . 2]" 1
1448 2 14 PHE QB 2 15 LYS H . . 3.890 3.400 3.265 3.715 . 0 0 "[ . 1 . 2]" 1
1449 2 14 PHE QB 2 30 ILE MD . . 6.250 3.535 2.645 4.493 . 0 0 "[ . 1 . 2]" 1
1450 2 14 PHE HB2 2 15 LYS H . . 4.290 4.354 4.200 4.494 0.204 17 0 "[ . 1 . 2]" 1
1451 2 14 PHE HB2 2 30 ILE MD . . 6.530 3.957 2.868 4.904 . 0 0 "[ . 1 . 2]" 1
1452 2 14 PHE HB3 2 15 LYS H . . 4.290 3.550 3.391 3.960 . 0 0 "[ . 1 . 2]" 1
1453 2 14 PHE HB3 2 30 ILE MD . . 6.530 3.998 3.101 5.217 . 0 0 "[ . 1 . 2]" 1
1454 2 14 PHE QD 2 15 LYS H . . 7.620 4.204 3.876 4.709 . 0 0 "[ . 1 . 2]" 1
1455 2 14 PHE QD 2 28 VAL MG2 . . 8.650 5.400 4.876 5.880 . 0 0 "[ . 1 . 2]" 1
1456 2 14 PHE QD 2 30 ILE MD . . 8.650 3.355 2.721 4.035 . 0 0 "[ . 1 . 2]" 1
1457 2 14 PHE QE 2 32 LEU MD1 . . 8.430 5.347 4.237 6.463 . 0 0 "[ . 1 . 2]" 1
1458 2 14 PHE QE 2 32 LEU MD2 . . 8.280 4.438 3.533 5.725 . 0 0 "[ . 1 . 2]" 1
1459 2 14 PHE HZ 2 32 LEU MD1 . . 5.850 5.730 4.840 6.084 0.234 17 0 "[ . 1 . 2]" 1
1460 2 14 PHE HZ 2 32 LEU MD2 . . 5.850 4.932 3.829 5.871 0.021 16 0 "[ . 1 . 2]" 1
1461 2 15 LYS H 2 15 LYS HB2 . . 3.520 2.458 2.339 2.607 . 0 0 "[ . 1 . 2]" 1
1462 2 15 LYS H 2 15 LYS QB . . 3.310 2.407 2.274 2.498 . 0 0 "[ . 1 . 2]" 1
1463 2 15 LYS H 2 15 LYS HB3 . . 3.520 3.584 2.506 3.697 0.177 18 0 "[ . 1 . 2]" 1
1464 2 15 LYS H 2 15 LYS HD2 . . 5.500 4.578 2.864 5.447 . 0 0 "[ . 1 . 2]" 1
1465 2 15 LYS H 2 15 LYS HD3 . . 5.500 4.738 2.885 5.844 0.344 15 0 "[ . 1 . 2]" 1
1466 2 15 LYS H 2 15 LYS HG2 . . 5.280 3.947 2.727 4.458 . 0 0 "[ . 1 . 2]" 1
1467 2 15 LYS H 2 15 LYS QG . . 4.720 2.994 2.599 3.975 . 0 0 "[ . 1 . 2]" 1
1468 2 15 LYS H 2 15 LYS HG3 . . 5.280 3.222 2.634 4.494 . 0 0 "[ . 1 . 2]" 1
1469 2 15 LYS H 2 16 PRO HD2 . . 5.500 4.784 4.633 5.005 . 0 0 "[ . 1 . 2]" 1
1470 2 15 LYS H 2 16 PRO HD3 . . 5.500 4.489 4.265 4.717 . 0 0 "[ . 1 . 2]" 1
1471 2 15 LYS H 2 17 LEU QD . . 7.570 5.269 4.816 5.912 . 0 0 "[ . 1 . 2]" 1
1472 2 15 LYS HA 2 15 LYS HD2 . . 5.500 4.255 2.883 4.903 . 0 0 "[ . 1 . 2]" 1
1473 2 15 LYS HA 2 15 LYS HD3 . . 5.500 4.258 2.083 4.816 . 0 0 "[ . 1 . 2]" 1
1474 2 15 LYS HA 2 15 LYS HG2 . . 3.950 2.736 2.358 3.603 . 0 0 "[ . 1 . 2]" 1
1475 2 15 LYS HA 2 15 LYS QG . . 3.740 2.452 2.288 2.866 . 0 0 "[ . 1 . 2]" 1
1476 2 15 LYS HA 2 15 LYS HG3 . . 3.950 3.001 2.318 3.801 . 0 0 "[ . 1 . 2]" 1
1477 2 15 LYS HA 2 16 PRO HD2 . . 3.860 2.063 1.929 2.300 . 0 0 "[ . 1 . 2]" 1
1478 2 15 LYS HA 2 16 PRO HD3 . . 3.860 2.436 2.121 2.636 . 0 0 "[ . 1 . 2]" 1
1479 2 15 LYS HA 2 16 PRO HG2 . . 5.500 4.242 4.107 4.451 . 0 0 "[ . 1 . 2]" 1
1480 2 15 LYS HA 2 16 PRO QG . . 5.070 3.848 3.788 3.956 . 0 0 "[ . 1 . 2]" 1
1481 2 15 LYS HA 2 16 PRO HG3 . . 5.500 4.415 4.292 4.476 . 0 0 "[ . 1 . 2]" 1
1482 2 15 LYS HA 2 17 LEU QD . . 8.100 5.745 5.072 6.176 . 0 0 "[ . 1 . 2]" 1
1483 2 15 LYS QB 2 17 LEU QD . . 8.980 4.518 3.525 5.065 . 0 0 "[ . 1 . 2]" 1
1484 2 15 LYS QD 2 17 LEU QD . . 8.510 6.066 5.125 6.784 . 0 0 "[ . 1 . 2]" 1
1485 2 16 PRO HA 2 17 LEU H . . 3.330 2.262 2.070 2.337 . 0 0 "[ . 1 . 2]" 1
1486 2 16 PRO HA 2 18 GLN H . . 3.490 3.931 3.522 5.432 1.942 10 4 "[* . - + . *2]" 1
1487 2 16 PRO QB 2 17 LEU H . . 3.610 2.585 2.480 2.642 . 0 0 "[ . 1 . 2]" 1
1488 2 16 PRO QB 2 18 GLN H . . 3.590 2.612 1.998 3.790 0.200 10 0 "[ . 1 . 2]" 1
1489 2 16 PRO QB 2 20 VAL MG1 . . 6.530 4.531 2.922 5.661 . 0 0 "[ . 1 . 2]" 1
1490 2 16 PRO QB 2 20 VAL MG2 . . 5.180 3.129 2.453 4.720 . 0 0 "[ . 1 . 2]" 1
1491 2 16 PRO HD2 2 17 LEU H . . 5.500 5.552 5.393 5.655 0.155 6 0 "[ . 1 . 2]" 1
1492 2 16 PRO HD3 2 17 LEU H . . 5.500 5.455 5.285 5.582 0.082 7 0 "[ . 1 . 2]" 1
1493 2 16 PRO QG 2 18 GLN H . . 6.380 4.474 3.820 5.549 . 0 0 "[ . 1 . 2]" 1
1494 2 16 PRO QG 2 20 VAL MG1 . . 6.360 4.143 2.226 5.799 . 0 0 "[ . 1 . 2]" 1
1495 2 16 PRO HG2 2 17 LEU H . . 5.500 4.668 4.502 5.063 . 0 0 "[ . 1 . 2]" 1
1496 2 16 PRO HG2 2 20 VAL MG1 . . 6.530 5.195 2.958 6.690 0.160 8 0 "[ . 1 . 2]" 1
1497 2 16 PRO HG2 2 20 VAL MG2 . . 5.570 3.643 2.536 5.664 0.094 8 0 "[ . 1 . 2]" 1
1498 2 16 PRO HG3 2 17 LEU H . . 5.500 5.002 4.304 5.153 . 0 0 "[ . 1 . 2]" 1
1499 2 16 PRO HG3 2 20 VAL MG1 . . 6.530 4.390 2.302 6.358 . 0 0 "[ . 1 . 2]" 1
1500 2 16 PRO HG3 2 20 VAL MG2 . . 5.570 2.960 2.033 5.707 0.137 8 0 "[ . 1 . 2]" 1
1501 2 17 LEU H 2 17 LEU HB2 . . 4.140 2.526 2.328 2.725 . 0 0 "[ . 1 . 2]" 1
1502 2 17 LEU H 2 17 LEU QB . . 3.920 2.485 2.299 2.665 . 0 0 "[ . 1 . 2]" 1
1503 2 17 LEU H 2 17 LEU HB3 . . 4.140 3.689 3.559 3.777 . 0 0 "[ . 1 . 2]" 1
1504 2 17 LEU H 2 17 LEU HG . . 4.790 3.625 2.588 3.932 . 0 0 "[ . 1 . 2]" 1
1505 2 17 LEU H 2 18 GLN H . . 3.610 2.186 1.618 3.915 0.305 10 0 "[ . 1 . 2]" 1
1506 2 17 LEU HA 2 18 GLN H . . 3.360 3.146 1.998 3.508 0.148 7 0 "[ . 1 . 2]" 1
1507 2 17 LEU QB 2 18 GLN H . . 4.120 2.989 2.078 3.557 . 0 0 "[ . 1 . 2]" 1
1508 2 17 LEU HB2 2 18 GLN H . . 4.320 3.195 2.110 4.361 0.041 1 0 "[ . 1 . 2]" 1
1509 2 17 LEU HB3 2 18 GLN H . . 4.320 3.852 2.815 4.181 . 0 0 "[ . 1 . 2]" 1
1510 2 17 LEU MD1 2 18 GLN H . . 6.530 4.025 3.391 5.330 . 0 0 "[ . 1 . 2]" 1
1511 2 17 LEU MD2 2 18 GLN H . . 6.530 4.924 4.129 5.299 . 0 0 "[ . 1 . 2]" 1
1512 2 17 LEU HG 2 18 GLN H . . 5.500 4.749 3.906 5.058 . 0 0 "[ . 1 . 2]" 1
1513 2 18 GLN H 2 18 GLN HB2 . . 3.860 3.115 2.368 4.061 0.201 19 0 "[ . 1 . 2]" 1
1514 2 18 GLN H 2 18 GLN QB . . 3.600 2.716 2.232 3.217 . 0 0 "[ . 1 . 2]" 1
1515 2 18 GLN H 2 18 GLN HB3 . . 3.860 3.340 2.410 3.775 . 0 0 "[ . 1 . 2]" 1
1516 2 18 GLN H 2 18 GLN HG2 . . 4.410 3.589 2.090 4.783 0.373 19 0 "[ . 1 . 2]" 1
1517 2 18 GLN H 2 18 GLN QG . . 3.930 3.075 1.984 3.959 0.029 18 0 "[ . 1 . 2]" 1
1518 2 18 GLN H 2 18 GLN HG3 . . 4.410 3.671 2.064 4.568 0.158 1 0 "[ . 1 . 2]" 1
1519 2 18 GLN H 2 19 LYS H . . 5.500 4.146 2.010 4.668 . 0 0 "[ . 1 . 2]" 1
