NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
600454 |
5huz   |
30005 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5huz
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 1727
_Distance_constraint_stats_list.Viol_count 2449
_Distance_constraint_stats_list.Viol_total 4251.823
_Distance_constraint_stats_list.Viol_max 0.458
_Distance_constraint_stats_list.Viol_rms 0.0296
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0062
_Distance_constraint_stats_list.Viol_average_violations_only 0.0868
_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 1 ASP 1.951 0.258 9 0 "[ . 1 . 2]"
1 2 PHE 7.883 0.272 2 0 "[ . 1 . 2]"
1 3 LYS 10.371 0.458 8 0 "[ . 1 . 2]"
1 4 LYS 11.024 0.458 8 0 "[ . 1 . 2]"
1 5 LEU 5.098 0.206 19 0 "[ . 1 . 2]"
1 6 TYR 7.041 0.221 2 0 "[ . 1 . 2]"
1 7 GLU 7.296 0.225 1 0 "[ . 1 . 2]"
1 8 GLN 11.069 0.287 2 0 "[ . 1 . 2]"
1 9 ILE 11.382 0.366 1 0 "[ . 1 . 2]"
1 10 LEU 3.875 0.159 19 0 "[ . 1 . 2]"
1 11 ALA 1.231 0.130 17 0 "[ . 1 . 2]"
1 12 GLU 2.499 0.321 19 0 "[ . 1 . 2]"
1 13 ASN 0.150 0.051 13 0 "[ . 1 . 2]"
1 14 GLU 7.211 0.303 9 0 "[ . 1 . 2]"
1 15 LYS 11.957 0.321 19 0 "[ . 1 . 2]"
1 16 LEU 2.242 0.135 9 0 "[ . 1 . 2]"
1 17 LYS 3.153 0.166 6 0 "[ . 1 . 2]"
1 18 ALA 2.349 0.130 17 0 "[ . 1 . 2]"
1 19 GLN 22.166 0.264 11 0 "[ . 1 . 2]"
1 20 LEU 5.049 0.244 20 0 "[ . 1 . 2]"
1 21 HIS 0.381 0.071 9 0 "[ . 1 . 2]"
1 22 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 THR 3.653 0.246 18 0 "[ . 1 . 2]"
1 24 ASN 2.635 0.158 7 0 "[ . 1 . 2]"
1 25 MET 4.014 0.370 17 0 "[ . 1 . 2]"
1 26 GLU 0.045 0.020 2 0 "[ . 1 . 2]"
1 27 LEU 10.330 0.458 4 0 "[ . 1 . 2]"
1 28 THR 0.271 0.061 16 0 "[ . 1 . 2]"
1 29 ASP 0.485 0.248 5 0 "[ . 1 . 2]"
1 30 LEU 2.158 0.287 5 0 "[ . 1 . 2]"
1 31 LYS 1.017 0.248 5 0 "[ . 1 . 2]"
1 32 LEU 1.503 0.160 17 0 "[ . 1 . 2]"
1 33 GLN 3.284 0.231 11 0 "[ . 1 . 2]"
1 34 LEU 2.402 0.155 17 0 "[ . 1 . 2]"
1 35 GLU 0.827 0.160 17 0 "[ . 1 . 2]"
1 36 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 ALA 5.785 0.265 11 0 "[ . 1 . 2]"
1 38 THR 3.351 0.457 8 0 "[ . 1 . 2]"
1 39 GLN 5.367 0.316 20 0 "[ . 1 . 2]"
1 40 ARG 4.821 0.316 20 0 "[ . 1 . 2]"
1 41 GLN 6.904 0.398 20 0 "[ . 1 . 2]"
1 42 GLU 1.931 0.278 8 0 "[ . 1 . 2]"
1 43 ARG 2.743 0.242 7 0 "[ . 1 . 2]"
1 44 PHE 0.706 0.177 11 0 "[ . 1 . 2]"
2 1 ASP 2.168 0.310 7 0 "[ . 1 . 2]"
2 2 PHE 6.674 0.310 7 0 "[ . 1 . 2]"
2 3 LYS 6.603 0.312 1 0 "[ . 1 . 2]"
2 4 LYS 9.960 0.349 8 0 "[ . 1 . 2]"
2 5 LEU 5.763 0.206 19 0 "[ . 1 . 2]"
2 6 TYR 10.128 0.366 1 0 "[ . 1 . 2]"
2 7 GLU 5.551 0.208 19 0 "[ . 1 . 2]"
2 8 GLN 7.902 0.349 8 0 "[ . 1 . 2]"
2 9 ILE 6.890 0.235 17 0 "[ . 1 . 2]"
2 10 LEU 4.675 0.208 19 0 "[ . 1 . 2]"
2 11 ALA 2.119 0.177 19 0 "[ . 1 . 2]"
2 12 GLU 3.519 0.338 9 0 "[ . 1 . 2]"
2 13 ASN 0.562 0.235 17 0 "[ . 1 . 2]"
2 14 GLU 7.112 0.292 3 0 "[ . 1 . 2]"
2 15 LYS 12.226 0.338 9 0 "[ . 1 . 2]"
2 16 LEU 1.812 0.154 19 0 "[ . 1 . 2]"
2 17 LYS 3.968 0.219 13 0 "[ . 1 . 2]"
2 18 ALA 1.646 0.091 8 0 "[ . 1 . 2]"
2 19 GLN 16.054 0.228 5 0 "[ . 1 . 2]"
2 20 LEU 4.004 0.167 16 0 "[ . 1 . 2]"
2 21 HIS 0.813 0.091 8 0 "[ . 1 . 2]"
2 22 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 23 THR 3.749 0.168 10 0 "[ . 1 . 2]"
2 24 ASN 1.644 0.168 10 0 "[ . 1 . 2]"
2 25 MET 4.347 0.355 5 0 "[ . 1 . 2]"
2 26 GLU 6.545 0.458 4 0 "[ . 1 . 2]"
2 27 LEU 2.839 0.202 20 0 "[ . 1 . 2]"
2 28 THR 0.026 0.015 1 0 "[ . 1 . 2]"
2 29 ASP 0.722 0.247 9 0 "[ . 1 . 2]"
2 30 LEU 3.931 0.398 20 0 "[ . 1 . 2]"
2 31 LYS 2.301 0.450 16 0 "[ . 1 . 2]"
2 32 LEU 0.373 0.373 16 0 "[ . 1 . 2]"
2 33 GLN 1.416 0.155 17 0 "[ . 1 . 2]"
2 34 LEU 6.225 0.265 11 0 "[ . 1 . 2]"
2 35 GLU 2.214 0.450 16 0 "[ . 1 . 2]"
2 36 LYS 0.885 0.370 16 0 "[ . 1 . 2]"
2 37 ALA 1.558 0.214 5 0 "[ . 1 . 2]"
2 38 THR 1.810 0.381 17 0 "[ . 1 . 2]"
2 39 GLN 5.780 0.381 17 0 "[ . 1 . 2]"
2 40 ARG 6.125 0.270 15 0 "[ . 1 . 2]"
2 41 GLN 3.773 0.270 15 0 "[ . 1 . 2]"
2 42 GLU 3.181 0.278 15 0 "[ . 1 . 2]"
2 43 ARG 2.818 0.278 15 0 "[ . 1 . 2]"
2 44 PHE 1.801 0.206 8 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 1 ASP HA 1 2 PHE H 3.500 . 3.850 3.472 3.154 3.604 . 0 0 "[ . 1 . 2]" 1
2 1 1 ASP HA 1 3 LYS H 4.110 . 4.520 4.068 3.376 4.638 0.118 14 0 "[ . 1 . 2]" 1
3 1 1 ASP HA 1 4 LYS H 4.070 . 4.480 4.081 3.570 4.681 0.201 12 0 "[ . 1 . 2]" 1
4 1 1 ASP HA 1 5 LEU H 5.620 . 6.180 4.990 4.226 5.888 . 0 0 "[ . 1 . 2]" 1
5 1 1 ASP QB 1 2 PHE H 3.500 . 3.850 2.868 1.903 3.291 . 0 0 "[ . 1 . 2]" 1
6 1 1 ASP HB2 1 2 PHE H 2.940 . 3.230 2.969 1.912 3.488 0.258 9 0 "[ . 1 . 2]" 1
7 1 1 ASP HB3 1 2 PHE H 3.950 . 4.350 3.885 3.297 4.245 . 0 0 "[ . 1 . 2]" 1
8 1 2 PHE H 1 2 PHE HB2 2.900 . 3.190 2.352 2.226 2.586 . 0 0 "[ . 1 . 2]" 1
9 1 2 PHE H 1 2 PHE HB3 3.540 . 3.890 3.511 2.484 3.608 . 0 0 "[ . 1 . 2]" 1
10 1 2 PHE H 1 3 LYS QG 5.740 . 6.310 5.722 5.411 6.024 . 0 0 "[ . 1 . 2]" 1
11 1 2 PHE H 1 4 LYS H 4.500 . 4.950 4.549 4.173 4.776 . 0 0 "[ . 1 . 2]" 1
12 1 2 PHE H 2 2 PHE QD 5.200 . 5.720 5.359 3.692 5.669 . 0 0 "[ . 1 . 2]" 1
13 1 2 PHE H 2 2 PHE QE 5.200 . 5.720 5.562 3.908 5.851 0.131 12 0 "[ . 1 . 2]" 1
14 1 2 PHE HA 1 3 LYS H 3.490 . 3.840 3.459 3.314 3.623 . 0 0 "[ . 1 . 2]" 1
15 1 2 PHE HA 1 4 LYS HG2 5.500 . 6.050 5.707 4.681 6.112 0.062 17 0 "[ . 1 . 2]" 1
16 1 2 PHE HA 1 4 LYS QG 4.500 . 4.950 4.128 3.372 4.713 . 0 0 "[ . 1 . 2]" 1
17 1 2 PHE HA 1 4 LYS HG3 4.380 . 4.820 4.238 3.457 4.941 0.121 19 0 "[ . 1 . 2]" 1
18 1 2 PHE HA 1 5 LEU H 3.380 . 3.720 2.970 2.785 3.639 . 0 0 "[ . 1 . 2]" 1
19 1 2 PHE HA 1 5 LEU QB 2.650 . 2.920 2.185 1.950 2.827 . 0 0 "[ . 1 . 2]" 1
20 1 2 PHE HA 1 6 TYR H 4.730 . 5.200 4.169 3.824 4.594 . 0 0 "[ . 1 . 2]" 1
21 1 2 PHE HA 2 2 PHE HB2 5.500 . 6.050 5.216 3.863 5.956 . 0 0 "[ . 1 . 2]" 1
22 1 2 PHE HA 2 2 PHE HB3 4.690 . 5.160 4.614 4.253 5.291 0.131 19 0 "[ . 1 . 2]" 1
23 1 2 PHE HA 2 2 PHE QD 5.500 . 6.050 4.900 1.793 5.285 0.007 19 0 "[ . 1 . 2]" 1
24 1 2 PHE QB 1 3 LYS H 3.250 . 3.580 3.177 2.582 3.402 . 0 0 "[ . 1 . 2]" 1
25 1 2 PHE HB2 1 3 LYS H 4.190 . 4.610 3.406 3.091 3.983 . 0 0 "[ . 1 . 2]" 1
26 1 2 PHE HB2 2 2 PHE HA 5.870 . 6.460 5.839 3.761 6.245 . 0 0 "[ . 1 . 2]" 1
27 1 2 PHE HB2 2 2 PHE HB3 4.100 . 4.510 3.954 3.565 4.252 . 0 0 "[ . 1 . 2]" 1
28 1 2 PHE HB3 1 3 LYS H 3.590 . 3.950 3.950 2.615 4.124 0.174 13 0 "[ . 1 . 2]" 1
29 1 2 PHE HB3 2 2 PHE HA 4.720 . 5.190 4.774 3.785 5.262 0.072 19 0 "[ . 1 . 2]" 1
30 1 2 PHE HB3 2 2 PHE HB2 3.780 . 4.160 3.468 2.613 4.245 0.085 19 0 "[ . 1 . 2]" 1
31 1 2 PHE QD 2 2 PHE H 5.200 . 5.720 5.119 3.794 5.641 . 0 0 "[ . 1 . 2]" 1
32 1 2 PHE QD 2 2 PHE HA 5.500 . 6.050 4.942 1.812 5.323 . 0 0 "[ . 1 . 2]" 1
33 1 2 PHE QD 2 2 PHE QE 4.090 . 4.500 4.216 3.841 4.498 . 0 0 "[ . 1 . 2]" 1
34 1 2 PHE QD 2 3 LYS HA 5.840 . 6.420 5.317 4.624 6.522 0.102 19 0 "[ . 1 . 2]" 1
35 1 2 PHE QD 2 6 TYR H 5.730 . 6.300 5.545 5.326 5.854 . 0 0 "[ . 1 . 2]" 1
36 1 2 PHE QD 2 6 TYR HA 6.450 . 7.090 6.533 6.250 7.192 0.102 19 0 "[ . 1 . 2]" 1
37 1 2 PHE QD 2 6 TYR QB 5.680 . 6.250 4.825 4.444 6.173 . 0 0 "[ . 1 . 2]" 1
38 1 2 PHE QE 2 2 PHE H 5.200 . 5.720 5.087 4.382 5.917 0.197 17 0 "[ . 1 . 2]" 1
39 1 2 PHE QE 2 2 PHE QD 3.910 . 4.300 4.153 3.678 4.455 0.155 19 0 "[ . 1 . 2]" 1
40 1 2 PHE QE 2 6 TYR H 5.330 . 5.860 5.972 5.407 6.132 0.272 2 0 "[ . 1 . 2]" 1
41 1 3 LYS H 1 3 LYS HA 2.800 . 3.080 2.843 2.812 2.900 . 0 0 "[ . 1 . 2]" 1
42 1 3 LYS H 1 3 LYS HB2 3.550 . 3.900 3.639 3.578 3.681 . 0 0 "[ . 1 . 2]" 1
43 1 3 LYS H 1 3 LYS HB3 2.290 . 2.520 2.447 2.324 2.547 0.027 20 0 "[ . 1 . 2]" 1
44 1 3 LYS H 1 3 LYS HD2 2.200 . 2.420 2.018 1.789 2.335 0.011 20 0 "[ . 1 . 2]" 1
45 1 3 LYS H 1 3 LYS QD 3.000 . 3.300 1.994 1.784 2.321 0.016 20 0 "[ . 1 . 2]" 1
46 1 3 LYS H 1 3 LYS HD3 3.680 . 4.050 3.348 2.848 4.048 . 0 0 "[ . 1 . 2]" 1
47 1 3 LYS H 1 3 LYS HE2 4.110 . 4.520 4.156 2.895 4.603 0.083 15 0 "[ . 1 . 2]" 1
48 1 3 LYS H 1 3 LYS HE3 4.350 . 4.790 4.580 3.175 4.968 0.178 6 0 "[ . 1 . 2]" 1
49 1 3 LYS H 1 3 LYS QG 3.770 . 4.150 3.472 3.357 3.602 . 0 0 "[ . 1 . 2]" 1
50 1 3 LYS H 1 4 LYS H 2.900 . 3.190 2.599 2.385 2.720 . 0 0 "[ . 1 . 2]" 1
51 1 3 LYS H 1 5 LEU H 4.140 . 4.550 3.845 3.587 4.174 . 0 0 "[ . 1 . 2]" 1
52 1 3 LYS H 2 5 LEU MD2 5.500 . 6.050 5.005 4.713 5.443 . 0 0 "[ . 1 . 2]" 1
53 1 3 LYS HA 1 3 LYS HB2 2.330 . 2.560 2.345 2.318 2.381 . 0 0 "[ . 1 . 2]" 1
54 1 3 LYS HA 1 3 LYS QB 2.500 . 2.750 2.179 2.170 2.187 . 0 0 "[ . 1 . 2]" 1
55 1 3 LYS HA 1 3 LYS HB3 2.580 . 2.840 2.589 2.534 2.677 . 0 0 "[ . 1 . 2]" 1
56 1 3 LYS HA 1 4 LYS H 3.510 . 3.860 3.543 3.502 3.601 . 0 0 "[ . 1 . 2]" 1
57 1 3 LYS HA 1 5 LEU H 4.400 . 4.840 4.332 4.200 4.611 . 0 0 "[ . 1 . 2]" 1
58 1 3 LYS HA 1 6 TYR H 3.830 . 4.210 3.814 3.598 4.066 . 0 0 "[ . 1 . 2]" 1
59 1 3 LYS HA 1 6 TYR QB 4.120 . 4.530 3.238 2.949 3.471 . 0 0 "[ . 1 . 2]" 1
60 1 3 LYS HA 1 7 GLU H 5.140 . 5.650 4.789 4.560 5.009 . 0 0 "[ . 1 . 2]" 1
61 1 3 LYS HA 2 2 PHE QD 5.980 . 6.580 5.205 4.650 6.395 . 0 0 "[ . 1 . 2]" 1
62 1 3 LYS HA 2 5 LEU MD2 4.340 . 4.770 4.070 3.607 4.470 . 0 0 "[ . 1 . 2]" 1
63 1 3 LYS HB2 1 3 LYS QG 2.450 . 2.700 2.167 2.162 2.177 . 0 0 "[ . 1 . 2]" 1
64 1 3 LYS HB2 1 4 LYS H 4.070 . 4.480 4.045 3.931 4.158 . 0 0 "[ . 1 . 2]" 1
65 1 3 LYS HB3 1 4 LYS H 3.670 . 4.040 3.833 3.752 3.914 . 0 0 "[ . 1 . 2]" 1
66 1 3 LYS HD2 1 4 LYS H 2.100 . 2.310 2.462 2.027 2.768 0.458 8 0 "[ . 1 . 2]" 1
67 1 3 LYS HD2 1 4 LYS HG2 3.880 . 4.270 4.259 3.656 4.497 0.227 9 0 "[ . 1 . 2]" 1
68 1 3 LYS HD2 1 4 LYS HG3 4.010 . 4.410 4.112 3.538 4.495 0.085 2 0 "[ . 1 . 2]" 1
69 1 3 LYS HD3 1 4 LYS H 2.640 . 2.900 2.335 1.605 3.024 0.195 2 0 "[ . 1 . 2]" 1
70 1 3 LYS HE2 1 3 LYS QG 3.710 . 4.080 3.275 2.332 3.485 . 0 0 "[ . 1 . 2]" 1
71 1 3 LYS HE2 1 4 LYS H 4.550 . 5.010 4.383 3.920 4.983 . 0 0 "[ . 1 . 2]" 1
72 1 3 LYS HE3 1 3 LYS QG 3.010 . 3.310 2.603 2.389 3.482 0.172 18 0 "[ . 1 . 2]" 1
73 1 3 LYS HE3 1 4 LYS H 4.580 . 5.040 4.461 3.891 5.008 . 0 0 "[ . 1 . 2]" 1
74 1 3 LYS QG 1 4 LYS H 2.860 . 3.150 2.712 2.345 3.108 . 0 0 "[ . 1 . 2]" 1
75 1 3 LYS QG 1 4 LYS HG2 4.630 . 5.090 4.693 4.167 5.129 0.039 7 0 "[ . 1 . 2]" 1
76 1 3 LYS QG 1 4 LYS HG3 4.500 . 4.950 4.651 4.053 5.037 0.087 7 0 "[ . 1 . 2]" 1
77 1 3 LYS QG 1 7 GLU H 5.410 . 5.950 5.313 4.969 5.525 . 0 0 "[ . 1 . 2]" 1
78 1 4 LYS H 1 4 LYS HA 2.860 . 3.150 2.888 2.852 2.912 . 0 0 "[ . 1 . 2]" 1
79 1 4 LYS H 1 4 LYS QB 3.090 . 3.400 2.594 2.416 2.753 . 0 0 "[ . 1 . 2]" 1
80 1 4 LYS H 1 4 LYS QE 4.560 . 5.020 4.627 4.175 5.062 0.042 12 0 "[ . 1 . 2]" 1
81 1 4 LYS H 1 4 LYS HG2 2.990 . 3.290 3.227 2.723 3.437 0.147 18 0 "[ . 1 . 2]" 1
82 1 4 LYS H 1 4 LYS HG3 2.620 . 2.880 2.403 1.981 2.671 . 0 0 "[ . 1 . 2]" 1
83 1 4 LYS H 1 5 LEU H 2.530 . 2.780 2.441 2.303 2.549 . 0 0 "[ . 1 . 2]" 1
84 1 4 LYS H 1 6 TYR H 4.350 . 4.790 4.269 3.947 4.479 . 0 0 "[ . 1 . 2]" 1
85 1 4 LYS H 1 7 GLU H 5.080 . 5.590 4.765 4.613 4.903 . 0 0 "[ . 1 . 2]" 1
86 1 4 LYS H 2 5 LEU MD2 5.760 . 6.340 5.678 5.038 6.128 . 0 0 "[ . 1 . 2]" 1
87 1 4 LYS HA 1 4 LYS HG2 4.150 . 4.570 4.240 4.072 4.299 . 0 0 "[ . 1 . 2]" 1
88 1 4 LYS HA 1 4 LYS HG3 3.580 . 3.940 3.701 3.651 3.734 . 0 0 "[ . 1 . 2]" 1
89 1 4 LYS HA 1 6 TYR H 4.510 . 4.960 4.304 4.081 4.471 . 0 0 "[ . 1 . 2]" 1
90 1 4 LYS HA 1 7 GLU H 3.270 . 3.600 2.967 2.700 3.158 . 0 0 "[ . 1 . 2]" 1
91 1 4 LYS HA 1 7 GLU HB2 2.810 . 3.090 2.217 1.951 2.504 . 0 0 "[ . 1 . 2]" 1
92 1 4 LYS HA 1 7 GLU HB3 4.110 . 4.520 3.806 3.563 4.112 . 0 0 "[ . 1 . 2]" 1
93 1 4 LYS HA 1 8 GLN H 3.940 . 4.330 4.107 3.842 4.265 . 0 0 "[ . 1 . 2]" 1
94 1 4 LYS QB 1 7 GLU QB 5.200 . 5.720 3.303 2.960 3.582 . 0 0 "[ . 1 . 2]" 1
95 1 4 LYS QB 1 8 GLN H 4.900 . 5.390 4.581 4.280 4.705 . 0 0 "[ . 1 . 2]" 1
96 1 4 LYS QD 1 4 LYS HG2 2.490 . 2.740 2.302 2.180 2.381 . 0 0 "[ . 1 . 2]" 1
97 1 4 LYS QD 1 8 GLN HG2 3.440 . 3.780 2.788 2.081 4.067 0.287 2 0 "[ . 1 . 2]" 1
98 1 4 LYS QD 1 8 GLN HG3 4.430 . 4.870 3.331 2.702 4.503 . 0 0 "[ . 1 . 2]" 1
99 1 4 LYS QE 1 4 LYS QG 3.200 . 3.520 2.412 2.178 2.900 . 0 0 "[ . 1 . 2]" 1
100 1 4 LYS QE 1 8 GLN QB 4.360 . 4.800 4.308 3.499 4.810 0.010 13 0 "[ . 1 . 2]" 1
101 1 4 LYS QE 1 8 GLN HG2 2.950 . 3.250 2.967 1.843 3.410 0.160 7 0 "[ . 1 . 2]" 1
102 1 4 LYS QE 1 8 GLN HG3 4.220 . 4.640 3.075 2.345 3.774 . 0 0 "[ . 1 . 2]" 1
103 1 4 LYS QG 1 5 LEU QB 4.750 . 5.220 3.683 3.244 3.952 . 0 0 "[ . 1 . 2]" 1
104 1 4 LYS QG 1 8 GLN QB 5.500 . 6.050 5.664 5.303 6.064 0.014 11 0 "[ . 1 . 2]" 1
105 1 4 LYS HG2 1 5 LEU H 3.680 . 4.050 4.012 3.616 4.156 0.106 3 0 "[ . 1 . 2]" 1
106 1 4 LYS HG2 1 5 LEU QB 5.000 . 5.500 5.280 4.762 5.518 0.018 3 0 "[ . 1 . 2]" 1
107 1 4 LYS HG2 1 8 GLN HG2 5.130 . 5.640 5.273 5.026 5.589 . 0 0 "[ . 1 . 2]" 1
108 1 4 LYS HG3 1 5 LEU H 2.200 . 2.420 2.356 2.049 2.507 0.087 11 0 "[ . 1 . 2]" 1
109 1 4 LYS HG3 1 5 LEU QB 3.850 . 4.230 3.760 3.302 4.057 . 0 0 "[ . 1 . 2]" 1
110 1 4 LYS HG3 1 8 GLN HG2 4.480 . 4.930 4.418 3.910 5.007 0.077 11 0 "[ . 1 . 2]" 1
111 1 4 LYS HG3 1 8 GLN HG3 5.630 . 6.190 5.451 4.869 6.073 . 0 0 "[ . 1 . 2]" 1
112 1 5 LEU H 1 5 LEU HA 2.790 . 3.070 2.795 2.771 2.866 . 0 0 "[ . 1 . 2]" 1
113 1 5 LEU H 1 5 LEU MD1 4.970 . 5.470 4.078 3.924 4.293 . 0 0 "[ . 1 . 2]" 1
114 1 5 LEU H 1 5 LEU MD2 4.160 . 4.580 4.409 4.341 4.461 . 0 0 "[ . 1 . 2]" 1
115 1 5 LEU H 1 5 LEU HG 4.540 . 4.990 4.566 4.532 4.590 . 0 0 "[ . 1 . 2]" 1
116 1 5 LEU H 1 6 TYR H 2.680 . 2.950 2.775 2.479 2.861 . 0 0 "[ . 1 . 2]" 1
117 1 5 LEU H 1 7 GLU H 4.160 . 4.580 4.123 3.946 4.225 . 0 0 "[ . 1 . 2]" 1
118 1 5 LEU H 2 5 LEU MD2 4.500 . 4.950 4.572 3.693 4.898 . 0 0 "[ . 1 . 2]" 1
119 1 5 LEU HA 1 5 LEU HG 3.610 . 3.970 2.953 2.847 3.100 . 0 0 "[ . 1 . 2]" 1
120 1 5 LEU HA 1 6 TYR H 3.570 . 3.930 3.548 3.503 3.588 . 0 0 "[ . 1 . 2]" 1
121 1 5 LEU HA 1 7 GLU H 4.640 . 5.100 4.539 4.208 4.704 . 0 0 "[ . 1 . 2]" 1
122 1 5 LEU HA 1 8 GLN H 3.620 . 3.980 3.518 2.871 3.844 . 0 0 "[ . 1 . 2]" 1
123 1 5 LEU HA 1 8 GLN QB 3.620 . 3.980 3.109 2.530 3.449 . 0 0 "[ . 1 . 2]" 1
124 1 5 LEU HA 1 8 GLN HE22 4.650 . 5.120 4.455 3.951 4.827 . 0 0 "[ . 1 . 2]" 1
125 1 5 LEU HA 1 9 ILE H 4.780 . 5.260 4.358 3.760 4.564 . 0 0 "[ . 1 . 2]" 1
126 1 5 LEU HA 2 5 LEU MD2 4.910 . 5.400 5.260 4.232 5.461 0.061 1 0 "[ . 1 . 2]" 1
127 1 5 LEU QB 1 5 LEU HG 2.450 . 2.700 2.462 2.443 2.483 . 0 0 "[ . 1 . 2]" 1
128 1 5 LEU QD 1 8 GLN H 5.500 . 6.050 4.766 4.215 5.175 . 0 0 "[ . 1 . 2]" 1
129 1 5 LEU MD1 1 6 TYR H 5.000 . 5.500 4.603 4.539 4.726 . 0 0 "[ . 1 . 2]" 1
130 1 5 LEU MD1 1 8 GLN H 5.970 . 6.570 4.944 4.321 5.427 . 0 0 "[ . 1 . 2]" 1
131 1 5 LEU MD1 1 9 ILE HG12 4.990 . 5.490 4.432 3.143 5.260 . 0 0 "[ . 1 . 2]" 1
132 1 5 LEU MD1 2 5 LEU MD2 4.190 . 4.610 4.689 4.070 4.801 0.191 8 0 "[ . 1 . 2]" 1
133 1 5 LEU MD2 1 6 TYR H 5.200 . 5.720 3.985 3.900 4.191 . 0 0 "[ . 1 . 2]" 1
134 1 5 LEU MD2 2 3 LYS H 5.500 . 6.050 5.202 4.851 5.766 . 0 0 "[ . 1 . 2]" 1
135 1 5 LEU MD2 2 3 LYS HA 5.290 . 5.820 3.956 3.534 4.914 . 0 0 "[ . 1 . 2]" 1
136 1 5 LEU MD2 2 4 LYS H 5.670 . 6.240 5.849 5.450 6.258 0.018 19 0 "[ . 1 . 2]" 1
137 1 5 LEU MD2 2 5 LEU H . . 4.950 4.778 4.568 5.028 0.078 17 0 "[ . 1 . 2]" 1
138 1 5 LEU MD2 2 5 LEU HA 5.040 . 5.540 5.586 5.121 5.719 0.179 12 0 "[ . 1 . 2]" 1
139 1 5 LEU MD2 2 5 LEU MD1 2.800 . 3.080 2.314 2.070 3.286 0.206 19 0 "[ . 1 . 2]" 1
140 1 5 LEU MD2 2 5 LEU HG . . 2.980 2.335 2.026 2.499 . 0 0 "[ . 1 . 2]" 1
141 1 5 LEU MD2 2 6 TYR HA 3.830 . 4.210 3.338 2.903 3.604 . 0 0 "[ . 1 . 2]" 1
142 1 5 LEU MD2 2 6 TYR QB 5.000 . 5.500 1.970 1.850 2.227 . 0 0 "[ . 1 . 2]" 1
143 1 5 LEU MD2 2 6 TYR QD 3.000 . 3.300 2.252 1.742 2.540 0.058 19 0 "[ . 1 . 2]" 1
144 1 5 LEU MD2 2 6 TYR QE 3.810 . 4.190 4.048 3.653 4.283 0.093 1 0 "[ . 1 . 2]" 1
145 1 5 LEU HG 2 5 LEU MD2 . . 4.270 3.977 3.016 4.299 0.029 2 0 "[ . 1 . 2]" 1
146 1 6 TYR H 1 6 TYR HA 2.820 . 3.100 2.772 2.761 2.792 . 0 0 "[ . 1 . 2]" 1
147 1 6 TYR H 1 6 TYR QB 2.540 . 2.790 2.175 2.146 2.226 . 0 0 "[ . 1 . 2]" 1
148 1 6 TYR H 1 7 GLU H 2.620 . 2.880 2.817 2.725 2.879 . 0 0 "[ . 1 . 2]" 1
149 1 6 TYR H 1 7 GLU HB2 4.490 . 4.940 4.845 4.758 4.948 0.008 1 0 "[ . 1 . 2]" 1
150 1 6 TYR H 1 8 GLN H 4.020 . 4.420 4.221 4.035 4.372 . 0 0 "[ . 1 . 2]" 1
151 1 6 TYR H 1 8 GLN HE22 5.200 . 5.720 5.577 5.444 5.739 0.019 8 0 "[ . 1 . 2]" 1
152 1 6 TYR H 2 2 PHE QD 5.260 . 5.790 5.701 5.148 5.829 0.039 6 0 "[ . 1 . 2]" 1
153 1 6 TYR H 2 2 PHE QE 6.130 . 6.740 6.772 4.917 6.961 0.221 2 0 "[ . 1 . 2]" 1
154 1 6 TYR H 2 9 ILE MD 4.960 . 5.460 4.680 4.491 4.946 . 0 0 "[ . 1 . 2]" 1
155 1 6 TYR HA 1 7 GLU H 3.520 . 3.870 3.555 3.527 3.589 . 0 0 "[ . 1 . 2]" 1
156 1 6 TYR HA 1 8 GLN H 4.640 . 5.100 4.435 4.272 4.612 . 0 0 "[ . 1 . 2]" 1
157 1 6 TYR HA 1 9 ILE H 4.180 . 4.600 4.425 4.065 4.633 0.033 13 0 "[ . 1 . 2]" 1
158 1 6 TYR HA 1 9 ILE HB 3.860 . 4.250 4.301 4.003 4.430 0.180 9 0 "[ . 1 . 2]" 1
159 1 6 TYR HA 1 10 LEU H 4.440 . 4.880 4.189 4.059 4.356 . 0 0 "[ . 1 . 2]" 1
160 1 6 TYR HA 2 2 PHE QD 6.130 . 6.740 6.650 6.442 6.822 0.082 2 0 "[ . 1 . 2]" 1
161 1 6 TYR HA 2 5 LEU MD2 4.210 . 4.630 3.580 2.731 3.829 . 0 0 "[ . 1 . 2]" 1
162 1 6 TYR HA 2 9 ILE MD 3.500 . 3.850 2.384 2.189 2.552 . 0 0 "[ . 1 . 2]" 1
163 1 6 TYR HA 2 9 ILE MG 4.520 . 4.970 4.590 4.437 4.697 . 0 0 "[ . 1 . 2]" 1
164 1 6 TYR QB 2 2 PHE QD 5.000 . 5.500 4.845 4.542 5.534 0.034 19 0 "[ . 1 . 2]" 1
165 1 6 TYR QB 2 5 LEU MD2 5.000 . 5.500 2.431 2.174 2.793 . 0 0 "[ . 1 . 2]" 1
166 1 6 TYR QD 2 5 LEU MD2 3.000 . 3.300 2.296 1.898 2.679 . 0 0 "[ . 1 . 2]" 1
167 1 6 TYR QD 2 9 ILE H 5.810 . 6.390 6.258 6.152 6.409 0.019 17 0 "[ . 1 . 2]" 1
168 1 6 TYR QD 2 9 ILE MD 3.000 . 3.300 2.788 2.640 3.075 . 0 0 "[ . 1 . 2]" 1
169 1 6 TYR QD 2 9 ILE MG 4.840 . 5.320 5.066 4.860 5.309 . 0 0 "[ . 1 . 2]" 1
170 1 6 TYR QE 2 5 LEU MD2 3.990 . 4.390 4.199 3.886 4.506 0.116 19 0 "[ . 1 . 2]" 1
171 1 6 TYR QE 2 9 ILE H 5.320 . 5.850 5.946 5.908 6.015 0.165 19 0 "[ . 1 . 2]" 1
172 1 6 TYR QE 2 9 ILE MD 3.000 . 3.300 2.842 2.665 2.987 . 0 0 "[ . 1 . 2]" 1
173 1 6 TYR QE 2 9 ILE MG 4.620 . 5.080 4.931 4.668 5.252 0.172 12 0 "[ . 1 . 2]" 1
174 1 7 GLU H 1 7 GLU HB2 2.140 . 2.350 2.395 2.326 2.481 0.131 10 0 "[ . 1 . 2]" 1
175 1 7 GLU H 1 7 GLU HB3 3.450 . 3.790 3.566 3.542 3.598 . 0 0 "[ . 1 . 2]" 1
176 1 7 GLU H 1 7 GLU QG 4.080 . 4.490 2.348 2.157 3.417 . 0 0 "[ . 1 . 2]" 1
