NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
399281 |
1u2u   |
6301 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1u2u
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 1079
_Distance_constraint_stats_list.Viol_count 1384
_Distance_constraint_stats_list.Viol_total 1487.044
_Distance_constraint_stats_list.Viol_max 0.498
_Distance_constraint_stats_list.Viol_rms 0.0156
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0019
_Distance_constraint_stats_list.Viol_average_violations_only 0.0398
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 GLU 1.050 0.151 13 0 "[ . 1 . 2 . ]"
1 3 VAL 1.282 0.151 13 0 "[ . 1 . 2 . ]"
1 4 ALA 0.162 0.147 1 0 "[ . 1 . 2 . ]"
1 5 GLN 0.101 0.051 24 0 "[ . 1 . 2 . ]"
1 6 LEU 1.007 0.297 19 0 "[ . 1 . 2 . ]"
1 7 GLU 0.772 0.147 1 0 "[ . 1 . 2 . ]"
1 8 LYS 1.685 0.126 24 0 "[ . 1 . 2 . ]"
1 9 GLU 1.207 0.082 17 0 "[ . 1 . 2 . ]"
1 10 VAL 2.031 0.161 4 0 "[ . 1 . 2 . ]"
1 11 ALA 0.001 0.001 4 0 "[ . 1 . 2 . ]"
1 12 GLN 0.957 0.082 6 0 "[ . 1 . 2 . ]"
1 13 LEU 2.668 0.270 18 0 "[ . 1 . 2 . ]"
1 14 GLU 0.504 0.039 23 0 "[ . 1 . 2 . ]"
1 15 ALA 0.003 0.003 20 0 "[ . 1 . 2 . ]"
1 16 GLU 2.609 0.442 24 0 "[ . 1 . 2 . ]"
1 17 ASN 3.254 0.209 24 0 "[ . 1 . 2 . ]"
1 18 TYR 0.104 0.016 10 0 "[ . 1 . 2 . ]"
1 19 GLN 0.022 0.012 5 0 "[ . 1 . 2 . ]"
1 20 LEU 1.562 0.110 8 0 "[ . 1 . 2 . ]"
1 21 GLU 0.437 0.036 24 0 "[ . 1 . 2 . ]"
1 22 GLN 0.514 0.098 8 0 "[ . 1 . 2 . ]"
1 23 GLU 0.918 0.110 8 0 "[ . 1 . 2 . ]"
1 24 VAL 0.636 0.047 20 0 "[ . 1 . 2 . ]"
1 25 ALA 0.019 0.018 24 0 "[ . 1 . 2 . ]"
1 26 GLN 0.037 0.014 9 0 "[ . 1 . 2 . ]"
1 27 LEU 0.485 0.118 15 0 "[ . 1 . 2 . ]"
1 28 GLU 0.160 0.118 15 0 "[ . 1 . 2 . ]"
1 29 HIS 0.069 0.014 9 0 "[ . 1 . 2 . ]"
1 30 GLU 0.087 0.021 25 0 "[ . 1 . 2 . ]"
1 31 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 2 GLU 5.282 0.498 1 0 "[ . 1 . 2 . ]"
2 3 VAL 3.984 0.445 24 0 "[ . 1 . 2 . ]"
2 4 GLN 10.344 0.498 1 0 "[ . 1 . 2 . ]"
2 5 ALA 3.971 0.460 1 0 "[ . 1 . 2 . ]"
2 6 LEU 10.352 0.258 1 0 "[ . 1 . 2 . ]"
2 7 LYS 10.926 0.445 24 0 "[ . 1 . 2 . ]"
2 8 LYS 1.657 0.266 24 0 "[ . 1 . 2 . ]"
2 9 ARG 2.438 0.110 8 0 "[ . 1 . 2 . ]"
2 10 VAL 2.095 0.161 4 0 "[ . 1 . 2 . ]"
2 11 GLN 0.083 0.026 6 0 "[ . 1 . 2 . ]"
2 12 ALA 0.362 0.156 6 0 "[ . 1 . 2 . ]"
2 13 LEU 4.774 0.209 24 0 "[ . 1 . 2 . ]"
2 14 LYS 5.303 0.476 6 0 "[ . 1 . 2 . ]"
2 15 ALA 1.378 0.476 6 0 "[ . 1 . 2 . ]"
2 16 ARG 0.169 0.113 10 0 "[ . 1 . 2 . ]"
2 17 ASN 0.700 0.061 6 0 "[ . 1 . 2 . ]"
2 18 TYR 0.995 0.107 8 0 "[ . 1 . 2 . ]"
2 19 ALA 1.296 0.070 9 0 "[ . 1 . 2 . ]"
2 20 LEU 2.122 0.160 15 0 "[ . 1 . 2 . ]"
2 21 LYS 1.491 0.160 15 0 "[ . 1 . 2 . ]"
2 22 GLN 2.581 0.070 9 0 "[ . 1 . 2 . ]"
2 23 LYS 0.938 0.100 8 0 "[ . 1 . 2 . ]"
2 24 VAL 2.042 0.093 24 0 "[ . 1 . 2 . ]"
2 25 GLN 0.328 0.068 8 0 "[ . 1 . 2 . ]"
2 26 ALA 0.000 0.000 . 0 "[ . 1 . 2 . ]"
2 27 LEU 0.799 0.063 8 0 "[ . 1 . 2 . ]"
2 28 ARG 0.978 0.088 21 0 "[ . 1 . 2 . ]"
2 29 HIS 0.005 0.005 10 0 "[ . 1 . 2 . ]"
2 30 LYS 0.050 0.018 21 0 "[ . 1 . 2 . ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 GLU H 1 2 GLU QB 3.500 . 4.600 2.376 2.141 2.837 . 0 0 "[ . 1 . 2 . ]" 1
2 1 2 GLU H 1 2 GLU HG2 5.500 . 7.200 3.554 1.979 4.676 . 0 0 "[ . 1 . 2 . ]" 1
3 1 2 GLU H 1 3 VAL H 3.500 . 4.500 4.004 2.314 4.563 0.063 20 0 "[ . 1 . 2 . ]" 1
4 1 2 GLU H 1 4 ALA H 5.500 . 7.200 5.972 5.006 6.772 . 0 0 "[ . 1 . 2 . ]" 1
5 1 2 GLU H 1 5 GLN H 5.000 . 6.500 5.254 3.545 6.142 . 0 0 "[ . 1 . 2 . ]" 1
6 1 2 GLU HA 1 3 VAL H 2.900 . 3.800 2.419 2.137 3.292 . 0 0 "[ . 1 . 2 . ]" 1
7 1 2 GLU HA 1 3 VAL HB 3.900 . 4.900 4.837 4.468 5.051 0.151 13 0 "[ . 1 . 2 . ]" 1
8 1 2 GLU HA 1 5 GLN H 5.000 . 6.500 4.060 3.077 4.862 . 0 0 "[ . 1 . 2 . ]" 1
9 1 2 GLU HA 1 5 GLN QG 4.500 . 5.900 4.480 2.639 5.304 . 0 0 "[ . 1 . 2 . ]" 1
10 1 2 GLU QB 1 3 VAL H 3.100 . 4.000 3.384 2.424 3.735 . 0 0 "[ . 1 . 2 . ]" 1
11 1 3 VAL H 1 3 VAL HA 2.700 . 3.500 2.807 2.631 2.911 . 0 0 "[ . 1 . 2 . ]" 1
12 1 3 VAL H 1 3 VAL HB 2.200 . 2.900 2.598 2.239 2.694 . 0 0 "[ . 1 . 2 . ]" 1
13 1 3 VAL H 1 3 VAL MG1 4.400 . 5.700 3.771 3.676 3.809 . 0 0 "[ . 1 . 2 . ]" 1
14 1 3 VAL H 1 4 ALA H 2.600 . 3.400 2.789 2.410 3.312 . 0 0 "[ . 1 . 2 . ]" 1
15 1 3 VAL H 1 4 ALA MB 5.500 . 7.200 4.363 4.016 4.864 . 0 0 "[ . 1 . 2 . ]" 1
16 1 3 VAL H 1 5 GLN H 3.900 . 5.100 3.951 3.471 4.487 . 0 0 "[ . 1 . 2 . ]" 1
17 1 3 VAL HA 1 3 VAL HB 2.800 . 3.600 3.017 2.985 3.022 . 0 0 "[ . 1 . 2 . ]" 1
18 1 3 VAL HA 1 3 VAL MG2 3.500 . 4.500 2.369 2.117 2.512 . 0 0 "[ . 1 . 2 . ]" 1
19 1 3 VAL HA 1 4 ALA H 3.400 . 4.400 3.561 3.490 3.576 . 0 0 "[ . 1 . 2 . ]" 1
20 1 3 VAL HA 1 4 ALA HA 3.800 . 4.900 4.798 4.643 4.890 . 0 0 "[ . 1 . 2 . ]" 1
21 1 3 VAL HA 1 5 GLN H 4.100 . 5.300 4.236 3.665 4.856 . 0 0 "[ . 1 . 2 . ]" 1
22 1 3 VAL HA 1 6 LEU H 3.400 . 4.400 3.643 3.002 3.936 . 0 0 "[ . 1 . 2 . ]" 1
23 1 3 VAL HA 1 6 LEU HB2 3.000 . 3.900 3.356 2.467 3.753 . 0 0 "[ . 1 . 2 . ]" 1
24 1 3 VAL HA 1 6 LEU HB3 4.100 . 5.200 4.912 4.053 5.256 0.056 1 0 "[ . 1 . 2 . ]" 1
25 1 3 VAL HA 1 6 LEU QD 4.200 . 5.400 2.719 2.045 3.624 . 0 0 "[ . 1 . 2 . ]" 1
26 1 3 VAL HA 1 7 GLU H 4.200 . 5.400 4.490 4.043 5.319 . 0 0 "[ . 1 . 2 . ]" 1
27 1 3 VAL HB 1 4 ALA H 2.800 . 3.600 2.303 2.006 2.762 . 0 0 "[ . 1 . 2 . ]" 1
28 1 3 VAL HB 1 4 ALA MB 3.800 . 4.800 3.776 3.507 4.085 . 0 0 "[ . 1 . 2 . ]" 1
29 1 3 VAL HB 1 5 GLN H 3.700 . 4.800 4.705 4.406 4.851 0.051 24 0 "[ . 1 . 2 . ]" 1
30 1 3 VAL MG1 1 3 VAL MG2 2.900 . 3.800 2.028 1.914 2.092 . 0 0 "[ . 1 . 2 . ]" 1
31 1 3 VAL MG1 1 4 ALA H 4.300 . 5.600 3.264 2.771 3.537 . 0 0 "[ . 1 . 2 . ]" 1
32 1 3 VAL MG1 1 4 ALA HA 4.900 . 6.400 3.471 3.130 3.705 . 0 0 "[ . 1 . 2 . ]" 1
33 1 3 VAL MG1 1 6 LEU H 5.500 . 7.200 4.418 3.641 4.795 . 0 0 "[ . 1 . 2 . ]" 1
34 1 3 VAL MG1 1 7 GLU H 5.500 . 7.200 4.046 3.228 4.671 . 0 0 "[ . 1 . 2 . ]" 1
35 1 3 VAL MG1 1 7 GLU QG 4.300 . 5.600 2.682 1.759 3.885 0.041 8 0 "[ . 1 . 2 . ]" 1
36 1 3 VAL MG1 2 3 VAL H 5.100 . 6.600 4.080 3.238 5.334 . 0 0 "[ . 1 . 2 . ]" 1
37 1 3 VAL MG2 1 4 ALA H 5.500 . 7.200 3.668 3.502 4.057 . 0 0 "[ . 1 . 2 . ]" 1
38 1 3 VAL MG2 2 3 VAL HA 4.200 . 5.400 4.248 3.755 4.680 . 0 0 "[ . 1 . 2 . ]" 1
39 1 4 ALA H 1 4 ALA HA 3.000 . 3.900 2.786 2.726 2.886 . 0 0 "[ . 1 . 2 . ]" 1
40 1 4 ALA H 1 4 ALA MB 3.100 . 4.000 2.139 2.064 2.259 . 0 0 "[ . 1 . 2 . ]" 1
41 1 4 ALA H 1 5 GLN H 2.500 . 3.200 2.721 2.348 2.939 . 0 0 "[ . 1 . 2 . ]" 1
42 1 4 ALA H 1 5 GLN QB 4.700 . 5.900 4.542 4.029 4.888 . 0 0 "[ . 1 . 2 . ]" 1
43 1 4 ALA H 1 6 LEU H 3.600 . 4.600 4.209 4.045 4.481 . 0 0 "[ . 1 . 2 . ]" 1
44 1 4 ALA H 1 7 GLU H 3.900 . 5.100 4.801 4.511 5.247 0.147 1 0 "[ . 1 . 2 . ]" 1
45 1 4 ALA HA 1 5 GLN H 3.800 . 4.900 3.500 3.301 3.569 . 0 0 "[ . 1 . 2 . ]" 1
46 1 4 ALA HA 1 7 GLU H 3.300 . 4.200 3.221 2.891 3.732 . 0 0 "[ . 1 . 2 . ]" 1
47 1 4 ALA HA 1 7 GLU HB2 2.900 . 3.800 2.546 1.958 3.491 . 0 0 "[ . 1 . 2 . ]" 1
48 1 4 ALA HA 1 7 GLU HB3 4.100 . 5.300 4.138 3.409 5.147 . 0 0 "[ . 1 . 2 . ]" 1
49 1 4 ALA HA 1 7 GLU QG 4.600 . 6.000 2.906 2.121 3.657 . 0 0 "[ . 1 . 2 . ]" 1
50 1 4 ALA MB 1 5 GLN H 3.800 . 4.900 2.735 2.288 3.204 . 0 0 "[ . 1 . 2 . ]" 1
51 1 4 ALA MB 1 8 LYS HD3 3.600 . 4.600 3.577 3.389 3.814 . 0 0 "[ . 1 . 2 . ]" 1
52 1 4 ALA MB 1 8 LYS QE 5.500 . 7.200 4.009 1.912 5.046 . 0 0 "[ . 1 . 2 . ]" 1
53 1 5 GLN H 1 5 GLN QB 3.000 . 3.900 2.245 2.051 2.478 . 0 0 "[ . 1 . 2 . ]" 1
54 1 5 GLN H 1 5 GLN QG 3.900 . 5.100 2.996 2.226 4.026 . 0 0 "[ . 1 . 2 . ]" 1
55 1 5 GLN H 1 6 LEU H 2.500 . 3.200 2.658 2.326 2.817 . 0 0 "[ . 1 . 2 . ]" 1
56 1 5 GLN H 1 6 LEU QD 5.500 . 7.200 4.582 3.820 5.158 . 0 0 "[ . 1 . 2 . ]" 1
57 1 5 GLN H 1 7 GLU H 3.600 . 4.700 4.112 3.809 4.354 . 0 0 "[ . 1 . 2 . ]" 1
58 1 5 GLN HA 1 7 GLU H 4.000 . 5.200 4.504 4.224 4.844 . 0 0 "[ . 1 . 2 . ]" 1
59 1 5 GLN HA 1 7 GLU QG 5.500 . 7.200 6.181 5.802 6.421 . 0 0 "[ . 1 . 2 . ]" 1
60 1 5 GLN HA 1 8 LYS H 4.000 . 5.200 4.083 3.210 5.068 . 0 0 "[ . 1 . 2 . ]" 1
61 1 5 GLN HA 1 8 LYS QG 5.100 . 6.600 3.573 2.230 5.424 . 0 0 "[ . 1 . 2 . ]" 1
62 1 5 GLN QB 1 6 LEU H 3.000 . 3.900 2.935 2.465 3.578 . 0 0 "[ . 1 . 2 . ]" 1
63 1 5 GLN QB 1 6 LEU HA 4.200 . 5.400 4.031 3.828 4.456 . 0 0 "[ . 1 . 2 . ]" 1
64 1 5 GLN QB 1 6 LEU HG 4.000 . 5.200 3.388 2.796 4.375 . 0 0 "[ . 1 . 2 . ]" 1
65 1 5 GLN QG 1 6 LEU H 4.700 . 6.100 4.283 2.287 4.728 . 0 0 "[ . 1 . 2 . ]" 1
66 1 6 LEU H 1 6 LEU HB2 2.900 . 3.800 2.501 2.197 2.803 . 0 0 "[ . 1 . 2 . ]" 1
67 1 6 LEU H 1 6 LEU HB3 3.300 . 4.300 3.628 3.485 3.786 . 0 0 "[ . 1 . 2 . ]" 1
68 1 6 LEU H 1 6 LEU QD 4.300 . 5.600 3.169 2.320 3.504 . 0 0 "[ . 1 . 2 . ]" 1
69 1 6 LEU H 1 6 LEU HG 5.000 . 6.500 2.580 1.980 3.076 . 0 0 "[ . 1 . 2 . ]" 1
70 1 6 LEU H 1 7 GLU H 2.600 . 3.400 2.316 1.966 2.819 . 0 0 "[ . 1 . 2 . ]" 1
71 1 6 LEU H 1 8 LYS H 3.500 . 4.400 4.089 3.759 4.409 0.009 26 0 "[ . 1 . 2 . ]" 1
72 1 6 LEU H 1 9 GLU H 5.000 . 6.500 4.529 3.781 5.068 . 0 0 "[ . 1 . 2 . ]" 1
73 1 6 LEU HA 1 6 LEU QD 3.800 . 4.900 2.171 1.736 2.572 0.064 19 0 "[ . 1 . 2 . ]" 1
74 1 6 LEU HA 1 6 LEU HG 3.000 . 3.900 3.023 2.656 3.626 . 0 0 "[ . 1 . 2 . ]" 1
75 1 6 LEU HA 1 7 GLU H 2.800 . 3.600 3.512 3.471 3.550 . 0 0 "[ . 1 . 2 . ]" 1
76 1 6 LEU HA 1 7 GLU HA 3.800 . 4.900 4.816 4.664 4.929 0.029 24 0 "[ . 1 . 2 . ]" 1
77 1 6 LEU HA 1 9 GLU H 3.100 . 4.000 3.324 2.775 4.001 0.001 5 0 "[ . 1 . 2 . ]" 1
78 1 6 LEU HA 1 9 GLU HB2 3.000 . 3.800 2.674 2.305 3.408 . 0 0 "[ . 1 . 2 . ]" 1
79 1 6 LEU HA 1 9 GLU QG 4.400 . 5.700 4.276 3.311 4.814 . 0 0 "[ . 1 . 2 . ]" 1
80 1 6 LEU HA 1 10 VAL H 4.400 . 5.700 4.759 3.968 5.242 . 0 0 "[ . 1 . 2 . ]" 1
81 1 6 LEU HA 2 10 VAL MG2 4.700 . 6.100 3.582 2.770 4.748 . 0 0 "[ . 1 . 2 . ]" 1
82 1 6 LEU HB2 1 7 GLU H 2.900 . 3.800 2.748 2.464 2.987 . 0 0 "[ . 1 . 2 . ]" 1
83 1 6 LEU HB2 1 7 GLU QG 4.900 . 6.400 3.699 2.950 4.617 . 0 0 "[ . 1 . 2 . ]" 1
84 1 6 LEU HB3 1 7 GLU H 3.600 . 4.700 3.733 3.122 4.105 . 0 0 "[ . 1 . 2 . ]" 1
85 1 6 LEU HB3 2 6 LEU MD1 5.000 . 6.400 4.220 2.760 5.206 . 0 0 "[ . 1 . 2 . ]" 1
86 1 6 LEU QD 2 3 VAL HA 4.900 . 6.400 2.287 1.822 4.671 . 0 0 "[ . 1 . 2 . ]" 1
87 1 6 LEU QD 2 7 LYS H 4.600 . 6.000 2.878 1.879 3.775 . 0 0 "[ . 1 . 2 . ]" 1
88 1 6 LEU QD 2 7 LYS HA 4.700 . 6.100 2.260 1.858 3.190 . 0 0 "[ . 1 . 2 . ]" 1
89 1 6 LEU QD 2 7 LYS HE2 4.200 . 5.500 3.114 1.982 4.119 . 0 0 "[ . 1 . 2 . ]" 1
90 1 6 LEU HG 1 7 GLU H 4.200 . 5.500 4.338 3.742 4.768 . 0 0 "[ . 1 . 2 . ]" 1
91 1 6 LEU HG 2 3 VAL MG1 4.300 . 5.500 4.083 3.249 4.642 . 0 0 "[ . 1 . 2 . ]" 1
92 1 6 LEU HG 2 7 LYS HD3 3.200 . 4.100 4.086 3.767 4.397 0.297 19 0 "[ . 1 . 2 . ]" 1
93 1 7 GLU H 1 7 GLU HA 3.000 . 3.900 2.804 2.739 2.900 . 0 0 "[ . 1 . 2 . ]" 1
94 1 7 GLU H 1 7 GLU HB2 2.400 . 3.100 2.396 2.138 2.735 . 0 0 "[ . 1 . 2 . ]" 1
95 1 7 GLU H 1 7 GLU HB3 3.300 . 4.300 3.557 3.455 3.640 . 0 0 "[ . 1 . 2 . ]" 1
96 1 7 GLU H 1 7 GLU QG 3.300 . 4.300 2.491 1.943 3.000 . 0 0 "[ . 1 . 2 . ]" 1
97 1 7 GLU H 1 8 LYS H 2.500 . 3.200 2.753 2.420 3.117 . 0 0 "[ . 1 . 2 . ]" 1
98 1 7 GLU H 1 9 GLU H 3.900 . 5.100 3.867 3.525 4.169 . 0 0 "[ . 1 . 2 . ]" 1
99 1 7 GLU H 1 10 VAL H 5.000 . 6.500 5.147 4.873 5.333 . 0 0 "[ . 1 . 2 . ]" 1
100 1 7 GLU H 1 10 VAL MG2 5.500 . 7.200 4.936 4.204 5.826 . 0 0 "[ . 1 . 2 . ]" 1
101 1 7 GLU H 2 6 LEU MD1 5.500 . 7.200 3.772 2.383 4.976 . 0 0 "[ . 1 . 2 . ]" 1
102 1 7 GLU H 2 6 LEU MD2 5.500 . 7.200 4.904 3.988 5.475 . 0 0 "[ . 1 . 2 . ]" 1
103 1 7 GLU HA 1 7 GLU HB3 2.800 . 3.600 2.551 2.369 2.741 . 0 0 "[ . 1 . 2 . ]" 1
104 1 7 GLU HA 1 7 GLU QG 3.600 . 4.700 2.357 2.065 2.645 . 0 0 "[ . 1 . 2 . ]" 1
105 1 7 GLU HA 1 8 LYS H 3.000 . 3.900 3.533 3.462 3.572 . 0 0 "[ . 1 . 2 . ]" 1
106 1 7 GLU HA 1 10 VAL H 3.600 . 4.700 3.874 3.491 4.147 . 0 0 "[ . 1 . 2 . ]" 1
107 1 7 GLU HA 1 10 VAL HB 3.200 . 4.100 3.866 3.064 4.112 0.012 10 0 "[ . 1 . 2 . ]" 1
