NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
|
|
384421 |
1kik   |
cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1kik
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 1718
_Distance_constraint_stats_list.Viol_count 5396
_Distance_constraint_stats_list.Viol_total 6483.426
_Distance_constraint_stats_list.Viol_max 0.242
_Distance_constraint_stats_list.Viol_rms 0.0219
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0060
_Distance_constraint_stats_list.Viol_average_violations_only 0.0481
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 ASN 1.950 0.065 3 0 "[ . 1 . 2 .]"
1 2 LEU 20.926 0.199 12 0 "[ . 1 . 2 .]"
1 3 VAL 15.770 0.199 12 0 "[ . 1 . 2 .]"
1 4 ILE 16.882 0.107 15 0 "[ . 1 . 2 .]"
1 5 ALA 3.043 0.096 13 0 "[ . 1 . 2 .]"
1 6 LEU 4.034 0.084 12 0 "[ . 1 . 2 .]"
1 7 HIS 1.662 0.047 19 0 "[ . 1 . 2 .]"
1 8 SER 0.621 0.020 21 0 "[ . 1 . 2 .]"
1 9 TYR 5.169 0.100 5 0 "[ . 1 . 2 .]"
1 10 GLU 8.564 0.170 20 0 "[ . 1 . 2 .]"
1 11 PRO 7.603 0.170 20 0 "[ . 1 . 2 .]"
1 12 SER 0.019 0.016 16 0 "[ . 1 . 2 .]"
1 13 HIS 0.971 0.045 2 0 "[ . 1 . 2 .]"
1 14 ASP 0.000 0.000 . 0 "[ . 1 . 2 .]"
1 15 GLY 5.789 0.242 19 0 "[ . 1 . 2 .]"
1 16 ASP 1.497 0.032 9 0 "[ . 1 . 2 .]"
1 17 LEU 4.013 0.064 16 0 "[ . 1 . 2 .]"
1 18 GLY 8.364 0.214 4 0 "[ . 1 . 2 .]"
1 19 PHE 7.600 0.214 4 0 "[ . 1 . 2 .]"
1 20 GLU 5.432 0.085 7 0 "[ . 1 . 2 .]"
1 21 LYS 4.353 0.100 5 0 "[ . 1 . 2 .]"
1 22 GLY 4.178 0.107 15 0 "[ . 1 . 2 .]"
1 23 GLU 9.235 0.085 7 0 "[ . 1 . 2 .]"
1 24 GLN 9.283 0.082 10 0 "[ . 1 . 2 .]"
1 25 LEU 14.980 0.109 13 0 "[ . 1 . 2 .]"
1 26 ARG 15.370 0.122 21 0 "[ . 1 . 2 .]"
1 27 ILE 15.245 0.166 6 0 "[ . 1 . 2 .]"
1 28 LEU 10.299 0.118 19 0 "[ . 1 . 2 .]"
1 29 GLU 6.684 0.115 19 0 "[ . 1 . 2 .]"
1 30 GLN 13.785 0.181 16 0 "[ . 1 . 2 .]"
1 31 SER 2.799 0.056 13 0 "[ . 1 . 2 .]"
1 32 GLY 5.734 0.158 15 0 "[ . 1 . 2 .]"
1 33 GLU 9.510 0.158 15 0 "[ . 1 . 2 .]"
1 34 TRP 5.474 0.067 22 0 "[ . 1 . 2 .]"
1 35 TRP 8.712 0.083 25 0 "[ . 1 . 2 .]"
1 36 LYS 6.045 0.081 9 0 "[ . 1 . 2 .]"
1 37 ALA 4.763 0.109 13 0 "[ . 1 . 2 .]"
1 38 GLN 14.633 0.155 25 0 "[ . 1 . 2 .]"
1 39 SER 13.770 0.126 2 0 "[ . 1 . 2 .]"
1 40 LEU 10.446 0.098 3 0 "[ . 1 . 2 .]"
1 41 THR 8.164 0.121 3 0 "[ . 1 . 2 .]"
1 42 THR 12.224 0.121 6 0 "[ . 1 . 2 .]"
1 43 GLY 17.041 0.146 16 0 "[ . 1 . 2 .]"
1 44 GLN 14.709 0.146 17 0 "[ . 1 . 2 .]"
1 45 GLU 8.680 0.143 24 0 "[ . 1 . 2 .]"
1 46 GLY 1.403 0.045 16 0 "[ . 1 . 2 .]"
1 47 PHE 10.649 0.242 19 0 "[ . 1 . 2 .]"
1 48 ILE 11.031 0.160 5 0 "[ . 1 . 2 .]"
1 49 PRO 11.873 0.129 16 0 "[ . 1 . 2 .]"
1 50 PHE 1.619 0.067 22 0 "[ . 1 . 2 .]"
1 51 ASN 1.406 0.123 20 0 "[ . 1 . 2 .]"
1 52 PHE 6.963 0.160 5 0 "[ . 1 . 2 .]"
1 53 VAL 3.400 0.047 4 0 "[ . 1 . 2 .]"
1 54 ALA 0.910 0.045 16 0 "[ . 1 . 2 .]"
1 55 LYS 2.102 0.047 16 0 "[ . 1 . 2 .]"
1 56 ALA 12.076 0.164 23 0 "[ . 1 . 2 .]"
1 57 ASN 1.319 0.047 16 0 "[ . 1 . 2 .]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 ASN HA 1 2 LEU H 6.000 . 7.000 3.036 2.899 3.512 . 0 0 "[ . 1 . 2 .]" 1
2 1 1 ASN HA 1 27 ILE H 4.200 . 6.000 5.347 5.237 5.623 . 0 0 "[ . 1 . 2 .]" 1
3 1 1 ASN HB2 1 1 ASN HD21 2.600 . 3.500 2.342 2.274 2.638 . 0 0 "[ . 1 . 2 .]" 1
4 1 1 ASN HB2 1 1 ASN HD22 2.700 . 3.600 3.525 3.498 3.640 0.040 5 0 "[ . 1 . 2 .]" 1
5 1 1 ASN HB2 1 2 LEU H 3.600 . 5.200 3.950 2.806 4.175 . 0 0 "[ . 1 . 2 .]" 1
6 1 1 ASN HB2 1 26 ARG HG2 4.000 . 6.000 5.084 4.979 5.236 . 0 0 "[ . 1 . 2 .]" 1
7 1 1 ASN HB2 1 27 ILE H 3.100 . 4.300 4.353 4.315 4.365 0.065 3 0 "[ . 1 . 2 .]" 1
8 1 1 ASN HB2 1 27 ILE HB 2.700 . 3.600 3.515 3.394 3.631 0.031 5 0 "[ . 1 . 2 .]" 1
9 1 1 ASN HB2 1 27 ILE MD 4.000 . 6.000 5.967 5.888 6.006 0.006 10 0 "[ . 1 . 2 .]" 1
10 1 1 ASN HB2 1 27 ILE HG12 3.600 . 5.200 5.091 4.914 5.176 . 0 0 "[ . 1 . 2 .]" 1
11 1 1 ASN HB2 1 27 ILE MG 3.600 . 5.200 4.675 4.560 4.878 . 0 0 "[ . 1 . 2 .]" 1
12 1 1 ASN HB3 1 1 ASN HD21 2.600 . 3.500 2.762 2.414 2.848 . 0 0 "[ . 1 . 2 .]" 1
13 1 1 ASN HB3 1 1 ASN HD22 2.800 . 3.800 3.702 3.543 3.743 . 0 0 "[ . 1 . 2 .]" 1
14 1 1 ASN HB3 1 2 LEU H 3.500 . 5.000 4.236 3.655 4.319 . 0 0 "[ . 1 . 2 .]" 1
15 1 1 ASN HB3 1 26 ARG HG2 3.900 . 5.800 5.745 5.574 5.811 0.011 5 0 "[ . 1 . 2 .]" 1
16 1 1 ASN HB3 1 26 ARG HG3 4.200 . 6.000 5.033 4.878 5.156 . 0 0 "[ . 1 . 2 .]" 1
17 1 1 ASN HB3 1 27 ILE H 3.100 . 4.300 3.798 3.690 3.981 . 0 0 "[ . 1 . 2 .]" 1
18 1 1 ASN HB3 1 27 ILE HB 2.900 . 3.900 2.170 2.044 2.337 . 0 0 "[ . 1 . 2 .]" 1
19 1 1 ASN HB3 1 27 ILE MD 3.600 . 5.200 4.884 4.784 5.000 . 0 0 "[ . 1 . 2 .]" 1
20 1 1 ASN HB3 1 27 ILE HG12 3.700 . 5.400 3.923 3.829 4.022 . 0 0 "[ . 1 . 2 .]" 1
21 1 1 ASN HB3 1 27 ILE MG 3.700 . 5.400 3.476 3.335 3.578 . 0 0 "[ . 1 . 2 .]" 1
22 1 1 ASN HD21 1 27 ILE HB 3.400 . 4.900 4.158 3.752 4.316 . 0 0 "[ . 1 . 2 .]" 1
23 1 1 ASN HD21 1 27 ILE MG 3.200 . 4.500 4.451 4.158 4.514 0.014 16 0 "[ . 1 . 2 .]" 1
24 1 1 ASN HD22 1 27 ILE HB 4.200 . 6.000 5.315 5.182 5.409 . 0 0 "[ . 1 . 2 .]" 1
25 1 1 ASN HD22 1 27 ILE MG 3.600 . 5.200 5.212 5.185 5.220 0.020 5 0 "[ . 1 . 2 .]" 1
26 1 2 LEU H 1 2 LEU HA 2.400 . 3.100 2.850 2.695 2.883 . 0 0 "[ . 1 . 2 .]" 1
27 1 2 LEU H 1 2 LEU HB2 2.400 . 3.100 2.843 2.638 2.903 . 0 0 "[ . 1 . 2 .]" 1
28 1 2 LEU H 1 2 LEU HB3 2.200 . 2.800 2.353 2.314 2.471 . 0 0 "[ . 1 . 2 .]" 1
29 1 2 LEU H 1 3 VAL H 3.300 . 4.700 4.509 4.497 4.531 . 0 0 "[ . 1 . 2 .]" 1
30 1 2 LEU H 1 3 VAL MG1 4.500 . 6.000 4.770 4.651 4.922 . 0 0 "[ . 1 . 2 .]" 1
31 1 2 LEU H 1 56 ALA MB 6.000 4.900 7.000 5.584 5.498 5.928 . 0 0 "[ . 1 . 2 .]" 1
32 1 2 LEU HA 1 2 LEU HB2 2.600 . 3.400 2.327 2.316 2.330 . 0 0 "[ . 1 . 2 .]" 1
33 1 2 LEU HA 1 2 LEU HB3 2.500 . 3.300 2.995 2.994 2.997 . 0 0 "[ . 1 . 2 .]" 1
34 1 2 LEU HA 1 2 LEU MD1 2.300 . 2.900 2.061 2.031 2.091 . 0 0 "[ . 1 . 2 .]" 1
35 1 2 LEU HA 1 2 LEU MD2 2.900 . 4.000 3.882 3.874 3.889 . 0 0 "[ . 1 . 2 .]" 1
36 1 2 LEU HA 1 2 LEU HG 2.900 . 3.900 3.286 3.272 3.321 . 0 0 "[ . 1 . 2 .]" 1
37 1 2 LEU HA 1 3 VAL H 1.900 . 2.400 2.106 2.096 2.119 . 0 0 "[ . 1 . 2 .]" 1
38 1 2 LEU HA 1 3 VAL MG1 3.300 . 4.700 3.839 3.816 3.859 . 0 0 "[ . 1 . 2 .]" 1
39 1 2 LEU HA 1 3 VAL MG2 3.200 . 4.500 3.164 3.144 3.202 . 0 0 "[ . 1 . 2 .]" 1
40 1 2 LEU HA 1 26 ARG H 4.000 . 6.000 4.891 4.827 4.926 . 0 0 "[ . 1 . 2 .]" 1
41 1 2 LEU HA 1 26 ARG HA 2.300 . 3.000 2.364 2.307 2.397 . 0 0 "[ . 1 . 2 .]" 1
42 1 2 LEU HA 1 27 ILE H 3.000 . 4.100 2.559 2.429 2.613 . 0 0 "[ . 1 . 2 .]" 1
43 1 2 LEU HA 1 55 LYS HA 3.900 . 5.800 5.798 5.771 5.814 0.014 15 0 "[ . 1 . 2 .]" 1
44 1 2 LEU HA 1 56 ALA MB 4.500 . 6.000 5.499 5.476 5.548 . 0 0 "[ . 1 . 2 .]" 1
45 1 2 LEU HB2 1 2 LEU MD1 2.300 . 3.000 2.281 2.269 2.287 . 0 0 "[ . 1 . 2 .]" 1
46 1 2 LEU HB2 1 2 LEU MD2 2.600 . 3.400 2.359 2.339 2.367 . 0 0 "[ . 1 . 2 .]" 1
47 1 2 LEU HB2 1 2 LEU HG 3.600 2.600 4.600 2.981 2.975 2.985 . 0 0 "[ . 1 . 2 .]" 1
48 1 2 LEU HB2 1 3 VAL H 2.700 . 3.600 3.760 3.752 3.766 0.166 3 0 "[ . 1 . 2 .]" 1
49 1 2 LEU HB2 1 25 LEU H 5.700 . 6.000 5.272 5.238 5.313 . 0 0 "[ . 1 . 2 .]" 1
50 1 2 LEU HB2 1 26 ARG HA 2.600 . 3.500 2.940 2.832 2.998 . 0 0 "[ . 1 . 2 .]" 1
51 1 2 LEU HB2 1 56 ALA MB 3.800 2.600 5.000 5.133 5.121 5.164 0.164 23 0 "[ . 1 . 2 .]" 1
52 1 2 LEU HB3 1 2 LEU MD1 2.400 . 3.100 3.161 3.159 3.163 0.063 22 0 "[ . 1 . 2 .]" 1
53 1 2 LEU HB3 1 2 LEU MD2 2.700 . 3.600 2.353 2.344 2.367 . 0 0 "[ . 1 . 2 .]" 1
54 1 2 LEU HB3 1 2 LEU HG 2.000 . 2.500 2.441 2.433 2.448 . 0 0 "[ . 1 . 2 .]" 1
55 1 2 LEU HB3 1 3 VAL H 3.000 . 4.100 4.028 4.012 4.068 . 0 0 "[ . 1 . 2 .]" 1
56 1 2 LEU HB3 1 25 LEU H 4.800 . 6.000 5.959 5.937 5.988 . 0 0 "[ . 1 . 2 .]" 1
57 1 2 LEU MD1 1 2 LEU HG 2.100 . 2.600 2.075 2.073 2.077 . 0 0 "[ . 1 . 2 .]" 1
58 1 2 LEU MD1 1 3 VAL H 3.000 . 4.100 1.801 1.794 1.806 0.106 12 0 "[ . 1 . 2 .]" 1
59 1 2 LEU MD1 1 3 VAL HB 3.100 . 4.300 4.488 4.476 4.499 0.199 12 0 "[ . 1 . 2 .]" 1
60 1 2 LEU MD1 1 24 GLN HB3 3.600 . 5.200 2.120 2.030 2.207 . 0 0 "[ . 1 . 2 .]" 1
61 1 2 LEU MD1 1 24 GLN HE21 3.600 . 5.200 3.770 3.401 4.225 . 0 0 "[ . 1 . 2 .]" 1
62 1 2 LEU MD1 1 24 GLN HE22 3.700 . 5.400 5.063 4.892 5.292 . 0 0 "[ . 1 . 2 .]" 1
63 1 2 LEU MD1 1 25 LEU H 3.200 . 4.500 1.894 1.880 1.918 0.020 17 0 "[ . 1 . 2 .]" 1
64 1 2 LEU MD1 1 26 ARG HA 2.300 . 2.900 2.117 2.017 2.177 . 0 0 "[ . 1 . 2 .]" 1
65 1 2 LEU MD1 1 26 ARG QD 3.700 . 5.400 4.795 4.761 4.816 . 0 0 "[ . 1 . 2 .]" 1
66 1 2 LEU MD1 1 26 ARG HE 4.000 . 6.000 6.037 6.032 6.048 0.048 25 0 "[ . 1 . 2 .]" 1
67 1 2 LEU MD1 1 27 ILE H 3.100 . 4.300 3.360 3.237 3.438 . 0 0 "[ . 1 . 2 .]" 1
68 1 2 LEU MD2 1 24 GLN HB3 3.100 . 4.300 2.390 2.278 2.496 . 0 0 "[ . 1 . 2 .]" 1
69 1 2 LEU MD2 1 24 GLN HE21 3.600 . 5.300 2.337 2.021 2.696 . 0 0 "[ . 1 . 2 .]" 1
70 1 2 LEU MD2 1 24 GLN HE22 3.600 . 5.200 3.649 3.452 3.799 . 0 0 "[ . 1 . 2 .]" 1
71 1 2 LEU MD2 1 25 LEU H 3.000 . 4.100 4.119 4.112 4.133 0.033 15 0 "[ . 1 . 2 .]" 1
72 1 2 LEU MD2 1 26 ARG HA 3.200 . 4.500 4.196 4.081 4.288 . 0 0 "[ . 1 . 2 .]" 1
73 1 2 LEU MD2 1 56 ALA MB 3.800 3.000 4.600 2.982 2.967 2.989 0.033 12 0 "[ . 1 . 2 .]" 1
74 1 2 LEU HG 1 3 VAL H 3.200 . 4.500 2.842 2.810 2.926 . 0 0 "[ . 1 . 2 .]" 1
75 1 2 LEU HG 1 56 ALA MB 4.200 3.000 5.000 2.890 2.870 2.900 0.130 23 0 "[ . 1 . 2 .]" 1
76 1 3 VAL H 1 3 VAL HA 2.400 . 3.100 2.945 2.943 2.948 . 0 0 "[ . 1 . 2 .]" 1
77 1 3 VAL H 1 3 VAL HB 3.600 . 5.300 3.665 3.656 3.682 . 0 0 "[ . 1 . 2 .]" 1
78 1 3 VAL H 1 3 VAL MG1 2.400 . 3.100 3.134 3.127 3.142 0.042 3 0 "[ . 1 . 2 .]" 1
79 1 3 VAL H 1 3 VAL MG2 2.300 . 2.900 1.943 1.915 2.018 . 0 0 "[ . 1 . 2 .]" 1
80 1 3 VAL H 1 24 GLN HB2 4.600 . 6.000 5.986 5.913 6.014 0.014 12 0 "[ . 1 . 2 .]" 1
81 1 3 VAL H 1 25 LEU H 2.600 . 3.400 3.093 3.073 3.116 . 0 0 "[ . 1 . 2 .]" 1
82 1 3 VAL H 1 25 LEU HB2 3.800 . 5.600 4.344 4.296 4.400 . 0 0 "[ . 1 . 2 .]" 1
83 1 3 VAL H 1 25 LEU HB3 4.600 . 6.000 5.729 5.686 5.782 . 0 0 "[ . 1 . 2 .]" 1
84 1 3 VAL H 1 25 LEU MD1 4.700 . 6.000 4.700 4.642 4.754 . 0 0 "[ . 1 . 2 .]" 1
85 1 3 VAL H 1 26 ARG HA 2.700 . 3.600 3.599 3.559 3.618 0.018 19 0 "[ . 1 . 2 .]" 1
86 1 3 VAL H 1 55 LYS HA 4.800 . 6.000 4.805 4.784 4.834 . 0 0 "[ . 1 . 2 .]" 1
87 1 3 VAL H 1 56 ALA MB 4.200 2.400 6.000 4.803 4.784 4.847 . 0 0 "[ . 1 . 2 .]" 1
88 1 3 VAL HA 1 3 VAL HB 2.400 . 3.100 2.539 2.531 2.543 . 0 0 "[ . 1 . 2 .]" 1