177 1 7 GLU H 1 8 GLN H 2.480 . 2.730 2.774 2.690 2.840 0.110 10 0 "[ . 1 . 2]" 1
178 1 7 GLU H 1 8 GLN HE21 5.280 . 5.810 5.304 5.070 5.445 . 0 0 "[ . 1 . 2]" 1
179 1 7 GLU H 1 8 GLN HE22 3.970 . 4.370 3.810 3.605 3.939 . 0 0 "[ . 1 . 2]" 1
180 1 7 GLU H 1 9 ILE H 4.780 . 5.260 5.011 4.739 5.262 0.002 10 0 "[ . 1 . 2]" 1
181 1 7 GLU H 1 11 ALA H 5.540 . 6.090 5.851 5.757 5.892 . 0 0 "[ . 1 . 2]" 1
182 1 7 GLU HA 1 7 GLU HB2 2.950 . 3.250 3.036 3.020 3.043 . 0 0 "[ . 1 . 2]" 1
183 1 7 GLU HA 1 7 GLU HB3 2.710 . 2.980 2.559 2.519 2.648 . 0 0 "[ . 1 . 2]" 1
184 1 7 GLU HA 1 7 GLU QG 3.020 . 3.320 2.694 2.379 3.156 . 0 0 "[ . 1 . 2]" 1
185 1 7 GLU HA 1 8 GLN H 3.550 . 3.900 3.550 3.528 3.585 . 0 0 "[ . 1 . 2]" 1
186 1 7 GLU HA 1 9 ILE H 4.980 . 5.480 5.229 4.979 5.502 0.022 10 0 "[ . 1 . 2]" 1
187 1 7 GLU HA 1 10 LEU H 3.970 . 4.370 3.933 3.556 4.214 . 0 0 "[ . 1 . 2]" 1
188 1 7 GLU HA 1 10 LEU HB2 4.840 . 5.320 3.783 3.014 4.447 . 0 0 "[ . 1 . 2]" 1
189 1 7 GLU HA 1 10 LEU QB 4.010 . 4.410 2.740 2.293 3.130 . 0 0 "[ . 1 . 2]" 1
190 1 7 GLU HA 1 10 LEU HB3 3.170 . 3.490 2.815 2.377 3.199 . 0 0 "[ . 1 . 2]" 1
191 1 7 GLU HA 1 11 ALA H 3.460 . 3.810 3.832 3.659 3.940 0.130 17 0 "[ . 1 . 2]" 1
192 1 7 GLU HA 2 9 ILE MD 5.500 . 6.050 4.970 4.573 5.210 . 0 0 "[ . 1 . 2]" 1
193 1 7 GLU QB 1 11 ALA MB 3.600 . 3.960 3.831 3.675 3.948 . 0 0 "[ . 1 . 2]" 1
194 1 7 GLU HB2 1 8 GLN H 3.020 . 3.320 2.867 2.732 3.052 . 0 0 "[ . 1 . 2]" 1
195 1 7 GLU HB2 1 8 GLN HE21 3.720 . 4.090 3.228 3.008 3.586 . 0 0 "[ . 1 . 2]" 1
196 1 7 GLU HB2 1 8 GLN HE22 2.910 . 3.200 2.221 1.969 2.549 . 0 0 "[ . 1 . 2]" 1
197 1 7 GLU HB2 1 11 ALA MB 5.060 . 5.570 5.063 4.947 5.227 . 0 0 "[ . 1 . 2]" 1
198 1 7 GLU HB3 1 7 GLU QG 2.430 . 2.670 2.344 2.169 2.398 . 0 0 "[ . 1 . 2]" 1
199 1 7 GLU HB3 1 8 GLN H 3.280 . 3.610 3.736 3.659 3.835 0.225 1 0 "[ . 1 . 2]" 1
200 1 7 GLU HB3 1 8 GLN HE21 2.950 . 3.250 3.353 3.242 3.452 0.202 18 0 "[ . 1 . 2]" 1
201 1 7 GLU HB3 1 8 GLN HE22 2.910 . 3.200 3.060 2.934 3.201 0.001 2 0 "[ . 1 . 2]" 1
202 1 7 GLU HB3 1 11 ALA MB 3.700 . 4.070 3.967 3.789 4.130 0.060 17 0 "[ . 1 . 2]" 1
203 1 8 GLN H 1 8 GLN HA 2.750 . 3.030 2.838 2.826 2.860 . 0 0 "[ . 1 . 2]" 1
204 1 8 GLN H 1 8 GLN QB 2.920 . 3.210 2.576 2.501 2.627 . 0 0 "[ . 1 . 2]" 1
205 1 8 GLN H 1 8 GLN HE21 3.460 . 3.810 3.880 3.818 3.931 0.121 4 0 "[ . 1 . 2]" 1
206 1 8 GLN H 1 8 GLN HE22 2.040 . 2.240 2.320 2.277 2.349 0.109 5 0 "[ . 1 . 2]" 1
207 1 8 GLN H 1 8 GLN HG2 3.030 . 3.330 2.508 2.408 2.721 . 0 0 "[ . 1 . 2]" 1
208 1 8 GLN H 1 8 GLN HG3 4.140 . 4.550 3.929 3.866 4.053 . 0 0 "[ . 1 . 2]" 1
209 1 8 GLN H 1 9 ILE H 3.060 . 3.370 2.944 2.770 3.063 . 0 0 "[ . 1 . 2]" 1
210 1 8 GLN H 1 10 LEU H 4.440 . 4.880 3.983 3.853 4.155 . 0 0 "[ . 1 . 2]" 1
211 1 8 GLN HA 1 8 GLN HE21 2.930 . 3.220 3.256 3.218 3.325 0.105 1 0 "[ . 1 . 2]" 1
212 1 8 GLN HA 1 8 GLN HE22 2.790 . 3.070 2.927 2.838 3.020 . 0 0 "[ . 1 . 2]" 1
213 1 8 GLN HA 1 8 GLN HG2 3.420 . 3.760 3.443 3.401 3.487 . 0 0 "[ . 1 . 2]" 1
214 1 8 GLN HA 1 8 GLN HG3 3.450 . 3.790 3.697 3.594 3.743 . 0 0 "[ . 1 . 2]" 1
215 1 8 GLN HA 1 10 LEU H 5.240 . 5.760 4.633 4.489 4.793 . 0 0 "[ . 1 . 2]" 1
216 1 8 GLN HA 1 11 ALA H 4.500 . 4.950 3.771 3.554 3.955 . 0 0 "[ . 1 . 2]" 1
217 1 8 GLN HA 1 11 ALA MB 4.300 . 4.730 3.025 2.724 3.176 . 0 0 "[ . 1 . 2]" 1
218 1 8 GLN QB 1 8 GLN HG2 2.540 . 2.790 2.263 2.243 2.283 . 0 0 "[ . 1 . 2]" 1
219 1 8 GLN QB 1 8 GLN HG3 2.490 . 2.740 2.169 2.160 2.175 . 0 0 "[ . 1 . 2]" 1
220 1 8 GLN QB 1 9 ILE H 3.140 . 3.450 2.203 2.026 2.425 . 0 0 "[ . 1 . 2]" 1
221 1 8 GLN HE21 1 9 ILE H 5.890 . 6.480 6.227 6.153 6.277 . 0 0 "[ . 1 . 2]" 1
222 1 8 GLN HE21 1 11 ALA MB 4.320 . 4.750 4.546 4.245 4.737 . 0 0 "[ . 1 . 2]" 1
223 1 8 GLN HE22 1 8 GLN HG3 3.530 . 3.880 3.493 3.472 3.508 . 0 0 "[ . 1 . 2]" 1
224 1 8 GLN HE22 1 9 ILE H 4.790 . 5.270 4.966 4.848 5.060 . 0 0 "[ . 1 . 2]" 1
225 1 8 GLN HE22 1 11 ALA MB 4.890 . 5.380 4.762 4.570 4.896 . 0 0 "[ . 1 . 2]" 1
226 1 9 ILE H 1 9 ILE HB 2.640 . 2.900 2.886 2.755 3.006 0.106 5 0 "[ . 1 . 2]" 1
227 1 9 ILE H 1 9 ILE HG12 3.000 . 3.300 3.050 2.909 3.175 . 0 0 "[ . 1 . 2]" 1
228 1 9 ILE H 1 9 ILE HG13 3.980 . 4.380 1.902 1.743 2.093 0.057 20 0 "[ . 1 . 2]" 1
229 1 9 ILE H 1 9 ILE MG 4.390 . 4.830 3.823 3.762 3.872 . 0 0 "[ . 1 . 2]" 1
230 1 9 ILE H 1 10 LEU H 2.890 . 3.180 2.785 2.692 2.885 . 0 0 "[ . 1 . 2]" 1
231 1 9 ILE H 1 11 ALA H 4.140 . 4.550 4.267 4.048 4.421 . 0 0 "[ . 1 . 2]" 1
232 1 9 ILE H 2 6 TYR QD 4.870 . 5.360 5.399 5.345 5.473 0.113 13 0 "[ . 1 . 2]" 1
233 1 9 ILE H 2 6 TYR QE 4.460 . 4.910 5.209 5.130 5.276 0.366 1 0 "[ . 1 . 2]" 1
234 1 9 ILE H 2 9 ILE MD 5.000 . 5.500 4.395 4.164 4.744 . 0 0 "[ . 1 . 2]" 1
235 1 9 ILE H 2 9 ILE MG 5.500 . 6.050 4.544 4.434 4.633 . 0 0 "[ . 1 . 2]" 1
236 1 9 ILE HA 1 9 ILE MD 3.770 . 4.150 3.965 3.874 4.048 . 0 0 "[ . 1 . 2]" 1
237 1 9 ILE HA 1 9 ILE HG12 2.670 . 2.940 2.833 2.648 3.003 0.063 20 0 "[ . 1 . 2]" 1
238 1 9 ILE HA 1 9 ILE HG13 3.590 . 3.950 3.301 3.254 3.356 . 0 0 "[ . 1 . 2]" 1
239 1 9 ILE HA 1 9 ILE MG 3.390 . 3.730 2.320 2.269 2.392 . 0 0 "[ . 1 . 2]" 1
240 1 9 ILE HA 1 10 LEU H 3.570 . 3.930 3.568 3.534 3.600 . 0 0 "[ . 1 . 2]" 1
241 1 9 ILE HA 1 11 ALA H 4.800 . 5.280 4.360 4.154 4.546 . 0 0 "[ . 1 . 2]" 1
242 1 9 ILE HA 1 12 GLU H 4.430 . 4.870 3.702 3.580 3.967 . 0 0 "[ . 1 . 2]" 1
243 1 9 ILE HA 1 12 GLU QB 4.170 . 4.590 3.072 2.819 3.418 . 0 0 "[ . 1 . 2]" 1
244 1 9 ILE HA 1 13 ASN H 4.750 . 5.220 4.298 4.177 4.437 . 0 0 "[ . 1 . 2]" 1
245 1 9 ILE HA 2 9 ILE MD 5.260 . 5.790 5.305 5.113 5.530 . 0 0 "[ . 1 . 2]" 1
246 1 9 ILE HA 2 9 ILE MG 4.500 . 4.950 4.130 4.033 4.215 . 0 0 "[ . 1 . 2]" 1
247 1 9 ILE HA 2 10 LEU QD 3.800 . 4.180 4.073 3.784 4.200 0.020 13 0 "[ . 1 . 2]" 1
248 1 9 ILE HB 1 9 ILE HG12 2.960 . 3.260 3.057 3.042 3.066 . 0 0 "[ . 1 . 2]" 1
249 1 9 ILE HB 1 9 ILE HG13 2.430 . 2.670 2.512 2.465 2.556 . 0 0 "[ . 1 . 2]" 1
250 1 9 ILE HB 1 10 LEU H 2.500 . 2.750 2.634 2.433 2.800 0.050 3 0 "[ . 1 . 2]" 1
251 1 9 ILE HB 2 9 ILE MD 4.500 . 4.950 2.846 2.590 3.045 . 0 0 "[ . 1 . 2]" 1
252 1 9 ILE HB 2 9 ILE MG 3.000 . 3.300 2.331 2.173 2.529 . 0 0 "[ . 1 . 2]" 1
253 1 9 ILE HB 2 10 LEU QD 4.150 . 4.570 4.396 4.252 4.507 . 0 0 "[ . 1 . 2]" 1
254 1 9 ILE MD 1 9 ILE MG 3.300 . 3.630 1.959 1.888 2.075 . 0 0 "[ . 1 . 2]" 1
255 1 9 ILE MD 2 6 TYR H 4.500 . 4.950 4.384 3.985 4.651 . 0 0 "[ . 1 . 2]" 1
256 1 9 ILE MD 2 6 TYR HA 3.500 . 3.850 2.137 1.920 2.294 . 0 0 "[ . 1 . 2]" 1
257 1 9 ILE MD 2 6 TYR QD 3.000 . 3.300 2.227 1.764 2.711 0.036 14 0 "[ . 1 . 2]" 1
258 1 9 ILE MD 2 6 TYR QE 3.000 . 3.300 2.812 2.531 3.135 . 0 0 "[ . 1 . 2]" 1
259 1 9 ILE MD 2 7 GLU HA 5.500 . 6.050 4.964 4.608 5.464 . 0 0 "[ . 1 . 2]" 1
260 1 9 ILE MD 2 9 ILE H 5.000 . 5.500 3.981 3.704 4.266 . 0 0 "[ . 1 . 2]" 1
261 1 9 ILE MD 2 9 ILE HA 5.270 . 5.800 4.933 4.753 5.190 . 0 0 "[ . 1 . 2]" 1
262 1 9 ILE MD 2 9 ILE HB 4.500 . 4.950 2.509 2.261 2.851 . 0 0 "[ . 1 . 2]" 1
263 1 9 ILE MD 2 9 ILE MG 3.500 . 3.850 3.448 3.247 3.719 . 0 0 "[ . 1 . 2]" 1
264 1 9 ILE MD 2 10 LEU H 3.800 . 4.180 2.938 2.775 3.091 . 0 0 "[ . 1 . 2]" 1
265 1 9 ILE MD 2 10 LEU HA 3.500 . 3.850 3.419 3.080 4.032 0.182 17 0 "[ . 1 . 2]" 1
266 1 9 ILE MD 2 10 LEU QD 2.800 . 3.080 2.614 2.037 3.139 0.059 19 0 "[ . 1 . 2]" 1
267 1 9 ILE MD 2 10 LEU HG 4.180 . 4.600 3.827 3.175 4.462 . 0 0 "[ . 1 . 2]" 1
268 1 9 ILE MD 2 13 ASN H 5.750 . 6.320 5.755 5.486 6.114 . 0 0 "[ . 1 . 2]" 1
269 1 9 ILE HG12 2 10 LEU H 5.120 . 5.630 5.395 5.077 5.604 . 0 0 "[ . 1 . 2]" 1
270 1 9 ILE HG12 2 10 LEU QD 3.000 . 3.300 2.908 2.674 3.150 . 0 0 "[ . 1 . 2]" 1
271 1 9 ILE HG13 1 9 ILE MG 3.170 . 3.490 3.246 3.235 3.256 . 0 0 "[ . 1 . 2]" 1
272 1 9 ILE MG 1 10 LEU H 3.370 . 3.710 3.770 3.714 3.861 0.151 20 0 "[ . 1 . 2]" 1
273 1 9 ILE MG 1 10 LEU HA 3.710 . 4.080 3.814 3.662 4.013 . 0 0 "[ . 1 . 2]" 1
274 1 9 ILE MG 1 10 LEU HB2 4.600 . 5.060 4.853 4.671 5.004 . 0 0 "[ . 1 . 2]" 1
275 1 9 ILE MG 1 10 LEU HB3 5.360 . 5.900 5.760 5.597 5.921 0.021 15 0 "[ . 1 . 2]" 1
276 1 9 ILE MG 1 13 ASN H 5.500 . 6.050 3.983 3.825 4.231 . 0 0 "[ . 1 . 2]" 1
277 1 9 ILE MG 1 13 ASN HB2 4.900 . 5.390 2.906 2.635 3.143 . 0 0 "[ . 1 . 2]" 1
278 1 9 ILE MG 1 13 ASN HB3 5.110 . 5.620 4.230 3.896 4.594 . 0 0 "[ . 1 . 2]" 1
279 1 9 ILE MG 1 13 ASN HD21 5.200 . 5.720 4.841 4.438 5.395 . 0 0 "[ . 1 . 2]" 1
280 1 9 ILE MG 2 6 TYR HA 4.310 . 4.740 4.498 4.078 4.764 0.024 2 0 "[ . 1 . 2]" 1
281 1 9 ILE MG 2 6 TYR QD 4.720 . 5.190 4.925 4.447 5.209 0.019 18 0 "[ . 1 . 2]" 1
282 1 9 ILE MG 2 6 TYR QE 4.780 . 5.260 4.757 4.150 5.120 . 0 0 "[ . 1 . 2]" 1
283 1 9 ILE MG 2 9 ILE H 5.500 . 6.050 4.461 4.206 4.617 . 0 0 "[ . 1 . 2]" 1
284 1 9 ILE MG 2 9 ILE HA 4.500 . 4.950 4.072 3.994 4.189 . 0 0 "[ . 1 . 2]" 1
285 1 9 ILE MG 2 9 ILE HB 3.000 . 3.300 2.474 2.101 2.642 . 0 0 "[ . 1 . 2]" 1
286 1 9 ILE MG 2 9 ILE MD 3.500 . 3.850 3.739 3.464 3.894 0.044 19 0 "[ . 1 . 2]" 1
287 1 9 ILE MG 2 9 ILE MG 3.000 . 3.300 1.983 1.894 2.078 . 0 0 "[ . 1 . 2]" 1
288 1 9 ILE MG 2 10 LEU H 5.500 . 6.050 2.953 2.765 3.087 . 0 0 "[ . 1 . 2]" 1
289 1 9 ILE MG 2 10 LEU HA 4.000 . 4.400 2.304 2.161 2.557 . 0 0 "[ . 1 . 2]" 1
290 1 9 ILE MG 2 10 LEU QD . . 2.640 2.169 1.974 2.323 . 0 0 "[ . 1 . 2]" 1
291 1 9 ILE MG 2 13 ASN H 4.210 . 4.630 3.991 3.857 4.231 . 0 0 "[ . 1 . 2]" 1
292 1 9 ILE MG 2 13 ASN HA 4.880 . 5.370 4.514 4.328 4.876 . 0 0 "[ . 1 . 2]" 1
293 1 9 ILE MG 2 13 ASN HB2 5.000 . 5.500 2.481 2.332 2.878 . 0 0 "[ . 1 . 2]" 1
294 1 9 ILE MG 2 13 ASN HB3 5.000 . 5.500 3.097 2.883 3.539 . 0 0 "[ . 1 . 2]" 1
295 1 10 LEU H 1 10 LEU HA 2.890 . 3.180 2.838 2.818 2.864 . 0 0 "[ . 1 . 2]" 1
296 1 10 LEU H 1 10 LEU HB2 2.360 . 2.600 2.313 2.180 2.504 . 0 0 "[ . 1 . 2]" 1
297 1 10 LEU H 1 10 LEU HB3 3.080 . 3.390 2.817 2.626 2.947 . 0 0 "[ . 1 . 2]" 1
298 1 10 LEU H 1 11 ALA H 2.820 . 3.100 2.675 2.628 2.723 . 0 0 "[ . 1 . 2]" 1
299 1 10 LEU H 1 11 ALA MB 5.100 . 5.610 4.392 4.352 4.454 . 0 0 "[ . 1 . 2]" 1
300 1 10 LEU H 1 12 GLU H 4.500 . 4.950 4.346 4.124 4.574 . 0 0 "[ . 1 . 2]" 1
301 1 10 LEU H 1 13 ASN H 4.910 . 5.400 4.513 4.411 4.642 . 0 0 "[ . 1 . 2]" 1
302 1 10 LEU H 1 13 ASN HB2 5.200 . 5.720 4.665 4.471 4.848 . 0 0 "[ . 1 . 2]" 1
303 1 10 LEU H 1 13 ASN HB3 4.980 . 5.480 4.652 4.394 4.911 . 0 0 "[ . 1 . 2]" 1
304 1 10 LEU H 2 9 ILE MD 3.500 . 3.850 3.212 3.079 3.322 . 0 0 "[ . 1 . 2]" 1
305 1 10 LEU H 2 9 ILE HG12 5.090 . 5.600 5.632 5.551 5.759 0.159 19 0 "[ . 1 . 2]" 1
306 1 10 LEU H 2 9 ILE MG 5.500 . 6.050 2.934 2.794 3.007 . 0 0 "[ . 1 . 2]" 1
307 1 10 LEU H 2 10 LEU QD 5.700 . 6.270 6.218 6.010 6.326 0.056 13 0 "[ . 1 . 2]" 1
308 1 10 LEU HA 1 11 ALA H 3.570 . 3.930 3.534 3.487 3.562 . 0 0 "[ . 1 . 2]" 1
309 1 10 LEU HA 1 11 ALA HA 4.860 . 5.350 4.859 4.818 4.922 . 0 0 "[ . 1 . 2]" 1
310 1 10 LEU HA 1 13 ASN H 3.260 . 3.590 3.080 2.949 3.300 . 0 0 "[ . 1 . 2]" 1
311 1 10 LEU HA 1 13 ASN HB2 3.160 . 3.480 2.635 2.319 2.888 . 0 0 "[ . 1 . 2]" 1
312 1 10 LEU HA 1 13 ASN HB3 2.340 . 2.570 1.956 1.774 2.161 0.026 7 0 "[ . 1 . 2]" 1
313 1 10 LEU HA 2 9 ILE MD 3.500 . 3.850 3.582 3.462 3.774 . 0 0 "[ . 1 . 2]" 1
314 1 10 LEU HA 2 9 ILE MG 4.000 . 4.400 2.356 2.264 2.512 . 0 0 "[ . 1 . 2]" 1
315 1 10 LEU HB2 1 10 LEU HG 2.980 . 3.280 2.562 2.376 3.053 . 0 0 "[ . 1 . 2]" 1
316 1 10 LEU HB2 1 11 ALA H 3.560 . 3.920 3.905 3.778 4.016 0.096 19 0 "[ . 1 . 2]" 1
317 1 10 LEU HB3 1 10 LEU QD 2.450 . 2.700 2.337 2.258 2.393 . 0 0 "[ . 1 . 2]" 1
318 1 10 LEU HB3 1 10 LEU HG 2.430 . 2.670 2.509 2.456 2.559 . 0 0 "[ . 1 . 2]" 1
319 1 10 LEU HB3 1 11 ALA H 2.790 . 3.070 3.007 2.880 3.108 0.038 2 0 "[ . 1 . 2]" 1
320 1 10 LEU HB3 1 11 ALA MB 4.800 . 5.280 4.330 4.202 4.431 . 0 0 "[ . 1 . 2]" 1
321 1 10 LEU QD 1 11 ALA H 4.900 . 5.390 3.983 3.791 4.319 . 0 0 "[ . 1 . 2]" 1
322 1 10 LEU QD 1 13 ASN QB 5.250 . 5.780 2.298 2.160 2.431 . 0 0 "[ . 1 . 2]" 1
323 1 10 LEU QD 2 9 ILE HA 3.680 . 4.050 4.073 3.881 4.151 0.101 19 0 "[ . 1 . 2]" 1
324 1 10 LEU QD 2 9 ILE HB 4.110 . 4.520 4.222 4.089 4.369 . 0 0 "[ . 1 . 2]" 1
325 1 10 LEU QD 2 9 ILE MD 2.800 . 3.080 2.267 1.949 2.490 . 0 0 "[ . 1 . 2]" 1
326 1 10 LEU QD 2 9 ILE HG12 3.000 . 3.300 2.812 2.576 3.090 . 0 0 "[ . 1 . 2]" 1
327 1 10 LEU QD 2 9 ILE MG 2.400 . 2.640 2.091 2.012 2.159 . 0 0 "[ . 1 . 2]" 1
328 1 10 LEU QD 2 10 LEU H 5.590 . 6.150 6.162 6.039 6.229 0.079 19 0 "[ . 1 . 2]" 1
329 1 10 LEU QD 2 12 GLU H 6.170 . 6.790 6.617 6.301 6.782 . 0 0 "[ . 1 . 2]" 1
330 1 10 LEU QD 2 12 GLU QG 5.140 . 5.650 4.670 4.281 4.890 . 0 0 "[ . 1 . 2]" 1
331 1 10 LEU HG 2 9 ILE MD 4.170 . 4.590 3.696 3.299 4.554 . 0 0 "[ . 1 . 2]" 1
332 1 11 ALA H 1 11 ALA HA 2.730 . 3.000 2.843 2.812 2.878 . 0 0 "[ . 1 . 2]" 1
333 1 11 ALA H 1 11 ALA MB 2.750 . 3.030 2.283 2.265 2.302 . 0 0 "[ . 1 . 2]" 1
334 1 11 ALA H 1 12 GLU H 2.920 . 3.210 2.685 2.530 2.855 . 0 0 "[ . 1 . 2]" 1
335 1 11 ALA H 1 13 ASN H 3.990 . 4.390 3.792 3.623 3.979 . 0 0 "[ . 1 . 2]" 1
336 1 11 ALA HA 1 14 GLU H 4.410 . 4.850 3.772 3.383 4.104 . 0 0 "[ . 1 . 2]" 1
337 1 11 ALA MB 1 12 GLU H 3.280 . 3.610 2.424 2.224 2.637 . 0 0 "[ . 1 . 2]" 1
338 1 11 ALA MB 1 13 ASN H 5.200 . 5.720 4.345 4.199 4.461 . 0 0 "[ . 1 . 2]" 1
339 1 12 GLU H 1 12 GLU HA 2.840 . 3.120 2.851 2.826 2.888 . 0 0 "[ . 1 . 2]" 1
340 1 12 GLU H 1 13 ASN H 2.530 . 2.780 2.555 2.467 2.636 . 0 0 "[ . 1 . 2]" 1
341 1 12 GLU H 2 10 LEU QD 6.270 . 6.900 6.664 6.375 6.817 . 0 0 "[ . 1 . 2]" 1
342 1 12 GLU HA 1 12 GLU QG 2.780 . 3.060 2.747 2.408 2.962 . 0 0 "[ . 1 . 2]" 1
343 1 12 GLU HA 1 13 ASN H 3.570 . 3.930 3.507 3.473 3.552 . 0 0 "[ . 1 . 2]" 1
344 1 12 GLU HA 1 15 LYS H 3.550 . 3.900 3.494 2.798 3.718 . 0 0 "[ . 1 . 2]" 1
345 1 12 GLU HA 1 15 LYS QB 2.700 . 2.970 2.452 2.005 2.700 . 0 0 "[ . 1 . 2]" 1
346 1 12 GLU HA 1 15 LYS QE 3.660 . 4.030 3.481 2.765 4.058 0.028 1 0 "[ . 1 . 2]" 1
347 1 12 GLU HA 1 15 LYS QG 4.670 . 5.140 4.429 4.044 4.720 . 0 0 "[ . 1 . 2]" 1
348 1 12 GLU HA 1 16 LEU H 4.500 . 4.950 4.129 3.699 4.344 . 0 0 "[ . 1 . 2]" 1
349 1 12 GLU QB 1 15 LYS QE 5.100 . 5.610 4.577 3.918 5.165 . 0 0 "[ . 1 . 2]" 1
350 1 12 GLU QG 1 13 ASN H 4.620 . 5.080 3.929 3.657 4.542 . 0 0 "[ . 1 . 2]" 1
351 1 12 GLU QG 1 15 LYS QG 4.840 . 5.320 5.242 4.062 5.641 0.321 19 0 "[ . 1 . 2]" 1
352 1 12 GLU QG 2 10 LEU QD 5.250 . 5.780 5.067 4.622 5.796 0.016 16 0 "[ . 1 . 2]" 1
353 1 13 ASN H 1 13 ASN HB2 2.800 . 3.080 2.484 2.366 2.615 . 0 0 "[ . 1 . 2]" 1
354 1 13 ASN H 1 13 ASN QB 2.550 . 2.800 2.225 2.195 2.256 . 0 0 "[ . 1 . 2]" 1
355 1 13 ASN H 1 13 ASN HB3 2.590 . 2.850 2.523 2.362 2.643 . 0 0 "[ . 1 . 2]" 1
356 1 13 ASN H 1 14 GLU H 2.870 . 3.160 2.600 2.447 2.739 . 0 0 "[ . 1 . 2]" 1
357 1 13 ASN H 1 14 GLU QB 5.300 . 5.830 4.270 4.039 4.572 . 0 0 "[ . 1 . 2]" 1
358 1 13 ASN H 1 15 LYS H 4.210 . 4.630 3.983 3.607 4.336 . 0 0 "[ . 1 . 2]" 1
359 1 13 ASN H 1 16 LEU H 4.870 . 5.360 4.554 4.414 4.697 . 0 0 "[ . 1 . 2]" 1
360 1 13 ASN H 1 16 LEU QB 5.400 . 5.940 4.940 4.785 5.168 . 0 0 "[ . 1 . 2]" 1
361 1 13 ASN H 2 9 ILE MD 5.900 . 6.490 6.028 5.860 6.233 . 0 0 "[ . 1 . 2]" 1
362 1 13 ASN H 2 9 ILE MG 4.160 . 4.580 4.105 3.975 4.239 . 0 0 "[ . 1 . 2]" 1
363 1 13 ASN HA 1 14 GLU H 3.570 . 3.930 3.545 3.502 3.579 . 0 0 "[ . 1 . 2]" 1
364 1 13 ASN HA 1 16 LEU H 3.960 . 4.360 3.464 3.226 3.658 . 0 0 "[ . 1 . 2]" 1
365 1 13 ASN HA 1 16 LEU QB 3.760 . 4.140 2.635 2.370 2.916 . 0 0 "[ . 1 . 2]" 1
366 1 13 ASN HA 1 17 LYS H 4.760 . 5.240 4.342 4.177 4.571 . 0 0 "[ . 1 . 2]" 1
367 1 13 ASN HA 2 9 ILE MG 4.840 . 5.320 4.490 4.270 4.712 . 0 0 "[ . 1 . 2]" 1
368 1 13 ASN QB 1 15 LYS H 5.200 . 5.720 4.724 4.408 4.900 . 0 0 "[ . 1 . 2]" 1
369 1 13 ASN HB2 1 14 GLU H 3.770 . 4.150 3.783 3.652 3.935 . 0 0 "[ . 1 . 2]" 1
370 1 13 ASN HB2 2 9 ILE MG 5.000 . 5.500 2.474 2.297 2.708 . 0 0 "[ . 1 . 2]" 1
371 1 13 ASN HB3 1 14 GLU H 2.370 . 2.610 2.510 2.268 2.661 0.051 13 0 "[ . 1 . 2]" 1
372 1 13 ASN HB3 1 15 LYS H 4.940 . 5.430 4.996 4.668 5.175 . 0 0 "[ . 1 . 2]" 1
373 1 13 ASN HB3 2 9 ILE MG 5.000 . 5.500 3.061 2.884 3.319 . 0 0 "[ . 1 . 2]" 1
374 1 13 ASN HD21 2 13 ASN HD22 4.890 . 5.380 4.834 4.304 5.237 . 0 0 "[ . 1 . 2]" 1
375 1 13 ASN HD22 2 13 ASN HD21 4.890 . 5.380 4.867 4.305 5.286 . 0 0 "[ . 1 . 2]" 1
376 1 14 GLU H 1 14 GLU HA 2.860 . 3.150 2.822 2.769 2.882 . 0 0 "[ . 1 . 2]" 1
377 1 14 GLU H 1 14 GLU QB 2.620 . 2.880 2.155 2.097 2.304 . 0 0 "[ . 1 . 2]" 1
378 1 14 GLU H 1 14 GLU HG2 3.810 . 4.190 3.884 2.756 4.218 0.028 14 0 "[ . 1 . 2]" 1
379 1 14 GLU H 1 14 GLU HG3 4.380 . 4.820 4.430 3.997 4.542 . 0 0 "[ . 1 . 2]" 1
380 1 14 GLU H 1 15 LYS H 2.820 . 3.100 2.658 2.393 2.805 . 0 0 "[ . 1 . 2]" 1
381 1 14 GLU H 1 16 LEU H 4.110 . 4.520 4.024 3.828 4.208 . 0 0 "[ . 1 . 2]" 1
382 1 14 GLU HA 1 14 GLU QG 3.330 . 3.660 2.914 2.747 3.336 . 0 0 "[ . 1 . 2]" 1
383 1 14 GLU HA 1 15 LYS H 3.560 . 3.920 3.551 3.503 3.580 . 0 0 "[ . 1 . 2]" 1
384 1 14 GLU HA 1 17 LYS QB 3.800 . 4.180 2.603 2.129 3.141 . 0 0 "[ . 1 . 2]" 1
385 1 14 GLU HA 1 18 ALA H 4.990 . 5.490 4.440 4.211 4.616 . 0 0 "[ . 1 . 2]" 1
386 1 14 GLU QB 1 15 LYS H 3.430 . 3.770 2.809 2.554 3.481 . 0 0 "[ . 1 . 2]" 1
387 1 14 GLU QB 1 16 LEU H 5.500 . 6.050 4.884 4.702 5.250 . 0 0 "[ . 1 . 2]" 1
388 1 14 GLU QG 1 15 LYS H 3.480 . 3.830 2.641 2.085 2.835 . 0 0 "[ . 1 . 2]" 1
389 1 14 GLU QG 1 18 ALA MB 3.740 . 4.110 3.550 3.200 3.994 . 0 0 "[ . 1 . 2]" 1
390 1 14 GLU HG2 1 15 LYS H 2.440 . 2.680 2.702 2.114 2.935 0.255 15 0 "[ . 1 . 2]" 1
391 1 14 GLU HG2 1 15 LYS HA 3.080 . 3.390 3.320 3.060 3.693 0.303 9 0 "[ . 1 . 2]" 1
392 1 14 GLU HG2 1 18 ALA H 5.400 . 5.940 5.308 5.055 5.863 . 0 0 "[ . 1 . 2]" 1
393 1 14 GLU HG3 1 15 LYS H 3.440 . 3.780 3.731 3.174 3.894 0.114 3 0 "[ . 1 . 2]" 1
394 1 14 GLU HG3 1 15 LYS HA 3.460 . 3.810 3.904 3.244 4.078 0.268 18 0 "[ . 1 . 2]" 1
395 1 14 GLU HG3 1 18 ALA H 4.650 . 5.120 4.758 4.293 5.186 0.066 17 0 "[ . 1 . 2]" 1
396 1 14 GLU HG3 1 18 ALA MB 4.380 . 4.820 3.787 3.353 4.171 . 0 0 "[ . 1 . 2]" 1
397 1 15 LYS H 1 15 LYS HA 2.760 . 3.040 2.771 2.732 2.813 . 0 0 "[ . 1 . 2]" 1
398 1 15 LYS H 1 15 LYS QB 2.530 . 2.780 2.258 2.238 2.290 . 0 0 "[ . 1 . 2]" 1
399 1 15 LYS H 1 15 LYS QE 4.790 . 5.270 4.445 4.175 4.683 . 0 0 "[ . 1 . 2]" 1
400 1 15 LYS H 1 15 LYS QG 4.470 . 4.920 4.011 3.979 4.043 . 0 0 "[ . 1 . 2]" 1