108 1 7 GLU HA 1 10 VAL MG2 4.200 . 5.400 3.237 2.182 4.355 . 0 0 "[ . 1 . 2 . ]" 1
109 1 7 GLU HA 2 6 LEU MD1 5.200 . 6.700 2.513 1.866 3.567 . 0 0 "[ . 1 . 2 . ]" 1
110 1 7 GLU HB2 1 7 GLU QG 2.500 . 3.200 2.226 2.132 2.446 . 0 0 "[ . 1 . 2 . ]" 1
111 1 7 GLU HB2 1 8 LYS H 2.300 . 3.000 2.578 1.938 3.001 0.001 24 0 "[ . 1 . 2 . ]" 1
112 1 7 GLU HB2 1 8 LYS HA 3.700 . 4.700 4.480 4.016 4.826 0.126 24 0 "[ . 1 . 2 . ]" 1
113 1 7 GLU HB2 2 6 LEU MD2 5.200 . 6.600 5.180 4.283 5.403 . 0 0 "[ . 1 . 2 . ]" 1
114 1 7 GLU HB3 1 8 LYS QG 3.900 . 4.900 4.106 3.690 4.360 . 0 0 "[ . 1 . 2 . ]" 1
115 1 7 GLU QG 1 8 LYS H 5.500 . 7.200 4.088 3.610 4.429 . 0 0 "[ . 1 . 2 . ]" 1
116 1 7 GLU QG 2 6 LEU MD1 4.900 . 6.400 1.983 1.756 2.937 0.044 16 0 "[ . 1 . 2 . ]" 1
117 1 7 GLU QG 2 6 LEU MD2 5.500 . 7.200 3.472 2.087 4.207 . 0 0 "[ . 1 . 2 . ]" 1
118 1 8 LYS H 1 8 LYS HD2 3.900 . 5.100 3.698 1.910 4.796 . 0 0 "[ . 1 . 2 . ]" 1
119 1 8 LYS H 1 8 LYS HD3 3.900 . 5.100 3.914 2.594 4.626 . 0 0 "[ . 1 . 2 . ]" 1
120 1 8 LYS H 1 9 GLU H 2.400 . 3.100 2.493 2.066 2.717 . 0 0 "[ . 1 . 2 . ]" 1
121 1 8 LYS HA 1 8 LYS HD3 4.200 . 5.300 4.374 3.590 5.176 . 0 0 "[ . 1 . 2 . ]" 1
122 1 8 LYS HA 1 8 LYS QE 5.500 . 7.200 4.179 2.986 5.435 . 0 0 "[ . 1 . 2 . ]" 1
123 1 8 LYS HA 1 8 LYS QG 3.400 . 4.400 2.806 2.236 3.370 . 0 0 "[ . 1 . 2 . ]" 1
124 1 8 LYS HA 1 10 VAL H 2.800 . 3.700 3.718 3.703 3.753 0.053 1 0 "[ . 1 . 2 . ]" 1
125 1 8 LYS HA 1 12 GLN HB3 4.500 . 5.800 5.820 5.700 5.882 0.082 6 0 "[ . 1 . 2 . ]" 1
126 1 8 LYS HD2 1 12 GLN H 5.500 . 7.100 6.775 5.823 7.146 0.046 19 0 "[ . 1 . 2 . ]" 1
127 1 9 GLU H 1 9 GLU HA 2.900 . 3.800 2.796 2.773 2.850 . 0 0 "[ . 1 . 2 . ]" 1
128 1 9 GLU H 1 9 GLU HB2 2.200 . 2.900 2.342 2.272 2.546 . 0 0 "[ . 1 . 2 . ]" 1
129 1 9 GLU H 1 9 GLU HB3 2.200 . 2.800 2.724 2.520 2.802 0.002 22 0 "[ . 1 . 2 . ]" 1
130 1 9 GLU H 1 10 VAL H 2.500 . 3.200 2.652 2.455 2.709 . 0 0 "[ . 1 . 2 . ]" 1
131 1 9 GLU H 1 10 VAL HA 4.400 . 5.700 5.252 5.071 5.315 . 0 0 "[ . 1 . 2 . ]" 1
132 1 9 GLU H 1 10 VAL MG2 5.500 . 7.200 4.125 3.722 5.066 . 0 0 "[ . 1 . 2 . ]" 1
133 1 9 GLU H 2 10 VAL MG2 5.500 . 7.200 4.236 3.960 4.558 . 0 0 "[ . 1 . 2 . ]" 1
134 1 9 GLU HA 1 9 GLU HB2 1.900 . 2.500 2.544 2.475 2.582 0.082 17 0 "[ . 1 . 2 . ]" 1
135 1 9 GLU HA 1 9 GLU HB3 2.700 . 3.400 3.011 2.996 3.026 . 0 0 "[ . 1 . 2 . ]" 1
136 1 9 GLU HA 1 10 VAL H 4.000 . 5.200 3.464 3.429 3.489 . 0 0 "[ . 1 . 2 . ]" 1
137 1 9 GLU HB2 1 9 GLU QG 2.400 . 3.100 2.399 2.293 2.521 . 0 0 "[ . 1 . 2 . ]" 1
138 1 9 GLU HB2 1 10 VAL H 3.600 . 4.600 3.944 3.886 4.090 . 0 0 "[ . 1 . 2 . ]" 1
139 1 9 GLU HB2 1 10 VAL MG2 5.800 . 7.400 4.707 4.464 5.563 . 0 0 "[ . 1 . 2 . ]" 1
140 1 9 GLU HB2 2 10 VAL MG2 3.700 . 4.800 3.686 3.426 3.945 . 0 0 "[ . 1 . 2 . ]" 1
141 1 9 GLU QG 1 10 VAL H 5.500 . 7.200 4.142 4.013 4.318 . 0 0 "[ . 1 . 2 . ]" 1
142 1 9 GLU QG 1 12 GLN HB2 4.200 . 5.300 4.660 4.395 4.807 . 0 0 "[ . 1 . 2 . ]" 1
143 1 9 GLU QG 1 13 LEU MD1 4.400 . 5.700 3.117 2.484 4.144 . 0 0 "[ . 1 . 2 . ]" 1
144 1 9 GLU QG 2 10 VAL HB 3.900 . 4.900 3.936 3.131 4.116 . 0 0 "[ . 1 . 2 . ]" 1
145 1 10 VAL H 1 10 VAL HA 2.400 . 3.100 2.872 2.848 2.900 . 0 0 "[ . 1 . 2 . ]" 1
146 1 10 VAL H 1 10 VAL HB 2.000 . 2.600 2.445 2.137 2.563 . 0 0 "[ . 1 . 2 . ]" 1
147 1 10 VAL H 1 10 VAL MG2 3.300 . 4.300 2.357 2.201 3.145 . 0 0 "[ . 1 . 2 . ]" 1
148 1 10 VAL H 1 11 ALA H 2.500 . 3.300 2.628 2.396 2.732 . 0 0 "[ . 1 . 2 . ]" 1
149 1 10 VAL H 1 11 ALA MB 5.500 . 7.200 4.187 3.982 4.303 . 0 0 "[ . 1 . 2 . ]" 1
150 1 10 VAL H 1 12 GLN H 3.800 . 4.900 3.639 3.559 3.726 . 0 0 "[ . 1 . 2 . ]" 1
151 1 10 VAL H 1 12 GLN HB3 3.800 . 4.900 4.690 4.488 4.810 . 0 0 "[ . 1 . 2 . ]" 1
152 1 10 VAL H 2 10 VAL MG1 5.500 . 7.200 4.236 3.686 5.173 . 0 0 "[ . 1 . 2 . ]" 1
153 1 10 VAL H 2 10 VAL MG2 4.600 . 6.000 3.201 2.880 3.727 . 0 0 "[ . 1 . 2 . ]" 1
154 1 10 VAL HA 1 10 VAL HB 2.800 . 3.600 3.018 2.905 3.026 . 0 0 "[ . 1 . 2 . ]" 1
155 1 10 VAL HA 1 10 VAL MG2 3.100 . 4.000 2.331 2.144 2.448 . 0 0 "[ . 1 . 2 . ]" 1
156 1 10 VAL HA 1 11 ALA H 3.200 . 4.200 3.570 3.549 3.576 . 0 0 "[ . 1 . 2 . ]" 1
157 1 10 VAL HA 1 12 GLN H 4.600 . 6.000 3.955 3.805 4.110 . 0 0 "[ . 1 . 2 . ]" 1
158 1 10 VAL HA 1 13 LEU H 3.000 . 3.900 3.571 3.366 3.866 . 0 0 "[ . 1 . 2 . ]" 1
159 1 10 VAL HA 1 13 LEU HB2 3.800 . 4.800 3.635 3.375 4.210 . 0 0 "[ . 1 . 2 . ]" 1
160 1 10 VAL HA 1 13 LEU HB3 5.000 . 6.500 5.316 4.747 5.930 . 0 0 "[ . 1 . 2 . ]" 1
161 1 10 VAL HA 1 13 LEU MD1 4.000 . 5.200 3.327 2.511 3.768 . 0 0 "[ . 1 . 2 . ]" 1
162 1 10 VAL HA 1 14 GLU H 3.400 . 4.400 3.926 3.504 4.353 . 0 0 "[ . 1 . 2 . ]" 1
163 1 10 VAL HA 2 10 VAL MG2 4.000 . 5.200 2.800 2.402 3.079 . 0 0 "[ . 1 . 2 . ]" 1
164 1 10 VAL HA 2 13 LEU MD1 3.400 . 4.400 2.015 1.914 2.568 . 0 0 "[ . 1 . 2 . ]" 1
165 1 10 VAL HA 2 13 LEU MD2 5.500 . 7.200 4.118 3.830 5.125 . 0 0 "[ . 1 . 2 . ]" 1
166 1 10 VAL HB 1 11 ALA H 2.300 . 3.000 2.324 2.173 2.887 . 0 0 "[ . 1 . 2 . ]" 1
167 1 10 VAL HB 2 9 ARG HE 3.100 . 4.000 3.667 3.326 4.025 0.025 6 0 "[ . 1 . 2 . ]" 1
168 1 10 VAL MG1 1 11 ALA H 5.500 . 7.200 3.043 2.139 3.396 . 0 0 "[ . 1 . 2 . ]" 1
169 1 10 VAL MG1 1 14 GLU H 4.400 . 5.700 3.706 3.275 4.395 . 0 0 "[ . 1 . 2 . ]" 1
170 1 10 VAL MG1 1 14 GLU HG2 4.800 . 6.200 3.567 3.354 4.525 . 0 0 "[ . 1 . 2 . ]" 1
171 1 10 VAL MG1 1 14 GLU HG3 3.900 . 5.000 2.365 2.043 3.334 . 0 0 "[ . 1 . 2 . ]" 1
172 1 10 VAL MG1 2 9 ARG HD3 4.200 . 5.400 3.235 2.894 4.212 . 0 0 "[ . 1 . 2 . ]" 1
173 1 10 VAL MG2 1 11 ALA H 4.100 . 5.300 3.765 3.617 4.068 . 0 0 "[ . 1 . 2 . ]" 1
174 1 10 VAL MG2 1 13 LEU H 5.300 . 6.800 5.312 5.148 5.602 . 0 0 "[ . 1 . 2 . ]" 1
175 1 10 VAL MG2 2 6 LEU HA 5.000 . 6.500 3.687 3.278 4.505 . 0 0 "[ . 1 . 2 . ]" 1
176 1 10 VAL MG2 2 6 LEU HB2 4.500 . 5.700 4.505 3.967 4.750 . 0 0 "[ . 1 . 2 . ]" 1
177 1 10 VAL MG2 2 9 ARG HD3 4.600 . 6.000 3.265 2.992 3.467 . 0 0 "[ . 1 . 2 . ]" 1
178 1 10 VAL MG2 2 9 ARG HG2 5.500 . 7.200 2.794 2.125 3.324 . 0 0 "[ . 1 . 2 . ]" 1
179 1 10 VAL MG2 2 9 ARG HG3 4.200 . 5.500 2.365 1.974 2.862 . 0 0 "[ . 1 . 2 . ]" 1
180 1 10 VAL MG2 2 10 VAL H 4.800 . 6.200 3.488 3.213 3.936 . 0 0 "[ . 1 . 2 . ]" 1
181 1 10 VAL MG2 2 10 VAL HA 4.100 . 5.300 2.751 2.433 3.222 . 0 0 "[ . 1 . 2 . ]" 1
182 1 10 VAL MG2 2 10 VAL MG2 2.700 . 3.500 1.799 1.639 2.082 0.161 4 0 "[ . 1 . 2 . ]" 1
183 1 10 VAL MG2 2 13 LEU MD2 4.800 . 6.100 3.970 3.895 4.053 . 0 0 "[ . 1 . 2 . ]" 1
184 1 11 ALA H 1 11 ALA HA 3.000 . 3.900 2.778 2.752 2.811 . 0 0 "[ . 1 . 2 . ]" 1
185 1 11 ALA H 1 11 ALA MB 3.200 . 4.200 2.123 2.054 2.233 . 0 0 "[ . 1 . 2 . ]" 1
186 1 11 ALA H 1 12 GLN H 2.400 . 3.100 2.693 2.595 2.766 . 0 0 "[ . 1 . 2 . ]" 1
187 1 11 ALA H 1 12 GLN HB3 4.100 . 5.200 4.890 4.586 5.006 . 0 0 "[ . 1 . 2 . ]" 1
188 1 11 ALA H 1 13 LEU H 4.100 . 5.300 4.662 4.395 5.058 . 0 0 "[ . 1 . 2 . ]" 1
189 1 11 ALA H 1 14 GLU H 4.500 . 5.800 4.754 4.584 5.563 . 0 0 "[ . 1 . 2 . ]" 1
190 1 11 ALA HA 1 12 GLN H 3.000 . 3.900 3.465 3.446 3.491 . 0 0 "[ . 1 . 2 . ]" 1
191 1 11 ALA HA 1 14 GLU H 3.600 . 4.600 3.542 3.313 4.312 . 0 0 "[ . 1 . 2 . ]" 1
192 1 11 ALA HA 1 14 GLU HG2 4.200 . 5.400 4.841 4.287 5.401 0.001 4 0 "[ . 1 . 2 . ]" 1
193 1 11 ALA HA 1 15 ALA H 4.400 . 5.700 4.155 3.695 4.667 . 0 0 "[ . 1 . 2 . ]" 1
194 1 11 ALA MB 1 12 GLN H 3.900 . 5.100 2.877 2.769 2.937 . 0 0 "[ . 1 . 2 . ]" 1
195 1 11 ALA MB 1 12 GLN HB3 4.600 . 6.000 4.855 4.630 4.946 . 0 0 "[ . 1 . 2 . ]" 1
196 1 11 ALA MB 1 13 LEU H 5.500 . 7.200 4.908 4.655 5.242 . 0 0 "[ . 1 . 2 . ]" 1
197 1 11 ALA MB 1 14 GLU H 4.900 . 6.400 4.740 4.517 5.397 . 0 0 "[ . 1 . 2 . ]" 1
198 1 11 ALA MB 1 15 ALA H 5.500 . 7.200 4.818 4.573 5.095 . 0 0 "[ . 1 . 2 . ]" 1
199 1 12 GLN H 1 12 GLN HA 2.900 . 3.800 2.820 2.760 2.850 . 0 0 "[ . 1 . 2 . ]" 1
200 1 12 GLN H 1 12 GLN HB2 2.400 . 3.100 2.595 2.495 2.785 . 0 0 "[ . 1 . 2 . ]" 1
201 1 12 GLN H 1 12 GLN HG2 3.800 . 4.900 4.490 4.390 4.600 . 0 0 "[ . 1 . 2 . ]" 1
202 1 12 GLN H 1 12 GLN HG3 4.200 . 5.500 4.450 4.227 4.618 . 0 0 "[ . 1 . 2 . ]" 1
203 1 12 GLN H 1 13 LEU H 2.500 . 3.300 2.767 2.565 3.049 . 0 0 "[ . 1 . 2 . ]" 1
204 1 12 GLN H 1 14 GLU H 4.200 . 5.400 3.926 3.732 4.643 . 0 0 "[ . 1 . 2 . ]" 1
205 1 12 GLN HA 1 12 GLN HB2 2.800 . 3.600 2.429 2.319 2.465 . 0 0 "[ . 1 . 2 . ]" 1
206 1 12 GLN HA 1 12 GLN HG2 3.200 . 4.100 3.380 2.422 3.951 . 0 0 "[ . 1 . 2 . ]" 1
207 1 12 GLN HA 1 12 GLN HG3 3.100 . 4.000 2.961 2.438 3.648 . 0 0 "[ . 1 . 2 . ]" 1
208 1 12 GLN HA 1 15 ALA H 4.200 . 5.400 4.041 3.637 4.298 . 0 0 "[ . 1 . 2 . ]" 1
209 1 12 GLN HB2 1 13 LEU H 3.000 . 3.900 3.775 3.562 3.914 0.014 2 0 "[ . 1 . 2 . ]" 1
210 1 12 GLN HB3 1 12 GLN HG3 2.300 . 2.900 2.729 2.460 2.979 0.079 2 0 "[ . 1 . 2 . ]" 1
211 1 12 GLN HB3 1 13 LEU H 3.000 . 3.900 2.372 2.062 2.642 . 0 0 "[ . 1 . 2 . ]" 1
212 1 12 GLN HB3 1 13 LEU MD1 4.200 . 5.500 4.356 4.169 4.602 . 0 0 "[ . 1 . 2 . ]" 1
213 1 12 GLN HB3 1 15 ALA MB 5.800 . 7.400 5.695 5.125 5.899 . 0 0 "[ . 1 . 2 . ]" 1
214 1 12 GLN HG3 1 13 LEU H 5.000 . 6.500 3.954 2.555 4.878 . 0 0 "[ . 1 . 2 . ]" 1
215 1 13 LEU H 1 13 LEU HB2 2.400 . 3.100 2.598 2.491 3.107 0.007 6 0 "[ . 1 . 2 . ]" 1
216 1 13 LEU H 1 13 LEU HB3 2.900 . 3.800 3.610 3.452 3.667 . 0 0 "[ . 1 . 2 . ]" 1
217 1 13 LEU H 1 13 LEU MD1 4.200 . 5.500 3.466 3.326 3.527 . 0 0 "[ . 1 . 2 . ]" 1
218 1 13 LEU H 1 13 LEU MD2 4.200 . 5.400 3.368 1.983 3.652 . 0 0 "[ . 1 . 2 . ]" 1
219 1 13 LEU H 1 14 GLU H 2.600 . 3.400 2.524 2.288 3.331 . 0 0 "[ . 1 . 2 . ]" 1
220 1 13 LEU H 1 15 ALA H 4.500 . 5.900 4.020 3.802 4.267 . 0 0 "[ . 1 . 2 . ]" 1
221 1 13 LEU H 2 10 VAL MG2 5.200 . 6.700 5.305 4.787 5.471 . 0 0 "[ . 1 . 2 . ]" 1
222 1 13 LEU H 2 13 LEU MD1 5.500 . 7.200 3.338 3.140 3.991 . 0 0 "[ . 1 . 2 . ]" 1
223 1 13 LEU H 2 14 LYS HB3 4.700 . 5.900 5.922 5.835 6.170 0.270 18 0 "[ . 1 . 2 . ]" 1
224 1 13 LEU HA 1 13 LEU HB3 2.800 . 3.600 2.416 2.272 2.470 . 0 0 "[ . 1 . 2 . ]" 1
225 1 13 LEU HA 1 13 LEU MD1 4.400 . 5.700 3.918 3.878 3.957 . 0 0 "[ . 1 . 2 . ]" 1
226 1 13 LEU HA 1 13 LEU MD2 3.600 . 4.700 2.237 1.974 2.401 . 0 0 "[ . 1 . 2 . ]" 1
227 1 13 LEU HA 1 14 GLU H 3.500 . 4.600 3.525 3.488 3.577 . 0 0 "[ . 1 . 2 . ]" 1
228 1 13 LEU HA 1 16 GLU H 5.000 . 6.500 3.047 2.938 3.572 . 0 0 "[ . 1 . 2 . ]" 1
229 1 13 LEU HA 1 17 ASN H 3.500 . 4.500 2.933 2.492 3.386 . 0 0 "[ . 1 . 2 . ]" 1
230 1 13 LEU HA 2 14 LYS HB3 4.000 . 5.200 5.194 5.075 5.408 0.208 6 0 "[ . 1 . 2 . ]" 1
231 1 13 LEU HB2 1 13 LEU MD1 2.900 . 3.800 2.268 2.157 2.311 . 0 0 "[ . 1 . 2 . ]" 1
232 1 13 LEU HB2 1 14 GLU H 2.900 . 3.800 2.638 1.860 2.882 . 0 0 "[ . 1 . 2 . ]" 1
233 1 13 LEU HB2 1 16 GLU H 4.300 . 5.400 5.307 5.103 5.463 0.063 6 0 "[ . 1 . 2 . ]" 1
234 1 13 LEU HB2 1 17 ASN HB3 3.800 . 4.900 4.457 4.099 4.604 . 0 0 "[ . 1 . 2 . ]" 1
235 1 13 LEU HB2 2 13 LEU H 4.200 . 5.300 4.819 4.697 5.010 . 0 0 "[ . 1 . 2 . ]" 1
236 1 13 LEU HB2 2 13 LEU HB3 1.900 . 2.500 2.538 2.501 2.697 0.197 24 0 "[ . 1 . 2 . ]" 1
237 1 13 LEU HB2 2 13 LEU MD1 3.700 . 4.800 1.974 1.660 2.169 0.140 18 0 "[ . 1 . 2 . ]" 1
238 1 13 LEU HB3 1 13 LEU MD1 3.100 . 4.000 2.456 2.368 2.589 . 0 0 "[ . 1 . 2 . ]" 1
239 1 13 LEU HB3 1 14 GLU H 3.200 . 4.200 3.771 3.387 3.921 . 0 0 "[ . 1 . 2 . ]" 1
240 1 13 LEU HB3 1 17 ASN HD21 3.900 . 5.100 4.117 3.651 4.504 . 0 0 "[ . 1 . 2 . ]" 1
241 1 13 LEU HB3 1 17 ASN HD22 4.500 . 5.800 5.492 4.352 5.702 . 0 0 "[ . 1 . 2 . ]" 1
242 1 13 LEU HB3 2 13 LEU HB2 2.200 . 2.800 2.239 1.960 2.659 . 0 0 "[ . 1 . 2 . ]" 1
243 1 13 LEU HB3 2 13 LEU MD1 3.700 . 4.800 3.320 3.016 3.460 . 0 0 "[ . 1 . 2 . ]" 1
244 1 13 LEU HB3 2 14 LYS HB3 3.700 . 4.800 3.748 3.616 4.039 . 0 0 "[ . 1 . 2 . ]" 1
245 1 13 LEU MD1 1 13 LEU MD2 2.800 . 3.600 2.062 1.969 2.091 . 0 0 "[ . 1 . 2 . ]" 1
246 1 13 LEU MD1 1 14 GLU H 4.400 . 5.700 4.359 3.703 4.617 . 0 0 "[ . 1 . 2 . ]" 1
247 1 13 LEU MD1 1 17 ASN H 5.300 . 6.800 5.486 5.342 5.758 . 0 0 "[ . 1 . 2 . ]" 1