89 1 3 VAL HA 1 3 VAL MG1 2.400 . 3.100 2.267 2.251 2.278 . 0 0 "[ . 1 . 2 .]" 1
90 1 3 VAL HA 1 3 VAL MG2 3.200 . 4.400 3.178 3.175 3.180 . 0 0 "[ . 1 . 2 .]" 1
91 1 3 VAL HA 1 4 ILE H 2.000 . 2.500 2.580 2.565 2.587 0.087 17 0 "[ . 1 . 2 .]" 1
92 1 3 VAL HA 1 54 ALA H 4.400 2.700 6.100 4.566 4.497 4.642 . 0 0 "[ . 1 . 2 .]" 1
93 1 3 VAL HA 1 55 LYS HA 2.900 . 4.000 2.000 1.971 2.041 . 0 0 "[ . 1 . 2 .]" 1
94 1 3 VAL HA 1 56 ALA H 2.300 . 2.900 2.707 2.692 2.720 . 0 0 "[ . 1 . 2 .]" 1
95 1 3 VAL HA 1 56 ALA MB 3.200 . 4.900 3.842 3.812 3.872 . 0 0 "[ . 1 . 2 .]" 1
96 1 3 VAL HB 1 3 VAL MG1 2.300 . 3.000 2.121 2.116 2.125 . 0 0 "[ . 1 . 2 .]" 1
97 1 3 VAL HB 1 3 VAL MG2 2.400 . 3.100 2.123 2.120 2.125 . 0 0 "[ . 1 . 2 .]" 1
98 1 3 VAL HB 1 4 ILE H 2.200 . 2.800 1.886 1.867 1.908 . 0 0 "[ . 1 . 2 .]" 1
99 1 3 VAL HB 1 48 ILE MD 4.300 . 6.000 4.816 4.715 4.976 . 0 0 "[ . 1 . 2 .]" 1
100 1 3 VAL HB 1 53 VAL HA 3.700 . 5.400 3.940 3.859 4.016 . 0 0 "[ . 1 . 2 .]" 1
101 1 3 VAL HB 1 53 VAL HB 2.700 . 3.600 1.802 1.785 1.834 0.015 4 0 "[ . 1 . 2 .]" 1
102 1 3 VAL HB 1 53 VAL MG1 3.300 . 4.600 3.376 3.307 3.446 . 0 0 "[ . 1 . 2 .]" 1
103 1 3 VAL HB 1 53 VAL MG2 3.100 . 4.300 2.680 2.475 2.807 . 0 0 "[ . 1 . 2 .]" 1
104 1 3 VAL HB 1 54 ALA H 3.000 . 4.100 3.006 2.907 3.086 . 0 0 "[ . 1 . 2 .]" 1
105 1 3 VAL HB 1 54 ALA MB 5.000 2.900 6.900 4.614 4.570 4.664 . 0 0 "[ . 1 . 2 .]" 1
106 1 3 VAL HB 1 55 LYS HA 3.000 . 4.100 3.856 3.803 3.920 . 0 0 "[ . 1 . 2 .]" 1
107 1 3 VAL HB 1 56 ALA H 3.500 . 5.000 5.037 5.026 5.046 0.046 20 0 "[ . 1 . 2 .]" 1
108 1 3 VAL HB 1 56 ALA MB 5.500 4.000 7.000 5.548 5.529 5.576 . 0 0 "[ . 1 . 2 .]" 1
109 1 3 VAL MG1 1 3 VAL MG2 2.000 . 2.500 2.070 2.058 2.082 . 0 0 "[ . 1 . 2 .]" 1
110 1 3 VAL MG1 1 4 ILE H 2.800 . 3.800 3.208 3.192 3.221 . 0 0 "[ . 1 . 2 .]" 1
111 1 3 VAL MG1 1 25 LEU MD1 5.100 . 6.000 4.763 4.674 4.834 . 0 0 "[ . 1 . 2 .]" 1
112 1 3 VAL MG1 1 27 ILE HG12 2.500 . 3.300 3.074 2.989 3.217 . 0 0 "[ . 1 . 2 .]" 1
113 1 3 VAL MG1 1 27 ILE HG13 2.600 . 3.400 2.618 2.522 2.771 . 0 0 "[ . 1 . 2 .]" 1
114 1 3 VAL MG1 1 35 TRP HE3 3.300 . 4.700 3.569 3.385 3.776 . 0 0 "[ . 1 . 2 .]" 1
115 1 3 VAL MG1 1 35 TRP HZ3 2.900 . 4.000 2.783 2.602 3.020 . 0 0 "[ . 1 . 2 .]" 1
116 1 3 VAL MG1 1 53 VAL HB 2.600 . 3.400 3.172 3.132 3.212 . 0 0 "[ . 1 . 2 .]" 1
117 1 3 VAL MG1 1 53 VAL MG1 3.000 . 4.100 4.117 4.067 4.143 0.043 4 0 "[ . 1 . 2 .]" 1
118 1 3 VAL MG1 1 54 ALA H 4.900 3.700 6.100 3.973 3.913 4.052 . 0 0 "[ . 1 . 2 .]" 1
119 1 3 VAL MG1 1 54 ALA MB 5.800 3.500 6.600 4.322 4.282 4.378 . 0 0 "[ . 1 . 2 .]" 1
120 1 3 VAL MG1 1 55 LYS H 3.600 . 5.200 2.882 2.841 2.915 . 0 0 "[ . 1 . 2 .]" 1
121 1 3 VAL MG1 1 55 LYS HA 2.200 . 2.800 2.594 2.528 2.633 . 0 0 "[ . 1 . 2 .]" 1
122 1 3 VAL MG1 1 55 LYS HB2 3.400 . 4.800 4.459 4.012 4.590 . 0 0 "[ . 1 . 2 .]" 1
123 1 3 VAL MG1 1 55 LYS HB3 3.500 . 5.000 4.491 4.403 4.716 . 0 0 "[ . 1 . 2 .]" 1
124 1 3 VAL MG1 1 55 LYS QE 3.800 . 5.600 2.708 2.512 3.005 . 0 0 "[ . 1 . 2 .]" 1
125 1 3 VAL MG1 1 56 ALA H 3.200 . 4.500 4.182 4.155 4.197 . 0 0 "[ . 1 . 2 .]" 1
126 1 3 VAL MG1 1 57 ASN H 6.000 . 7.000 6.181 6.107 6.211 . 0 0 "[ . 1 . 2 .]" 1
127 1 3 VAL MG2 1 4 ILE H 2.900 . 4.000 3.295 3.274 3.313 . 0 0 "[ . 1 . 2 .]" 1
128 1 3 VAL MG2 1 24 GLN HA 3.900 . 5.800 4.107 4.046 4.179 . 0 0 "[ . 1 . 2 .]" 1
129 1 3 VAL MG2 1 25 LEU H 2.700 . 3.600 2.997 2.922 3.114 . 0 0 "[ . 1 . 2 .]" 1
130 1 3 VAL MG2 1 25 LEU HB2 2.300 . 3.000 2.889 2.804 2.983 . 0 0 "[ . 1 . 2 .]" 1
131 1 3 VAL MG2 1 25 LEU MD1 2.500 . 3.300 2.528 2.441 2.592 . 0 0 "[ . 1 . 2 .]" 1
132 1 3 VAL MG2 1 26 ARG HA 3.400 . 4.900 4.079 4.016 4.179 . 0 0 "[ . 1 . 2 .]" 1
133 1 3 VAL MG2 1 27 ILE HG12 2.700 . 3.600 1.965 1.928 2.049 . 0 0 "[ . 1 . 2 .]" 1
134 1 3 VAL MG2 1 35 TRP HE3 3.600 . 5.200 3.643 3.530 3.778 . 0 0 "[ . 1 . 2 .]" 1
135 1 3 VAL MG2 1 35 TRP HZ3 4.600 . 6.000 4.151 4.071 4.289 . 0 0 "[ . 1 . 2 .]" 1
136 1 3 VAL MG2 1 53 VAL HB 2.400 . 3.100 2.337 2.241 2.443 . 0 0 "[ . 1 . 2 .]" 1
137 1 3 VAL MG2 1 53 VAL MG1 2.300 . 3.000 2.465 2.355 2.591 . 0 0 "[ . 1 . 2 .]" 1
138 1 3 VAL MG2 1 54 ALA H 4.800 3.400 6.200 4.299 4.210 4.386 . 0 0 "[ . 1 . 2 .]" 1
139 1 3 VAL MG2 1 55 LYS HA 3.500 . 5.000 4.628 4.602 4.665 . 0 0 "[ . 1 . 2 .]" 1
140 1 3 VAL MG2 1 56 ALA H 4.900 . 6.000 5.330 5.314 5.346 . 0 0 "[ . 1 . 2 .]" 1
141 1 4 ILE H 1 4 ILE HB 2.600 . 3.400 2.805 2.767 2.836 . 0 0 "[ . 1 . 2 .]" 1
142 1 4 ILE H 1 4 ILE MD 3.900 . 5.800 4.808 4.781 4.833 . 0 0 "[ . 1 . 2 .]" 1
143 1 4 ILE H 1 4 ILE HG12 3.200 . 4.500 4.579 4.571 4.587 0.087 12 0 "[ . 1 . 2 .]" 1
144 1 4 ILE H 1 4 ILE HG13 3.000 . 4.100 4.122 4.106 4.138 0.038 25 0 "[ . 1 . 2 .]" 1
145 1 4 ILE H 1 4 ILE MG 3.600 . 4.600 3.412 3.378 3.442 . 0 0 "[ . 1 . 2 .]" 1
146 1 4 ILE H 1 5 ALA H 4.000 . 6.000 4.134 4.109 4.155 . 0 0 "[ . 1 . 2 .]" 1
147 1 4 ILE H 1 53 VAL HA 3.500 . 5.000 3.860 3.789 3.911 . 0 0 "[ . 1 . 2 .]" 1
148 1 4 ILE H 1 53 VAL HB 3.000 . 4.100 2.727 2.609 2.849 . 0 0 "[ . 1 . 2 .]" 1
149 1 4 ILE H 1 53 VAL MG1 4.500 . 6.000 3.876 3.742 3.957 . 0 0 "[ . 1 . 2 .]" 1
150 1 4 ILE H 1 53 VAL MG2 3.300 . 4.600 4.071 3.946 4.196 . 0 0 "[ . 1 . 2 .]" 1
151 1 4 ILE H 1 54 ALA H 2.800 2.100 3.500 2.261 2.181 2.328 . 0 0 "[ . 1 . 2 .]" 1
152 1 4 ILE H 1 54 ALA MB 4.100 2.700 5.500 3.881 3.818 3.948 . 0 0 "[ . 1 . 2 .]" 1
153 1 4 ILE H 1 55 LYS HA 3.000 . 4.100 3.600 3.536 3.669 . 0 0 "[ . 1 . 2 .]" 1
154 1 4 ILE H 1 56 ALA H 3.300 . 4.700 4.216 4.186 4.236 . 0 0 "[ . 1 . 2 .]" 1
155 1 4 ILE H 1 56 ALA HA 4.100 . 6.000 4.567 4.537 4.588 . 0 0 "[ . 1 . 2 .]" 1
156 1 4 ILE H 1 56 ALA MB 6.000 4.600 7.400 4.517 4.507 4.523 0.093 15 0 "[ . 1 . 2 .]" 1
157 1 4 ILE HA 1 4 ILE HB 2.900 . 3.900 2.893 2.884 2.901 . 0 0 "[ . 1 . 2 .]" 1
158 1 4 ILE HA 1 4 ILE HG12 3.600 . 5.200 2.166 2.148 2.182 . 0 0 "[ . 1 . 2 .]" 1
159 1 4 ILE HA 1 4 ILE HG13 3.000 . 4.100 2.552 2.535 2.575 . 0 0 "[ . 1 . 2 .]" 1
160 1 4 ILE HA 1 4 ILE MG 2.700 . 3.600 2.886 2.872 2.904 . 0 0 "[ . 1 . 2 .]" 1
161 1 4 ILE HA 1 5 ALA H 1.900 . 2.400 2.103 2.094 2.111 . 0 0 "[ . 1 . 2 .]" 1
162 1 4 ILE HA 1 5 ALA MB 3.200 . 4.500 3.885 3.873 3.897 . 0 0 "[ . 1 . 2 .]" 1
163 1 4 ILE HA 1 24 GLN HA 2.500 . 3.300 2.338 2.278 2.376 . 0 0 "[ . 1 . 2 .]" 1
164 1 4 ILE HA 1 24 GLN HB2 4.000 . 6.000 5.136 5.091 5.189 . 0 0 "[ . 1 . 2 .]" 1
165 1 4 ILE HA 1 24 GLN HG2 3.900 . 5.800 3.866 3.829 3.907 . 0 0 "[ . 1 . 2 .]" 1
166 1 4 ILE HA 1 25 LEU H 2.800 . 3.800 3.669 3.603 3.708 . 0 0 "[ . 1 . 2 .]" 1
167 1 4 ILE HB 1 4 ILE MD 3.300 . 4.600 2.553 2.541 2.565 . 0 0 "[ . 1 . 2 .]" 1
168 1 4 ILE HB 1 4 ILE MD 2.200 . 2.800 2.031 2.029 2.034 . 0 0 "[ . 1 . 2 .]" 1
169 1 4 ILE HB 1 4 ILE HG12 2.600 . 3.400 3.001 3.000 3.003 . 0 0 "[ . 1 . 2 .]" 1
170 1 4 ILE HB 1 4 ILE HG13 2.100 . 2.700 2.372 2.365 2.378 . 0 0 "[ . 1 . 2 .]" 1
171 1 4 ILE HB 1 5 ALA H 6.000 . 7.000 4.450 4.418 4.472 . 0 0 "[ . 1 . 2 .]" 1
172 1 4 ILE HB 1 6 LEU QD 6.000 4.900 7.000 4.871 4.850 4.932 0.050 12 0 "[ . 1 . 2 .]" 1
173 1 4 ILE HB 1 22 GLY HA2 4.100 . 6.000 5.002 4.960 5.036 . 0 0 "[ . 1 . 2 .]" 1
174 1 4 ILE HB 1 24 GLN HA 3.800 . 5.600 4.673 4.608 4.719 . 0 0 "[ . 1 . 2 .]" 1
175 1 4 ILE HB 1 24 GLN HB2 5.600 4.000 7.200 6.670 6.621 6.718 . 0 0 "[ . 1 . 2 .]" 1
176 1 4 ILE HB 1 24 GLN HG2 3.100 . 4.300 4.251 4.231 4.281 . 0 0 "[ . 1 . 2 .]" 1
177 1 4 ILE HB 1 24 GLN HG3 4.100 . 6.000 5.132 5.096 5.179 . 0 0 "[ . 1 . 2 .]" 1
178 1 4 ILE HB 1 56 ALA H 3.000 . 4.100 3.757 3.716 3.817 . 0 0 "[ . 1 . 2 .]" 1
179 1 4 ILE HB 1 56 ALA HA 3.200 . 4.500 2.357 2.319 2.387 . 0 0 "[ . 1 . 2 .]" 1
180 1 4 ILE HB 1 56 ALA MB 3.500 2.700 4.300 2.907 2.858 2.948 . 0 0 "[ . 1 . 2 .]" 1
181 1 4 ILE MD 1 4 ILE HG12 2.000 . 2.500 2.064 2.063 2.066 . 0 0 "[ . 1 . 2 .]" 1
182 1 4 ILE MD 1 4 ILE HG13 2.100 . 2.600 2.074 2.072 2.075 . 0 0 "[ . 1 . 2 .]" 1
183 1 4 ILE MD 1 5 ALA H 3.500 . 5.000 4.529 4.460 4.580 . 0 0 "[ . 1 . 2 .]" 1
184 1 4 ILE MD 1 22 GLY HA2 3.400 . 4.800 3.396 3.329 3.452 . 0 0 "[ . 1 . 2 .]" 1
185 1 4 ILE MD 1 22 GLY HA3 3.400 . 4.900 3.990 3.952 4.020 . 0 0 "[ . 1 . 2 .]" 1
186 1 4 ILE MD 1 23 GLU HA 3.100 . 4.300 4.358 4.346 4.366 0.066 10 0 "[ . 1 . 2 .]" 1
187 1 4 ILE MD 1 24 GLN HA 3.200 . 4.500 4.139 4.108 4.159 . 0 0 "[ . 1 . 2 .]" 1
188 1 4 ILE MD 1 24 GLN HB2 3.300 . 4.700 4.717 4.707 4.730 0.030 22 0 "[ . 1 . 2 .]" 1
189 1 4 ILE MD 1 24 GLN HE21 3.600 . 5.200 3.885 3.259 4.426 . 0 0 "[ . 1 . 2 .]" 1
190 1 4 ILE MD 1 24 GLN HE22 4.400 . 6.000 4.515 4.198 4.796 . 0 0 "[ . 1 . 2 .]" 1
191 1 4 ILE MD 1 24 GLN HG2 2.900 . 3.900 2.318 2.289 2.350 . 0 0 "[ . 1 . 2 .]" 1
192 1 4 ILE MD 1 24 GLN HG3 3.500 . 5.000 2.760 2.729 2.783 . 0 0 "[ . 1 . 2 .]" 1
193 1 4 ILE MD 1 55 LYS HB3 6.000 . 7.100 6.889 6.750 6.968 . 0 0 "[ . 1 . 2 .]" 1
194 1 4 ILE MD 1 56 ALA HA 3.200 . 4.500 2.833 2.784 2.891 . 0 0 "[ . 1 . 2 .]" 1
195 1 4 ILE MD 1 56 ALA MB 3.400 2.100 4.700 2.358 2.319 2.407 . 0 0 "[ . 1 . 2 .]" 1
196 1 4 ILE HG12 1 4 ILE MG 2.400 . 3.100 2.504 2.496 2.512 . 0 0 "[ . 1 . 2 .]" 1
197 1 4 ILE HG12 1 5 ALA H 3.100 . 4.300 3.229 3.185 3.264 . 0 0 "[ . 1 . 2 .]" 1
198 1 4 ILE HG12 1 22 GLY H 4.200 . 6.000 5.180 5.120 5.273 . 0 0 "[ . 1 . 2 .]" 1
199 1 4 ILE HG12 1 22 GLY HA2 3.300 . 4.600 3.834 3.813 3.868 . 0 0 "[ . 1 . 2 .]" 1
200 1 4 ILE HG12 1 22 GLY HA3 3.800 . 5.600 4.816 4.768 4.872 . 0 0 "[ . 1 . 2 .]" 1
201 1 4 ILE HG12 1 24 GLN HA 3.800 . 5.600 2.795 2.760 2.825 . 0 0 "[ . 1 . 2 .]" 1
202 1 4 ILE HG12 1 24 GLN HG2 3.400 . 4.800 2.526 2.484 2.555 . 0 0 "[ . 1 . 2 .]" 1
203 1 4 ILE HG12 1 24 GLN HG3 3.900 . 5.800 2.427 2.379 2.493 . 0 0 "[ . 1 . 2 .]" 1
204 1 4 ILE HG12 1 56 ALA HA 3.600 . 5.200 4.691 4.673 4.724 . 0 0 "[ . 1 . 2 .]" 1
205 1 4 ILE HG12 1 56 ALA MB 2.600 . 3.800 3.859 3.855 3.863 0.063 25 0 "[ . 1 . 2 .]" 1
206 1 4 ILE HG13 1 4 ILE MG 3.000 . 4.200 3.176 3.173 3.179 . 0 0 "[ . 1 . 2 .]" 1
207 1 4 ILE HG13 1 5 ALA H 3.100 . 4.300 4.383 4.373 4.396 0.096 13 0 "[ . 1 . 2 .]" 1
208 1 4 ILE HG13 1 22 GLY HA2 3.600 . 5.200 5.294 5.284 5.307 0.107 15 0 "[ . 1 . 2 .]" 1
209 1 4 ILE HG13 1 22 GLY HA3 6.000 4.000 7.000 6.369 6.339 6.400 . 0 0 "[ . 1 . 2 .]" 1
210 1 4 ILE HG13 1 24 GLN HA 3.400 . 4.800 3.018 2.958 3.075 . 0 0 "[ . 1 . 2 .]" 1