1520 2 18 GLN HA 2 19 LYS H . . 3.020 2.499 2.199 3.440 0.420 8 0 "[ . 1 . 2]" 1
1521 2 18 GLN HB2 2 19 LYS H . . 4.010 3.502 1.916 4.346 0.336 10 0 "[ . 1 . 2]" 1
1522 2 18 GLN HB3 2 19 LYS H . . 4.010 3.459 1.742 4.386 0.376 4 0 "[ . 1 . 2]" 1
1523 2 18 GLN HG2 2 19 LYS H . . 5.500 4.011 2.014 5.137 . 0 0 "[ . 1 . 2]" 1
1524 2 18 GLN HG3 2 19 LYS H . . 5.500 4.127 2.521 5.388 . 0 0 "[ . 1 . 2]" 1
1525 2 19 LYS H 2 19 LYS HB2 . . 3.550 2.749 2.275 3.620 0.070 12 0 "[ . 1 . 2]" 1
1526 2 19 LYS H 2 19 LYS HB3 . . 3.550 3.154 2.426 3.960 0.410 4 0 "[ . 1 . 2]" 1
1527 2 19 LYS H 2 19 LYS HD2 . . 5.500 4.701 2.909 5.821 0.321 14 0 "[ . 1 . 2]" 1
1528 2 19 LYS H 2 19 LYS HD3 . . 5.500 4.748 2.833 5.736 0.236 8 0 "[ . 1 . 2]" 1
1529 2 19 LYS H 2 19 LYS HG2 . . 4.380 3.730 2.109 4.665 0.285 8 0 "[ . 1 . 2]" 1
1530 2 19 LYS H 2 19 LYS QG . . 4.230 3.097 2.079 4.021 . 0 0 "[ . 1 . 2]" 1
1531 2 19 LYS H 2 19 LYS HG3 . . 4.380 3.475 2.238 4.523 0.143 13 0 "[ . 1 . 2]" 1
1532 2 19 LYS H 2 20 VAL H . . 5.500 4.516 4.155 4.617 . 0 0 "[ . 1 . 2]" 1
1533 2 19 LYS HA 2 19 LYS HG2 . . 3.980 2.908 2.322 4.033 0.053 18 0 "[ . 1 . 2]" 1
1534 2 19 LYS HA 2 19 LYS QG . . 3.810 2.532 2.259 3.358 . 0 0 "[ . 1 . 2]" 1
1535 2 19 LYS HA 2 19 LYS HG3 . . 3.980 3.002 2.454 3.751 . 0 0 "[ . 1 . 2]" 1
1536 2 19 LYS HA 2 20 VAL H . . 3.020 2.274 2.057 3.259 0.239 8 0 "[ . 1 . 2]" 1
1537 2 19 LYS QB 2 20 VAL H . . 3.770 2.954 1.761 3.703 . 0 0 "[ . 1 . 2]" 1
1538 2 19 LYS HB2 2 20 VAL H . . 4.040 3.797 2.703 4.253 0.213 17 0 "[ . 1 . 2]" 1
1539 2 19 LYS HB3 2 20 VAL H . . 4.040 3.250 1.784 4.198 0.158 20 0 "[ . 1 . 2]" 1
1540 2 19 LYS HD2 2 20 VAL H . . 5.500 4.898 2.057 5.731 0.231 5 0 "[ . 1 . 2]" 1
1541 2 19 LYS HD3 2 20 VAL H . . 5.500 4.750 2.800 5.629 0.129 12 0 "[ . 1 . 2]" 1
1542 2 19 LYS HG2 2 20 VAL H . . 4.880 3.756 1.968 5.053 0.173 18 0 "[ . 1 . 2]" 1
1543 2 19 LYS HG3 2 20 VAL H . . 4.880 4.081 2.884 4.961 0.081 5 0 "[ . 1 . 2]" 1
1544 2 20 VAL H 2 20 VAL HB . . 2.990 2.978 2.642 3.532 0.542 8 1 "[ . + 1 . 2]" 1
1545 2 20 VAL H 2 20 VAL MG2 . . 4.420 2.689 1.762 3.992 . 0 0 "[ . 1 . 2]" 1
1546 2 20 VAL H 2 21 ASP H . . 5.500 4.378 4.166 4.547 . 0 0 "[ . 1 . 2]" 1
1547 2 20 VAL HA 2 21 ASP H . . 2.990 2.172 1.969 2.562 . 0 0 "[ . 1 . 2]" 1
1548 2 20 VAL HA 2 21 ASP QB . . 4.350 3.919 3.677 4.281 . 0 0 "[ . 1 . 2]" 1
1549 2 20 VAL HA 2 22 LEU H . . 4.380 4.198 3.379 4.808 0.428 4 0 "[ . 1 . 2]" 1
1550 2 20 VAL HB 2 21 ASP H . . 3.550 3.663 3.305 3.886 0.336 9 0 "[ . 1 . 2]" 1
1551 2 20 VAL HB 2 21 ASP QB . . 6.380 5.361 4.929 6.050 . 0 0 "[ . 1 . 2]" 1
1552 2 20 VAL HB 2 22 LEU H . . 3.830 3.640 2.914 5.208 1.378 12 1 "[ . 1 + . 2]" 1
1553 2 20 VAL HB 2 22 LEU MD1 . . 6.530 4.066 2.994 4.840 . 0 0 "[ . 1 . 2]" 1
1554 2 20 VAL HB 2 22 LEU HG . . 5.030 4.176 3.089 4.865 . 0 0 "[ . 1 . 2]" 1
1555 2 20 VAL MG1 2 21 ASP H . . 5.540 2.510 1.757 4.029 . 0 0 "[ . 1 . 2]" 1
1556 2 20 VAL MG1 2 22 LEU H . . 4.760 2.557 1.714 4.702 . 0 0 "[ . 1 . 2]" 1
1557 2 20 VAL MG1 2 22 LEU MD1 . . 6.100 2.614 2.017 4.554 . 0 0 "[ . 1 . 2]" 1
1558 2 20 VAL MG2 2 21 ASP H . . 6.530 3.665 1.751 4.234 . 0 0 "[ . 1 . 2]" 1
1559 2 20 VAL MG2 2 22 LEU H . . 5.160 4.116 1.668 5.162 0.002 7 0 "[ . 1 . 2]" 1
1560 2 21 ASP H 2 21 ASP QB . . 3.420 2.513 2.215 2.948 . 0 0 "[ . 1 . 2]" 1
1561 2 21 ASP H 2 22 LEU H . . 4.230 2.739 1.986 3.683 . 0 0 "[ . 1 . 2]" 1
1562 2 21 ASP HA 2 22 LEU H . . 2.990 2.671 2.080 3.090 0.100 10 0 "[ . 1 . 2]" 1
1563 2 21 ASP QB 2 22 LEU H . . 3.970 3.719 3.472 3.905 . 0 0 "[ . 1 . 2]" 1
1564 2 22 LEU H 2 22 LEU HB2 . . 3.420 2.493 2.273 3.620 0.200 4 0 "[ . 1 . 2]" 1
1565 2 22 LEU H 2 22 LEU HB3 . . 3.420 3.598 3.531 3.687 0.267 19 0 "[ . 1 . 2]" 1
1566 2 22 LEU H 2 22 LEU MD2 . . 5.750 3.613 3.241 3.962 . 0 0 "[ . 1 . 2]" 1
1567 2 22 LEU H 2 22 LEU HG . . 4.070 2.684 2.214 3.245 . 0 0 "[ . 1 . 2]" 1
1568 2 22 LEU H 2 23 LYS H . . 5.500 4.302 2.024 4.622 . 0 0 "[ . 1 . 2]" 1
1569 2 22 LEU HA 2 22 LEU HG . . 3.950 3.087 2.832 3.532 . 0 0 "[ . 1 . 2]" 1
1570 2 22 LEU HA 2 23 LYS H . . 3.050 2.645 2.061 3.214 0.164 2 0 "[ . 1 . 2]" 1
1571 2 22 LEU QB 2 26 GLU QB . . 5.040 2.598 1.943 3.415 . 0 0 "[ . 1 . 2]" 1
1572 2 22 LEU QB 2 26 GLU QG . . 6.320 2.043 1.729 2.590 . 0 0 "[ . 1 . 2]" 1
1573 2 22 LEU HB2 2 23 LYS H . . 4.040 3.272 2.862 3.675 . 0 0 "[ . 1 . 2]" 1
1574 2 22 LEU HB2 2 26 GLU QB . . 6.040 3.518 2.405 4.689 . 0 0 "[ . 1 . 2]" 1
1575 2 22 LEU HB2 2 26 GLU HG2 . . 7.250 4.314 3.112 5.965 . 0 0 "[ . 1 . 2]" 1
1576 2 22 LEU HB2 2 26 GLU HG3 . . 7.250 4.051 2.165 5.510 . 0 0 "[ . 1 . 2]" 1
1577 2 22 LEU HB3 2 23 LYS H . . 4.040 2.235 1.766 4.076 0.036 2 0 "[ . 1 . 2]" 1
1578 2 22 LEU HB3 2 26 GLU QB . . 6.040 2.764 1.958 3.935 . 0 0 "[ . 1 . 2]" 1
1579 2 22 LEU HB3 2 26 GLU HG2 . . 7.250 3.035 1.771 5.280 . 0 0 "[ . 1 . 2]" 1
1580 2 22 LEU HB3 2 26 GLU HG3 . . 7.250 2.740 1.748 4.140 . 0 0 "[ . 1 . 2]" 1
1581 2 22 LEU MD1 2 23 LYS H . . 6.530 4.100 3.720 4.961 . 0 0 "[ . 1 . 2]" 1
1582 2 22 LEU MD1 2 26 GLU QB . . 5.970 2.780 1.896 3.950 . 0 0 "[ . 1 . 2]" 1
1583 2 22 LEU MD1 2 26 GLU HG2 . . 6.530 3.610 1.777 5.548 . 0 0 "[ . 1 . 2]" 1
1584 2 22 LEU MD1 2 26 GLU QG . . 6.190 2.689 1.751 3.980 . 0 0 "[ . 1 . 2]" 1
1585 2 22 LEU MD1 2 26 GLU HG3 . . 6.530 3.062 2.523 4.079 . 0 0 "[ . 1 . 2]" 1
1586 2 22 LEU MD2 2 23 LYS H . . 5.940 3.486 2.716 5.393 . 0 0 "[ . 1 . 2]" 1
1587 2 22 LEU MD2 2 26 GLU QB . . 6.880 3.630 2.395 4.365 . 0 0 "[ . 1 . 2]" 1
1588 2 22 LEU MD2 2 26 GLU HG2 . . 5.660 3.575 2.148 5.345 . 0 0 "[ . 1 . 2]" 1
1589 2 22 LEU MD2 2 26 GLU QG . . 5.450 2.591 1.779 3.884 . 0 0 "[ . 1 . 2]" 1
1590 2 22 LEU MD2 2 26 GLU HG3 . . 5.660 3.069 1.786 3.989 . 0 0 "[ . 1 . 2]" 1
1591 2 22 LEU HG 2 23 LYS H . . 5.500 4.691 4.331 5.187 . 0 0 "[ . 1 . 2]" 1