248 1 13 LEU MD1 1 17 ASN HB3 5.100 . 6.500 5.330 5.302 5.387 . 0 0 "[ . 1 . 2 . ]" 1
249 1 13 LEU MD1 1 17 ASN HD21 4.900 . 6.400 4.943 4.635 5.101 . 0 0 "[ . 1 . 2 . ]" 1
250 1 13 LEU MD1 2 10 VAL HA 4.600 . 6.000 3.057 1.781 3.363 0.019 18 0 "[ . 1 . 2 . ]" 1
251 1 13 LEU MD1 2 13 LEU HB3 3.700 . 4.800 3.352 3.104 3.444 . 0 0 "[ . 1 . 2 . ]" 1
252 1 13 LEU MD1 2 14 LYS H 4.600 . 6.000 1.988 1.857 2.179 . 0 0 "[ . 1 . 2 . ]" 1
253 1 13 LEU MD1 2 14 LYS HA 4.600 . 6.000 3.044 2.838 3.702 . 0 0 "[ . 1 . 2 . ]" 1
254 1 13 LEU MD1 2 14 LYS HB3 3.900 . 5.100 1.912 1.815 2.756 . 0 0 "[ . 1 . 2 . ]" 1
255 1 13 LEU MD1 2 14 LYS HD2 4.900 . 6.400 4.277 3.919 4.598 . 0 0 "[ . 1 . 2 . ]" 1
256 1 13 LEU MD1 2 14 LYS HD3 4.000 . 5.200 4.163 3.250 4.280 . 0 0 "[ . 1 . 2 . ]" 1
257 1 13 LEU MD1 2 14 LYS HE2 4.400 . 5.700 3.873 2.536 4.217 . 0 0 "[ . 1 . 2 . ]" 1
258 1 13 LEU MD1 2 14 LYS HE3 5.500 . 7.200 4.832 2.708 5.215 . 0 0 "[ . 1 . 2 . ]" 1
259 1 13 LEU MD1 2 14 LYS QG 5.500 . 7.200 2.235 1.812 3.477 . 0 0 "[ . 1 . 2 . ]" 1
260 1 13 LEU MD1 2 17 ASN H 5.500 . 7.200 5.505 5.059 5.672 . 0 0 "[ . 1 . 2 . ]" 1
261 1 13 LEU MD2 1 17 ASN H 5.300 . 6.900 4.124 3.820 4.721 . 0 0 "[ . 1 . 2 . ]" 1
262 1 13 LEU MD2 1 17 ASN HD21 5.500 . 7.100 5.483 5.050 5.887 . 0 0 "[ . 1 . 2 . ]" 1
263 1 13 LEU MD2 2 13 LEU HB2 3.600 . 4.600 3.583 3.482 3.741 . 0 0 "[ . 1 . 2 . ]" 1
264 1 13 LEU MD2 2 13 LEU HB3 4.700 . 6.000 4.468 4.324 4.887 . 0 0 "[ . 1 . 2 . ]" 1
265 1 13 LEU MD2 2 14 LYS H 5.500 . 7.200 3.730 3.069 3.929 . 0 0 "[ . 1 . 2 . ]" 1
266 1 13 LEU MD2 2 14 LYS HA 4.400 . 5.700 2.724 2.462 3.448 . 0 0 "[ . 1 . 2 . ]" 1
267 1 13 LEU MD2 2 14 LYS HB3 3.100 . 4.000 2.032 1.872 2.858 . 0 0 "[ . 1 . 2 . ]" 1
268 1 13 LEU MD2 2 17 ASN H 5.200 . 6.700 5.386 5.345 5.651 . 0 0 "[ . 1 . 2 . ]" 1
269 1 13 LEU MD2 2 17 ASN HB3 4.100 . 5.300 3.542 3.309 4.284 . 0 0 "[ . 1 . 2 . ]" 1
270 1 13 LEU MD2 2 17 ASN HD21 4.100 . 5.300 2.548 2.056 3.492 . 0 0 "[ . 1 . 2 . ]" 1
271 1 13 LEU MD2 2 17 ASN HD22 4.200 . 5.500 3.524 3.078 4.454 . 0 0 "[ . 1 . 2 . ]" 1
272 1 14 GLU H 1 14 GLU HA 3.000 . 3.900 2.767 2.665 2.812 . 0 0 "[ . 1 . 2 . ]" 1
273 1 14 GLU H 1 14 GLU HB2 3.100 . 4.000 2.255 2.152 2.650 . 0 0 "[ . 1 . 2 . ]" 1
274 1 14 GLU H 1 14 GLU HG2 3.200 . 4.100 3.867 3.164 4.054 . 0 0 "[ . 1 . 2 . ]" 1
275 1 14 GLU H 1 14 GLU HG3 2.100 . 3.000 2.747 1.933 3.006 0.006 20 0 "[ . 1 . 2 . ]" 1
276 1 14 GLU H 1 15 ALA H 2.500 . 3.300 2.742 2.616 3.013 . 0 0 "[ . 1 . 2 . ]" 1
277 1 14 GLU H 1 15 ALA HA 5.000 . 6.500 5.344 5.249 5.555 . 0 0 "[ . 1 . 2 . ]" 1
278 1 14 GLU H 1 15 ALA MB 5.500 . 7.200 4.425 4.295 4.670 . 0 0 "[ . 1 . 2 . ]" 1
279 1 14 GLU H 1 16 GLU H 4.200 . 5.400 4.258 4.005 4.746 . 0 0 "[ . 1 . 2 . ]" 1
280 1 14 GLU H 2 13 LEU HB3 4.000 . 5.200 3.874 3.343 4.082 . 0 0 "[ . 1 . 2 . ]" 1
281 1 14 GLU H 2 13 LEU MD1 4.600 . 6.000 2.749 2.292 3.085 . 0 0 "[ . 1 . 2 . ]" 1
282 1 14 GLU H 2 13 LEU MD2 5.500 . 7.200 3.886 3.490 4.202 . 0 0 "[ . 1 . 2 . ]" 1
283 1 14 GLU HA 1 14 GLU HB3 2.300 . 3.000 2.660 2.438 2.737 . 0 0 "[ . 1 . 2 . ]" 1
284 1 14 GLU HA 1 15 ALA H 4.700 . 6.100 3.472 3.454 3.518 . 0 0 "[ . 1 . 2 . ]" 1
285 1 14 GLU HA 1 17 ASN H 3.400 . 4.400 4.186 3.719 4.344 . 0 0 "[ . 1 . 2 . ]" 1
286 1 14 GLU HA 1 17 ASN HB2 3.500 . 4.500 4.365 2.609 4.539 0.039 23 0 "[ . 1 . 2 . ]" 1
287 1 14 GLU HA 1 17 ASN HB3 2.900 . 3.800 3.042 2.564 3.195 . 0 0 "[ . 1 . 2 . ]" 1
288 1 14 GLU HA 1 18 TYR H 3.100 . 4.000 3.895 3.518 4.016 0.016 10 0 "[ . 1 . 2 . ]" 1
289 1 14 GLU HB2 1 15 ALA H 2.700 . 3.500 3.108 2.771 3.239 . 0 0 "[ . 1 . 2 . ]" 1
290 1 14 GLU HB2 1 15 ALA MB 5.500 . 7.200 4.241 3.917 4.383 . 0 0 "[ . 1 . 2 . ]" 1
291 1 14 GLU HB3 2 13 LEU MD2 4.400 . 5.600 4.468 4.373 4.537 . 0 0 "[ . 1 . 2 . ]" 1
292 1 14 GLU HG2 2 13 LEU MD1 3.800 . 4.900 3.717 2.620 3.954 . 0 0 "[ . 1 . 2 . ]" 1
293 1 14 GLU HG2 2 13 LEU MD2 4.800 . 6.200 2.633 2.343 2.793 . 0 0 "[ . 1 . 2 . ]" 1
294 1 14 GLU HG3 1 15 ALA H 4.000 . 5.100 4.835 4.275 5.035 . 0 0 "[ . 1 . 2 . ]" 1
295 1 14 GLU HG3 2 13 LEU HA 4.500 . 5.600 5.609 5.600 5.633 0.033 24 0 "[ . 1 . 2 . ]" 1
296 1 15 ALA H 1 15 ALA MB 3.300 . 4.300 2.236 2.050 2.297 . 0 0 "[ . 1 . 2 . ]" 1
297 1 15 ALA H 1 16 GLU H 2.400 . 3.100 2.355 2.256 2.761 . 0 0 "[ . 1 . 2 . ]" 1
298 1 15 ALA HA 1 16 GLU H 4.400 . 5.700 3.527 3.491 3.584 . 0 0 "[ . 1 . 2 . ]" 1
299 1 15 ALA HA 1 17 ASN H 4.500 . 5.800 5.128 4.877 5.221 . 0 0 "[ . 1 . 2 . ]" 1
300 1 15 ALA HA 1 18 TYR H 3.300 . 4.300 4.079 3.877 4.303 0.003 20 0 "[ . 1 . 2 . ]" 1
301 1 15 ALA HA 1 18 TYR HB3 3.000 . 3.800 3.226 2.920 3.607 . 0 0 "[ . 1 . 2 . ]" 1
302 1 15 ALA MB 1 16 GLU H 3.800 . 4.900 2.631 2.225 2.809 . 0 0 "[ . 1 . 2 . ]" 1
303 1 15 ALA MB 1 17 ASN H 5.500 . 7.200 4.752 4.264 4.900 . 0 0 "[ . 1 . 2 . ]" 1
304 1 16 GLU H 1 16 GLU HB2 2.300 . 3.000 2.623 2.351 3.442 0.442 24 0 "[ . 1 . 2 . ]" 1
305 1 16 GLU H 1 16 GLU HB3 2.200 . 2.800 2.730 2.471 3.088 0.288 6 0 "[ . 1 . 2 . ]" 1
306 1 16 GLU H 1 16 GLU QG 4.000 . 5.200 3.709 1.758 4.095 0.042 6 0 "[ . 1 . 2 . ]" 1
307 1 16 GLU H 1 17 ASN H 2.700 . 3.500 2.539 2.424 2.645 . 0 0 "[ . 1 . 2 . ]" 1
308 1 16 GLU H 1 18 TYR H 3.100 . 4.000 3.756 3.617 3.932 . 0 0 "[ . 1 . 2 . ]" 1
309 1 16 GLU HA 1 17 ASN H 3.200 . 4.200 3.570 3.549 3.604 . 0 0 "[ . 1 . 2 . ]" 1
310 1 16 GLU HA 1 17 ASN HA 3.800 . 4.900 4.853 4.814 4.897 . 0 0 "[ . 1 . 2 . ]" 1
311 1 16 GLU HA 1 19 GLN H 2.700 . 3.500 3.233 2.877 3.512 0.012 5 0 "[ . 1 . 2 . ]" 1
312 1 16 GLU HA 1 19 GLN QB 3.900 . 5.100 2.548 2.195 3.929 . 0 0 "[ . 1 . 2 . ]" 1
313 1 16 GLU HA 1 20 LEU H 4.600 . 6.000 4.321 3.594 5.253 . 0 0 "[ . 1 . 2 . ]" 1
314 1 16 GLU HB2 1 17 ASN H 2.900 . 3.800 3.484 3.025 3.722 . 0 0 "[ . 1 . 2 . ]" 1
315 1 16 GLU HB3 1 17 ASN H 3.500 . 4.500 2.511 2.189 4.035 . 0 0 "[ . 1 . 2 . ]" 1
316 1 17 ASN H 1 17 ASN HA 2.600 . 3.400 2.752 2.735 2.793 . 0 0 "[ . 1 . 2 . ]" 1
317 1 17 ASN H 1 17 ASN HB2 2.500 . 3.200 2.453 2.013 2.524 . 0 0 "[ . 1 . 2 . ]" 1
318 1 17 ASN H 1 17 ASN HB3 3.000 . 3.900 2.600 2.503 3.245 . 0 0 "[ . 1 . 2 . ]" 1
319 1 17 ASN H 1 17 ASN HD21 4.000 . 5.200 4.728 4.655 4.974 . 0 0 "[ . 1 . 2 . ]" 1
320 1 17 ASN H 1 17 ASN HD22 4.700 . 6.100 5.809 5.551 5.828 . 0 0 "[ . 1 . 2 . ]" 1
321 1 17 ASN H 1 18 TYR H 2.700 . 3.500 2.795 2.679 2.896 . 0 0 "[ . 1 . 2 . ]" 1
322 1 17 ASN H 1 20 LEU H 4.500 . 5.800 5.047 4.753 5.600 . 0 0 "[ . 1 . 2 . ]" 1
323 1 17 ASN H 2 13 LEU HB2 4.300 . 5.400 5.471 5.440 5.598 0.198 24 0 "[ . 1 . 2 . ]" 1
324 1 17 ASN H 2 17 ASN HD21 3.900 . 5.000 3.275 2.296 4.131 . 0 0 "[ . 1 . 2 . ]" 1
325 1 17 ASN H 2 17 ASN HD22 3.200 . 4.200 3.456 2.960 4.127 . 0 0 "[ . 1 . 2 . ]" 1
326 1 17 ASN HA 1 17 ASN HB2 2.500 . 3.300 2.468 2.417 2.832 . 0 0 "[ . 1 . 2 . ]" 1
327 1 17 ASN HA 1 17 ASN HB3 2.400 . 3.100 3.022 2.878 3.031 . 0 0 "[ . 1 . 2 . ]" 1
328 1 17 ASN HA 1 17 ASN HD21 4.000 . 5.200 4.426 3.863 4.501 . 0 0 "[ . 1 . 2 . ]" 1
329 1 17 ASN HA 1 17 ASN HD22 4.100 . 5.300 4.684 4.092 4.763 . 0 0 "[ . 1 . 2 . ]" 1
330 1 17 ASN HA 1 18 TYR H 3.600 . 4.700 3.495 3.436 3.549 . 0 0 "[ . 1 . 2 . ]" 1
331 1 17 ASN HA 1 20 LEU H 3.500 . 4.500 3.830 3.503 4.204 . 0 0 "[ . 1 . 2 . ]" 1
332 1 17 ASN HA 1 20 LEU HB2 2.800 . 3.600 3.348 2.851 3.595 . 0 0 "[ . 1 . 2 . ]" 1
333 1 17 ASN HA 1 20 LEU HB3 4.000 . 5.100 4.997 4.516 5.147 0.047 24 0 "[ . 1 . 2 . ]" 1
334 1 17 ASN HA 1 21 GLU H 4.800 . 6.200 3.987 3.530 4.305 . 0 0 "[ . 1 . 2 . ]" 1
335 1 17 ASN HA 1 21 GLU HB2 3.700 . 4.800 4.514 4.058 4.814 0.014 8 0 "[ . 1 . 2 . ]" 1
336 1 17 ASN HA 2 17 ASN HD21 3.600 . 4.700 3.427 2.378 4.299 . 0 0 "[ . 1 . 2 . ]" 1
337 1 17 ASN HA 2 17 ASN HD22 5.000 . 6.500 3.488 2.717 3.990 . 0 0 "[ . 1 . 2 . ]" 1
338 1 17 ASN HA 2 20 LEU MD1 4.600 . 6.000 3.998 3.320 4.670 . 0 0 "[ . 1 . 2 . ]" 1
339 1 17 ASN HB2 1 17 ASN HD21 2.500 . 3.200 2.730 2.162 3.191 . 0 0 "[ . 1 . 2 . ]" 1
340 1 17 ASN HB2 1 17 ASN HD22 3.800 . 4.900 3.688 3.448 3.916 . 0 0 "[ . 1 . 2 . ]" 1
341 1 17 ASN HB2 1 18 TYR H 3.600 . 4.600 3.987 3.417 4.133 . 0 0 "[ . 1 . 2 . ]" 1
342 1 17 ASN HB2 2 13 LEU HA 3.800 . 4.900 3.949 3.621 4.772 . 0 0 "[ . 1 . 2 . ]" 1
343 1 17 ASN HB2 2 13 LEU HB2 3.600 . 4.700 4.000 3.866 4.137 . 0 0 "[ . 1 . 2 . ]" 1
344 1 17 ASN HB3 1 17 ASN HD21 2.500 . 3.200 2.374 2.089 2.988 . 0 0 "[ . 1 . 2 . ]" 1
345 1 17 ASN HB3 1 17 ASN HD22 3.200 . 4.200 3.538 3.406 3.816 . 0 0 "[ . 1 . 2 . ]" 1
346 1 17 ASN HB3 1 18 TYR H 3.300 . 4.300 2.848 2.526 3.219 . 0 0 "[ . 1 . 2 . ]" 1
347 1 17 ASN HD21 2 13 LEU HA 3.800 . 4.900 1.964 1.845 2.459 . 0 0 "[ . 1 . 2 . ]" 1
348 1 17 ASN HD21 2 13 LEU HB2 2.900 . 3.800 3.768 3.386 4.009 0.209 24 0 "[ . 1 . 2 . ]" 1
349 1 17 ASN HD21 2 13 LEU HB3 3.500 . 4.500 2.446 2.224 2.879 . 0 0 "[ . 1 . 2 . ]" 1
350 1 17 ASN HD21 2 13 LEU MD1 4.500 . 5.900 4.601 4.341 4.950 . 0 0 "[ . 1 . 2 . ]" 1
351 1 17 ASN HD21 2 13 LEU MD2 5.500 . 7.100 3.132 2.599 3.943 . 0 0 "[ . 1 . 2 . ]" 1
352 1 17 ASN HD21 2 16 ARG QB 4.900 . 6.400 4.479 3.843 4.871 . 0 0 "[ . 1 . 2 . ]" 1
353 1 17 ASN HD21 2 16 ARG QG 5.300 . 6.900 5.875 4.851 6.194 . 0 0 "[ . 1 . 2 . ]" 1
354 1 17 ASN HD21 2 17 ASN H 4.600 . 6.000 4.410 3.215 4.842 . 0 0 "[ . 1 . 2 . ]" 1
355 1 17 ASN HD21 2 17 ASN HB2 3.500 . 4.600 3.682 2.521 4.159 . 0 0 "[ . 1 . 2 . ]" 1
356 1 17 ASN HD22 2 13 LEU HA 3.100 . 4.000 2.593 1.869 3.097 . 0 0 "[ . 1 . 2 . ]" 1
357 1 17 ASN HD22 2 13 LEU HB2 5.000 . 6.500 5.085 3.620 5.323 . 0 0 "[ . 1 . 2 . ]" 1
358 1 17 ASN HD22 2 13 LEU HB3 3.400 . 4.400 3.995 2.840 4.228 . 0 0 "[ . 1 . 2 . ]" 1
359 1 17 ASN HD22 2 13 LEU MD1 5.600 . 7.200 5.845 4.927 6.044 . 0 0 "[ . 1 . 2 . ]" 1
360 1 17 ASN HD22 2 13 LEU MD2 4.700 . 6.100 4.136 3.664 4.886 . 0 0 "[ . 1 . 2 . ]" 1
361 1 17 ASN HD22 2 16 ARG H 4.000 . 5.200 4.350 3.369 4.915 . 0 0 "[ . 1 . 2 . ]" 1
362 1 17 ASN HD22 2 16 ARG QB 3.700 . 4.800 3.146 2.325 3.653 . 0 0 "[ . 1 . 2 . ]" 1
363 1 17 ASN HD22 2 16 ARG QG 4.300 . 5.600 4.461 3.350 4.777 . 0 0 "[ . 1 . 2 . ]" 1
364 1 17 ASN HD22 2 17 ASN H 3.600 . 4.600 3.793 3.176 4.168 . 0 0 "[ . 1 . 2 . ]" 1
365 1 17 ASN HD22 2 17 ASN HA 4.500 . 5.800 5.016 4.294 5.376 . 0 0 "[ . 1 . 2 . ]" 1
366 1 17 ASN HD22 2 17 ASN HB2 3.500 . 4.500 3.767 2.251 4.212 . 0 0 "[ . 1 . 2 . ]" 1
367 1 17 ASN HD22 2 17 ASN HB3 3.800 . 5.000 4.951 3.251 5.061 0.061 6 0 "[ . 1 . 2 . ]" 1
368 1 17 ASN HD22 2 17 ASN HD21 5.000 . 6.500 6.061 4.480 6.521 0.021 15 0 "[ . 1 . 2 . ]" 1
369 1 17 ASN HD22 2 20 LEU MD1 5.100 . 6.600 4.976 4.099 5.369 . 0 0 "[ . 1 . 2 . ]" 1
370 1 18 TYR H 1 18 TYR HA 2.600 . 3.400 2.879 2.822 2.910 . 0 0 "[ . 1 . 2 . ]" 1
371 1 18 TYR H 1 18 TYR HB2 2.600 . 3.400 2.802 2.656 3.084 . 0 0 "[ . 1 . 2 . ]" 1
372 1 18 TYR H 1 18 TYR HB3 2.500 . 3.300 2.367 2.176 2.457 . 0 0 "[ . 1 . 2 . ]" 1
373 1 18 TYR H 1 18 TYR QD 4.300 . 5.600 4.145 3.832 4.209 . 0 0 "[ . 1 . 2 . ]" 1
374 1 18 TYR H 1 19 GLN H 2.500 . 3.300 2.443 2.250 2.641 . 0 0 "[ . 1 . 2 . ]" 1
375 1 18 TYR H 1 20 LEU H 3.500 . 4.500 3.940 3.683 4.115 . 0 0 "[ . 1 . 2 . ]" 1
376 1 18 TYR HA 1 18 TYR HB2 2.300 . 3.000 2.395 2.293 2.443 . 0 0 "[ . 1 . 2 . ]" 1
377 1 18 TYR HA 1 18 TYR HB3 2.600 . 3.400 3.019 2.974 3.026 . 0 0 "[ . 1 . 2 . ]" 1
378 1 18 TYR HA 1 18 TYR QD 3.300 . 4.300 2.731 2.234 3.159 . 0 0 "[ . 1 . 2 . ]" 1
379 1 18 TYR HA 1 18 TYR QE 4.300 . 5.600 4.704 4.494 5.006 . 0 0 "[ . 1 . 2 . ]" 1
380 1 18 TYR HA 1 19 GLN H 3.300 . 4.300 3.525 3.447 3.569 . 0 0 "[ . 1 . 2 . ]" 1
381 1 18 TYR HA 1 21 GLU H 3.300 . 4.300 3.519 3.294 3.914 . 0 0 "[ . 1 . 2 . ]" 1
382 1 18 TYR HA 1 21 GLU HB2 3.200 . 4.100 3.159 2.729 3.768 . 0 0 "[ . 1 . 2 . ]" 1
383 1 18 TYR HA 1 21 GLU HB3 3.300 . 4.300 3.017 2.629 3.526 . 0 0 "[ . 1 . 2 . ]" 1
384 1 18 TYR HA 1 21 GLU QG 4.500 . 5.800 4.614 4.048 5.219 . 0 0 "[ . 1 . 2 . ]" 1