211 1 4 ILE HG13 1 24 GLN HB2 3.600 . 5.200 4.372 4.327 4.418 . 0 0 "[ . 1 . 2 .]" 1
212 1 4 ILE HG13 1 24 GLN HG2 3.300 . 4.700 1.912 1.893 1.932 0.007 3 0 "[ . 1 . 2 .]" 1
213 1 4 ILE HG13 1 24 GLN HG3 3.400 . 4.900 2.989 2.938 3.023 . 0 0 "[ . 1 . 2 .]" 1
214 1 4 ILE HG13 1 56 ALA HA 3.600 . 5.300 3.530 3.493 3.574 . 0 0 "[ . 1 . 2 .]" 1
215 1 4 ILE MG 1 5 ALA H 2.700 . 3.600 2.946 2.865 3.009 . 0 0 "[ . 1 . 2 .]" 1
216 1 4 ILE MG 1 5 ALA MB 3.500 . 5.000 3.788 3.717 3.828 . 0 0 "[ . 1 . 2 .]" 1
217 1 4 ILE MG 1 6 LEU H 5.200 . 6.000 4.645 4.583 4.703 . 0 0 "[ . 1 . 2 .]" 1
218 1 4 ILE MG 1 6 LEU HA 4.000 . 6.000 3.936 3.787 4.015 . 0 0 "[ . 1 . 2 .]" 1
219 1 4 ILE MG 1 21 LYS HA 4.000 . 6.000 5.185 5.068 5.248 . 0 0 "[ . 1 . 2 .]" 1
220 1 4 ILE MG 1 22 GLY H 3.300 . 4.600 3.343 3.232 3.406 . 0 0 "[ . 1 . 2 .]" 1
221 1 4 ILE MG 1 22 GLY HA2 2.600 . 3.400 2.069 2.043 2.097 . 0 0 "[ . 1 . 2 .]" 1
222 1 4 ILE MG 1 22 GLY HA3 3.000 . 4.100 3.545 3.517 3.580 . 0 0 "[ . 1 . 2 .]" 1
223 1 4 ILE MG 1 23 GLU H 4.100 . 6.000 4.177 4.048 4.265 . 0 0 "[ . 1 . 2 .]" 1
224 1 4 ILE MG 1 23 GLU HA 4.500 . 6.000 5.016 4.945 5.046 . 0 0 "[ . 1 . 2 .]" 1
225 1 4 ILE MG 1 24 GLN HA 3.200 . 4.500 4.497 4.462 4.514 0.014 2 0 "[ . 1 . 2 .]" 1
226 1 4 ILE MG 1 24 GLN HG2 3.100 . 4.300 4.364 4.358 4.370 0.070 3 0 "[ . 1 . 2 .]" 1
227 1 4 ILE MG 1 24 GLN HG3 4.600 2.800 5.400 4.432 4.385 4.484 . 0 0 "[ . 1 . 2 .]" 1
228 1 4 ILE MG 1 56 ALA HA 2.600 . 3.400 3.359 3.302 3.403 0.003 5 0 "[ . 1 . 2 .]" 1
229 1 5 ALA H 1 5 ALA HA 2.800 . 3.800 2.799 2.777 2.822 . 0 0 "[ . 1 . 2 .]" 1
230 1 5 ALA H 1 5 ALA MB 2.200 . 2.800 2.050 2.030 2.081 . 0 0 "[ . 1 . 2 .]" 1
231 1 5 ALA H 1 6 LEU H 5.200 . 6.000 4.626 4.621 4.632 . 0 0 "[ . 1 . 2 .]" 1
232 1 5 ALA H 1 19 PHE QD 5.100 . 6.000 4.035 4.001 4.079 . 0 0 "[ . 1 . 2 .]" 1
233 1 5 ALA H 1 21 LYS HA 5.800 3.600 6.800 5.114 5.036 5.172 . 0 0 "[ . 1 . 2 .]" 1
234 1 5 ALA H 1 22 GLY H 3.400 . 4.900 3.848 3.719 4.037 . 0 0 "[ . 1 . 2 .]" 1
235 1 5 ALA H 1 22 GLY HA2 4.400 . 6.000 4.137 4.016 4.232 . 0 0 "[ . 1 . 2 .]" 1
236 1 5 ALA H 1 23 GLU H 3.400 . 4.800 3.738 3.667 3.833 . 0 0 "[ . 1 . 2 .]" 1
237 1 5 ALA H 1 23 GLU HB2 4.600 . 6.000 4.580 4.507 4.678 . 0 0 "[ . 1 . 2 .]" 1
238 1 5 ALA H 1 23 GLU HB3 4.100 . 6.000 3.693 3.594 3.773 . 0 0 "[ . 1 . 2 .]" 1
239 1 5 ALA H 1 24 GLN HA 3.300 . 4.700 3.423 3.338 3.503 . 0 0 "[ . 1 . 2 .]" 1
240 1 5 ALA H 1 25 LEU H 3.600 . 5.200 4.812 4.715 4.932 . 0 0 "[ . 1 . 2 .]" 1
241 1 5 ALA H 1 25 LEU MD1 3.500 . 5.100 3.596 3.491 3.743 . 0 0 "[ . 1 . 2 .]" 1
242 1 5 ALA H 1 53 VAL MG1 5.200 . 6.000 3.011 2.786 3.252 . 0 0 "[ . 1 . 2 .]" 1
243 1 5 ALA HA 1 5 ALA MB 2.400 . 3.100 2.082 2.078 2.090 . 0 0 "[ . 1 . 2 .]" 1
244 1 5 ALA HA 1 6 LEU H 2.200 . 2.800 2.255 2.230 2.280 . 0 0 "[ . 1 . 2 .]" 1
245 1 5 ALA HA 1 7 HIS H 3.300 . 4.600 3.832 3.772 3.911 . 0 0 "[ . 1 . 2 .]" 1
246 1 5 ALA HA 1 53 VAL HA 2.900 . 3.900 1.948 1.907 1.970 . 0 0 "[ . 1 . 2 .]" 1
247 1 5 ALA HA 1 53 VAL MG1 2.700 . 3.600 2.089 1.915 2.431 . 0 0 "[ . 1 . 2 .]" 1
248 1 5 ALA HA 1 53 VAL MG2 4.800 . 6.000 4.393 4.336 4.473 . 0 0 "[ . 1 . 2 .]" 1
249 1 5 ALA HA 1 54 ALA H 4.100 2.100 6.100 3.489 3.448 3.543 . 0 0 "[ . 1 . 2 .]" 1
250 1 5 ALA MB 1 6 LEU H 2.700 . 3.600 2.751 2.709 2.818 . 0 0 "[ . 1 . 2 .]" 1
251 1 5 ALA MB 1 6 LEU HA 3.400 . 4.800 4.055 3.995 4.173 . 0 0 "[ . 1 . 2 .]" 1
252 1 5 ALA MB 1 19 PHE HB2 3.200 . 4.500 3.221 3.145 3.281 . 0 0 "[ . 1 . 2 .]" 1
253 1 5 ALA MB 1 19 PHE HB3 3.300 . 4.700 4.406 4.335 4.464 . 0 0 "[ . 1 . 2 .]" 1
254 1 5 ALA MB 1 19 PHE QD 2.100 . 2.700 1.802 1.738 1.848 . 0 0 "[ . 1 . 2 .]" 1
255 1 5 ALA MB 1 20 GLU H 4.800 . 6.000 4.019 3.922 4.127 . 0 0 "[ . 1 . 2 .]" 1
256 1 5 ALA MB 1 21 LYS HA 2.400 . 3.100 2.280 2.226 2.361 . 0 0 "[ . 1 . 2 .]" 1
257 1 5 ALA MB 1 22 GLY H 2.200 . 2.800 2.389 2.350 2.479 . 0 0 "[ . 1 . 2 .]" 1
258 1 5 ALA MB 1 22 GLY HA2 3.000 . 4.200 4.046 4.021 4.069 . 0 0 "[ . 1 . 2 .]" 1
259 1 5 ALA MB 1 22 GLY HA3 6.000 4.700 7.300 4.673 4.650 4.689 0.050 5 0 "[ . 1 . 2 .]" 1
260 1 5 ALA MB 1 23 GLU H 2.300 . 3.000 2.808 2.636 2.952 . 0 0 "[ . 1 . 2 .]" 1
261 1 5 ALA MB 1 23 GLU HA 4.100 . 6.000 4.516 4.365 4.633 . 0 0 "[ . 1 . 2 .]" 1
262 1 5 ALA MB 1 23 GLU HB2 3.100 . 4.300 3.264 3.085 3.435 . 0 0 "[ . 1 . 2 .]" 1
263 1 5 ALA MB 1 23 GLU HB3 2.700 . 3.600 2.822 2.639 2.967 . 0 0 "[ . 1 . 2 .]" 1
264 1 5 ALA MB 1 23 GLU HG2 4.100 . 6.000 4.917 4.738 5.059 . 0 0 "[ . 1 . 2 .]" 1
265 1 5 ALA MB 1 23 GLU HG3 3.800 . 5.600 4.707 4.540 4.825 . 0 0 "[ . 1 . 2 .]" 1
266 1 5 ALA MB 1 25 LEU MD1 2.600 . 3.500 3.046 2.936 3.167 . 0 0 "[ . 1 . 2 .]" 1
267 1 5 ALA MB 1 25 LEU MD2 3.200 . 4.500 4.082 3.975 4.223 . 0 0 "[ . 1 . 2 .]" 1
268 1 5 ALA MB 1 48 ILE MG 6.000 5.000 7.000 5.284 5.231 5.330 . 0 0 "[ . 1 . 2 .]" 1
269 1 5 ALA MB 1 52 PHE QE 3.200 . 4.500 4.213 3.619 4.525 0.025 24 0 "[ . 1 . 2 .]" 1
270 1 5 ALA MB 1 53 VAL HA 3.800 . 5.600 3.609 3.574 3.643 . 0 0 "[ . 1 . 2 .]" 1
271 1 5 ALA MB 1 53 VAL MG1 2.500 . 3.300 2.543 2.348 2.773 . 0 0 "[ . 1 . 2 .]" 1
272 1 6 LEU H 1 6 LEU HA 2.700 . 3.600 2.942 2.924 2.950 . 0 0 "[ . 1 . 2 .]" 1
273 1 6 LEU H 1 6 LEU HB2 2.600 . 3.400 2.474 2.367 2.526 . 0 0 "[ . 1 . 2 .]" 1
274 1 6 LEU H 1 6 LEU HB3 2.900 . 3.900 3.676 3.608 3.709 . 0 0 "[ . 1 . 2 .]" 1
275 1 6 LEU H 1 6 LEU MD1 4.600 3.300 5.900 4.078 4.001 4.117 . 0 0 "[ . 1 . 2 .]" 1
276 1 6 LEU H 1 6 LEU MD2 2.900 . 3.900 3.790 3.594 3.871 . 0 0 "[ . 1 . 2 .]" 1
277 1 6 LEU H 1 6 LEU HG 2.400 . 3.100 3.050 2.881 3.118 0.018 23 0 "[ . 1 . 2 .]" 1
278 1 6 LEU H 1 7 HIS H 2.200 . 2.800 2.151 2.068 2.230 . 0 0 "[ . 1 . 2 .]" 1
279 1 6 LEU H 1 7 HIS HB2 4.700 . 6.000 5.318 5.079 5.762 . 0 0 "[ . 1 . 2 .]" 1
280 1 6 LEU H 1 7 HIS HB3 4.600 . 6.000 5.353 5.147 5.551 . 0 0 "[ . 1 . 2 .]" 1
281 1 6 LEU H 1 52 PHE HB3 4.700 . 6.000 4.494 4.253 4.957 . 0 0 "[ . 1 . 2 .]" 1
282 1 6 LEU H 1 53 VAL HA 2.700 . 3.600 3.235 3.120 3.298 . 0 0 "[ . 1 . 2 .]" 1
283 1 6 LEU H 1 53 VAL HB 3.800 . 5.600 5.583 5.463 5.613 0.013 2 0 "[ . 1 . 2 .]" 1
284 1 6 LEU H 1 53 VAL MG1 3.000 . 4.100 3.859 3.775 4.010 . 0 0 "[ . 1 . 2 .]" 1
285 1 6 LEU H 1 53 VAL MG2 4.500 . 6.000 5.611 5.534 5.681 . 0 0 "[ . 1 . 2 .]" 1
286 1 6 LEU H 1 54 ALA H 4.400 2.300 6.300 4.667 4.531 4.760 . 0 0 "[ . 1 . 2 .]" 1
287 1 6 LEU H 1 54 ALA MB 5.900 3.300 7.400 4.944 4.765 5.130 . 0 0 "[ . 1 . 2 .]" 1
288 1 6 LEU HA 1 6 LEU HB2 2.600 . 3.400 3.013 3.010 3.015 . 0 0 "[ . 1 . 2 .]" 1
289 1 6 LEU HA 1 6 LEU HB3 2.200 . 2.800 2.529 2.521 2.544 . 0 0 "[ . 1 . 2 .]" 1
290 1 6 LEU HA 1 6 LEU MD1 4.700 3.500 5.900 3.828 3.790 3.849 . 0 0 "[ . 1 . 2 .]" 1
291 1 6 LEU HA 1 6 LEU MD2 2.000 . 2.500 1.978 1.933 2.046 . 0 0 "[ . 1 . 2 .]" 1
292 1 6 LEU HA 1 6 LEU HG 2.500 . 3.300 3.044 3.009 3.104 . 0 0 "[ . 1 . 2 .]" 1
293 1 6 LEU HA 1 7 HIS H 3.000 . 4.100 3.254 3.122 3.463 . 0 0 "[ . 1 . 2 .]" 1
294 1 6 LEU HA 1 21 LYS HA 3.800 . 5.600 4.172 3.988 4.562 . 0 0 "[ . 1 . 2 .]" 1
295 1 6 LEU HA 1 21 LYS HE2 3.700 . 5.400 4.703 4.042 5.257 . 0 0 "[ . 1 . 2 .]" 1
296 1 6 LEU HA 1 21 LYS HG2 3.600 . 5.200 4.140 3.840 4.726 . 0 0 "[ . 1 . 2 .]" 1
297 1 6 LEU HA 1 21 LYS HG3 4.200 . 6.000 3.261 2.881 3.856 . 0 0 "[ . 1 . 2 .]" 1
298 1 6 LEU HA 1 22 GLY H 3.800 . 5.700 3.280 3.060 3.595 . 0 0 "[ . 1 . 2 .]" 1
299 1 6 LEU HA 1 53 VAL HA 4.300 . 6.000 5.290 5.041 5.431 . 0 0 "[ . 1 . 2 .]" 1
300 1 6 LEU HB2 1 6 LEU MD1 3.300 2.500 4.100 2.434 2.416 2.470 0.084 12 0 "[ . 1 . 2 .]" 1
301 1 6 LEU HB2 1 6 LEU MD2 2.500 . 3.300 3.195 3.189 3.197 . 0 0 "[ . 1 . 2 .]" 1
302 1 6 LEU HB2 1 7 HIS H 3.100 . 4.300 3.537 3.007 3.822 . 0 0 "[ . 1 . 2 .]" 1
303 1 6 LEU HB2 1 7 HIS HD2 3.600 . 5.200 2.728 1.958 3.256 0.042 4 0 "[ . 1 . 2 .]" 1
304 1 6 LEU HB2 1 52 PHE HA 3.200 . 4.500 4.096 3.595 4.506 0.006 15 0 "[ . 1 . 2 .]" 1
305 1 6 LEU HB2 1 53 VAL HA 3.900 . 5.800 4.512 4.412 4.661 . 0 0 "[ . 1 . 2 .]" 1
306 1 6 LEU HB3 1 6 LEU MD1 2.900 2.300 3.500 2.301 2.269 2.324 0.031 19 0 "[ . 1 . 2 .]" 1
307 1 6 LEU HB3 1 6 LEU MD2 2.300 . 2.900 2.362 2.339 2.422 . 0 0 "[ . 1 . 2 .]" 1
308 1 6 LEU HB3 1 7 HIS H 3.300 . 4.700 4.173 3.851 4.335 . 0 0 "[ . 1 . 2 .]" 1
309 1 6 LEU HB3 1 7 HIS HD2 3.600 . 5.200 3.684 2.222 4.474 . 0 0 "[ . 1 . 2 .]" 1
310 1 6 LEU MD1 1 6 LEU HG 2.300 . 3.000 2.118 2.115 2.123 . 0 0 "[ . 1 . 2 .]" 1
311 1 6 LEU MD1 1 21 LYS HE2 6.000 4.100 7.000 6.787 6.178 7.009 0.009 10 0 "[ . 1 . 2 .]" 1
312 1 6 LEU MD1 1 52 PHE HA 5.000 3.400 6.600 4.792 4.110 5.183 . 0 0 "[ . 1 . 2 .]" 1
313 1 6 LEU MD1 1 53 VAL H 4.000 . 6.000 5.071 4.565 5.453 . 0 0 "[ . 1 . 2 .]" 1
314 1 6 LEU MD1 1 53 VAL HA 4.000 . 6.000 4.385 4.204 4.591 . 0 0 "[ . 1 . 2 .]" 1
315 1 6 LEU MD1 1 54 ALA H 4.800 3.400 6.200 4.240 3.998 4.606 . 0 0 "[ . 1 . 2 .]" 1
316 1 6 LEU MD1 1 54 ALA MB 2.600 2.100 5.100 2.278 2.096 2.543 0.004 21 0 "[ . 1 . 2 .]" 1
317 1 6 LEU MD2 1 7 HIS H 3.400 . 4.900 4.645 4.615 4.671 . 0 0 "[ . 1 . 2 .]" 1
318 1 6 LEU MD2 1 53 VAL HA 3.600 . 5.300 4.674 4.270 4.896 . 0 0 "[ . 1 . 2 .]" 1
319 1 6 LEU MD2 1 54 ALA H 4.700 3.100 6.300 4.128 3.649 4.377 . 0 0 "[ . 1 . 2 .]" 1
320 1 6 LEU HG 1 7 HIS H 3.500 . 5.100 4.800 4.605 4.901 . 0 0 "[ . 1 . 2 .]" 1
321 1 6 LEU HG 1 53 VAL HA 2.700 . 3.600 3.475 3.298 3.608 0.008 2 0 "[ . 1 . 2 .]" 1
322 1 6 LEU HG 1 53 VAL HB 4.500 . 6.000 5.566 5.463 5.665 . 0 0 "[ . 1 . 2 .]" 1
323 1 6 LEU HG 1 53 VAL MG1 3.500 . 5.000 5.032 5.019 5.047 0.047 4 0 "[ . 1 . 2 .]" 1
324 1 6 LEU HG 1 54 ALA H 3.300 2.200 4.400 3.407 3.259 3.534 . 0 0 "[ . 1 . 2 .]" 1
325 1 7 HIS H 1 7 HIS HA 2.700 . 3.600 2.868 2.839 2.918 . 0 0 "[ . 1 . 2 .]" 1
326 1 7 HIS H 1 7 HIS HB2 2.900 . 3.900 3.697 3.634 3.834 . 0 0 "[ . 1 . 2 .]" 1
327 1 7 HIS H 1 7 HIS HB3 3.100 . 4.300 3.848 3.656 3.954 . 0 0 "[ . 1 . 2 .]" 1
328 1 7 HIS H 1 7 HIS HD2 4.700 . 6.000 2.387 2.109 2.968 . 0 0 "[ . 1 . 2 .]" 1
329 1 7 HIS H 1 21 LYS HA 3.400 . 4.800 2.837 2.540 3.332 . 0 0 "[ . 1 . 2 .]" 1
330 1 7 HIS H 1 21 LYS HB3 5.200 4.200 6.200 5.124 4.887 5.564 . 0 0 "[ . 1 . 2 .]" 1
331 1 7 HIS H 1 21 LYS HG2 4.400 . 6.000 4.882 4.576 5.370 . 0 0 "[ . 1 . 2 .]" 1
332 1 7 HIS H 1 52 PHE HB3 4.400 . 6.000 5.312 5.070 5.643 . 0 0 "[ . 1 . 2 .]" 1
333 1 7 HIS H 1 53 VAL HA 5.000 . 6.000 5.257 5.173 5.345 . 0 0 "[ . 1 . 2 .]" 1