1592 2 23 LYS H 2 23 LYS HB2 . . 3.520 2.857 2.324 3.804 0.284 3 0 "[ . 1 . 2]" 1
1593 2 23 LYS H 2 23 LYS HB3 . . 3.520 3.461 2.433 4.013 0.493 2 0 "[ . 1 . 2]" 1
1594 2 23 LYS H 2 23 LYS HD2 . . 5.500 4.458 3.035 5.495 . 0 0 "[ . 1 . 2]" 1
1595 2 23 LYS H 2 23 LYS QD . . 5.180 3.905 1.757 4.853 . 0 0 "[ . 1 . 2]" 1
1596 2 23 LYS H 2 23 LYS HD3 . . 5.500 4.518 1.768 5.516 0.016 2 0 "[ . 1 . 2]" 1
1597 2 23 LYS H 2 23 LYS HG2 . . 5.000 3.641 2.250 4.835 . 0 0 "[ . 1 . 2]" 1
1598 2 23 LYS H 2 23 LYS QG . . 4.820 2.967 1.950 4.233 . 0 0 "[ . 1 . 2]" 1
1599 2 23 LYS H 2 23 LYS HG3 . . 5.000 3.377 1.962 4.830 . 0 0 "[ . 1 . 2]" 1
1600 2 23 LYS H 2 24 GLU H . . 5.500 4.476 4.308 4.622 . 0 0 "[ . 1 . 2]" 1
1601 2 23 LYS H 2 26 GLU QB . . 3.740 2.942 2.509 3.915 0.175 2 0 "[ . 1 . 2]" 1
1602 2 23 LYS H 2 26 GLU HG2 . . 4.940 2.879 1.877 5.074 0.134 2 0 "[ . 1 . 2]" 1
1603 2 23 LYS H 2 26 GLU QG . . 4.410 2.524 1.736 4.326 . 0 0 "[ . 1 . 2]" 1
1604 2 23 LYS H 2 26 GLU HG3 . . 4.940 3.156 1.821 4.982 0.042 10 0 "[ . 1 . 2]" 1
1605 2 23 LYS HA 2 23 LYS HD2 . . 5.280 4.146 2.216 4.787 . 0 0 "[ . 1 . 2]" 1
1606 2 23 LYS HA 2 23 LYS QD . . 4.990 3.598 1.832 4.254 . 0 0 "[ . 1 . 2]" 1
1607 2 23 LYS HA 2 23 LYS HD3 . . 5.280 4.096 1.887 4.808 . 0 0 "[ . 1 . 2]" 1
1608 2 23 LYS HA 2 24 GLU H . . 3.110 2.468 2.291 2.733 . 0 0 "[ . 1 . 2]" 1
1609 2 23 LYS HA 2 26 GLU QB . . 4.580 4.645 4.341 4.872 0.292 6 0 "[ . 1 . 2]" 1
1610 2 23 LYS HA 2 26 GLU QG . . 5.850 4.686 3.689 5.876 0.026 3 0 "[ . 1 . 2]" 1
1611 2 23 LYS QB 2 24 GLU H . . 3.760 2.389 1.816 3.473 . 0 0 "[ . 1 . 2]" 1
1612 2 23 LYS HB2 2 24 GLU H . . 3.920 3.365 2.128 3.985 0.065 14 0 "[ . 1 . 2]" 1
1613 2 23 LYS HB3 2 24 GLU H . . 3.920 2.662 1.831 3.959 0.039 17 0 "[ . 1 . 2]" 1
1614 2 23 LYS QD 2 24 GLU H . . 5.220 4.174 2.360 4.918 . 0 0 "[ . 1 . 2]" 1
1615 2 23 LYS HD2 2 24 GLU H . . 5.500 4.823 2.469 5.676 0.176 1 0 "[ . 1 . 2]" 1
1616 2 23 LYS HD3 2 24 GLU H . . 5.500 4.780 2.379 5.578 0.078 5 0 "[ . 1 . 2]" 1
1617 2 23 LYS HG2 2 24 GLU H . . 5.500 3.990 2.179 4.850 . 0 0 "[ . 1 . 2]" 1
1618 2 23 LYS HG3 2 24 GLU H . . 5.500 4.224 2.559 5.089 . 0 0 "[ . 1 . 2]" 1
1619 2 24 GLU H 2 24 GLU HB2 . . 3.330 2.645 2.258 3.578 0.248 12 0 "[ . 1 . 2]" 1
1620 2 24 GLU H 2 24 GLU HB3 . . 3.330 3.506 2.840 3.639 0.309 5 0 "[ . 1 . 2]" 1
1621 2 24 GLU H 2 24 GLU HG2 . . 3.830 3.591 2.775 3.924 0.094 6 0 "[ . 1 . 2]" 1
1622 2 24 GLU H 2 24 GLU QG . . 3.590 2.699 2.019 3.448 . 0 0 "[ . 1 . 2]" 1
1623 2 24 GLU H 2 24 GLU HG3 . . 3.830 2.867 2.032 3.822 . 0 0 "[ . 1 . 2]" 1
1624 2 24 GLU H 2 25 GLY H . . 5.500 4.478 4.328 4.552 . 0 0 "[ . 1 . 2]" 1
1625 2 24 GLU HA 2 25 GLY H . . 2.990 2.115 2.036 2.206 . 0 0 "[ . 1 . 2]" 1
1626 2 24 GLU HA 2 26 GLU H . . 3.420 3.473 3.124 3.746 0.326 14 0 "[ . 1 . 2]" 1
1627 2 24 GLU HB2 2 25 GLY H . . 3.980 3.927 3.268 4.154 0.174 5 0 "[ . 1 . 2]" 1
1628 2 24 GLU HB3 2 25 GLY H . . 3.980 3.190 2.718 4.062 0.082 12 0 "[ . 1 . 2]" 1
1629 2 24 GLU HG2 2 25 GLY H . . 5.410 4.907 4.007 5.601 0.191 19 0 "[ . 1 . 2]" 1
1630 2 24 GLU HG3 2 25 GLY H . . 5.410 4.615 3.811 5.367 . 0 0 "[ . 1 . 2]" 1
1631 2 25 GLY H 2 26 GLU H . . 3.330 2.546 2.103 2.948 . 0 0 "[ . 1 . 2]" 1
1632 2 25 GLY QA 2 26 GLU H . . 3.210 2.688 2.461 2.929 . 0 0 "[ . 1 . 2]" 1
1633 2 25 GLY HA2 2 26 GLU H . . 3.390 2.830 2.513 3.196 . 0 0 "[ . 1 . 2]" 1
1634 2 25 GLY HA3 2 26 GLU H . . 3.390 3.470 3.389 3.536 0.146 4 0 "[ . 1 . 2]" 1
1635 2 26 GLU H 2 26 GLU QB . . 3.490 2.195 2.105 2.337 . 0 0 "[ . 1 . 2]" 1
1636 2 26 GLU H 2 26 GLU HG2 . . 4.290 3.966 3.278 4.556 0.266 14 0 "[ . 1 . 2]" 1
1637 2 26 GLU H 2 26 GLU QG . . 3.970 3.661 3.181 3.987 0.017 11 0 "[ . 1 . 2]" 1
1638 2 26 GLU H 2 26 GLU HG3 . . 4.290 4.420 4.296 4.604 0.314 2 0 "[ . 1 . 2]" 1
1639 2 26 GLU H 2 27 ARG H . . 5.500 4.557 4.456 4.633 . 0 0 "[ . 1 . 2]" 1
1640 2 26 GLU HA 2 26 GLU HG2 . . 4.010 2.994 2.440 3.726 . 0 0 "[ . 1 . 2]" 1
1641 2 26 GLU HA 2 26 GLU QG . . 3.850 2.669 2.402 2.965 . 0 0 "[ . 1 . 2]" 1
1642 2 26 GLU HA 2 26 GLU HG3 . . 4.010 3.371 2.889 3.595 . 0 0 "[ . 1 . 2]" 1
1643 2 26 GLU HA 2 27 ARG H . . 3.050 2.232 2.156 2.343 . 0 0 "[ . 1 . 2]" 1
1644 2 26 GLU QB 2 27 ARG H . . 3.930 3.315 2.875 3.792 . 0 0 "[ . 1 . 2]" 1
1645 2 26 GLU QB 2 28 VAL MG1 . . 6.210 2.993 2.636 3.776 . 0 0 "[ . 1 . 2]" 1
1646 2 26 GLU QG 2 27 ARG H . . 4.420 3.513 2.471 4.166 . 0 0 "[ . 1 . 2]" 1
1647 2 26 GLU QG 2 28 VAL MG2 . . 7.410 5.354 4.081 6.261 . 0 0 "[ . 1 . 2]" 1
1648 2 26 GLU HG2 2 27 ARG H . . 4.570 4.284 3.639 4.630 0.060 12 0 "[ . 1 . 2]" 1
1649 2 26 GLU HG2 2 28 VAL MG1 . . 5.470 4.735 3.091 5.603 0.133 1 0 "[ . 1 . 2]" 1
1650 2 26 GLU HG3 2 27 ARG H . . 4.570 3.933 2.498 4.754 0.184 13 0 "[ . 1 . 2]" 1
1651 2 26 GLU HG3 2 28 VAL MG1 . . 5.470 3.890 2.265 4.841 . 0 0 "[ . 1 . 2]" 1
1652 2 27 ARG H 2 27 ARG HB2 . . 3.580 2.535 2.276 2.938 . 0 0 "[ . 1 . 2]" 1
1653 2 27 ARG H 2 27 ARG HB3 . . 3.580 2.986 2.433 3.636 0.056 16 0 "[ . 1 . 2]" 1
1654 2 27 ARG H 2 27 ARG HD2 . . 5.500 4.882 2.646 5.769 0.269 2 0 "[ . 1 . 2]" 1
1655 2 27 ARG H 2 27 ARG HD3 . . 5.500 4.387 2.341 5.263 . 0 0 "[ . 1 . 2]" 1
1656 2 27 ARG H 2 27 ARG HG2 . . 5.160 4.245 2.463 4.709 . 0 0 "[ . 1 . 2]" 1
1657 2 27 ARG H 2 27 ARG QG . . 4.510 3.726 2.428 4.160 . 0 0 "[ . 1 . 2]" 1
1658 2 27 ARG H 2 27 ARG HG3 . . 5.160 4.252 3.066 4.638 . 0 0 "[ . 1 . 2]" 1
1659 2 27 ARG H 2 28 VAL H . . 5.500 4.332 4.110 4.496 . 0 0 "[ . 1 . 2]" 1
1660 2 27 ARG H 2 28 VAL MG1 . . 6.400 3.865 3.599 4.119 . 0 0 "[ . 1 . 2]" 1
1661 2 27 ARG HA 2 27 ARG QD . . 4.490 2.657 1.771 4.054 . 0 0 "[ . 1 . 2]" 1
1662 2 27 ARG HA 2 27 ARG HG2 . . 4.110 3.363 2.325 3.792 . 0 0 "[ . 1 . 2]" 1
1663 2 27 ARG HA 2 27 ARG QG . . 3.780 2.561 2.093 2.928 . 0 0 "[ . 1 . 2]" 1