385 1 18 TYR HA 1 22 GLN H 3.700 . 4.800 4.154 3.397 4.605 . 0 0 "[ . 1 . 2 . ]" 1
386 1 18 TYR HB2 1 18 TYR QD 3.300 . 4.300 2.512 2.327 2.716 . 0 0 "[ . 1 . 2 . ]" 1
387 1 18 TYR HB2 1 19 GLN H 3.700 . 4.800 4.003 3.762 4.258 . 0 0 "[ . 1 . 2 . ]" 1
388 1 18 TYR HB3 1 18 TYR QD 3.300 . 4.300 2.339 2.278 2.489 . 0 0 "[ . 1 . 2 . ]" 1
389 1 18 TYR HB3 1 18 TYR QE 4.600 . 6.000 4.401 4.383 4.442 . 0 0 "[ . 1 . 2 . ]" 1
390 1 18 TYR HB3 1 19 GLN H 2.700 . 3.500 2.714 2.344 3.136 . 0 0 "[ . 1 . 2 . ]" 1
391 1 18 TYR HB3 1 21 GLU HB3 4.900 . 6.300 5.918 5.526 6.306 0.006 9 0 "[ . 1 . 2 . ]" 1
392 1 18 TYR QD 1 19 GLN H 5.000 . 6.500 3.482 2.941 4.010 . 0 0 "[ . 1 . 2 . ]" 1
393 1 18 TYR QD 1 19 GLN HA 4.200 . 5.500 3.530 2.778 4.264 . 0 0 "[ . 1 . 2 . ]" 1
394 1 18 TYR QD 1 19 GLN QB 4.800 . 6.200 4.116 3.383 4.758 . 0 0 "[ . 1 . 2 . ]" 1
395 1 18 TYR QD 1 19 GLN HG3 5.500 . 7.200 4.757 3.478 6.198 . 0 0 "[ . 1 . 2 . ]" 1
396 1 18 TYR QD 1 21 GLU HB2 5.500 . 7.200 5.031 4.158 6.057 . 0 0 "[ . 1 . 2 . ]" 1
397 1 18 TYR QD 1 22 GLN HB3 5.000 . 6.500 5.336 3.826 5.982 . 0 0 "[ . 1 . 2 . ]" 1
398 1 18 TYR QE 1 19 GLN HA 4.200 . 5.400 4.528 3.935 5.089 . 0 0 "[ . 1 . 2 . ]" 1
399 1 18 TYR QE 1 22 GLN HB3 4.600 . 6.000 4.945 3.418 5.630 . 0 0 "[ . 1 . 2 . ]" 1
400 1 19 GLN H 1 19 GLN HA 2.900 . 3.800 2.808 2.750 2.893 . 0 0 "[ . 1 . 2 . ]" 1
401 1 19 GLN H 1 19 GLN QB 3.100 . 4.000 2.160 2.038 2.560 . 0 0 "[ . 1 . 2 . ]" 1
402 1 19 GLN H 1 19 GLN HG2 5.000 . 6.500 4.094 2.102 4.668 . 0 0 "[ . 1 . 2 . ]" 1
403 1 19 GLN H 1 19 GLN HG3 3.500 . 4.600 3.956 2.950 4.488 . 0 0 "[ . 1 . 2 . ]" 1
404 1 19 GLN H 1 20 LEU H 2.500 . 3.300 2.673 2.481 2.844 . 0 0 "[ . 1 . 2 . ]" 1
405 1 19 GLN H 1 20 LEU MD2 5.100 . 6.600 5.241 4.575 5.498 . 0 0 "[ . 1 . 2 . ]" 1
406 1 19 GLN H 1 21 GLU H 4.800 . 6.200 4.383 4.064 4.794 . 0 0 "[ . 1 . 2 . ]" 1
407 1 19 GLN HA 1 19 GLN HG2 3.600 . 4.700 2.829 2.016 3.891 . 0 0 "[ . 1 . 2 . ]" 1
408 1 19 GLN HA 1 19 GLN HG3 2.900 . 3.800 2.808 2.044 3.697 . 0 0 "[ . 1 . 2 . ]" 1
409 1 19 GLN HA 1 20 LEU H 3.700 . 4.800 3.474 3.184 3.545 . 0 0 "[ . 1 . 2 . ]" 1
410 1 19 GLN HA 1 22 GLN H 3.400 . 4.400 4.114 3.834 4.409 0.009 24 0 "[ . 1 . 2 . ]" 1
411 1 19 GLN HA 1 22 GLN HB3 3.500 . 4.500 4.178 3.764 4.501 0.001 26 0 "[ . 1 . 2 . ]" 1
412 1 19 GLN QB 1 20 LEU H 3.400 . 4.400 2.942 2.559 3.602 . 0 0 "[ . 1 . 2 . ]" 1
413 1 20 LEU H 1 20 LEU HB2 2.400 . 3.100 2.488 2.344 2.693 . 0 0 "[ . 1 . 2 . ]" 1
414 1 20 LEU H 1 20 LEU HB3 3.300 . 4.300 3.631 3.567 3.726 . 0 0 "[ . 1 . 2 . ]" 1
415 1 20 LEU H 1 20 LEU MD2 4.800 . 6.200 3.528 3.104 3.975 . 0 0 "[ . 1 . 2 . ]" 1
416 1 20 LEU H 1 21 GLU H 3.300 . 4.300 2.432 2.073 2.619 . 0 0 "[ . 1 . 2 . ]" 1
417 1 20 LEU H 1 21 GLU HA 4.000 . 5.200 5.036 4.670 5.215 0.015 3 0 "[ . 1 . 2 . ]" 1
418 1 20 LEU H 1 22 GLN H 3.800 . 5.000 3.739 2.991 4.023 . 0 0 "[ . 1 . 2 . ]" 1
419 1 20 LEU H 1 22 GLN HB3 4.800 . 6.000 5.818 5.100 6.004 0.004 2 0 "[ . 1 . 2 . ]" 1
420 1 20 LEU H 1 24 VAL MG2 4.500 . 5.700 4.695 4.640 4.727 . 0 0 "[ . 1 . 2 . ]" 1
421 1 20 LEU HA 1 20 LEU HB2 2.300 . 3.000 3.012 2.999 3.016 0.016 18 0 "[ . 1 . 2 . ]" 1
422 1 20 LEU HA 1 20 LEU HB3 2.500 . 3.200 2.467 2.354 2.544 . 0 0 "[ . 1 . 2 . ]" 1
423 1 20 LEU HA 1 21 GLU H 4.500 . 5.800 3.560 3.530 3.573 . 0 0 "[ . 1 . 2 . ]" 1
424 1 20 LEU HA 1 21 GLU HA 3.900 . 5.000 4.868 4.808 4.901 . 0 0 "[ . 1 . 2 . ]" 1
425 1 20 LEU HA 1 23 GLU H 4.000 . 5.200 3.010 2.860 3.217 . 0 0 "[ . 1 . 2 . ]" 1
426 1 20 LEU HA 1 23 GLU QG 4.900 . 6.400 4.164 1.743 4.772 0.057 8 0 "[ . 1 . 2 . ]" 1
427 1 20 LEU HA 1 24 VAL H 3.100 . 4.000 3.585 3.204 3.911 . 0 0 "[ . 1 . 2 . ]" 1
428 1 20 LEU HA 2 24 VAL MG1 4.200 . 5.400 4.022 3.249 4.350 . 0 0 "[ . 1 . 2 . ]" 1
429 1 20 LEU HB2 1 20 LEU MD2 3.000 . 3.900 3.183 3.154 3.198 . 0 0 "[ . 1 . 2 . ]" 1
430 1 20 LEU HB2 1 22 GLN H 3.900 . 5.000 4.728 4.551 5.001 0.001 10 0 "[ . 1 . 2 . ]" 1
431 1 20 LEU HB2 1 23 GLU H 4.100 . 5.100 5.131 5.102 5.210 0.110 8 0 "[ . 1 . 2 . ]" 1
432 1 20 LEU HB2 2 20 LEU HA 5.100 . 6.500 6.175 5.544 6.542 0.042 24 0 "[ . 1 . 2 . ]" 1
433 1 20 LEU HB3 1 21 GLU H 3.100 . 4.000 3.464 3.124 3.702 . 0 0 "[ . 1 . 2 . ]" 1
434 1 20 LEU MD1 2 21 LYS H 4.900 . 6.400 2.642 2.165 3.249 . 0 0 "[ . 1 . 2 . ]" 1
435 1 20 LEU MD1 2 21 LYS HA 3.800 . 4.900 2.193 1.834 2.757 . 0 0 "[ . 1 . 2 . ]" 1
436 1 20 LEU MD2 1 21 GLU H 5.200 . 6.700 4.596 4.399 4.735 . 0 0 "[ . 1 . 2 . ]" 1
437 1 20 LEU MD2 1 23 GLU H 5.100 . 6.600 4.598 4.276 4.964 . 0 0 "[ . 1 . 2 . ]" 1
438 1 20 LEU MD2 2 21 LYS HA 4.400 . 5.700 3.124 2.299 3.710 . 0 0 "[ . 1 . 2 . ]" 1
439 1 20 LEU MD2 2 24 VAL MG2 2.900 . 3.700 2.053 1.717 2.242 0.083 24 0 "[ . 1 . 2 . ]" 1
440 1 21 GLU H 1 21 GLU HA 2.700 . 3.500 2.743 2.726 2.770 . 0 0 "[ . 1 . 2 . ]" 1
441 1 21 GLU H 1 21 GLU HB2 2.300 . 3.000 2.196 2.088 2.307 . 0 0 "[ . 1 . 2 . ]" 1
442 1 21 GLU H 1 21 GLU HB3 2.900 . 3.800 2.937 2.783 3.160 . 0 0 "[ . 1 . 2 . ]" 1
443 1 21 GLU H 1 21 GLU QG 3.400 . 4.400 3.799 3.619 4.002 . 0 0 "[ . 1 . 2 . ]" 1
444 1 21 GLU H 1 22 GLN H 2.600 . 3.400 2.812 2.742 2.905 . 0 0 "[ . 1 . 2 . ]" 1
445 1 21 GLU H 1 23 GLU H 3.400 . 4.400 4.129 4.038 4.278 . 0 0 "[ . 1 . 2 . ]" 1
446 1 21 GLU H 2 20 LEU MD1 4.200 . 5.500 3.019 2.509 3.278 . 0 0 "[ . 1 . 2 . ]" 1
447 1 21 GLU H 2 20 LEU MD2 5.400 . 7.000 5.605 5.202 5.861 . 0 0 "[ . 1 . 2 . ]" 1
448 1 21 GLU HA 1 21 GLU HB2 2.400 . 3.100 2.628 2.544 2.742 . 0 0 "[ . 1 . 2 . ]" 1
449 1 21 GLU HA 1 21 GLU HB3 2.800 . 3.600 2.987 2.934 3.016 . 0 0 "[ . 1 . 2 . ]" 1
450 1 21 GLU HA 1 22 GLN H 4.700 . 6.100 3.480 3.464 3.539 . 0 0 "[ . 1 . 2 . ]" 1
451 1 21 GLU HA 1 23 GLU H 5.000 . 6.500 4.374 4.127 4.655 . 0 0 "[ . 1 . 2 . ]" 1
452 1 21 GLU HA 1 24 VAL H 3.700 . 4.800 3.705 3.232 3.999 . 0 0 "[ . 1 . 2 . ]" 1
453 1 21 GLU HA 1 24 VAL HA 4.600 . 5.900 5.693 5.045 5.912 0.012 24 0 "[ . 1 . 2 . ]" 1
454 1 21 GLU HA 1 24 VAL HB 2.600 . 3.400 3.084 2.332 3.338 . 0 0 "[ . 1 . 2 . ]" 1
455 1 21 GLU HA 1 24 VAL MG2 3.700 . 4.800 2.813 2.116 3.379 . 0 0 "[ . 1 . 2 . ]" 1
456 1 21 GLU HA 1 25 ALA H 3.700 . 4.800 4.266 2.945 4.818 0.018 24 0 "[ . 1 . 2 . ]" 1
457 1 21 GLU HB2 1 21 GLU QG 2.600 . 3.400 2.238 2.128 2.518 . 0 0 "[ . 1 . 2 . ]" 1
458 1 21 GLU HB2 1 22 GLN H 3.000 . 3.900 3.784 3.548 3.911 0.011 16 0 "[ . 1 . 2 . ]" 1
459 1 21 GLU HB2 1 24 VAL H 4.600 . 5.900 5.851 5.493 5.936 0.036 24 0 "[ . 1 . 2 . ]" 1
460 1 21 GLU HB2 2 20 LEU MD2 5.400 . 7.000 5.364 4.573 5.743 . 0 0 "[ . 1 . 2 . ]" 1
461 1 21 GLU HB3 1 22 GLN H 2.300 . 3.000 2.957 2.592 3.014 0.014 22 0 "[ . 1 . 2 . ]" 1
462 1 21 GLU QG 1 22 GLN H 5.000 . 6.500 4.378 4.119 4.663 . 0 0 "[ . 1 . 2 . ]" 1
463 1 21 GLU QG 2 20 LEU MD1 5.200 . 6.800 2.811 2.305 3.053 . 0 0 "[ . 1 . 2 . ]" 1
464 1 21 GLU QG 2 20 LEU MD2 4.800 . 6.200 4.258 3.795 4.491 . 0 0 "[ . 1 . 2 . ]" 1
465 1 22 GLN H 1 22 GLN HA 2.800 . 3.600 2.904 2.842 2.932 . 0 0 "[ . 1 . 2 . ]" 1
466 1 22 GLN H 1 22 GLN HB2 2.700 . 3.500 2.391 2.149 3.598 0.098 8 0 "[ . 1 . 2 . ]" 1
467 1 22 GLN H 1 22 GLN HB3 2.900 . 3.700 2.990 2.665 3.214 . 0 0 "[ . 1 . 2 . ]" 1
468 1 22 GLN H 1 23 GLU H 2.400 . 3.100 2.273 2.107 2.515 . 0 0 "[ . 1 . 2 . ]" 1
469 1 22 GLN H 1 24 VAL H 3.100 . 4.000 3.737 3.534 3.946 . 0 0 "[ . 1 . 2 . ]" 1
470 1 22 GLN H 1 24 VAL MG2 5.500 . 7.200 4.344 4.107 4.508 . 0 0 "[ . 1 . 2 . ]" 1
471 1 22 GLN HA 1 22 GLN HB2 2.600 . 3.400 2.719 2.481 2.843 . 0 0 "[ . 1 . 2 . ]" 1
472 1 22 GLN HA 1 22 GLN HB3 2.300 . 3.000 2.894 2.395 3.002 0.002 20 0 "[ . 1 . 2 . ]" 1
473 1 22 GLN HA 1 23 GLU H 2.800 . 3.700 3.485 3.463 3.527 . 0 0 "[ . 1 . 2 . ]" 1
474 1 22 GLN HA 1 25 ALA H 3.400 . 4.400 3.728 3.527 4.002 . 0 0 "[ . 1 . 2 . ]" 1
475 1 22 GLN HA 1 25 ALA MB 3.700 . 4.800 3.011 2.789 3.318 . 0 0 "[ . 1 . 2 . ]" 1
476 1 22 GLN HA 1 26 GLN H 4.400 . 5.700 5.216 3.891 5.711 0.011 9 0 "[ . 1 . 2 . ]" 1
477 1 22 GLN HB2 1 22 GLN QG 2.400 . 3.100 2.277 2.129 2.525 . 0 0 "[ . 1 . 2 . ]" 1
478 1 22 GLN HB2 1 24 VAL H 4.400 . 5.500 5.495 5.328 5.547 0.047 20 0 "[ . 1 . 2 . ]" 1
479 1 22 GLN HB2 1 25 ALA MB 5.300 . 6.800 5.298 4.722 5.536 . 0 0 "[ . 1 . 2 . ]" 1
480 1 22 GLN HB3 1 22 GLN QG 2.600 . 3.400 2.326 2.128 2.511 . 0 0 "[ . 1 . 2 . ]" 1
481 1 22 GLN HB3 1 23 GLU H 4.200 . 5.500 3.144 2.857 4.062 . 0 0 "[ . 1 . 2 . ]" 1
482 1 22 GLN HB3 1 25 ALA MB 5.000 . 6.400 5.162 5.014 5.271 . 0 0 "[ . 1 . 2 . ]" 1
483 1 23 GLU H 1 23 GLU HA 3.000 . 3.900 2.899 2.873 2.911 . 0 0 "[ . 1 . 2 . ]" 1
484 1 23 GLU H 1 23 GLU QB 2.800 . 3.600 2.265 2.096 2.597 . 0 0 "[ . 1 . 2 . ]" 1
485 1 23 GLU H 1 23 GLU QG 4.700 . 6.100 3.686 2.379 4.103 . 0 0 "[ . 1 . 2 . ]" 1
486 1 23 GLU H 1 24 VAL H 2.500 . 3.300 2.317 2.242 2.408 . 0 0 "[ . 1 . 2 . ]" 1
487 1 23 GLU H 1 24 VAL MG2 5.500 . 7.200 3.592 3.459 4.053 . 0 0 "[ . 1 . 2 . ]" 1
488 1 23 GLU H 1 25 ALA H 4.500 . 5.800 3.914 3.777 4.236 . 0 0 "[ . 1 . 2 . ]" 1
489 1 23 GLU H 1 26 GLN H 5.200 . 6.600 5.174 4.586 5.496 . 0 0 "[ . 1 . 2 . ]" 1
490 1 23 GLU HA 1 24 VAL H 3.600 . 4.700 3.479 3.435 3.521 . 0 0 "[ . 1 . 2 . ]" 1
491 1 23 GLU HA 1 26 GLN H 3.400 . 4.400 3.716 3.325 4.186 . 0 0 "[ . 1 . 2 . ]" 1
492 1 23 GLU HA 1 27 LEU H 3.800 . 4.900 4.420 3.780 4.911 0.011 16 0 "[ . 1 . 2 . ]" 1
493 1 23 GLU QB 1 24 VAL H 3.200 . 4.200 2.871 2.650 3.624 . 0 0 "[ . 1 . 2 . ]" 1
494 1 23 GLU QB 1 24 VAL HA 4.500 . 5.900 3.993 3.767 4.566 . 0 0 "[ . 1 . 2 . ]" 1
495 1 24 VAL H 1 24 VAL HA 2.600 . 3.400 2.851 2.799 2.910 . 0 0 "[ . 1 . 2 . ]" 1
496 1 24 VAL H 1 24 VAL HB 2.300 . 3.000 2.648 2.406 2.747 . 0 0 "[ . 1 . 2 . ]" 1
497 1 24 VAL H 1 24 VAL MG2 3.500 . 4.500 2.107 1.942 2.441 . 0 0 "[ . 1 . 2 . ]" 1
498 1 24 VAL H 1 25 ALA H 2.700 . 3.500 2.496 2.251 2.661 . 0 0 "[ . 1 . 2 . ]" 1
499 1 24 VAL H 1 25 ALA MB 5.500 . 7.200 4.131 3.876 4.297 . 0 0 "[ . 1 . 2 . ]" 1
500 1 24 VAL H 1 26 GLN H 4.000 . 5.200 4.078 3.781 4.240 . 0 0 "[ . 1 . 2 . ]" 1
501 1 24 VAL HA 1 25 ALA H 3.500 . 4.600 3.497 3.460 3.561 . 0 0 "[ . 1 . 2 . ]" 1
502 1 24 VAL HA 1 25 ALA HA 4.100 . 5.300 4.828 4.771 4.882 . 0 0 "[ . 1 . 2 . ]" 1
503 1 24 VAL HA 1 27 LEU H 3.200 . 4.100 3.100 2.922 3.491 . 0 0 "[ . 1 . 2 . ]" 1
504 1 24 VAL HA 1 27 LEU HB2 2.500 . 3.200 2.254 2.002 2.526 . 0 0 "[ . 1 . 2 . ]" 1
505 1 24 VAL HA 1 27 LEU QD 4.100 . 5.300 2.353 1.828 2.992 . 0 0 "[ . 1 . 2 . ]" 1
506 1 24 VAL HA 1 28 GLU H 4.300 . 5.500 3.597 3.110 3.920 . 0 0 "[ . 1 . 2 . ]" 1
507 1 24 VAL HA 1 28 GLU HG3 4.800 . 6.200 4.744 3.697 5.999 . 0 0 "[ . 1 . 2 . ]" 1
508 1 24 VAL HA 2 24 VAL MG2 5.000 . 6.400 4.483 3.907 5.126 . 0 0 "[ . 1 . 2 . ]" 1
509 1 24 VAL HA 2 27 LEU HB3 4.700 . 6.100 4.920 4.154 5.352 . 0 0 "[ . 1 . 2 . ]" 1
510 1 24 VAL HA 2 27 LEU MD1 4.200 . 5.500 2.763 2.304 3.142 . 0 0 "[ . 1 . 2 . ]" 1
511 1 24 VAL HA 2 27 LEU HG 4.400 . 5.700 5.365 4.613 5.702 0.002 4 0 "[ . 1 . 2 . ]" 1
512 1 24 VAL HB 1 25 ALA H 2.900 . 3.700 2.807 2.331 2.965 . 0 0 "[ . 1 . 2 . ]" 1
513 1 24 VAL HB 1 25 ALA MB 5.500 . 7.200 4.094 3.724 4.299 . 0 0 "[ . 1 . 2 . ]" 1
514 1 24 VAL HB 1 27 LEU HB3 5.300 . 6.700 6.655 6.432 6.723 0.023 15 0 "[ . 1 . 2 . ]" 1
515 1 24 VAL MG1 1 25 ALA H 5.500 . 7.200 3.799 3.231 3.922 . 0 0 "[ . 1 . 2 . ]" 1
516 1 24 VAL MG1 1 25 ALA HA 4.200 . 5.500 3.925 3.317 4.100 . 0 0 "[ . 1 . 2 . ]" 1
517 1 24 VAL MG1 1 28 GLU H 4.600 . 6.000 3.256 2.743 3.798 . 0 0 "[ . 1 . 2 . ]" 1
518 1 24 VAL MG1 1 28 GLU HG2 3.800 . 5.000 2.377 1.828 3.965 . 0 0 "[ . 1 . 2 . ]" 1
519 1 24 VAL MG1 1 28 GLU HG3 3.800 . 4.900 3.241 2.249 4.006 . 0 0 "[ . 1 . 2 . ]" 1
520 1 24 VAL MG1 2 23 LYS HD2 5.500 . 7.200 2.594 1.966 5.115 . 0 0 "[ . 1 . 2 . ]" 1
521 1 24 VAL MG1 2 23 LYS QE 4.700 . 6.100 3.344 1.867 4.002 . 0 0 "[ . 1 . 2 . ]" 1
522 1 24 VAL MG2 1 25 ALA H 5.100 . 6.600 3.763 3.553 3.920 . 0 0 "[ . 1 . 2 . ]" 1
523 1 24 VAL MG2 2 20 LEU HA 4.200 . 5.500 3.615 3.260 4.405 . 0 0 "[ . 1 . 2 . ]" 1