334 1 7 HIS HA 1 7 HIS HB2 2.800 . 3.800 2.767 2.620 2.833 . 0 0 "[ . 1 . 2 .]" 1
335 1 7 HIS HA 1 7 HIS HB3 2.900 . 3.900 2.255 2.239 2.310 . 0 0 "[ . 1 . 2 .]" 1
336 1 7 HIS HA 1 8 SER H 2.700 . 3.600 2.366 2.225 2.634 . 0 0 "[ . 1 . 2 .]" 1
337 1 7 HIS HA 1 21 LYS HB2 4.000 . 6.000 2.186 1.989 2.365 0.011 16 0 "[ . 1 . 2 .]" 1
338 1 7 HIS HB2 1 7 HIS HD2 3.500 . 5.100 3.573 3.331 3.965 . 0 0 "[ . 1 . 2 .]" 1
339 1 7 HIS HB2 1 8 SER H 3.400 . 4.800 2.807 1.998 3.264 0.002 19 0 "[ . 1 . 2 .]" 1
340 1 7 HIS HB2 1 52 PHE QD 3.600 . 5.200 4.652 4.396 5.073 . 0 0 "[ . 1 . 2 .]" 1
341 1 7 HIS HB2 1 52 PHE QE 3.200 . 4.500 3.311 3.236 3.406 . 0 0 "[ . 1 . 2 .]" 1
342 1 7 HIS HB3 1 7 HIS HD1 3.100 . 4.300 2.884 2.517 3.558 . 0 0 "[ . 1 . 2 .]" 1
343 1 7 HIS HB3 1 7 HIS HD2 3.700 . 5.400 3.620 3.002 3.945 . 0 0 "[ . 1 . 2 .]" 1
344 1 7 HIS HB3 1 8 SER H 3.000 . 4.100 3.364 3.069 3.510 . 0 0 "[ . 1 . 2 .]" 1
345 1 7 HIS HB3 1 52 PHE QD 3.800 . 5.600 5.571 5.495 5.647 0.047 19 0 "[ . 1 . 2 .]" 1
346 1 7 HIS HB3 1 52 PHE QE 3.200 . 4.500 4.515 4.504 4.534 0.034 4 0 "[ . 1 . 2 .]" 1
347 1 7 HIS HD1 1 52 PHE HA 3.500 . 5.000 4.999 4.709 5.046 0.046 25 0 "[ . 1 . 2 .]" 1
348 1 7 HIS HD2 1 52 PHE HA 3.100 . 4.300 3.467 2.926 4.309 0.009 22 0 "[ . 1 . 2 .]" 1
349 1 8 SER H 1 8 SER HB2 2.700 . 3.600 2.980 2.924 3.022 . 0 0 "[ . 1 . 2 .]" 1
350 1 8 SER H 1 8 SER HB3 3.000 . 4.100 3.515 3.480 3.575 . 0 0 "[ . 1 . 2 .]" 1
351 1 8 SER H 1 21 LYS H 4.300 . 6.000 4.283 4.059 4.636 . 0 0 "[ . 1 . 2 .]" 1
352 1 8 SER H 1 21 LYS HA 4.800 . 6.000 4.289 4.091 4.573 . 0 0 "[ . 1 . 2 .]" 1
353 1 8 SER H 1 21 LYS HB2 2.700 . 3.600 2.644 2.369 3.010 . 0 0 "[ . 1 . 2 .]" 1
354 1 8 SER H 1 21 LYS HG2 4.800 . 6.000 5.583 5.314 5.947 . 0 0 "[ . 1 . 2 .]" 1
355 1 8 SER HA 1 9 TYR H 2.800 . 3.800 2.149 2.142 2.153 . 0 0 "[ . 1 . 2 .]" 1
356 1 8 SER HA 1 21 LYS H 2.700 . 3.600 2.817 2.711 2.949 . 0 0 "[ . 1 . 2 .]" 1
357 1 8 SER HB2 1 9 TYR H 2.900 . 3.900 3.913 3.905 3.920 0.020 21 0 "[ . 1 . 2 .]" 1
358 1 8 SER HB2 1 21 LYS H 3.600 . 5.200 5.086 4.938 5.205 0.005 16 0 "[ . 1 . 2 .]" 1
359 1 8 SER HB2 1 21 LYS HB2 3.800 . 5.600 5.028 4.866 5.137 . 0 0 "[ . 1 . 2 .]" 1
360 1 8 SER HB3 1 9 TYR H 2.700 . 3.600 3.496 3.480 3.511 . 0 0 "[ . 1 . 2 .]" 1
361 1 8 SER HB3 1 9 TYR HA 3.600 . 5.200 5.211 5.204 5.218 0.018 7 0 "[ . 1 . 2 .]" 1
362 1 8 SER HB3 1 21 LYS H 3.000 . 4.100 3.782 3.640 3.887 . 0 0 "[ . 1 . 2 .]" 1
363 1 8 SER HB3 1 21 LYS HB2 3.600 . 5.200 4.643 4.492 4.735 . 0 0 "[ . 1 . 2 .]" 1
364 1 9 TYR H 1 9 TYR HA 3.000 2.500 3.500 2.940 2.937 2.945 . 0 0 "[ . 1 . 2 .]" 1
365 1 9 TYR H 1 9 TYR HB2 2.800 . 3.800 2.814 2.775 2.876 . 0 0 "[ . 1 . 2 .]" 1
366 1 9 TYR H 1 9 TYR HB3 2.800 . 3.800 2.642 2.588 2.674 . 0 0 "[ . 1 . 2 .]" 1
367 1 9 TYR H 1 9 TYR QD 3.300 . 4.700 4.300 4.293 4.306 . 0 0 "[ . 1 . 2 .]" 1
368 1 9 TYR H 1 10 GLU H 6.000 3.600 7.600 4.541 4.537 4.549 . 0 0 "[ . 1 . 2 .]" 1
369 1 9 TYR H 1 19 PHE H 2.700 . 3.600 3.604 3.564 3.616 0.016 13 0 "[ . 1 . 2 .]" 1
370 1 9 TYR H 1 19 PHE QD 3.100 . 4.300 4.294 4.191 4.319 0.019 3 0 "[ . 1 . 2 .]" 1
371 1 9 TYR H 1 21 LYS HB3 5.500 . 6.000 6.087 6.074 6.100 0.100 5 0 "[ . 1 . 2 .]" 1
372 1 9 TYR HA 1 9 TYR HB2 2.700 . 3.600 2.501 2.469 2.516 . 0 0 "[ . 1 . 2 .]" 1
373 1 9 TYR HA 1 9 TYR QD 2.700 . 3.600 2.094 2.070 2.120 . 0 0 "[ . 1 . 2 .]" 1
374 1 9 TYR HA 1 10 GLU H 2.000 . 2.500 2.205 2.196 2.218 . 0 0 "[ . 1 . 2 .]" 1
375 1 9 TYR HA 1 19 PHE H 3.400 . 4.800 4.730 4.693 4.772 . 0 0 "[ . 1 . 2 .]" 1
376 1 9 TYR HB2 1 9 TYR QD 2.200 . 2.800 2.721 2.712 2.728 . 0 0 "[ . 1 . 2 .]" 1
377 1 9 TYR HB2 1 10 GLU H 3.400 . 4.800 4.005 3.976 4.025 . 0 0 "[ . 1 . 2 .]" 1
378 1 9 TYR HB2 1 18 GLY HA2 4.000 . 6.000 4.696 4.645 4.738 . 0 0 "[ . 1 . 2 .]" 1
379 1 9 TYR HB2 1 19 PHE H 3.800 . 5.600 3.568 3.527 3.640 . 0 0 "[ . 1 . 2 .]" 1
380 1 9 TYR HB2 1 19 PHE QD 3.000 . 4.100 3.632 3.571 3.722 . 0 0 "[ . 1 . 2 .]" 1
381 1 9 TYR HB2 1 19 PHE QE 2.800 . 3.800 3.159 3.030 3.208 . 0 0 "[ . 1 . 2 .]" 1
382 1 9 TYR HB2 1 19 PHE HZ 2.900 . 4.000 3.514 3.372 3.596 . 0 0 "[ . 1 . 2 .]" 1
383 1 9 TYR HB2 1 52 PHE QD 3.000 . 4.100 2.575 2.100 3.313 . 0 0 "[ . 1 . 2 .]" 1
384 1 9 TYR HB3 1 9 TYR QD 2.300 . 3.000 2.289 2.283 2.296 . 0 0 "[ . 1 . 2 .]" 1
385 1 9 TYR HB3 1 10 GLU H 3.700 . 5.500 3.797 3.758 3.864 . 0 0 "[ . 1 . 2 .]" 1
386 1 9 TYR HB3 1 18 GLY HA2 4.000 . 6.000 3.147 3.067 3.216 . 0 0 "[ . 1 . 2 .]" 1
387 1 9 TYR HB3 1 18 GLY HA3 4.100 . 6.000 4.362 4.342 4.400 . 0 0 "[ . 1 . 2 .]" 1
388 1 9 TYR HB3 1 19 PHE H 3.000 . 4.100 1.906 1.882 1.963 0.018 1 0 "[ . 1 . 2 .]" 1
389 1 9 TYR HB3 1 19 PHE QD 3.000 . 4.100 3.375 3.336 3.414 . 0 0 "[ . 1 . 2 .]" 1
390 1 9 TYR HB3 1 19 PHE QE 2.900 . 3.900 3.645 3.605 3.700 . 0 0 "[ . 1 . 2 .]" 1
391 1 9 TYR HB3 1 19 PHE HZ 3.800 . 5.600 4.278 4.187 4.337 . 0 0 "[ . 1 . 2 .]" 1
392 1 9 TYR HB3 1 52 PHE QD 3.500 . 5.100 4.113 3.691 4.763 . 0 0 "[ . 1 . 2 .]" 1
393 1 9 TYR QD 1 10 GLU H 2.700 . 3.600 2.489 2.312 2.586 . 0 0 "[ . 1 . 2 .]" 1
394 1 9 TYR QD 1 11 PRO HA 3.600 . 5.200 4.258 4.208 4.304 . 0 0 "[ . 1 . 2 .]" 1
395 1 9 TYR QD 1 11 PRO HD2 3.300 . 4.600 4.206 4.160 4.248 . 0 0 "[ . 1 . 2 .]" 1
396 1 9 TYR QD 1 17 LEU H 4.400 . 6.000 4.820 4.624 4.969 . 0 0 "[ . 1 . 2 .]" 1
397 1 9 TYR QD 1 18 GLY HA2 3.100 . 4.300 1.917 1.886 1.944 0.014 4 0 "[ . 1 . 2 .]" 1
398 1 9 TYR QD 1 18 GLY HA3 3.000 . 4.100 3.635 3.597 3.677 . 0 0 "[ . 1 . 2 .]" 1
399 1 9 TYR QD 1 19 PHE H 3.000 . 4.100 2.561 2.432 2.621 . 0 0 "[ . 1 . 2 .]" 1
400 1 9 TYR QD 1 48 ILE HA 6.000 4.400 7.600 4.423 4.393 4.463 0.007 4 0 "[ . 1 . 2 .]" 1
401 1 9 TYR QD 1 49 PRO HB3 3.600 . 5.200 5.233 5.222 5.246 0.046 23 0 "[ . 1 . 2 .]" 1
402 1 9 TYR QD 1 49 PRO HD2 2.900 . 3.900 3.672 3.613 3.724 . 0 0 "[ . 1 . 2 .]" 1
403 1 9 TYR QD 1 49 PRO HG3 3.100 . 4.300 3.223 3.193 3.254 . 0 0 "[ . 1 . 2 .]" 1
404 1 9 TYR QE 1 10 GLU H 4.100 . 6.000 3.604 3.507 3.663 . 0 0 "[ . 1 . 2 .]" 1
405 1 9 TYR QE 1 11 PRO HA 2.500 . 3.300 2.954 2.876 2.998 . 0 0 "[ . 1 . 2 .]" 1
406 1 9 TYR QE 1 11 PRO HB3 3.000 . 4.200 3.660 3.543 3.771 . 0 0 "[ . 1 . 2 .]" 1
407 1 9 TYR QE 1 11 PRO HG3 4.100 . 6.000 4.463 4.295 4.549 . 0 0 "[ . 1 . 2 .]" 1
408 1 9 TYR QE 1 12 SER H 3.800 . 5.600 4.122 3.941 4.206 . 0 0 "[ . 1 . 2 .]" 1
409 1 9 TYR QE 1 12 SER HB2 4.200 . 6.000 5.048 4.438 6.016 0.016 16 0 "[ . 1 . 2 .]" 1
410 1 9 TYR QE 1 49 PRO HD2 2.400 . 3.100 3.135 3.115 3.157 0.057 7 0 "[ . 1 . 2 .]" 1
411 1 9 TYR QE 1 49 PRO HG3 3.000 . 4.100 2.415 2.302 2.571 . 0 0 "[ . 1 . 2 .]" 1
412 1 10 GLU H 1 10 GLU HA 2.600 . 3.400 2.914 2.910 2.918 . 0 0 "[ . 1 . 2 .]" 1
413 1 10 GLU H 1 10 GLU HB2 2.400 . 3.100 2.610 2.595 2.625 . 0 0 "[ . 1 . 2 .]" 1
414 1 10 GLU H 1 10 GLU HB3 2.500 . 3.300 3.368 3.360 3.376 0.076 12 0 "[ . 1 . 2 .]" 1
415 1 10 GLU H 1 10 GLU HG3 3.000 . 4.100 4.167 4.157 4.171 0.071 12 0 "[ . 1 . 2 .]" 1
416 1 10 GLU H 1 11 PRO HD3 3.800 . 5.600 3.963 3.931 4.002 . 0 0 "[ . 1 . 2 .]" 1
417 1 10 GLU HA 1 10 GLU HB2 2.800 . 3.700 2.829 2.827 2.832 . 0 0 "[ . 1 . 2 .]" 1
418 1 10 GLU HA 1 10 GLU HB3 2.700 . 3.600 2.825 2.823 2.827 . 0 0 "[ . 1 . 2 .]" 1
419 1 10 GLU HA 1 10 GLU HG3 2.800 . 3.800 2.310 2.293 2.331 . 0 0 "[ . 1 . 2 .]" 1
420 1 10 GLU HA 1 11 PRO HD2 2.100 . 2.600 1.676 1.672 1.680 . 0 0 "[ . 1 . 2 .]" 1
421 1 10 GLU HA 1 11 PRO HG3 3.600 . 5.200 4.355 4.352 4.358 . 0 0 "[ . 1 . 2 .]" 1
422 1 10 GLU HA 1 19 PHE H 3.400 . 4.800 4.703 4.604 4.800 0.000 4 0 "[ . 1 . 2 .]" 1
423 1 10 GLU HB2 1 10 GLU HG3 2.300 . 3.000 2.508 2.496 2.517 . 0 0 "[ . 1 . 2 .]" 1
424 1 10 GLU HB2 1 11 PRO HD2 3.100 . 4.300 4.467 4.466 4.470 0.170 20 0 "[ . 1 . 2 .]" 1
425 1 10 GLU HB3 1 10 GLU HG3 2.500 . 3.300 2.993 2.990 2.996 . 0 0 "[ . 1 . 2 .]" 1
426 1 10 GLU HB3 1 11 PRO HD2 3.000 . 4.100 4.141 4.138 4.146 0.046 19 0 "[ . 1 . 2 .]" 1
427 1 10 GLU HG3 1 11 PRO HD2 3.100 . 4.300 3.690 3.668 3.715 . 0 0 "[ . 1 . 2 .]" 1
428 1 11 PRO HA 1 11 PRO HB3 2.100 . 2.600 2.250 2.248 2.251 . 0 0 "[ . 1 . 2 .]" 1
429 1 11 PRO HA 1 11 PRO HD2 2.900 . 3.900 3.924 3.911 3.939 0.039 19 0 "[ . 1 . 2 .]" 1
430 1 11 PRO HA 1 11 PRO HG2 2.900 . 3.900 3.905 3.904 3.907 0.007 4 0 "[ . 1 . 2 .]" 1
431 1 11 PRO HA 1 12 SER H 2.300 . 3.000 2.131 2.126 2.148 . 0 0 "[ . 1 . 2 .]" 1
432 1 11 PRO HA 1 13 HIS H 3.100 . 4.300 3.826 3.529 3.917 . 0 0 "[ . 1 . 2 .]" 1
433 1 11 PRO HA 1 16 ASP HB2 2.500 . 3.300 3.239 3.076 3.308 0.008 9 0 "[ . 1 . 2 .]" 1
434 1 11 PRO HA 1 16 ASP HB3 2.700 . 3.600 3.050 2.815 3.222 . 0 0 "[ . 1 . 2 .]" 1
435 1 11 PRO HB2 1 12 SER H 3.000 . 4.100 3.798 3.671 3.987 . 0 0 "[ . 1 . 2 .]" 1
436 1 11 PRO HB2 1 13 HIS H 5.000 . 6.100 5.102 4.816 5.231 . 0 0 "[ . 1 . 2 .]" 1
437 1 11 PRO HB3 1 11 PRO QD 2.300 . 3.000 3.036 3.020 3.052 0.052 16 0 "[ . 1 . 2 .]" 1
438 1 11 PRO HB3 1 12 SER H 3.200 . 4.400 3.743 3.617 3.989 . 0 0 "[ . 1 . 2 .]" 1
439 1 11 PRO HB3 1 16 ASP H 4.500 . 5.800 4.252 4.163 4.294 . 0 0 "[ . 1 . 2 .]" 1
440 1 11 PRO HB3 1 16 ASP HB2 2.500 . 3.300 2.492 2.378 2.558 . 0 0 "[ . 1 . 2 .]" 1
441 1 11 PRO HB3 1 16 ASP HB3 2.400 . 3.100 2.859 2.659 2.940 . 0 0 "[ . 1 . 2 .]" 1
442 1 11 PRO HB3 1 17 LEU H 4.600 . 6.000 4.183 4.025 4.252 . 0 0 "[ . 1 . 2 .]" 1
443 1 11 PRO HB3 1 18 GLY H 3.400 . 4.900 4.087 3.972 4.165 . 0 0 "[ . 1 . 2 .]" 1
444 1 11 PRO HB3 1 18 GLY HA2 3.800 . 5.600 4.191 4.057 4.291 . 0 0 "[ . 1 . 2 .]" 1
445 1 11 PRO QD 1 11 PRO HG3 2.300 . 3.000 2.192 2.191 2.194 . 0 0 "[ . 1 . 2 .]" 1
446 1 11 PRO HD2 1 18 GLY H 3.300 . 4.700 4.678 4.603 4.709 0.009 20 0 "[ . 1 . 2 .]" 1
447 1 11 PRO HD2 1 19 PHE H 3.900 . 5.800 4.231 4.149 4.312 . 0 0 "[ . 1 . 2 .]" 1
448 1 11 PRO HD3 1 18 GLY H 4.100 . 6.000 3.791 3.731 3.841 . 0 0 "[ . 1 . 2 .]" 1
449 1 11 PRO HD3 1 19 PHE H 4.200 . 6.000 3.513 3.458 3.588 . 0 0 "[ . 1 . 2 .]" 1
450 1 11 PRO HG2 1 16 ASP HB2 3.900 . 5.800 5.317 5.170 5.390 . 0 0 "[ . 1 . 2 .]" 1
451 1 11 PRO HG2 1 16 ASP HB3 3.900 . 5.800 5.739 5.556 5.816 0.016 19 0 "[ . 1 . 2 .]" 1
452 1 11 PRO HG2 1 18 GLY H 3.600 . 5.200 4.343 4.244 4.406 . 0 0 "[ . 1 . 2 .]" 1
453 1 11 PRO HG2 1 18 GLY HA2 3.700 . 5.400 4.324 4.312 4.332 . 0 0 "[ . 1 . 2 .]" 1
454 1 11 PRO HG2 1 18 GLY HA3 3.100 . 4.300 3.420 3.349 3.500 . 0 0 "[ . 1 . 2 .]" 1
455 1 11 PRO HG3 1 12 SER H 4.600 . 6.000 5.584 5.517 5.706 . 0 0 "[ . 1 . 2 .]" 1