1664 2 27 ARG HA 2 27 ARG HG3 . . 4.110 2.793 2.160 3.794 . 0 0 "[ . 1 . 2]" 1
1665 2 27 ARG HA 2 28 VAL H . . 3.240 2.031 1.946 2.128 . 0 0 "[ . 1 . 2]" 1
1666 2 27 ARG HB2 2 28 VAL H . . 3.980 4.237 4.024 4.411 0.431 14 0 "[ . 1 . 2]" 1
1667 2 27 ARG HB3 2 28 VAL H . . 3.980 3.817 2.852 4.195 0.215 2 0 "[ . 1 . 2]" 1
1668 2 27 ARG QD 2 28 VAL H . . 5.330 3.851 2.327 5.070 . 0 0 "[ . 1 . 2]" 1
1669 2 27 ARG HD2 2 28 VAL H . . 5.500 4.435 3.213 5.777 0.277 1 0 "[ . 1 . 2]" 1
1670 2 27 ARG HD3 2 28 VAL H . . 5.500 4.574 2.359 5.626 0.126 16 0 "[ . 1 . 2]" 1
1671 2 27 ARG HG2 2 28 VAL H . . 5.380 4.376 3.158 5.226 . 0 0 "[ . 1 . 2]" 1
1672 2 27 ARG HG3 2 28 VAL H . . 5.380 3.630 2.722 5.494 0.114 5 0 "[ . 1 . 2]" 1
1673 2 28 VAL H 2 28 VAL HB . . 4.070 3.858 3.801 3.933 . 0 0 "[ . 1 . 2]" 1
1674 2 28 VAL H 2 29 LYS H . . 5.500 4.428 4.390 4.470 . 0 0 "[ . 1 . 2]" 1
1675 2 28 VAL HA 2 29 LYS H . . 3.240 2.367 2.193 2.528 . 0 0 "[ . 1 . 2]" 1
1676 2 28 VAL HB 2 29 LYS H . . 4.110 2.502 2.170 2.779 . 0 0 "[ . 1 . 2]" 1
1677 2 28 VAL HB 2 30 ILE MG . . 6.190 5.701 4.908 6.075 . 0 0 "[ . 1 . 2]" 1
1678 2 28 VAL MG1 2 29 LYS H . . 6.160 3.699 3.544 3.831 . 0 0 "[ . 1 . 2]" 1
1679 2 28 VAL MG2 2 29 LYS H . . 6.090 3.476 3.156 3.741 . 0 0 "[ . 1 . 2]" 1
1680 2 28 VAL MG2 2 30 ILE MD . . 7.560 2.752 2.001 4.082 . 0 0 "[ . 1 . 2]" 1
1681 2 28 VAL MG2 2 30 ILE MG . . 7.560 4.655 3.880 5.059 . 0 0 "[ . 1 . 2]" 1
1682 2 29 LYS H 2 29 LYS HB2 . . 3.520 2.523 2.386 2.676 . 0 0 "[ . 1 . 2]" 1
1683 2 29 LYS H 2 29 LYS QB . . 3.340 2.481 2.353 2.620 . 0 0 "[ . 1 . 2]" 1
1684 2 29 LYS H 2 29 LYS HB3 . . 3.520 3.667 3.578 3.735 0.215 10 0 "[ . 1 . 2]" 1
1685 2 29 LYS H 2 29 LYS HD2 . . 5.500 4.836 3.231 5.530 0.030 9 0 "[ . 1 . 2]" 1
1686 2 29 LYS H 2 29 LYS HD3 . . 5.500 4.951 3.016 5.690 0.190 10 0 "[ . 1 . 2]" 1
1687 2 29 LYS H 2 29 LYS HG2 . . 4.230 3.900 2.548 4.479 0.249 9 0 "[ . 1 . 2]" 1
1688 2 29 LYS H 2 29 LYS HG3 . . 4.230 3.492 2.847 4.336 0.106 4 0 "[ . 1 . 2]" 1
1689 2 29 LYS H 2 30 ILE H . . 5.500 4.377 4.315 4.423 . 0 0 "[ . 1 . 2]" 1
1690 2 29 LYS HA 2 29 LYS HD2 . . 5.440 4.116 2.552 4.613 . 0 0 "[ . 1 . 2]" 1
1691 2 29 LYS HA 2 29 LYS QD . . 4.740 3.476 1.972 4.034 . 0 0 "[ . 1 . 2]" 1
1692 2 29 LYS HA 2 29 LYS HD3 . . 5.440 3.843 1.992 4.485 . 0 0 "[ . 1 . 2]" 1
1693 2 29 LYS HA 2 29 LYS HG2 . . 3.950 2.583 2.216 3.684 . 0 0 "[ . 1 . 2]" 1
1694 2 29 LYS HA 2 29 LYS HG3 . . 3.950 3.107 2.532 3.861 . 0 0 "[ . 1 . 2]" 1
1695 2 29 LYS HA 2 30 ILE H . . 3.020 2.181 2.055 2.281 . 0 0 "[ . 1 . 2]" 1
1696 2 29 LYS QB 2 30 ILE H . . 3.720 2.782 2.502 2.931 . 0 0 "[ . 1 . 2]" 1
1697 2 29 LYS HB2 2 30 ILE H . . 3.920 3.980 3.737 4.103 0.183 4 0 "[ . 1 . 2]" 1
1698 2 29 LYS HB3 2 30 ILE H . . 3.920 2.841 2.536 3.004 . 0 0 "[ . 1 . 2]" 1
1699 2 29 LYS HD2 2 30 ILE H . . 5.500 5.165 3.979 5.975 0.475 12 0 "[ . 1 . 2]" 1
1700 2 29 LYS HD3 2 30 ILE H . . 5.500 4.880 3.560 5.654 0.154 11 0 "[ . 1 . 2]" 1
1701 2 29 LYS QG 2 30 ILE H . . 4.780 3.820 3.345 4.570 . 0 0 "[ . 1 . 2]" 1
1702 2 29 LYS HG2 2 30 ILE H . . 5.000 4.079 3.440 5.070 0.070 2 0 "[ . 1 . 2]" 1
1703 2 29 LYS HG3 2 30 ILE H . . 5.000 4.806 3.767 5.232 0.232 17 0 "[ . 1 . 2]" 1
1704 2 30 ILE H 2 30 ILE HB . . 3.450 2.919 2.739 3.361 . 0 0 "[ . 1 . 2]" 1
1705 2 30 ILE H 2 30 ILE HG12 . . 4.040 2.812 1.903 4.074 0.034 17 0 "[ . 1 . 2]" 1
1706 2 30 ILE H 2 30 ILE QG . . 3.710 2.286 1.895 2.721 . 0 0 "[ . 1 . 2]" 1
1707 2 30 ILE H 2 30 ILE HG13 . . 4.040 3.164 2.053 3.892 . 0 0 "[ . 1 . 2]" 1
1708 2 30 ILE H 2 31 LYS H . . 5.500 4.371 4.255 4.445 . 0 0 "[ . 1 . 2]" 1
1709 2 30 ILE HA 2 30 ILE HG12 . . 4.010 3.135 2.630 3.498 . 0 0 "[ . 1 . 2]" 1
1710 2 30 ILE HA 2 30 ILE QG . . 3.660 2.962 2.522 3.282 . 0 0 "[ . 1 . 2]" 1
1711 2 30 ILE HA 2 30 ILE HG13 . . 4.010 3.651 2.971 4.041 0.031 9 0 "[ . 1 . 2]" 1
1712 2 30 ILE HA 2 31 LYS H . . 3.050 2.141 2.025 2.273 . 0 0 "[ . 1 . 2]" 1
1713 2 30 ILE HB 2 31 LYS H . . 3.490 3.669 3.532 3.847 0.357 17 0 "[ . 1 . 2]" 1
1714 2 30 ILE MD 2 31 LYS H . . 6.000 4.533 3.841 5.240 . 0 0 "[ . 1 . 2]" 1
1715 2 30 ILE MD 2 32 LEU MD1 . . 7.560 6.737 4.477 7.719 0.159 18 0 "[ . 1 . 2]" 1
1716 2 30 ILE MD 2 32 LEU MD2 . . 7.560 6.018 4.812 7.114 . 0 0 "[ . 1 . 2]" 1
1717 2 30 ILE QG 2 32 LEU MD2 . . 6.760 6.226 4.582 7.096 0.336 19 0 "[ . 1 . 2]" 1
1718 2 30 ILE HG12 2 31 LYS H . . 5.500 4.908 4.410 5.179 . 0 0 "[ . 1 . 2]" 1
1719 2 30 ILE HG13 2 31 LYS H . . 5.500 5.225 4.827 5.575 0.075 11 0 "[ . 1 . 2]" 1
1720 2 30 ILE MG 2 31 LYS H . . 5.160 2.391 2.098 2.981 . 0 0 "[ . 1 . 2]" 1
1721 2 30 ILE MG 2 32 LEU H . . 6.530 4.588 3.681 5.157 . 0 0 "[ . 1 . 2]" 1
1722 2 30 ILE MG 2 32 LEU HA . . 5.660 4.392 3.890 5.114 . 0 0 "[ . 1 . 2]" 1
1723 2 30 ILE MG 2 32 LEU HB2 . . 6.530 5.864 3.699 6.623 0.093 5 0 "[ . 1 . 2]" 1
1724 2 30 ILE MG 2 32 LEU HB3 . . 6.530 5.804 4.088 6.568 0.038 7 0 "[ . 1 . 2]" 1
1725 2 30 ILE MG 2 32 LEU MD1 . . 7.560 4.793 3.077 6.088 . 0 0 "[ . 1 . 2]" 1
1726 2 30 ILE MG 2 32 LEU MD2 . . 7.310 4.061 2.719 5.417 . 0 0 "[ . 1 . 2]" 1
1727 2 30 ILE MG 2 32 LEU HG . . 6.120 5.061 3.564 6.212 0.092 19 0 "[ . 1 . 2]" 1
1728 2 30 ILE MG 2 33 GLU H . . 6.470 5.803 5.259 6.674 0.204 17 0 "[ . 1 . 2]" 1
1729 2 31 LYS H 2 31 LYS HB2 . . 3.520 3.406 2.413 3.890 0.370 14 0 "[ . 1 . 2]" 1
1730 2 31 LYS H 2 31 LYS HB3 . . 3.520 3.181 2.650 3.770 0.250 2 0 "[ . 1 . 2]" 1
1731 2 31 LYS H 2 31 LYS HD2 . . 5.500 4.736 1.908 5.803 0.303 10 0 "[ . 1 . 2]" 1
1732 2 31 LYS H 2 31 LYS HD3 . . 5.500 4.870 3.474 5.658 0.158 18 0 "[ . 1 . 2]" 1
1733 2 31 LYS H 2 31 LYS HG2 . . 4.910 3.683 1.961 5.042 0.132 3 0 "[ . 1 . 2]" 1
1734 2 31 LYS H 2 31 LYS HG3 . . 4.910 3.848 2.112 4.826 . 0 0 "[ . 1 . 2]" 1
1735 2 31 LYS H 2 32 LEU H . . 5.500 4.235 4.054 4.376 . 0 0 "[ . 1 . 2]" 1