401 1 15 LYS H 1 16 LEU H 2.710 . 2.980 2.753 2.579 2.910 . 0 0 "[ . 1 . 2]" 1
402 1 15 LYS H 1 16 LEU QB 5.520 . 6.070 4.739 4.569 4.856 . 0 0 "[ . 1 . 2]" 1
403 1 15 LYS HA 1 15 LYS QG 2.930 . 3.220 2.527 2.446 2.638 . 0 0 "[ . 1 . 2]" 1
404 1 15 LYS HA 1 18 ALA H 3.440 . 3.780 3.438 3.278 3.613 . 0 0 "[ . 1 . 2]" 1
405 1 15 LYS HA 1 18 ALA MB 3.200 . 3.520 2.636 2.411 2.933 . 0 0 "[ . 1 . 2]" 1
406 1 15 LYS HA 1 19 GLN H 4.150 . 4.570 4.122 4.003 4.234 . 0 0 "[ . 1 . 2]" 1
407 1 15 LYS QB 1 15 LYS QD 3.200 . 3.520 2.408 2.364 2.448 . 0 0 "[ . 1 . 2]" 1
408 1 15 LYS QB 1 15 LYS QE 3.230 . 3.550 2.092 1.949 2.252 . 0 0 "[ . 1 . 2]" 1
409 1 15 LYS QB 1 16 LEU H 3.120 . 3.430 2.534 2.359 2.629 . 0 0 "[ . 1 . 2]" 1
410 1 15 LYS QB 1 16 LEU HG 4.670 . 5.140 3.307 3.210 3.438 . 0 0 "[ . 1 . 2]" 1
411 1 15 LYS QD 1 16 LEU H 4.820 . 5.300 4.733 4.479 4.876 . 0 0 "[ . 1 . 2]" 1
412 1 15 LYS QD 1 19 GLN QB 5.410 . 5.950 4.652 4.387 5.046 . 0 0 "[ . 1 . 2]" 1
413 1 15 LYS QD 1 19 GLN HG2 4.000 . 4.400 4.109 3.803 4.473 0.073 2 0 "[ . 1 . 2]" 1
414 1 15 LYS QD 1 19 GLN QG 4.860 . 5.350 3.991 3.717 4.325 . 0 0 "[ . 1 . 2]" 1
415 1 15 LYS QD 1 19 GLN HG3 5.400 . 5.940 5.421 5.236 5.740 . 0 0 "[ . 1 . 2]" 1
416 1 15 LYS QE 1 15 LYS QG 3.220 . 3.540 2.348 2.285 2.410 . 0 0 "[ . 1 . 2]" 1
417 1 15 LYS QE 1 16 LEU HA 3.080 . 3.390 3.080 2.937 3.401 0.011 2 0 "[ . 1 . 2]" 1
418 1 15 LYS QE 1 16 LEU QB 4.770 . 5.250 4.053 3.796 4.261 . 0 0 "[ . 1 . 2]" 1
419 1 15 LYS QE 1 16 LEU QD 4.730 . 5.200 2.242 2.128 2.417 . 0 0 "[ . 1 . 2]" 1
420 1 15 LYS QE 1 16 LEU HG 2.720 . 2.990 2.592 2.110 2.903 . 0 0 "[ . 1 . 2]" 1
421 1 15 LYS QE 1 19 GLN HE21 4.730 . 5.200 5.271 5.142 5.391 0.191 12 0 "[ . 1 . 2]" 1
422 1 15 LYS QE 1 19 GLN QE 4.650 . 5.120 4.580 4.404 4.679 . 0 0 "[ . 1 . 2]" 1
423 1 15 LYS QE 1 19 GLN HE22 4.570 . 5.030 5.034 4.695 5.183 0.153 19 0 "[ . 1 . 2]" 1
424 1 15 LYS QG 1 16 LEU HG 5.320 . 5.850 4.735 4.328 5.000 . 0 0 "[ . 1 . 2]" 1
425 1 15 LYS QG 1 19 GLN H 3.860 . 4.250 3.881 3.629 4.116 . 0 0 "[ . 1 . 2]" 1
426 1 15 LYS QG 1 19 GLN HA 5.340 . 5.870 5.468 5.212 5.765 . 0 0 "[ . 1 . 2]" 1
427 1 16 LEU H 1 16 LEU QB 2.960 . 3.260 2.397 2.343 2.463 . 0 0 "[ . 1 . 2]" 1
428 1 16 LEU H 1 17 LYS H 2.700 . 2.970 2.579 2.472 2.710 . 0 0 "[ . 1 . 2]" 1
429 1 16 LEU H 1 17 LYS HE3 5.470 . 6.020 5.656 5.147 6.080 0.060 18 0 "[ . 1 . 2]" 1
430 1 16 LEU H 1 18 ALA H 4.280 . 4.710 3.940 3.819 4.151 . 0 0 "[ . 1 . 2]" 1
431 1 16 LEU H 1 19 GLN H 5.020 . 5.520 4.875 4.779 5.015 . 0 0 "[ . 1 . 2]" 1
432 1 16 LEU H 1 19 GLN QE 5.070 . 5.580 5.143 4.481 5.270 . 0 0 "[ . 1 . 2]" 1
433 1 16 LEU H 1 19 GLN HE22 5.370 . 5.910 5.438 4.612 5.580 . 0 0 "[ . 1 . 2]" 1
434 1 16 LEU HA 1 16 LEU QD 3.920 . 4.310 2.027 1.977 2.122 . 0 0 "[ . 1 . 2]" 1
435 1 16 LEU HA 1 16 LEU HG 2.690 . 2.960 3.038 2.957 3.095 0.135 9 0 "[ . 1 . 2]" 1
436 1 16 LEU HA 1 17 LYS H 3.540 . 3.890 3.510 3.479 3.564 . 0 0 "[ . 1 . 2]" 1
437 1 16 LEU HA 1 18 ALA H 4.090 . 4.500 4.105 4.006 4.255 . 0 0 "[ . 1 . 2]" 1
438 1 16 LEU HA 1 19 GLN H 3.600 . 3.960 3.595 3.464 3.834 . 0 0 "[ . 1 . 2]" 1
439 1 16 LEU HA 1 19 GLN QB 4.250 . 4.680 4.088 4.008 4.176 . 0 0 "[ . 1 . 2]" 1
440 1 16 LEU HA 1 19 GLN HG2 2.330 . 2.560 2.481 2.376 2.555 . 0 0 "[ . 1 . 2]" 1
441 1 16 LEU HA 1 19 GLN QG 2.280 . 2.510 2.013 1.964 2.114 . 0 0 "[ . 1 . 2]" 1
442 1 16 LEU HA 1 19 GLN HG3 2.530 . 2.780 2.129 2.066 2.255 . 0 0 "[ . 1 . 2]" 1
443 1 16 LEU HA 1 20 LEU H 4.270 . 4.700 3.811 3.698 3.889 . 0 0 "[ . 1 . 2]" 1
444 1 16 LEU QB 1 16 LEU MD1 3.090 . 3.400 2.146 2.132 2.160 . 0 0 "[ . 1 . 2]" 1
445 1 16 LEU QB 1 17 LYS H 2.970 . 3.270 2.798 2.645 2.927 . 0 0 "[ . 1 . 2]" 1
446 1 16 LEU QB 1 17 LYS QB 5.300 . 5.830 4.186 3.863 4.664 . 0 0 "[ . 1 . 2]" 1
447 1 16 LEU QB 1 18 ALA H 5.100 . 5.610 4.688 4.569 4.777 . 0 0 "[ . 1 . 2]" 1
448 1 16 LEU MD1 2 17 LYS H 3.500 . 3.850 3.326 3.008 3.572 . 0 0 "[ . 1 . 2]" 1
449 1 16 LEU MD2 1 19 GLN HG2 4.950 . 5.440 2.885 2.625 3.114 . 0 0 "[ . 1 . 2]" 1
450 1 16 LEU MD2 1 19 GLN HG3 4.970 . 5.470 3.450 3.320 3.596 . 0 0 "[ . 1 . 2]" 1
451 1 16 LEU HG 1 19 GLN HG2 4.300 . 4.730 4.744 4.627 4.820 0.090 19 0 "[ . 1 . 2]" 1
452 1 16 LEU HG 1 19 GLN QG 4.580 . 5.040 4.361 4.260 4.406 . 0 0 "[ . 1 . 2]" 1
453 1 16 LEU HG 1 19 GLN HG3 4.860 . 5.350 5.087 4.966 5.171 . 0 0 "[ . 1 . 2]" 1
454 1 16 LEU HG 2 20 LEU QD 4.750 . 5.220 4.395 4.300 4.517 . 0 0 "[ . 1 . 2]" 1
455 1 17 LYS H 1 17 LYS HA 2.820 . 3.100 2.849 2.822 2.883 . 0 0 "[ . 1 . 2]" 1
456 1 17 LYS H 1 17 LYS HB2 2.920 . 3.210 2.486 2.203 2.771 . 0 0 "[ . 1 . 2]" 1
457 1 17 LYS H 1 17 LYS QB 3.100 . 3.410 2.245 2.142 2.454 . 0 0 "[ . 1 . 2]" 1
458 1 17 LYS H 1 17 LYS HB3 3.590 . 3.950 2.841 2.241 3.687 . 0 0 "[ . 1 . 2]" 1
459 1 17 LYS H 1 17 LYS QD 4.430 . 4.870 4.249 2.409 4.697 . 0 0 "[ . 1 . 2]" 1
460 1 17 LYS H 1 17 LYS HE2 4.470 . 4.920 4.759 3.999 5.086 0.166 6 0 "[ . 1 . 2]" 1
461 1 17 LYS H 1 17 LYS HE3 3.750 . 4.130 3.790 3.280 4.186 0.056 18 0 "[ . 1 . 2]" 1
462 1 17 LYS H 1 17 LYS QG 4.070 . 4.480 3.685 2.336 4.098 . 0 0 "[ . 1 . 2]" 1
463 1 17 LYS H 1 18 ALA H 2.400 . 2.640 2.534 2.454 2.615 . 0 0 "[ . 1 . 2]" 1
464 1 17 LYS H 1 19 GLN QE 5.370 . 5.910 4.787 4.414 4.923 . 0 0 "[ . 1 . 2]" 1
465 1 17 LYS H 1 19 GLN HE22 4.770 . 5.250 4.965 4.521 5.119 . 0 0 "[ . 1 . 2]" 1
466 1 17 LYS H 1 19 GLN HG2 4.860 . 5.350 5.410 5.323 5.474 0.124 14 0 "[ . 1 . 2]" 1
467 1 17 LYS H 1 19 GLN QG 4.590 . 5.050 4.198 4.128 4.276 . 0 0 "[ . 1 . 2]" 1
468 1 17 LYS H 1 19 GLN HG3 4.310 . 4.740 4.374 4.301 4.463 . 0 0 "[ . 1 . 2]" 1
469 1 17 LYS H 1 20 LEU QD 5.500 . 6.050 3.866 3.750 3.971 . 0 0 "[ . 1 . 2]" 1
470 1 17 LYS H 2 16 LEU MD1 3.500 . 3.850 3.232 2.997 3.455 . 0 0 "[ . 1 . 2]" 1
471 1 17 LYS HA 1 17 LYS QD 4.050 . 4.460 3.418 2.094 4.103 . 0 0 "[ . 1 . 2]" 1
472 1 17 LYS HA 1 18 ALA H 3.530 . 3.880 3.510 3.473 3.528 . 0 0 "[ . 1 . 2]" 1
473 1 17 LYS HA 1 18 ALA HA 4.720 . 5.190 4.817 4.782 4.841 . 0 0 "[ . 1 . 2]" 1
474 1 17 LYS HA 1 20 LEU QB 4.750 . 5.220 3.563 3.256 3.808 . 0 0 "[ . 1 . 2]" 1
475 1 17 LYS QB 1 17 LYS QE 4.010 . 4.410 1.965 1.827 2.110 . 0 0 "[ . 1 . 2]" 1
476 1 17 LYS QB 1 18 ALA H 3.330 . 3.660 2.840 2.706 2.977 . 0 0 "[ . 1 . 2]" 1
477 1 17 LYS QB 1 18 ALA HA 4.430 . 4.870 4.165 3.885 4.542 . 0 0 "[ . 1 . 2]" 1
478 1 17 LYS QB 1 20 LEU QD 5.300 . 5.830 3.401 3.145 3.705 . 0 0 "[ . 1 . 2]" 1
479 1 17 LYS HB2 1 17 LYS QG 2.440 . 2.680 2.283 2.161 2.521 . 0 0 "[ . 1 . 2]" 1
480 1 17 LYS QD 1 20 LEU QD 4.360 . 4.800 3.622 1.865 4.427 . 0 0 "[ . 1 . 2]" 1
481 1 17 LYS QE 1 18 ALA H 5.450 . 6.000 4.036 3.063 5.165 . 0 0 "[ . 1 . 2]" 1
482 1 17 LYS HE3 1 18 ALA H 4.790 . 5.270 4.166 3.098 5.342 0.072 9 0 "[ . 1 . 2]" 1
483 1 17 LYS QG 1 18 ALA H 4.520 . 4.970 4.353 4.171 4.725 . 0 0 "[ . 1 . 2]" 1
484 1 18 ALA H 1 18 ALA HA 2.870 . 3.160 2.874 2.859 2.893 . 0 0 "[ . 1 . 2]" 1
485 1 18 ALA H 1 18 ALA MB 2.920 . 3.210 2.252 2.227 2.273 . 0 0 "[ . 1 . 2]" 1
486 1 18 ALA H 1 19 GLN H 2.570 . 2.830 2.630 2.540 2.721 . 0 0 "[ . 1 . 2]" 1
487 1 18 ALA H 1 19 GLN HG2 4.320 . 4.750 4.845 4.802 4.880 0.130 17 0 "[ . 1 . 2]" 1
488 1 18 ALA H 1 19 GLN QG 4.020 . 4.420 3.578 3.535 3.645 . 0 0 "[ . 1 . 2]" 1
489 1 18 ALA H 1 19 GLN HG3 3.710 . 4.080 3.686 3.636 3.763 . 0 0 "[ . 1 . 2]" 1
490 1 18 ALA H 1 20 LEU H 4.490 . 4.940 3.918 3.848 4.041 . 0 0 "[ . 1 . 2]" 1
491 1 18 ALA HA 1 21 HIS H 3.560 . 3.920 3.717 3.592 3.869 . 0 0 "[ . 1 . 2]" 1
492 1 18 ALA HA 1 21 HIS HB2 3.370 . 3.710 3.612 3.330 3.781 0.071 9 0 "[ . 1 . 2]" 1
493 1 18 ALA HA 1 21 HIS HB3 2.850 . 3.130 2.946 2.666 3.162 0.032 19 0 "[ . 1 . 2]" 1
494 1 18 ALA HA 1 22 ASP H 4.500 . 4.950 4.435 4.229 4.606 . 0 0 "[ . 1 . 2]" 1
495 1 18 ALA MB 1 19 GLN H 3.150 . 3.470 2.331 2.217 2.514 . 0 0 "[ . 1 . 2]" 1
496 1 18 ALA MB 1 19 GLN QG 5.200 . 5.720 3.659 3.536 3.737 . 0 0 "[ . 1 . 2]" 1
497 1 18 ALA MB 1 20 LEU H 5.200 . 5.720 4.441 4.387 4.512 . 0 0 "[ . 1 . 2]" 1
498 1 18 ALA MB 1 21 HIS QB 5.500 . 6.050 4.072 3.913 4.266 . 0 0 "[ . 1 . 2]" 1
499 1 18 ALA MB 1 21 HIS HB3 5.000 . 5.500 4.290 4.065 4.537 . 0 0 "[ . 1 . 2]" 1
500 1 19 GLN H 1 19 GLN HA 2.770 . 3.050 2.827 2.796 2.876 . 0 0 "[ . 1 . 2]" 1
501 1 19 GLN H 1 19 GLN QB 3.160 . 3.480 2.626 2.541 2.686 . 0 0 "[ . 1 . 2]" 1
502 1 19 GLN H 1 19 GLN HE21 5.570 . 6.130 5.224 5.082 5.342 . 0 0 "[ . 1 . 2]" 1
503 1 19 GLN H 1 19 GLN QE 4.900 . 5.390 3.657 3.496 3.891 . 0 0 "[ . 1 . 2]" 1
504 1 19 GLN H 1 19 GLN HE22 4.230 . 4.650 3.735 3.561 3.998 . 0 0 "[ . 1 . 2]" 1
505 1 19 GLN H 1 19 GLN HG2 2.530 . 2.780 2.976 2.905 3.044 0.264 11 0 "[ . 1 . 2]" 1
506 1 19 GLN H 1 19 GLN QG 2.340 . 2.570 1.912 1.840 1.976 . 0 0 "[ . 1 . 2]" 1
507 1 19 GLN H 1 19 GLN HG3 2.140 . 2.350 1.935 1.857 2.003 . 0 0 "[ . 1 . 2]" 1
508 1 19 GLN H 1 20 LEU H 3.060 . 3.370 2.704 2.548 2.803 . 0 0 "[ . 1 . 2]" 1
509 1 19 GLN H 1 20 LEU HG 4.860 . 5.350 5.108 4.832 5.320 . 0 0 "[ . 1 . 2]" 1
510 1 19 GLN H 1 21 HIS H 4.350 . 4.790 4.177 4.023 4.317 . 0 0 "[ . 1 . 2]" 1
511 1 19 GLN HA 1 19 GLN QB 2.460 . 2.710 2.178 2.171 2.185 . 0 0 "[ . 1 . 2]" 1
512 1 19 GLN HA 1 19 GLN QG 3.780 . 4.160 3.406 3.388 3.425 . 0 0 "[ . 1 . 2]" 1
513 1 19 GLN HA 1 20 LEU H 3.560 . 3.920 3.577 3.553 3.597 . 0 0 "[ . 1 . 2]" 1
514 1 19 GLN QB 1 19 GLN HG2 2.550 . 2.800 2.158 2.151 2.165 . 0 0 "[ . 1 . 2]" 1
515 1 19 GLN QB 1 20 LEU H 3.620 . 3.980 3.543 3.484 3.590 . 0 0 "[ . 1 . 2]" 1
516 1 19 GLN QB 2 20 LEU QD 3.700 . 4.070 4.078 3.923 4.178 0.108 12 0 "[ . 1 . 2]" 1
517 1 19 GLN QE 1 20 LEU H 3.280 . 3.610 2.009 1.911 2.789 . 0 0 "[ . 1 . 2]" 1
518 1 19 GLN QE 1 20 LEU HA 4.280 . 4.710 2.988 2.795 3.698 . 0 0 "[ . 1 . 2]" 1
519 1 19 GLN HE21 1 20 LEU H 3.980 . 4.380 3.604 3.488 3.843 . 0 0 "[ . 1 . 2]" 1
520 1 19 GLN HE21 1 20 LEU HA 5.270 . 5.800 3.637 3.363 4.052 . 0 0 "[ . 1 . 2]" 1
521 1 19 GLN HE21 2 19 GLN HE22 3.300 . 3.630 3.812 3.744 3.858 0.228 5 0 "[ . 1 . 2]" 1
522 1 19 GLN HE21 2 19 GLN HG2 6.040 . 6.640 6.643 6.535 6.684 0.044 5 0 "[ . 1 . 2]" 1
523 1 19 GLN HE21 2 20 LEU QD 4.000 . 4.400 2.059 1.921 2.253 . 0 0 "[ . 1 . 2]" 1
524 1 19 GLN HE21 2 20 LEU HG 4.500 . 4.950 3.991 3.866 4.104 . 0 0 "[ . 1 . 2]" 1
525 1 19 GLN HE22 1 20 LEU H 2.590 . 2.850 2.022 1.919 2.864 0.014 2 0 "[ . 1 . 2]" 1
526 1 19 GLN HE22 1 20 LEU HA 5.060 . 5.570 3.187 2.988 4.270 . 0 0 "[ . 1 . 2]" 1
527 1 19 GLN HE22 2 19 GLN HE21 3.300 . 3.630 3.334 3.157 3.672 0.042 2 0 "[ . 1 . 2]" 1
528 1 19 GLN HE22 2 19 GLN HG2 6.290 . 6.920 6.951 6.816 7.024 0.104 1 0 "[ . 1 . 2]" 1
529 1 19 GLN HE22 2 19 GLN HG3 5.630 . 6.190 6.304 6.221 6.356 0.166 9 0 "[ . 1 . 2]" 1
530 1 19 GLN HE22 2 20 LEU QD 3.070 . 3.380 3.262 2.938 3.415 0.035 16 0 "[ . 1 . 2]" 1
531 1 19 GLN HE22 2 20 LEU HG 5.410 . 5.950 5.653 5.495 5.782 . 0 0 "[ . 1 . 2]" 1
532 1 19 GLN QG 1 20 LEU H 2.620 . 2.880 2.332 2.266 2.408 . 0 0 "[ . 1 . 2]" 1
533 1 19 GLN QG 1 20 LEU QB 4.930 . 5.420 3.805 3.674 3.923 . 0 0 "[ . 1 . 2]" 1
534 1 19 GLN QG 1 20 LEU HG 5.030 . 5.530 5.006 4.793 5.232 . 0 0 "[ . 1 . 2]" 1
535 1 19 GLN HG2 1 20 LEU H 3.470 . 3.820 3.994 3.930 4.064 0.244 20 0 "[ . 1 . 2]" 1
536 1 19 GLN HG2 1 20 LEU QB 5.500 . 6.050 5.270 5.093 5.421 . 0 0 "[ . 1 . 2]" 1
537 1 19 GLN HG2 2 19 GLN HE21 5.990 . 6.590 6.607 6.438 6.709 0.119 7 0 "[ . 1 . 2]" 1
538 1 19 GLN HG2 2 20 LEU QD 4.240 . 4.660 3.964 3.758 4.075 . 0 0 "[ . 1 . 2]" 1
539 1 19 GLN HG3 1 20 LEU H 2.200 . 2.420 2.348 2.280 2.426 0.006 20 0 "[ . 1 . 2]" 1
540 1 19 GLN HG3 1 20 LEU QB 4.110 . 4.520 3.903 3.768 4.026 . 0 0 "[ . 1 . 2]" 1
541 1 19 GLN HG3 2 19 GLN HE22 5.640 . 6.200 6.134 5.990 6.224 0.024 18 0 "[ . 1 . 2]" 1
542 1 19 GLN HG3 2 20 LEU QD 4.250 . 4.680 4.159 4.016 4.263 . 0 0 "[ . 1 . 2]" 1
543 1 20 LEU H 1 20 LEU HA 2.800 . 3.080 2.849 2.837 2.866 . 0 0 "[ . 1 . 2]" 1
544 1 20 LEU H 1 20 LEU QB 2.890 . 3.180 2.369 2.280 2.444 . 0 0 "[ . 1 . 2]" 1
545 1 20 LEU H 1 20 LEU QD 4.450 . 4.890 3.380 3.318 3.438 . 0 0 "[ . 1 . 2]" 1
546 1 20 LEU H 1 20 LEU HG 2.890 . 3.180 3.046 2.898 3.247 0.067 5 0 "[ . 1 . 2]" 1
547 1 20 LEU H 1 21 HIS H 2.880 . 3.170 2.626 2.559 2.724 . 0 0 "[ . 1 . 2]" 1
548 1 20 LEU H 1 22 ASP H 4.320 . 4.750 4.172 4.025 4.410 . 0 0 "[ . 1 . 2]" 1
549 1 20 LEU H 2 20 LEU HA 5.650 . 6.210 6.081 5.884 6.256 0.046 6 0 "[ . 1 . 2]" 1
550 1 20 LEU H 2 20 LEU QD 4.440 . 4.880 4.793 4.647 4.895 0.015 8 0 "[ . 1 . 2]" 1
551 1 20 LEU HA 1 20 LEU QB 2.450 . 2.700 2.161 2.155 2.167 . 0 0 "[ . 1 . 2]" 1
552 1 20 LEU HA 1 20 LEU HG 3.750 . 4.130 3.876 3.836 3.913 . 0 0 "[ . 1 . 2]" 1
553 1 20 LEU HA 2 20 LEU H 5.800 . 6.380 6.098 5.865 6.288 . 0 0 "[ . 1 . 2]" 1
554 1 20 LEU HA 2 20 LEU QB 3.310 . 3.640 3.515 3.207 3.716 0.076 12 0 "[ . 1 . 2]" 1
555 1 20 LEU QB 1 21 HIS H 3.750 . 4.130 3.437 3.362 3.520 . 0 0 "[ . 1 . 2]" 1
556 1 20 LEU QB 2 20 LEU HA 3.710 . 4.080 3.493 3.164 3.735 . 0 0 "[ . 1 . 2]" 1
557 1 20 LEU QD 1 21 HIS H 3.460 . 3.810 2.925 2.781 3.130 . 0 0 "[ . 1 . 2]" 1
558 1 20 LEU QD 2 16 LEU HG 4.740 . 5.210 4.477 4.370 4.616 . 0 0 "[ . 1 . 2]" 1
559 1 20 LEU QD 2 19 GLN QB 3.660 . 4.030 3.996 3.848 4.102 0.072 18 0 "[ . 1 . 2]" 1
560 1 20 LEU QD 2 19 GLN HE21 4.000 . 4.400 2.188 1.934 2.368 . 0 0 "[ . 1 . 2]" 1
561 1 20 LEU QD 2 19 GLN HE22 . . 3.090 2.884 2.787 2.994 . 0 0 "[ . 1 . 2]" 1
562 1 20 LEU QD 2 19 GLN HG2 3.760 . 4.140 3.434 3.270 3.580 . 0 0 "[ . 1 . 2]" 1
563 1 20 LEU QD 2 19 GLN HG3 4.060 . 4.470 4.002 3.910 4.077 . 0 0 "[ . 1 . 2]" 1
564 1 20 LEU QD 2 20 LEU H 4.320 . 4.750 4.788 4.641 4.848 0.098 8 0 "[ . 1 . 2]" 1
565 1 20 LEU QD 2 20 LEU HG 5.940 . 6.530 6.239 5.952 6.543 0.013 20 0 "[ . 1 . 2]" 1
566 1 20 LEU HG 1 21 HIS H 2.200 . 2.420 2.215 2.058 2.365 . 0 0 "[ . 1 . 2]" 1
567 1 20 LEU HG 1 21 HIS HA 4.660 . 5.130 3.709 3.467 4.007 . 0 0 "[ . 1 . 2]" 1
568 1 20 LEU HG 2 19 GLN HE21 4.500 . 4.950 3.952 3.817 4.019 . 0 0 "[ . 1 . 2]" 1
569 1 20 LEU HG 2 19 GLN HE22 5.370 . 5.910 5.357 5.268 5.468 . 0 0 "[ . 1 . 2]" 1
570 1 20 LEU HG 2 20 LEU QD 5.800 . 6.380 6.252 6.027 6.501 0.121 20 0 "[ . 1 . 2]" 1
571 1 21 HIS H 1 21 HIS HA 2.830 . 3.110 2.798 2.757 2.823 . 0 0 "[ . 1 . 2]" 1
572 1 21 HIS H 1 21 HIS HB2 2.480 . 2.730 2.549 2.443 2.795 0.065 12 0 "[ . 1 . 2]" 1
573 1 21 HIS H 1 21 HIS QB 2.540 . 2.790 2.263 2.199 2.307 . 0 0 "[ . 1 . 2]" 1
574 1 21 HIS H 1 21 HIS HB3 2.590 . 2.850 2.546 2.301 2.673 . 0 0 "[ . 1 . 2]" 1
575 1 21 HIS H 1 22 ASP H 2.830 . 3.110 2.753 2.624 2.935 . 0 0 "[ . 1 . 2]" 1
576 1 21 HIS H 1 24 ASN HD21 5.870 . 6.460 5.662 5.493 5.978 . 0 0 "[ . 1 . 2]" 1
577 1 21 HIS H 1 24 ASN QD 5.300 . 5.830 4.769 4.514 4.875 . 0 0 "[ . 1 . 2]" 1
578 1 21 HIS H 1 24 ASN HD22 4.990 . 5.490 5.146 4.695 5.308 . 0 0 "[ . 1 . 2]" 1
579 1 21 HIS HA 1 21 HIS HB2 2.490 . 2.740 2.470 2.351 2.543 . 0 0 "[ . 1 . 2]" 1
580 1 21 HIS HA 1 24 ASN H 3.670 . 4.040 3.611 3.391 3.822 . 0 0 "[ . 1 . 2]" 1
581 1 21 HIS HA 1 24 ASN HB2 2.580 . 2.840 2.690 2.524 2.892 0.052 18 0 "[ . 1 . 2]" 1
582 1 21 HIS HA 1 24 ASN QB 3.300 . 3.630 2.663 2.502 2.858 . 0 0 "[ . 1 . 2]" 1
583 1 21 HIS HA 1 24 ASN HB3 4.030 . 4.430 4.269 4.087 4.455 0.025 18 0 "[ . 1 . 2]" 1
584 1 21 HIS HA 1 24 ASN QD 3.950 . 4.350 4.068 3.574 4.366 0.016 18 0 "[ . 1 . 2]" 1
585 1 21 HIS QB 1 23 THR H 5.200 . 5.720 4.889 4.709 5.063 . 0 0 "[ . 1 . 2]" 1
586 1 21 HIS HB3 1 23 THR H 5.230 . 5.750 5.176 4.969 5.397 . 0 0 "[ . 1 . 2]" 1
587 1 22 ASP H 1 23 THR H 2.760 . 3.040 2.775 2.630 2.932 . 0 0 "[ . 1 . 2]" 1
588 1 22 ASP H 1 24 ASN H 4.090 . 4.500 4.061 3.947 4.208 . 0 0 "[ . 1 . 2]" 1
589 1 22 ASP HA 1 22 ASP QB 2.560 . 2.820 2.421 2.345 2.477 . 0 0 "[ . 1 . 2]" 1
590 1 22 ASP HA 1 23 THR H 3.550 . 3.900 3.584 3.549 3.614 . 0 0 "[ . 1 . 2]" 1
591 1 22 ASP QB 1 23 THR H 2.970 . 3.270 2.496 2.262 2.715 . 0 0 "[ . 1 . 2]" 1
592 1 23 THR H 1 23 THR HA 2.810 . 3.090 2.838 2.796 2.873 . 0 0 "[ . 1 . 2]" 1
593 1 23 THR H 1 23 THR MG 3.730 . 4.100 3.823 3.771 3.858 . 0 0 "[ . 1 . 2]" 1
594 1 23 THR H 1 24 ASN H 2.460 . 2.710 2.626 2.508 2.720 0.010 16 0 "[ . 1 . 2]" 1
595 1 23 THR H 1 24 ASN HD21 5.500 . 6.050 5.548 5.290 5.985 . 0 0 "[ . 1 . 2]" 1
596 1 23 THR H 1 24 ASN QD 4.850 . 5.330 3.972 3.737 4.224 . 0 0 "[ . 1 . 2]" 1
597 1 23 THR H 1 24 ASN HD22 4.050 . 4.460 4.069 3.820 4.318 . 0 0 "[ . 1 . 2]" 1
598 1 23 THR H 1 25 MET H 4.110 . 4.520 4.330 4.157 4.514 . 0 0 "[ . 1 . 2]" 1
599 1 23 THR H 2 27 LEU QD 5.760 . 6.340 5.242 4.892 5.814 . 0 0 "[ . 1 . 2]" 1
600 1 23 THR HA 1 24 ASN H 3.490 . 3.840 3.502 3.456 3.533 . 0 0 "[ . 1 . 2]" 1
601 1 23 THR HA 1 26 GLU H 3.690 . 4.060 3.657 3.450 3.788 . 0 0 "[ . 1 . 2]" 1
602 1 23 THR HA 1 26 GLU QB 4.810 . 5.290 3.937 3.699 4.145 . 0 0 "[ . 1 . 2]" 1
603 1 23 THR HA 1 26 GLU QG 2.420 . 2.660 1.919 1.780 2.049 0.020 2 0 "[ . 1 . 2]" 1
604 1 23 THR HA 2 23 THR MG . . 4.400 4.121 3.984 4.270 . 0 0 "[ . 1 . 2]" 1
605 1 23 THR HA 2 24 ASN HA 5.500 . 6.050 5.895 5.699 6.117 0.067 9 0 "[ . 1 . 2]" 1
606 1 23 THR HA 2 24 ASN HD21 5.300 . 5.830 5.376 5.007 5.678 . 0 0 "[ . 1 . 2]" 1
607 1 23 THR HA 2 24 ASN HD22 5.500 . 6.050 5.655 5.454 5.987 . 0 0 "[ . 1 . 2]" 1
608 1 23 THR HA 2 27 LEU QD 4.500 . 4.950 3.165 2.716 3.719 . 0 0 "[ . 1 . 2]" 1
609 1 23 THR MG 1 24 ASN H 3.690 . 4.060 3.939 3.746 4.069 0.009 6 0 "[ . 1 . 2]" 1
610 1 23 THR MG 1 24 ASN HA 3.750 . 4.130 3.985 3.783 4.115 . 0 0 "[ . 1 . 2]" 1
611 1 23 THR MG 1 24 ASN QB 5.020 . 5.520 5.164 4.899 5.273 . 0 0 "[ . 1 . 2]" 1
612 1 23 THR MG 1 24 ASN HD21 4.300 . 4.730 4.686 4.528 4.779 0.049 15 0 "[ . 1 . 2]" 1
613 1 23 THR MG 1 24 ASN QD 3.390 . 3.730 3.616 3.490 3.771 0.041 7 0 "[ . 1 . 2]" 1
614 1 23 THR MG 1 24 ASN HD22 3.480 . 3.830 3.764 3.629 3.988 0.158 7 0 "[ . 1 . 2]" 1
615 1 23 THR MG 1 25 MET H 5.150 . 5.670 5.489 5.295 5.631 . 0 0 "[ . 1 . 2]" 1
616 1 23 THR MG 1 27 LEU HB2 5.500 . 6.050 3.307 3.132 3.480 . 0 0 "[ . 1 . 2]" 1
617 1 23 THR MG 1 27 LEU QB 5.350 . 5.890 3.227 3.038 3.385 . 0 0 "[ . 1 . 2]" 1
618 1 23 THR MG 1 27 LEU HB3 5.200 . 5.720 4.500 4.095 4.753 . 0 0 "[ . 1 . 2]" 1
619 1 23 THR MG 2 23 THR HA 4.000 . 4.400 4.188 4.025 4.349 . 0 0 "[ . 1 . 2]" 1
620 1 23 THR MG 2 24 ASN H 3.800 . 4.180 3.524 3.369 3.724 . 0 0 "[ . 1 . 2]" 1
621 1 23 THR MG 2 24 ASN HA 4.500 . 4.950 2.619 2.450 2.787 . 0 0 "[ . 1 . 2]" 1