456 1 11 PRO HG3 1 16 ASP H 4.600 . 6.000 6.025 6.019 6.032 0.032 9 0 "[ . 1 . 2 .]" 1
457 1 11 PRO HG3 1 16 ASP HB2 4.300 . 6.000 4.687 4.553 4.749 . 0 0 "[ . 1 . 2 .]" 1
458 1 11 PRO HG3 1 16 ASP HB3 3.600 . 5.200 4.741 4.568 4.823 . 0 0 "[ . 1 . 2 .]" 1
459 1 11 PRO HG3 1 18 GLY H 3.200 . 4.500 2.680 2.576 2.747 . 0 0 "[ . 1 . 2 .]" 1
460 1 11 PRO HG3 1 18 GLY HA2 3.400 . 4.800 3.053 2.984 3.103 . 0 0 "[ . 1 . 2 .]" 1
461 1 11 PRO HG3 1 18 GLY HA3 3.000 . 4.100 2.324 2.209 2.440 . 0 0 "[ . 1 . 2 .]" 1
462 1 12 SER H 1 12 SER HB2 3.400 . 4.800 2.870 2.463 3.798 . 0 0 "[ . 1 . 2 .]" 1
463 1 12 SER H 1 12 SER HB3 3.100 . 4.300 3.325 2.676 3.853 . 0 0 "[ . 1 . 2 .]" 1
464 1 12 SER H 1 13 HIS H 2.400 . 3.100 1.948 1.927 1.987 . 0 0 "[ . 1 . 2 .]" 1
465 1 12 SER H 1 16 ASP HB2 3.600 . 5.200 3.487 3.162 3.970 . 0 0 "[ . 1 . 2 .]" 1
466 1 12 SER H 1 16 ASP HB3 3.900 . 5.800 3.800 3.493 4.280 . 0 0 "[ . 1 . 2 .]" 1
467 1 12 SER HA 1 12 SER HB2 2.400 . 3.100 2.786 2.398 3.029 . 0 0 "[ . 1 . 2 .]" 1
468 1 12 SER HA 1 12 SER HB3 2.400 . 3.100 2.704 2.248 3.030 . 0 0 "[ . 1 . 2 .]" 1
469 1 12 SER HA 1 13 HIS H 2.900 . 3.900 3.535 3.483 3.548 . 0 0 "[ . 1 . 2 .]" 1
470 1 12 SER HB2 1 13 HIS H 3.800 . 5.600 3.223 2.550 3.910 . 0 0 "[ . 1 . 2 .]" 1
471 1 12 SER HB3 1 13 HIS H 3.700 . 5.400 3.249 2.573 4.179 . 0 0 "[ . 1 . 2 .]" 1
472 1 13 HIS H 1 13 HIS HB2 2.800 . 3.800 2.180 2.130 2.220 . 0 0 "[ . 1 . 2 .]" 1
473 1 13 HIS H 1 13 HIS HB3 2.900 . 4.000 3.465 3.364 3.511 . 0 0 "[ . 1 . 2 .]" 1
474 1 13 HIS H 1 16 ASP HB2 2.900 . 4.000 3.652 3.554 3.770 . 0 0 "[ . 1 . 2 .]" 1
475 1 13 HIS H 1 16 ASP HB3 3.400 . 4.800 4.172 4.096 4.241 . 0 0 "[ . 1 . 2 .]" 1
476 1 13 HIS HB2 1 14 ASP H 3.700 . 5.400 3.933 3.708 4.132 . 0 0 "[ . 1 . 2 .]" 1
477 1 13 HIS HB2 1 16 ASP H 3.900 . 5.800 5.438 5.221 5.621 . 0 0 "[ . 1 . 2 .]" 1
478 1 13 HIS HB2 1 34 TRP HE3 3.500 . 5.000 5.035 5.019 5.045 0.045 2 0 "[ . 1 . 2 .]" 1
479 1 13 HIS HB3 1 14 ASP H 3.900 . 5.800 2.571 2.236 2.885 . 0 0 "[ . 1 . 2 .]" 1
480 1 13 HIS HB3 1 34 TRP HE3 3.900 . 5.800 5.778 5.574 5.811 0.011 19 0 "[ . 1 . 2 .]" 1
481 1 14 ASP H 1 14 ASP HB2 3.000 . 4.100 2.600 2.102 3.610 . 0 0 "[ . 1 . 2 .]" 1
482 1 14 ASP H 1 14 ASP HB3 2.900 . 4.000 3.067 2.541 3.616 . 0 0 "[ . 1 . 2 .]" 1
483 1 14 ASP HA 1 14 ASP HB2 2.600 . 3.500 2.739 2.470 3.024 . 0 0 "[ . 1 . 2 .]" 1
484 1 14 ASP HA 1 14 ASP HB3 2.500 . 3.300 2.707 2.372 3.027 . 0 0 "[ . 1 . 2 .]" 1
485 1 14 ASP HA 1 15 GLY H 2.100 . 2.700 2.210 2.158 2.259 . 0 0 "[ . 1 . 2 .]" 1
486 1 14 ASP HA 1 16 ASP H 2.800 . 3.800 3.658 3.532 3.744 . 0 0 "[ . 1 . 2 .]" 1
487 1 14 ASP HB2 1 15 GLY H 3.200 . 4.500 3.949 2.935 4.388 . 0 0 "[ . 1 . 2 .]" 1
488 1 14 ASP HB3 1 15 GLY H 3.500 . 5.000 3.567 2.879 4.180 . 0 0 "[ . 1 . 2 .]" 1
489 1 15 GLY H 1 15 GLY HA2 2.600 . 3.400 2.304 2.296 2.321 . 0 0 "[ . 1 . 2 .]" 1
490 1 15 GLY H 1 15 GLY HA3 2.500 . 3.300 2.830 2.792 2.883 . 0 0 "[ . 1 . 2 .]" 1
491 1 15 GLY H 1 16 ASP H 2.700 . 3.600 2.653 2.452 2.769 . 0 0 "[ . 1 . 2 .]" 1
492 1 15 GLY HA2 1 16 ASP H 3.100 . 4.300 2.875 2.807 2.975 . 0 0 "[ . 1 . 2 .]" 1
493 1 15 GLY HA2 1 47 PHE QD 3.700 . 5.400 5.632 5.621 5.642 0.242 19 0 "[ . 1 . 2 .]" 1
494 1 15 GLY HA3 1 16 ASP H 2.900 . 4.000 3.529 3.496 3.549 . 0 0 "[ . 1 . 2 .]" 1
495 1 15 GLY HA3 1 47 PHE QD 3.800 . 5.600 4.863 4.761 4.935 . 0 0 "[ . 1 . 2 .]" 1
496 1 16 ASP H 1 16 ASP HA 2.700 . 3.600 2.934 2.924 2.941 . 0 0 "[ . 1 . 2 .]" 1
497 1 16 ASP H 1 16 ASP HB2 2.200 . 2.800 2.451 2.384 2.495 . 0 0 "[ . 1 . 2 .]" 1
498 1 16 ASP H 1 16 ASP HB3 3.500 2.700 4.300 3.663 3.623 3.693 . 0 0 "[ . 1 . 2 .]" 1
499 1 16 ASP H 1 17 LEU H 4.200 . 6.000 4.530 4.507 4.555 . 0 0 "[ . 1 . 2 .]" 1
500 1 16 ASP H 1 47 PHE H 4.400 . 6.000 4.119 4.077 4.161 . 0 0 "[ . 1 . 2 .]" 1
501 1 16 ASP H 1 47 PHE HB2 3.200 . 4.500 4.358 4.225 4.477 . 0 0 "[ . 1 . 2 .]" 1
502 1 16 ASP HA 1 16 ASP HB2 2.500 . 3.300 3.018 3.015 3.019 . 0 0 "[ . 1 . 2 .]" 1
503 1 16 ASP HA 1 16 ASP HB3 2.600 . 3.400 2.520 2.504 2.547 . 0 0 "[ . 1 . 2 .]" 1
504 1 16 ASP HA 1 17 LEU H 2.100 . 2.700 2.305 2.288 2.331 . 0 0 "[ . 1 . 2 .]" 1
505 1 16 ASP HA 1 17 LEU HB2 4.300 . 6.000 4.745 4.700 4.819 . 0 0 "[ . 1 . 2 .]" 1
506 1 16 ASP HA 1 17 LEU HB3 3.200 . 4.500 4.198 4.128 4.243 . 0 0 "[ . 1 . 2 .]" 1
507 1 16 ASP HA 1 34 TRP HZ3 4.200 . 6.000 4.540 4.300 4.727 . 0 0 "[ . 1 . 2 .]" 1
508 1 16 ASP HA 1 46 GLY HA2 3.300 . 4.600 4.175 4.101 4.302 . 0 0 "[ . 1 . 2 .]" 1
509 1 16 ASP HA 1 46 GLY HA3 3.500 . 5.100 3.718 3.651 3.816 . 0 0 "[ . 1 . 2 .]" 1
510 1 16 ASP HA 1 47 PHE H 2.200 . 2.800 1.886 1.837 1.955 . 0 0 "[ . 1 . 2 .]" 1
511 1 16 ASP HA 1 47 PHE HB3 2.500 . 3.300 3.213 3.114 3.295 . 0 0 "[ . 1 . 2 .]" 1
512 1 16 ASP HA 1 47 PHE QD 3.900 . 5.800 4.177 4.128 4.258 . 0 0 "[ . 1 . 2 .]" 1
513 1 16 ASP HA 1 48 ILE MG 4.100 . 6.000 4.411 4.331 4.510 . 0 0 "[ . 1 . 2 .]" 1
514 1 16 ASP QB 1 47 PHE H 3.500 . 5.000 3.985 3.942 4.051 . 0 0 "[ . 1 . 2 .]" 1
515 1 16 ASP HB2 1 17 LEU H 2.800 . 3.800 3.815 3.806 3.823 0.023 17 0 "[ . 1 . 2 .]" 1
516 1 16 ASP HB2 1 34 TRP HZ3 6.000 4.200 7.200 4.730 4.696 4.753 . 0 0 "[ . 1 . 2 .]" 1
517 1 16 ASP HB3 1 17 LEU H 2.800 . 3.800 2.591 2.531 2.623 . 0 0 "[ . 1 . 2 .]" 1
518 1 16 ASP HB3 1 34 TRP HZ3 2.500 . 3.300 3.316 3.301 3.327 0.027 8 0 "[ . 1 . 2 .]" 1
519 1 17 LEU H 1 17 LEU HB2 2.600 . 3.500 3.307 3.266 3.404 . 0 0 "[ . 1 . 2 .]" 1
520 1 17 LEU H 1 17 LEU HB3 2.400 . 3.100 2.356 2.329 2.407 . 0 0 "[ . 1 . 2 .]" 1
521 1 17 LEU H 1 17 LEU MD1 3.600 . 5.200 4.447 4.396 4.530 . 0 0 "[ . 1 . 2 .]" 1
522 1 17 LEU H 1 17 LEU MD2 3.500 . 5.000 4.163 4.031 4.220 . 0 0 "[ . 1 . 2 .]" 1
523 1 17 LEU H 1 17 LEU HG 3.900 . 5.800 4.019 3.928 4.092 . 0 0 "[ . 1 . 2 .]" 1
524 1 17 LEU H 1 18 GLY H 4.700 . 6.000 4.400 4.325 4.433 . 0 0 "[ . 1 . 2 .]" 1
525 1 17 LEU H 1 46 GLY HA3 3.300 . 4.700 3.271 3.186 3.423 . 0 0 "[ . 1 . 2 .]" 1
526 1 17 LEU H 1 47 PHE H 3.000 . 4.100 2.843 2.775 2.992 . 0 0 "[ . 1 . 2 .]" 1
527 1 17 LEU H 1 47 PHE HB3 4.100 . 6.000 4.335 4.282 4.373 . 0 0 "[ . 1 . 2 .]" 1
528 1 17 LEU H 1 48 ILE HA 4.300 . 6.000 3.597 3.464 3.704 . 0 0 "[ . 1 . 2 .]" 1
529 1 17 LEU H 1 48 ILE MG 3.300 . 4.600 2.705 2.653 2.776 . 0 0 "[ . 1 . 2 .]" 1
530 1 17 LEU HA 1 17 LEU HB2 2.200 . 2.800 2.298 2.273 2.313 . 0 0 "[ . 1 . 2 .]" 1
531 1 17 LEU HA 1 17 LEU HB3 2.600 . 3.500 2.975 2.953 2.988 . 0 0 "[ . 1 . 2 .]" 1
532 1 17 LEU HA 1 17 LEU MD1 2.600 . 3.400 2.641 2.541 2.804 . 0 0 "[ . 1 . 2 .]" 1
533 1 17 LEU HA 1 17 LEU MD2 3.800 . 5.600 4.030 4.006 4.066 . 0 0 "[ . 1 . 2 .]" 1
534 1 17 LEU HA 1 17 LEU HG 3.700 . 5.400 3.354 3.260 3.404 . 0 0 "[ . 1 . 2 .]" 1
535 1 17 LEU HA 1 18 GLY H 2.100 . 2.600 2.171 2.152 2.185 . 0 0 "[ . 1 . 2 .]" 1
536 1 17 LEU HA 1 47 PHE H 4.900 . 6.000 4.530 4.498 4.567 . 0 0 "[ . 1 . 2 .]" 1
537 1 17 LEU HB2 1 18 GLY H 3.600 . 5.200 3.957 3.866 4.052 . 0 0 "[ . 1 . 2 .]" 1
538 1 17 LEU HB2 1 45 GLU HA 4.200 . 6.000 3.886 3.744 4.007 . 0 0 "[ . 1 . 2 .]" 1
539 1 17 LEU HB2 1 46 GLY H 2.800 . 3.800 3.031 2.980 3.116 . 0 0 "[ . 1 . 2 .]" 1
540 1 17 LEU HB2 1 46 GLY HA2 3.100 . 4.300 3.461 3.440 3.513 . 0 0 "[ . 1 . 2 .]" 1
541 1 17 LEU HB2 1 46 GLY HA3 2.600 . 3.500 1.856 1.814 1.899 . 0 0 "[ . 1 . 2 .]" 1
542 1 17 LEU HB2 1 48 ILE MG 2.700 . 3.600 3.630 3.608 3.640 0.040 8 0 "[ . 1 . 2 .]" 1
543 1 17 LEU HB3 1 17 LEU MD1 2.100 . 2.600 2.072 2.071 2.075 . 0 0 "[ . 1 . 2 .]" 1
544 1 17 LEU HB3 1 18 GLY H 3.300 . 4.700 4.380 4.341 4.443 . 0 0 "[ . 1 . 2 .]" 1
545 1 17 LEU HB3 1 19 PHE QD 3.800 . 5.600 4.341 4.274 4.431 . 0 0 "[ . 1 . 2 .]" 1
546 1 17 LEU HB3 1 46 GLY H 2.700 . 3.600 3.573 3.485 3.608 0.008 4 0 "[ . 1 . 2 .]" 1
547 1 17 LEU HB3 1 46 GLY HA2 3.900 . 5.800 4.069 3.958 4.158 . 0 0 "[ . 1 . 2 .]" 1
548 1 17 LEU HB3 1 46 GLY HA3 3.100 . 4.300 2.681 2.593 2.751 . 0 0 "[ . 1 . 2 .]" 1
549 1 17 LEU HB3 1 47 PHE H 3.300 . 4.700 3.606 3.546 3.641 . 0 0 "[ . 1 . 2 .]" 1
550 1 17 LEU HB3 1 48 ILE MG 2.200 . 2.800 2.231 2.216 2.260 . 0 0 "[ . 1 . 2 .]" 1
551 1 17 LEU MD1 1 17 LEU HG 2.300 . 3.000 2.101 2.099 2.105 . 0 0 "[ . 1 . 2 .]" 1
552 1 17 LEU MD1 1 18 GLY H 2.300 . 3.000 2.397 2.161 2.779 . 0 0 "[ . 1 . 2 .]" 1
553 1 17 LEU MD1 1 18 GLY HA3 4.000 . 6.000 3.950 3.734 4.320 . 0 0 "[ . 1 . 2 .]" 1
554 1 17 LEU MD1 1 19 PHE QD 3.900 . 5.800 3.528 3.320 3.832 . 0 0 "[ . 1 . 2 .]" 1
555 1 17 LEU MD1 1 38 GLN HA 3.400 . 4.800 4.416 4.190 4.539 . 0 0 "[ . 1 . 2 .]" 1
556 1 17 LEU MD1 1 39 SER H 2.600 . 3.500 3.223 3.031 3.317 . 0 0 "[ . 1 . 2 .]" 1
557 1 17 LEU MD1 1 39 SER HB2 3.100 . 4.300 2.640 2.585 2.675 . 0 0 "[ . 1 . 2 .]" 1
558 1 17 LEU MD1 1 39 SER HB3 2.900 . 3.900 3.933 3.912 3.951 0.051 16 0 "[ . 1 . 2 .]" 1
559 1 17 LEU MD1 1 43 GLY H 4.500 . 6.000 5.052 5.024 5.093 . 0 0 "[ . 1 . 2 .]" 1
560 1 17 LEU MD1 1 44 GLN H 3.500 . 5.000 3.969 3.909 4.033 . 0 0 "[ . 1 . 2 .]" 1
561 1 17 LEU MD1 1 44 GLN HA 3.500 . 5.000 4.126 4.045 4.189 . 0 0 "[ . 1 . 2 .]" 1
562 1 17 LEU MD1 1 44 GLN HB2 2.400 . 3.100 2.742 2.671 2.854 . 0 0 "[ . 1 . 2 .]" 1
563 1 17 LEU MD1 1 44 GLN HB3 2.300 . 3.000 2.462 2.393 2.518 . 0 0 "[ . 1 . 2 .]" 1
564 1 17 LEU MD1 1 44 GLN HG2 3.100 . 4.300 4.169 4.096 4.251 . 0 0 "[ . 1 . 2 .]" 1
565 1 17 LEU MD1 1 44 GLN QG 3.000 . 4.100 3.895 3.834 3.955 . 0 0 "[ . 1 . 2 .]" 1
566 1 17 LEU MD1 1 44 GLN HG3 3.300 . 4.700 4.674 4.607 4.709 0.009 2 0 "[ . 1 . 2 .]" 1
567 1 17 LEU MD1 1 45 GLU H 3.200 . 4.500 4.180 3.980 4.300 . 0 0 "[ . 1 . 2 .]" 1
568 1 17 LEU MD1 1 45 GLU HA 2.900 . 4.000 3.681 3.338 3.853 . 0 0 "[ . 1 . 2 .]" 1
569 1 17 LEU MD2 1 17 LEU HG 1.700 . 2.200 2.114 2.080 2.127 . 0 0 "[ . 1 . 2 .]" 1
570 1 17 LEU MD2 1 18 GLY H 3.400 . 4.800 4.589 4.507 4.703 . 0 0 "[ . 1 . 2 .]" 1
571 1 17 LEU MD2 1 19 PHE HB3 3.900 . 5.800 3.883 3.817 3.917 . 0 0 "[ . 1 . 2 .]" 1
572 1 17 LEU MD2 1 19 PHE QD 3.000 . 4.100 3.450 3.181 3.621 . 0 0 "[ . 1 . 2 .]" 1
573 1 17 LEU MD2 1 19 PHE QE 4.300 . 6.000 4.049 3.582 4.310 . 0 0 "[ . 1 . 2 .]" 1
574 1 17 LEU MD2 1 25 LEU MD1 3.400 . 4.800 3.053 2.717 3.265 . 0 0 "[ . 1 . 2 .]" 1
575 1 17 LEU MD2 1 37 ALA H 4.500 . 6.000 3.216 2.888 3.342 . 0 0 "[ . 1 . 2 .]" 1
576 1 17 LEU MD2 1 37 ALA HA 4.700 . 6.000 4.248 4.117 4.312 . 0 0 "[ . 1 . 2 .]" 1