524 1 24 VAL MG2 2 23 LYS QE 5.500 . 7.200 4.951 3.352 5.235 . 0 0 "[ . 1 . 2 . ]" 1
525 1 24 VAL MG2 2 23 LYS HG3 4.700 . 6.100 3.995 3.517 4.475 . 0 0 "[ . 1 . 2 . ]" 1
526 1 24 VAL MG2 2 24 VAL HA 3.300 . 4.300 3.249 2.784 3.386 . 0 0 "[ . 1 . 2 . ]" 1
527 1 24 VAL MG2 2 27 LEU HG 4.900 . 6.300 4.953 4.175 5.105 . 0 0 "[ . 1 . 2 . ]" 1
528 1 25 ALA H 1 25 ALA MB 3.100 . 4.000 2.151 2.024 2.240 . 0 0 "[ . 1 . 2 . ]" 1
529 1 25 ALA H 1 26 GLN H 2.600 . 3.400 2.664 2.518 2.761 . 0 0 "[ . 1 . 2 . ]" 1
530 1 25 ALA H 1 28 GLU H 4.800 . 6.200 5.212 4.869 5.725 . 0 0 "[ . 1 . 2 . ]" 1
531 1 25 ALA HA 1 26 GLN H 5.000 . 6.500 3.470 3.386 3.528 . 0 0 "[ . 1 . 2 . ]" 1
532 1 25 ALA MB 1 26 GLN H 3.600 . 4.700 2.880 2.551 3.101 . 0 0 "[ . 1 . 2 . ]" 1
533 1 25 ALA MB 1 26 GLN HA 4.700 . 6.100 3.948 3.785 4.114 . 0 0 "[ . 1 . 2 . ]" 1
534 1 25 ALA MB 1 26 GLN QB 5.300 . 6.900 4.193 3.668 4.408 . 0 0 "[ . 1 . 2 . ]" 1
535 1 25 ALA MB 1 26 GLN HG2 4.600 . 6.000 3.895 2.741 4.861 . 0 0 "[ . 1 . 2 . ]" 1
536 1 25 ALA MB 1 27 LEU H 5.200 . 6.800 4.627 4.528 4.728 . 0 0 "[ . 1 . 2 . ]" 1
537 1 25 ALA MB 1 28 GLU H 5.500 . 7.200 5.453 5.089 6.056 . 0 0 "[ . 1 . 2 . ]" 1
538 1 26 GLN H 1 26 GLN HA 2.700 . 3.500 2.920 2.847 2.945 . 0 0 "[ . 1 . 2 . ]" 1
539 1 26 GLN H 1 26 GLN QB 3.100 . 4.000 2.448 2.109 2.907 . 0 0 "[ . 1 . 2 . ]" 1
540 1 26 GLN H 1 26 GLN HG2 5.000 . 6.500 3.467 2.062 4.426 . 0 0 "[ . 1 . 2 . ]" 1
541 1 26 GLN H 1 26 GLN HG3 2.900 . 3.800 3.040 2.245 3.801 0.001 27 0 "[ . 1 . 2 . ]" 1
542 1 26 GLN H 1 27 LEU H 2.500 . 3.300 2.202 1.985 2.577 . 0 0 "[ . 1 . 2 . ]" 1
543 1 26 GLN H 1 28 GLU H 4.200 . 5.400 4.270 3.615 4.740 . 0 0 "[ . 1 . 2 . ]" 1
544 1 26 GLN HA 1 26 GLN HG2 3.100 . 4.000 2.702 2.056 3.846 . 0 0 "[ . 1 . 2 . ]" 1
545 1 26 GLN HA 1 27 LEU H 3.600 . 4.700 3.508 3.306 3.547 . 0 0 "[ . 1 . 2 . ]" 1
546 1 26 GLN HA 1 29 HIS HB2 4.200 . 5.400 3.469 2.146 5.412 0.012 17 0 "[ . 1 . 2 . ]" 1
547 1 26 GLN HA 1 29 HIS HB3 4.600 . 5.900 4.351 2.081 5.914 0.014 9 0 "[ . 1 . 2 . ]" 1
548 1 26 GLN QB 1 27 LEU H 3.100 . 4.000 2.790 2.577 3.521 . 0 0 "[ . 1 . 2 . ]" 1
549 1 26 GLN HG3 1 27 LEU H 4.600 . 6.000 4.405 2.009 5.096 . 0 0 "[ . 1 . 2 . ]" 1
550 1 27 LEU H 1 27 LEU HB2 2.300 . 3.000 2.370 2.207 2.551 . 0 0 "[ . 1 . 2 . ]" 1
551 1 27 LEU H 1 27 LEU HB3 3.000 . 3.900 3.563 3.504 3.606 . 0 0 "[ . 1 . 2 . ]" 1
552 1 27 LEU H 1 28 GLU H 2.500 . 3.300 2.902 2.393 3.166 . 0 0 "[ . 1 . 2 . ]" 1
553 1 27 LEU H 2 24 VAL MG1 5.700 . 7.300 5.937 5.873 6.010 . 0 0 "[ . 1 . 2 . ]" 1
554 1 27 LEU H 2 27 LEU HB3 4.500 . 5.700 5.201 4.970 5.511 . 0 0 "[ . 1 . 2 . ]" 1
555 1 27 LEU H 2 27 LEU MD1 4.800 . 6.200 4.124 3.717 4.740 . 0 0 "[ . 1 . 2 . ]" 1
556 1 27 LEU HA 1 28 GLU H 3.800 . 4.900 3.559 3.503 3.574 . 0 0 "[ . 1 . 2 . ]" 1
557 1 27 LEU HB2 1 28 GLU H 2.700 . 3.500 2.350 2.030 2.832 . 0 0 "[ . 1 . 2 . ]" 1
558 1 27 LEU HB2 2 27 LEU HB3 2.600 . 3.300 3.202 2.894 3.331 0.031 15 0 "[ . 1 . 2 . ]" 1
559 1 27 LEU HB2 2 28 ARG HB3 4.200 . 5.300 5.217 4.856 5.329 0.029 15 0 "[ . 1 . 2 . ]" 1
560 1 27 LEU HB3 1 28 GLU HB3 3.700 . 4.800 4.388 3.872 4.918 0.118 15 0 "[ . 1 . 2 . ]" 1
561 1 27 LEU QD 2 24 VAL HA 5.500 . 7.200 2.840 2.344 3.432 . 0 0 "[ . 1 . 2 . ]" 1
562 1 27 LEU QD 2 27 LEU HB3 4.100 . 5.200 3.179 2.277 3.837 . 0 0 "[ . 1 . 2 . ]" 1
563 1 27 LEU QD 2 28 ARG H 4.300 . 5.600 2.502 1.957 3.091 . 0 0 "[ . 1 . 2 . ]" 1
564 1 28 GLU H 1 28 GLU HB2 3.100 . 4.000 3.598 2.905 3.657 . 0 0 "[ . 1 . 2 . ]" 1
565 1 28 GLU H 1 28 GLU HB3 3.000 . 3.900 2.827 2.559 3.617 . 0 0 "[ . 1 . 2 . ]" 1
566 1 28 GLU H 1 28 GLU HG2 2.800 . 3.600 2.632 1.825 3.484 . 0 0 "[ . 1 . 2 . ]" 1
567 1 28 GLU H 1 28 GLU HG3 2.800 . 3.700 2.382 1.906 3.701 0.001 9 0 "[ . 1 . 2 . ]" 1
568 1 28 GLU H 1 29 HIS H 2.700 . 3.500 3.259 2.354 3.511 0.011 1 0 "[ . 1 . 2 . ]" 1
569 1 28 GLU H 2 27 LEU HB3 3.400 . 4.400 3.553 2.885 4.132 . 0 0 "[ . 1 . 2 . ]" 1
570 1 28 GLU H 2 27 LEU MD1 4.600 . 6.000 2.520 2.024 3.759 . 0 0 "[ . 1 . 2 . ]" 1
571 1 28 GLU HA 1 28 GLU HG3 3.200 . 4.100 3.636 3.538 3.992 . 0 0 "[ . 1 . 2 . ]" 1
572 1 28 GLU HB2 1 28 GLU HG2 2.500 . 3.300 2.822 2.364 3.006 . 0 0 "[ . 1 . 2 . ]" 1
573 1 28 GLU HB2 1 29 HIS H 3.900 . 5.000 4.285 3.510 4.467 . 0 0 "[ . 1 . 2 . ]" 1
574 1 28 GLU HB3 1 28 GLU HG2 2.800 . 3.700 2.312 2.206 2.999 . 0 0 "[ . 1 . 2 . ]" 1
575 1 28 GLU HB3 1 28 GLU HG3 2.400 . 3.100 2.825 2.376 3.008 . 0 0 "[ . 1 . 2 . ]" 1
576 1 28 GLU HB3 1 29 HIS H 3.900 . 5.100 4.549 4.009 4.657 . 0 0 "[ . 1 . 2 . ]" 1
577 1 28 GLU HB3 2 27 LEU MD1 4.100 . 5.200 2.312 1.862 4.206 . 0 0 "[ . 1 . 2 . ]" 1
578 1 28 GLU HG2 2 27 LEU MD1 4.200 . 5.500 2.482 1.828 4.435 . 0 0 "[ . 1 . 2 . ]" 1
579 1 28 GLU HG3 2 27 LEU MD2 4.200 . 5.400 4.166 2.417 4.367 . 0 0 "[ . 1 . 2 . ]" 1
580 1 29 HIS H 1 29 HIS HB2 3.500 . 4.500 2.608 2.176 3.656 . 0 0 "[ . 1 . 2 . ]" 1
581 1 29 HIS H 1 29 HIS HB3 3.300 . 4.200 2.682 2.422 3.002 . 0 0 "[ . 1 . 2 . ]" 1
582 1 29 HIS H 1 30 GLU H 2.600 . 3.400 2.628 2.323 3.273 . 0 0 "[ . 1 . 2 . ]" 1
583 1 29 HIS H 1 31 GLY QA 5.300 . 6.800 5.594 4.775 6.118 . 0 0 "[ . 1 . 2 . ]" 1
584 1 29 HIS HB2 1 30 GLU H 3.900 . 5.000 3.699 3.294 4.317 . 0 0 "[ . 1 . 2 . ]" 1
585 1 29 HIS HB3 1 30 GLU H 3.800 . 4.900 2.704 1.852 4.033 . 0 0 "[ . 1 . 2 . ]" 1
586 1 29 HIS HD2 1 30 GLU HA 5.500 . 7.100 4.120 2.698 6.152 . 0 0 "[ . 1 . 2 . ]" 1
587 1 29 HIS HD2 1 30 GLU HB3 5.100 . 6.600 5.666 1.979 6.610 0.010 15 0 "[ . 1 . 2 . ]" 1
588 1 30 GLU H 1 30 GLU HB2 3.300 . 4.300 2.664 2.059 3.668 . 0 0 "[ . 1 . 2 . ]" 1
589 1 30 GLU H 1 30 GLU HB3 3.000 . 3.900 2.970 2.517 3.605 . 0 0 "[ . 1 . 2 . ]" 1
590 1 30 GLU H 1 30 GLU HG2 3.800 . 4.900 3.615 1.975 4.723 . 0 0 "[ . 1 . 2 . ]" 1
591 1 30 GLU H 1 30 GLU HG3 3.800 . 5.000 3.926 2.170 4.619 . 0 0 "[ . 1 . 2 . ]" 1
592 1 30 GLU HA 1 30 GLU HB2 2.300 . 3.000 2.680 2.373 3.021 0.021 25 0 "[ . 1 . 2 . ]" 1
593 1 30 GLU HA 1 30 GLU HG2 3.400 . 4.400 3.143 2.170 4.162 . 0 0 "[ . 1 . 2 . ]" 1
594 1 30 GLU HA 1 31 GLY H 3.400 . 4.400 3.261 2.145 3.573 . 0 0 "[ . 1 . 2 . ]" 1
595 1 30 GLU HB2 1 30 GLU HG2 2.200 . 2.800 2.654 2.429 2.815 0.015 16 0 "[ . 1 . 2 . ]" 1
596 1 30 GLU HB3 1 30 GLU HG2 2.800 . 3.600 2.677 2.207 3.008 . 0 0 "[ . 1 . 2 . ]" 1
597 1 30 GLU HB3 1 30 GLU HG3 2.600 . 3.400 2.653 2.435 2.815 . 0 0 "[ . 1 . 2 . ]" 1
598 2 2 GLU H 2 2 GLU HB3 3.500 . 4.500 3.475 2.846 3.657 . 0 0 "[ . 1 . 2 . ]" 1
599 2 2 GLU H 2 2 GLU HG2 5.500 . 7.200 2.884 1.954 4.203 . 0 0 "[ . 1 . 2 . ]" 1
600 2 2 GLU H 2 2 GLU HG3 5.400 . 7.000 2.713 1.930 3.728 . 0 0 "[ . 1 . 2 . ]" 1
601 2 2 GLU H 2 5 ALA MB 5.500 . 7.200 2.740 1.772 6.091 0.028 18 0 "[ . 1 . 2 . ]" 1
602 2 2 GLU HA 2 2 GLU HB2 2.900 . 3.800 2.899 2.541 3.021 . 0 0 "[ . 1 . 2 . ]" 1
603 2 2 GLU HA 2 2 GLU HG2 3.100 . 4.000 3.242 2.449 4.106 0.106 17 0 "[ . 1 . 2 . ]" 1
604 2 2 GLU HA 2 2 GLU HG3 3.300 . 4.300 3.405 2.455 4.230 . 0 0 "[ . 1 . 2 . ]" 1
605 2 2 GLU HA 2 3 VAL H 2.800 . 3.600 2.943 2.620 3.563 . 0 0 "[ . 1 . 2 . ]" 1
606 2 2 GLU HA 2 3 VAL HA 5.000 . 6.500 4.463 4.314 4.881 . 0 0 "[ . 1 . 2 . ]" 1
607 2 2 GLU HA 2 3 VAL MG2 5.200 . 6.800 4.389 3.936 5.691 . 0 0 "[ . 1 . 2 . ]" 1
608 2 2 GLU HA 2 5 ALA H 3.900 . 5.000 4.882 3.522 5.410 0.410 19 0 "[ . 1 . 2 . ]" 1
609 2 2 GLU HA 2 5 ALA MB 4.700 . 6.100 3.959 3.459 5.152 . 0 0 "[ . 1 . 2 . ]" 1
610 2 2 GLU HA 2 6 LEU H 3.700 . 4.800 4.800 4.192 4.904 0.104 5 0 "[ . 1 . 2 . ]" 1
611 2 2 GLU HA 2 6 LEU HB3 4.800 . 6.100 6.019 4.661 6.173 0.073 17 0 "[ . 1 . 2 . ]" 1
612 2 2 GLU HB2 2 2 GLU HG2 2.300 . 3.000 2.803 2.401 3.015 0.015 19 0 "[ . 1 . 2 . ]" 1
613 2 2 GLU HB2 2 2 GLU HG3 2.600 . 3.400 2.539 2.209 3.010 . 0 0 "[ . 1 . 2 . ]" 1
614 2 2 GLU HB2 2 4 GLN H 3.200 . 4.100 4.169 3.980 4.598 0.498 1 0 "[ . 1 . 2 . ]" 1
615 2 2 GLU HB3 2 2 GLU HG3 2.300 . 3.000 2.803 2.394 3.007 0.007 9 0 "[ . 1 . 2 . ]" 1
616 2 3 VAL H 2 3 VAL HA 2.600 . 3.400 2.706 2.540 2.906 . 0 0 "[ . 1 . 2 . ]" 1
617 2 3 VAL H 2 3 VAL HB 3.100 . 3.900 2.962 2.559 3.611 . 0 0 "[ . 1 . 2 . ]" 1
618 2 3 VAL H 2 3 VAL MG2 3.500 . 4.500 2.239 1.947 3.782 . 0 0 "[ . 1 . 2 . ]" 1
619 2 3 VAL HA 2 3 VAL HB 2.300 . 3.000 2.832 2.261 3.018 0.018 7 0 "[ . 1 . 2 . ]" 1
620 2 3 VAL HA 2 4 GLN H 2.600 . 3.400 3.328 2.000 3.528 0.128 10 0 "[ . 1 . 2 . ]" 1
621 2 3 VAL HA 2 4 GLN HA 3.900 . 5.000 4.628 4.299 4.722 . 0 0 "[ . 1 . 2 . ]" 1
622 2 3 VAL HA 2 5 ALA H 4.200 . 5.500 4.598 3.339 5.543 0.043 17 0 "[ . 1 . 2 . ]" 1
623 2 3 VAL HA 2 6 LEU H 4.300 . 5.500 4.175 3.592 5.502 0.002 24 0 "[ . 1 . 2 . ]" 1
624 2 3 VAL HA 2 7 LYS H 3.800 . 4.900 3.875 3.219 5.345 0.445 24 0 "[ . 1 . 2 . ]" 1
625 2 3 VAL HA 2 7 LYS HB3 3.600 . 4.700 4.167 3.834 4.613 . 0 0 "[ . 1 . 2 . ]" 1
626 2 3 VAL HA 2 7 LYS QG 4.700 . 6.000 5.336 4.793 5.512 . 0 0 "[ . 1 . 2 . ]" 1
627 2 3 VAL HB 2 4 GLN H 3.100 . 3.900 2.427 1.808 4.123 0.223 19 0 "[ . 1 . 2 . ]" 1
628 2 3 VAL MG1 2 3 VAL MG2 2.700 . 3.500 2.018 1.913 2.097 . 0 0 "[ . 1 . 2 . ]" 1
629 2 3 VAL MG1 2 4 GLN H 4.500 . 5.900 3.317 2.146 4.259 . 0 0 "[ . 1 . 2 . ]" 1
630 2 3 VAL MG1 2 4 GLN HA 5.500 . 7.200 4.103 2.987 5.304 . 0 0 "[ . 1 . 2 . ]" 1
631 2 3 VAL MG1 2 7 LYS HE3 4.000 . 5.200 3.702 1.862 4.506 . 0 0 "[ . 1 . 2 . ]" 1
632 2 3 VAL MG2 2 4 GLN H 4.300 . 5.500 3.056 1.909 3.926 . 0 0 "[ . 1 . 2 . ]" 1
633 2 4 GLN H 2 4 GLN QB 3.100 . 4.000 2.316 2.076 2.644 . 0 0 "[ . 1 . 2 . ]" 1
634 2 4 GLN H 2 4 GLN QG 3.800 . 4.900 2.975 1.994 4.022 . 0 0 "[ . 1 . 2 . ]" 1
635 2 4 GLN H 2 5 ALA H 2.000 . 2.700 2.766 2.622 3.160 0.460 1 0 "[ . 1 . 2 . ]" 1
636 2 4 GLN H 2 5 ALA MB 4.900 . 6.400 4.322 4.125 4.607 . 0 0 "[ . 1 . 2 . ]" 1
637 2 4 GLN H 2 6 LEU H 3.700 . 4.800 4.180 3.406 4.958 0.158 24 0 "[ . 1 . 2 . ]" 1
638 2 4 GLN H 2 7 LYS H 4.100 . 5.300 4.441 4.144 4.682 . 0 0 "[ . 1 . 2 . ]" 1
639 2 4 GLN H 2 7 LYS HB2 3.600 . 4.600 4.684 4.251 4.857 0.257 8 0 "[ . 1 . 2 . ]" 1
640 2 4 GLN H 2 8 LYS HD2 4.200 . 5.400 5.404 5.247 5.486 0.086 1 0 "[ . 1 . 2 . ]" 1
641 2 4 GLN HA 2 4 GLN QG 3.800 . 4.900 2.607 2.009 3.430 . 0 0 "[ . 1 . 2 . ]" 1
642 2 4 GLN HA 2 6 LEU H 3.900 . 5.100 3.875 3.710 4.051 . 0 0 "[ . 1 . 2 . ]" 1
643 2 4 GLN HA 2 7 LYS H 3.600 . 4.700 3.361 2.450 3.695 . 0 0 "[ . 1 . 2 . ]" 1
644 2 4 GLN HA 2 7 LYS HA 4.100 . 5.100 4.824 3.886 5.212 0.112 17 0 "[ . 1 . 2 . ]" 1
645 2 4 GLN HA 2 7 LYS HE2 4.300 . 5.600 4.712 3.238 5.611 0.011 12 0 "[ . 1 . 2 . ]" 1
646 2 4 GLN HA 2 8 LYS H 2.700 . 3.500 3.134 2.380 3.547 0.047 4 0 "[ . 1 . 2 . ]" 1
647 2 4 GLN QG 2 6 LEU H 4.700 . 6.100 5.032 4.196 5.489 . 0 0 "[ . 1 . 2 . ]" 1
648 2 4 GLN QG 2 8 LYS HD2 4.300 . 5.600 3.087 1.850 4.465 . 0 0 "[ . 1 . 2 . ]" 1
649 2 4 GLN QG 2 8 LYS QE 4.500 . 5.800 3.767 1.966 4.630 . 0 0 "[ . 1 . 2 . ]" 1
650 2 5 ALA H 2 5 ALA HA 2.300 . 3.000 2.785 2.725 2.908 . 0 0 "[ . 1 . 2 . ]" 1
651 2 5 ALA H 2 5 ALA MB 3.300 . 4.300 2.093 2.024 2.233 . 0 0 "[ . 1 . 2 . ]" 1
652 2 5 ALA H 2 6 LEU H 2.500 . 3.200 2.709 2.063 2.935 . 0 0 "[ . 1 . 2 . ]" 1
653 2 5 ALA H 2 7 LYS H 5.000 . 6.500 4.003 2.923 4.391 . 0 0 "[ . 1 . 2 . ]" 1
654 2 5 ALA HA 2 6 LEU H 3.200 . 4.200 3.467 3.396 3.506 . 0 0 "[ . 1 . 2 . ]" 1
655 2 5 ALA HA 2 8 LYS H 3.500 . 4.500 4.500 4.007 4.766 0.266 24 0 "[ . 1 . 2 . ]" 1
656 2 5 ALA MB 2 6 LEU H 3.900 . 5.100 2.867 2.217 3.141 . 0 0 "[ . 1 . 2 . ]" 1
657 2 5 ALA MB 2 7 LYS H 4.700 . 6.100 4.472 3.563 4.765 . 0 0 "[ . 1 . 2 . ]" 1
658 2 6 LEU H 2 6 LEU HB2 2.300 . 3.000 2.343 2.261 2.498 . 0 0 "[ . 1 . 2 . ]" 1
659 2 6 LEU H 2 6 LEU HB3 3.200 . 4.100 3.525 3.483 3.576 . 0 0 "[ . 1 . 2 . ]" 1
660 2 6 LEU H 2 6 LEU MD1 4.500 . 5.800 3.909 3.648 4.238 . 0 0 "[ . 1 . 2 . ]" 1
661 2 6 LEU H 2 6 LEU MD2 4.300 . 5.600 4.326 4.031 4.500 . 0 0 "[ . 1 . 2 . ]" 1
662 2 6 LEU H 2 7 LYS H 2.600 . 3.400 1.962 1.708 2.052 0.092 24 0 "[ . 1 . 2 . ]" 1
663 2 6 LEU H 2 7 LYS HA 5.000 . 6.500 4.625 4.313 4.693 . 0 0 "[ . 1 . 2 . ]" 1