622 1 23 THR MG 2 24 ASN HB2 3.920 . 4.310 4.258 3.869 4.393 0.083 19 0 "[ . 1 . 2]" 1
623 1 23 THR MG 2 24 ASN HB3 3.900 . 4.290 4.275 4.097 4.378 0.088 7 0 "[ . 1 . 2]" 1
624 1 23 THR MG 2 24 ASN HD22 2.300 . 2.530 1.949 1.748 2.341 0.052 1 0 "[ . 1 . 2]" 1
625 1 23 THR MG 2 26 GLU QB 5.190 . 5.710 4.708 4.287 5.141 . 0 0 "[ . 1 . 2]" 1
626 1 23 THR MG 2 26 GLU QG 4.960 . 5.460 5.542 5.319 5.706 0.246 18 0 "[ . 1 . 2]" 1
627 1 23 THR MG 2 27 LEU H 3.970 . 4.370 4.145 3.911 4.419 0.049 18 0 "[ . 1 . 2]" 1
628 1 23 THR MG 2 27 LEU HB3 3.300 . 3.630 3.378 3.220 3.524 . 0 0 "[ . 1 . 2]" 1
629 1 23 THR MG 2 27 LEU QD 3.070 . 3.380 1.953 1.756 3.051 0.044 17 0 "[ . 1 . 2]" 1
630 1 24 ASN H 1 24 ASN HA 2.850 . 3.130 2.883 2.867 2.905 . 0 0 "[ . 1 . 2]" 1
631 1 24 ASN H 1 24 ASN HB2 2.220 . 2.440 2.367 2.222 2.412 . 0 0 "[ . 1 . 2]" 1
632 1 24 ASN H 1 24 ASN QB 2.830 . 3.110 2.337 2.198 2.379 . 0 0 "[ . 1 . 2]" 1
633 1 24 ASN H 1 24 ASN HB3 3.520 . 3.870 3.607 3.498 3.641 . 0 0 "[ . 1 . 2]" 1
634 1 24 ASN H 1 24 ASN HD21 3.900 . 4.290 3.957 3.809 4.214 . 0 0 "[ . 1 . 2]" 1
635 1 24 ASN H 1 24 ASN QD 3.120 . 3.430 2.310 2.189 2.553 . 0 0 "[ . 1 . 2]" 1
636 1 24 ASN H 1 24 ASN HD22 2.280 . 2.510 2.326 2.202 2.575 0.065 7 0 "[ . 1 . 2]" 1
637 1 24 ASN H 1 25 MET H 2.750 . 3.030 2.529 2.446 2.671 . 0 0 "[ . 1 . 2]" 1
638 1 24 ASN H 1 26 GLU H 4.100 . 4.510 4.024 3.849 4.247 . 0 0 "[ . 1 . 2]" 1
639 1 24 ASN H 2 23 THR MG 3.800 . 4.180 3.413 3.256 3.539 . 0 0 "[ . 1 . 2]" 1
640 1 24 ASN HA 1 24 ASN QD 3.700 . 4.070 2.660 2.498 3.111 . 0 0 "[ . 1 . 2]" 1
641 1 24 ASN HA 1 25 MET H 3.530 . 3.880 3.579 3.554 3.604 . 0 0 "[ . 1 . 2]" 1
642 1 24 ASN HA 1 27 LEU H 3.500 . 3.850 3.580 3.337 3.912 0.062 9 0 "[ . 1 . 2]" 1
643 1 24 ASN HA 1 27 LEU HB2 4.290 . 4.720 3.265 2.885 3.695 . 0 0 "[ . 1 . 2]" 1
644 1 24 ASN HA 1 27 LEU QB 3.180 . 3.500 2.533 2.284 2.758 . 0 0 "[ . 1 . 2]" 1
645 1 24 ASN HA 1 27 LEU HB3 2.680 . 2.950 2.646 2.362 2.879 . 0 0 "[ . 1 . 2]" 1
646 1 24 ASN HA 1 28 THR H 4.490 . 4.940 4.206 3.973 4.401 . 0 0 "[ . 1 . 2]" 1
647 1 24 ASN HA 2 23 THR HA 5.500 . 6.050 5.644 5.355 5.868 . 0 0 "[ . 1 . 2]" 1
648 1 24 ASN HA 2 23 THR MG 4.500 . 4.950 2.562 2.320 2.745 . 0 0 "[ . 1 . 2]" 1
649 1 24 ASN QB 1 25 MET H 3.210 . 3.530 2.593 2.429 2.781 . 0 0 "[ . 1 . 2]" 1
650 1 24 ASN QB 1 25 MET QG 4.500 . 4.950 3.524 2.968 4.468 . 0 0 "[ . 1 . 2]" 1
651 1 24 ASN QB 1 27 LEU QD 5.300 . 5.830 4.323 3.963 4.640 . 0 0 "[ . 1 . 2]" 1
652 1 24 ASN HB2 2 23 THR MG 3.820 . 4.200 4.168 3.954 4.281 0.081 4 0 "[ . 1 . 2]" 1
653 1 24 ASN HB3 2 23 THR MG 3.770 . 4.150 4.199 4.010 4.293 0.143 2 0 "[ . 1 . 2]" 1
654 1 24 ASN QD 1 25 MET H 5.230 . 5.750 4.353 4.224 4.548 . 0 0 "[ . 1 . 2]" 1
655 1 24 ASN HD21 2 23 THR HA 5.000 . 5.500 5.269 4.937 5.516 0.016 4 0 "[ . 1 . 2]" 1
656 1 24 ASN HD22 2 23 THR HA 5.370 . 5.910 5.569 5.366 5.910 . 0 0 "[ . 1 . 2]" 1
657 1 24 ASN HD22 2 23 THR MG 2.300 . 2.530 1.866 1.736 2.207 0.064 3 0 "[ . 1 . 2]" 1
658 1 25 MET H 1 25 MET HA 2.830 . 3.110 2.820 2.741 2.856 . 0 0 "[ . 1 . 2]" 1
659 1 25 MET H 1 25 MET QB 3.010 . 3.310 2.483 2.354 2.653 . 0 0 "[ . 1 . 2]" 1
660 1 25 MET H 1 25 MET HG2 2.340 . 2.570 2.413 2.166 2.940 0.370 17 0 "[ . 1 . 2]" 1
661 1 25 MET H 1 25 MET QG 2.680 . 2.950 2.266 2.106 2.554 . 0 0 "[ . 1 . 2]" 1
662 1 25 MET H 1 25 MET HG3 3.010 . 3.310 3.288 2.167 3.565 0.255 5 0 "[ . 1 . 2]" 1
663 1 25 MET H 1 26 GLU H 2.670 . 2.940 2.732 2.541 2.949 0.009 17 0 "[ . 1 . 2]" 1
664 1 25 MET H 1 26 GLU QG 4.400 . 4.840 4.220 3.979 4.554 . 0 0 "[ . 1 . 2]" 1
665 1 25 MET H 1 27 LEU H 4.330 . 4.760 4.022 3.858 4.358 . 0 0 "[ . 1 . 2]" 1
666 1 25 MET HA 1 25 MET QG 3.340 . 3.670 2.882 2.465 3.411 . 0 0 "[ . 1 . 2]" 1
667 1 25 MET HA 1 28 THR H 4.090 . 4.500 3.547 3.231 3.812 . 0 0 "[ . 1 . 2]" 1
668 1 25 MET HA 1 29 ASP H 5.040 . 5.540 4.245 3.954 4.438 . 0 0 "[ . 1 . 2]" 1
669 1 26 GLU H 1 26 GLU HA 2.800 . 3.080 2.870 2.815 2.914 . 0 0 "[ . 1 . 2]" 1
670 1 26 GLU H 1 26 GLU QB 3.240 . 3.560 2.542 2.454 2.637 . 0 0 "[ . 1 . 2]" 1
671 1 26 GLU H 1 26 GLU QG 2.600 . 2.860 2.278 2.055 2.568 . 0 0 "[ . 1 . 2]" 1
672 1 26 GLU H 1 27 LEU H 2.550 . 2.800 2.552 2.378 2.735 . 0 0 "[ . 1 . 2]" 1
673 1 26 GLU H 1 28 THR H 4.300 . 4.730 4.135 3.896 4.340 . 0 0 "[ . 1 . 2]" 1
674 1 26 GLU H 2 27 LEU QD 4.620 . 5.080 4.561 4.283 4.885 . 0 0 "[ . 1 . 2]" 1
675 1 26 GLU HA 1 26 GLU QB 2.460 . 2.710 2.184 2.170 2.192 . 0 0 "[ . 1 . 2]" 1
676 1 26 GLU HA 1 27 LEU H 3.540 . 3.890 3.542 3.498 3.588 . 0 0 "[ . 1 . 2]" 1
677 1 26 GLU HA 1 29 ASP HA 5.600 . 6.160 5.006 4.645 5.573 . 0 0 "[ . 1 . 2]" 1
678 1 26 GLU HA 1 29 ASP QB 3.010 . 3.310 2.199 1.795 2.734 0.005 4 0 "[ . 1 . 2]" 1
679 1 26 GLU QB 1 27 LEU H 3.740 . 4.110 3.657 3.506 3.766 . 0 0 "[ . 1 . 2]" 1
680 1 26 GLU QB 1 29 ASP QB 5.350 . 5.890 3.610 3.328 4.083 . 0 0 "[ . 1 . 2]" 1
681 1 26 GLU QB 2 23 THR MG 5.860 . 6.450 6.309 6.187 6.451 0.001 7 0 "[ . 1 . 2]" 1
682 1 26 GLU QG 1 27 LEU H 2.850 . 3.130 2.484 1.972 2.653 . 0 0 "[ . 1 . 2]" 1
683 1 26 GLU QG 1 27 LEU QB 4.740 . 5.210 3.470 3.020 3.641 . 0 0 "[ . 1 . 2]" 1
684 1 26 GLU QG 1 28 THR H 5.450 . 6.000 4.741 4.488 4.919 . 0 0 "[ . 1 . 2]" 1
685 1 26 GLU QG 2 23 THR MG 4.550 . 5.010 4.561 4.439 4.703 . 0 0 "[ . 1 . 2]" 1
686 1 26 GLU QG 2 27 LEU QD 2.500 . 2.750 2.008 1.844 2.538 . 0 0 "[ . 1 . 2]" 1
687 1 27 LEU H 1 27 LEU HA 2.790 . 3.070 2.825 2.789 2.860 . 0 0 "[ . 1 . 2]" 1
688 1 27 LEU H 1 27 LEU HB2 2.900 . 3.190 2.452 2.236 2.693 . 0 0 "[ . 1 . 2]" 1
689 1 27 LEU H 1 27 LEU QB 2.540 . 2.790 2.196 2.106 2.253 . 0 0 "[ . 1 . 2]" 1
690 1 27 LEU H 1 27 LEU HB3 2.170 . 2.390 2.495 2.390 2.595 0.205 5 0 "[ . 1 . 2]" 1
691 1 27 LEU H 1 28 THR H 2.980 . 3.280 2.691 2.553 2.837 . 0 0 "[ . 1 . 2]" 1
692 1 27 LEU H 2 23 THR MG 3.980 . 4.380 4.422 4.272 4.527 0.147 10 0 "[ . 1 . 2]" 1
693 1 27 LEU H 2 27 LEU HB2 4.500 . 4.950 5.035 4.949 5.152 0.202 20 0 "[ . 1 . 2]" 1
694 1 27 LEU H 2 27 LEU QD 3.830 . 4.210 3.364 2.988 3.684 . 0 0 "[ . 1 . 2]" 1
695 1 27 LEU HA 1 27 LEU QB 2.640 . 2.900 2.376 2.332 2.414 . 0 0 "[ . 1 . 2]" 1
696 1 27 LEU HA 1 27 LEU HG 3.580 . 3.940 2.831 2.588 3.348 . 0 0 "[ . 1 . 2]" 1
697 1 27 LEU HA 1 28 THR H 3.510 . 3.860 3.571 3.536 3.591 . 0 0 "[ . 1 . 2]" 1
698 1 27 LEU HA 1 29 ASP H 4.750 . 5.220 4.570 4.333 4.806 . 0 0 "[ . 1 . 2]" 1
699 1 27 LEU QB 1 28 THR H 3.420 . 3.760 2.474 2.293 2.617 . 0 0 "[ . 1 . 2]" 1
700 1 27 LEU HB2 1 27 LEU HG 2.660 . 2.930 2.721 2.545 3.037 0.107 1 0 "[ . 1 . 2]" 1
701 1 27 LEU HB2 2 27 LEU H 4.500 . 4.950 4.771 4.395 5.003 0.053 11 0 "[ . 1 . 2]" 1
702 1 27 LEU HB3 1 27 LEU HG 2.970 . 3.270 2.887 2.471 3.061 . 0 0 "[ . 1 . 2]" 1
703 1 27 LEU HB3 2 23 THR MG 3.300 . 3.630 3.533 3.251 3.697 0.067 7 0 "[ . 1 . 2]" 1
704 1 27 LEU QD 1 28 THR H 4.340 . 4.770 3.436 3.034 3.944 . 0 0 "[ . 1 . 2]" 1
705 1 27 LEU QD 1 28 THR HA 4.600 . 5.060 3.345 2.734 4.333 . 0 0 "[ . 1 . 2]" 1
706 1 27 LEU QD 1 31 LYS QB 5.500 . 6.050 3.026 2.556 3.994 . 0 0 "[ . 1 . 2]" 1
707 1 27 LEU QD 2 23 THR H 5.240 . 5.760 4.971 4.722 5.328 . 0 0 "[ . 1 . 2]" 1
708 1 27 LEU QD 2 23 THR HA 4.500 . 4.950 2.793 2.523 3.158 . 0 0 "[ . 1 . 2]" 1
709 1 27 LEU QD 2 23 THR MG 2.800 . 3.080 1.938 1.749 2.071 0.051 4 0 "[ . 1 . 2]" 1
710 1 27 LEU QD 2 26 GLU H 3.710 . 4.080 3.932 3.745 4.125 0.045 8 0 "[ . 1 . 2]" 1
711 1 27 LEU QD 2 26 GLU QG 2.500 . 2.750 2.896 2.439 3.208 0.458 4 0 "[ . 1 . 2]" 1
712 1 27 LEU QD 2 27 LEU H 2.930 . 3.220 3.067 2.632 3.328 0.108 6 0 "[ . 1 . 2]" 1
713 1 28 THR H 1 28 THR HA 2.830 . 3.110 2.825 2.791 2.866 . 0 0 "[ . 1 . 2]" 1
714 1 28 THR H 1 28 THR HB 2.350 . 2.580 2.571 2.477 2.641 0.061 16 0 "[ . 1 . 2]" 1
715 1 28 THR H 1 28 THR MG 4.350 . 4.790 3.790 3.750 3.815 . 0 0 "[ . 1 . 2]" 1
716 1 28 THR H 1 29 ASP H 2.740 . 3.010 2.654 2.486 2.807 . 0 0 "[ . 1 . 2]" 1
717 1 28 THR H 1 29 ASP QB 5.030 . 5.530 4.413 4.146 4.636 . 0 0 "[ . 1 . 2]" 1
718 1 28 THR H 1 30 LEU H 4.420 . 4.860 4.127 3.804 4.486 . 0 0 "[ . 1 . 2]" 1
719 1 28 THR H 1 31 LYS QG 5.310 . 5.840 4.721 4.069 5.736 . 0 0 "[ . 1 . 2]" 1
720 1 28 THR HA 1 28 THR HB 2.940 . 3.230 3.054 3.050 3.060 . 0 0 "[ . 1 . 2]" 1
721 1 28 THR HA 1 29 ASP H 3.480 . 3.830 3.545 3.492 3.579 . 0 0 "[ . 1 . 2]" 1
722 1 28 THR HA 1 29 ASP HA 4.840 . 5.320 4.895 4.818 4.927 . 0 0 "[ . 1 . 2]" 1
723 1 28 THR HA 1 30 LEU H 4.540 . 4.990 4.584 4.231 4.923 . 0 0 "[ . 1 . 2]" 1
724 1 28 THR HA 1 31 LYS H 3.970 . 4.370 3.725 3.359 3.939 . 0 0 "[ . 1 . 2]" 1
725 1 28 THR HA 1 31 LYS QB 4.120 . 4.530 3.597 1.994 4.460 . 0 0 "[ . 1 . 2]" 1
726 1 28 THR HA 1 31 LYS QG 3.020 . 3.320 2.544 2.091 3.305 . 0 0 "[ . 1 . 2]" 1
727 1 28 THR HA 1 32 LEU H 5.030 . 5.530 4.188 3.950 4.382 . 0 0 "[ . 1 . 2]" 1
728 1 28 THR HB 1 29 ASP H 3.090 . 3.400 2.614 2.429 2.857 . 0 0 "[ . 1 . 2]" 1
729 1 28 THR MG 1 29 ASP H 3.800 . 4.180 3.590 3.375 3.827 . 0 0 "[ . 1 . 2]" 1
730 1 28 THR MG 1 29 ASP QB 5.200 . 5.720 4.749 4.249 5.097 . 0 0 "[ . 1 . 2]" 1
731 1 28 THR MG 1 31 LYS QG 4.570 . 5.030 3.573 3.167 3.940 . 0 0 "[ . 1 . 2]" 1
732 1 28 THR MG 1 32 LEU H 4.900 . 5.390 4.463 4.182 4.612 . 0 0 "[ . 1 . 2]" 1
733 1 28 THR MG 1 32 LEU HA 5.760 . 6.340 5.381 5.108 5.624 . 0 0 "[ . 1 . 2]" 1
734 1 28 THR MG 1 32 LEU QB 4.400 . 4.840 3.484 3.200 3.635 . 0 0 "[ . 1 . 2]" 1
735 1 29 ASP H 1 29 ASP HA 2.790 . 3.070 2.819 2.789 2.854 . 0 0 "[ . 1 . 2]" 1
736 1 29 ASP H 1 29 ASP QB 2.640 . 2.900 2.299 2.147 2.456 . 0 0 "[ . 1 . 2]" 1
737 1 29 ASP H 1 30 LEU H 2.700 . 2.970 2.718 2.526 2.863 . 0 0 "[ . 1 . 2]" 1
738 1 29 ASP H 1 31 LYS QG 5.200 . 5.720 4.906 4.375 5.968 0.248 5 0 "[ . 1 . 2]" 1
739 1 29 ASP HA 1 29 ASP QB 2.610 . 2.870 2.411 2.293 2.497 . 0 0 "[ . 1 . 2]" 1
740 1 29 ASP HA 1 30 LEU H 3.560 . 3.920 3.565 3.514 3.597 . 0 0 "[ . 1 . 2]" 1
741 1 29 ASP HA 1 31 LYS H 4.570 . 5.030 4.621 4.393 4.972 . 0 0 "[ . 1 . 2]" 1
742 1 29 ASP HA 1 32 LEU H 3.570 . 3.930 3.773 3.326 3.944 0.014 19 0 "[ . 1 . 2]" 1
743 1 29 ASP HA 1 32 LEU QB 2.910 . 3.200 2.794 2.323 3.202 0.002 7 0 "[ . 1 . 2]" 1
744 1 29 ASP HA 1 33 GLN H 4.270 . 4.700 4.137 3.754 4.417 . 0 0 "[ . 1 . 2]" 1
745 1 29 ASP QB 1 30 LEU H 3.380 . 3.720 2.482 2.218 2.775 . 0 0 "[ . 1 . 2]" 1
746 1 29 ASP QB 1 32 LEU QB 5.500 . 6.050 4.486 4.103 4.895 . 0 0 "[ . 1 . 2]" 1
747 1 29 ASP QB 1 33 GLN QE 5.500 . 6.050 4.860 3.485 5.859 . 0 0 "[ . 1 . 2]" 1
748 1 30 LEU H 1 30 LEU HA 2.810 . 3.090 2.806 2.739 2.865 . 0 0 "[ . 1 . 2]" 1
749 1 30 LEU H 1 30 LEU QB 2.910 . 3.200 2.197 2.119 2.505 . 0 0 "[ . 1 . 2]" 1
750 1 30 LEU H 1 30 LEU QD 4.650 . 5.120 3.024 2.322 3.700 . 0 0 "[ . 1 . 2]" 1
751 1 30 LEU H 1 30 LEU HG 4.460 . 4.910 4.264 2.729 4.640 . 0 0 "[ . 1 . 2]" 1
752 1 30 LEU H 1 32 LEU H 4.210 . 4.630 4.153 3.766 4.469 . 0 0 "[ . 1 . 2]" 1
753 1 30 LEU H 1 33 GLN QE 5.180 . 5.700 4.555 3.481 5.376 . 0 0 "[ . 1 . 2]" 1
754 1 30 LEU H 2 30 LEU QD 4.500 . 4.950 4.309 3.472 5.053 0.103 15 0 "[ . 1 . 2]" 1
755 1 30 LEU H 2 30 LEU HG 6.360 . 7.000 5.793 4.527 7.036 0.036 5 0 "[ . 1 . 2]" 1
756 1 30 LEU H 2 34 LEU QD 5.950 . 6.540 5.552 4.300 6.415 . 0 0 "[ . 1 . 2]" 1
757 1 30 LEU HA 1 30 LEU QB 2.450 . 2.700 2.525 2.413 2.581 . 0 0 "[ . 1 . 2]" 1
758 1 30 LEU HA 1 30 LEU HB3 2.970 . 3.270 2.882 2.530 3.050 . 0 0 "[ . 1 . 2]" 1
759 1 30 LEU HA 1 30 LEU HG 3.700 . 4.070 3.237 2.384 3.772 . 0 0 "[ . 1 . 2]" 1
760 1 30 LEU HA 1 31 LYS H 3.520 . 3.870 3.550 3.495 3.607 . 0 0 "[ . 1 . 2]" 1
761 1 30 LEU HA 1 33 GLN H 4.370 . 4.810 4.030 3.632 4.363 . 0 0 "[ . 1 . 2]" 1
762 1 30 LEU QB 1 31 LYS H 3.820 . 4.200 2.708 2.350 3.044 . 0 0 "[ . 1 . 2]" 1
763 1 30 LEU HB2 1 30 LEU HG 2.980 . 3.280 2.730 2.333 3.051 . 0 0 "[ . 1 . 2]" 1
764 1 30 LEU HB2 2 30 LEU HG 4.610 . 5.070 4.432 2.744 5.195 0.125 3 0 "[ . 1 . 2]" 1
765 1 30 LEU HB2 2 34 LEU QD 5.040 . 5.540 4.775 3.451 5.597 0.057 3 0 "[ . 1 . 2]" 1
766 1 30 LEU HB3 2 30 LEU QD 4.140 . 4.550 2.581 1.672 3.339 0.128 9 0 "[ . 1 . 2]" 1
767 1 30 LEU HB3 2 30 LEU HG 3.800 . 4.180 3.354 2.302 4.467 0.287 5 0 "[ . 1 . 2]" 1
768 1 30 LEU QD 1 31 LYS H 4.440 . 4.880 4.111 3.841 4.320 . 0 0 "[ . 1 . 2]" 1
769 1 30 LEU QD 1 31 LYS QB 5.300 . 5.830 4.921 4.336 5.225 . 0 0 "[ . 1 . 2]" 1
770 1 30 LEU QD 2 30 LEU H 4.690 . 5.160 4.520 3.907 5.252 0.092 9 0 "[ . 1 . 2]" 1
771 1 30 LEU QD 2 30 LEU HB3 4.570 . 5.030 2.436 1.767 3.772 0.033 10 0 "[ . 1 . 2]" 1
772 1 30 LEU QD 2 31 LYS H 4.000 . 4.400 3.300 2.469 4.020 . 0 0 "[ . 1 . 2]" 1
773 1 30 LEU QD 2 41 GLN QE 5.900 . 6.490 4.503 1.843 5.739 . 0 0 "[ . 1 . 2]" 1
774 1 30 LEU HG 2 30 LEU H 6.090 . 6.700 6.125 5.149 6.899 0.199 9 0 "[ . 1 . 2]" 1
775 1 30 LEU HG 2 30 LEU HB2 5.670 . 6.240 4.233 3.074 5.432 . 0 0 "[ . 1 . 2]" 1
776 1 30 LEU HG 2 30 LEU HB3 4.930 . 5.420 3.728 2.673 5.233 . 0 0 "[ . 1 . 2]" 1
777 1 31 LYS H 1 31 LYS HA 2.840 . 3.120 2.846 2.728 2.929 . 0 0 "[ . 1 . 2]" 1
778 1 31 LYS H 1 31 LYS QB 2.800 . 3.080 2.417 1.995 2.783 . 0 0 "[ . 1 . 2]" 1
779 1 31 LYS H 1 31 LYS QD 4.900 . 5.390 4.060 3.524 4.587 . 0 0 "[ . 1 . 2]" 1
780 1 31 LYS H 1 31 LYS QG 3.420 . 3.760 2.744 2.067 3.922 0.162 5 0 "[ . 1 . 2]" 1
781 1 31 LYS H 1 32 LEU H 2.630 . 2.890 2.569 2.332 2.952 0.062 5 0 "[ . 1 . 2]" 1
782 1 31 LYS H 1 33 GLN H 4.790 . 5.270 4.526 4.173 5.020 . 0 0 "[ . 1 . 2]" 1
783 1 31 LYS H 1 33 GLN QE 5.380 . 5.920 4.995 4.548 5.732 . 0 0 "[ . 1 . 2]" 1
784 1 31 LYS H 2 30 LEU QD 4.000 . 4.400 2.910 2.192 3.552 . 0 0 "[ . 1 . 2]" 1
785 1 31 LYS HA 1 31 LYS QB 2.500 . 2.750 2.204 2.172 2.326 . 0 0 "[ . 1 . 2]" 1
786 1 31 LYS HA 1 31 LYS QD 3.780 . 4.160 3.534 2.390 4.021 . 0 0 "[ . 1 . 2]" 1
787 1 31 LYS HA 1 32 LEU H 3.450 . 3.790 3.515 3.470 3.565 . 0 0 "[ . 1 . 2]" 1
788 1 31 LYS HA 1 32 LEU HA 4.780 . 5.260 4.861 4.813 4.912 . 0 0 "[ . 1 . 2]" 1
789 1 31 LYS HA 1 34 LEU H 4.160 . 4.580 3.640 3.252 4.340 . 0 0 "[ . 1 . 2]" 1
790 1 31 LYS HA 1 34 LEU QB 3.330 . 3.660 2.342 1.987 2.946 . 0 0 "[ . 1 . 2]" 1
791 1 31 LYS HA 1 34 LEU HG 4.310 . 4.740 4.160 3.511 4.810 0.070 5 0 "[ . 1 . 2]" 1
792 1 31 LYS HA 1 35 GLU H 4.320 . 4.750 4.086 3.764 4.429 . 0 0 "[ . 1 . 2]" 1
793 1 31 LYS QB 1 31 LYS QD 3.220 . 3.540 2.480 2.258 2.802 . 0 0 "[ . 1 . 2]" 1
794 1 31 LYS QD 1 35 GLU QG 3.910 . 4.300 3.861 3.308 4.336 0.036 8 0 "[ . 1 . 2]" 1
795 1 31 LYS QG 1 32 LEU H 3.200 . 3.520 2.624 2.284 3.088 . 0 0 "[ . 1 . 2]" 1
796 1 32 LEU H 1 32 LEU HA 2.830 . 3.110 2.817 2.780 2.855 . 0 0 "[ . 1 . 2]" 1
797 1 32 LEU H 1 32 LEU QB 2.580 . 2.840 2.203 2.144 2.254 . 0 0 "[ . 1 . 2]" 1
798 1 32 LEU H 1 32 LEU HG 4.490 . 4.940 4.511 4.464 4.548 . 0 0 "[ . 1 . 2]" 1
799 1 32 LEU H 1 33 GLN H 2.920 . 3.210 2.833 2.632 3.004 . 0 0 "[ . 1 . 2]" 1
800 1 32 LEU H 1 33 GLN HE22 5.460 . 6.010 5.565 4.678 6.141 0.131 6 0 "[ . 1 . 2]" 1
801 1 32 LEU H 1 34 LEU H 3.970 . 4.370 3.887 3.707 4.079 . 0 0 "[ . 1 . 2]" 1
802 1 32 LEU HA 1 32 LEU QD 4.050 . 4.460 2.372 2.088 3.228 . 0 0 "[ . 1 . 2]" 1
803 1 32 LEU HA 1 33 GLN H 3.550 . 3.900 3.582 3.559 3.631 . 0 0 "[ . 1 . 2]" 1
804 1 32 LEU HA 1 34 LEU H 4.480 . 4.930 4.490 4.401 4.635 . 0 0 "[ . 1 . 2]" 1
805 1 32 LEU HA 1 35 GLU H 4.370 . 4.810 4.241 4.027 4.524 . 0 0 "[ . 1 . 2]" 1
806 1 32 LEU HA 1 35 GLU QG 2.920 . 3.210 2.903 2.554 3.370 0.160 17 0 "[ . 1 . 2]" 1
807 1 32 LEU HA 1 36 LYS H 5.220 . 5.740 4.612 4.424 4.726 . 0 0 "[ . 1 . 2]" 1
808 1 32 LEU HA 1 36 LYS QG 4.530 . 4.980 4.106 3.862 4.281 . 0 0 "[ . 1 . 2]" 1
809 1 32 LEU QB 1 33 GLN H 2.850 . 3.130 2.238 2.082 2.395 . 0 0 "[ . 1 . 2]" 1
810 1 32 LEU QB 1 33 GLN HA 4.810 . 5.290 4.208 4.067 4.364 . 0 0 "[ . 1 . 2]" 1
811 1 32 LEU QB 1 33 GLN QE 5.450 . 6.000 5.474 4.460 6.063 0.063 20 0 "[ . 1 . 2]" 1
812 1 32 LEU QD 1 33 GLN QE 5.800 . 6.380 5.940 4.789 6.497 0.117 13 0 "[ . 1 . 2]" 1
813 1 32 LEU HG 1 33 GLN HA 4.140 . 4.550 3.855 3.394 4.608 0.058 19 0 "[ . 1 . 2]" 1
814 1 33 GLN H 1 33 GLN HA 2.820 . 3.100 2.840 2.795 2.882 . 0 0 "[ . 1 . 2]" 1
815 1 33 GLN H 1 33 GLN QB 2.950 . 3.250 2.650 2.454 2.883 . 0 0 "[ . 1 . 2]" 1
816 1 33 GLN H 1 33 GLN QE 3.980 . 4.380 4.060 3.043 4.533 0.153 16 0 "[ . 1 . 2]" 1
817 1 33 GLN H 1 33 GLN QG 3.700 . 4.070 2.040 1.793 2.387 0.007 17 0 "[ . 1 . 2]" 1
818 1 33 GLN H 1 34 LEU H 2.710 . 2.980 2.628 2.562 2.787 . 0 0 "[ . 1 . 2]" 1
819 1 33 GLN H 1 35 GLU H 5.080 . 5.590 4.714 4.538 4.921 . 0 0 "[ . 1 . 2]" 1
820 1 33 GLN H 1 36 LYS H 5.280 . 5.810 4.880 4.777 5.018 . 0 0 "[ . 1 . 2]" 1
821 1 33 GLN H 2 34 LEU QD 4.980 . 5.480 5.031 4.336 5.582 0.102 19 0 "[ . 1 . 2]" 1
822 1 33 GLN HA 1 33 GLN QG 3.630 . 3.990 3.415 3.358 3.517 . 0 0 "[ . 1 . 2]" 1
823 1 33 GLN HA 1 36 LYS H 3.920 . 4.310 3.367 3.009 3.677 . 0 0 "[ . 1 . 2]" 1
824 1 33 GLN HA 1 36 LYS QB 3.440 . 3.780 2.232 1.887 2.511 . 0 0 "[ . 1 . 2]" 1
825 1 33 GLN HA 1 36 LYS QD 3.040 . 3.340 2.199 1.821 2.609 . 0 0 "[ . 1 . 2]" 1
826 1 33 GLN HA 1 36 LYS QG 4.400 . 4.840 3.162 2.776 3.740 . 0 0 "[ . 1 . 2]" 1
827 1 33 GLN QB 1 34 LEU H 3.590 . 3.950 3.567 3.382 3.754 . 0 0 "[ . 1 . 2]" 1
828 1 33 GLN QB 1 34 LEU QB 5.100 . 5.610 4.961 4.746 5.209 . 0 0 "[ . 1 . 2]" 1
829 1 33 GLN QB 1 36 LYS QD 5.620 . 6.180 3.434 2.983 4.107 . 0 0 "[ . 1 . 2]" 1
830 1 33 GLN QB 2 34 LEU HA 6.890 . 7.580 7.330 6.695 7.758 0.178 19 0 "[ . 1 . 2]" 1
831 1 33 GLN QB 2 34 LEU QD 3.750 . 4.130 4.011 3.484 4.361 0.231 11 0 "[ . 1 . 2]" 1
832 1 33 GLN QE 1 34 LEU H 5.200 . 5.720 3.441 1.862 4.408 . 0 0 "[ . 1 . 2]" 1
833 1 33 GLN HE22 2 34 LEU QD 2.700 . 2.970 2.543 2.071 3.094 0.124 5 0 "[ . 1 . 2]" 1
834 1 33 GLN QG 1 36 LYS QD 5.280 . 5.810 4.849 4.582 5.363 . 0 0 "[ . 1 . 2]" 1
835 1 33 GLN HG3 2 34 LEU QD 4.340 . 4.770 3.399 2.105 4.548 . 0 0 "[ . 1 . 2]" 1
836 1 34 LEU H 1 34 LEU QB 2.710 . 2.980 2.244 2.163 2.319 . 0 0 "[ . 1 . 2]" 1
837 1 34 LEU H 1 34 LEU QD 4.950 . 5.440 3.806 3.682 3.899 . 0 0 "[ . 1 . 2]" 1
838 1 34 LEU H 1 34 LEU HG 4.630 . 5.090 4.535 4.274 4.676 . 0 0 "[ . 1 . 2]" 1
839 1 34 LEU H 1 35 GLU H 3.080 . 3.390 2.958 2.847 3.109 . 0 0 "[ . 1 . 2]" 1
840 1 34 LEU H 1 36 LYS H 4.050 . 4.460 4.051 3.909 4.219 . 0 0 "[ . 1 . 2]" 1
841 1 34 LEU H 2 34 LEU QD 4.300 . 4.730 3.524 2.900 4.152 . 0 0 "[ . 1 . 2]" 1
842 1 34 LEU HA 1 34 LEU QB 2.510 . 2.760 2.347 2.280 2.485 . 0 0 "[ . 1 . 2]" 1
843 1 34 LEU HA 1 34 LEU HG 3.640 . 4.000 3.502 2.705 3.769 . 0 0 "[ . 1 . 2]" 1