577 1 17 LEU MD2 1 37 ALA MB 2.600 . 3.500 2.222 2.172 2.267 . 0 0 "[ . 1 . 2 .]" 1
578 1 17 LEU MD2 1 38 GLN H 4.500 . 6.000 4.179 4.110 4.270 . 0 0 "[ . 1 . 2 .]" 1
579 1 17 LEU MD2 1 38 GLN HA 2.700 . 3.600 3.101 2.907 3.364 . 0 0 "[ . 1 . 2 .]" 1
580 1 17 LEU MD2 1 39 SER H 2.600 . 3.400 2.581 2.458 2.744 . 0 0 "[ . 1 . 2 .]" 1
581 1 17 LEU MD2 1 39 SER HB2 3.500 . 5.000 3.188 3.087 3.428 . 0 0 "[ . 1 . 2 .]" 1
582 1 17 LEU MD2 1 39 SER HB3 4.000 . 6.000 4.417 4.299 4.678 . 0 0 "[ . 1 . 2 .]" 1
583 1 17 LEU MD2 1 45 GLU H 4.600 . 6.000 4.946 4.730 5.245 . 0 0 "[ . 1 . 2 .]" 1
584 1 17 LEU MD2 1 45 GLU HA 2.500 . 3.300 3.024 2.812 3.316 0.016 10 0 "[ . 1 . 2 .]" 1
585 1 17 LEU MD2 1 46 GLY H 2.700 . 3.600 2.844 2.785 2.930 . 0 0 "[ . 1 . 2 .]" 1
586 1 17 LEU MD2 1 48 ILE MG 2.400 . 3.100 2.064 1.824 2.224 . 0 0 "[ . 1 . 2 .]" 1
587 1 17 LEU HG 1 18 GLY H 2.500 . 3.300 3.322 3.313 3.328 0.028 16 0 "[ . 1 . 2 .]" 1
588 1 17 LEU HG 1 19 PHE HB2 4.100 . 6.000 5.372 5.317 5.421 . 0 0 "[ . 1 . 2 .]" 1
589 1 17 LEU HG 1 19 PHE HB3 3.400 . 4.900 3.754 3.701 3.857 . 0 0 "[ . 1 . 2 .]" 1
590 1 17 LEU HG 1 19 PHE QD 3.000 . 4.100 2.327 2.118 2.498 . 0 0 "[ . 1 . 2 .]" 1
591 1 17 LEU HG 1 25 LEU MD1 4.100 . 6.000 4.144 4.050 4.279 . 0 0 "[ . 1 . 2 .]" 1
592 1 17 LEU HG 1 25 LEU MD2 3.200 . 4.500 2.896 2.802 3.029 . 0 0 "[ . 1 . 2 .]" 1
593 1 17 LEU HG 1 37 ALA MB 3.500 . 5.000 4.370 4.265 4.519 . 0 0 "[ . 1 . 2 .]" 1
594 1 17 LEU HG 1 39 SER H 4.300 . 6.000 5.182 5.053 5.307 . 0 0 "[ . 1 . 2 .]" 1
595 1 17 LEU HG 1 47 PHE H 4.900 . 6.000 6.056 6.042 6.064 0.064 16 0 "[ . 1 . 2 .]" 1
596 1 17 LEU HG 1 48 ILE MG 3.000 . 4.100 2.661 2.525 2.761 . 0 0 "[ . 1 . 2 .]" 1
597 1 18 GLY H 1 18 GLY HA2 2.200 . 2.800 2.923 2.911 2.930 0.130 24 0 "[ . 1 . 2 .]" 1
598 1 18 GLY H 1 18 GLY HA3 2.600 . 3.400 2.374 2.356 2.387 . 0 0 "[ . 1 . 2 .]" 1
599 1 18 GLY H 1 19 PHE H 3.600 . 5.200 4.549 4.534 4.566 . 0 0 "[ . 1 . 2 .]" 1
600 1 18 GLY H 1 19 PHE QD 4.300 . 6.000 4.075 3.986 4.233 . 0 0 "[ . 1 . 2 .]" 1
601 1 18 GLY HA2 1 19 PHE H 2.300 . 3.000 2.196 2.175 2.235 . 0 0 "[ . 1 . 2 .]" 1
602 1 18 GLY HA2 1 19 PHE QD 3.600 . 5.200 2.814 2.740 2.950 . 0 0 "[ . 1 . 2 .]" 1
603 1 18 GLY HA3 1 19 PHE H 2.200 . 2.800 2.986 2.942 3.014 0.214 4 0 "[ . 1 . 2 .]" 1
604 1 18 GLY HA3 1 19 PHE QD 3.700 . 5.400 4.018 3.954 4.167 . 0 0 "[ . 1 . 2 .]" 1
605 1 19 PHE H 1 19 PHE HA 2.600 . 3.400 2.909 2.899 2.920 . 0 0 "[ . 1 . 2 .]" 1
606 1 19 PHE H 1 19 PHE HB2 3.500 . 5.100 3.781 3.760 3.811 . 0 0 "[ . 1 . 2 .]" 1
607 1 19 PHE H 1 19 PHE HB3 3.300 . 4.700 3.571 3.529 3.596 . 0 0 "[ . 1 . 2 .]" 1
608 1 19 PHE H 1 19 PHE QD 2.900 . 3.900 2.680 2.590 2.766 . 0 0 "[ . 1 . 2 .]" 1
609 1 19 PHE H 1 20 GLU H 3.900 . 5.800 4.381 4.370 4.396 . 0 0 "[ . 1 . 2 .]" 1
610 1 19 PHE HA 1 19 PHE HB2 2.200 . 2.800 2.612 2.603 2.625 . 0 0 "[ . 1 . 2 .]" 1
611 1 19 PHE HA 1 19 PHE HB3 2.100 . 2.700 2.310 2.304 2.319 . 0 0 "[ . 1 . 2 .]" 1
612 1 19 PHE HA 1 19 PHE QD 3.100 . 4.300 3.553 3.527 3.584 . 0 0 "[ . 1 . 2 .]" 1
613 1 19 PHE HA 1 20 GLU H 2.100 . 2.600 2.541 2.517 2.568 . 0 0 "[ . 1 . 2 .]" 1
614 1 19 PHE HA 1 23 GLU HB2 3.700 . 5.400 4.475 4.401 4.570 . 0 0 "[ . 1 . 2 .]" 1
615 1 19 PHE HA 1 23 GLU HG3 3.100 . 4.300 3.706 3.634 3.789 . 0 0 "[ . 1 . 2 .]" 1
616 1 19 PHE HA 1 25 LEU MD2 3.600 . 5.200 3.777 3.707 3.840 . 0 0 "[ . 1 . 2 .]" 1
617 1 19 PHE HB2 1 19 PHE QD 2.300 . 2.900 2.280 2.273 2.288 . 0 0 "[ . 1 . 2 .]" 1
618 1 19 PHE HB2 1 20 GLU H 2.300 . 3.000 2.094 2.043 2.125 . 0 0 "[ . 1 . 2 .]" 1
619 1 19 PHE HB2 1 23 GLU HB2 2.900 . 3.900 2.943 2.915 2.998 . 0 0 "[ . 1 . 2 .]" 1
620 1 19 PHE HB2 1 23 GLU HB3 2.800 . 3.800 2.270 2.224 2.316 . 0 0 "[ . 1 . 2 .]" 1
621 1 19 PHE HB2 1 23 GLU HG2 3.800 . 5.600 3.391 3.280 3.477 . 0 0 "[ . 1 . 2 .]" 1
622 1 19 PHE HB2 1 23 GLU HG3 3.500 . 5.000 2.958 2.859 3.043 . 0 0 "[ . 1 . 2 .]" 1
623 1 19 PHE HB2 1 25 LEU MD1 3.000 . 4.100 3.707 3.619 3.802 . 0 0 "[ . 1 . 2 .]" 1
624 1 19 PHE HB2 1 25 LEU MD2 2.700 . 3.600 2.690 2.640 2.789 . 0 0 "[ . 1 . 2 .]" 1
625 1 19 PHE HB3 1 19 PHE QD 2.200 . 2.800 2.553 2.516 2.575 . 0 0 "[ . 1 . 2 .]" 1
626 1 19 PHE HB3 1 20 GLU H 2.500 . 3.300 3.334 3.320 3.343 0.043 4 0 "[ . 1 . 2 .]" 1
627 1 19 PHE HB3 1 23 GLU HB2 3.200 . 4.500 4.461 4.418 4.510 0.010 16 0 "[ . 1 . 2 .]" 1
628 1 19 PHE HB3 1 23 GLU HB3 3.400 . 4.800 3.489 3.430 3.565 . 0 0 "[ . 1 . 2 .]" 1
629 1 19 PHE HB3 1 25 LEU MD1 3.000 . 4.100 3.513 3.379 3.624 . 0 0 "[ . 1 . 2 .]" 1
630 1 19 PHE HB3 1 25 LEU MD2 2.500 . 3.300 1.758 1.719 1.802 . 0 0 "[ . 1 . 2 .]" 1
631 1 19 PHE QD 1 20 GLU H 3.000 . 4.200 3.666 3.556 3.727 . 0 0 "[ . 1 . 2 .]" 1
632 1 19 PHE QD 1 21 LYS H 4.300 . 6.000 5.616 5.485 5.689 . 0 0 "[ . 1 . 2 .]" 1
633 1 19 PHE QD 1 21 LYS HA 4.100 . 6.000 4.532 4.439 4.605 . 0 0 "[ . 1 . 2 .]" 1
634 1 19 PHE QD 1 23 GLU HB2 4.300 . 6.000 3.856 3.705 4.005 . 0 0 "[ . 1 . 2 .]" 1
635 1 19 PHE QD 1 23 GLU HB3 3.600 . 5.300 3.271 3.172 3.338 . 0 0 "[ . 1 . 2 .]" 1
636 1 19 PHE QD 1 25 LEU MD1 3.500 . 5.000 2.993 2.903 3.094 . 0 0 "[ . 1 . 2 .]" 1
637 1 19 PHE QD 1 25 LEU MD2 3.000 . 4.100 2.880 2.709 2.944 . 0 0 "[ . 1 . 2 .]" 1
638 1 19 PHE QD 1 48 ILE HB 3.600 . 5.300 4.278 4.131 4.379 . 0 0 "[ . 1 . 2 .]" 1
639 1 19 PHE QD 1 48 ILE MD 3.600 . 5.200 4.355 4.188 4.462 . 0 0 "[ . 1 . 2 .]" 1
640 1 19 PHE QD 1 48 ILE MG 2.700 . 3.600 2.732 2.542 2.856 . 0 0 "[ . 1 . 2 .]" 1
641 1 19 PHE QD 1 52 PHE HB3 3.400 . 4.900 4.645 4.590 4.691 . 0 0 "[ . 1 . 2 .]" 1
642 1 19 PHE QE 1 25 LEU MD1 3.400 . 4.800 3.185 3.119 3.280 . 0 0 "[ . 1 . 2 .]" 1
643 1 19 PHE QE 1 25 LEU MD2 4.000 . 6.000 3.984 3.885 4.072 . 0 0 "[ . 1 . 2 .]" 1
644 1 19 PHE QE 1 37 ALA MB 4.500 . 6.000 4.793 4.715 4.902 . 0 0 "[ . 1 . 2 .]" 1
645 1 19 PHE QE 1 48 ILE HA 2.900 . 4.000 2.956 2.869 3.026 . 0 0 "[ . 1 . 2 .]" 1
646 1 19 PHE QE 1 48 ILE HB 2.300 . 3.000 2.338 2.133 2.467 . 0 0 "[ . 1 . 2 .]" 1
647 1 19 PHE QE 1 48 ILE MD 3.000 . 4.100 3.415 3.316 3.473 . 0 0 "[ . 1 . 2 .]" 1
648 1 19 PHE QE 1 48 ILE HG12 4.100 . 6.000 4.570 4.471 4.620 . 0 0 "[ . 1 . 2 .]" 1
649 1 19 PHE QE 1 48 ILE HG13 3.900 . 5.800 4.710 4.595 4.777 . 0 0 "[ . 1 . 2 .]" 1
650 1 19 PHE QE 1 48 ILE MG 2.300 . 2.900 1.842 1.825 1.867 . 0 0 "[ . 1 . 2 .]" 1
651 1 19 PHE QE 1 49 PRO QG 3.800 . 5.600 3.523 3.448 3.575 . 0 0 "[ . 1 . 2 .]" 1
652 1 19 PHE QE 1 52 PHE HB2 2.800 . 3.800 3.859 3.836 3.872 0.072 14 0 "[ . 1 . 2 .]" 1
653 1 19 PHE QE 1 52 PHE HB3 2.600 . 3.400 2.307 2.237 2.370 . 0 0 "[ . 1 . 2 .]" 1
654 1 19 PHE HZ 1 48 ILE HB 3.200 . 4.500 2.246 2.080 2.472 . 0 0 "[ . 1 . 2 .]" 1
655 1 19 PHE HZ 1 48 ILE MD 3.300 . 4.700 3.121 3.003 3.416 . 0 0 "[ . 1 . 2 .]" 1
656 1 19 PHE HZ 1 48 ILE MG 3.600 . 5.300 3.315 3.183 3.494 . 0 0 "[ . 1 . 2 .]" 1
657 1 19 PHE HZ 1 49 PRO HD2 2.500 . 3.300 2.285 2.117 2.447 . 0 0 "[ . 1 . 2 .]" 1
658 1 19 PHE HZ 1 49 PRO QG 4.200 . 6.000 2.402 2.290 2.490 . 0 0 "[ . 1 . 2 .]" 1
659 1 19 PHE HZ 1 52 PHE H 3.900 . 5.800 5.059 4.828 5.297 . 0 0 "[ . 1 . 2 .]" 1
660 1 19 PHE HZ 1 52 PHE HB2 2.600 . 3.400 3.182 2.966 3.393 . 0 0 "[ . 1 . 2 .]" 1
661 1 19 PHE HZ 1 52 PHE HB3 2.600 . 3.400 2.464 2.138 2.797 . 0 0 "[ . 1 . 2 .]" 1
662 1 19 PHE HZ 1 53 VAL MG1 3.200 . 4.500 3.357 3.140 3.477 . 0 0 "[ . 1 . 2 .]" 1
663 1 20 GLU H 1 20 GLU HA 2.800 . 3.800 2.943 2.941 2.944 . 0 0 "[ . 1 . 2 .]" 1
664 1 20 GLU H 1 20 GLU HB2 2.500 . 3.300 2.279 2.267 2.289 . 0 0 "[ . 1 . 2 .]" 1
665 1 20 GLU H 1 20 GLU HB3 2.500 . 3.300 3.361 3.352 3.370 0.070 13 0 "[ . 1 . 2 .]" 1
666 1 20 GLU H 1 20 GLU HG2 3.000 . 4.100 4.117 4.113 4.121 0.021 17 0 "[ . 1 . 2 .]" 1
667 1 20 GLU H 1 20 GLU HG3 2.900 . 3.900 3.920 3.916 3.923 0.023 9 0 "[ . 1 . 2 .]" 1
668 1 20 GLU H 1 21 LYS H 3.600 . 5.200 4.489 4.461 4.507 . 0 0 "[ . 1 . 2 .]" 1
669 1 20 GLU H 1 23 GLU H 3.600 . 5.300 4.031 3.959 4.118 . 0 0 "[ . 1 . 2 .]" 1
670 1 20 GLU H 1 23 GLU HB2 3.500 . 5.000 2.093 2.028 2.165 . 0 0 "[ . 1 . 2 .]" 1
671 1 20 GLU H 1 23 GLU HB3 2.900 . 3.900 2.763 2.648 2.838 . 0 0 "[ . 1 . 2 .]" 1
672 1 20 GLU H 1 23 GLU HG2 3.000 . 4.100 2.098 2.061 2.137 . 0 0 "[ . 1 . 2 .]" 1
673 1 20 GLU H 1 23 GLU HG3 2.200 . 2.800 2.876 2.867 2.885 0.085 7 0 "[ . 1 . 2 .]" 1
674 1 20 GLU H 1 25 LEU MD1 6.000 4.600 7.400 5.430 5.348 5.473 . 0 0 "[ . 1 . 2 .]" 1
675 1 20 GLU H 1 25 LEU MD2 3.100 . 4.300 4.309 4.271 4.329 0.029 3 0 "[ . 1 . 2 .]" 1
676 1 20 GLU HB2 1 20 GLU HG2 2.400 . 3.100 2.897 2.896 2.899 . 0 0 "[ . 1 . 2 .]" 1
677 1 20 GLU HB2 1 20 GLU HG3 2.300 . 3.000 2.216 2.214 2.218 . 0 0 "[ . 1 . 2 .]" 1
678 1 20 GLU HB2 1 21 LYS H 3.200 . 4.500 3.826 3.749 3.882 . 0 0 "[ . 1 . 2 .]" 1
679 1 20 GLU HB2 1 23 GLU H 4.100 . 6.000 4.349 4.238 4.473 . 0 0 "[ . 1 . 2 .]" 1
680 1 20 GLU HB2 1 23 GLU HB2 3.100 . 4.300 2.867 2.743 2.953 . 0 0 "[ . 1 . 2 .]" 1
681 1 20 GLU HB2 1 23 GLU HB3 3.800 . 5.600 4.316 4.196 4.386 . 0 0 "[ . 1 . 2 .]" 1
682 1 20 GLU HB2 1 23 GLU HG2 3.100 . 4.300 2.396 2.328 2.453 . 0 0 "[ . 1 . 2 .]" 1
683 1 20 GLU HB3 1 20 GLU HG2 2.300 . 3.000 2.757 2.753 2.759 . 0 0 "[ . 1 . 2 .]" 1
684 1 20 GLU HB3 1 20 GLU HG3 2.300 . 2.900 2.893 2.891 2.896 . 0 0 "[ . 1 . 2 .]" 1
685 1 20 GLU HB3 1 21 LYS H 2.600 . 3.500 2.410 2.294 2.495 . 0 0 "[ . 1 . 2 .]" 1
686 1 20 GLU HB3 1 23 GLU H 4.500 . 6.000 3.763 3.642 3.892 . 0 0 "[ . 1 . 2 .]" 1
687 1 20 GLU QG 1 21 LYS H 3.400 . 4.800 3.115 3.092 3.131 . 0 0 "[ . 1 . 2 .]" 1
688 1 20 GLU HG2 1 21 LYS H 3.600 . 5.200 3.185 3.159 3.202 . 0 0 "[ . 1 . 2 .]" 1
689 1 20 GLU HG3 1 21 LYS H 3.900 . 5.800 4.405 4.367 4.440 . 0 0 "[ . 1 . 2 .]" 1
690 1 21 LYS H 1 21 LYS HA 2.700 . 3.600 2.861 2.850 2.872 . 0 0 "[ . 1 . 2 .]" 1
691 1 21 LYS H 1 21 LYS HB2 2.400 . 3.100 2.886 2.822 2.939 . 0 0 "[ . 1 . 2 .]" 1
692 1 21 LYS H 1 21 LYS HB3 2.100 . 2.700 2.243 2.204 2.301 . 0 0 "[ . 1 . 2 .]" 1
693 1 21 LYS H 1 21 LYS HD2 4.300 . 6.000 4.530 4.217 5.351 . 0 0 "[ . 1 . 2 .]" 1
694 1 21 LYS H 1 21 LYS HG2 4.200 . 6.000 4.216 4.174 4.259 . 0 0 "[ . 1 . 2 .]" 1
695 1 21 LYS H 1 21 LYS HG3 3.900 . 5.800 4.635 4.597 4.651 . 0 0 "[ . 1 . 2 .]" 1
696 1 21 LYS H 1 22 GLY H 3.700 . 5.400 4.530 4.511 4.561 . 0 0 "[ . 1 . 2 .]" 1
697 1 21 LYS HA 1 21 LYS HB2 2.100 . 2.700 2.333 2.315 2.358 . 0 0 "[ . 1 . 2 .]" 1
698 1 21 LYS HA 1 21 LYS HB3 2.500 . 3.300 2.995 2.987 3.005 . 0 0 "[ . 1 . 2 .]" 1