1736 2 31 LYS HA 2 31 LYS HD2 . . 5.500 4.368 2.194 5.515 0.015 20 0 "[ . 1 . 2]" 1
1737 2 31 LYS HA 2 31 LYS QD . . 4.980 3.755 1.863 4.499 . 0 0 "[ . 1 . 2]" 1
1738 2 31 LYS HA 2 31 LYS HD3 . . 5.500 4.317 1.872 5.479 . 0 0 "[ . 1 . 2]" 1
1739 2 31 LYS HA 2 31 LYS HG2 . . 3.700 3.446 2.672 4.042 0.342 8 0 "[ . 1 . 2]" 1
1740 2 31 LYS HA 2 31 LYS HG3 . . 3.700 3.219 2.165 4.134 0.434 9 0 "[ . 1 . 2]" 1
1741 2 31 LYS HA 2 32 LEU H . . 3.050 2.261 2.065 2.444 . 0 0 "[ . 1 . 2]" 1
1742 2 31 LYS QB 2 32 LEU H . . 3.820 3.017 2.261 3.796 . 0 0 "[ . 1 . 2]" 1
1743 2 31 LYS HB2 2 32 LEU H . . 4.260 3.385 2.282 4.467 0.207 10 0 "[ . 1 . 2]" 1
1744 2 31 LYS HB3 2 32 LEU H . . 4.260 3.798 2.749 4.253 . 0 0 "[ . 1 . 2]" 1
1745 2 31 LYS HD2 2 32 LEU H . . 5.500 5.074 2.417 5.685 0.185 6 0 "[ . 1 . 2]" 1
1746 2 31 LYS HD3 2 32 LEU H . . 5.500 4.971 3.026 5.745 0.245 9 0 "[ . 1 . 2]" 1
1747 2 31 LYS QG 2 32 LEU H . . 4.370 3.321 2.753 4.227 . 0 0 "[ . 1 . 2]" 1
1748 2 31 LYS HG2 2 32 LEU H . . 4.570 4.086 2.941 4.830 0.260 2 0 "[ . 1 . 2]" 1
1749 2 31 LYS HG3 2 32 LEU H . . 4.570 3.659 2.995 4.669 0.099 2 0 "[ . 1 . 2]" 1
1750 2 32 LEU H 2 32 LEU HB2 . . 3.520 2.688 2.269 3.748 0.228 20 0 "[ . 1 . 2]" 1
1751 2 32 LEU H 2 32 LEU HB3 . . 3.520 3.479 2.257 3.678 0.158 8 0 "[ . 1 . 2]" 1
1752 2 32 LEU H 2 32 LEU MD1 . . 5.600 3.255 1.712 4.249 . 0 0 "[ . 1 . 2]" 1
1753 2 32 LEU H 2 32 LEU HG . . 4.010 2.956 1.870 4.702 0.692 17 1 "[ . 1 . + 2]" 1
1754 2 32 LEU H 2 33 GLU H . . 5.500 4.449 4.303 4.623 . 0 0 "[ . 1 . 2]" 1
1755 2 32 LEU HA 2 32 LEU HG . . 3.670 3.121 2.421 3.767 0.097 20 0 "[ . 1 . 2]" 1
1756 2 32 LEU HA 2 33 GLU H . . 3.050 2.206 2.135 2.421 . 0 0 "[ . 1 . 2]" 1
1757 2 32 LEU QB 2 33 GLU H . . 3.810 3.208 2.559 3.728 . 0 0 "[ . 1 . 2]" 1
1758 2 32 LEU HB2 2 33 GLU H . . 4.110 4.045 2.600 4.306 0.196 15 0 "[ . 1 . 2]" 1
1759 2 32 LEU HB3 2 33 GLU H . . 4.110 3.448 3.024 4.226 0.116 19 0 "[ . 1 . 2]" 1
1760 2 32 LEU MD1 2 33 GLU H . . 6.430 4.582 2.056 5.358 . 0 0 "[ . 1 . 2]" 1
1761 2 32 LEU MD2 2 33 GLU H . . 5.780 4.314 3.490 4.982 . 0 0 "[ . 1 . 2]" 1
1762 2 32 LEU HG 2 33 GLU H . . 5.250 4.702 1.776 5.349 0.099 14 0 "[ . 1 . 2]" 1
1763 2 33 GLU H 2 33 GLU HB2 . . 3.390 2.617 2.247 3.392 0.002 17 0 "[ . 1 . 2]" 1
1764 2 33 GLU H 2 33 GLU HB3 . . 3.390 3.380 2.563 3.773 0.383 11 0 "[ . 1 . 2]" 1
1765 2 33 GLU H 2 33 GLU HG2 . . 4.510 3.667 2.254 4.709 0.199 19 0 "[ . 1 . 2]" 1
1766 2 33 GLU H 2 33 GLU HG3 . . 4.510 4.005 2.680 4.756 0.246 17 0 "[ . 1 . 2]" 1
1767 2 33 GLU H 2 34 LEU H . . 5.500 4.443 4.240 4.607 . 0 0 "[ . 1 . 2]" 1
1768 2 33 GLU HA 2 34 LEU H . . 3.050 2.221 2.017 2.460 . 0 0 "[ . 1 . 2]" 1
1769 2 33 GLU QB 2 34 LEU H . . 3.560 2.882 2.229 3.503 . 0 0 "[ . 1 . 2]" 1
1770 2 33 GLU HB2 2 34 LEU H . . 3.800 3.919 3.685 4.167 0.367 18 0 "[ . 1 . 2]" 1
1771 2 33 GLU HB3 2 34 LEU H . . 3.800 3.016 2.247 3.936 0.136 13 0 "[ . 1 . 2]" 1
1772 2 33 GLU HG2 2 34 LEU H . . 5.500 3.815 1.774 5.101 . 0 0 "[ . 1 . 2]" 1
1773 2 33 GLU HG3 2 34 LEU H . . 5.500 4.137 2.290 5.394 . 0 0 "[ . 1 . 2]" 1
1774 2 34 LEU H 2 34 LEU HB2 . . 3.670 3.060 2.418 3.900 0.230 13 0 "[ . 1 . 2]" 1
1775 2 34 LEU H 2 34 LEU QB . . 3.320 2.732 2.384 3.267 . 0 0 "[ . 1 . 2]" 1
1776 2 34 LEU H 2 34 LEU HB3 . . 3.670 3.495 2.453 3.808 0.138 18 0 "[ . 1 . 2]" 1
1777 2 34 LEU H 2 34 LEU MD2 . . 5.470 3.604 1.747 4.654 . 0 0 "[ . 1 . 2]" 1
1778 2 34 LEU H 2 34 LEU HG . . 3.730 3.075 1.735 4.102 0.372 3 0 "[ . 1 . 2]" 1
1779 2 34 LEU H 2 35 LYS H . . 5.500 4.352 4.137 4.559 . 0 0 "[ . 1 . 2]" 1
1780 2 34 LEU HA 2 34 LEU HG . . 3.450 3.109 2.414 3.657 0.207 2 0 "[ . 1 . 2]" 1
1781 2 34 LEU HA 2 35 LYS H . . 3.050 2.501 2.226 2.991 . 0 0 "[ . 1 . 2]" 1
1782 2 34 LEU QB 2 35 LYS H . . 3.620 2.259 1.731 3.400 . 0 0 "[ . 1 . 2]" 1
1783 2 34 LEU HB2 2 35 LYS H . . 3.800 3.035 1.812 3.975 0.175 18 0 "[ . 1 . 2]" 1
1784 2 34 LEU HB3 2 35 LYS H . . 3.800 2.794 1.767 3.880 0.080 3 0 "[ . 1 . 2]" 1
1785 2 34 LEU MD1 2 35 LYS H . . 5.350 3.826 1.781 4.884 . 0 0 "[ . 1 . 2]" 1
1786 2 34 LEU MD2 2 35 LYS H . . 5.630 3.676 2.719 4.825 . 0 0 "[ . 1 . 2]" 1
1787 2 34 LEU HG 2 35 LYS H . . 4.320 4.133 2.241 4.586 0.266 18 0 "[ . 1 . 2]" 1
1788 2 35 LYS H 2 35 LYS HB2 . . 3.360 2.747 2.269 3.642 0.282 20 0 "[ . 1 . 2]" 1
1789 2 35 LYS H 2 35 LYS QB . . 3.150 2.488 2.243 3.040 . 0 0 "[ . 1 . 2]" 1
1790 2 35 LYS H 2 35 LYS HB3 . . 3.360 3.289 2.510 3.686 0.326 18 0 "[ . 1 . 2]" 1
1791 2 35 LYS H 2 35 LYS HG2 . . 4.850 3.833 1.873 4.896 0.046 6 0 "[ . 1 . 2]" 1
1792 2 35 LYS H 2 35 LYS QG . . 4.350 3.076 1.843 4.269 . 0 0 "[ . 1 . 2]" 1
1793 2 35 LYS H 2 35 LYS HG3 . . 4.850 3.439 1.899 4.772 . 0 0 "[ . 1 . 2]" 1
1794 2 35 LYS H 2 36 VAL H . . 5.500 4.478 4.301 4.583 . 0 0 "[ . 1 . 2]" 1
1795 2 35 LYS HA 2 35 LYS HG2 . . 4.140 3.145 2.398 3.951 . 0 0 "[ . 1 . 2]" 1
1796 2 35 LYS HA 2 35 LYS HG3 . . 4.140 3.021 2.298 3.752 . 0 0 "[ . 1 . 2]" 1
1797 2 35 LYS HA 2 36 VAL H . . 3.020 2.363 2.200 2.675 . 0 0 "[ . 1 . 2]" 1
1798 2 35 LYS QB 2 36 VAL H . . 3.500 2.643 1.847 3.401 . 0 0 "[ . 1 . 2]" 1
1799 2 35 LYS HB2 2 36 VAL H . . 3.700 3.588 2.400 3.870 0.170 13 0 "[ . 1 . 2]" 1
1800 2 35 LYS HB3 2 36 VAL H . . 3.700 2.903 1.856 3.830 0.130 20 0 "[ . 1 . 2]" 1
1801 2 35 LYS QG 2 36 VAL H . . 4.980 3.382 1.780 4.301 . 0 0 "[ . 1 . 2]" 1
1802 2 35 LYS HG2 2 36 VAL H . . 5.220 3.998 1.801 5.255 0.035 15 0 "[ . 1 . 2]" 1
1803 2 35 LYS HG3 2 36 VAL H . . 5.220 3.933 1.824 5.047 . 0 0 "[ . 1 . 2]" 1
1804 2 36 VAL H 2 36 VAL HB . . 2.830 2.814 2.549 3.483 0.653 18 1 "[ . 1 . + 2]" 1
1805 2 36 VAL H 2 37 GLU H . . 5.500 4.475 4.143 4.613 . 0 0 "[ . 1 . 2]" 1
1806 2 36 VAL HA 2 37 GLU H . . 2.520 2.241 2.090 2.437 . 0 0 "[ . 1 . 2]" 1