844 1 34 LEU HA 1 36 LYS H 4.290 . 4.720 4.571 4.423 4.710 . 0 0 "[ . 1 . 2]" 1
845 1 34 LEU HA 1 38 THR H 4.040 . 4.440 2.966 2.595 3.329 . 0 0 "[ . 1 . 2]" 1
846 1 34 LEU HA 2 33 GLN QB 5.180 . 5.700 5.306 5.016 5.594 . 0 0 "[ . 1 . 2]" 1
847 1 34 LEU HA 2 34 LEU QD 2.490 . 2.740 2.318 2.001 2.717 . 0 0 "[ . 1 . 2]" 1
848 1 34 LEU HA 2 37 ALA MB 5.310 . 5.840 3.967 3.109 4.663 . 0 0 "[ . 1 . 2]" 1
849 1 34 LEU QB 1 35 GLU H 3.530 . 3.880 2.202 1.913 2.318 . 0 0 "[ . 1 . 2]" 1
850 1 34 LEU QB 1 35 GLU QB 5.980 . 6.580 3.755 3.379 3.930 . 0 0 "[ . 1 . 2]" 1
851 1 34 LEU QB 2 34 LEU QD 4.000 . 4.400 2.539 2.051 3.461 . 0 0 "[ . 1 . 2]" 1
852 1 34 LEU QD 1 35 GLU H 4.150 . 4.570 3.164 2.732 3.602 . 0 0 "[ . 1 . 2]" 1
853 1 34 LEU QD 1 35 GLU HA 4.500 . 4.950 3.205 2.535 3.880 . 0 0 "[ . 1 . 2]" 1
854 1 34 LEU QD 2 30 LEU H 5.590 . 6.150 5.282 4.458 5.913 . 0 0 "[ . 1 . 2]" 1
855 1 34 LEU QD 2 30 LEU HB2 5.120 . 5.630 4.737 3.362 5.581 . 0 0 "[ . 1 . 2]" 1
856 1 34 LEU QD 2 33 GLN H 4.230 . 4.650 3.927 3.437 4.267 . 0 0 "[ . 1 . 2]" 1
857 1 34 LEU QD 2 33 GLN QB 2.490 . 2.740 1.866 1.652 2.010 0.148 12 0 "[ . 1 . 2]" 1
858 1 34 LEU QD 2 33 GLN HE22 2.700 . 2.970 2.947 1.940 3.125 0.155 17 0 "[ . 1 . 2]" 1
859 1 34 LEU QD 2 33 GLN HG3 3.880 . 4.270 3.801 3.510 4.218 . 0 0 "[ . 1 . 2]" 1
860 1 34 LEU QD 2 34 LEU H 4.300 . 4.730 3.095 2.745 3.522 . 0 0 "[ . 1 . 2]" 1
861 1 34 LEU QD 2 34 LEU HA . . 3.600 2.214 1.789 3.165 0.011 15 0 "[ . 1 . 2]" 1
862 1 34 LEU QD 2 34 LEU QB 4.000 . 4.400 3.233 2.258 4.277 . 0 0 "[ . 1 . 2]" 1
863 1 34 LEU QD 2 34 LEU QD 2.980 . 3.250 2.176 1.774 2.857 0.026 11 0 "[ . 1 . 2]" 1
864 1 34 LEU QD 2 37 ALA H 4.440 . 4.880 3.782 3.535 4.116 . 0 0 "[ . 1 . 2]" 1
865 1 34 LEU QD 2 37 ALA HA 5.060 . 5.570 4.444 4.059 4.898 . 0 0 "[ . 1 . 2]" 1
866 1 34 LEU QD 2 37 ALA MB 2.800 . 3.080 2.332 2.013 2.714 . 0 0 "[ . 1 . 2]" 1
867 1 34 LEU QD 2 38 THR MG 4.660 . 5.130 4.623 3.807 5.241 0.111 9 0 "[ . 1 . 2]" 1
868 1 34 LEU HG 1 35 GLU H 4.140 . 4.550 3.887 2.793 4.689 0.139 9 0 "[ . 1 . 2]" 1
869 1 34 LEU HG 1 35 GLU QG 5.910 . 6.500 5.377 4.278 6.432 . 0 0 "[ . 1 . 2]" 1
870 1 35 GLU H 1 35 GLU HA 2.830 . 3.110 2.855 2.815 2.901 . 0 0 "[ . 1 . 2]" 1
871 1 35 GLU H 1 35 GLU QB 2.940 . 3.230 2.575 2.459 2.677 . 0 0 "[ . 1 . 2]" 1
872 1 35 GLU H 1 35 GLU QG 3.070 . 3.380 2.059 1.906 2.217 . 0 0 "[ . 1 . 2]" 1
873 1 35 GLU H 1 36 LYS H 3.000 . 3.300 2.652 2.582 2.811 . 0 0 "[ . 1 . 2]" 1
874 1 35 GLU HA 1 35 GLU QB 2.460 . 2.710 2.188 2.175 2.204 . 0 0 "[ . 1 . 2]" 1
875 1 35 GLU HA 1 36 LYS H 3.480 . 3.830 3.545 3.491 3.592 . 0 0 "[ . 1 . 2]" 1
876 1 35 GLU HA 1 37 ALA H 4.860 . 5.350 3.461 3.290 3.621 . 0 0 "[ . 1 . 2]" 1
877 1 35 GLU QB 1 36 LYS H 4.000 . 4.400 3.663 3.555 3.760 . 0 0 "[ . 1 . 2]" 1
878 1 35 GLU QG 1 36 LYS H 3.000 . 3.300 2.544 2.299 2.966 . 0 0 "[ . 1 . 2]" 1
879 1 35 GLU QG 1 36 LYS QB 5.250 . 5.780 4.254 3.944 4.860 . 0 0 "[ . 1 . 2]" 1
880 1 35 GLU QG 1 36 LYS QD 5.000 . 5.500 4.545 4.022 5.136 . 0 0 "[ . 1 . 2]" 1
881 1 35 GLU QG 1 36 LYS QG 4.280 . 4.710 3.033 2.647 3.747 . 0 0 "[ . 1 . 2]" 1
882 1 36 LYS H 1 36 LYS HA 2.820 . 3.100 2.862 2.829 2.903 . 0 0 "[ . 1 . 2]" 1
883 1 36 LYS H 1 36 LYS QB 2.900 . 3.190 2.422 2.357 2.495 . 0 0 "[ . 1 . 2]" 1
884 1 36 LYS H 1 36 LYS QD 4.340 . 4.770 3.832 3.636 4.056 . 0 0 "[ . 1 . 2]" 1
885 1 36 LYS H 1 36 LYS QE 5.400 . 5.940 4.811 4.475 5.298 . 0 0 "[ . 1 . 2]" 1
886 1 36 LYS H 1 36 LYS QG 3.450 . 3.790 2.366 2.252 2.467 . 0 0 "[ . 1 . 2]" 1
887 1 36 LYS H 1 37 ALA H 2.710 . 2.980 2.564 2.446 2.650 . 0 0 "[ . 1 . 2]" 1
888 1 36 LYS H 1 38 THR H 4.600 . 5.060 4.447 3.996 4.685 . 0 0 "[ . 1 . 2]" 1
889 1 36 LYS HA 1 36 LYS QD 4.580 . 5.040 4.223 4.023 4.328 . 0 0 "[ . 1 . 2]" 1
890 1 36 LYS HA 1 36 LYS QG 2.600 . 2.860 2.461 2.385 2.535 . 0 0 "[ . 1 . 2]" 1
891 1 36 LYS HA 1 37 ALA HA 5.220 . 5.740 5.138 5.054 5.202 . 0 0 "[ . 1 . 2]" 1
892 1 36 LYS QB 1 36 LYS QD 3.060 . 3.370 2.319 2.168 2.422 . 0 0 "[ . 1 . 2]" 1
893 1 36 LYS QB 1 36 LYS QE 3.620 . 3.980 2.656 1.938 3.719 . 0 0 "[ . 1 . 2]" 1
894 1 36 LYS QB 1 37 ALA H 3.450 . 3.790 3.043 2.873 3.186 . 0 0 "[ . 1 . 2]" 1
895 1 36 LYS QB 1 37 ALA HA 4.970 . 5.470 4.840 4.718 4.971 . 0 0 "[ . 1 . 2]" 1
896 1 37 ALA H 1 37 ALA HA 2.920 . 3.210 2.259 2.240 2.292 . 0 0 "[ . 1 . 2]" 1
897 1 37 ALA H 1 37 ALA MB 3.000 . 3.300 3.099 3.077 3.124 . 0 0 "[ . 1 . 2]" 1
898 1 37 ALA H 1 38 THR H 2.860 . 3.150 2.418 2.238 2.575 . 0 0 "[ . 1 . 2]" 1
899 1 37 ALA H 2 34 LEU QD 4.570 . 5.030 5.060 4.465 5.295 0.265 11 0 "[ . 1 . 2]" 1
900 1 37 ALA H 2 37 ALA MB 5.000 . 5.500 4.602 4.141 5.043 . 0 0 "[ . 1 . 2]" 1
901 1 37 ALA HA 2 34 LEU QD 4.580 . 5.040 4.897 4.282 5.304 0.264 5 0 "[ . 1 . 2]" 1
902 1 37 ALA HA 2 37 ALA MB 3.500 . 3.850 2.997 2.665 3.306 . 0 0 "[ . 1 . 2]" 1
903 1 37 ALA MB 1 38 THR H 3.720 . 4.090 3.711 3.618 3.766 . 0 0 "[ . 1 . 2]" 1
904 1 37 ALA MB 2 34 LEU HA 6.380 . 7.020 6.860 6.321 7.162 0.142 5 0 "[ . 1 . 2]" 1
905 1 37 ALA MB 2 34 LEU QD 5.470 . 6.020 5.609 5.012 6.022 0.002 17 0 "[ . 1 . 2]" 1
906 1 37 ALA MB 2 37 ALA H 6.240 . 6.860 6.734 6.511 6.901 0.041 11 0 "[ . 1 . 2]" 1
907 1 37 ALA MB 2 37 ALA HA 4.610 . 5.070 5.076 4.587 5.284 0.214 5 0 "[ . 1 . 2]" 1
908 1 38 THR H 1 38 THR HA 2.900 . 3.190 2.906 2.663 3.018 . 0 0 "[ . 1 . 2]" 1
909 1 38 THR H 1 38 THR MG 3.100 . 3.410 2.565 1.987 3.867 0.457 8 0 "[ . 1 . 2]" 1
910 1 38 THR H 1 39 GLN QG 5.980 . 6.580 6.062 5.709 6.752 0.172 15 0 "[ . 1 . 2]" 1
911 1 38 THR H 1 40 ARG H 5.930 . 6.520 6.157 5.607 6.594 0.074 20 0 "[ . 1 . 2]" 1
912 1 38 THR MG 1 39 GLN H 3.040 . 3.340 3.036 2.002 3.537 0.197 5 0 "[ . 1 . 2]" 1
913 1 38 THR MG 1 39 GLN QG 4.370 . 4.810 4.407 3.497 5.050 0.240 10 0 "[ . 1 . 2]" 1
914 1 38 THR MG 2 34 LEU QD 3.690 . 4.060 2.347 1.749 3.948 0.051 2 0 "[ . 1 . 2]" 1
915 1 39 GLN H 1 39 GLN HA 2.940 . 3.230 2.949 2.920 2.968 . 0 0 "[ . 1 . 2]" 1
916 1 39 GLN H 1 39 GLN QB 3.500 . 3.850 3.036 2.815 3.237 . 0 0 "[ . 1 . 2]" 1
917 1 39 GLN H 1 39 GLN QE 4.500 . 4.950 4.265 2.922 4.858 . 0 0 "[ . 1 . 2]" 1
918 1 39 GLN H 1 39 GLN QG 3.960 . 4.360 2.198 1.979 2.629 . 0 0 "[ . 1 . 2]" 1
919 1 39 GLN H 1 40 ARG H 2.000 . 2.200 2.067 1.686 2.319 0.119 14 0 "[ . 1 . 2]" 1
920 1 39 GLN HA 1 39 GLN QB 2.450 . 2.700 2.185 2.163 2.196 . 0 0 "[ . 1 . 2]" 1
921 1 39 GLN HA 1 39 GLN QE 5.000 . 5.500 4.475 3.501 5.210 . 0 0 "[ . 1 . 2]" 1
922 1 39 GLN HA 1 39 GLN QG 3.820 . 4.200 3.424 3.359 3.540 . 0 0 "[ . 1 . 2]" 1
923 1 39 GLN QB 1 40 ARG H 3.930 . 4.320 3.436 2.959 3.914 . 0 0 "[ . 1 . 2]" 1
924 1 39 GLN QB 1 40 ARG QB 4.840 . 5.320 3.890 3.367 4.611 . 0 0 "[ . 1 . 2]" 1
925 1 39 GLN QE 1 40 ARG H 3.220 . 3.540 3.498 2.762 3.856 0.316 20 0 "[ . 1 . 2]" 1
926 1 39 GLN QE 1 40 ARG QB 3.970 . 4.370 2.759 1.805 4.520 0.150 14 0 "[ . 1 . 2]" 1
927 1 39 GLN QE 1 40 ARG QG 4.280 . 4.710 4.084 2.216 4.960 0.250 14 0 "[ . 1 . 2]" 1
928 1 39 GLN HE21 2 39 GLN HE22 5.560 . 6.120 5.562 3.798 6.314 0.194 11 0 "[ . 1 . 2]" 1
929 1 39 GLN HE22 2 39 GLN HE21 5.560 . 6.120 4.410 3.056 6.040 . 0 0 "[ . 1 . 2]" 1
930 1 39 GLN QG 1 40 ARG H 2.900 . 3.190 2.206 1.704 3.330 0.140 6 0 "[ . 1 . 2]" 1
931 1 40 ARG H 1 40 ARG QD 5.000 . 5.500 4.645 2.607 5.142 . 0 0 "[ . 1 . 2]" 1
932 1 40 ARG H 1 40 ARG QG 4.720 . 5.190 3.923 2.400 4.507 . 0 0 "[ . 1 . 2]" 1
933 1 40 ARG H 1 41 GLN H 4.650 . 5.120 4.395 4.049 4.599 . 0 0 "[ . 1 . 2]" 1
934 1 40 ARG HA 1 40 ARG QD 4.590 . 5.050 3.929 2.010 4.651 . 0 0 "[ . 1 . 2]" 1
935 1 40 ARG HA 1 40 ARG QG 3.030 . 3.330 2.754 2.371 3.455 0.125 13 0 "[ . 1 . 2]" 1
936 1 40 ARG HA 1 41 GLN H 2.320 . 2.550 2.327 2.147 2.590 0.040 20 0 "[ . 1 . 2]" 1
937 1 40 ARG QB 1 40 ARG QD 2.880 . 3.170 2.304 2.146 2.776 . 0 0 "[ . 1 . 2]" 1
938 1 40 ARG QB 2 41 GLN QE 5.200 . 5.720 4.534 2.964 5.683 . 0 0 "[ . 1 . 2]" 1
939 1 40 ARG QD 1 41 GLN QG 5.900 . 6.490 5.671 4.165 6.668 0.178 11 0 "[ . 1 . 2]" 1
940 1 40 ARG QG 1 41 GLN H 2.400 . 2.640 2.435 1.807 2.828 0.188 17 0 "[ . 1 . 2]" 1
941 1 40 ARG QG 1 41 GLN QB 4.600 . 5.060 4.467 2.567 5.085 0.025 4 0 "[ . 1 . 2]" 1
942 1 40 ARG QG 1 41 GLN QG 5.130 . 5.640 4.269 3.617 4.940 . 0 0 "[ . 1 . 2]" 1
943 1 41 GLN H 1 41 GLN HA 2.950 . 3.250 2.910 2.195 2.979 . 0 0 "[ . 1 . 2]" 1
944 1 41 GLN H 1 41 GLN HB2 3.980 . 4.380 3.831 3.680 3.971 . 0 0 "[ . 1 . 2]" 1
945 1 41 GLN H 1 41 GLN QB 3.260 . 3.590 3.017 2.768 3.290 . 0 0 "[ . 1 . 2]" 1
946 1 41 GLN H 1 41 GLN HB3 3.250 . 3.580 3.165 2.847 3.544 . 0 0 "[ . 1 . 2]" 1
947 1 41 GLN H 1 41 GLN QG 4.160 . 4.580 2.732 2.003 4.295 . 0 0 "[ . 1 . 2]" 1
948 1 41 GLN HA 1 41 GLN HB2 2.530 . 2.780 2.462 2.324 2.600 . 0 0 "[ . 1 . 2]" 1
949 1 41 GLN HA 1 41 GLN QB 2.460 . 2.710 2.194 2.163 2.211 . 0 0 "[ . 1 . 2]" 1
950 1 41 GLN HA 1 41 GLN QG 3.780 . 4.160 3.486 3.361 3.585 . 0 0 "[ . 1 . 2]" 1
951 1 41 GLN HA 1 42 GLU QB 5.250 . 5.780 4.348 3.962 4.682 . 0 0 "[ . 1 . 2]" 1
952 1 41 GLN QB 1 42 GLU H 3.090 . 3.400 2.566 2.006 3.416 0.016 11 0 "[ . 1 . 2]" 1
953 1 41 GLN QB 1 42 GLU HA 5.250 . 5.780 4.548 4.227 5.062 . 0 0 "[ . 1 . 2]" 1
954 1 41 GLN QB 1 43 ARG QD 5.100 . 5.610 4.291 2.750 5.499 . 0 0 "[ . 1 . 2]" 1
955 1 41 GLN QB 1 43 ARG QG 5.200 . 5.720 3.524 2.306 5.117 . 0 0 "[ . 1 . 2]" 1
956 1 41 GLN HB2 1 41 GLN QG 2.500 . 2.750 2.202 2.151 2.325 . 0 0 "[ . 1 . 2]" 1
957 1 41 GLN QE 1 43 ARG H 5.240 . 5.760 5.401 4.605 6.002 0.242 7 0 "[ . 1 . 2]" 1
958 1 41 GLN HE21 2 30 LEU QD 6.340 . 6.970 6.923 6.130 7.368 0.398 20 0 "[ . 1 . 2]" 1
959 1 41 GLN HE21 2 40 ARG QB 5.200 . 5.720 5.092 2.693 5.972 0.252 20 0 "[ . 1 . 2]" 1
960 1 41 GLN HE21 2 41 GLN QE 4.500 . 4.950 3.172 1.810 4.667 . 0 0 "[ . 1 . 2]" 1
961 1 41 GLN HE22 2 41 GLN QE 4.500 . 4.950 3.430 1.832 4.620 . 0 0 "[ . 1 . 2]" 1
962 1 41 GLN QG 1 42 GLU H 3.190 . 3.510 3.226 1.925 3.788 0.278 8 0 "[ . 1 . 2]" 1
963 1 41 GLN QG 1 42 GLU HA 4.050 . 4.460 3.943 3.194 4.639 0.179 8 0 "[ . 1 . 2]" 1
964 1 41 GLN QG 1 42 GLU QB 5.200 . 5.720 4.889 4.199 5.481 . 0 0 "[ . 1 . 2]" 1
965 1 41 GLN QG 1 43 ARG H 3.720 . 4.090 3.172 2.352 3.908 . 0 0 "[ . 1 . 2]" 1
966 1 41 GLN QG 1 43 ARG HA 4.800 . 5.280 4.444 2.441 5.223 . 0 0 "[ . 1 . 2]" 1
967 1 41 GLN QG 1 43 ARG QD 3.180 . 3.500 3.193 2.333 3.629 0.129 3 0 "[ . 1 . 2]" 1
968 1 41 GLN QG 1 43 ARG QG 4.090 . 4.500 2.617 1.900 4.607 0.107 20 0 "[ . 1 . 2]" 1
969 1 42 GLU H 1 42 GLU HA 2.940 . 3.230 2.829 2.175 2.981 . 0 0 "[ . 1 . 2]" 1
970 1 42 GLU H 1 42 GLU QB 3.560 . 3.920 2.830 2.478 3.424 . 0 0 "[ . 1 . 2]" 1
971 1 42 GLU H 1 42 GLU QG 4.090 . 4.500 2.984 1.888 4.508 0.008 11 0 "[ . 1 . 2]" 1
972 1 42 GLU H 1 43 ARG H 3.510 . 3.860 2.743 1.805 3.935 0.075 18 0 "[ . 1 . 2]" 1
973 1 42 GLU H 1 43 ARG HA 5.450 . 6.000 4.530 3.910 5.353 . 0 0 "[ . 1 . 2]" 1
974 1 42 GLU H 1 43 ARG QG 5.050 . 5.560 4.298 3.502 5.738 0.178 20 0 "[ . 1 . 2]" 1
975 1 42 GLU HA 1 42 GLU QB 2.500 . 2.750 2.299 2.179 2.462 . 0 0 "[ . 1 . 2]" 1
976 1 42 GLU QG 1 43 ARG H 4.210 . 4.630 3.721 2.403 4.804 0.174 13 0 "[ . 1 . 2]" 1
977 1 43 ARG H 1 43 ARG HA 2.730 . 3.000 2.627 2.217 2.971 . 0 0 "[ . 1 . 2]" 1
978 1 43 ARG H 1 43 ARG QB 3.690 . 4.060 2.792 2.081 3.451 . 0 0 "[ . 1 . 2]" 1
979 1 43 ARG H 1 43 ARG QD 4.760 . 5.240 4.192 2.128 5.031 . 0 0 "[ . 1 . 2]" 1
980 1 43 ARG H 1 43 ARG QG 3.820 . 4.200 2.777 1.967 4.310 0.110 15 0 "[ . 1 . 2]" 1
981 1 43 ARG H 1 44 PHE H 3.880 . 4.270 3.090 1.970 4.114 . 0 0 "[ . 1 . 2]" 1
982 1 43 ARG HA 1 43 ARG QG 2.600 . 2.860 2.539 2.435 2.977 0.117 18 0 "[ . 1 . 2]" 1
983 1 43 ARG QB 1 44 PHE H 2.220 . 2.440 2.266 1.900 2.617 0.177 11 0 "[ . 1 . 2]" 1
984 1 43 ARG QG 1 44 PHE H 4.410 . 4.850 3.942 2.957 4.446 . 0 0 "[ . 1 . 2]" 1
985 1 44 PHE H 1 44 PHE HA 2.940 . 3.230 2.927 2.831 2.976 . 0 0 "[ . 1 . 2]" 1
986 1 44 PHE H 1 44 PHE HB2 2.920 . 3.210 3.022 2.494 3.349 0.139 19 0 "[ . 1 . 2]" 1
987 1 44 PHE H 1 44 PHE QB 2.900 . 3.190 2.527 2.250 2.831 . 0 0 "[ . 1 . 2]" 1
988 1 44 PHE H 1 44 PHE HB3 2.870 . 3.160 2.722 2.400 3.142 . 0 0 "[ . 1 . 2]" 1
989 2 1 ASP HA 2 2 PHE H 3.500 . 3.850 3.437 3.311 3.513 . 0 0 "[ . 1 . 2]" 1
990 2 1 ASP HA 2 3 LYS H 4.110 . 4.520 4.163 3.497 4.593 0.073 17 0 "[ . 1 . 2]" 1
991 2 1 ASP HA 2 4 LYS H 4.070 . 4.480 4.386 3.893 4.662 0.182 13 0 "[ . 1 . 2]" 1
992 2 1 ASP HA 2 5 LEU H 5.620 . 6.180 5.812 4.148 6.249 0.069 6 0 "[ . 1 . 2]" 1
993 2 1 ASP QB 2 2 PHE H 3.500 . 3.850 2.809 2.064 3.239 . 0 0 "[ . 1 . 2]" 1
994 2 1 ASP HB2 2 2 PHE H 2.940 . 3.230 2.962 2.442 3.540 0.310 7 0 "[ . 1 . 2]" 1
995 2 1 ASP HB3 2 2 PHE H 3.950 . 4.350 3.823 2.078 4.221 . 0 0 "[ . 1 . 2]" 1
996 2 2 PHE H 2 2 PHE HB2 2.900 . 3.190 2.475 2.395 2.588 . 0 0 "[ . 1 . 2]" 1
997 2 2 PHE H 2 2 PHE HB3 3.540 . 3.890 3.578 2.415 3.721 . 0 0 "[ . 1 . 2]" 1
998 2 2 PHE H 2 3 LYS QG 5.740 . 6.310 5.194 4.775 5.697 . 0 0 "[ . 1 . 2]" 1
999 2 2 PHE H 2 4 LYS H 4.500 . 4.950 4.215 3.664 4.720 . 0 0 "[ . 1 . 2]" 1
1000 2 2 PHE HA 2 3 LYS H 3.490 . 3.840 3.414 3.318 3.556 . 0 0 "[ . 1 . 2]" 1
1001 2 2 PHE HA 2 4 LYS HG2 5.500 . 6.050 4.814 4.176 6.272 0.222 19 0 "[ . 1 . 2]" 1
1002 2 2 PHE HA 2 4 LYS QG 4.500 . 4.950 3.320 2.735 4.518 . 0 0 "[ . 1 . 2]" 1
1003 2 2 PHE HA 2 4 LYS HG3 4.380 . 4.820 3.387 2.769 4.632 . 0 0 "[ . 1 . 2]" 1
1004 2 2 PHE HA 2 5 LEU H 3.380 . 3.720 2.924 2.720 3.488 . 0 0 "[ . 1 . 2]" 1
1005 2 2 PHE HA 2 5 LEU QB 2.650 . 2.920 2.817 2.278 3.004 0.084 8 0 "[ . 1 . 2]" 1
1006 2 2 PHE HA 2 6 TYR H 4.730 . 5.200 4.515 4.124 4.692 . 0 0 "[ . 1 . 2]" 1
1007 2 2 PHE QB 2 3 LYS H 3.250 . 3.580 3.157 2.760 3.393 . 0 0 "[ . 1 . 2]" 1
1008 2 2 PHE HB2 2 3 LYS H 4.190 . 4.610 3.339 2.845 4.033 . 0 0 "[ . 1 . 2]" 1
1009 2 2 PHE HB3 2 3 LYS H 3.810 . 4.190 4.081 2.810 4.272 0.082 13 0 "[ . 1 . 2]" 1
1010 2 3 LYS H 2 3 LYS HA 2.800 . 3.080 2.808 2.793 2.846 . 0 0 "[ . 1 . 2]" 1
1011 2 3 LYS H 2 3 LYS HB2 3.550 . 3.900 3.617 3.579 3.663 . 0 0 "[ . 1 . 2]" 1
1012 2 3 LYS H 2 3 LYS HB3 2.290 . 2.520 2.426 2.363 2.519 . 0 0 "[ . 1 . 2]" 1
1013 2 3 LYS H 2 3 LYS HD2 2.200 . 2.420 1.907 1.788 2.002 0.012 16 0 "[ . 1 . 2]" 1
1014 2 3 LYS H 2 3 LYS QD 3.000 . 3.300 1.896 1.783 1.985 0.017 16 0 "[ . 1 . 2]" 1
1015 2 3 LYS H 2 3 LYS HD3 3.680 . 4.050 3.415 2.956 3.723 . 0 0 "[ . 1 . 2]" 1
1016 2 3 LYS H 2 3 LYS HE2 4.110 . 4.520 4.067 3.677 4.421 . 0 0 "[ . 1 . 2]" 1
1017 2 3 LYS H 2 3 LYS HE3 4.350 . 4.790 4.464 2.913 4.929 0.139 9 0 "[ . 1 . 2]" 1
1018 2 3 LYS H 2 3 LYS QG 3.770 . 4.150 3.423 3.330 3.491 . 0 0 "[ . 1 . 2]" 1
1019 2 3 LYS H 2 4 LYS H 2.900 . 3.190 2.633 2.557 2.733 . 0 0 "[ . 1 . 2]" 1
1020 2 3 LYS H 2 5 LEU H 4.140 . 4.550 4.131 3.831 4.235 . 0 0 "[ . 1 . 2]" 1
1021 2 3 LYS HA 2 3 LYS HB2 2.330 . 2.560 2.371 2.352 2.403 . 0 0 "[ . 1 . 2]" 1
1022 2 3 LYS HA 2 3 LYS QB 2.500 . 2.750 2.187 2.177 2.197 . 0 0 "[ . 1 . 2]" 1
1023 2 3 LYS HA 2 3 LYS HB3 2.580 . 2.840 2.564 2.536 2.599 . 0 0 "[ . 1 . 2]" 1
1024 2 3 LYS HA 2 4 LYS H 3.510 . 3.860 3.509 3.449 3.571 . 0 0 "[ . 1 . 2]" 1
1025 2 3 LYS HA 2 5 LEU H 4.400 . 4.840 4.332 4.188 4.474 . 0 0 "[ . 1 . 2]" 1
1026 2 3 LYS HA 2 6 TYR H 3.830 . 4.210 3.663 3.483 3.874 . 0 0 "[ . 1 . 2]" 1
1027 2 3 LYS HA 2 6 TYR QB 4.120 . 4.530 3.078 2.907 3.457 . 0 0 "[ . 1 . 2]" 1
1028 2 3 LYS HA 2 7 GLU H 5.140 . 5.650 4.571 4.395 4.717 . 0 0 "[ . 1 . 2]" 1
1029 2 3 LYS HB2 2 3 LYS QG 2.450 . 2.700 2.170 2.162 2.180 . 0 0 "[ . 1 . 2]" 1
1030 2 3 LYS HB2 2 4 LYS H 4.070 . 4.480 4.030 3.909 4.115 . 0 0 "[ . 1 . 2]" 1
1031 2 3 LYS HB3 2 4 LYS H 3.670 . 4.040 3.872 3.830 3.937 . 0 0 "[ . 1 . 2]" 1
1032 2 3 LYS HD2 2 4 LYS H 2.100 . 2.310 2.369 2.140 2.622 0.312 1 0 "[ . 1 . 2]" 1
1033 2 3 LYS HD2 2 4 LYS HG2 3.880 . 4.270 4.283 3.731 4.463 0.193 20 0 "[ . 1 . 2]" 1
1034 2 3 LYS HD2 2 4 LYS HG3 4.010 . 4.410 3.879 3.472 4.514 0.104 7 0 "[ . 1 . 2]" 1
1035 2 3 LYS HD3 2 4 LYS H 2.640 . 2.900 2.504 1.708 3.138 0.238 10 0 "[ . 1 . 2]" 1
1036 2 3 LYS HE2 2 3 LYS QG 3.710 . 4.080 3.317 2.313 3.491 . 0 0 "[ . 1 . 2]" 1
1037 2 3 LYS HE2 2 4 LYS H 4.550 . 5.010 4.428 3.897 5.010 0.000 10 0 "[ . 1 . 2]" 1
1038 2 3 LYS HE3 2 3 LYS QG 3.010 . 3.310 2.505 2.378 2.981 . 0 0 "[ . 1 . 2]" 1
1039 2 3 LYS HE3 2 4 LYS H 4.580 . 5.040 4.652 4.176 5.054 0.014 7 0 "[ . 1 . 2]" 1
1040 2 3 LYS QG 2 4 LYS H 2.860 . 3.150 2.728 2.362 3.158 0.008 12 0 "[ . 1 . 2]" 1
1041 2 3 LYS QG 2 4 LYS HG2 4.630 . 5.090 4.909 4.193 5.242 0.152 9 0 "[ . 1 . 2]" 1
1042 2 3 LYS QG 2 4 LYS HG3 4.500 . 4.950 4.623 4.078 5.090 0.140 8 0 "[ . 1 . 2]" 1
1043 2 3 LYS QG 2 7 GLU H 5.410 . 5.950 5.163 4.979 5.381 . 0 0 "[ . 1 . 2]" 1
1044 2 4 LYS H 2 4 LYS HA 2.860 . 3.150 2.839 2.781 2.878 . 0 0 "[ . 1 . 2]" 1
1045 2 4 LYS H 2 4 LYS QB 3.090 . 3.400 2.553 2.429 2.713 . 0 0 "[ . 1 . 2]" 1
1046 2 4 LYS H 2 4 LYS QE 4.560 . 5.020 4.724 4.081 4.962 . 0 0 "[ . 1 . 2]" 1
1047 2 4 LYS H 2 4 LYS HG2 2.990 . 3.290 3.240 2.862 3.422 0.132 15 0 "[ . 1 . 2]" 1
1048 2 4 LYS H 2 4 LYS HG3 2.620 . 2.880 2.253 2.036 2.663 . 0 0 "[ . 1 . 2]" 1
1049 2 4 LYS H 2 5 LEU H 2.530 . 2.780 2.653 2.502 2.861 0.081 10 0 "[ . 1 . 2]" 1
1050 2 4 LYS H 2 6 TYR H 4.350 . 4.790 4.245 4.091 4.408 . 0 0 "[ . 1 . 2]" 1
1051 2 4 LYS H 2 7 GLU H 5.080 . 5.590 4.747 4.506 4.888 . 0 0 "[ . 1 . 2]" 1
1052 2 4 LYS HA 2 4 LYS HG2 4.150 . 4.570 4.246 4.142 4.281 . 0 0 "[ . 1 . 2]" 1
1053 2 4 LYS HA 2 4 LYS HG3 3.580 . 3.940 3.706 3.679 3.739 . 0 0 "[ . 1 . 2]" 1
1054 2 4 LYS HA 2 6 TYR H 4.510 . 4.960 4.384 4.191 4.582 . 0 0 "[ . 1 . 2]" 1
1055 2 4 LYS HA 2 7 GLU H 3.400 . 3.740 3.159 2.856 3.407 . 0 0 "[ . 1 . 2]" 1
1056 2 4 LYS HA 2 7 GLU HB2 2.930 . 3.220 2.385 2.045 2.668 . 0 0 "[ . 1 . 2]" 1
1057 2 4 LYS HA 2 7 GLU HB3 4.310 . 4.740 3.985 3.643 4.262 . 0 0 "[ . 1 . 2]" 1
1058 2 4 LYS HA 2 8 GLN H 3.940 . 4.330 4.044 3.874 4.231 . 0 0 "[ . 1 . 2]" 1
1059 2 4 LYS QB 2 7 GLU QB 5.200 . 5.720 3.677 3.225 3.970 . 0 0 "[ . 1 . 2]" 1
1060 2 4 LYS QB 2 8 GLN H 4.900 . 5.390 4.594 4.323 4.785 . 0 0 "[ . 1 . 2]" 1
1061 2 4 LYS QD 2 4 LYS HG2 2.490 . 2.740 2.317 2.185 2.384 . 0 0 "[ . 1 . 2]" 1
1062 2 4 LYS QD 2 8 GLN HG2 3.440 . 3.780 3.189 2.147 4.129 0.349 8 0 "[ . 1 . 2]" 1
1063 2 4 LYS QD 2 8 GLN HG3 4.430 . 4.870 3.811 2.893 4.525 . 0 0 "[ . 1 . 2]" 1
1064 2 4 LYS QE 2 4 LYS QG 3.200 . 3.520 2.639 2.218 2.929 . 0 0 "[ . 1 . 2]" 1
1065 2 4 LYS QE 2 8 GLN QB 4.360 . 4.800 4.096 3.333 4.589 . 0 0 "[ . 1 . 2]" 1