664 2 6 LEU H 2 7 LYS HB3 2.800 . 3.600 3.697 3.289 3.789 0.189 8 0 "[ . 1 . 2 . ]" 1
665 2 6 LEU H 2 7 LYS QG 4.800 . 6.100 5.349 5.053 5.427 . 0 0 "[ . 1 . 2 . ]" 1
666 2 6 LEU H 2 8 LYS H 3.800 . 4.900 3.601 3.363 4.380 . 0 0 "[ . 1 . 2 . ]" 1
667 2 6 LEU HA 2 6 LEU MD1 4.200 . 5.500 3.796 3.769 3.817 . 0 0 "[ . 1 . 2 . ]" 1
668 2 6 LEU HA 2 6 LEU MD2 3.600 . 4.700 2.300 1.923 2.559 . 0 0 "[ . 1 . 2 . ]" 1
669 2 6 LEU HA 2 7 LYS H 4.500 . 5.800 3.461 3.311 3.510 . 0 0 "[ . 1 . 2 . ]" 1
670 2 6 LEU HA 2 9 ARG HB3 2.600 . 3.300 2.955 2.532 3.324 0.024 17 0 "[ . 1 . 2 . ]" 1
671 2 6 LEU HA 2 9 ARG HD3 3.900 . 5.000 4.250 1.886 5.010 0.010 24 0 "[ . 1 . 2 . ]" 1
672 2 6 LEU HA 2 9 ARG HG3 3.100 . 4.000 3.213 2.803 3.588 . 0 0 "[ . 1 . 2 . ]" 1
673 2 6 LEU HA 2 10 VAL MG2 5.500 . 7.200 4.120 3.528 4.572 . 0 0 "[ . 1 . 2 . ]" 1
674 2 6 LEU HB2 2 6 LEU MD1 3.400 . 4.400 2.149 2.016 2.342 . 0 0 "[ . 1 . 2 . ]" 1
675 2 6 LEU HB2 2 7 LYS H 3.300 . 4.300 2.777 2.546 3.513 . 0 0 "[ . 1 . 2 . ]" 1
676 2 6 LEU HB2 2 9 ARG HE 4.600 . 5.900 5.672 4.714 5.929 0.029 8 0 "[ . 1 . 2 . ]" 1
677 2 6 LEU HB2 2 9 ARG HG2 3.500 . 4.400 4.463 4.419 4.510 0.110 8 0 "[ . 1 . 2 . ]" 1
678 2 6 LEU HB3 2 7 LYS HB3 4.200 2.800 5.300 5.391 5.327 5.558 0.258 1 0 "[ . 1 . 2 . ]" 1
679 2 6 LEU MD1 2 6 LEU MD2 2.900 . 3.800 2.023 1.939 2.090 . 0 0 "[ . 1 . 2 . ]" 1
680 2 7 LYS H 2 7 LYS HB3 4.100 . 5.300 2.285 1.968 2.439 . 0 0 "[ . 1 . 2 . ]" 1
681 2 7 LYS H 2 7 LYS HD2 4.600 . 5.900 5.679 5.143 5.876 . 0 0 "[ . 1 . 2 . ]" 1
682 2 7 LYS H 2 7 LYS HD3 3.900 . 5.000 4.604 4.332 4.926 . 0 0 "[ . 1 . 2 . ]" 1
683 2 7 LYS H 2 7 LYS QG 4.200 . 5.500 3.872 3.512 3.956 . 0 0 "[ . 1 . 2 . ]" 1
684 2 7 LYS H 2 8 LYS H 2.600 . 3.400 2.760 2.325 2.922 . 0 0 "[ . 1 . 2 . ]" 1
685 2 7 LYS H 2 9 ARG H 3.800 . 4.900 4.023 3.343 4.413 . 0 0 "[ . 1 . 2 . ]" 1
686 2 7 LYS H 2 10 VAL MG2 5.500 . 7.200 4.317 3.946 4.699 . 0 0 "[ . 1 . 2 . ]" 1
687 2 7 LYS HA 2 7 LYS HB3 2.900 . 3.800 2.993 2.904 3.009 . 0 0 "[ . 1 . 2 . ]" 1
688 2 7 LYS HA 2 7 LYS HD2 3.900 . 5.100 4.166 3.088 4.814 . 0 0 "[ . 1 . 2 . ]" 1
689 2 7 LYS HA 2 7 LYS HD3 3.600 . 4.700 3.495 2.124 4.185 . 0 0 "[ . 1 . 2 . ]" 1
690 2 7 LYS HA 2 7 LYS QG 3.400 . 4.400 2.697 2.407 3.321 . 0 0 "[ . 1 . 2 . ]" 1
691 2 7 LYS HA 2 8 LYS H 4.700 . 6.100 3.517 3.430 3.560 . 0 0 "[ . 1 . 2 . ]" 1
692 2 7 LYS HA 2 8 LYS QB 4.800 . 6.100 5.383 5.255 5.597 . 0 0 "[ . 1 . 2 . ]" 1
693 2 7 LYS HA 2 9 ARG H 3.900 . 5.100 4.326 3.778 4.834 . 0 0 "[ . 1 . 2 . ]" 1
694 2 7 LYS HA 2 10 VAL H 4.800 . 6.200 3.818 3.099 4.137 . 0 0 "[ . 1 . 2 . ]" 1
695 2 7 LYS HA 2 10 VAL HB 3.200 . 4.100 3.732 2.787 4.160 0.060 8 0 "[ . 1 . 2 . ]" 1
696 2 7 LYS HA 2 10 VAL MG2 4.600 . 6.000 2.650 2.208 2.985 . 0 0 "[ . 1 . 2 . ]" 1
697 2 7 LYS HA 2 11 GLN H 4.700 . 6.000 5.321 4.506 6.009 0.009 8 0 "[ . 1 . 2 . ]" 1
698 2 7 LYS HB3 2 8 LYS H 3.400 . 4.400 2.725 2.146 3.251 . 0 0 "[ . 1 . 2 . ]" 1
699 2 7 LYS HD2 2 7 LYS HE2 2.600 . 3.400 2.687 2.351 3.011 . 0 0 "[ . 1 . 2 . ]" 1
700 2 7 LYS HD3 2 7 LYS HE3 2.700 . 3.500 2.689 2.364 3.012 . 0 0 "[ . 1 . 2 . ]" 1
701 2 7 LYS QG 2 10 VAL H 4.900 . 6.300 5.046 4.666 5.384 . 0 0 "[ . 1 . 2 . ]" 1
702 2 7 LYS QG 2 10 VAL MG2 5.500 . 7.100 4.374 3.861 5.080 . 0 0 "[ . 1 . 2 . ]" 1
703 2 8 LYS H 2 8 LYS HA 2.900 . 3.800 2.882 2.772 2.928 . 0 0 "[ . 1 . 2 . ]" 1
704 2 8 LYS H 2 8 LYS QB 3.000 . 3.900 2.376 2.108 2.714 . 0 0 "[ . 1 . 2 . ]" 1
705 2 8 LYS H 2 8 LYS HD2 5.000 . 6.500 3.441 1.940 4.601 . 0 0 "[ . 1 . 2 . ]" 1
706 2 8 LYS H 2 8 LYS HD3 3.800 . 5.000 3.901 2.395 4.905 . 0 0 "[ . 1 . 2 . ]" 1
707 2 8 LYS H 2 9 ARG H 2.800 . 3.600 2.415 2.210 2.744 . 0 0 "[ . 1 . 2 . ]" 1
708 2 8 LYS H 2 10 VAL H 4.600 . 6.000 4.009 3.795 4.392 . 0 0 "[ . 1 . 2 . ]" 1
709 2 8 LYS HA 2 8 LYS QE 4.400 . 5.700 3.890 1.917 5.247 . 0 0 "[ . 1 . 2 . ]" 1
710 2 8 LYS HA 2 9 ARG H 3.300 . 4.300 3.470 3.337 3.550 . 0 0 "[ . 1 . 2 . ]" 1
711 2 8 LYS HA 2 11 GLN H 4.600 . 6.000 3.710 3.438 4.338 . 0 0 "[ . 1 . 2 . ]" 1
712 2 8 LYS HA 2 11 GLN HG2 3.500 . 4.500 3.452 2.371 4.489 . 0 0 "[ . 1 . 2 . ]" 1
713 2 8 LYS QB 2 8 LYS HD2 3.400 . 4.400 2.551 1.961 3.316 . 0 0 "[ . 1 . 2 . ]" 1
714 2 8 LYS QB 2 9 ARG H 3.500 . 4.600 3.143 2.455 3.686 . 0 0 "[ . 1 . 2 . ]" 1
715 2 8 LYS HD2 2 9 ARG H 4.600 . 6.000 5.108 3.146 6.046 0.046 5 0 "[ . 1 . 2 . ]" 1
716 2 8 LYS QE 2 9 ARG H 4.500 . 5.800 5.052 4.475 5.248 . 0 0 "[ . 1 . 2 . ]" 1
717 2 9 ARG H 2 9 ARG HB2 2.800 . 3.600 3.578 3.464 3.651 0.051 8 0 "[ . 1 . 2 . ]" 1
718 2 9 ARG H 2 9 ARG HB3 2.300 . 3.000 2.365 2.157 2.573 . 0 0 "[ . 1 . 2 . ]" 1
719 2 9 ARG H 2 9 ARG HG2 3.400 . 4.400 3.096 2.464 3.433 . 0 0 "[ . 1 . 2 . ]" 1
720 2 9 ARG H 2 10 VAL H 2.600 . 3.400 2.514 2.265 2.790 . 0 0 "[ . 1 . 2 . ]" 1
721 2 9 ARG H 2 10 VAL MG1 5.500 . 7.200 5.811 5.598 6.045 . 0 0 "[ . 1 . 2 . ]" 1
722 2 9 ARG H 2 10 VAL MG2 5.500 . 7.200 3.849 3.596 4.143 . 0 0 "[ . 1 . 2 . ]" 1
723 2 9 ARG HA 2 9 ARG HB2 2.900 . 3.800 2.318 2.251 2.349 . 0 0 "[ . 1 . 2 . ]" 1
724 2 9 ARG HA 2 9 ARG HB3 2.900 . 3.800 2.591 2.537 2.707 . 0 0 "[ . 1 . 2 . ]" 1
725 2 9 ARG HA 2 9 ARG HD2 3.900 . 5.000 4.734 4.391 5.010 0.010 3 0 "[ . 1 . 2 . ]" 1
726 2 9 ARG HA 2 9 ARG HD3 4.400 . 5.700 4.154 3.741 5.329 . 0 0 "[ . 1 . 2 . ]" 1
727 2 9 ARG HA 2 9 ARG HG2 3.200 . 4.200 4.126 3.843 4.215 0.015 14 0 "[ . 1 . 2 . ]" 1
728 2 9 ARG HA 2 9 ARG HG3 3.000 . 3.900 3.575 3.485 3.630 . 0 0 "[ . 1 . 2 . ]" 1
729 2 9 ARG HA 2 10 VAL H 3.600 . 4.700 3.468 3.401 3.533 . 0 0 "[ . 1 . 2 . ]" 1
730 2 9 ARG HA 2 12 ALA H 2.800 . 3.600 3.529 3.365 3.628 0.028 19 0 "[ . 1 . 2 . ]" 1
731 2 9 ARG HA 2 12 ALA MB 4.000 . 5.200 3.001 2.591 3.358 . 0 0 "[ . 1 . 2 . ]" 1
732 2 9 ARG HA 2 13 LEU H 5.000 . 6.500 5.611 5.065 6.105 . 0 0 "[ . 1 . 2 . ]" 1
733 2 9 ARG HB2 2 9 ARG HD3 3.800 . 4.900 2.205 1.930 3.572 . 0 0 "[ . 1 . 2 . ]" 1
734 2 9 ARG HB2 2 10 VAL H 3.800 . 4.800 4.190 4.036 4.355 . 0 0 "[ . 1 . 2 . ]" 1
735 2 9 ARG HB3 2 9 ARG HD3 3.900 . 5.100 3.239 3.053 3.421 . 0 0 "[ . 1 . 2 . ]" 1
736 2 9 ARG HB3 2 9 ARG HG2 2.000 . 2.600 2.246 2.209 2.430 . 0 0 "[ . 1 . 2 . ]" 1
737 2 9 ARG HB3 2 9 ARG HG3 2.400 . 3.100 2.848 2.744 3.013 . 0 0 "[ . 1 . 2 . ]" 1
738 2 9 ARG HB3 2 10 VAL H 3.100 . 4.000 3.906 3.640 4.018 0.018 22 0 "[ . 1 . 2 . ]" 1
739 2 9 ARG HD2 2 9 ARG HE 2.800 . 3.600 2.430 2.286 2.891 . 0 0 "[ . 1 . 2 . ]" 1
740 2 9 ARG HD2 2 9 ARG HG3 2.500 . 3.300 2.312 2.218 2.824 . 0 0 "[ . 1 . 2 . ]" 1
741 2 9 ARG HD3 2 9 ARG HG2 2.900 . 3.800 2.776 2.221 2.931 . 0 0 "[ . 1 . 2 . ]" 1
742 2 9 ARG HG2 2 13 LEU MD1 5.500 . 7.100 4.861 4.251 5.303 . 0 0 "[ . 1 . 2 . ]" 1
743 2 9 ARG HG3 2 10 VAL HB 4.100 . 5.300 4.479 4.147 5.264 . 0 0 "[ . 1 . 2 . ]" 1
744 2 9 ARG HG3 2 13 LEU MD1 4.600 . 6.000 3.654 3.105 4.364 . 0 0 "[ . 1 . 2 . ]" 1
745 2 10 VAL H 2 10 VAL HA 2.600 . 3.400 2.809 2.741 2.866 . 0 0 "[ . 1 . 2 . ]" 1
746 2 10 VAL H 2 10 VAL HB 2.200 . 2.900 2.542 2.373 2.623 . 0 0 "[ . 1 . 2 . ]" 1
747 2 10 VAL H 2 10 VAL MG2 3.400 . 4.400 2.145 1.978 2.353 . 0 0 "[ . 1 . 2 . ]" 1
748 2 10 VAL H 2 11 GLN H 2.700 . 3.500 2.699 2.544 2.957 . 0 0 "[ . 1 . 2 . ]" 1
749 2 10 VAL H 2 11 GLN QB 5.500 . 7.200 4.827 4.653 5.204 . 0 0 "[ . 1 . 2 . ]" 1
750 2 10 VAL H 2 12 ALA H 4.500 . 5.900 4.076 3.868 4.600 . 0 0 "[ . 1 . 2 . ]" 1
751 2 10 VAL HA 2 10 VAL HB 2.600 . 3.300 3.024 3.021 3.034 . 0 0 "[ . 1 . 2 . ]" 1
752 2 10 VAL HA 2 10 VAL MG2 3.200 . 4.100 2.392 2.215 2.457 . 0 0 "[ . 1 . 2 . ]" 1
753 2 10 VAL HA 2 11 GLN H 3.400 . 4.400 3.537 3.488 3.564 . 0 0 "[ . 1 . 2 . ]" 1
754 2 10 VAL HA 2 12 ALA H 3.700 . 4.800 3.836 3.547 4.772 . 0 0 "[ . 1 . 2 . ]" 1
755 2 10 VAL HA 2 13 LEU H 3.500 . 4.600 3.603 3.220 3.941 . 0 0 "[ . 1 . 2 . ]" 1
756 2 10 VAL HA 2 13 LEU HB2 3.600 . 4.400 3.914 3.679 4.164 . 0 0 "[ . 1 . 2 . ]" 1
757 2 10 VAL HA 2 13 LEU HB3 3.900 . 5.000 4.963 4.751 5.115 0.115 6 0 "[ . 1 . 2 . ]" 1
758 2 10 VAL HA 2 13 LEU MD1 3.500 . 4.500 1.939 1.866 2.590 . 0 0 "[ . 1 . 2 . ]" 1
759 2 10 VAL HA 2 13 LEU MD2 4.000 . 5.200 3.765 3.568 4.423 . 0 0 "[ . 1 . 2 . ]" 1
760 2 10 VAL HA 2 14 LYS H 4.000 . 5.100 4.527 3.779 4.727 . 0 0 "[ . 1 . 2 . ]" 1
761 2 10 VAL HB 2 11 GLN H 2.300 . 3.000 2.613 2.370 2.882 . 0 0 "[ . 1 . 2 . ]" 1
762 2 10 VAL HB 2 11 GLN HA 3.400 . 4.400 4.228 4.125 4.426 0.026 6 0 "[ . 1 . 2 . ]" 1
763 2 10 VAL MG1 2 11 GLN H 4.500 . 5.800 3.455 3.246 3.697 . 0 0 "[ . 1 . 2 . ]" 1
764 2 10 VAL MG1 2 11 GLN HA 5.400 . 7.000 3.490 3.263 3.657 . 0 0 "[ . 1 . 2 . ]" 1
765 2 10 VAL MG1 2 14 LYS H 5.500 . 7.200 3.497 3.252 3.760 . 0 0 "[ . 1 . 2 . ]" 1
766 2 10 VAL MG1 2 14 LYS HB3 3.600 . 4.600 3.651 2.521 3.860 . 0 0 "[ . 1 . 2 . ]" 1
767 2 10 VAL MG1 2 14 LYS HD2 5.100 . 6.600 4.686 4.102 5.256 . 0 0 "[ . 1 . 2 . ]" 1
768 2 10 VAL MG1 2 14 LYS HD3 5.500 . 7.200 5.041 4.114 5.291 . 0 0 "[ . 1 . 2 . ]" 1
769 2 10 VAL MG1 2 14 LYS HE2 3.800 . 4.900 3.786 2.815 4.159 . 0 0 "[ . 1 . 2 . ]" 1
770 2 10 VAL MG1 2 14 LYS HE3 4.700 . 6.100 4.548 1.973 5.164 . 0 0 "[ . 1 . 2 . ]" 1
771 2 10 VAL MG1 2 14 LYS QG 3.800 . 5.000 2.621 2.380 3.360 . 0 0 "[ . 1 . 2 . ]" 1
772 2 10 VAL MG2 2 11 GLN H 4.700 . 6.100 3.840 3.738 4.012 . 0 0 "[ . 1 . 2 . ]" 1
773 2 11 GLN H 2 11 GLN HA 2.700 . 3.500 2.777 2.745 2.827 . 0 0 "[ . 1 . 2 . ]" 1
774 2 11 GLN H 2 11 GLN QB 3.200 . 4.200 2.483 2.322 2.682 . 0 0 "[ . 1 . 2 . ]" 1
775 2 11 GLN H 2 11 GLN HG2 3.100 . 4.000 2.745 1.981 3.245 . 0 0 "[ . 1 . 2 . ]" 1
776 2 11 GLN H 2 11 GLN HG3 3.700 . 4.800 2.650 2.004 3.992 . 0 0 "[ . 1 . 2 . ]" 1
777 2 11 GLN H 2 12 ALA H 2.200 . 2.900 2.733 2.616 2.912 0.012 6 0 "[ . 1 . 2 . ]" 1
778 2 11 GLN H 2 13 LEU H 3.500 . 4.500 4.226 4.108 4.356 . 0 0 "[ . 1 . 2 . ]" 1
779 2 11 GLN HA 2 11 GLN HG3 3.000 . 3.900 3.583 3.161 3.910 0.010 13 0 "[ . 1 . 2 . ]" 1
780 2 11 GLN HA 2 12 ALA H 3.800 . 4.900 3.463 3.385 3.568 . 0 0 "[ . 1 . 2 . ]" 1
781 2 11 GLN HA 2 15 ALA MB 4.100 . 5.300 3.687 2.051 4.089 . 0 0 "[ . 1 . 2 . ]" 1
782 2 11 GLN QB 2 12 ALA H 3.300 . 4.200 3.357 2.163 3.692 . 0 0 "[ . 1 . 2 . ]" 1
783 2 11 GLN HG3 2 12 ALA H 3.300 . 4.300 2.999 1.979 4.308 0.008 19 0 "[ . 1 . 2 . ]" 1
784 2 12 ALA H 2 12 ALA MB 3.100 . 4.000 2.181 2.072 2.255 . 0 0 "[ . 1 . 2 . ]" 1
785 2 12 ALA H 2 13 LEU H 2.500 . 3.200 2.598 2.280 2.954 . 0 0 "[ . 1 . 2 . ]" 1
786 2 12 ALA H 2 14 LYS H 4.300 . 5.600 4.428 4.034 5.336 . 0 0 "[ . 1 . 2 . ]" 1
787 2 12 ALA HA 2 13 LEU H 4.000 . 5.200 3.364 3.163 3.500 . 0 0 "[ . 1 . 2 . ]" 1
788 2 12 ALA HA 2 15 ALA H 3.500 . 4.500 3.998 3.658 4.656 0.156 6 0 "[ . 1 . 2 . ]" 1
789 2 12 ALA MB 2 13 LEU H 3.600 . 4.700 3.156 2.803 3.489 . 0 0 "[ . 1 . 2 . ]" 1
790 2 12 ALA MB 2 13 LEU HA 5.500 . 7.200 4.003 3.853 4.137 . 0 0 "[ . 1 . 2 . ]" 1
791 2 12 ALA MB 2 13 LEU MD1 5.200 . 6.700 4.342 4.171 4.518 . 0 0 "[ . 1 . 2 . ]" 1
792 2 13 LEU H 2 13 LEU HB2 2.700 . 3.400 2.905 2.819 2.982 . 0 0 "[ . 1 . 2 . ]" 1
793 2 13 LEU H 2 13 LEU HB3 3.100 . 4.000 3.707 3.628 3.818 . 0 0 "[ . 1 . 2 . ]" 1
794 2 13 LEU H 2 13 LEU MD1 4.300 . 5.600 3.409 3.252 3.605 . 0 0 "[ . 1 . 2 . ]" 1
795 2 13 LEU H 2 13 LEU MD2 5.500 . 7.200 3.386 3.033 3.609 . 0 0 "[ . 1 . 2 . ]" 1
796 2 13 LEU H 2 14 LYS H 2.600 . 3.400 2.271 1.966 2.999 . 0 0 "[ . 1 . 2 . ]" 1
797 2 13 LEU H 2 14 LYS HB2 4.600 . 5.900 5.676 4.643 5.908 0.008 17 0 "[ . 1 . 2 . ]" 1
798 2 13 LEU H 2 15 ALA H 3.200 . 4.200 3.309 2.911 3.858 . 0 0 "[ . 1 . 2 . ]" 1
799 2 13 LEU HA 2 13 LEU HB3 2.900 . 3.800 2.298 2.289 2.319 . 0 0 "[ . 1 . 2 . ]" 1
800 2 13 LEU HA 2 13 LEU MD1 3.800 . 4.900 4.045 4.030 4.064 . 0 0 "[ . 1 . 2 . ]" 1
801 2 13 LEU HA 2 13 LEU MD2 3.400 . 4.400 2.638 2.468 2.771 . 0 0 "[ . 1 . 2 . ]" 1
802 2 13 LEU HA 2 14 LYS H 3.000 . 3.900 3.541 3.505 3.566 . 0 0 "[ . 1 . 2 . ]" 1
803 2 13 LEU HA 2 16 ARG H 3.700 . 4.700 4.361 4.095 4.558 . 0 0 "[ . 1 . 2 . ]" 1