1807 2 36 VAL HB 2 37 GLU H . . 3.800 3.939 3.811 4.083 0.283 20 0 "[ . 1 . 2]" 1
1808 2 36 VAL QG 2 37 GLU H . . 5.580 2.214 1.784 2.561 . 0 0 "[ . 1 . 2]" 1
1809 2 36 VAL MG1 2 37 GLU H . . 6.500 3.170 2.203 3.953 . 0 0 "[ . 1 . 2]" 1
1810 2 36 VAL MG2 2 37 GLU H . . 6.500 2.809 1.801 4.175 . 0 0 "[ . 1 . 2]" 1
1811 2 37 GLU H 2 37 GLU HB2 . . 3.330 2.981 2.069 3.625 0.295 20 0 "[ . 1 . 2]" 1
1812 2 37 GLU H 2 37 GLU QB . . 2.980 2.569 2.051 3.073 0.093 20 0 "[ . 1 . 2]" 1
1813 2 37 GLU H 2 37 GLU HB3 . . 3.330 3.156 2.544 3.594 0.264 1 0 "[ . 1 . 2]" 1
1814 2 37 GLU H 2 37 GLU HG2 . . 4.720 3.208 1.770 4.961 0.241 16 0 "[ . 1 . 2]" 1
1815 2 37 GLU H 2 37 GLU QG . . 4.520 2.671 1.753 4.174 . 0 0 "[ . 1 . 2]" 1
1816 2 37 GLU H 2 37 GLU HG3 . . 4.720 3.201 2.130 4.774 0.054 3 0 "[ . 1 . 2]" 1
1817 2 37 GLU HA 2 37 GLU HG2 . . 3.830 3.237 2.367 3.768 . 0 0 "[ . 1 . 2]" 1
1818 2 37 GLU HA 2 37 GLU HG3 . . 3.830 3.204 2.423 3.886 0.056 18 0 "[ . 1 . 2]" 1
1819 2 38 PRO HA 2 39 ILE H . . 2.990 2.533 2.386 2.858 . 0 0 "[ . 1 . 2]" 1
1820 2 38 PRO HB2 2 39 ILE H . . 3.700 2.379 1.750 2.980 . 0 0 "[ . 1 . 2]" 1
1821 2 38 PRO HB3 2 39 ILE H . . 3.700 3.156 2.454 3.518 . 0 0 "[ . 1 . 2]" 1
1822 2 38 PRO HD2 2 39 ILE H . . 5.500 5.170 4.540 5.544 0.044 6 0 "[ . 1 . 2]" 1
1823 2 38 PRO HD3 2 39 ILE H . . 5.500 5.534 5.249 5.689 0.189 11 0 "[ . 1 . 2]" 1
1824 2 38 PRO HG2 2 39 ILE H . . 5.500 4.264 3.499 4.985 . 0 0 "[ . 1 . 2]" 1
1825 2 38 PRO HG3 2 39 ILE H . . 5.500 4.777 4.324 4.995 . 0 0 "[ . 1 . 2]" 1
1826 2 39 ILE H 2 39 ILE HB . . 3.450 3.569 2.657 3.724 0.274 2 0 "[ . 1 . 2]" 1
1827 2 39 ILE H 2 39 ILE MD . . 5.630 3.159 1.741 4.411 . 0 0 "[ . 1 . 2]" 1
1828 2 39 ILE H 2 39 ILE HG12 . . 3.980 2.875 1.869 4.009 0.029 1 0 "[ . 1 . 2]" 1
1829 2 39 ILE H 2 39 ILE HG13 . . 3.980 2.444 1.713 3.802 . 0 0 "[ . 1 . 2]" 1
1830 2 39 ILE HA 2 39 ILE HG12 . . 4.260 3.786 2.544 4.232 . 0 0 "[ . 1 . 2]" 1
1831 2 39 ILE HA 2 39 ILE HG13 . . 4.260 3.569 2.516 4.260 . 0 0 "[ . 1 . 2]" 1
1832 2 39 ILE HA 2 40 ASP H . . 2.460 2.362 2.158 2.505 0.045 7 0 "[ . 1 . 2]" 1
1833 2 39 ILE HB 2 40 ASP H . . 3.580 2.692 1.977 3.746 0.166 17 0 "[ . 1 . 2]" 1
1834 2 39 ILE MD 2 40 ASP H . . 5.880 4.164 3.220 5.353 . 0 0 "[ . 1 . 2]" 1
1835 2 39 ILE QG 2 40 ASP H . . 5.350 4.011 3.020 4.705 . 0 0 "[ . 1 . 2]" 1
1836 2 39 ILE HG12 2 40 ASP H . . 5.500 4.728 3.124 5.450 . 0 0 "[ . 1 . 2]" 1
1837 2 39 ILE HG13 2 40 ASP H . . 5.500 4.436 3.582 5.143 . 0 0 "[ . 1 . 2]" 1
1838 2 39 ILE MG 2 40 ASP H . . 5.940 3.241 1.823 3.834 . 0 0 "[ . 1 . 2]" 1
1839 2 40 ASP H 2 40 ASP HB2 . . 3.300 3.050 2.486 3.595 0.295 12 0 "[ . 1 . 2]" 1
1840 2 40 ASP H 2 40 ASP QB . . 3.010 2.474 2.241 2.868 . 0 0 "[ . 1 . 2]" 1
1841 2 40 ASP H 2 40 ASP HB3 . . 3.300 2.655 2.327 3.469 0.169 10 0 "[ . 1 . 2]" 1
1842 2 41 LEU H 2 41 LEU QB . . 3.920 2.723 2.355 3.254 . 0 0 "[ . 1 . 2]" 1
1843 2 41 LEU HA 2 41 LEU MD2 . . 4.330 3.319 1.975 4.066 . 0 0 "[ . 1 . 2]" 1
1844 2 41 LEU HA 2 42 GLY H . . 3.050 2.316 2.122 2.737 . 0 0 "[ . 1 . 2]" 1
1845 2 41 LEU HB2 2 42 GLY H . . 4.510 3.542 2.268 4.370 . 0 0 "[ . 1 . 2]" 1
1846 2 41 LEU HB3 2 42 GLY H . . 4.510 3.508 1.878 4.380 . 0 0 "[ . 1 . 2]" 1
1847 2 41 LEU MD1 2 42 GLY H . . 6.530 3.591 2.106 5.235 . 0 0 "[ . 1 . 2]" 1
1848 2 41 LEU MD2 2 42 GLY H . . 6.530 4.117 2.612 4.884 . 0 0 "[ . 1 . 2]" 1
1849 2 42 GLY H 2 43 GLU H . . 4.010 4.097 3.708 4.360 0.350 1 0 "[ . 1 . 2]" 1
1850 2 42 GLY QA 2 43 GLU H . . 2.890 2.100 2.017 2.215 . 0 0 "[ . 1 . 2]" 1
1851 2 42 GLY HA2 2 43 GLU H . . 3.140 2.456 2.037 3.209 0.069 19 0 "[ . 1 . 2]" 1
1852 2 42 GLY HA3 2 43 GLU H . . 3.140 2.792 2.116 3.282 0.142 6 0 "[ . 1 . 2]" 1
1853 2 43 GLU H 2 43 GLU HB2 . . 3.490 3.114 2.351 3.708 0.218 20 0 "[ . 1 . 2]" 1
1854 2 43 GLU H 2 43 GLU QB . . 3.070 2.624 2.322 3.057 . 0 0 "[ . 1 . 2]" 1
1855 2 43 GLU H 2 43 GLU HB3 . . 3.490 3.185 2.552 3.729 0.239 3 0 "[ . 1 . 2]" 1
1856 2 43 GLU H 2 43 GLU HG2 . . 5.470 3.124 1.885 4.511 . 0 0 "[ . 1 . 2]" 1
1857 2 43 GLU H 2 43 GLU HG3 . . 5.470 3.219 2.212 4.571 . 0 0 "[ . 1 . 2]" 1
1858 2 43 GLU HA 2 43 GLU HB2 . . 2.960 2.714 2.410 3.019 0.059 15 0 "[ . 1 . 2]" 1
1859 2 43 GLU HA 2 43 GLU HB3 . . 2.960 2.466 2.228 3.014 0.054 11 0 "[ . 1 . 2]" 1
1860 2 44 PRO HA 2 45 VAL H . . 3.050 2.332 2.144 2.791 . 0 0 "[ . 1 . 2]" 1
1861 2 44 PRO QB 2 45 VAL H . . 3.820 2.866 1.888 3.550 . 0 0 "[ . 1 . 2]" 1
1862 2 44 PRO HB2 2 45 VAL H . . 4.010 3.227 1.903 4.056 0.046 10 0 "[ . 1 . 2]" 1
1863 2 44 PRO HB3 2 45 VAL H . . 4.010 3.379 2.725 3.989 . 0 0 "[ . 1 . 2]" 1
1864 2 44 PRO QD 2 45 VAL H . . 5.590 4.848 4.291 5.005 . 0 0 "[ . 1 . 2]" 1
1865 2 45 VAL H 2 45 VAL HB . . 3.140 2.747 2.662 2.853 . 0 0 "[ . 1 . 2]" 1
1866 2 45 VAL HA 2 46 SER H . . 2.490 2.292 2.096 2.473 . 0 0 "[ . 1 . 2]" 1
1867 2 45 VAL HB 2 46 SER H . . 3.450 3.612 3.393 3.778 0.328 10 0 "[ . 1 . 2]" 1
1868 2 45 VAL MG1 2 46 SER H . . 4.980 2.605 1.790 4.034 . 0 0 "[ . 1 . 2]" 1
1869 2 45 VAL MG2 2 46 SER H . . 6.000 3.347 1.802 4.093 . 0 0 "[ . 1 . 2]" 1
1870 2 46 SER H 2 46 SER HB2 . . 3.490 2.743 2.520 3.654 0.164 12 0 "[ . 1 . 2]" 1
1871 2 46 SER H 2 46 SER QB . . 3.220 2.600 2.474 3.046 . 0 0 "[ . 1 . 2]" 1
1872 2 46 SER H 2 46 SER HB3 . . 3.490 3.550 3.011 3.745 0.255 8 0 "[ . 1 . 2]" 1
1873 2 46 SER HA 2 47 VAL H . . 2.650 2.470 2.205 2.752 0.102 12 0 "[ . 1 . 2]" 1
1874 2 46 SER HB2 2 47 VAL H . . 3.330 3.173 1.764 3.453 0.123 10 0 "[ . 1 . 2]" 1
1875 2 46 SER HB3 2 47 VAL H . . 3.330 2.544 2.143 3.516 0.186 6 0 "[ . 1 . 2]" 1
1876 2 47 VAL H 2 47 VAL HB . . 2.990 2.862 2.533 3.418 0.428 12 0 "[ . 1 . 2]" 1
1877 2 47 VAL HA 2 48 GLU H . . 3.080 2.245 2.092 2.443 . 0 0 "[ . 1 . 2]" 1
1878 2 47 VAL HB 2 48 GLU H . . 4.070 4.053 3.793 4.191 0.121 20 0 "[ . 1 . 2]" 1