1066 2 4 LYS QE 2 8 GLN HG2 2.950 . 3.250 2.735 1.980 3.448 0.198 18 0 "[ . 1 . 2]" 1
1067 2 4 LYS QE 2 8 GLN HG3 4.220 . 4.640 2.891 2.579 3.712 . 0 0 "[ . 1 . 2]" 1
1068 2 4 LYS QG 2 5 LEU QB 4.750 . 5.220 3.641 3.260 3.848 . 0 0 "[ . 1 . 2]" 1
1069 2 4 LYS QG 2 8 GLN QB 5.500 . 6.050 5.828 5.512 6.027 . 0 0 "[ . 1 . 2]" 1
1070 2 4 LYS HG2 2 5 LEU H 3.680 . 4.050 3.995 3.722 4.146 0.096 17 0 "[ . 1 . 2]" 1
1071 2 4 LYS HG2 2 5 LEU QB 5.000 . 5.500 5.135 4.865 5.451 . 0 0 "[ . 1 . 2]" 1
1072 2 4 LYS HG2 2 8 GLN HG2 5.130 . 5.640 5.366 5.132 5.560 . 0 0 "[ . 1 . 2]" 1
1073 2 4 LYS HG3 2 5 LEU H 2.200 . 2.420 2.343 2.065 2.502 0.082 2 0 "[ . 1 . 2]" 1
1074 2 4 LYS HG3 2 5 LEU QB 3.850 . 4.230 3.727 3.313 3.956 . 0 0 "[ . 1 . 2]" 1
1075 2 4 LYS HG3 2 8 GLN HG2 4.480 . 4.930 4.856 4.263 5.121 0.191 10 0 "[ . 1 . 2]" 1
1076 2 4 LYS HG3 2 8 GLN HG3 5.630 . 6.190 5.950 5.327 6.199 0.009 2 0 "[ . 1 . 2]" 1
1077 2 5 LEU H 2 5 LEU HA 2.790 . 3.070 2.824 2.775 2.841 . 0 0 "[ . 1 . 2]" 1
1078 2 5 LEU H 2 5 LEU MD1 4.970 . 5.470 4.194 4.090 4.394 . 0 0 "[ . 1 . 2]" 1
1079 2 5 LEU H 2 5 LEU MD2 4.160 . 4.580 3.772 3.663 4.258 . 0 0 "[ . 1 . 2]" 1
1080 2 5 LEU H 2 5 LEU HG 4.540 . 4.990 3.181 2.952 4.254 . 0 0 "[ . 1 . 2]" 1
1081 2 5 LEU H 2 6 TYR H 2.680 . 2.950 2.651 2.577 2.856 . 0 0 "[ . 1 . 2]" 1
1082 2 5 LEU H 2 7 GLU H 4.160 . 4.580 4.116 3.930 4.253 . 0 0 "[ . 1 . 2]" 1
1083 2 5 LEU HA 2 5 LEU HG 3.720 . 4.090 3.906 3.644 3.951 . 0 0 "[ . 1 . 2]" 1
1084 2 5 LEU HA 2 6 TYR H 3.570 . 3.930 3.547 3.527 3.583 . 0 0 "[ . 1 . 2]" 1
1085 2 5 LEU HA 2 7 GLU H 4.640 . 5.100 4.443 4.292 4.591 . 0 0 "[ . 1 . 2]" 1
1086 2 5 LEU HA 2 8 GLN H 3.620 . 3.980 3.418 3.115 3.664 . 0 0 "[ . 1 . 2]" 1
1087 2 5 LEU HA 2 8 GLN QB 3.620 . 3.980 3.015 2.637 3.361 . 0 0 "[ . 1 . 2]" 1
1088 2 5 LEU HA 2 8 GLN HE22 4.650 . 5.120 4.540 4.105 4.891 . 0 0 "[ . 1 . 2]" 1
1089 2 5 LEU HA 2 9 ILE H 4.780 . 5.260 3.961 3.784 4.148 . 0 0 "[ . 1 . 2]" 1
1090 2 5 LEU QB 2 5 LEU HG 2.450 . 2.700 2.463 2.369 2.482 . 0 0 "[ . 1 . 2]" 1
1091 2 5 LEU QD 2 8 GLN H 5.500 . 6.050 4.837 4.431 5.008 . 0 0 "[ . 1 . 2]" 1
1092 2 5 LEU MD1 2 6 TYR H 5.000 . 5.500 2.953 2.746 3.843 . 0 0 "[ . 1 . 2]" 1
1093 2 5 LEU MD1 2 8 GLN H 5.970 . 6.570 4.973 4.513 5.158 . 0 0 "[ . 1 . 2]" 1
1094 2 5 LEU MD1 2 9 ILE HG12 4.990 . 5.490 4.443 3.810 4.685 . 0 0 "[ . 1 . 2]" 1
1095 2 5 LEU MD2 2 6 TYR H 5.200 . 5.720 3.955 3.870 4.031 . 0 0 "[ . 1 . 2]" 1
1096 2 6 TYR H 2 6 TYR HA 2.820 . 3.100 2.793 2.777 2.820 . 0 0 "[ . 1 . 2]" 1
1097 2 6 TYR H 2 6 TYR QB 2.540 . 2.790 2.264 2.224 2.314 . 0 0 "[ . 1 . 2]" 1
1098 2 6 TYR H 2 7 GLU H 2.620 . 2.880 2.786 2.694 2.861 . 0 0 "[ . 1 . 2]" 1
1099 2 6 TYR H 2 7 GLU HB2 4.490 . 4.940 4.859 4.753 4.956 0.016 2 0 "[ . 1 . 2]" 1
1100 2 6 TYR H 2 8 GLN H 4.020 . 4.420 4.275 4.125 4.365 . 0 0 "[ . 1 . 2]" 1
1101 2 6 TYR H 2 8 GLN HE22 5.200 . 5.720 5.624 5.501 5.739 0.019 7 0 "[ . 1 . 2]" 1
1102 2 6 TYR HA 2 7 GLU H 3.520 . 3.870 3.564 3.539 3.587 . 0 0 "[ . 1 . 2]" 1
1103 2 6 TYR HA 2 8 GLN H 4.640 . 5.100 4.567 4.433 4.708 . 0 0 "[ . 1 . 2]" 1
1104 2 6 TYR HA 2 9 ILE H 4.350 . 4.790 4.303 4.112 4.529 . 0 0 "[ . 1 . 2]" 1
1105 2 6 TYR HA 2 9 ILE HB 3.860 . 4.250 4.079 3.957 4.289 0.039 19 0 "[ . 1 . 2]" 1
1106 2 6 TYR HA 2 10 LEU H 4.440 . 4.880 4.055 3.601 4.275 . 0 0 "[ . 1 . 2]" 1
1107 2 7 GLU H 2 7 GLU HB2 2.140 . 2.350 2.406 2.231 2.481 0.131 20 0 "[ . 1 . 2]" 1
1108 2 7 GLU H 2 7 GLU HB3 3.450 . 3.790 3.572 3.534 3.606 . 0 0 "[ . 1 . 2]" 1
1109 2 7 GLU H 2 7 GLU QG 4.080 . 4.490 2.355 2.096 3.621 . 0 0 "[ . 1 . 2]" 1
1110 2 7 GLU H 2 8 GLN H 2.480 . 2.730 2.771 2.714 2.827 0.097 17 0 "[ . 1 . 2]" 1
1111 2 7 GLU H 2 8 GLN HE21 5.280 . 5.810 5.261 5.140 5.429 . 0 0 "[ . 1 . 2]" 1
1112 2 7 GLU H 2 8 GLN HE22 3.970 . 4.370 3.784 3.707 3.927 . 0 0 "[ . 1 . 2]" 1
1113 2 7 GLU H 2 9 ILE H 4.660 . 5.130 4.721 4.582 4.923 . 0 0 "[ . 1 . 2]" 1
1114 2 7 GLU H 2 11 ALA H 5.540 . 6.090 5.832 5.640 5.913 . 0 0 "[ . 1 . 2]" 1
1115 2 7 GLU HA 2 7 GLU HB2 2.950 . 3.250 3.036 2.998 3.046 . 0 0 "[ . 1 . 2]" 1
1116 2 7 GLU HA 2 7 GLU HB3 2.710 . 2.980 2.546 2.500 2.716 . 0 0 "[ . 1 . 2]" 1
1117 2 7 GLU HA 2 7 GLU QG 3.020 . 3.320 2.778 2.422 3.090 . 0 0 "[ . 1 . 2]" 1
1118 2 7 GLU HA 2 8 GLN H 3.550 . 3.900 3.576 3.552 3.597 . 0 0 "[ . 1 . 2]" 1
1119 2 7 GLU HA 2 9 ILE H 4.980 . 5.480 5.039 4.899 5.348 . 0 0 "[ . 1 . 2]" 1
1120 2 7 GLU HA 2 10 LEU H 3.970 . 4.370 4.047 3.848 4.436 0.066 19 0 "[ . 1 . 2]" 1
1121 2 7 GLU HA 2 10 LEU HB2 4.840 . 5.320 4.098 3.632 4.917 . 0 0 "[ . 1 . 2]" 1
1122 2 7 GLU HA 2 10 LEU QB 4.010 . 4.410 3.042 2.658 3.597 . 0 0 "[ . 1 . 2]" 1
1123 2 7 GLU HA 2 10 LEU HB3 3.170 . 3.490 3.139 2.715 3.698 0.208 19 0 "[ . 1 . 2]" 1
1124 2 7 GLU HA 2 11 ALA H 3.480 . 3.830 3.880 3.734 3.966 0.136 9 0 "[ . 1 . 2]" 1
1125 2 7 GLU QB 2 11 ALA MB 3.720 . 4.090 3.941 3.784 4.034 . 0 0 "[ . 1 . 2]" 1
1126 2 7 GLU HB2 2 8 GLN H 3.020 . 3.320 2.774 2.669 3.162 . 0 0 "[ . 1 . 2]" 1
1127 2 7 GLU HB2 2 8 GLN HE21 3.720 . 4.090 3.108 2.942 3.797 . 0 0 "[ . 1 . 2]" 1
1128 2 7 GLU HB2 2 8 GLN HE22 2.910 . 3.200 2.098 1.943 2.794 . 0 0 "[ . 1 . 2]" 1
1129 2 7 GLU HB2 2 11 ALA MB 5.100 . 5.610 5.135 5.020 5.310 . 0 0 "[ . 1 . 2]" 1
1130 2 7 GLU HB3 2 7 GLU QG 2.430 . 2.670 2.327 2.176 2.371 . 0 0 "[ . 1 . 2]" 1
1131 2 7 GLU HB3 2 8 GLN H 3.280 . 3.610 3.675 3.566 3.743 0.133 20 0 "[ . 1 . 2]" 1
1132 2 7 GLU HB3 2 8 GLN HE21 2.950 . 3.250 3.195 2.937 3.346 0.096 3 0 "[ . 1 . 2]" 1
1133 2 7 GLU HB3 2 8 GLN HE22 2.910 . 3.200 2.968 2.794 3.109 . 0 0 "[ . 1 . 2]" 1
1134 2 7 GLU HB3 2 11 ALA MB 3.780 . 4.160 4.094 3.913 4.211 0.051 20 0 "[ . 1 . 2]" 1
1135 2 8 GLN H 2 8 GLN HA 2.750 . 3.030 2.848 2.827 2.875 . 0 0 "[ . 1 . 2]" 1
1136 2 8 GLN H 2 8 GLN QB 2.920 . 3.210 2.607 2.569 2.642 . 0 0 "[ . 1 . 2]" 1
1137 2 8 GLN H 2 8 GLN HE21 3.460 . 3.810 3.850 3.811 3.903 0.093 18 0 "[ . 1 . 2]" 1
1138 2 8 GLN H 2 8 GLN HE22 2.040 . 2.240 2.304 2.267 2.341 0.101 13 0 "[ . 1 . 2]" 1
1139 2 8 GLN H 2 8 GLN HG2 3.030 . 3.330 2.511 2.423 2.620 . 0 0 "[ . 1 . 2]" 1
1140 2 8 GLN H 2 8 GLN HG3 4.140 . 4.550 3.931 3.863 3.994 . 0 0 "[ . 1 . 2]" 1
1141 2 8 GLN H 2 9 ILE H 3.060 . 3.370 2.762 2.678 2.872 . 0 0 "[ . 1 . 2]" 1
1142 2 8 GLN H 2 10 LEU H 4.440 . 4.880 4.020 3.879 4.146 . 0 0 "[ . 1 . 2]" 1
1143 2 8 GLN HA 2 8 GLN HE21 3.050 . 3.360 3.367 3.267 3.413 0.053 8 0 "[ . 1 . 2]" 1
1144 2 8 GLN HA 2 8 GLN HE22 2.910 . 3.200 3.046 2.955 3.114 . 0 0 "[ . 1 . 2]" 1
1145 2 8 GLN HA 2 8 GLN HG2 3.420 . 3.760 3.495 3.463 3.551 . 0 0 "[ . 1 . 2]" 1
1146 2 8 GLN HA 2 8 GLN HG3 3.450 . 3.790 3.735 3.694 3.773 . 0 0 "[ . 1 . 2]" 1
1147 2 8 GLN HA 2 10 LEU H 5.240 . 5.760 4.647 4.454 4.836 . 0 0 "[ . 1 . 2]" 1
1148 2 8 GLN HA 2 11 ALA H 4.500 . 4.950 3.820 3.514 4.163 . 0 0 "[ . 1 . 2]" 1
1149 2 8 GLN HA 2 11 ALA MB 4.300 . 4.730 2.957 2.702 3.312 . 0 0 "[ . 1 . 2]" 1
1150 2 8 GLN QB 2 8 GLN HG2 2.540 . 2.790 2.263 2.249 2.281 . 0 0 "[ . 1 . 2]" 1
1151 2 8 GLN QB 2 8 GLN HG3 2.490 . 2.740 2.167 2.160 2.176 . 0 0 "[ . 1 . 2]" 1
1152 2 8 GLN QB 2 9 ILE H 3.140 . 3.450 2.318 2.171 2.429 . 0 0 "[ . 1 . 2]" 1
1153 2 8 GLN HE21 2 9 ILE H 5.890 . 6.480 6.154 6.095 6.206 . 0 0 "[ . 1 . 2]" 1
1154 2 8 GLN HE21 2 11 ALA MB 4.320 . 4.750 4.702 4.453 4.927 0.177 19 0 "[ . 1 . 2]" 1
1155 2 8 GLN HE22 2 8 GLN HG3 3.530 . 3.880 3.478 3.461 3.512 . 0 0 "[ . 1 . 2]" 1
1156 2 8 GLN HE22 2 9 ILE H 4.790 . 5.270 4.855 4.811 4.920 . 0 0 "[ . 1 . 2]" 1
1157 2 8 GLN HE22 2 11 ALA MB 4.890 . 5.380 4.887 4.755 5.063 . 0 0 "[ . 1 . 2]" 1
1158 2 9 ILE H 2 9 ILE HB 2.650 . 2.920 2.769 2.710 2.834 . 0 0 "[ . 1 . 2]" 1
1159 2 9 ILE H 2 9 ILE HG12 3.000 . 3.300 3.197 3.134 3.239 . 0 0 "[ . 1 . 2]" 1
1160 2 9 ILE H 2 9 ILE HG13 3.980 . 4.380 2.000 1.929 2.138 . 0 0 "[ . 1 . 2]" 1
1161 2 9 ILE H 2 9 ILE MG 4.390 . 4.830 3.832 3.809 3.850 . 0 0 "[ . 1 . 2]" 1
1162 2 9 ILE H 2 10 LEU H 2.900 . 3.190 2.634 2.577 2.721 . 0 0 "[ . 1 . 2]" 1
1163 2 9 ILE H 2 11 ALA H 4.140 . 4.550 4.134 4.038 4.317 . 0 0 "[ . 1 . 2]" 1
1164 2 9 ILE HA 2 9 ILE MD 3.800 . 4.180 3.959 3.879 3.990 . 0 0 "[ . 1 . 2]" 1
1165 2 9 ILE HA 2 9 ILE HG12 2.670 . 2.940 2.776 2.635 2.847 . 0 0 "[ . 1 . 2]" 1
1166 2 9 ILE HA 2 9 ILE HG13 3.590 . 3.950 3.262 3.229 3.303 . 0 0 "[ . 1 . 2]" 1
1167 2 9 ILE HA 2 9 ILE MG 3.390 . 3.730 2.344 2.303 2.378 . 0 0 "[ . 1 . 2]" 1
1168 2 9 ILE HA 2 10 LEU H 3.570 . 3.930 3.567 3.540 3.612 . 0 0 "[ . 1 . 2]" 1
1169 2 9 ILE HA 2 11 ALA H 4.800 . 5.280 4.426 4.311 4.575 . 0 0 "[ . 1 . 2]" 1
1170 2 9 ILE HA 2 12 GLU H 4.430 . 4.870 3.547 3.324 3.667 . 0 0 "[ . 1 . 2]" 1
1171 2 9 ILE HA 2 12 GLU QB 4.170 . 4.590 2.741 2.555 2.985 . 0 0 "[ . 1 . 2]" 1
1172 2 9 ILE HA 2 13 ASN H 4.750 . 5.220 4.152 4.067 4.216 . 0 0 "[ . 1 . 2]" 1
1173 2 9 ILE HB 2 9 ILE HG12 2.960 . 3.260 3.060 3.055 3.067 . 0 0 "[ . 1 . 2]" 1
1174 2 9 ILE HB 2 9 ILE HG13 2.430 . 2.670 2.514 2.476 2.538 . 0 0 "[ . 1 . 2]" 1
1175 2 9 ILE HB 2 10 LEU H 2.500 . 2.750 2.777 2.737 2.881 0.131 19 0 "[ . 1 . 2]" 1
1176 2 9 ILE MD 2 9 ILE MG 3.300 . 3.630 1.990 1.954 2.028 . 0 0 "[ . 1 . 2]" 1
1177 2 9 ILE HG13 2 9 ILE MG 3.170 . 3.490 3.245 3.237 3.254 . 0 0 "[ . 1 . 2]" 1
1178 2 9 ILE MG 2 10 LEU H 3.370 . 3.710 3.811 3.761 3.857 0.147 20 0 "[ . 1 . 2]" 1
1179 2 9 ILE MG 2 10 LEU HA 3.710 . 4.080 3.874 3.754 3.983 . 0 0 "[ . 1 . 2]" 1
1180 2 9 ILE MG 2 10 LEU HB2 4.560 . 5.020 4.881 4.743 5.043 0.023 20 0 "[ . 1 . 2]" 1
1181 2 9 ILE MG 2 10 LEU HB3 5.360 . 5.900 5.783 5.663 5.952 0.052 17 0 "[ . 1 . 2]" 1
1182 2 9 ILE MG 2 13 ASN H 5.500 . 6.050 4.009 3.902 4.117 . 0 0 "[ . 1 . 2]" 1
1183 2 9 ILE MG 2 13 ASN HB2 4.900 . 5.390 3.139 2.937 3.511 . 0 0 "[ . 1 . 2]" 1
1184 2 9 ILE MG 2 13 ASN HB3 5.110 . 5.620 4.379 4.034 4.595 . 0 0 "[ . 1 . 2]" 1
1185 2 9 ILE MG 2 13 ASN HD21 5.200 . 5.720 5.250 4.886 5.955 0.235 17 0 "[ . 1 . 2]" 1
1186 2 10 LEU H 2 10 LEU HA 2.890 . 3.180 2.863 2.846 2.886 . 0 0 "[ . 1 . 2]" 1
1187 2 10 LEU H 2 10 LEU HB2 2.360 . 2.600 2.383 2.285 2.507 . 0 0 "[ . 1 . 2]" 1
1188 2 10 LEU H 2 10 LEU HB3 3.080 . 3.390 2.782 2.681 2.952 . 0 0 "[ . 1 . 2]" 1
1189 2 10 LEU H 2 11 ALA H 2.820 . 3.100 2.619 2.545 2.690 . 0 0 "[ . 1 . 2]" 1
1190 2 10 LEU H 2 11 ALA MB 5.100 . 5.610 4.334 4.253 4.421 . 0 0 "[ . 1 . 2]" 1
1191 2 10 LEU H 2 12 GLU H 4.500 . 4.950 4.158 4.001 4.340 . 0 0 "[ . 1 . 2]" 1
1192 2 10 LEU H 2 13 ASN H 4.910 . 5.400 4.473 4.369 4.572 . 0 0 "[ . 1 . 2]" 1
1193 2 10 LEU H 2 13 ASN HB2 5.200 . 5.720 4.857 4.645 5.059 . 0 0 "[ . 1 . 2]" 1
1194 2 10 LEU H 2 13 ASN HB3 4.980 . 5.480 4.745 4.514 4.925 . 0 0 "[ . 1 . 2]" 1
1195 2 10 LEU HA 2 11 ALA H 3.570 . 3.930 3.558 3.518 3.597 . 0 0 "[ . 1 . 2]" 1
1196 2 10 LEU HA 2 11 ALA HA 4.860 . 5.350 4.863 4.832 4.907 . 0 0 "[ . 1 . 2]" 1
1197 2 10 LEU HA 2 13 ASN H 3.260 . 3.590 3.089 2.857 3.245 . 0 0 "[ . 1 . 2]" 1
1198 2 10 LEU HA 2 13 ASN HB2 3.160 . 3.480 2.747 2.502 2.914 . 0 0 "[ . 1 . 2]" 1
1199 2 10 LEU HA 2 13 ASN HB3 2.340 . 2.570 2.044 1.865 2.179 . 0 0 "[ . 1 . 2]" 1
1200 2 10 LEU HB2 2 10 LEU HG 2.980 . 3.280 2.519 2.352 3.050 . 0 0 "[ . 1 . 2]" 1
1201 2 10 LEU HB2 2 11 ALA H 3.560 . 3.920 3.877 3.697 3.999 0.079 16 0 "[ . 1 . 2]" 1
1202 2 10 LEU HB3 2 10 LEU QD 2.450 . 2.700 2.335 2.279 2.408 . 0 0 "[ . 1 . 2]" 1
1203 2 10 LEU HB3 2 10 LEU HG 2.430 . 2.670 2.518 2.461 2.567 . 0 0 "[ . 1 . 2]" 1
1204 2 10 LEU HB3 2 11 ALA H 2.790 . 3.070 2.899 2.766 2.990 . 0 0 "[ . 1 . 2]" 1
1205 2 10 LEU HB3 2 11 ALA MB 4.800 . 5.280 4.262 4.143 4.459 . 0 0 "[ . 1 . 2]" 1
1206 2 10 LEU QD 2 11 ALA H 4.900 . 5.390 3.871 3.667 4.283 . 0 0 "[ . 1 . 2]" 1
1207 2 10 LEU QD 2 13 ASN QB 5.250 . 5.780 2.314 1.993 2.489 . 0 0 "[ . 1 . 2]" 1
1208 2 11 ALA H 2 11 ALA HA 2.730 . 3.000 2.842 2.825 2.867 . 0 0 "[ . 1 . 2]" 1
1209 2 11 ALA H 2 11 ALA MB 2.750 . 3.030 2.283 2.261 2.303 . 0 0 "[ . 1 . 2]" 1
1210 2 11 ALA H 2 12 GLU H 2.920 . 3.210 2.664 2.583 2.737 . 0 0 "[ . 1 . 2]" 1
1211 2 11 ALA H 2 13 ASN H 3.990 . 4.390 3.900 3.765 4.008 . 0 0 "[ . 1 . 2]" 1
1212 2 11 ALA HA 2 14 GLU H 4.410 . 4.850 3.633 3.455 3.928 . 0 0 "[ . 1 . 2]" 1
1213 2 11 ALA MB 2 12 GLU H 3.280 . 3.610 2.483 2.418 2.683 . 0 0 "[ . 1 . 2]" 1
1214 2 11 ALA MB 2 13 ASN H 5.200 . 5.720 4.447 4.352 4.524 . 0 0 "[ . 1 . 2]" 1
1215 2 12 GLU H 2 12 GLU HA 2.840 . 3.120 2.836 2.818 2.876 . 0 0 "[ . 1 . 2]" 1
1216 2 12 GLU H 2 13 ASN H 2.530 . 2.780 2.600 2.438 2.673 . 0 0 "[ . 1 . 2]" 1
1217 2 12 GLU HA 2 12 GLU QG 2.780 . 3.060 2.872 2.775 3.034 . 0 0 "[ . 1 . 2]" 1
1218 2 12 GLU HA 2 13 ASN H 3.570 . 3.930 3.531 3.500 3.548 . 0 0 "[ . 1 . 2]" 1
1219 2 12 GLU HA 2 15 LYS H 3.550 . 3.900 3.523 3.325 3.668 . 0 0 "[ . 1 . 2]" 1
1220 2 12 GLU HA 2 15 LYS QB 2.700 . 2.970 2.603 2.364 2.795 . 0 0 "[ . 1 . 2]" 1
1221 2 12 GLU HA 2 15 LYS QE 3.660 . 4.030 3.580 3.053 3.991 . 0 0 "[ . 1 . 2]" 1
1222 2 12 GLU HA 2 15 LYS QG 4.670 . 5.140 4.620 4.332 4.880 . 0 0 "[ . 1 . 2]" 1
1223 2 12 GLU HA 2 16 LEU H 4.500 . 4.950 4.220 3.982 4.431 . 0 0 "[ . 1 . 2]" 1
1224 2 12 GLU QB 2 15 LYS QE 5.100 . 5.610 4.727 4.277 5.174 . 0 0 "[ . 1 . 2]" 1
1225 2 12 GLU QG 2 13 ASN H 4.620 . 5.080 3.814 3.524 4.023 . 0 0 "[ . 1 . 2]" 1
1226 2 12 GLU QG 2 15 LYS QG 4.840 . 5.320 5.496 5.352 5.658 0.338 9 0 "[ . 1 . 2]" 1
1227 2 13 ASN H 2 13 ASN HB2 2.800 . 3.080 2.498 2.423 2.601 . 0 0 "[ . 1 . 2]" 1
1228 2 13 ASN H 2 13 ASN QB 2.550 . 2.800 2.221 2.168 2.247 . 0 0 "[ . 1 . 2]" 1
1229 2 13 ASN H 2 13 ASN HB3 2.590 . 2.850 2.499 2.362 2.638 . 0 0 "[ . 1 . 2]" 1
1230 2 13 ASN H 2 14 GLU H 2.870 . 3.160 2.611 2.470 2.746 . 0 0 "[ . 1 . 2]" 1
1231 2 13 ASN H 2 14 GLU QB 5.300 . 5.830 4.226 4.070 4.484 . 0 0 "[ . 1 . 2]" 1
1232 2 13 ASN H 2 15 LYS H 4.090 . 4.500 4.122 3.902 4.331 . 0 0 "[ . 1 . 2]" 1
1233 2 13 ASN H 2 16 LEU H 4.870 . 5.360 4.568 4.479 4.669 . 0 0 "[ . 1 . 2]" 1
1234 2 13 ASN H 2 16 LEU QB 5.400 . 5.940 4.824 4.673 5.049 . 0 0 "[ . 1 . 2]" 1
1235 2 13 ASN HA 2 14 GLU H 3.570 . 3.930 3.528 3.491 3.558 . 0 0 "[ . 1 . 2]" 1
1236 2 13 ASN HA 2 16 LEU H 3.960 . 4.360 3.402 3.203 3.597 . 0 0 "[ . 1 . 2]" 1
1237 2 13 ASN HA 2 16 LEU QB 3.760 . 4.140 2.462 2.233 2.648 . 0 0 "[ . 1 . 2]" 1
1238 2 13 ASN HA 2 17 LYS H 4.760 . 5.240 4.336 4.129 4.646 . 0 0 "[ . 1 . 2]" 1
1239 2 13 ASN QB 2 15 LYS H 5.200 . 5.720 4.836 4.620 4.941 . 0 0 "[ . 1 . 2]" 1
1240 2 13 ASN HB2 2 14 GLU H 3.770 . 4.150 3.846 3.745 3.947 . 0 0 "[ . 1 . 2]" 1
1241 2 13 ASN HB3 2 14 GLU H 2.370 . 2.610 2.593 2.432 2.669 0.059 3 0 "[ . 1 . 2]" 1
1242 2 13 ASN HB3 2 15 LYS H 4.940 . 5.430 5.122 4.891 5.237 . 0 0 "[ . 1 . 2]" 1
1243 2 14 GLU H 2 14 GLU HA 2.860 . 3.150 2.816 2.768 2.874 . 0 0 "[ . 1 . 2]" 1
1244 2 14 GLU H 2 14 GLU QB 2.620 . 2.880 2.130 2.086 2.229 . 0 0 "[ . 1 . 2]" 1
1245 2 14 GLU H 2 14 GLU HG2 3.810 . 4.190 4.030 3.077 4.185 . 0 0 "[ . 1 . 2]" 1
1246 2 14 GLU H 2 14 GLU HG3 4.380 . 4.820 4.495 4.218 4.553 . 0 0 "[ . 1 . 2]" 1
1247 2 14 GLU H 2 15 LYS H 2.820 . 3.100 2.697 2.444 2.807 . 0 0 "[ . 1 . 2]" 1
1248 2 14 GLU H 2 16 LEU H 4.110 . 4.520 3.940 3.785 4.084 . 0 0 "[ . 1 . 2]" 1
1249 2 14 GLU HA 2 14 GLU QG 3.330 . 3.660 2.858 2.766 3.298 . 0 0 "[ . 1 . 2]" 1
1250 2 14 GLU HA 2 15 LYS H 3.560 . 3.920 3.555 3.523 3.580 . 0 0 "[ . 1 . 2]" 1
1251 2 14 GLU HA 2 17 LYS QB 3.800 . 4.180 2.784 2.167 3.218 . 0 0 "[ . 1 . 2]" 1
1252 2 14 GLU HA 2 18 ALA H 4.990 . 5.490 4.479 4.263 4.630 . 0 0 "[ . 1 . 2]" 1
1253 2 14 GLU QB 2 15 LYS H 3.430 . 3.770 2.679 2.491 3.374 . 0 0 "[ . 1 . 2]" 1
1254 2 14 GLU QB 2 16 LEU H 5.500 . 6.050 4.753 4.619 5.110 . 0 0 "[ . 1 . 2]" 1
1255 2 14 GLU QG 2 15 LYS H 3.480 . 3.830 2.659 2.214 2.782 . 0 0 "[ . 1 . 2]" 1
1256 2 14 GLU QG 2 18 ALA MB 3.740 . 4.110 3.628 3.265 3.933 . 0 0 "[ . 1 . 2]" 1
1257 2 14 GLU HG2 2 15 LYS H 2.440 . 2.680 2.716 2.240 2.863 0.183 9 0 "[ . 1 . 2]" 1
1258 2 14 GLU HG2 2 15 LYS HA 3.080 . 3.390 3.232 2.935 3.464 0.074 11 0 "[ . 1 . 2]" 1
1259 2 14 GLU HG2 2 18 ALA H 5.400 . 5.940 5.247 5.007 5.597 . 0 0 "[ . 1 . 2]" 1
1260 2 14 GLU HG3 2 15 LYS H 3.440 . 3.780 3.815 3.462 3.889 0.109 20 0 "[ . 1 . 2]" 1
1261 2 14 GLU HG3 2 15 LYS HA 3.460 . 3.810 4.013 3.609 4.102 0.292 3 0 "[ . 1 . 2]" 1
1262 2 14 GLU HG3 2 18 ALA H 4.650 . 5.120 4.801 4.513 5.066 . 0 0 "[ . 1 . 2]" 1
1263 2 14 GLU HG3 2 18 ALA MB 4.380 . 4.820 3.908 3.470 4.234 . 0 0 "[ . 1 . 2]" 1
1264 2 15 LYS H 2 15 LYS HA 2.760 . 3.040 2.777 2.761 2.824 . 0 0 "[ . 1 . 2]" 1
1265 2 15 LYS H 2 15 LYS QB 2.530 . 2.780 2.260 2.228 2.295 . 0 0 "[ . 1 . 2]" 1
1266 2 15 LYS H 2 15 LYS QE 4.790 . 5.270 4.444 4.268 4.673 . 0 0 "[ . 1 . 2]" 1
1267 2 15 LYS H 2 15 LYS QG 4.470 . 4.920 4.011 3.988 4.039 . 0 0 "[ . 1 . 2]" 1
1268 2 15 LYS H 2 16 LEU H 2.710 . 2.980 2.709 2.559 2.764 . 0 0 "[ . 1 . 2]" 1
1269 2 15 LYS H 2 16 LEU QB 5.520 . 6.070 4.697 4.519 4.795 . 0 0 "[ . 1 . 2]" 1
1270 2 15 LYS HA 2 15 LYS QG 2.930 . 3.220 2.537 2.429 2.603 . 0 0 "[ . 1 . 2]" 1
1271 2 15 LYS HA 2 18 ALA H 3.440 . 3.780 3.485 3.342 3.613 . 0 0 "[ . 1 . 2]" 1
1272 2 15 LYS HA 2 18 ALA MB 3.200 . 3.520 2.716 2.453 2.992 . 0 0 "[ . 1 . 2]" 1
1273 2 15 LYS HA 2 19 GLN H 4.150 . 4.570 4.136 4.068 4.274 . 0 0 "[ . 1 . 2]" 1
1274 2 15 LYS QB 2 15 LYS QD 3.200 . 3.520 2.403 2.365 2.427 . 0 0 "[ . 1 . 2]" 1
1275 2 15 LYS QB 2 15 LYS QE 3.230 . 3.550 2.108 2.032 2.209 . 0 0 "[ . 1 . 2]" 1
1276 2 15 LYS QB 2 16 LEU H 3.120 . 3.430 2.583 2.460 2.740 . 0 0 "[ . 1 . 2]" 1
1277 2 15 LYS QB 2 16 LEU HG 4.670 . 5.140 3.333 3.182 3.527 . 0 0 "[ . 1 . 2]" 1
1278 2 15 LYS QD 2 16 LEU H 4.820 . 5.300 4.807 4.611 4.951 . 0 0 "[ . 1 . 2]" 1
1279 2 15 LYS QD 2 19 GLN QB 5.410 . 5.950 4.379 4.104 4.672 . 0 0 "[ . 1 . 2]" 1
1280 2 15 LYS QD 2 19 GLN HG2 4.000 . 4.400 4.359 4.053 4.491 0.091 9 0 "[ . 1 . 2]" 1
1281 2 15 LYS QD 2 19 GLN QG 4.860 . 5.350 4.196 3.927 4.310 . 0 0 "[ . 1 . 2]" 1
1282 2 15 LYS QD 2 19 GLN HG3 5.400 . 5.940 5.469 5.267 5.593 . 0 0 "[ . 1 . 2]" 1
1283 2 15 LYS QE 2 15 LYS QG 3.220 . 3.540 2.337 2.307 2.377 . 0 0 "[ . 1 . 2]" 1
1284 2 15 LYS QE 2 16 LEU HA 3.080 . 3.390 3.179 2.878 3.460 0.070 16 0 "[ . 1 . 2]" 1
1285 2 15 LYS QE 2 16 LEU QB 4.770 . 5.250 4.162 3.925 4.432 . 0 0 "[ . 1 . 2]" 1
1286 2 15 LYS QE 2 16 LEU QD 4.730 . 5.200 2.327 2.155 2.610 . 0 0 "[ . 1 . 2]" 1
1287 2 15 LYS QE 2 16 LEU HG 2.720 . 2.990 2.707 2.361 3.018 0.028 4 0 "[ . 1 . 2]" 1