699 1 21 LYS HA 1 21 LYS HD2 4.100 . 6.000 4.627 4.542 4.713 . 0 0 "[ . 1 . 2 .]" 1
700 1 21 LYS HA 1 21 LYS HD3 3.600 . 5.300 4.982 4.618 5.113 . 0 0 "[ . 1 . 2 .]" 1
701 1 21 LYS HA 1 21 LYS HG2 2.400 . 3.100 3.134 3.117 3.152 0.052 21 0 "[ . 1 . 2 .]" 1
702 1 21 LYS HA 1 21 LYS HG3 2.600 . 3.500 2.994 2.833 3.084 . 0 0 "[ . 1 . 2 .]" 1
703 1 21 LYS HA 1 22 GLY H 2.000 . 2.500 2.159 2.145 2.190 . 0 0 "[ . 1 . 2 .]" 1
704 1 21 LYS HA 1 22 GLY HA2 3.800 . 5.600 4.422 4.410 4.444 . 0 0 "[ . 1 . 2 .]" 1
705 1 21 LYS HA 1 23 GLU H 3.000 . 4.100 3.278 3.203 3.336 . 0 0 "[ . 1 . 2 .]" 1
706 1 21 LYS QB 1 21 LYS HG3 2.300 . 3.000 2.234 2.215 2.274 . 0 0 "[ . 1 . 2 .]" 1
707 1 21 LYS HB2 1 21 LYS HE2 3.800 . 5.600 3.408 2.465 4.644 . 0 0 "[ . 1 . 2 .]" 1
708 1 21 LYS HB2 1 22 GLY H 3.100 . 4.300 4.037 3.960 4.085 . 0 0 "[ . 1 . 2 .]" 1
709 1 21 LYS HB3 1 21 LYS HE2 3.600 . 5.200 3.890 3.299 4.514 . 0 0 "[ . 1 . 2 .]" 1
710 1 21 LYS HB3 1 22 GLY H 3.700 . 5.400 4.336 4.284 4.372 . 0 0 "[ . 1 . 2 .]" 1
711 1 21 LYS QD 1 21 LYS HE2 2.200 . 2.800 2.474 2.356 2.531 . 0 0 "[ . 1 . 2 .]" 1
712 1 21 LYS QD 1 21 LYS HG3 2.000 . 2.500 2.420 2.211 2.522 0.022 18 0 "[ . 1 . 2 .]" 1
713 1 21 LYS HD2 1 21 LYS HE2 2.400 . 3.100 2.879 2.459 3.012 . 0 0 "[ . 1 . 2 .]" 1
714 1 21 LYS HD2 1 21 LYS HG2 2.500 . 3.300 2.729 2.485 3.007 . 0 0 "[ . 1 . 2 .]" 1
715 1 21 LYS HD2 1 21 LYS HG3 2.600 . 3.400 2.812 2.281 3.012 . 0 0 "[ . 1 . 2 .]" 1
716 1 21 LYS HD2 1 22 GLY H 3.700 . 5.400 5.434 5.422 5.452 0.052 24 0 "[ . 1 . 2 .]" 1
717 1 21 LYS HD3 1 21 LYS HE2 2.400 . 3.100 2.737 2.492 3.016 . 0 0 "[ . 1 . 2 .]" 1
718 1 21 LYS HD3 1 21 LYS HG2 2.500 . 3.300 2.348 2.221 2.645 . 0 0 "[ . 1 . 2 .]" 1
719 1 21 LYS HD3 1 21 LYS HG3 2.300 . 3.000 2.735 2.491 3.010 0.010 25 0 "[ . 1 . 2 .]" 1
720 1 21 LYS HE2 1 21 LYS HG2 2.700 . 3.600 3.187 2.083 3.575 . 0 0 "[ . 1 . 2 .]" 1
721 1 21 LYS HE2 1 21 LYS HG3 2.400 . 3.100 2.292 1.975 3.020 . 0 0 "[ . 1 . 2 .]" 1
722 1 21 LYS HG2 1 22 GLY H 2.800 . 3.800 3.017 2.867 3.093 . 0 0 "[ . 1 . 2 .]" 1
723 1 21 LYS HG3 1 22 GLY H 2.900 . 3.900 3.371 3.193 3.478 . 0 0 "[ . 1 . 2 .]" 1
724 1 21 LYS HG3 1 22 GLY HA2 3.400 . 4.800 4.795 4.697 4.825 0.025 3 0 "[ . 1 . 2 .]" 1
725 1 21 LYS HG3 1 22 GLY HA3 3.900 . 5.800 4.728 4.687 4.785 . 0 0 "[ . 1 . 2 .]" 1
726 1 22 GLY H 1 22 GLY HA2 2.200 . 2.800 2.342 2.329 2.351 . 0 0 "[ . 1 . 2 .]" 1
727 1 22 GLY H 1 22 GLY HA3 2.400 . 3.100 2.910 2.892 2.920 . 0 0 "[ . 1 . 2 .]" 1
728 1 22 GLY H 1 23 GLU H 2.500 . 3.300 2.645 2.613 2.673 . 0 0 "[ . 1 . 2 .]" 1
729 1 22 GLY HA2 1 23 GLU H 2.900 . 4.000 3.383 3.348 3.415 . 0 0 "[ . 1 . 2 .]" 1
730 1 22 GLY HA3 1 23 GLU H 2.700 . 3.600 3.166 3.113 3.223 . 0 0 "[ . 1 . 2 .]" 1
731 1 23 GLU H 1 23 GLU HA 2.500 . 3.300 2.778 2.762 2.794 . 0 0 "[ . 1 . 2 .]" 1
732 1 23 GLU H 1 23 GLU HB2 2.100 . 2.700 2.096 2.093 2.100 . 0 0 "[ . 1 . 2 .]" 1
733 1 23 GLU H 1 23 GLU HB3 2.400 . 3.100 2.989 2.971 3.005 . 0 0 "[ . 1 . 2 .]" 1
734 1 23 GLU H 1 23 GLU HG2 3.000 . 4.100 4.127 4.118 4.137 0.037 22 0 "[ . 1 . 2 .]" 1
735 1 23 GLU H 1 24 GLN H 6.000 . 7.000 4.607 4.598 4.615 . 0 0 "[ . 1 . 2 .]" 1
736 1 23 GLU HA 1 23 GLU HB2 2.500 . 3.300 2.715 2.705 2.720 . 0 0 "[ . 1 . 2 .]" 1
737 1 23 GLU HA 1 23 GLU HB3 2.500 . 3.300 2.959 2.958 2.962 . 0 0 "[ . 1 . 2 .]" 1
738 1 23 GLU HA 1 23 GLU HG2 2.500 . 3.300 3.310 3.307 3.323 0.023 3 0 "[ . 1 . 2 .]" 1
739 1 23 GLU HA 1 23 GLU HG3 2.600 . 3.400 3.428 3.421 3.432 0.032 17 0 "[ . 1 . 2 .]" 1
740 1 23 GLU HA 1 24 GLN H 1.900 . 2.400 2.421 2.417 2.424 0.024 14 0 "[ . 1 . 2 .]" 1
741 1 23 GLU HA 1 24 GLN HA 4.100 . 6.000 4.408 4.403 4.412 . 0 0 "[ . 1 . 2 .]" 1
742 1 23 GLU HA 1 24 GLN HB2 5.100 3.900 6.300 4.848 4.825 4.878 . 0 0 "[ . 1 . 2 .]" 1
743 1 23 GLU HA 1 24 GLN QB 4.700 3.600 5.800 4.572 4.556 4.593 . 0 0 "[ . 1 . 2 .]" 1
744 1 23 GLU HA 1 24 GLN HG3 3.400 . 4.900 3.167 3.156 3.184 . 0 0 "[ . 1 . 2 .]" 1
745 1 23 GLU HB2 1 23 GLU HG2 2.400 . 3.100 2.188 2.186 2.190 . 0 0 "[ . 1 . 2 .]" 1
746 1 23 GLU HB2 1 23 GLU HG3 3.600 2.600 4.600 2.827 2.824 2.837 . 0 0 "[ . 1 . 2 .]" 1
747 1 23 GLU HB2 1 24 GLN H 3.600 2.600 4.600 3.989 3.975 3.991 . 0 0 "[ . 1 . 2 .]" 1
748 1 23 GLU HB2 1 25 LEU MD1 4.300 . 6.000 5.305 5.276 5.338 . 0 0 "[ . 1 . 2 .]" 1
749 1 23 GLU HB2 1 25 LEU MD2 3.500 . 5.000 4.689 4.658 4.787 . 0 0 "[ . 1 . 2 .]" 1
750 1 23 GLU HB2 1 25 LEU HG 4.600 . 6.000 5.449 5.421 5.480 . 0 0 "[ . 1 . 2 .]" 1
751 1 23 GLU HB3 1 23 GLU HG2 2.300 . 3.000 2.778 2.764 2.781 . 0 0 "[ . 1 . 2 .]" 1
752 1 23 GLU HB3 1 23 GLU HG3 1.800 . 2.200 2.191 2.189 2.193 . 0 0 "[ . 1 . 2 .]" 1
753 1 23 GLU HB3 1 24 GLN H 2.300 . 3.000 3.060 3.055 3.067 0.067 7 0 "[ . 1 . 2 .]" 1
754 1 23 GLU HB3 1 25 LEU MD1 3.600 . 5.200 3.946 3.929 3.968 . 0 0 "[ . 1 . 2 .]" 1
755 1 23 GLU HB3 1 25 LEU MD2 3.300 . 4.700 3.352 3.317 3.497 . 0 0 "[ . 1 . 2 .]" 1
756 1 23 GLU HB3 1 25 LEU HG 4.800 . 6.000 3.697 3.669 3.727 . 0 0 "[ . 1 . 2 .]" 1
757 1 23 GLU HG2 1 24 GLN H 3.500 2.600 4.400 3.941 3.909 3.948 . 0 0 "[ . 1 . 2 .]" 1
758 1 23 GLU HG2 1 25 LEU MD1 4.400 . 6.000 6.018 6.012 6.028 0.028 17 0 "[ . 1 . 2 .]" 1
759 1 23 GLU HG2 1 25 LEU MD2 3.200 . 4.500 4.560 4.550 4.568 0.068 5 0 "[ . 1 . 2 .]" 1
760 1 23 GLU HG2 1 41 THR HB 3.700 . 5.400 5.392 5.204 5.408 0.008 17 0 "[ . 1 . 2 .]" 1
761 1 23 GLU HG2 1 41 THR MG 3.900 . 5.800 5.449 5.352 5.474 . 0 0 "[ . 1 . 2 .]" 1
762 1 23 GLU HG3 1 24 GLN H 2.300 . 2.900 2.905 2.849 2.913 0.013 16 0 "[ . 1 . 2 .]" 1
763 1 23 GLU HG3 1 25 LEU MD1 3.800 . 5.600 4.941 4.918 4.957 . 0 0 "[ . 1 . 2 .]" 1
764 1 23 GLU HG3 1 25 LEU MD2 2.800 . 3.800 3.263 3.221 3.289 . 0 0 "[ . 1 . 2 .]" 1
765 1 23 GLU HG3 1 25 LEU HG 3.300 . 4.700 4.293 4.248 4.316 . 0 0 "[ . 1 . 2 .]" 1
766 1 23 GLU HG3 1 41 THR HB 4.000 . 6.000 5.044 4.921 5.082 . 0 0 "[ . 1 . 2 .]" 1
767 1 23 GLU HG3 1 41 THR MG 4.000 . 6.000 5.540 5.484 5.570 . 0 0 "[ . 1 . 2 .]" 1
768 1 24 GLN H 1 24 GLN HA 2.600 . 3.500 2.940 2.939 2.941 . 0 0 "[ . 1 . 2 .]" 1
769 1 24 GLN H 1 24 GLN HB2 2.500 . 3.000 2.842 2.833 2.852 . 0 0 "[ . 1 . 2 .]" 1
770 1 24 GLN H 1 24 GLN HG2 3.100 . 4.300 4.094 4.068 4.118 . 0 0 "[ . 1 . 2 .]" 1
771 1 24 GLN H 1 24 GLN HG3 3.000 . 4.100 2.635 2.603 2.667 . 0 0 "[ . 1 . 2 .]" 1
772 1 24 GLN H 1 25 LEU H 3.700 . 5.400 4.409 4.399 4.418 . 0 0 "[ . 1 . 2 .]" 1
773 1 24 GLN H 1 40 LEU MD1 3.200 . 4.500 4.501 4.477 4.506 0.006 2 0 "[ . 1 . 2 .]" 1
774 1 24 GLN HA 1 24 GLN HB2 2.300 . 3.000 3.002 3.000 3.003 0.003 8 0 "[ . 1 . 2 .]" 1
775 1 24 GLN HA 1 24 GLN HB3 2.700 . 3.600 2.355 2.350 2.360 . 0 0 "[ . 1 . 2 .]" 1
776 1 24 GLN HA 1 24 GLN HG2 2.600 . 3.500 3.066 3.040 3.088 . 0 0 "[ . 1 . 2 .]" 1
777 1 24 GLN HA 1 24 GLN HG3 2.700 . 3.600 2.848 2.838 2.861 . 0 0 "[ . 1 . 2 .]" 1
778 1 24 GLN HA 1 25 LEU H 2.000 . 2.500 2.176 2.166 2.192 . 0 0 "[ . 1 . 2 .]" 1
779 1 24 GLN HA 1 25 LEU MD1 3.600 . 5.200 4.051 4.022 4.073 . 0 0 "[ . 1 . 2 .]" 1
780 1 24 GLN HA 1 25 LEU MD2 3.900 . 5.800 4.494 4.480 4.510 . 0 0 "[ . 1 . 2 .]" 1
781 1 24 GLN HB2 1 24 GLN HE21 3.900 . 5.800 2.876 2.231 3.501 . 0 0 "[ . 1 . 2 .]" 1
782 1 24 GLN HB2 1 24 GLN HE22 4.000 . 6.000 3.651 3.349 3.965 . 0 0 "[ . 1 . 2 .]" 1
783 1 24 GLN HB2 1 24 GLN HG2 2.500 . 3.300 2.929 2.923 2.936 . 0 0 "[ . 1 . 2 .]" 1
784 1 24 GLN HB2 1 24 GLN HG3 2.200 . 2.800 2.706 2.695 2.714 . 0 0 "[ . 1 . 2 .]" 1
785 1 24 GLN HB2 1 25 LEU H 2.700 . 3.600 3.666 3.648 3.682 0.082 10 0 "[ . 1 . 2 .]" 1
786 1 24 GLN HB2 1 40 LEU H 4.600 . 6.000 4.323 4.297 4.344 . 0 0 "[ . 1 . 2 .]" 1
787 1 24 GLN HB2 1 40 LEU HB3 2.600 . 4.400 4.418 4.411 4.428 0.028 21 0 "[ . 1 . 2 .]" 1
788 1 24 GLN HB2 1 40 LEU MD1 2.200 . 2.800 2.628 2.607 2.664 . 0 0 "[ . 1 . 2 .]" 1
789 1 24 GLN HB3 1 24 GLN HE21 3.900 . 5.800 2.714 2.385 3.125 . 0 0 "[ . 1 . 2 .]" 1
790 1 24 GLN HB3 1 24 GLN HE22 3.700 . 5.500 4.128 3.984 4.306 . 0 0 "[ . 1 . 2 .]" 1
791 1 24 GLN HB3 1 24 GLN HG2 1.800 . 2.200 2.234 2.230 2.238 0.038 7 0 "[ . 1 . 2 .]" 1
792 1 24 GLN HB3 1 24 GLN HG3 2.800 2.400 3.200 2.925 2.920 2.929 . 0 0 "[ . 1 . 2 .]" 1
793 1 24 GLN HB3 1 25 LEU H 3.300 . 4.600 2.798 2.769 2.824 . 0 0 "[ . 1 . 2 .]" 1
794 1 24 GLN HB3 1 40 LEU H 3.800 . 5.600 5.616 5.611 5.622 0.022 3 0 "[ . 1 . 2 .]" 1
795 1 24 GLN HE21 1 24 GLN HG2 3.100 . 4.300 2.497 2.223 2.796 . 0 0 "[ . 1 . 2 .]" 1
796 1 24 GLN HE21 1 24 GLN HG3 2.800 . 3.800 3.519 3.454 3.552 . 0 0 "[ . 1 . 2 .]" 1
797 1 24 GLN HE21 1 56 ALA MB 3.700 . 4.800 3.793 3.290 4.350 . 0 0 "[ . 1 . 2 .]" 1
798 1 24 GLN HE22 1 24 GLN HG2 3.600 . 5.200 3.594 3.479 3.725 . 0 0 "[ . 1 . 2 .]" 1
799 1 24 GLN HE22 1 24 GLN HG3 3.600 . 5.200 4.082 4.048 4.101 . 0 0 "[ . 1 . 2 .]" 1
800 1 24 GLN HE22 1 56 ALA MB 5.100 . 6.000 4.853 4.596 5.145 . 0 0 "[ . 1 . 2 .]" 1
801 1 24 GLN HG2 1 25 LEU H 3.400 . 4.800 4.550 4.511 4.583 . 0 0 "[ . 1 . 2 .]" 1
802 1 24 GLN HG3 1 25 LEU H 3.300 . 4.700 4.755 4.747 4.763 0.063 21 0 "[ . 1 . 2 .]" 1
803 1 24 GLN HG3 1 56 ALA MB 6.000 . 7.000 4.544 4.474 4.587 . 0 0 "[ . 1 . 2 .]" 1
804 1 25 LEU H 1 25 LEU HA 2.800 . 3.800 2.915 2.913 2.917 . 0 0 "[ . 1 . 2 .]" 1
805 1 25 LEU H 1 25 LEU HB2 2.500 . 3.300 3.156 3.139 3.171 . 0 0 "[ . 1 . 2 .]" 1
806 1 25 LEU H 1 25 LEU HB3 3.500 2.600 4.400 3.952 3.944 3.961 . 0 0 "[ . 1 . 2 .]" 1
807 1 25 LEU H 1 25 LEU MD1 3.500 . 5.000 3.506 3.464 3.543 . 0 0 "[ . 1 . 2 .]" 1
808 1 25 LEU H 1 25 LEU MD2 4.200 . 6.000 4.086 4.062 4.110 . 0 0 "[ . 1 . 2 .]" 1
809 1 25 LEU H 1 25 LEU HG 2.700 . 3.600 2.710 2.687 2.742 . 0 0 "[ . 1 . 2 .]" 1
810 1 25 LEU H 1 53 VAL MG1 4.300 . 6.000 4.365 4.214 4.497 . 0 0 "[ . 1 . 2 .]" 1
811 1 25 LEU HA 1 25 LEU HB2 3.000 . 4.100 2.961 2.959 2.964 . 0 0 "[ . 1 . 2 .]" 1
812 1 25 LEU HA 1 25 LEU HB3 2.200 . 2.800 2.280 2.277 2.285 . 0 0 "[ . 1 . 2 .]" 1
813 1 25 LEU HA 1 25 LEU MD1 3.700 . 5.400 4.021 4.017 4.028 . 0 0 "[ . 1 . 2 .]" 1
814 1 25 LEU HA 1 25 LEU MD2 2.400 . 3.100 2.871 2.822 3.028 . 0 0 "[ . 1 . 2 .]" 1
815 1 25 LEU HA 1 25 LEU HG 2.900 . 3.900 3.107 3.097 3.115 . 0 0 "[ . 1 . 2 .]" 1
816 1 25 LEU HA 1 26 ARG H 2.100 . 2.600 2.126 2.119 2.133 . 0 0 "[ . 1 . 2 .]" 1
817 1 25 LEU HA 1 38 GLN H 3.100 . 4.300 4.351 4.343 4.360 0.060 24 0 "[ . 1 . 2 .]" 1
818 1 25 LEU HA 1 39 SER H 5.300 . 6.000 4.264 4.232 4.315 . 0 0 "[ . 1 . 2 .]" 1