1879 2 47 VAL QG 2 48 GLU H . . 6.210 2.331 1.778 2.842 . 0 0 "[ . 1 . 2]" 1
1880 2 47 VAL MG1 2 48 GLU H . . 6.530 3.125 2.177 3.883 . 0 0 "[ . 1 . 2]" 1
1881 2 47 VAL MG2 2 48 GLU H . . 6.530 3.024 1.786 4.147 . 0 0 "[ . 1 . 2]" 1
1882 2 48 GLU H 2 48 GLU HB2 . . 3.760 3.056 2.374 3.853 0.093 6 0 "[ . 1 . 2]" 1
1883 2 48 GLU H 2 48 GLU HB3 . . 3.760 3.222 2.581 3.715 . 0 0 "[ . 1 . 2]" 1
1884 2 48 GLU H 2 48 GLU HG2 . . 4.820 3.260 1.952 4.768 . 0 0 "[ . 1 . 2]" 1
1885 2 48 GLU H 2 48 GLU HG3 . . 4.820 3.298 1.776 4.655 . 0 0 "[ . 1 . 2]" 1
1886 2 48 GLU H 2 49 GLU H . . 4.480 4.024 1.821 4.536 0.056 2 0 "[ . 1 . 2]" 1
1887 2 48 GLU HA 2 49 GLU H . . 3.360 2.365 2.030 3.455 0.095 16 0 "[ . 1 . 2]" 1
1888 2 48 GLU QB 2 49 GLU H . . 3.820 3.137 1.773 3.624 . 0 0 "[ . 1 . 2]" 1
1889 2 48 GLU HB2 2 49 GLU H . . 4.010 3.684 1.782 4.233 0.223 8 0 "[ . 1 . 2]" 1
1890 2 48 GLU HB3 2 49 GLU H . . 4.010 3.649 2.833 4.258 0.248 6 0 "[ . 1 . 2]" 1
1891 2 48 GLU QG 2 49 GLU H . . 5.330 3.975 2.120 4.719 . 0 0 "[ . 1 . 2]" 1
1892 2 48 GLU HG2 2 49 GLU H . . 5.500 4.433 2.846 5.149 . 0 0 "[ . 1 . 2]" 1
1893 2 48 GLU HG3 2 49 GLU H . . 5.500 4.715 2.134 5.592 0.092 6 0 "[ . 1 . 2]" 1
1894 2 49 GLU H 2 49 GLU HB2 . . 4.070 2.772 2.390 3.637 . 0 0 "[ . 1 . 2]" 1
1895 2 49 GLU H 2 49 GLU QB . . 3.880 2.400 2.235 2.953 . 0 0 "[ . 1 . 2]" 1
1896 2 49 GLU H 2 49 GLU HB3 . . 4.070 2.890 2.375 3.630 . 0 0 "[ . 1 . 2]" 1
1897 2 49 GLU HA 2 50 ILE H . . 3.330 3.424 3.401 3.459 0.129 12 0 "[ . 1 . 2]" 1
1898 2 49 GLU QB 2 50 ILE H . . 4.390 3.041 2.812 3.604 . 0 0 "[ . 1 . 2]" 1
1899 2 49 GLU HB2 2 50 ILE H . . 4.690 3.700 2.954 4.086 . 0 0 "[ . 1 . 2]" 1
1900 2 49 GLU HB3 2 50 ILE H . . 4.690 3.502 2.875 4.297 . 0 0 "[ . 1 . 2]" 1
1901 2 49 GLU QG 2 50 ILE H . . 6.380 3.790 2.438 4.697 . 0 0 "[ . 1 . 2]" 1
1902 2 50 ILE H 2 50 ILE HB . . 3.980 2.664 2.134 3.639 . 0 0 "[ . 1 . 2]" 1
1903 2 50 ILE H 2 50 ILE HG12 . . 4.850 3.828 1.891 4.694 . 0 0 "[ . 1 . 2]" 1
1904 2 50 ILE H 2 50 ILE QG . . 4.700 3.239 1.848 4.079 . 0 0 "[ . 1 . 2]" 1
1905 2 50 ILE H 2 50 ILE HG13 . . 4.850 3.708 1.862 4.502 . 0 0 "[ . 1 . 2]" 1
1906 2 50 ILE HA 2 51 LYS H . . 3.210 3.279 3.062 3.396 0.186 18 0 "[ . 1 . 2]" 1
1907 2 50 ILE HB 2 51 LYS H . . 4.230 3.948 3.220 4.330 0.100 2 0 "[ . 1 . 2]" 1
1908 2 50 ILE MD 2 51 LYS H . . 6.530 4.885 3.625 5.415 . 0 0 "[ . 1 . 2]" 1
1909 2 50 ILE HG12 2 51 LYS H . . 5.500 4.754 3.597 5.580 0.080 11 0 "[ . 1 . 2]" 1
1910 2 50 ILE HG13 2 51 LYS H . . 5.500 4.799 3.245 5.589 0.089 10 0 "[ . 1 . 2]" 1
1911 2 50 ILE MG 2 51 LYS H . . 6.530 3.426 2.663 4.283 . 0 0 "[ . 1 . 2]" 1
1912 2 51 LYS H 2 51 LYS HB2 . . 3.170 2.533 2.154 3.217 0.047 6 0 "[ . 1 . 2]" 1
1913 2 51 LYS H 2 51 LYS QB . . 2.980 2.301 2.123 2.745 . 0 0 "[ . 1 . 2]" 1
1914 2 51 LYS H 2 51 LYS HB3 . . 3.170 2.772 2.333 3.538 0.368 5 0 "[ . 1 . 2]" 1
1915 2 51 LYS H 2 51 LYS HG2 . . 5.030 4.330 2.467 5.096 0.066 6 0 "[ . 1 . 2]" 1
1916 2 51 LYS H 2 51 LYS QG . . 4.800 3.873 2.438 4.291 . 0 0 "[ . 1 . 2]" 1
1917 2 51 LYS H 2 51 LYS HG3 . . 5.030 4.455 3.790 5.021 . 0 0 "[ . 1 . 2]" 1
1918 2 51 LYS HA 2 51 LYS HG2 . . 4.170 3.231 2.336 3.733 . 0 0 "[ . 1 . 2]" 1
1919 2 51 LYS HA 2 51 LYS QG . . 3.980 2.566 2.118 2.957 . 0 0 "[ . 1 . 2]" 1
1920 2 51 LYS HA 2 51 LYS HG3 . . 4.170 2.851 2.155 3.741 . 0 0 "[ . 1 . 2]" 1
1921 2 51 LYS HA 2 52 LYS H . . 3.140 2.234 2.129 3.003 . 0 0 "[ . 1 . 2]" 1
1922 2 51 LYS QB 2 52 LYS H . . 3.850 3.482 2.033 3.756 . 0 0 "[ . 1 . 2]" 1
1923 2 51 LYS HB2 2 52 LYS H . . 4.200 4.179 3.459 4.367 0.167 18 0 "[ . 1 . 2]" 1
1924 2 51 LYS HB3 2 52 LYS H . . 4.200 3.773 2.048 4.257 0.057 9 0 "[ . 1 . 2]" 1
1925 2 51 LYS QG 2 52 LYS H . . 5.110 2.887 1.930 4.633 . 0 0 "[ . 1 . 2]" 1
1926 2 51 LYS HG2 2 52 LYS H . . 5.340 3.588 1.951 5.098 . 0 0 "[ . 1 . 2]" 1
1927 2 51 LYS HG3 2 52 LYS H . . 5.340 3.293 2.086 5.320 . 0 0 "[ . 1 . 2]" 1
1928 2 52 LYS H 2 52 LYS HB2 . . 3.390 3.011 2.192 3.760 0.370 9 0 "[ . 1 . 2]" 1
1929 2 52 LYS H 2 52 LYS HB3 . . 3.390 3.218 2.649 3.739 0.349 17 0 "[ . 1 . 2]" 1
1930 2 52 LYS H 2 52 LYS HD2 . . 5.500 4.580 1.749 5.611 0.111 4 0 "[ . 1 . 2]" 1
1931 2 52 LYS H 2 52 LYS HD3 . . 5.500 4.713 3.458 5.744 0.244 19 0 "[ . 1 . 2]" 1
1932 2 52 LYS H 2 52 LYS HG2 . . 5.500 3.933 1.995 5.117 . 0 0 "[ . 1 . 2]" 1
1933 2 52 LYS H 2 52 LYS HG3 . . 5.500 4.015 2.398 4.881 . 0 0 "[ . 1 . 2]" 1
1934 2 52 LYS HA 2 52 LYS HD2 . . 5.500 3.663 1.867 5.516 0.016 11 0 "[ . 1 . 2]" 1
1935 2 52 LYS HA 2 52 LYS HD3 . . 5.500 3.874 1.843 5.482 . 0 0 "[ . 1 . 2]" 1
1936 2 52 LYS HA 2 53 ILE H . . 2.870 2.255 2.114 2.567 . 0 0 "[ . 1 . 2]" 1
1937 2 52 LYS QB 2 53 ILE H . . 3.970 3.234 2.252 3.918 . 0 0 "[ . 1 . 2]" 1
1938 2 52 LYS HB2 2 53 ILE H . . 4.350 3.887 2.285 4.497 0.147 1 0 "[ . 1 . 2]" 1
1939 2 52 LYS HB3 2 53 ILE H . . 4.350 3.665 2.371 4.374 0.024 9 0 "[ . 1 . 2]" 1
1940 2 52 LYS QG 2 53 ILE H . . 6.380 3.380 1.796 4.449 . 0 0 "[ . 1 . 2]" 1
1941 2 53 ILE H 2 53 ILE HB . . 3.240 2.866 2.443 3.498 0.258 7 0 "[ . 1 . 2]" 1
1942 2 53 ILE H 2 53 ILE HG12 . . 4.110 4.072 3.401 4.525 0.415 17 0 "[ . 1 . 2]" 1
1943 2 53 ILE H 2 53 ILE QG . . 3.930 3.192 1.790 3.877 . 0 0 "[ . 1 . 2]" 1
1944 2 53 ILE H 2 53 ILE HG13 . . 4.110 3.437 1.797 4.469 0.359 16 0 "[ . 1 . 2]" 1
1945 2 53 ILE HA 2 53 ILE HG12 . . 3.800 3.199 2.430 4.090 0.290 7 0 "[ . 1 . 2]" 1
1946 2 53 ILE HA 2 53 ILE QG . . 3.560 2.477 2.239 3.248 . 0 0 "[ . 1 . 2]" 1
1947 2 53 ILE HA 2 53 ILE HG13 . . 3.800 2.706 2.265 3.408 . 0 0 "[ . 1 . 2]" 1
1948 2 54 ARG H 2 54 ARG HB2 . . 3.670 2.999 2.409 3.881 0.211 7 0 "[ . 1 . 2]" 1
1949 2 54 ARG H 2 54 ARG HB3 . . 3.670 3.109 2.377 4.036 0.366 14 0 "[ . 1 . 2]" 1
1950 2 54 ARG H 2 54 ARG HG2 . . 4.630 3.851 2.030 4.971 0.341 20 0 "[ . 1 . 2]" 1