1288 2 15 LYS QE 2 19 GLN HE21 4.950 . 5.440 5.500 5.406 5.655 0.215 18 0 "[ . 1 . 2]" 1
1289 2 15 LYS QE 2 19 GLN QE 4.650 . 5.120 4.406 4.285 4.594 . 0 0 "[ . 1 . 2]" 1
1290 2 15 LYS QE 2 19 GLN HE22 4.570 . 5.030 4.639 4.493 4.860 . 0 0 "[ . 1 . 2]" 1
1291 2 15 LYS QG 2 16 LEU HG 5.320 . 5.850 4.724 4.388 5.106 . 0 0 "[ . 1 . 2]" 1
1292 2 15 LYS QG 2 19 GLN H 3.860 . 4.250 3.941 3.754 4.272 0.022 9 0 "[ . 1 . 2]" 1
1293 2 15 LYS QG 2 19 GLN HA 5.340 . 5.870 5.228 4.935 5.648 . 0 0 "[ . 1 . 2]" 1
1294 2 16 LEU H 2 16 LEU QB 2.960 . 3.260 2.392 2.348 2.473 . 0 0 "[ . 1 . 2]" 1
1295 2 16 LEU H 2 17 LYS H 2.700 . 2.970 2.592 2.507 2.753 . 0 0 "[ . 1 . 2]" 1
1296 2 16 LEU H 2 17 LYS HE3 5.470 . 6.020 5.572 4.780 6.066 0.046 20 0 "[ . 1 . 2]" 1
1297 2 16 LEU H 2 18 ALA H 4.280 . 4.710 4.047 3.922 4.193 . 0 0 "[ . 1 . 2]" 1
1298 2 16 LEU H 2 19 GLN H 5.020 . 5.520 4.781 4.676 4.836 . 0 0 "[ . 1 . 2]" 1
1299 2 16 LEU H 2 19 GLN QE 5.070 . 5.580 4.666 4.532 4.773 . 0 0 "[ . 1 . 2]" 1
1300 2 16 LEU H 2 19 GLN HE22 5.230 . 5.750 4.794 4.651 4.909 . 0 0 "[ . 1 . 2]" 1
1301 2 16 LEU HA 2 16 LEU QD 3.920 . 4.310 2.024 1.966 2.116 . 0 0 "[ . 1 . 2]" 1
1302 2 16 LEU HA 2 16 LEU HG 2.690 . 2.960 3.029 2.957 3.114 0.154 19 0 "[ . 1 . 2]" 1
1303 2 16 LEU HA 2 17 LYS H 3.540 . 3.890 3.502 3.466 3.576 . 0 0 "[ . 1 . 2]" 1
1304 2 16 LEU HA 2 18 ALA H 4.090 . 4.500 4.253 4.137 4.398 . 0 0 "[ . 1 . 2]" 1
1305 2 16 LEU HA 2 19 GLN H 3.600 . 3.960 3.523 3.388 3.658 . 0 0 "[ . 1 . 2]" 1
1306 2 16 LEU HA 2 19 GLN QB 4.250 . 4.680 3.855 3.785 3.963 . 0 0 "[ . 1 . 2]" 1
1307 2 16 LEU HA 2 19 GLN HG2 2.330 . 2.560 2.340 2.268 2.431 . 0 0 "[ . 1 . 2]" 1
1308 2 16 LEU HA 2 19 GLN QG 2.280 . 2.510 1.882 1.813 1.964 . 0 0 "[ . 1 . 2]" 1
1309 2 16 LEU HA 2 19 GLN HG3 2.530 . 2.780 1.984 1.899 2.087 . 0 0 "[ . 1 . 2]" 1
1310 2 16 LEU HA 2 20 LEU H 4.270 . 4.700 3.815 3.743 3.895 . 0 0 "[ . 1 . 2]" 1
1311 2 16 LEU QB 2 16 LEU MD1 3.090 . 3.400 2.146 2.129 2.159 . 0 0 "[ . 1 . 2]" 1
1312 2 16 LEU QB 2 17 LYS H 2.970 . 3.270 2.819 2.674 2.996 . 0 0 "[ . 1 . 2]" 1
1313 2 16 LEU QB 2 17 LYS QB 5.300 . 5.830 4.279 3.911 4.749 . 0 0 "[ . 1 . 2]" 1
1314 2 16 LEU QB 2 18 ALA H 5.100 . 5.610 4.773 4.673 4.867 . 0 0 "[ . 1 . 2]" 1
1315 2 16 LEU MD2 2 19 GLN HG2 4.950 . 5.440 2.592 2.390 2.899 . 0 0 "[ . 1 . 2]" 1
1316 2 16 LEU MD2 2 19 GLN HG3 4.970 . 5.470 3.313 3.168 3.542 . 0 0 "[ . 1 . 2]" 1
1317 2 16 LEU HG 2 19 GLN HG2 4.300 . 4.730 4.613 4.456 4.756 0.026 19 0 "[ . 1 . 2]" 1
1318 2 16 LEU HG 2 19 GLN QG 4.580 . 5.040 4.243 4.126 4.347 . 0 0 "[ . 1 . 2]" 1
1319 2 16 LEU HG 2 19 GLN HG3 4.860 . 5.350 4.957 4.860 5.042 . 0 0 "[ . 1 . 2]" 1
1320 2 17 LYS H 2 17 LYS HA 2.820 . 3.100 2.855 2.823 2.905 . 0 0 "[ . 1 . 2]" 1
1321 2 17 LYS H 2 17 LYS HB2 2.920 . 3.210 2.398 2.158 2.728 . 0 0 "[ . 1 . 2]" 1
1322 2 17 LYS H 2 17 LYS QB 3.100 . 3.410 2.266 2.112 2.501 . 0 0 "[ . 1 . 2]" 1
1323 2 17 LYS H 2 17 LYS HB3 3.590 . 3.950 3.097 2.220 3.657 . 0 0 "[ . 1 . 2]" 1
1324 2 17 LYS H 2 17 LYS QD 4.430 . 4.870 4.216 2.487 4.905 0.035 17 0 "[ . 1 . 2]" 1
1325 2 17 LYS H 2 17 LYS HE2 4.470 . 4.920 4.517 3.689 5.128 0.208 6 0 "[ . 1 . 2]" 1
1326 2 17 LYS H 2 17 LYS HE3 3.640 . 4.000 3.704 2.983 4.218 0.218 17 0 "[ . 1 . 2]" 1
1327 2 17 LYS H 2 17 LYS QG 4.070 . 4.480 3.453 2.307 4.103 . 0 0 "[ . 1 . 2]" 1
1328 2 17 LYS H 2 18 ALA H 2.400 . 2.640 2.540 2.407 2.621 . 0 0 "[ . 1 . 2]" 1
1329 2 17 LYS H 2 19 GLN QE 5.370 . 5.910 4.506 4.411 4.610 . 0 0 "[ . 1 . 2]" 1
1330 2 17 LYS H 2 19 GLN HE22 4.770 . 5.250 4.618 4.519 4.726 . 0 0 "[ . 1 . 2]" 1
1331 2 17 LYS H 2 19 GLN HG2 4.860 . 5.350 5.469 5.387 5.569 0.219 13 0 "[ . 1 . 2]" 1
1332 2 17 LYS H 2 19 GLN QG 4.590 . 5.050 4.150 4.071 4.245 . 0 0 "[ . 1 . 2]" 1
1333 2 17 LYS H 2 19 GLN HG3 4.310 . 4.740 4.299 4.210 4.402 . 0 0 "[ . 1 . 2]" 1
1334 2 17 LYS H 2 20 LEU QD 5.500 . 6.050 3.869 3.771 3.961 . 0 0 "[ . 1 . 2]" 1
1335 2 17 LYS HA 2 17 LYS QD 4.050 . 4.460 3.344 2.047 4.331 . 0 0 "[ . 1 . 2]" 1
1336 2 17 LYS HA 2 18 ALA H 3.530 . 3.880 3.523 3.486 3.553 . 0 0 "[ . 1 . 2]" 1
1337 2 17 LYS HA 2 18 ALA HA 4.720 . 5.190 4.819 4.786 4.856 . 0 0 "[ . 1 . 2]" 1
1338 2 17 LYS HA 2 20 LEU QB 4.750 . 5.220 3.771 3.201 4.089 . 0 0 "[ . 1 . 2]" 1
1339 2 17 LYS QB 2 17 LYS QE 4.010 . 4.410 2.010 1.882 2.178 . 0 0 "[ . 1 . 2]" 1
1340 2 17 LYS QB 2 18 ALA H 3.330 . 3.660 2.716 2.488 2.974 . 0 0 "[ . 1 . 2]" 1
1341 2 17 LYS QB 2 18 ALA HA 4.430 . 4.870 4.027 3.784 4.382 . 0 0 "[ . 1 . 2]" 1
1342 2 17 LYS QB 2 20 LEU QD 5.300 . 5.830 3.533 3.247 3.801 . 0 0 "[ . 1 . 2]" 1
1343 2 17 LYS HB2 2 17 LYS QG 2.440 . 2.680 2.354 2.160 2.503 . 0 0 "[ . 1 . 2]" 1
1344 2 17 LYS QD 2 20 LEU QD 4.360 . 4.800 3.518 1.817 4.819 0.019 19 0 "[ . 1 . 2]" 1
1345 2 17 LYS QE 2 18 ALA H 5.450 . 6.000 4.407 2.933 5.158 . 0 0 "[ . 1 . 2]" 1
1346 2 17 LYS HE3 2 18 ALA H 4.790 . 5.270 4.583 2.969 5.330 0.060 6 0 "[ . 1 . 2]" 1
1347 2 17 LYS QG 2 18 ALA H 4.520 . 4.970 4.231 3.420 4.702 . 0 0 "[ . 1 . 2]" 1
1348 2 18 ALA H 2 18 ALA HA 2.870 . 3.160 2.871 2.849 2.892 . 0 0 "[ . 1 . 2]" 1
1349 2 18 ALA H 2 18 ALA MB 2.920 . 3.210 2.242 2.216 2.267 . 0 0 "[ . 1 . 2]" 1
1350 2 18 ALA H 2 19 GLN H 2.570 . 2.830 2.564 2.488 2.656 . 0 0 "[ . 1 . 2]" 1
1351 2 18 ALA H 2 19 GLN HG2 4.730 . 5.200 5.250 5.202 5.290 0.090 3 0 "[ . 1 . 2]" 1
1352 2 18 ALA H 2 19 GLN QG 4.020 . 4.420 3.801 3.719 3.895 . 0 0 "[ . 1 . 2]" 1
1353 2 18 ALA H 2 19 GLN HG3 3.710 . 4.080 3.901 3.809 4.010 . 0 0 "[ . 1 . 2]" 1
1354 2 18 ALA H 2 20 LEU H 4.490 . 4.940 4.064 3.978 4.150 . 0 0 "[ . 1 . 2]" 1
1355 2 18 ALA HA 2 21 HIS H 3.510 . 3.860 3.782 3.604 3.882 0.022 13 0 "[ . 1 . 2]" 1
1356 2 18 ALA HA 2 21 HIS HB2 3.370 . 3.710 3.665 3.222 3.801 0.091 8 0 "[ . 1 . 2]" 1
1357 2 18 ALA HA 2 21 HIS HB3 2.850 . 3.130 2.927 2.533 3.173 0.043 3 0 "[ . 1 . 2]" 1
1358 2 18 ALA HA 2 22 ASP H 4.500 . 4.950 4.373 4.145 4.521 . 0 0 "[ . 1 . 2]" 1
1359 2 18 ALA MB 2 19 GLN H 3.150 . 3.470 2.524 2.418 2.660 . 0 0 "[ . 1 . 2]" 1
1360 2 18 ALA MB 2 19 GLN QG 5.200 . 5.720 4.009 3.901 4.109 . 0 0 "[ . 1 . 2]" 1
1361 2 18 ALA MB 2 20 LEU H 5.200 . 5.720 4.573 4.516 4.670 . 0 0 "[ . 1 . 2]" 1
1362 2 18 ALA MB 2 21 HIS QB 5.500 . 6.050 4.084 3.816 4.239 . 0 0 "[ . 1 . 2]" 1
1363 2 18 ALA MB 2 21 HIS HB3 5.000 . 5.500 4.294 3.956 4.478 . 0 0 "[ . 1 . 2]" 1
1364 2 19 GLN H 2 19 GLN HA 2.770 . 3.050 2.850 2.825 2.877 . 0 0 "[ . 1 . 2]" 1
1365 2 19 GLN H 2 19 GLN QB 3.160 . 3.480 2.594 2.522 2.664 . 0 0 "[ . 1 . 2]" 1
1366 2 19 GLN H 2 19 GLN HE21 5.570 . 6.130 5.316 5.200 5.440 . 0 0 "[ . 1 . 2]" 1
1367 2 19 GLN H 2 19 GLN QE 4.900 . 5.390 3.942 3.833 4.042 . 0 0 "[ . 1 . 2]" 1
1368 2 19 GLN H 2 19 GLN HE22 4.230 . 4.650 4.064 3.947 4.174 . 0 0 "[ . 1 . 2]" 1
1369 2 19 GLN H 2 19 GLN HG2 3.010 . 3.310 3.357 3.325 3.396 0.086 19 0 "[ . 1 . 2]" 1
1370 2 19 GLN H 2 19 GLN QG 2.340 . 2.570 2.071 1.985 2.155 . 0 0 "[ . 1 . 2]" 1
1371 2 19 GLN H 2 19 GLN HG3 2.140 . 2.350 2.091 2.000 2.180 . 0 0 "[ . 1 . 2]" 1
1372 2 19 GLN H 2 20 LEU H 3.060 . 3.370 2.609 2.508 2.684 . 0 0 "[ . 1 . 2]" 1
1373 2 19 GLN H 2 20 LEU HG 4.860 . 5.350 4.872 4.493 5.151 . 0 0 "[ . 1 . 2]" 1
1374 2 19 GLN H 2 21 HIS H 4.350 . 4.790 4.092 3.935 4.241 . 0 0 "[ . 1 . 2]" 1
1375 2 19 GLN HA 2 19 GLN QB 2.460 . 2.710 2.193 2.189 2.199 . 0 0 "[ . 1 . 2]" 1
1376 2 19 GLN HA 2 19 GLN QG 3.780 . 4.160 3.489 3.475 3.505 . 0 0 "[ . 1 . 2]" 1
1377 2 19 GLN HA 2 20 LEU H 3.560 . 3.920 3.584 3.566 3.611 . 0 0 "[ . 1 . 2]" 1
1378 2 19 GLN QB 2 19 GLN HG2 2.550 . 2.800 2.171 2.162 2.177 . 0 0 "[ . 1 . 2]" 1
1379 2 19 GLN QB 2 20 LEU H 3.620 . 3.980 3.528 3.488 3.574 . 0 0 "[ . 1 . 2]" 1
1380 2 19 GLN QE 2 20 LEU H 3.280 . 3.610 2.756 2.682 2.811 . 0 0 "[ . 1 . 2]" 1
1381 2 19 GLN QE 2 20 LEU HA 4.280 . 4.710 3.385 3.218 3.542 . 0 0 "[ . 1 . 2]" 1
1382 2 19 GLN HE21 2 20 LEU H 3.980 . 4.380 3.614 3.519 3.729 . 0 0 "[ . 1 . 2]" 1
1383 2 19 GLN HE21 2 20 LEU HA 5.270 . 5.800 3.590 3.381 3.768 . 0 0 "[ . 1 . 2]" 1
1384 2 19 GLN HE22 2 20 LEU H 2.880 . 3.170 2.859 2.774 2.915 . 0 0 "[ . 1 . 2]" 1
1385 2 19 GLN HE22 2 20 LEU HA 5.060 . 5.570 4.148 3.971 4.319 . 0 0 "[ . 1 . 2]" 1
1386 2 19 GLN QG 2 20 LEU H 2.620 . 2.880 2.318 2.245 2.375 . 0 0 "[ . 1 . 2]" 1
1387 2 19 GLN QG 2 20 LEU QB 4.930 . 5.420 3.646 3.544 3.798 . 0 0 "[ . 1 . 2]" 1
1388 2 19 GLN QG 2 20 LEU HG 5.030 . 5.530 4.865 4.528 5.215 . 0 0 "[ . 1 . 2]" 1
1389 2 19 GLN HG2 2 20 LEU H 3.470 . 3.820 3.919 3.877 3.987 0.167 16 0 "[ . 1 . 2]" 1
1390 2 19 GLN HG2 2 20 LEU QB 5.500 . 6.050 4.950 4.823 5.092 . 0 0 "[ . 1 . 2]" 1
1391 2 19 GLN HG3 2 20 LEU H 2.200 . 2.420 2.335 2.259 2.394 . 0 0 "[ . 1 . 2]" 1
1392 2 19 GLN HG3 2 20 LEU QB 4.110 . 4.520 3.753 3.646 3.924 . 0 0 "[ . 1 . 2]" 1
1393 2 20 LEU H 2 20 LEU HA 2.800 . 3.080 2.839 2.823 2.860 . 0 0 "[ . 1 . 2]" 1
1394 2 20 LEU H 2 20 LEU QB 2.890 . 3.180 2.361 2.249 2.477 . 0 0 "[ . 1 . 2]" 1
1395 2 20 LEU H 2 20 LEU QD 4.450 . 4.890 3.270 3.212 3.384 . 0 0 "[ . 1 . 2]" 1
1396 2 20 LEU H 2 20 LEU HG 2.970 . 3.270 2.939 2.652 3.237 . 0 0 "[ . 1 . 2]" 1
1397 2 20 LEU H 2 21 HIS H 2.880 . 3.170 2.627 2.530 2.707 . 0 0 "[ . 1 . 2]" 1
1398 2 20 LEU H 2 22 ASP H 4.320 . 4.750 4.146 3.983 4.349 . 0 0 "[ . 1 . 2]" 1
1399 2 20 LEU HA 2 20 LEU QB 2.450 . 2.700 2.167 2.158 2.177 . 0 0 "[ . 1 . 2]" 1
1400 2 20 LEU HA 2 20 LEU HG 3.750 . 4.130 3.840 3.808 3.880 . 0 0 "[ . 1 . 2]" 1
1401 2 20 LEU QB 2 21 HIS H 3.750 . 4.130 3.449 3.359 3.516 . 0 0 "[ . 1 . 2]" 1
1402 2 20 LEU QD 2 21 HIS H 3.460 . 3.810 2.905 2.614 3.104 . 0 0 "[ . 1 . 2]" 1
1403 2 20 LEU HG 2 21 HIS H 2.200 . 2.420 2.154 1.978 2.306 . 0 0 "[ . 1 . 2]" 1
1404 2 20 LEU HG 2 21 HIS HA 4.660 . 5.130 3.765 3.324 4.156 . 0 0 "[ . 1 . 2]" 1
1405 2 21 HIS H 2 21 HIS HA 2.830 . 3.110 2.796 2.761 2.831 . 0 0 "[ . 1 . 2]" 1
1406 2 21 HIS H 2 21 HIS HB2 2.480 . 2.730 2.565 2.380 2.792 0.062 6 0 "[ . 1 . 2]" 1
1407 2 21 HIS H 2 21 HIS QB 2.540 . 2.790 2.260 2.184 2.327 . 0 0 "[ . 1 . 2]" 1
1408 2 21 HIS H 2 21 HIS HB3 2.590 . 2.850 2.537 2.281 2.667 . 0 0 "[ . 1 . 2]" 1
1409 2 21 HIS H 2 22 ASP H 2.830 . 3.110 2.748 2.620 2.987 . 0 0 "[ . 1 . 2]" 1
1410 2 21 HIS H 2 24 ASN HD21 5.840 . 6.420 5.779 5.562 6.106 . 0 0 "[ . 1 . 2]" 1
1411 2 21 HIS H 2 24 ASN QD 5.300 . 5.830 4.869 4.637 5.020 . 0 0 "[ . 1 . 2]" 1
1412 2 21 HIS H 2 24 ASN HD22 4.990 . 5.490 5.257 4.805 5.476 . 0 0 "[ . 1 . 2]" 1
1413 2 21 HIS HA 2 21 HIS HB2 2.490 . 2.740 2.467 2.339 2.540 . 0 0 "[ . 1 . 2]" 1
1414 2 21 HIS HA 2 24 ASN H 3.670 . 4.040 3.610 3.367 3.825 . 0 0 "[ . 1 . 2]" 1
1415 2 21 HIS HA 2 24 ASN HB2 2.580 . 2.840 2.648 2.221 2.882 0.042 20 0 "[ . 1 . 2]" 1
1416 2 21 HIS HA 2 24 ASN QB 3.300 . 3.630 2.621 2.207 2.848 . 0 0 "[ . 1 . 2]" 1
1417 2 21 HIS HA 2 24 ASN HB3 4.030 . 4.430 4.210 3.775 4.471 0.041 11 0 "[ . 1 . 2]" 1
1418 2 21 HIS HA 2 24 ASN QD 3.950 . 4.350 4.096 3.781 4.381 0.031 15 0 "[ . 1 . 2]" 1
1419 2 21 HIS QB 2 23 THR H 5.200 . 5.720 4.852 4.707 5.066 . 0 0 "[ . 1 . 2]" 1
1420 2 21 HIS HB3 2 23 THR H 5.230 . 5.750 5.129 4.973 5.393 . 0 0 "[ . 1 . 2]" 1
1421 2 22 ASP H 2 23 THR H 2.760 . 3.040 2.759 2.622 2.935 . 0 0 "[ . 1 . 2]" 1
1422 2 22 ASP H 2 24 ASN H 4.090 . 4.500 4.042 3.794 4.196 . 0 0 "[ . 1 . 2]" 1
1423 2 22 ASP HA 2 22 ASP QB 2.560 . 2.820 2.392 2.341 2.476 . 0 0 "[ . 1 . 2]" 1
1424 2 22 ASP HA 2 23 THR H 3.550 . 3.900 3.573 3.546 3.613 . 0 0 "[ . 1 . 2]" 1
1425 2 22 ASP QB 2 23 THR H 2.970 . 3.270 2.514 2.310 2.760 . 0 0 "[ . 1 . 2]" 1
1426 2 23 THR H 2 23 THR HA 2.810 . 3.090 2.835 2.806 2.875 . 0 0 "[ . 1 . 2]" 1
1427 2 23 THR H 2 23 THR MG 3.730 . 4.100 3.798 3.775 3.823 . 0 0 "[ . 1 . 2]" 1
1428 2 23 THR H 2 24 ASN H 2.690 . 2.960 2.613 2.500 2.714 . 0 0 "[ . 1 . 2]" 1
1429 2 23 THR H 2 24 ASN HD21 5.650 . 6.210 5.630 5.483 6.034 . 0 0 "[ . 1 . 2]" 1
1430 2 23 THR H 2 24 ASN QD 4.850 . 5.330 4.055 3.868 4.282 . 0 0 "[ . 1 . 2]" 1
1431 2 23 THR H 2 24 ASN HD22 4.050 . 4.460 4.158 3.953 4.409 . 0 0 "[ . 1 . 2]" 1
1432 2 23 THR H 2 25 MET H 4.110 . 4.520 4.130 3.842 4.430 . 0 0 "[ . 1 . 2]" 1
1433 2 23 THR HA 2 24 ASN H 3.490 . 3.840 3.515 3.491 3.545 . 0 0 "[ . 1 . 2]" 1
1434 2 23 THR HA 2 26 GLU H 3.550 . 3.900 3.400 3.144 3.591 . 0 0 "[ . 1 . 2]" 1
1435 2 23 THR HA 2 26 GLU QB 4.810 . 5.290 2.864 2.323 3.356 . 0 0 "[ . 1 . 2]" 1
1436 2 23 THR HA 2 26 GLU QG 2.420 . 2.660 2.518 2.268 2.734 0.074 12 0 "[ . 1 . 2]" 1
1437 2 23 THR MG 2 24 ASN H 3.690 . 4.060 3.855 3.672 4.015 . 0 0 "[ . 1 . 2]" 1
1438 2 23 THR MG 2 24 ASN HA 3.750 . 4.130 3.966 3.725 4.178 0.048 17 0 "[ . 1 . 2]" 1
1439 2 23 THR MG 2 24 ASN QB 5.020 . 5.520 5.100 4.854 5.269 . 0 0 "[ . 1 . 2]" 1
1440 2 23 THR MG 2 24 ASN HD21 4.300 . 4.730 4.537 4.047 4.765 0.035 1 0 "[ . 1 . 2]" 1
1441 2 23 THR MG 2 24 ASN QD 3.390 . 3.730 3.485 3.093 3.760 0.030 10 0 "[ . 1 . 2]" 1
1442 2 23 THR MG 2 24 ASN HD22 3.480 . 3.830 3.624 3.210 3.998 0.168 10 0 "[ . 1 . 2]" 1
1443 2 23 THR MG 2 25 MET H 5.150 . 5.670 5.324 5.097 5.543 . 0 0 "[ . 1 . 2]" 1
1444 2 23 THR MG 2 27 LEU HB2 5.500 . 6.050 3.644 3.436 3.864 . 0 0 "[ . 1 . 2]" 1
1445 2 23 THR MG 2 27 LEU QB 5.350 . 5.890 3.524 3.328 3.701 . 0 0 "[ . 1 . 2]" 1
1446 2 23 THR MG 2 27 LEU HB3 5.200 . 5.720 4.686 4.411 4.968 . 0 0 "[ . 1 . 2]" 1
1447 2 24 ASN H 2 24 ASN HA 2.850 . 3.130 2.874 2.843 2.899 . 0 0 "[ . 1 . 2]" 1
1448 2 24 ASN H 2 24 ASN HB2 2.220 . 2.440 2.355 2.268 2.396 . 0 0 "[ . 1 . 2]" 1
1449 2 24 ASN H 2 24 ASN QB 2.830 . 3.110 2.326 2.242 2.364 . 0 0 "[ . 1 . 2]" 1
1450 2 24 ASN H 2 24 ASN HB3 3.520 . 3.870 3.599 3.538 3.627 . 0 0 "[ . 1 . 2]" 1
1451 2 24 ASN H 2 24 ASN HD21 3.900 . 4.290 3.936 3.752 4.226 . 0 0 "[ . 1 . 2]" 1
1452 2 24 ASN H 2 24 ASN QD 3.120 . 3.430 2.306 2.070 2.557 . 0 0 "[ . 1 . 2]" 1
1453 2 24 ASN H 2 24 ASN HD22 2.280 . 2.510 2.323 2.080 2.578 0.068 6 0 "[ . 1 . 2]" 1
1454 2 24 ASN H 2 25 MET H 2.750 . 3.030 2.527 2.417 2.639 . 0 0 "[ . 1 . 2]" 1
1455 2 24 ASN H 2 26 GLU H 4.100 . 4.510 3.972 3.716 4.156 . 0 0 "[ . 1 . 2]" 1
1456 2 24 ASN HA 2 24 ASN QD 3.700 . 4.070 2.613 2.396 3.197 . 0 0 "[ . 1 . 2]" 1
1457 2 24 ASN HA 2 25 MET H 3.530 . 3.880 3.570 3.526 3.604 . 0 0 "[ . 1 . 2]" 1
1458 2 24 ASN HA 2 27 LEU H 3.500 . 3.850 3.296 3.067 3.518 . 0 0 "[ . 1 . 2]" 1
1459 2 24 ASN HA 2 27 LEU HB2 4.290 . 4.720 3.132 2.766 3.428 . 0 0 "[ . 1 . 2]" 1
1460 2 24 ASN HA 2 27 LEU QB 3.180 . 3.500 2.324 2.024 2.579 . 0 0 "[ . 1 . 2]" 1
1461 2 24 ASN HA 2 27 LEU HB3 2.680 . 2.950 2.398 2.079 2.673 . 0 0 "[ . 1 . 2]" 1
1462 2 24 ASN HA 2 28 THR H 4.490 . 4.940 4.070 3.816 4.229 . 0 0 "[ . 1 . 2]" 1
1463 2 24 ASN QB 2 25 MET H 3.210 . 3.530 2.777 2.574 3.013 . 0 0 "[ . 1 . 2]" 1
1464 2 24 ASN QB 2 25 MET QG 4.500 . 4.950 3.675 3.195 4.515 . 0 0 "[ . 1 . 2]" 1
1465 2 24 ASN QB 2 27 LEU QD 5.300 . 5.830 4.126 3.672 4.477 . 0 0 "[ . 1 . 2]" 1
1466 2 24 ASN QD 2 25 MET H 5.230 . 5.750 4.396 4.271 4.634 . 0 0 "[ . 1 . 2]" 1
1467 2 25 MET H 2 25 MET HA 2.830 . 3.110 2.837 2.799 2.900 . 0 0 "[ . 1 . 2]" 1
1468 2 25 MET H 2 25 MET QB 3.010 . 3.310 2.465 2.347 2.646 . 0 0 "[ . 1 . 2]" 1
1469 2 25 MET H 2 25 MET HG2 2.340 . 2.570 2.355 2.186 2.874 0.304 19 0 "[ . 1 . 2]" 1
1470 2 25 MET H 2 25 MET QG 2.680 . 2.950 2.286 2.133 2.505 . 0 0 "[ . 1 . 2]" 1
1471 2 25 MET H 2 25 MET HG3 3.010 . 3.310 3.456 2.199 3.665 0.355 5 0 "[ . 1 . 2]" 1
1472 2 25 MET H 2 26 GLU H 2.670 . 2.940 2.651 2.435 2.761 . 0 0 "[ . 1 . 2]" 1
1473 2 25 MET H 2 26 GLU QG 4.400 . 4.840 4.125 3.929 4.394 . 0 0 "[ . 1 . 2]" 1
1474 2 25 MET H 2 27 LEU H 4.330 . 4.760 4.074 3.847 4.213 . 0 0 "[ . 1 . 2]" 1
1475 2 25 MET HA 2 25 MET QG 3.340 . 3.670 2.901 2.512 3.405 . 0 0 "[ . 1 . 2]" 1
1476 2 25 MET HA 2 28 THR H 4.090 . 4.500 3.293 2.899 3.581 . 0 0 "[ . 1 . 2]" 1
1477 2 25 MET HA 2 29 ASP H 5.040 . 5.540 4.074 3.761 4.311 . 0 0 "[ . 1 . 2]" 1
1478 2 26 GLU H 2 26 GLU HA 2.800 . 3.080 2.843 2.812 2.869 . 0 0 "[ . 1 . 2]" 1
1479 2 26 GLU H 2 26 GLU QB 3.240 . 3.560 2.597 2.387 2.824 . 0 0 "[ . 1 . 2]" 1
1480 2 26 GLU H 2 26 GLU QG 2.600 . 2.860 2.156 1.957 2.413 . 0 0 "[ . 1 . 2]" 1
1481 2 26 GLU H 2 27 LEU H 2.750 . 3.030 2.606 2.499 2.685 . 0 0 "[ . 1 . 2]" 1
1482 2 26 GLU H 2 28 THR H 4.300 . 4.730 4.005 3.860 4.230 . 0 0 "[ . 1 . 2]" 1
1483 2 26 GLU HA 2 26 GLU QB 2.460 . 2.710 2.351 2.285 2.433 . 0 0 "[ . 1 . 2]" 1
1484 2 26 GLU HA 2 27 LEU H 3.540 . 3.890 3.544 3.501 3.601 . 0 0 "[ . 1 . 2]" 1
1485 2 26 GLU HA 2 29 ASP HA 5.600 . 6.160 5.293 4.851 5.652 . 0 0 "[ . 1 . 2]" 1
1486 2 26 GLU HA 2 29 ASP QB 3.010 . 3.310 2.508 2.022 3.027 . 0 0 "[ . 1 . 2]" 1
1487 2 26 GLU QB 2 27 LEU H 3.740 . 4.110 2.491 2.331 2.762 . 0 0 "[ . 1 . 2]" 1
1488 2 26 GLU QB 2 29 ASP QB 5.350 . 5.890 3.976 3.511 4.343 . 0 0 "[ . 1 . 2]" 1
1489 2 26 GLU QG 2 27 LEU H 3.550 . 3.900 3.836 3.506 3.991 0.091 20 0 "[ . 1 . 2]" 1
1490 2 26 GLU QG 2 27 LEU QB 5.030 . 5.530 5.138 4.857 5.367 . 0 0 "[ . 1 . 2]" 1
1491 2 26 GLU QG 2 28 THR H 5.450 . 6.000 5.579 5.269 5.896 . 0 0 "[ . 1 . 2]" 1
1492 2 27 LEU H 2 27 LEU HA 2.790 . 3.070 2.818 2.788 2.860 . 0 0 "[ . 1 . 2]" 1
1493 2 27 LEU H 2 27 LEU HB2 2.900 . 3.190 2.473 2.343 2.556 . 0 0 "[ . 1 . 2]" 1
1494 2 27 LEU H 2 27 LEU QB 2.540 . 2.790 2.215 2.173 2.269 . 0 0 "[ . 1 . 2]" 1
1495 2 27 LEU H 2 27 LEU HB3 2.530 . 2.780 2.506 2.393 2.592 . 0 0 "[ . 1 . 2]" 1
1496 2 27 LEU H 2 28 THR H 2.980 . 3.280 2.694 2.573 2.858 . 0 0 "[ . 1 . 2]" 1
1497 2 27 LEU HA 2 27 LEU QB 2.640 . 2.900 2.383 2.344 2.419 . 0 0 "[ . 1 . 2]" 1
1498 2 27 LEU HA 2 27 LEU HG 3.580 . 3.940 3.105 2.596 3.751 . 0 0 "[ . 1 . 2]" 1
1499 2 27 LEU HA 2 28 THR H 3.510 . 3.860 3.549 3.519 3.585 . 0 0 "[ . 1 . 2]" 1
1500 2 27 LEU HA 2 29 ASP H 4.750 . 5.220 4.427 4.171 4.700 . 0 0 "[ . 1 . 2]" 1
1501 2 27 LEU QB 2 28 THR H 3.420 . 3.760 2.676 2.441 2.969 . 0 0 "[ . 1 . 2]" 1
1502 2 27 LEU HB2 2 27 LEU HG 2.850 . 3.130 2.971 2.338 3.058 . 0 0 "[ . 1 . 2]" 1
1503 2 27 LEU HB3 2 27 LEU HG 2.970 . 3.270 2.600 2.520 3.050 . 0 0 "[ . 1 . 2]" 1
1504 2 27 LEU QD 2 28 THR H 4.340 . 4.770 3.923 3.267 4.252 . 0 0 "[ . 1 . 2]" 1
1505 2 27 LEU QD 2 28 THR HA 4.600 . 5.060 4.260 3.094 4.708 . 0 0 "[ . 1 . 2]" 1
1506 2 27 LEU QD 2 31 LYS QB 5.500 . 6.050 3.775 3.035 4.180 . 0 0 "[ . 1 . 2]" 1
1507 2 28 THR H 2 28 THR HA 2.830 . 3.110 2.854 2.812 2.890 . 0 0 "[ . 1 . 2]" 1