804 2 13 LEU HA 2 16 ARG QB 4.100 . 5.200 4.419 3.544 4.670 . 0 0 "[ . 1 . 2 . ]" 1
805 2 13 LEU HA 2 17 ASN H 3.900 . 5.100 4.424 4.069 5.110 0.010 18 0 "[ . 1 . 2 . ]" 1
806 2 13 LEU HB2 2 13 LEU MD1 3.400 . 4.400 2.156 2.013 2.267 . 0 0 "[ . 1 . 2 . ]" 1
807 2 13 LEU HB2 2 14 LYS H 2.800 . 3.700 2.465 1.664 2.832 0.136 18 0 "[ . 1 . 2 . ]" 1
808 2 13 LEU HB2 2 17 ASN HD21 4.200 . 5.400 5.091 4.600 5.434 0.034 18 0 "[ . 1 . 2 . ]" 1
809 2 13 LEU HB3 2 14 LYS H 3.400 . 4.400 3.821 3.125 4.056 . 0 0 "[ . 1 . 2 . ]" 1
810 2 13 LEU HB3 2 14 LYS HB3 4.600 . 5.800 5.445 5.304 6.000 0.200 18 0 "[ . 1 . 2 . ]" 1
811 2 13 LEU MD1 2 13 LEU MD2 2.700 . 3.500 2.045 1.931 2.087 . 0 0 "[ . 1 . 2 . ]" 1
812 2 13 LEU MD1 2 14 LYS H 5.500 . 7.200 3.742 3.379 4.053 . 0 0 "[ . 1 . 2 . ]" 1
813 2 14 LYS H 2 14 LYS HA 2.800 . 3.600 2.866 2.664 2.906 . 0 0 "[ . 1 . 2 . ]" 1
814 2 14 LYS H 2 14 LYS HB2 3.100 . 4.000 3.486 2.007 3.626 . 0 0 "[ . 1 . 2 . ]" 1
815 2 14 LYS H 2 14 LYS HB3 2.800 . 3.600 2.831 2.735 3.002 . 0 0 "[ . 1 . 2 . ]" 1
816 2 14 LYS H 2 14 LYS HD2 3.300 . 4.200 3.669 2.722 4.565 0.365 6 0 "[ . 1 . 2 . ]" 1
817 2 14 LYS H 2 14 LYS HD3 3.600 . 4.700 4.058 3.354 4.427 . 0 0 "[ . 1 . 2 . ]" 1
818 2 14 LYS H 2 14 LYS QG 3.700 . 4.800 1.998 1.759 3.930 0.041 7 0 "[ . 1 . 2 . ]" 1
819 2 14 LYS H 2 15 ALA H 2.500 . 3.300 2.461 2.294 2.895 . 0 0 "[ . 1 . 2 . ]" 1
820 2 14 LYS H 2 15 ALA HA 4.300 . 5.600 5.004 4.862 5.302 . 0 0 "[ . 1 . 2 . ]" 1
821 2 14 LYS H 2 15 ALA MB 5.500 . 7.200 4.136 3.992 4.575 . 0 0 "[ . 1 . 2 . ]" 1
822 2 14 LYS H 2 17 ASN H 4.900 . 6.400 4.786 4.303 5.016 . 0 0 "[ . 1 . 2 . ]" 1
823 2 14 LYS HA 2 14 LYS HB2 2.500 . 3.300 2.516 2.477 2.613 . 0 0 "[ . 1 . 2 . ]" 1
824 2 14 LYS HA 2 14 LYS HD2 4.000 . 5.200 4.454 2.370 5.202 0.002 8 0 "[ . 1 . 2 . ]" 1
825 2 14 LYS HA 2 14 LYS HD3 3.100 . 4.000 3.887 2.426 4.375 0.375 8 0 "[ . 1 . 2 . ]" 1
826 2 14 LYS HA 2 14 LYS QG 3.300 . 4.300 3.345 2.646 3.465 . 0 0 "[ . 1 . 2 . ]" 1
827 2 14 LYS HA 2 17 ASN H 3.600 . 4.700 3.308 2.606 3.625 . 0 0 "[ . 1 . 2 . ]" 1
828 2 14 LYS HA 2 17 ASN HB2 3.000 . 3.900 3.337 2.295 3.715 . 0 0 "[ . 1 . 2 . ]" 1
829 2 14 LYS HA 2 17 ASN HB3 2.000 . 2.700 1.963 1.594 2.290 . 0 0 "[ . 1 . 2 . ]" 1
830 2 14 LYS HA 2 17 ASN HD21 3.800 . 4.900 3.096 2.604 3.619 . 0 0 "[ . 1 . 2 . ]" 1
831 2 14 LYS HA 2 18 TYR H 3.300 . 4.300 3.081 2.844 3.425 . 0 0 "[ . 1 . 2 . ]" 1
832 2 14 LYS HB2 2 14 LYS HD2 2.600 . 3.400 3.345 3.126 3.423 0.023 20 0 "[ . 1 . 2 . ]" 1
833 2 14 LYS HB2 2 14 LYS HD3 2.100 . 2.700 2.102 1.965 2.311 . 0 0 "[ . 1 . 2 . ]" 1
834 2 14 LYS HB2 2 15 ALA H 3.500 . 4.400 3.894 3.546 4.055 . 0 0 "[ . 1 . 2 . ]" 1
835 2 14 LYS HB2 2 15 ALA HA 3.700 . 4.800 4.562 4.240 5.276 0.476 6 0 "[ . 1 . 2 . ]" 1
836 2 14 LYS HB3 2 14 LYS HD3 3.000 . 3.900 3.398 2.743 3.548 . 0 0 "[ . 1 . 2 . ]" 1
837 2 14 LYS HB3 2 14 LYS HE2 3.400 . 4.400 3.978 3.125 4.410 0.010 1 0 "[ . 1 . 2 . ]" 1
838 2 14 LYS HB3 2 15 ALA H 3.300 . 4.300 4.116 2.689 4.317 0.017 13 0 "[ . 1 . 2 . ]" 1
839 2 14 LYS HB3 2 15 ALA HA 4.700 . 5.900 5.557 3.738 5.731 . 0 0 "[ . 1 . 2 . ]" 1
840 2 14 LYS HB3 2 18 TYR HA 4.900 . 6.200 6.183 5.965 6.307 0.107 8 0 "[ . 1 . 2 . ]" 1
841 2 14 LYS HD2 2 14 LYS HE2 2.900 . 3.800 2.880 2.729 3.017 . 0 0 "[ . 1 . 2 . ]" 1
842 2 14 LYS HD2 2 14 LYS HE3 2.800 . 3.600 2.274 2.217 2.557 . 0 0 "[ . 1 . 2 . ]" 1
843 2 14 LYS HD3 2 14 LYS HE2 2.400 . 3.100 2.749 2.354 2.929 . 0 0 "[ . 1 . 2 . ]" 1
844 2 14 LYS HD3 2 14 LYS HE3 2.500 . 3.300 2.881 2.733 3.012 . 0 0 "[ . 1 . 2 . ]" 1
845 2 14 LYS HE2 2 14 LYS QG 3.500 . 4.600 2.069 1.941 2.638 . 0 0 "[ . 1 . 2 . ]" 1
846 2 15 ALA H 2 15 ALA HA 2.700 . 3.500 2.774 2.668 2.809 . 0 0 "[ . 1 . 2 . ]" 1
847 2 15 ALA H 2 15 ALA MB 3.100 . 4.000 2.188 2.117 2.254 . 0 0 "[ . 1 . 2 . ]" 1
848 2 15 ALA H 2 17 ASN H 3.300 . 4.300 4.013 3.725 4.297 . 0 0 "[ . 1 . 2 . ]" 1
849 2 15 ALA HA 2 16 ARG H 3.100 . 4.000 3.553 3.455 3.570 . 0 0 "[ . 1 . 2 . ]" 1
850 2 15 ALA HA 2 16 ARG QB 4.800 . 6.200 5.176 5.134 5.254 . 0 0 "[ . 1 . 2 . ]" 1
851 2 15 ALA HA 2 18 TYR H 3.300 . 4.300 4.238 3.994 4.348 0.048 15 0 "[ . 1 . 2 . ]" 1
852 2 15 ALA HA 2 18 TYR HB3 3.800 . 4.900 3.668 3.175 3.967 . 0 0 "[ . 1 . 2 . ]" 1
853 2 15 ALA HA 2 19 ALA H 4.300 . 5.500 5.158 4.464 5.512 0.012 2 0 "[ . 1 . 2 . ]" 1
854 2 15 ALA MB 2 16 ARG H 3.400 . 4.400 2.437 2.222 2.760 . 0 0 "[ . 1 . 2 . ]" 1
855 2 15 ALA MB 2 18 TYR H 5.500 . 7.100 4.977 4.762 5.127 . 0 0 "[ . 1 . 2 . ]" 1
856 2 15 ALA MB 2 18 TYR HB2 5.400 . 7.000 5.611 5.248 5.830 . 0 0 "[ . 1 . 2 . ]" 1
857 2 16 ARG H 2 16 ARG QB 2.600 . 3.400 2.272 2.139 2.325 . 0 0 "[ . 1 . 2 . ]" 1
858 2 16 ARG H 2 16 ARG QG 4.100 . 5.300 4.033 3.513 4.105 . 0 0 "[ . 1 . 2 . ]" 1
859 2 16 ARG H 2 17 ASN H 2.600 . 3.400 2.387 2.211 2.566 . 0 0 "[ . 1 . 2 . ]" 1
860 2 16 ARG H 2 18 TYR H 4.500 . 5.800 4.111 3.808 4.278 . 0 0 "[ . 1 . 2 . ]" 1
861 2 16 ARG HA 2 16 ARG HD2 2.800 . 3.600 3.128 2.237 3.713 0.113 10 0 "[ . 1 . 2 . ]" 1
862 2 16 ARG HA 2 16 ARG HD3 5.000 . 6.500 2.843 1.982 4.408 . 0 0 "[ . 1 . 2 . ]" 1
863 2 16 ARG HA 2 17 ASN H 4.900 . 6.400 3.526 3.486 3.557 . 0 0 "[ . 1 . 2 . ]" 1
864 2 16 ARG HA 2 19 ALA H 3.200 . 4.200 3.582 3.467 3.956 . 0 0 "[ . 1 . 2 . ]" 1
865 2 16 ARG HA 2 19 ALA MB 3.800 . 4.900 2.971 2.567 3.661 . 0 0 "[ . 1 . 2 . ]" 1
866 2 16 ARG HA 2 20 LEU H 3.900 . 5.100 4.527 3.776 5.001 . 0 0 "[ . 1 . 2 . ]" 1
867 2 16 ARG HA 2 20 LEU HG 3.800 . 4.800 4.484 3.336 4.785 . 0 0 "[ . 1 . 2 . ]" 1
868 2 16 ARG QB 2 16 ARG HD2 3.700 . 4.800 3.064 2.126 3.487 . 0 0 "[ . 1 . 2 . ]" 1
869 2 16 ARG QB 2 17 ASN H 3.300 . 4.300 2.613 2.388 2.843 . 0 0 "[ . 1 . 2 . ]" 1
870 2 16 ARG QB 2 20 LEU MD2 4.700 . 6.100 4.058 3.438 4.436 . 0 0 "[ . 1 . 2 . ]" 1
871 2 16 ARG QB 2 20 LEU HG 4.700 . 6.000 4.274 3.044 4.941 . 0 0 "[ . 1 . 2 . ]" 1
872 2 16 ARG HD2 2 19 ALA MB 4.500 . 5.800 4.013 2.783 4.651 . 0 0 "[ . 1 . 2 . ]" 1
873 2 16 ARG HD3 2 19 ALA MB 5.000 . 6.500 4.316 2.802 5.356 . 0 0 "[ . 1 . 2 . ]" 1
874 2 16 ARG QG 2 17 ASN H 5.400 . 7.000 3.934 3.448 4.357 . 0 0 "[ . 1 . 2 . ]" 1
875 2 16 ARG QG 2 20 LEU MD1 3.600 . 4.700 2.923 2.335 3.491 . 0 0 "[ . 1 . 2 . ]" 1
876 2 16 ARG QG 2 20 LEU MD2 3.800 . 4.900 2.405 1.943 3.175 . 0 0 "[ . 1 . 2 . ]" 1
877 2 17 ASN H 2 17 ASN HB2 2.300 . 3.000 2.559 2.426 2.738 . 0 0 "[ . 1 . 2 . ]" 1
878 2 17 ASN H 2 17 ASN HB3 2.500 . 3.200 2.491 2.302 2.660 . 0 0 "[ . 1 . 2 . ]" 1
879 2 17 ASN H 2 17 ASN HD21 3.800 . 4.900 4.677 4.561 4.770 . 0 0 "[ . 1 . 2 . ]" 1
880 2 17 ASN H 2 18 TYR H 2.700 . 3.500 2.780 2.515 2.964 . 0 0 "[ . 1 . 2 . ]" 1
881 2 17 ASN H 2 20 LEU H 4.400 . 5.700 4.915 4.730 5.041 . 0 0 "[ . 1 . 2 . ]" 1
882 2 17 ASN HA 2 17 ASN HD21 3.600 . 4.600 4.447 4.287 4.507 . 0 0 "[ . 1 . 2 . ]" 1
883 2 17 ASN HA 2 20 LEU H 3.200 . 4.200 3.361 3.182 4.201 0.001 15 0 "[ . 1 . 2 . ]" 1
884 2 17 ASN HA 2 20 LEU HB3 4.500 . 5.900 4.673 4.341 5.002 . 0 0 "[ . 1 . 2 . ]" 1
885 2 17 ASN HA 2 20 LEU MD1 4.500 . 5.900 2.784 2.037 3.387 . 0 0 "[ . 1 . 2 . ]" 1
886 2 17 ASN HB2 2 17 ASN HD21 2.900 . 3.700 2.795 2.387 3.118 . 0 0 "[ . 1 . 2 . ]" 1
887 2 17 ASN HB2 2 18 TYR H 4.000 . 5.200 3.873 3.718 4.002 . 0 0 "[ . 1 . 2 . ]" 1
888 2 17 ASN HB3 2 17 ASN HD21 2.900 . 3.800 2.345 2.135 2.705 . 0 0 "[ . 1 . 2 . ]" 1
889 2 17 ASN HB3 2 17 ASN HD22 3.800 . 4.900 3.527 3.444 3.680 . 0 0 "[ . 1 . 2 . ]" 1
890 2 17 ASN HB3 2 18 TYR H 2.500 . 3.200 2.534 2.329 2.791 . 0 0 "[ . 1 . 2 . ]" 1
891 2 17 ASN HB3 2 18 TYR HA 4.500 . 5.800 4.263 4.133 4.385 . 0 0 "[ . 1 . 2 . ]" 1
892 2 17 ASN HD21 2 21 LYS HE3 4.400 . 5.700 4.838 3.392 5.549 . 0 0 "[ . 1 . 2 . ]" 1
893 2 17 ASN HD22 2 21 LYS HE3 3.100 . 4.000 3.487 2.137 4.017 0.017 15 0 "[ . 1 . 2 . ]" 1
894 2 18 TYR H 2 18 TYR HA 2.500 . 3.300 2.763 2.731 2.829 . 0 0 "[ . 1 . 2 . ]" 1
895 2 18 TYR H 2 18 TYR HB2 2.400 . 3.100 2.574 2.503 2.804 . 0 0 "[ . 1 . 2 . ]" 1
896 2 18 TYR H 2 18 TYR HB3 2.600 . 3.400 2.504 2.317 2.566 . 0 0 "[ . 1 . 2 . ]" 1
897 2 18 TYR H 2 18 TYR QD 4.500 . 5.900 4.194 4.132 4.206 . 0 0 "[ . 1 . 2 . ]" 1
898 2 18 TYR H 2 19 ALA H 2.600 . 3.400 2.788 2.717 2.896 . 0 0 "[ . 1 . 2 . ]" 1
899 2 18 TYR H 2 19 ALA MB 4.700 . 6.100 4.423 4.339 4.527 . 0 0 "[ . 1 . 2 . ]" 1
900 2 18 TYR H 2 20 LEU H 3.600 . 4.700 4.445 4.267 4.679 . 0 0 "[ . 1 . 2 . ]" 1
901 2 18 TYR HA 2 18 TYR QE 4.400 . 5.700 4.633 4.418 4.872 . 0 0 "[ . 1 . 2 . ]" 1
902 2 18 TYR HA 2 19 ALA H 3.800 . 4.900 3.511 3.479 3.564 . 0 0 "[ . 1 . 2 . ]" 1
903 2 18 TYR HA 2 21 LYS H 3.100 . 4.000 3.947 3.671 4.035 0.035 15 0 "[ . 1 . 2 . ]" 1
904 2 18 TYR HA 2 21 LYS HB2 2.600 . 3.400 3.093 2.799 3.271 . 0 0 "[ . 1 . 2 . ]" 1
905 2 18 TYR HB2 2 18 TYR QD 3.200 . 4.200 2.533 2.331 2.733 . 0 0 "[ . 1 . 2 . ]" 1
906 2 18 TYR HB2 2 19 ALA H 3.500 . 4.600 4.007 3.690 4.098 . 0 0 "[ . 1 . 2 . ]" 1
907 2 18 TYR HB3 2 18 TYR QD 3.100 . 4.000 2.331 2.279 2.483 . 0 0 "[ . 1 . 2 . ]" 1
908 2 18 TYR HB3 2 19 ALA H 2.700 . 3.500 2.764 2.229 2.933 . 0 0 "[ . 1 . 2 . ]" 1
909 2 18 TYR QD 2 19 ALA H 4.400 . 5.700 3.681 2.511 4.228 . 0 0 "[ . 1 . 2 . ]" 1
910 2 18 TYR QD 2 19 ALA MB 5.400 . 7.000 3.864 2.869 4.498 . 0 0 "[ . 1 . 2 . ]" 1
911 2 18 TYR QD 2 21 LYS HD3 5.500 . 7.200 5.228 4.252 6.227 . 0 0 "[ . 1 . 2 . ]" 1
912 2 18 TYR QE 2 19 ALA HA 4.400 . 5.700 4.755 3.868 5.297 . 0 0 "[ . 1 . 2 . ]" 1
913 2 18 TYR QE 2 22 GLN HB3 4.700 . 6.100 5.575 4.988 5.774 . 0 0 "[ . 1 . 2 . ]" 1
914 2 19 ALA H 2 19 ALA MB 3.100 . 4.000 2.155 2.057 2.265 . 0 0 "[ . 1 . 2 . ]" 1
915 2 19 ALA H 2 20 LEU H 2.600 . 3.400 2.646 2.510 2.968 . 0 0 "[ . 1 . 2 . ]" 1
916 2 19 ALA H 2 20 LEU MD1 5.500 . 7.200 5.280 5.159 5.519 . 0 0 "[ . 1 . 2 . ]" 1
917 2 19 ALA H 2 21 LYS H 3.600 . 4.700 4.231 4.012 4.461 . 0 0 "[ . 1 . 2 . ]" 1
918 2 19 ALA HA 2 20 LEU H 4.700 . 6.100 3.564 3.548 3.579 . 0 0 "[ . 1 . 2 . ]" 1
919 2 19 ALA HA 2 22 GLN HA 4.500 . 5.800 5.847 5.814 5.870 0.070 9 0 "[ . 1 . 2 . ]" 1
920 2 19 ALA HA 2 23 LYS H 4.000 . 5.100 4.563 4.298 4.861 . 0 0 "[ . 1 . 2 . ]" 1
921 2 19 ALA MB 2 20 LEU H 3.600 . 4.700 2.482 2.289 2.687 . 0 0 "[ . 1 . 2 . ]" 1
922 2 19 ALA MB 2 20 LEU HA 4.700 . 6.100 3.747 3.672 3.819 . 0 0 "[ . 1 . 2 . ]" 1
923 2 19 ALA MB 2 20 LEU HG 3.600 . 4.700 3.588 3.279 3.794 . 0 0 "[ . 1 . 2 . ]" 1
924 2 19 ALA MB 2 22 GLN HB3 4.300 . 5.600 4.406 4.212 4.491 . 0 0 "[ . 1 . 2 . ]" 1
925 2 20 LEU H 2 20 LEU HB2 2.600 . 3.400 2.952 2.905 2.991 . 0 0 "[ . 1 . 2 . ]" 1
926 2 20 LEU H 2 20 LEU HB3 3.100 . 4.000 3.556 3.543 3.585 . 0 0 "[ . 1 . 2 . ]" 1
927 2 20 LEU H 2 20 LEU MD1 4.400 . 5.700 3.614 3.464 3.690 . 0 0 "[ . 1 . 2 . ]" 1
928 2 20 LEU H 2 20 LEU HG 2.500 . 3.200 1.955 1.774 2.157 0.026 15 0 "[ . 1 . 2 . ]" 1
929 2 20 LEU H 2 21 LYS H 2.600 . 3.400 2.763 2.674 2.929 . 0 0 "[ . 1 . 2 . ]" 1
930 2 20 LEU H 2 22 GLN H 3.900 . 5.100 4.012 3.932 4.198 . 0 0 "[ . 1 . 2 . ]" 1
931 2 20 LEU H 2 24 VAL H 5.000 . 6.500 5.758 5.298 6.155 . 0 0 "[ . 1 . 2 . ]" 1
932 2 20 LEU HA 2 20 LEU HB3 2.800 . 3.600 2.292 2.279 2.339 . 0 0 "[ . 1 . 2 . ]" 1
933 2 20 LEU HA 2 20 LEU MD1 4.200 . 5.500 3.875 3.726 3.959 . 0 0 "[ . 1 . 2 . ]" 1
934 2 20 LEU HA 2 20 LEU MD2 3.100 . 4.000 2.282 2.103 2.416 . 0 0 "[ . 1 . 2 . ]" 1
935 2 20 LEU HA 2 20 LEU HG 3.900 . 5.100 3.581 3.268 3.682 . 0 0 "[ . 1 . 2 . ]" 1
936 2 20 LEU HA 2 23 LYS H 3.200 . 4.100 3.091 2.992 3.174 . 0 0 "[ . 1 . 2 . ]" 1
937 2 20 LEU HA 2 23 LYS QB 3.800 . 4.900 3.906 3.530 4.084 . 0 0 "[ . 1 . 2 . ]" 1
938 2 20 LEU HA 2 24 VAL H 4.400 . 5.700 3.587 2.906 4.105 . 0 0 "[ . 1 . 2 . ]" 1
939 2 20 LEU HB2 2 20 LEU HG 2.500 . 3.300 2.403 2.333 2.500 . 0 0 "[ . 1 . 2 . ]" 1
940 2 20 LEU HB2 2 21 LYS H 2.300 . 3.000 2.325 2.204 2.488 . 0 0 "[ . 1 . 2 . ]" 1
941 2 20 LEU HB2 2 24 VAL HA 4.300 . 5.500 5.559 5.535 5.593 0.093 24 0 "[ . 1 . 2 . ]" 1
942 2 20 LEU HB3 2 20 LEU HG 2.300 . 3.000 3.010 2.989 3.015 0.015 10 0 "[ . 1 . 2 . ]" 1