1951 2 54 ARG H 2 54 ARG QG . . 4.390 3.353 2.000 4.331 . 0 0 "[ . 1 . 2]" 1
1952 2 54 ARG H 2 54 ARG HG3 . . 4.630 3.870 2.346 4.774 0.144 19 0 "[ . 1 . 2]" 1
1953 2 54 ARG HA 2 54 ARG HD2 . . 5.500 4.301 1.737 4.859 . 0 0 "[ . 1 . 2]" 1
1954 2 54 ARG HA 2 54 ARG HD3 . . 5.500 4.423 1.899 5.534 0.034 12 0 "[ . 1 . 2]" 1
1955 2 55 ASP HA 2 56 GLY H . . 3.020 2.461 2.209 2.836 . 0 0 "[ . 1 . 2]" 1
1956 2 55 ASP QB 2 56 GLY H . . 3.470 2.696 2.058 3.440 . 0 0 "[ . 1 . 2]" 1
1957 2 55 ASP HB2 2 56 GLY H . . 3.760 3.321 2.070 3.920 0.160 16 0 "[ . 1 . 2]" 1
1958 2 55 ASP HB3 2 56 GLY H . . 3.760 3.263 2.221 3.854 0.094 4 0 "[ . 1 . 2]" 1
1959 2 56 GLY HA2 2 57 THR H . . 3.580 2.492 2.137 3.510 . 0 0 "[ . 1 . 2]" 1
1960 2 56 GLY HA3 2 57 THR H . . 3.580 3.110 2.167 3.572 . 0 0 "[ . 1 . 2]" 1
1961 2 57 THR H 2 57 THR HB . . 3.390 3.191 2.679 3.600 0.210 3 0 "[ . 1 . 2]" 1
1962 2 57 THR HA 2 58 TRP H . . 3.020 2.282 2.088 2.567 . 0 0 "[ . 1 . 2]" 1
1963 2 57 THR HB 2 58 TRP H . . 3.830 3.813 3.113 4.073 0.243 11 0 "[ . 1 . 2]" 1
1964 2 57 THR MG 2 58 TRP H . . 6.530 3.131 2.216 3.975 . 0 0 "[ . 1 . 2]" 1
1965 2 58 TRP H 2 58 TRP HB2 . . 3.140 2.739 2.065 3.483 0.343 1 0 "[ . 1 . 2]" 1
1966 2 58 TRP H 2 58 TRP QB . . 2.950 2.406 2.045 2.820 . 0 0 "[ . 1 . 2]" 1
1967 2 58 TRP H 2 58 TRP HB3 . . 3.140 2.960 2.438 3.522 0.382 10 0 "[ . 1 . 2]" 1
1968 2 58 TRP H 2 58 TRP HD1 . . 5.500 4.904 3.090 5.391 . 0 0 "[ . 1 . 2]" 1
1969 2 58 TRP HA 2 59 MET H . . 2.930 2.293 2.153 2.730 . 0 0 "[ . 1 . 2]" 1
1970 2 58 TRP QB 2 59 MET H . . 3.940 3.181 1.780 3.707 . 0 0 "[ . 1 . 2]" 1
1971 2 58 TRP HB2 2 59 MET H . . 4.170 3.977 2.835 4.247 0.077 12 0 "[ . 1 . 2]" 1
1972 2 58 TRP HB3 2 59 MET H . . 4.170 3.464 1.788 4.201 0.031 14 0 "[ . 1 . 2]" 1
1973 2 59 MET H 2 59 MET HB2 . . 4.110 3.310 2.476 4.019 . 0 0 "[ . 1 . 2]" 1
1974 2 59 MET H 2 59 MET QB . . 3.680 2.750 2.276 3.401 . 0 0 "[ . 1 . 2]" 1
1975 2 59 MET H 2 59 MET HB3 . . 4.110 3.069 2.466 4.130 0.020 16 0 "[ . 1 . 2]" 1
1976 2 59 MET H 2 59 MET HG2 . . 5.100 3.740 1.954 4.840 . 0 0 "[ . 1 . 2]" 1
1977 2 59 MET H 2 59 MET QG . . 4.760 3.212 1.940 4.200 . 0 0 "[ . 1 . 2]" 1
1978 2 59 MET H 2 59 MET HG3 . . 5.100 3.802 2.493 4.793 . 0 0 "[ . 1 . 2]" 1
1979 2 59 MET HA 2 60 SER H . . 3.050 2.273 2.115 2.574 . 0 0 "[ . 1 . 2]" 1
1980 2 59 MET QB 2 60 SER H . . 3.790 3.058 2.118 3.817 0.027 11 0 "[ . 1 . 2]" 1
1981 2 59 MET HB2 2 60 SER H . . 4.380 3.493 2.269 4.443 0.063 13 0 "[ . 1 . 2]" 1
1982 2 59 MET HB3 2 60 SER H . . 4.380 3.759 2.143 4.305 . 0 0 "[ . 1 . 2]" 1
1983 2 59 MET QG 2 60 SER H . . 6.380 3.327 2.317 4.358 . 0 0 "[ . 1 . 2]" 1
1984 2 60 SER H 2 60 SER HB2 . . 3.700 3.083 2.430 3.813 0.113 14 0 "[ . 1 . 2]" 1
1985 2 60 SER H 2 60 SER QB . . 3.500 2.726 2.245 3.373 . 0 0 "[ . 1 . 2]" 1
1986 2 60 SER H 2 60 SER HB3 . . 3.700 3.242 2.395 3.984 0.284 5 0 "[ . 1 . 2]" 1
1987 2 60 SER QB 2 61 SER H . . 4.010 3.127 2.030 3.775 . 0 0 "[ . 1 . 2]" 1
1988 2 60 SER HB2 2 61 SER H . . 4.170 3.695 2.042 4.323 0.153 3 0 "[ . 1 . 2]" 1
1989 2 60 SER HB3 2 61 SER H . . 4.170 3.593 2.407 4.393 0.223 16 0 "[ . 1 . 2]" 1
1990 2 61 SER H 2 61 SER QB . . 3.860 2.509 2.275 2.893 . 0 0 "[ . 1 . 2]" 1
1991 2 61 SER H 2 62 LEU H . . 3.760 2.455 2.203 2.850 . 0 0 "[ . 1 . 2]" 1
1992 2 61 SER HA 2 62 LEU H . . 3.170 3.158 2.999 3.287 0.117 18 0 "[ . 1 . 2]" 1
1993 2 61 SER QB 2 62 LEU H . . 4.300 3.552 3.255 3.961 . 0 0 "[ . 1 . 2]" 1
1994 2 61 SER HB2 2 62 LEU H . . 4.510 3.908 3.381 4.523 0.013 12 0 "[ . 1 . 2]" 1
1995 2 61 SER HB3 2 62 LEU H . . 4.510 4.256 3.622 4.569 0.059 16 0 "[ . 1 . 2]" 1
1996 2 62 LEU H 2 62 LEU HB2 . . 3.760 3.250 2.444 3.919 0.159 17 0 "[ . 1 . 2]" 1
1997 2 62 LEU H 2 62 LEU QB . . 3.470 2.986 2.227 3.346 . 0 0 "[ . 1 . 2]" 1
1998 2 62 LEU H 2 62 LEU HB3 . . 3.760 3.713 2.363 4.063 0.303 19 0 "[ . 1 . 2]" 1
1999 2 62 LEU H 2 62 LEU HG . . 4.200 3.496 2.338 4.501 0.301 2 0 "[ . 1 . 2]" 1
2000 2 62 LEU HA 2 62 LEU HG . . 3.830 2.954 2.373 3.675 . 0 0 "[ . 1 . 2]" 1
2001 2 62 LEU HA 2 63 GLU H . . 3.170 2.437 2.102 2.938 . 0 0 "[ . 1 . 2]" 1
2002 2 62 LEU QB 2 63 GLU H . . 4.280 3.064 1.782 3.973 . 0 0 "[ . 1 . 2]" 1
2003 2 62 LEU HB2 2 63 GLU H . . 4.540 3.907 2.840 4.594 0.054 2 0 "[ . 1 . 2]" 1
2004 2 62 LEU HB3 2 63 GLU H . . 4.540 3.322 1.791 4.484 . 0 0 "[ . 1 . 2]" 1
2005 2 62 LEU MD1 2 63 GLU H . . 6.530 4.440 2.650 5.616 . 0 0 "[ . 1 . 2]" 1
2006 2 62 LEU MD2 2 63 GLU H . . 6.530 4.325 3.060 5.432 . 0 0 "[ . 1 . 2]" 1
2007 2 62 LEU HG 2 63 GLU H . . 5.500 4.507 3.495 5.552 0.052 16 0 "[ . 1 . 2]" 1
2008 2 63 GLU H 2 63 GLU HB2 . . 3.580 2.912 2.138 3.709 0.129 15 0 "[ . 1 . 2]" 1
2009 2 63 GLU H 2 63 GLU QB . . 3.360 2.490 2.097 2.876 . 0 0 "[ . 1 . 2]" 1
2010 2 63 GLU H 2 63 GLU HB3 . . 3.580 2.914 2.573 3.586 0.006 4 0 "[ . 1 . 2]" 1
2011 2 63 GLU H 2 63 GLU HG2 . . 5.470 3.831 2.035 4.756 . 0 0 "[ . 1 . 2]" 1
2012 2 63 GLU H 2 63 GLU HG3 . . 5.470 4.141 2.056 4.985 . 0 0 "[ . 1 . 2]" 1
2013 2 63 GLU H 2 64 HIS H . . 4.850 4.353 3.757 4.615 . 0 0 "[ . 1 . 2]" 1
2014 2 63 GLU HA 2 64 HIS H . . 3.300 2.239 2.109 2.515 . 0 0 "[ . 1 . 2]" 1
2015 2 63 GLU HB2 2 64 HIS H . . 5.500 3.944 2.226 4.640 . 0 0 "[ . 1 . 2]" 1
2016 2 63 GLU HB3 2 64 HIS H . . 5.500 3.846 2.780 4.467 . 0 0 "[ . 1 . 2]" 1
2017 2 64 HIS HA 2 65 HIS H . . 3.390 2.330 2.104 2.961 . 0 0 "[ . 1 . 2]" 1
2018 2 64 HIS QB 2 65 HIS H . . 4.610 3.702 2.756 4.053 . 0 0 "[ . 1 . 2]" 1
2019 2 64 HIS HB2 2 65 HIS H . . 4.760 4.119 2.806 4.630 . 0 0 "[ . 1 . 2]" 1
2020 2 64 HIS HB3 2 65 HIS H . . 4.760 4.318 3.809 4.627 . 0 0 "[ . 1 . 2]" 1
2021 2 66 HIS H 2 66 HIS HA . . 2.900 2.908 2.851 2.944 0.044 7 0 "[ . 1 . 2]" 1
2022 2 66 HIS HA 2 67 HIS H . . 3.050 2.198 2.112 2.437 . 0 0 "[ . 1 . 2]" 1
stop_
save_