1508 2 28 THR H 2 28 THR HB 2.460 . 2.710 2.531 2.383 2.676 . 0 0 "[ . 1 . 2]" 1
1509 2 28 THR H 2 28 THR MG 4.350 . 4.790 3.810 3.784 3.849 . 0 0 "[ . 1 . 2]" 1
1510 2 28 THR H 2 29 ASP H 2.740 . 3.010 2.554 2.415 2.672 . 0 0 "[ . 1 . 2]" 1
1511 2 28 THR H 2 29 ASP QB 5.030 . 5.530 4.278 4.106 4.531 . 0 0 "[ . 1 . 2]" 1
1512 2 28 THR H 2 30 LEU H 4.420 . 4.860 3.980 3.692 4.395 . 0 0 "[ . 1 . 2]" 1
1513 2 28 THR H 2 31 LYS QG 5.310 . 5.840 4.627 4.134 5.840 . 0 0 "[ . 1 . 2]" 1
1514 2 28 THR HA 2 28 THR HB 2.940 . 3.230 3.056 3.049 3.064 . 0 0 "[ . 1 . 2]" 1
1515 2 28 THR HA 2 29 ASP H 3.480 . 3.830 3.534 3.478 3.584 . 0 0 "[ . 1 . 2]" 1
1516 2 28 THR HA 2 29 ASP HA 4.840 . 5.320 4.885 4.845 4.948 . 0 0 "[ . 1 . 2]" 1
1517 2 28 THR HA 2 30 LEU H 4.540 . 4.990 4.362 4.105 4.699 . 0 0 "[ . 1 . 2]" 1
1518 2 28 THR HA 2 31 LYS H 3.970 . 4.370 3.563 3.221 3.873 . 0 0 "[ . 1 . 2]" 1
1519 2 28 THR HA 2 31 LYS QB 4.120 . 4.530 3.575 1.898 4.372 . 0 0 "[ . 1 . 2]" 1
1520 2 28 THR HA 2 31 LYS QG 3.020 . 3.320 2.343 1.785 3.331 0.015 1 0 "[ . 1 . 2]" 1
1521 2 28 THR HA 2 32 LEU H 5.030 . 5.530 4.200 3.984 4.412 . 0 0 "[ . 1 . 2]" 1
1522 2 28 THR HB 2 29 ASP H 3.090 . 3.400 2.701 2.399 3.023 . 0 0 "[ . 1 . 2]" 1
1523 2 28 THR MG 2 29 ASP H 3.800 . 4.180 3.591 3.342 3.971 . 0 0 "[ . 1 . 2]" 1
1524 2 28 THR MG 2 29 ASP QB 5.200 . 5.720 4.500 4.045 5.021 . 0 0 "[ . 1 . 2]" 1
1525 2 28 THR MG 2 31 LYS QG 4.570 . 5.030 3.408 2.846 4.400 . 0 0 "[ . 1 . 2]" 1
1526 2 28 THR MG 2 32 LEU H 4.900 . 5.390 4.368 4.037 4.593 . 0 0 "[ . 1 . 2]" 1
1527 2 28 THR MG 2 32 LEU HA 5.760 . 6.340 5.387 4.959 5.785 . 0 0 "[ . 1 . 2]" 1
1528 2 28 THR MG 2 32 LEU QB 4.400 . 4.840 3.554 3.104 3.903 . 0 0 "[ . 1 . 2]" 1
1529 2 29 ASP H 2 29 ASP HA 2.790 . 3.070 2.832 2.801 2.874 . 0 0 "[ . 1 . 2]" 1
1530 2 29 ASP H 2 29 ASP QB 2.640 . 2.900 2.261 2.191 2.498 . 0 0 "[ . 1 . 2]" 1
1531 2 29 ASP H 2 30 LEU H 2.700 . 2.970 2.615 2.468 2.756 . 0 0 "[ . 1 . 2]" 1
1532 2 29 ASP H 2 31 LYS QG 5.200 . 5.720 4.761 4.332 5.967 0.247 9 0 "[ . 1 . 2]" 1
1533 2 29 ASP HA 2 29 ASP QB 2.610 . 2.870 2.378 2.314 2.440 . 0 0 "[ . 1 . 2]" 1
1534 2 29 ASP HA 2 30 LEU H 3.560 . 3.920 3.537 3.494 3.616 . 0 0 "[ . 1 . 2]" 1
1535 2 29 ASP HA 2 31 LYS H 4.290 . 4.720 4.642 4.453 4.759 0.039 10 0 "[ . 1 . 2]" 1
1536 2 29 ASP HA 2 32 LEU H 3.570 . 3.930 3.647 3.386 3.913 . 0 0 "[ . 1 . 2]" 1
1537 2 29 ASP HA 2 32 LEU QB 2.910 . 3.200 2.625 2.263 2.894 . 0 0 "[ . 1 . 2]" 1
1538 2 29 ASP HA 2 33 GLN H 4.590 . 5.050 4.256 3.992 4.567 . 0 0 "[ . 1 . 2]" 1
1539 2 29 ASP QB 2 30 LEU H 3.380 . 3.720 2.619 2.416 2.849 . 0 0 "[ . 1 . 2]" 1
1540 2 29 ASP QB 2 32 LEU QB 5.500 . 6.050 4.388 4.124 4.574 . 0 0 "[ . 1 . 2]" 1
1541 2 29 ASP QB 2 33 GLN QE 5.500 . 6.050 3.780 2.261 4.304 . 0 0 "[ . 1 . 2]" 1
1542 2 30 LEU H 2 30 LEU HA 2.810 . 3.090 2.839 2.795 2.873 . 0 0 "[ . 1 . 2]" 1
1543 2 30 LEU H 2 30 LEU QB 2.910 . 3.200 2.283 2.018 2.512 . 0 0 "[ . 1 . 2]" 1
1544 2 30 LEU H 2 30 LEU QD 4.650 . 5.120 3.032 2.296 3.706 . 0 0 "[ . 1 . 2]" 1
1545 2 30 LEU H 2 30 LEU HG 4.140 . 4.550 3.572 2.106 4.617 0.067 13 0 "[ . 1 . 2]" 1
1546 2 30 LEU H 2 32 LEU H 4.210 . 4.630 3.953 3.706 4.302 . 0 0 "[ . 1 . 2]" 1
1547 2 30 LEU H 2 33 GLN QE 5.180 . 5.700 3.901 3.361 4.475 . 0 0 "[ . 1 . 2]" 1
1548 2 30 LEU HA 2 30 LEU QB 2.450 . 2.700 2.465 2.267 2.579 . 0 0 "[ . 1 . 2]" 1
1549 2 30 LEU HA 2 30 LEU HB3 2.970 . 3.270 2.720 2.477 3.026 . 0 0 "[ . 1 . 2]" 1
1550 2 30 LEU HA 2 30 LEU HG 3.700 . 4.070 3.464 3.011 3.754 . 0 0 "[ . 1 . 2]" 1
1551 2 30 LEU HA 2 31 LYS H 3.520 . 3.870 3.572 3.500 3.611 . 0 0 "[ . 1 . 2]" 1
1552 2 30 LEU HA 2 33 GLN H 4.370 . 4.810 3.407 3.079 3.769 . 0 0 "[ . 1 . 2]" 1
1553 2 30 LEU QB 2 31 LYS H 3.820 . 4.200 2.642 2.390 2.946 . 0 0 "[ . 1 . 2]" 1
1554 2 30 LEU HB2 2 30 LEU HG 2.980 . 3.280 2.520 2.423 3.029 . 0 0 "[ . 1 . 2]" 1
1555 2 30 LEU QD 2 31 LYS H 4.440 . 4.880 3.998 3.602 4.250 . 0 0 "[ . 1 . 2]" 1
1556 2 30 LEU QD 2 31 LYS QB 5.300 . 5.830 4.957 4.106 5.491 . 0 0 "[ . 1 . 2]" 1
1557 2 31 LYS H 2 31 LYS HA 2.840 . 3.120 2.847 2.759 2.903 . 0 0 "[ . 1 . 2]" 1
1558 2 31 LYS H 2 31 LYS QB 2.800 . 3.080 2.472 2.073 2.786 . 0 0 "[ . 1 . 2]" 1
1559 2 31 LYS H 2 31 LYS QD 4.900 . 5.390 4.070 3.440 4.534 . 0 0 "[ . 1 . 2]" 1
1560 2 31 LYS H 2 31 LYS QG 3.420 . 3.760 2.625 2.051 3.872 0.112 11 0 "[ . 1 . 2]" 1
1561 2 31 LYS H 2 32 LEU H 2.630 . 2.890 2.579 2.432 2.845 . 0 0 "[ . 1 . 2]" 1
1562 2 31 LYS H 2 33 GLN H 4.640 . 5.100 4.193 3.987 4.431 . 0 0 "[ . 1 . 2]" 1
1563 2 31 LYS H 2 33 GLN QE 5.380 . 5.920 5.115 4.792 5.607 . 0 0 "[ . 1 . 2]" 1
1564 2 31 LYS HA 2 31 LYS QB 2.500 . 2.750 2.211 2.169 2.398 . 0 0 "[ . 1 . 2]" 1
1565 2 31 LYS HA 2 31 LYS QD 3.780 . 4.160 3.606 2.452 4.177 0.017 5 0 "[ . 1 . 2]" 1
1566 2 31 LYS HA 2 32 LEU H 3.450 . 3.790 3.514 3.457 3.578 . 0 0 "[ . 1 . 2]" 1
1567 2 31 LYS HA 2 32 LEU HA 4.780 . 5.260 4.845 4.795 4.905 . 0 0 "[ . 1 . 2]" 1
1568 2 31 LYS HA 2 34 LEU H 4.160 . 4.580 3.218 2.888 3.832 . 0 0 "[ . 1 . 2]" 1
1569 2 31 LYS HA 2 34 LEU QB 3.330 . 3.660 2.227 1.813 3.065 . 0 0 "[ . 1 . 2]" 1
1570 2 31 LYS HA 2 34 LEU HG 4.840 . 5.320 3.806 1.786 5.134 0.014 2 0 "[ . 1 . 2]" 1
1571 2 31 LYS HA 2 35 GLU H 4.320 . 4.750 4.170 3.920 4.505 . 0 0 "[ . 1 . 2]" 1
1572 2 31 LYS QB 2 31 LYS QD 3.220 . 3.540 2.376 2.143 2.828 . 0 0 "[ . 1 . 2]" 1
1573 2 31 LYS QD 2 35 GLU QG 3.910 . 4.300 3.975 3.018 4.750 0.450 16 0 "[ . 1 . 2]" 1
1574 2 31 LYS QG 2 32 LEU H 3.200 . 3.520 2.748 2.220 3.893 0.373 16 0 "[ . 1 . 2]" 1
1575 2 32 LEU H 2 32 LEU HA 2.830 . 3.110 2.835 2.774 2.861 . 0 0 "[ . 1 . 2]" 1
1576 2 32 LEU H 2 32 LEU QB 2.580 . 2.840 2.235 2.082 2.271 . 0 0 "[ . 1 . 2]" 1
1577 2 32 LEU H 2 32 LEU HG 4.490 . 4.940 4.517 4.448 4.583 . 0 0 "[ . 1 . 2]" 1
1578 2 32 LEU H 2 33 GLN H 2.760 . 3.040 2.687 2.559 2.853 . 0 0 "[ . 1 . 2]" 1
1579 2 32 LEU H 2 33 GLN HE22 5.460 . 6.010 5.375 4.821 5.924 . 0 0 "[ . 1 . 2]" 1
1580 2 32 LEU H 2 34 LEU H 3.910 . 4.300 3.817 3.635 4.285 . 0 0 "[ . 1 . 2]" 1
1581 2 32 LEU HA 2 32 LEU QD 4.050 . 4.460 2.258 2.067 3.316 . 0 0 "[ . 1 . 2]" 1
1582 2 32 LEU HA 2 33 GLN H 3.550 . 3.900 3.570 3.532 3.645 . 0 0 "[ . 1 . 2]" 1
1583 2 32 LEU HA 2 34 LEU H 4.480 . 4.930 4.145 3.910 4.480 . 0 0 "[ . 1 . 2]" 1
1584 2 32 LEU HA 2 35 GLU H 4.370 . 4.810 3.647 3.408 3.930 . 0 0 "[ . 1 . 2]" 1
1585 2 32 LEU HA 2 35 GLU QG 2.740 . 3.010 2.256 1.973 2.555 . 0 0 "[ . 1 . 2]" 1
1586 2 32 LEU HA 2 36 LYS H 5.220 . 5.740 4.445 4.181 4.625 . 0 0 "[ . 1 . 2]" 1
1587 2 32 LEU HA 2 36 LYS QG 4.530 . 4.980 4.178 3.956 4.614 . 0 0 "[ . 1 . 2]" 1
1588 2 32 LEU QB 2 33 GLN H 2.850 . 3.130 2.513 2.293 2.816 . 0 0 "[ . 1 . 2]" 1
1589 2 32 LEU QB 2 33 GLN HA 4.810 . 5.290 4.295 4.139 4.643 . 0 0 "[ . 1 . 2]" 1
1590 2 32 LEU QB 2 33 GLN QE 5.290 . 5.820 4.728 3.068 5.378 . 0 0 "[ . 1 . 2]" 1
1591 2 32 LEU QD 2 33 GLN QE 5.800 . 6.380 5.183 3.577 5.906 . 0 0 "[ . 1 . 2]" 1
1592 2 32 LEU HG 2 33 GLN HA 4.140 . 4.550 3.960 3.569 4.477 . 0 0 "[ . 1 . 2]" 1
1593 2 33 GLN H 2 33 GLN HA 2.820 . 3.100 2.843 2.798 2.887 . 0 0 "[ . 1 . 2]" 1
1594 2 33 GLN H 2 33 GLN QB 2.950 . 3.250 2.448 2.276 2.565 . 0 0 "[ . 1 . 2]" 1
1595 2 33 GLN H 2 33 GLN QE 3.980 . 4.380 3.598 2.683 4.051 . 0 0 "[ . 1 . 2]" 1
1596 2 33 GLN H 2 33 GLN QG 3.700 . 4.070 2.493 2.159 3.533 . 0 0 "[ . 1 . 2]" 1
1597 2 33 GLN H 2 34 LEU H 2.710 . 2.980 2.590 2.466 2.667 . 0 0 "[ . 1 . 2]" 1
1598 2 33 GLN H 2 35 GLU H 5.080 . 5.590 4.426 3.988 4.706 . 0 0 "[ . 1 . 2]" 1
1599 2 33 GLN H 2 36 LYS H 5.280 . 5.810 4.767 4.463 5.078 . 0 0 "[ . 1 . 2]" 1
1600 2 33 GLN HA 2 33 GLN QG 3.630 . 3.990 2.464 2.316 2.549 . 0 0 "[ . 1 . 2]" 1
1601 2 33 GLN HA 2 36 LYS H 3.920 . 4.310 3.341 2.835 3.901 . 0 0 "[ . 1 . 2]" 1
1602 2 33 GLN HA 2 36 LYS QB 3.440 . 3.780 2.318 1.794 3.007 0.006 12 0 "[ . 1 . 2]" 1
1603 2 33 GLN HA 2 36 LYS QD 3.040 . 3.340 2.438 1.997 3.059 . 0 0 "[ . 1 . 2]" 1
1604 2 33 GLN HA 2 36 LYS QG 4.400 . 4.840 3.340 2.782 3.921 . 0 0 "[ . 1 . 2]" 1
1605 2 33 GLN QB 2 34 LEU H 3.590 . 3.950 2.893 2.623 3.147 . 0 0 "[ . 1 . 2]" 1
1606 2 33 GLN QB 2 34 LEU QB 5.100 . 5.610 4.241 3.827 4.936 . 0 0 "[ . 1 . 2]" 1
1607 2 33 GLN QB 2 36 LYS QD 5.620 . 6.180 4.219 3.600 4.898 . 0 0 "[ . 1 . 2]" 1
1608 2 33 GLN QE 2 34 LEU H 5.200 . 5.720 4.914 4.348 5.278 . 0 0 "[ . 1 . 2]" 1
1609 2 33 GLN QG 2 36 LYS QD 5.280 . 5.810 3.273 2.064 4.340 . 0 0 "[ . 1 . 2]" 1
1610 2 34 LEU H 2 34 LEU QB 2.710 . 2.980 2.229 2.064 2.727 . 0 0 "[ . 1 . 2]" 1
1611 2 34 LEU H 2 34 LEU QD 4.950 . 5.440 3.380 2.526 3.782 . 0 0 "[ . 1 . 2]" 1
1612 2 34 LEU H 2 34 LEU HG 4.630 . 5.090 4.133 2.333 4.622 . 0 0 "[ . 1 . 2]" 1
1613 2 34 LEU H 2 35 GLU H 3.080 . 3.390 2.661 2.451 2.849 . 0 0 "[ . 1 . 2]" 1
1614 2 34 LEU H 2 36 LYS H 4.050 . 4.460 3.809 3.587 4.125 . 0 0 "[ . 1 . 2]" 1
1615 2 34 LEU HA 2 34 LEU QB 2.510 . 2.760 2.480 2.329 2.565 . 0 0 "[ . 1 . 2]" 1
1616 2 34 LEU HA 2 34 LEU HG 3.640 . 4.000 3.344 2.771 3.838 . 0 0 "[ . 1 . 2]" 1
1617 2 34 LEU HA 2 36 LYS H 4.290 . 4.720 4.274 4.001 4.517 . 0 0 "[ . 1 . 2]" 1
1618 2 34 LEU HA 2 38 THR H 4.590 . 5.050 4.288 3.991 4.603 . 0 0 "[ . 1 . 2]" 1
1619 2 34 LEU QB 2 35 GLU H 3.530 . 3.880 2.438 2.159 2.750 . 0 0 "[ . 1 . 2]" 1
1620 2 34 LEU QB 2 35 GLU QB 5.980 . 6.580 3.924 3.568 4.628 . 0 0 "[ . 1 . 2]" 1
1621 2 34 LEU QD 2 35 GLU H 4.150 . 4.570 3.895 3.316 4.173 . 0 0 "[ . 1 . 2]" 1
1622 2 34 LEU QD 2 35 GLU HA 4.690 . 5.160 4.451 3.231 5.306 0.146 2 0 "[ . 1 . 2]" 1
1623 2 34 LEU HG 2 35 GLU H 4.530 . 4.980 4.496 3.899 5.113 0.133 12 0 "[ . 1 . 2]" 1
1624 2 34 LEU HG 2 35 GLU QG 5.910 . 6.500 5.877 4.524 6.559 0.059 14 0 "[ . 1 . 2]" 1
1625 2 35 GLU H 2 35 GLU HA 2.830 . 3.110 2.863 2.801 2.915 . 0 0 "[ . 1 . 2]" 1
1626 2 35 GLU H 2 35 GLU QB 2.940 . 3.230 2.659 2.509 2.800 . 0 0 "[ . 1 . 2]" 1
1627 2 35 GLU H 2 35 GLU QG 3.070 . 3.380 1.967 1.764 2.104 0.036 7 0 "[ . 1 . 2]" 1
1628 2 35 GLU H 2 36 LYS H 3.000 . 3.300 2.585 2.476 2.751 . 0 0 "[ . 1 . 2]" 1
1629 2 35 GLU HA 2 35 GLU QB 2.460 . 2.710 2.196 2.170 2.325 . 0 0 "[ . 1 . 2]" 1
1630 2 35 GLU HA 2 36 LYS H 3.480 . 3.830 3.491 3.381 3.564 . 0 0 "[ . 1 . 2]" 1
1631 2 35 GLU HA 2 37 ALA H 4.860 . 5.350 4.180 3.914 4.956 . 0 0 "[ . 1 . 2]" 1
1632 2 35 GLU QB 2 36 LYS H 4.000 . 4.400 3.582 2.571 3.938 . 0 0 "[ . 1 . 2]" 1
1633 2 35 GLU QG 2 36 LYS H 3.000 . 3.300 2.781 2.214 3.670 0.370 16 0 "[ . 1 . 2]" 1
1634 2 35 GLU QG 2 36 LYS QB 5.250 . 5.780 4.332 3.685 5.372 . 0 0 "[ . 1 . 2]" 1
1635 2 35 GLU QG 2 36 LYS QD 5.000 . 5.500 4.542 3.853 5.686 0.186 2 0 "[ . 1 . 2]" 1
1636 2 35 GLU QG 2 36 LYS QG 4.280 . 4.710 3.070 2.316 4.679 . 0 0 "[ . 1 . 2]" 1
1637 2 36 LYS H 2 36 LYS HA 2.820 . 3.100 2.894 2.862 2.941 . 0 0 "[ . 1 . 2]" 1
1638 2 36 LYS H 2 36 LYS QB 2.900 . 3.190 2.399 2.334 2.541 . 0 0 "[ . 1 . 2]" 1
1639 2 36 LYS H 2 36 LYS QD 4.340 . 4.770 3.875 3.660 4.114 . 0 0 "[ . 1 . 2]" 1
1640 2 36 LYS H 2 36 LYS QE 5.400 . 5.940 4.862 4.403 5.419 . 0 0 "[ . 1 . 2]" 1
1641 2 36 LYS H 2 36 LYS QG 3.450 . 3.790 2.477 2.182 2.731 . 0 0 "[ . 1 . 2]" 1
1642 2 36 LYS H 2 37 ALA H 2.710 . 2.980 2.515 2.319 2.732 . 0 0 "[ . 1 . 2]" 1
1643 2 36 LYS H 2 38 THR H 4.600 . 5.060 4.127 3.799 4.853 . 0 0 "[ . 1 . 2]" 1
1644 2 36 LYS HA 2 36 LYS QD 4.580 . 5.040 4.187 4.018 4.297 . 0 0 "[ . 1 . 2]" 1
1645 2 36 LYS HA 2 36 LYS QG 2.600 . 2.860 2.452 2.423 2.508 . 0 0 "[ . 1 . 2]" 1
1646 2 36 LYS HA 2 37 ALA HA 5.220 . 5.740 4.831 4.718 4.908 . 0 0 "[ . 1 . 2]" 1
1647 2 36 LYS QB 2 36 LYS QD 3.060 . 3.370 2.280 2.157 2.429 . 0 0 "[ . 1 . 2]" 1
1648 2 36 LYS QB 2 36 LYS QE 3.620 . 3.980 2.962 1.932 3.745 . 0 0 "[ . 1 . 2]" 1
1649 2 36 LYS QB 2 37 ALA H 3.450 . 3.790 2.793 2.338 3.136 . 0 0 "[ . 1 . 2]" 1
1650 2 36 LYS QB 2 37 ALA HA 4.970 . 5.470 3.996 3.792 4.223 . 0 0 "[ . 1 . 2]" 1
1651 2 37 ALA H 2 37 ALA HA 2.920 . 3.210 2.875 2.805 2.945 . 0 0 "[ . 1 . 2]" 1
1652 2 37 ALA H 2 37 ALA MB 3.000 . 3.300 2.280 2.238 2.338 . 0 0 "[ . 1 . 2]" 1
1653 2 37 ALA H 2 38 THR H 2.860 . 3.150 2.544 2.379 2.734 . 0 0 "[ . 1 . 2]" 1
1654 2 37 ALA MB 2 38 THR H 3.720 . 4.090 2.684 2.049 3.253 . 0 0 "[ . 1 . 2]" 1
1655 2 38 THR H 2 38 THR HA 2.900 . 3.190 2.930 2.859 2.971 . 0 0 "[ . 1 . 2]" 1
1656 2 38 THR H 2 38 THR MG 3.100 . 3.410 2.397 1.920 2.932 . 0 0 "[ . 1 . 2]" 1
1657 2 38 THR H 2 39 GLN QG 5.980 . 6.580 5.735 4.895 6.704 0.124 15 0 "[ . 1 . 2]" 1
1658 2 38 THR H 2 40 ARG H 5.660 . 6.230 4.480 3.831 5.245 . 0 0 "[ . 1 . 2]" 1
1659 2 38 THR MG 2 39 GLN H 3.040 . 3.340 2.558 1.718 3.721 0.381 17 0 "[ . 1 . 2]" 1
1660 2 38 THR MG 2 39 GLN QG 4.370 . 4.810 4.097 2.974 4.824 0.014 9 0 "[ . 1 . 2]" 1
1661 2 39 GLN H 2 39 GLN HA 2.940 . 3.230 2.839 2.677 2.959 . 0 0 "[ . 1 . 2]" 1
1662 2 39 GLN H 2 39 GLN QB 3.500 . 3.850 3.152 2.795 3.521 . 0 0 "[ . 1 . 2]" 1
1663 2 39 GLN H 2 39 GLN QE 4.500 . 4.950 2.788 2.095 3.433 . 0 0 "[ . 1 . 2]" 1
1664 2 39 GLN H 2 39 GLN QG 3.960 . 4.360 2.678 1.835 3.961 . 0 0 "[ . 1 . 2]" 1
1665 2 39 GLN H 2 40 ARG H 2.000 . 2.200 1.998 1.677 2.384 0.184 1 0 "[ . 1 . 2]" 1
1666 2 39 GLN HA 2 39 GLN QB 2.450 . 2.700 2.189 2.166 2.208 . 0 0 "[ . 1 . 2]" 1
1667 2 39 GLN HA 2 39 GLN QE 5.000 . 5.500 4.495 4.104 5.137 . 0 0 "[ . 1 . 2]" 1
1668 2 39 GLN HA 2 39 GLN QG 3.820 . 4.200 3.513 3.460 3.558 . 0 0 "[ . 1 . 2]" 1
1669 2 39 GLN QB 2 40 ARG H 3.930 . 4.320 3.662 3.414 3.806 . 0 0 "[ . 1 . 2]" 1
1670 2 39 GLN QB 2 40 ARG QB 4.840 . 5.320 4.831 4.522 5.348 0.028 11 0 "[ . 1 . 2]" 1
1671 2 39 GLN QE 2 40 ARG H 3.220 . 3.540 2.355 1.810 3.412 . 0 0 "[ . 1 . 2]" 1
1672 2 39 GLN QE 2 40 ARG QB 3.970 . 4.370 3.744 2.278 4.337 . 0 0 "[ . 1 . 2]" 1
1673 2 39 GLN QE 2 40 ARG QG 4.280 . 4.710 4.593 3.906 4.925 0.215 11 0 "[ . 1 . 2]" 1
1674 2 39 GLN QG 2 40 ARG H 2.900 . 3.190 3.216 2.981 3.359 0.169 16 0 "[ . 1 . 2]" 1
1675 2 40 ARG H 2 40 ARG QD 5.000 . 5.500 4.751 3.512 5.565 0.065 1 0 "[ . 1 . 2]" 1
1676 2 40 ARG H 2 40 ARG QG 4.720 . 5.190 4.212 3.836 4.563 . 0 0 "[ . 1 . 2]" 1
1677 2 40 ARG H 2 41 GLN H 4.650 . 5.120 4.457 4.021 4.693 . 0 0 "[ . 1 . 2]" 1
1678 2 40 ARG HA 2 40 ARG QD 4.590 . 5.050 3.600 1.949 4.413 . 0 0 "[ . 1 . 2]" 1
1679 2 40 ARG HA 2 40 ARG QG 3.030 . 3.330 2.843 2.430 3.429 0.099 11 0 "[ . 1 . 2]" 1
1680 2 40 ARG HA 2 41 GLN H 2.320 . 2.550 2.463 2.176 2.820 0.270 15 0 "[ . 1 . 2]" 1
1681 2 40 ARG QB 2 40 ARG QD 2.880 . 3.170 2.303 2.123 2.794 . 0 0 "[ . 1 . 2]" 1
1682 2 40 ARG QD 2 41 GLN QG 5.900 . 6.490 4.798 2.346 6.324 . 0 0 "[ . 1 . 2]" 1
1683 2 40 ARG QG 2 41 GLN H 2.400 . 2.640 2.230 1.749 2.735 0.095 5 0 "[ . 1 . 2]" 1
1684 2 40 ARG QG 2 41 GLN QB 4.600 . 5.060 3.816 2.824 4.554 . 0 0 "[ . 1 . 2]" 1
1685 2 40 ARG QG 2 41 GLN QG 5.130 . 5.640 3.578 2.147 4.853 . 0 0 "[ . 1 . 2]" 1
1686 2 41 GLN H 2 41 GLN HA 2.760 . 3.040 2.723 2.178 2.953 . 0 0 "[ . 1 . 2]" 1
1687 2 41 GLN H 2 41 GLN HB2 3.980 . 4.380 3.658 3.327 4.072 . 0 0 "[ . 1 . 2]" 1
1688 2 41 GLN H 2 41 GLN QB 2.900 . 3.190 2.575 2.245 3.090 . 0 0 "[ . 1 . 2]" 1
1689 2 41 GLN H 2 41 GLN HB3 3.250 . 3.580 2.656 2.270 3.667 0.087 13 0 "[ . 1 . 2]" 1
1690 2 41 GLN H 2 41 GLN QG 4.160 . 4.580 3.081 1.962 4.284 . 0 0 "[ . 1 . 2]" 1
1691 2 41 GLN HA 2 41 GLN HB2 2.520 . 2.770 2.418 2.278 2.516 . 0 0 "[ . 1 . 2]" 1
1692 2 41 GLN HA 2 41 GLN QB 2.460 . 2.710 2.193 2.157 2.351 . 0 0 "[ . 1 . 2]" 1
1693 2 41 GLN HA 2 41 GLN QG 3.780 . 4.160 3.417 2.525 3.559 . 0 0 "[ . 1 . 2]" 1
1694 2 41 GLN HA 2 42 GLU QB 5.250 . 5.780 4.374 3.951 5.432 . 0 0 "[ . 1 . 2]" 1
1695 2 41 GLN QB 2 42 GLU H 3.090 . 3.400 2.833 2.131 3.657 0.257 10 0 "[ . 1 . 2]" 1
1696 2 41 GLN QB 2 42 GLU HA 5.250 . 5.780 4.770 4.069 5.282 . 0 0 "[ . 1 . 2]" 1
1697 2 41 GLN QB 2 43 ARG QD 5.100 . 5.610 4.053 2.498 5.246 . 0 0 "[ . 1 . 2]" 1
1698 2 41 GLN QB 2 43 ARG QG 5.200 . 5.720 3.690 2.137 5.067 . 0 0 "[ . 1 . 2]" 1
1699 2 41 GLN HB2 2 41 GLN QG 2.500 . 2.750 2.240 2.160 2.393 . 0 0 "[ . 1 . 2]" 1
1700 2 41 GLN QE 2 43 ARG H 5.240 . 5.760 4.959 3.935 5.917 0.157 16 0 "[ . 1 . 2]" 1
1701 2 41 GLN QG 2 42 GLU H 3.190 . 3.510 3.207 1.749 3.771 0.261 1 0 "[ . 1 . 2]" 1
1702 2 41 GLN QG 2 42 GLU HA 4.050 . 4.460 4.063 3.197 4.565 0.105 4 0 "[ . 1 . 2]" 1
1703 2 41 GLN QG 2 42 GLU QB 5.200 . 5.720 4.970 4.064 5.393 . 0 0 "[ . 1 . 2]" 1
1704 2 41 GLN QG 2 43 ARG H 3.720 . 4.090 2.783 2.207 3.451 . 0 0 "[ . 1 . 2]" 1
1705 2 41 GLN QG 2 43 ARG HA 4.800 . 5.280 4.417 2.287 4.994 . 0 0 "[ . 1 . 2]" 1
1706 2 41 GLN QG 2 43 ARG QD 3.180 . 3.500 3.184 2.335 3.694 0.194 15 0 "[ . 1 . 2]" 1
1707 2 41 GLN QG 2 43 ARG QG 4.090 . 4.500 2.725 1.770 4.495 0.030 12 0 "[ . 1 . 2]" 1
1708 2 42 GLU H 2 42 GLU HA 2.940 . 3.230 2.733 2.230 2.973 . 0 0 "[ . 1 . 2]" 1
1709 2 42 GLU H 2 42 GLU QB 3.560 . 3.920 2.786 2.228 3.159 . 0 0 "[ . 1 . 2]" 1
1710 2 42 GLU H 2 42 GLU QG 4.090 . 4.500 3.088 1.914 4.254 . 0 0 "[ . 1 . 2]" 1
1711 2 42 GLU H 2 43 ARG H 3.510 . 3.860 3.073 2.117 3.868 0.008 12 0 "[ . 1 . 2]" 1
1712 2 42 GLU H 2 43 ARG HA 5.450 . 6.000 4.927 4.318 5.603 . 0 0 "[ . 1 . 2]" 1
1713 2 42 GLU H 2 43 ARG QG 5.050 . 5.560 4.550 3.466 5.838 0.278 15 0 "[ . 1 . 2]" 1
1714 2 42 GLU HA 2 42 GLU QB 2.500 . 2.750 2.255 2.170 2.411 . 0 0 "[ . 1 . 2]" 1
1715 2 42 GLU QG 2 43 ARG H 4.210 . 4.630 3.984 2.691 4.892 0.262 8 0 "[ . 1 . 2]" 1
1716 2 43 ARG H 2 43 ARG HA 2.730 . 3.000 2.808 2.216 2.959 . 0 0 "[ . 1 . 2]" 1
1717 2 43 ARG H 2 43 ARG QB 3.690 . 4.060 2.489 2.156 3.332 . 0 0 "[ . 1 . 2]" 1
1718 2 43 ARG H 2 43 ARG QD 4.760 . 5.240 4.050 3.472 4.703 . 0 0 "[ . 1 . 2]" 1
1719 2 43 ARG H 2 43 ARG QG 3.820 . 4.200 2.815 2.077 4.101 . 0 0 "[ . 1 . 2]" 1
1720 2 43 ARG H 2 44 PHE H 3.880 . 4.270 2.769 2.108 4.042 . 0 0 "[ . 1 . 2]" 1
1721 2 43 ARG HA 2 43 ARG QG 2.600 . 2.860 2.612 2.438 2.994 0.134 11 0 "[ . 1 . 2]" 1
1722 2 43 ARG QB 2 44 PHE H 2.220 . 2.440 2.243 1.968 2.603 0.163 17 0 "[ . 1 . 2]" 1
1723 2 43 ARG QG 2 44 PHE H 4.410 . 4.850 3.824 3.048 4.158 . 0 0 "[ . 1 . 2]" 1
1724 2 44 PHE H 2 44 PHE HA 2.940 . 3.230 2.908 2.838 2.974 . 0 0 "[ . 1 . 2]" 1
1725 2 44 PHE H 2 44 PHE HB2 2.920 . 3.210 3.155 2.596 3.416 0.206 8 0 "[ . 1 . 2]" 1
1726 2 44 PHE H 2 44 PHE QB 2.900 . 3.190 2.638 2.271 2.913 . 0 0 "[ . 1 . 2]" 1
1727 2 44 PHE H 2 44 PHE HB3 2.870 . 3.160 2.837 2.484 3.341 0.181 9 0 "[ . 1 . 2]" 1
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