943 2 20 LEU HB3 2 21 LYS H 3.000 . 3.900 3.733 3.645 3.850 . 0 0 "[ . 1 . 2 . ]" 1
944 2 20 LEU MD1 2 21 LYS H 3.900 . 5.100 4.189 4.088 4.336 . 0 0 "[ . 1 . 2 . ]" 1
945 2 20 LEU MD1 2 23 LYS HD2 4.600 . 6.000 4.675 4.504 5.039 . 0 0 "[ . 1 . 2 . ]" 1
946 2 20 LEU HG 2 21 LYS HA 4.700 . 5.900 5.826 5.790 6.060 0.160 15 0 "[ . 1 . 2 . ]" 1
947 2 21 LYS H 2 21 LYS HA 3.000 . 3.900 2.713 2.692 2.728 . 0 0 "[ . 1 . 2 . ]" 1
948 2 21 LYS H 2 21 LYS HB2 2.500 . 3.300 2.107 2.089 2.162 . 0 0 "[ . 1 . 2 . ]" 1
949 2 21 LYS H 2 21 LYS HB3 2.500 . 3.300 3.112 3.030 3.168 . 0 0 "[ . 1 . 2 . ]" 1
950 2 21 LYS H 2 21 LYS QG 4.300 . 5.600 3.715 3.589 3.970 . 0 0 "[ . 1 . 2 . ]" 1
951 2 21 LYS H 2 22 GLN H 2.600 . 3.400 2.874 2.824 2.932 . 0 0 "[ . 1 . 2 . ]" 1
952 2 21 LYS HA 2 21 LYS HB3 2.800 . 3.700 2.954 2.939 2.981 . 0 0 "[ . 1 . 2 . ]" 1
953 2 21 LYS HA 2 21 LYS HE2 4.000 . 5.200 4.809 3.787 5.239 0.039 17 0 "[ . 1 . 2 . ]" 1
954 2 21 LYS HA 2 21 LYS HE3 4.500 . 5.800 5.308 3.906 5.816 0.016 18 0 "[ . 1 . 2 . ]" 1
955 2 21 LYS HA 2 21 LYS QG 3.300 . 4.300 2.171 2.054 2.282 . 0 0 "[ . 1 . 2 . ]" 1
956 2 21 LYS HA 2 22 GLN H 3.300 . 4.300 3.483 3.472 3.496 . 0 0 "[ . 1 . 2 . ]" 1
957 2 21 LYS HA 2 23 LYS H 4.700 . 6.100 4.693 4.463 4.941 . 0 0 "[ . 1 . 2 . ]" 1
958 2 21 LYS HA 2 24 VAL H 3.600 . 4.700 3.805 3.645 4.132 . 0 0 "[ . 1 . 2 . ]" 1
959 2 21 LYS HA 2 24 VAL HA 4.500 . 5.800 5.296 4.975 5.722 . 0 0 "[ . 1 . 2 . ]" 1
960 2 21 LYS HA 2 24 VAL HB 3.500 . 4.500 3.398 2.703 4.055 . 0 0 "[ . 1 . 2 . ]" 1
961 2 21 LYS HA 2 24 VAL MG1 4.300 . 5.600 4.064 3.687 4.426 . 0 0 "[ . 1 . 2 . ]" 1
962 2 21 LYS HA 2 24 VAL MG2 3.600 . 4.700 1.973 1.804 2.823 . 0 0 "[ . 1 . 2 . ]" 1
963 2 21 LYS HA 2 25 GLN H 4.800 . 6.100 5.113 4.392 5.780 . 0 0 "[ . 1 . 2 . ]" 1
964 2 21 LYS HB2 2 21 LYS HD2 2.700 . 3.500 2.744 2.087 3.509 0.009 13 0 "[ . 1 . 2 . ]" 1
965 2 21 LYS HB2 2 22 GLN H 2.800 . 3.600 3.618 3.603 3.654 0.054 15 0 "[ . 1 . 2 . ]" 1
966 2 21 LYS HB3 2 22 GLN HB3 3.800 . 4.900 4.908 4.728 4.929 0.029 13 0 "[ . 1 . 2 . ]" 1
967 2 21 LYS HD3 2 21 LYS HE2 2.700 . 3.500 2.729 2.241 3.014 . 0 0 "[ . 1 . 2 . ]" 1
968 2 22 GLN H 2 22 GLN HA 2.800 . 3.600 2.885 2.867 2.897 . 0 0 "[ . 1 . 2 . ]" 1
969 2 22 GLN H 2 22 GLN HB3 2.300 . 3.000 2.417 2.361 2.507 . 0 0 "[ . 1 . 2 . ]" 1
970 2 22 GLN H 2 23 LYS H 2.100 . 2.700 2.441 2.378 2.534 . 0 0 "[ . 1 . 2 . ]" 1
971 2 22 GLN H 2 24 VAL H 4.900 . 6.400 3.692 3.595 3.921 . 0 0 "[ . 1 . 2 . ]" 1
972 2 22 GLN HA 2 22 GLN HB3 2.700 . 3.500 3.018 3.016 3.022 . 0 0 "[ . 1 . 2 . ]" 1
973 2 22 GLN HA 2 23 LYS H 4.600 . 6.000 3.545 3.515 3.567 . 0 0 "[ . 1 . 2 . ]" 1
974 2 22 GLN HA 2 24 VAL H 4.400 . 5.700 4.328 3.982 4.880 . 0 0 "[ . 1 . 2 . ]" 1
975 2 22 GLN HA 2 25 GLN HG3 4.300 . 5.600 5.185 4.529 5.614 0.014 3 0 "[ . 1 . 2 . ]" 1
976 2 22 GLN HA 2 26 ALA MB 5.500 . 7.200 5.551 5.155 5.862 . 0 0 "[ . 1 . 2 . ]" 1
977 2 22 GLN HB3 2 23 LYS H 2.700 . 3.500 2.639 2.403 2.788 . 0 0 "[ . 1 . 2 . ]" 1
978 2 22 GLN HB3 2 23 LYS HG2 3.400 . 4.400 4.372 3.997 4.468 0.068 16 0 "[ . 1 . 2 . ]" 1
979 2 23 LYS H 2 23 LYS HA 2.300 . 3.000 2.903 2.841 2.909 . 0 0 "[ . 1 . 2 . ]" 1
980 2 23 LYS H 2 23 LYS QB 2.600 . 3.400 2.700 2.421 2.791 . 0 0 "[ . 1 . 2 . ]" 1
981 2 23 LYS H 2 23 LYS HG3 3.600 . 4.700 2.276 1.940 3.620 . 0 0 "[ . 1 . 2 . ]" 1
982 2 23 LYS H 2 24 VAL H 2.600 . 3.400 2.417 2.292 2.567 . 0 0 "[ . 1 . 2 . ]" 1
983 2 23 LYS H 2 24 VAL MG2 5.500 . 7.200 3.693 3.497 4.038 . 0 0 "[ . 1 . 2 . ]" 1
984 2 23 LYS H 2 25 GLN H 4.100 . 5.300 4.979 4.594 5.315 0.015 26 0 "[ . 1 . 2 . ]" 1
985 2 23 LYS H 2 27 LEU H 4.900 . 6.200 6.121 5.915 6.234 0.034 13 0 "[ . 1 . 2 . ]" 1
986 2 23 LYS HA 2 23 LYS QE 4.900 . 6.400 4.453 4.053 5.431 . 0 0 "[ . 1 . 2 . ]" 1
987 2 23 LYS HA 2 24 VAL H 3.200 . 4.200 3.420 3.302 3.542 . 0 0 "[ . 1 . 2 . ]" 1
988 2 23 LYS HA 2 24 VAL HA 4.500 . 5.800 4.954 4.900 5.053 . 0 0 "[ . 1 . 2 . ]" 1
989 2 23 LYS HA 2 26 ALA H 2.600 . 3.400 3.121 2.884 3.324 . 0 0 "[ . 1 . 2 . ]" 1
990 2 23 LYS QB 2 23 LYS HD3 3.000 . 3.900 2.419 2.071 3.332 . 0 0 "[ . 1 . 2 . ]" 1
991 2 23 LYS QB 2 24 VAL H 3.700 . 4.800 3.698 3.394 3.905 . 0 0 "[ . 1 . 2 . ]" 1
992 2 23 LYS HD2 2 23 LYS HG2 2.100 . 2.700 2.496 2.325 2.678 . 0 0 "[ . 1 . 2 . ]" 1
993 2 23 LYS HD2 2 23 LYS HG3 2.200 . 2.900 2.469 2.266 3.000 0.100 8 0 "[ . 1 . 2 . ]" 1
994 2 23 LYS HD3 2 23 LYS HG2 2.600 . 3.300 2.934 2.497 3.019 . 0 0 "[ . 1 . 2 . ]" 1
995 2 23 LYS QE 2 27 LEU HB3 4.700 . 6.100 5.321 5.027 5.473 . 0 0 "[ . 1 . 2 . ]" 1
996 2 23 LYS HG2 2 24 VAL H 4.700 . 6.100 3.912 2.017 4.672 . 0 0 "[ . 1 . 2 . ]" 1
997 2 23 LYS HG3 2 24 VAL H 4.000 . 5.200 2.516 1.967 3.244 . 0 0 "[ . 1 . 2 . ]" 1
998 2 23 LYS HG3 2 24 VAL HA 4.100 . 5.300 3.689 3.092 4.095 . 0 0 "[ . 1 . 2 . ]" 1
999 2 24 VAL H 2 24 VAL HA 2.500 . 3.200 2.710 2.628 2.753 . 0 0 "[ . 1 . 2 . ]" 1
1000 2 24 VAL H 2 24 VAL HB 2.300 . 3.000 2.694 2.488 2.878 . 0 0 "[ . 1 . 2 . ]" 1
1001 2 24 VAL H 2 24 VAL MG2 3.700 . 4.800 2.114 1.909 2.410 . 0 0 "[ . 1 . 2 . ]" 1
1002 2 24 VAL H 2 25 GLN H 2.700 . 3.500 3.132 2.949 3.273 . 0 0 "[ . 1 . 2 . ]" 1
1003 2 24 VAL H 2 26 ALA H 4.100 . 5.300 4.075 3.881 4.504 . 0 0 "[ . 1 . 2 . ]" 1
1004 2 24 VAL H 2 27 LEU H 4.000 . 5.200 4.779 4.619 4.886 . 0 0 "[ . 1 . 2 . ]" 1
1005 2 24 VAL HA 2 24 VAL MG2 3.100 . 4.000 2.336 2.168 2.457 . 0 0 "[ . 1 . 2 . ]" 1
1006 2 24 VAL HA 2 25 GLN H 3.000 . 3.900 3.572 3.547 3.578 . 0 0 "[ . 1 . 2 . ]" 1
1007 2 24 VAL HA 2 26 ALA H 5.000 . 6.500 4.392 3.943 4.706 . 0 0 "[ . 1 . 2 . ]" 1
1008 2 24 VAL HA 2 27 LEU H 3.100 . 4.000 3.689 3.486 3.860 . 0 0 "[ . 1 . 2 . ]" 1
1009 2 24 VAL HA 2 27 LEU HB2 2.600 . 3.400 3.359 3.147 3.434 0.034 8 0 "[ . 1 . 2 . ]" 1
1010 2 24 VAL HA 2 27 LEU HB3 3.900 . 5.100 4.850 4.419 4.998 . 0 0 "[ . 1 . 2 . ]" 1
1011 2 24 VAL HA 2 27 LEU MD1 4.600 . 6.000 2.580 1.877 3.215 . 0 0 "[ . 1 . 2 . ]" 1
1012 2 24 VAL HA 2 27 LEU HG 3.800 . 5.000 3.264 2.030 3.744 . 0 0 "[ . 1 . 2 . ]" 1
1013 2 24 VAL HA 2 28 ARG H 3.700 . 4.700 4.502 4.038 4.739 0.039 15 0 "[ . 1 . 2 . ]" 1
1014 2 24 VAL HB 2 25 GLN H 2.800 . 3.600 2.224 1.993 2.624 . 0 0 "[ . 1 . 2 . ]" 1
1015 2 24 VAL HB 2 25 GLN HG2 3.400 . 4.400 3.737 2.897 4.402 0.002 1 0 "[ . 1 . 2 . ]" 1
1016 2 24 VAL MG1 2 25 GLN H 4.000 . 5.200 3.092 2.579 3.457 . 0 0 "[ . 1 . 2 . ]" 1
1017 2 24 VAL MG1 2 25 GLN HA 4.900 . 6.400 3.347 2.960 3.692 . 0 0 "[ . 1 . 2 . ]" 1
1018 2 24 VAL MG1 2 28 ARG HD2 4.100 . 5.300 3.425 2.864 4.346 . 0 0 "[ . 1 . 2 . ]" 1
1019 2 24 VAL MG1 2 28 ARG HD3 4.100 . 5.300 2.522 2.108 4.325 . 0 0 "[ . 1 . 2 . ]" 1
1020 2 24 VAL MG2 2 25 GLN H 4.000 . 5.200 3.683 3.454 3.923 . 0 0 "[ . 1 . 2 . ]" 1
1021 2 25 GLN H 2 25 GLN HA 2.700 . 3.500 2.813 2.775 2.861 . 0 0 "[ . 1 . 2 . ]" 1
1022 2 25 GLN H 2 25 GLN QB 3.200 . 4.200 2.613 2.505 2.696 . 0 0 "[ . 1 . 2 . ]" 1
1023 2 25 GLN H 2 25 GLN HG2 3.400 . 4.400 2.300 1.915 3.066 . 0 0 "[ . 1 . 2 . ]" 1
1024 2 25 GLN H 2 25 GLN HG3 3.800 . 4.900 2.681 1.971 3.550 . 0 0 "[ . 1 . 2 . ]" 1
1025 2 25 GLN H 2 26 ALA H 3.900 . 5.100 2.637 2.464 2.781 . 0 0 "[ . 1 . 2 . ]" 1
1026 2 25 GLN H 2 27 LEU H 3.700 . 4.800 4.162 3.982 4.327 . 0 0 "[ . 1 . 2 . ]" 1
1027 2 25 GLN HA 2 25 GLN HG2 3.200 . 4.100 3.386 2.608 4.061 . 0 0 "[ . 1 . 2 . ]" 1
1028 2 25 GLN HA 2 25 GLN HG3 3.100 . 4.000 3.674 3.250 4.005 0.005 22 0 "[ . 1 . 2 . ]" 1
1029 2 25 GLN HA 2 27 LEU H 3.600 . 4.600 4.076 3.790 4.432 . 0 0 "[ . 1 . 2 . ]" 1
1030 2 25 GLN HA 2 28 ARG H 3.400 . 4.400 3.637 3.380 3.837 . 0 0 "[ . 1 . 2 . ]" 1
1031 2 25 GLN HA 2 28 ARG HB2 3.700 . 4.800 4.741 4.548 4.841 0.041 8 0 "[ . 1 . 2 . ]" 1
1032 2 25 GLN HA 2 28 ARG HB3 3.700 . 4.700 4.379 3.300 4.639 . 0 0 "[ . 1 . 2 . ]" 1
1033 2 25 GLN HA 2 28 ARG HD3 3.100 . 4.000 2.218 1.732 2.683 0.068 8 0 "[ . 1 . 2 . ]" 1
1034 2 25 GLN QB 2 26 ALA H 3.700 . 4.800 3.178 2.470 3.717 . 0 0 "[ . 1 . 2 . ]" 1
1035 2 25 GLN QB 2 28 ARG HB2 5.300 . 6.700 5.937 5.796 6.083 . 0 0 "[ . 1 . 2 . ]" 1
1036 2 25 GLN HG2 2 26 ALA H 5.000 . 6.500 3.570 2.008 4.830 . 0 0 "[ . 1 . 2 . ]" 1
1037 2 25 GLN HG3 2 26 ALA H 4.000 . 5.200 2.958 1.977 4.736 . 0 0 "[ . 1 . 2 . ]" 1
1038 2 26 ALA H 2 26 ALA MB 3.200 . 4.100 2.144 2.068 2.238 . 0 0 "[ . 1 . 2 . ]" 1
1039 2 26 ALA H 2 27 LEU H 2.500 . 3.200 2.627 2.323 2.789 . 0 0 "[ . 1 . 2 . ]" 1
1040 2 26 ALA HA 2 29 HIS HB2 3.700 . 4.800 2.932 2.208 3.949 . 0 0 "[ . 1 . 2 . ]" 1
1041 2 26 ALA HA 2 29 HIS HB3 4.000 . 5.200 3.655 2.690 4.592 . 0 0 "[ . 1 . 2 . ]" 1
1042 2 26 ALA MB 2 27 LEU H 5.500 . 7.200 2.757 2.549 2.952 . 0 0 "[ . 1 . 2 . ]" 1
1043 2 27 LEU H 2 27 LEU HB2 2.300 . 3.000 2.490 2.318 2.850 . 0 0 "[ . 1 . 2 . ]" 1
1044 2 27 LEU H 2 27 LEU MD1 4.200 . 5.500 3.669 3.393 3.932 . 0 0 "[ . 1 . 2 . ]" 1
1045 2 27 LEU H 2 27 LEU HG 2.600 . 3.400 2.335 1.948 2.739 . 0 0 "[ . 1 . 2 . ]" 1
1046 2 27 LEU HA 2 27 LEU HB2 2.400 . 3.100 3.016 2.989 3.021 . 0 0 "[ . 1 . 2 . ]" 1
1047 2 27 LEU HA 2 27 LEU HB3 2.700 . 3.500 2.470 2.321 2.560 . 0 0 "[ . 1 . 2 . ]" 1
1048 2 27 LEU HA 2 27 LEU MD2 4.100 . 5.300 2.100 1.922 2.406 . 0 0 "[ . 1 . 2 . ]" 1
1049 2 27 LEU HA 2 27 LEU HG 3.100 . 4.000 3.149 2.849 3.545 . 0 0 "[ . 1 . 2 . ]" 1
1050 2 27 LEU HA 2 28 ARG H 2.800 . 3.600 3.567 3.530 3.576 . 0 0 "[ . 1 . 2 . ]" 1
1051 2 27 LEU HA 2 29 HIS H 3.900 . 5.100 4.261 3.713 4.970 . 0 0 "[ . 1 . 2 . ]" 1
1052 2 27 LEU HB2 2 28 ARG H 2.300 . 3.000 2.219 2.049 2.615 . 0 0 "[ . 1 . 2 . ]" 1
1053 2 27 LEU HB3 2 27 LEU MD1 3.100 . 4.000 2.294 2.123 2.481 . 0 0 "[ . 1 . 2 . ]" 1
1054 2 27 LEU HB3 2 28 ARG HA 3.800 . 4.900 4.281 4.062 4.754 . 0 0 "[ . 1 . 2 . ]" 1
1055 2 27 LEU MD1 2 27 LEU MD2 2.600 . 3.400 2.006 1.913 2.084 . 0 0 "[ . 1 . 2 . ]" 1
1056 2 27 LEU MD2 2 30 LYS HB3 5.500 . 7.200 4.983 4.344 5.871 . 0 0 "[ . 1 . 2 . ]" 1
1057 2 27 LEU HG 2 28 ARG H 3.800 . 4.800 4.162 3.617 4.438 . 0 0 "[ . 1 . 2 . ]" 1
1058 2 27 LEU HG 2 28 ARG HD3 4.600 . 5.800 5.780 5.511 5.863 0.063 8 0 "[ . 1 . 2 . ]" 1
1059 2 28 ARG H 2 28 ARG HB2 4.000 . 5.200 3.576 3.421 3.623 . 0 0 "[ . 1 . 2 . ]" 1
1060 2 28 ARG H 2 28 ARG HB3 2.400 . 3.100 2.667 2.111 2.834 . 0 0 "[ . 1 . 2 . ]" 1
1061 2 28 ARG H 2 28 ARG QG 3.900 . 5.100 2.023 1.855 3.524 . 0 0 "[ . 1 . 2 . ]" 1
1062 2 28 ARG H 2 29 HIS H 2.700 . 3.500 2.742 2.480 2.977 . 0 0 "[ . 1 . 2 . ]" 1
1063 2 28 ARG HA 2 28 ARG HB3 2.900 . 3.800 2.385 2.306 2.688 . 0 0 "[ . 1 . 2 . ]" 1
1064 2 28 ARG HA 2 28 ARG QG 3.400 . 4.400 3.336 3.277 3.352 . 0 0 "[ . 1 . 2 . ]" 1
1065 2 28 ARG HB2 2 28 ARG HD2 2.800 . 3.600 2.926 2.677 3.440 . 0 0 "[ . 1 . 2 . ]" 1
1066 2 28 ARG HB2 2 28 ARG HD3 3.000 . 3.900 3.842 3.535 3.988 0.088 21 0 "[ . 1 . 2 . ]" 1
1067 2 28 ARG HB3 2 28 ARG HD2 2.800 . 3.600 2.111 2.001 2.598 . 0 0 "[ . 1 . 2 . ]" 1
1068 2 28 ARG HB3 2 28 ARG HD3 2.500 . 3.300 2.877 2.262 3.360 0.060 21 0 "[ . 1 . 2 . ]" 1
1069 2 28 ARG HB3 2 29 HIS H 5.000 . 6.500 4.092 3.707 4.423 . 0 0 "[ . 1 . 2 . ]" 1
1070 2 29 HIS H 2 29 HIS HB2 3.300 . 4.300 2.241 2.070 2.550 . 0 0 "[ . 1 . 2 . ]" 1
1071 2 29 HIS H 2 29 HIS HB3 3.400 . 4.400 3.229 2.602 3.642 . 0 0 "[ . 1 . 2 . ]" 1
1072 2 29 HIS H 2 30 LYS H 3.800 . 4.900 2.719 2.270 3.029 . 0 0 "[ . 1 . 2 . ]" 1
1073 2 29 HIS HB2 2 29 HIS HD2 3.900 . 5.100 3.445 2.665 3.957 . 0 0 "[ . 1 . 2 . ]" 1
1074 2 29 HIS HB2 2 30 LYS HB2 4.400 . 5.700 4.862 3.686 5.705 0.005 10 0 "[ . 1 . 2 . ]" 1
1075 2 30 LYS H 2 30 LYS HA 3.000 . 3.900 2.847 2.758 2.910 . 0 0 "[ . 1 . 2 . ]" 1
1076 2 30 LYS H 2 30 LYS HB3 2.600 . 3.400 3.031 2.478 3.418 0.018 21 0 "[ . 1 . 2 . ]" 1
1077 2 30 LYS H 2 30 LYS QD 4.700 . 6.100 4.316 2.765 4.761 . 0 0 "[ . 1 . 2 . ]" 1
1078 2 30 LYS HB2 2 30 LYS HG2 2.900 . 3.800 2.863 2.499 3.010 . 0 0 "[ . 1 . 2 . ]" 1
1079 2 30 LYS HB3 2 30 LYS HG2 2.700 . 3.500 2.512 2.210 3.002 . 0 0 "[ . 1 . 2 . ]" 1
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