819 1 25 LEU HA 1 40 LEU H 2.600 . 3.500 3.516 3.505 3.523 0.023 15 0 "[ . 1 . 2 .]" 1
820 1 25 LEU HA 1 40 LEU MD1 2.900 . 3.900 1.929 1.918 1.951 . 0 0 "[ . 1 . 2 .]" 1
821 1 25 LEU HA 1 40 LEU HG 3.100 . 4.300 4.261 4.238 4.298 . 0 0 "[ . 1 . 2 .]" 1
822 1 25 LEU HB2 1 25 LEU MD1 2.400 . 3.100 1.932 1.929 1.937 . 0 0 "[ . 1 . 2 .]" 1
823 1 25 LEU HB2 1 26 ARG H 2.800 . 3.800 3.813 3.804 3.830 0.030 15 0 "[ . 1 . 2 .]" 1
824 1 25 LEU HB2 1 38 GLN H 3.100 . 4.300 4.204 4.173 4.249 . 0 0 "[ . 1 . 2 .]" 1
825 1 25 LEU HB3 1 25 LEU MD1 2.300 . 3.000 2.815 2.805 2.829 . 0 0 "[ . 1 . 2 .]" 1
826 1 25 LEU HB3 1 25 LEU MD2 2.200 . 2.800 2.133 1.961 2.145 . 0 0 "[ . 1 . 2 .]" 1
827 1 25 LEU HB3 1 26 ARG H 2.700 . 3.600 3.319 3.306 3.332 . 0 0 "[ . 1 . 2 .]" 1
828 1 25 LEU HB3 1 38 GLN H 3.300 . 4.700 3.643 3.627 3.658 . 0 0 "[ . 1 . 2 .]" 1
829 1 25 LEU MD1 1 25 LEU MD2 2.200 . 2.800 2.038 2.010 2.057 . 0 0 "[ . 1 . 2 .]" 1
830 1 25 LEU MD1 1 27 ILE H 3.700 . 5.400 5.478 5.459 5.488 0.088 17 0 "[ . 1 . 2 .]" 1
831 1 25 LEU MD1 1 27 ILE MD 3.400 . 4.800 2.966 2.924 3.020 . 0 0 "[ . 1 . 2 .]" 1
832 1 25 LEU MD1 1 37 ALA MB 2.800 . 3.800 2.503 2.466 2.536 . 0 0 "[ . 1 . 2 .]" 1
833 1 25 LEU MD1 1 48 ILE HB 2.700 . 3.600 3.411 3.359 3.469 . 0 0 "[ . 1 . 2 .]" 1
834 1 25 LEU MD1 1 48 ILE MD 2.300 . 3.000 1.921 1.806 2.018 . 0 0 "[ . 1 . 2 .]" 1
835 1 25 LEU MD1 1 48 ILE MG 2.800 . 3.800 2.348 2.241 2.452 . 0 0 "[ . 1 . 2 .]" 1
836 1 25 LEU MD1 1 53 VAL HB 4.200 . 6.000 3.571 3.391 3.698 . 0 0 "[ . 1 . 2 .]" 1
837 1 25 LEU MD1 1 53 VAL MG1 2.300 . 2.900 1.780 1.690 1.857 0.010 22 0 "[ . 1 . 2 .]" 1
838 1 25 LEU MD1 1 53 VAL MG2 3.400 . 4.800 3.160 2.916 3.435 . 0 0 "[ . 1 . 2 .]" 1
839 1 25 LEU MD2 1 26 ARG H 3.200 . 4.500 4.443 4.397 4.500 0.000 3 0 "[ . 1 . 2 .]" 1
840 1 25 LEU MD2 1 37 ALA MB 2.100 . 2.700 2.798 2.793 2.809 0.109 13 0 "[ . 1 . 2 .]" 1
841 1 25 LEU MD2 1 39 SER H 2.900 . 4.000 3.596 3.532 3.623 . 0 0 "[ . 1 . 2 .]" 1
842 1 25 LEU MD2 1 39 SER HA 3.900 . 5.800 2.316 2.262 2.562 . 0 0 "[ . 1 . 2 .]" 1
843 1 25 LEU MD2 1 39 SER HB2 2.700 . 3.600 3.615 3.611 3.622 0.022 3 0 "[ . 1 . 2 .]" 1
844 1 25 LEU MD2 1 39 SER HB3 2.900 . 4.000 3.945 3.925 3.989 . 0 0 "[ . 1 . 2 .]" 1
845 1 25 LEU MD2 1 40 LEU H 2.900 . 3.900 3.961 3.947 3.998 0.098 3 0 "[ . 1 . 2 .]" 1
846 1 25 LEU MD2 1 41 THR H 4.600 . 6.000 5.127 5.102 5.153 . 0 0 "[ . 1 . 2 .]" 1
847 1 25 LEU MD2 1 48 ILE HB 3.300 . 4.700 4.731 4.722 4.746 0.046 3 0 "[ . 1 . 2 .]" 1
848 1 25 LEU MD2 1 48 ILE MG 2.500 . 3.300 2.816 2.739 2.973 . 0 0 "[ . 1 . 2 .]" 1
849 1 26 ARG H 1 26 ARG HA 2.800 . 3.800 2.867 2.862 2.869 . 0 0 "[ . 1 . 2 .]" 1
850 1 26 ARG H 1 26 ARG HB2 2.300 . 3.000 2.833 2.825 2.838 . 0 0 "[ . 1 . 2 .]" 1
851 1 26 ARG H 1 26 ARG HB3 2.600 . 3.400 2.283 2.268 2.299 . 0 0 "[ . 1 . 2 .]" 1
852 1 26 ARG H 1 26 ARG HD2 4.200 . 6.000 4.829 4.795 4.869 . 0 0 "[ . 1 . 2 .]" 1
853 1 26 ARG H 1 26 ARG QD 4.600 . 6.000 4.372 4.349 4.388 . 0 0 "[ . 1 . 2 .]" 1
854 1 26 ARG H 1 26 ARG HD3 5.300 . 6.000 4.995 4.935 5.052 . 0 0 "[ . 1 . 2 .]" 1
855 1 26 ARG H 1 26 ARG HG2 3.200 . 4.500 4.190 4.178 4.202 . 0 0 "[ . 1 . 2 .]" 1
856 1 26 ARG H 1 26 ARG HG3 3.200 . 4.400 4.485 4.477 4.491 0.091 12 0 "[ . 1 . 2 .]" 1
857 1 26 ARG H 1 27 ILE H 3.300 . 4.600 4.215 4.185 4.227 . 0 0 "[ . 1 . 2 .]" 1
858 1 26 ARG H 1 27 ILE MD 4.000 . 6.000 4.960 4.877 5.055 . 0 0 "[ . 1 . 2 .]" 1
859 1 26 ARG H 1 37 ALA HA 3.600 . 5.200 4.817 4.787 4.854 . 0 0 "[ . 1 . 2 .]" 1
860 1 26 ARG H 1 37 ALA MB 2.800 . 3.800 3.862 3.857 3.868 0.068 7 0 "[ . 1 . 2 .]" 1
861 1 26 ARG H 1 38 GLN H 2.400 . 3.100 3.095 3.081 3.106 0.006 23 0 "[ . 1 . 2 .]" 1
862 1 26 ARG H 1 38 GLN HB3 3.800 . 5.700 3.669 3.634 3.698 . 0 0 "[ . 1 . 2 .]" 1
863 1 26 ARG H 1 39 SER HA 4.500 . 6.000 3.366 3.326 3.439 . 0 0 "[ . 1 . 2 .]" 1
864 1 26 ARG H 1 40 LEU MD1 2.800 . 3.800 1.844 1.826 1.856 . 0 0 "[ . 1 . 2 .]" 1
865 1 26 ARG H 1 40 LEU HG 3.400 . 4.800 3.412 3.392 3.442 . 0 0 "[ . 1 . 2 .]" 1
866 1 26 ARG HA 1 26 ARG HB2 2.700 . 3.600 2.364 2.360 2.366 . 0 0 "[ . 1 . 2 .]" 1
867 1 26 ARG HA 1 26 ARG HG2 2.800 . 3.800 3.319 3.287 3.333 . 0 0 "[ . 1 . 2 .]" 1
868 1 26 ARG HA 1 26 ARG HG3 2.600 . 3.500 2.634 2.613 2.657 . 0 0 "[ . 1 . 2 .]" 1
869 1 26 ARG HA 1 27 ILE H 2.000 . 2.500 2.130 2.123 2.138 . 0 0 "[ . 1 . 2 .]" 1
870 1 26 ARG HB2 1 26 ARG HD2 2.600 . 3.400 2.274 2.235 2.326 . 0 0 "[ . 1 . 2 .]" 1
871 1 26 ARG HB2 1 26 ARG HE 3.500 . 5.000 4.085 4.002 4.153 . 0 0 "[ . 1 . 2 .]" 1
872 1 26 ARG HB2 1 26 ARG HG2 2.400 . 3.100 2.992 2.990 2.994 . 0 0 "[ . 1 . 2 .]" 1
873 1 26 ARG HB2 1 27 ILE H 3.500 2.500 4.500 4.338 4.330 4.349 . 0 0 "[ . 1 . 2 .]" 1
874 1 26 ARG HB2 1 40 LEU MD2 2.400 . 3.100 2.549 2.510 2.575 . 0 0 "[ . 1 . 2 .]" 1
875 1 26 ARG HB3 1 26 ARG HD2 2.500 . 3.300 2.854 2.832 2.880 . 0 0 "[ . 1 . 2 .]" 1
876 1 26 ARG HB3 1 26 ARG HE 3.900 . 5.800 4.555 4.532 4.711 . 0 0 "[ . 1 . 2 .]" 1
877 1 26 ARG HB3 1 26 ARG HG2 2.200 . 2.800 2.391 2.378 2.406 . 0 0 "[ . 1 . 2 .]" 1
878 1 26 ARG HB3 1 28 LEU MD2 3.400 . 4.900 3.356 3.262 3.484 . 0 0 "[ . 1 . 2 .]" 1
879 1 26 ARG HB3 1 38 GLN H 3.100 . 4.300 3.372 3.350 3.391 . 0 0 "[ . 1 . 2 .]" 1
880 1 26 ARG HB3 1 40 LEU MD2 2.700 . 3.600 3.636 3.632 3.641 0.041 25 0 "[ . 1 . 2 .]" 1
881 1 26 ARG QD 1 26 ARG HE 2.500 . 3.300 2.439 2.225 2.464 . 0 0 "[ . 1 . 2 .]" 1
882 1 26 ARG HD2 1 26 ARG HE 2.700 . 3.600 2.631 2.311 2.673 . 0 0 "[ . 1 . 2 .]" 1
883 1 26 ARG HD2 1 26 ARG HG2 2.300 . 2.900 2.983 2.976 2.990 0.090 12 0 "[ . 1 . 2 .]" 1
884 1 26 ARG HD2 1 26 ARG HG3 2.400 . 3.100 2.564 2.532 2.590 . 0 0 "[ . 1 . 2 .]" 1
885 1 26 ARG HD2 1 27 ILE H 5.000 . 6.000 5.836 5.808 5.885 . 0 0 "[ . 1 . 2 .]" 1
886 1 26 ARG HD2 1 28 LEU MD2 4.000 3.000 5.000 4.534 4.471 4.591 . 0 0 "[ . 1 . 2 .]" 1
887 1 26 ARG HD2 1 38 GLN H 4.200 . 6.000 6.019 6.009 6.026 0.026 20 0 "[ . 1 . 2 .]" 1
888 1 26 ARG HD2 1 38 GLN HB3 6.000 4.700 7.300 4.690 4.684 4.695 0.016 5 0 "[ . 1 . 2 .]" 1
889 1 26 ARG HD2 1 38 GLN HE22 2.800 . 3.800 3.810 3.802 3.813 0.013 21 0 "[ . 1 . 2 .]" 1
890 1 26 ARG HD2 1 40 LEU MD2 3.200 . 4.500 3.122 3.066 3.162 . 0 0 "[ . 1 . 2 .]" 1
891 1 26 ARG HD3 1 26 ARG HE 2.800 . 3.800 2.895 2.886 2.922 . 0 0 "[ . 1 . 2 .]" 1
892 1 26 ARG HD3 1 26 ARG HG2 2.700 . 3.600 2.335 2.321 2.357 . 0 0 "[ . 1 . 2 .]" 1
893 1 26 ARG HD3 1 26 ARG HG3 2.700 . 3.600 2.990 2.983 2.996 . 0 0 "[ . 1 . 2 .]" 1
894 1 26 ARG HD3 1 28 LEU MD2 2.600 . 3.400 3.313 3.247 3.382 . 0 0 "[ . 1 . 2 .]" 1
895 1 26 ARG HD3 1 38 GLN H 4.900 . 6.000 5.294 5.219 5.363 . 0 0 "[ . 1 . 2 .]" 1
896 1 26 ARG HD3 1 38 GLN HB3 3.600 . 5.200 3.530 3.444 3.613 . 0 0 "[ . 1 . 2 .]" 1
897 1 26 ARG HD3 1 38 GLN HE22 2.800 . 3.800 2.686 2.620 2.742 . 0 0 "[ . 1 . 2 .]" 1
898 1 26 ARG HD3 1 40 LEU MD2 3.100 . 4.300 4.372 4.362 4.377 0.077 9 0 "[ . 1 . 2 .]" 1
899 1 26 ARG HE 1 26 ARG HG2 3.500 . 5.000 3.018 2.911 3.599 . 0 0 "[ . 1 . 2 .]" 1
900 1 26 ARG HE 1 26 ARG HG3 3.700 . 5.400 2.312 2.256 2.776 . 0 0 "[ . 1 . 2 .]" 1
901 1 26 ARG HG2 1 27 ILE H 2.800 . 3.800 3.909 3.899 3.922 0.122 21 0 "[ . 1 . 2 .]" 1
902 1 26 ARG HG2 1 38 GLN H 2.800 . 3.800 3.847 3.839 3.859 0.059 21 0 "[ . 1 . 2 .]" 1
903 1 26 ARG HG2 1 38 GLN HB3 3.100 . 4.300 3.209 3.198 3.233 . 0 0 "[ . 1 . 2 .]" 1
904 1 26 ARG HG3 1 27 ILE H 3.200 . 4.500 3.583 3.540 3.656 . 0 0 "[ . 1 . 2 .]" 1
905 1 26 ARG HG3 1 28 LEU MD2 3.000 . 4.200 3.931 3.849 4.034 . 0 0 "[ . 1 . 2 .]" 1
906 1 26 ARG HG3 1 38 GLN HB3 3.300 . 4.700 4.723 4.717 4.730 0.030 12 0 "[ . 1 . 2 .]" 1
907 1 26 ARG HG3 1 40 LEU MD2 3.800 2.800 5.800 4.433 4.363 4.476 . 0 0 "[ . 1 . 2 .]" 1
908 1 27 ILE H 1 27 ILE HA 2.600 . 3.400 2.777 2.762 2.785 . 0 0 "[ . 1 . 2 .]" 1
909 1 27 ILE H 1 27 ILE HB 2.300 . 3.000 2.677 2.657 2.696 . 0 0 "[ . 1 . 2 .]" 1
910 1 27 ILE H 1 27 ILE MD 2.600 . 3.400 3.036 2.929 3.124 . 0 0 "[ . 1 . 2 .]" 1
911 1 27 ILE H 1 27 ILE HG12 2.500 . 3.300 1.866 1.839 1.888 . 0 0 "[ . 1 . 2 .]" 1
912 1 27 ILE H 1 27 ILE HG13 3.500 2.800 4.200 3.424 3.394 3.455 . 0 0 "[ . 1 . 2 .]" 1
913 1 27 ILE H 1 27 ILE MG 2.800 . 3.800 3.753 3.748 3.758 . 0 0 "[ . 1 . 2 .]" 1
914 1 27 ILE H 1 28 LEU H 4.700 . 6.000 4.377 4.369 4.388 . 0 0 "[ . 1 . 2 .]" 1
915 1 27 ILE H 1 37 ALA HA 4.300 . 6.000 4.172 4.115 4.199 . 0 0 "[ . 1 . 2 .]" 1
916 1 27 ILE HA 1 27 ILE HB 2.900 . 4.000 3.019 3.017 3.023 . 0 0 "[ . 1 . 2 .]" 1
917 1 27 ILE HA 1 27 ILE MD 2.100 . 2.700 2.127 2.057 2.229 . 0 0 "[ . 1 . 2 .]" 1
918 1 27 ILE HA 1 27 ILE HG12 2.900 . 4.000 3.090 3.040 3.134 . 0 0 "[ . 1 . 2 .]" 1
919 1 27 ILE HA 1 27 ILE HG13 3.400 . 4.900 3.775 3.759 3.788 . 0 0 "[ . 1 . 2 .]" 1
920 1 27 ILE HA 1 27 ILE MG 2.300 . 3.000 2.335 2.295 2.364 . 0 0 "[ . 1 . 2 .]" 1
921 1 27 ILE HA 1 28 LEU H 2.000 . 2.500 2.075 2.069 2.086 . 0 0 "[ . 1 . 2 .]" 1
922 1 27 ILE HA 1 28 LEU MD1 3.400 . 4.900 4.981 4.969 4.990 0.090 19 0 "[ . 1 . 2 .]" 1
923 1 27 ILE HA 1 28 LEU HG 3.000 . 4.100 3.608 3.587 3.653 . 0 0 "[ . 1 . 2 .]" 1
924 1 27 ILE HA 1 29 GLU H 3.100 . 4.300 3.728 3.698 3.759 . 0 0 "[ . 1 . 2 .]" 1
925 1 27 ILE HA 1 37 ALA HA 2.200 . 2.800 1.910 1.877 1.930 . 0 0 "[ . 1 . 2 .]" 1
926 1 27 ILE HA 1 37 ALA MB 2.400 . 3.100 2.672 2.607 2.696 . 0 0 "[ . 1 . 2 .]" 1
927 1 27 ILE HA 1 38 GLN H 3.200 . 4.500 3.275 3.242 3.304 . 0 0 "[ . 1 . 2 .]" 1
928 1 27 ILE HA 1 48 ILE MD 5.200 . 6.000 4.473 4.366 4.598 . 0 0 "[ . 1 . 2 .]" 1
929 1 27 ILE HB 1 27 ILE MD 2.700 . 3.600 3.218 3.217 3.219 . 0 0 "[ . 1 . 2 .]" 1
930 1 27 ILE HB 1 27 ILE HG12 2.400 . 3.100 2.471 2.447 2.485 . 0 0 "[ . 1 . 2 .]" 1
931 1 27 ILE HB 1 27 ILE HG13 2.300 . 2.900 2.429 2.413 2.450 . 0 0 "[ . 1 . 2 .]" 1
932 1 27 ILE HB 1 27 ILE MG 2.100 . 2.700 2.088 2.084 2.094 . 0 0 "[ . 1 . 2 .]" 1
933 1 27 ILE HB 1 28 LEU H 3.700 . 5.400 4.268 4.244 4.278 . 0 0 "[ . 1 . 2 .]" 1
934 1 27 ILE HB 1 30 GLN HB3 3.300 . 4.700 4.470 4.242 4.714 0.014 10 0 "[ . 1 . 2 .]" 1
935 1 27 ILE HB 1 37 ALA HA 3.500 . 5.100 4.925 4.893 4.947 . 0 0 "[ . 1 . 2 .]" 1
936 1 27 ILE HB 1 37 ALA MB 3.800 . 5.600 4.846 4.797 4.873 . 0 0 "[ . 1 . 2 .]" 1
937 1 27 ILE MD 1 27 ILE HG12 2.200 . 2.800 2.070 2.067 2.076 . 0 0 "[ . 1 . 2 .]" 1
938 1 27 ILE MD 1 27 ILE HG13 2.100 . 2.600 2.075 2.074 2.079 . 0 0 "[ . 1 . 2 .]" 1
939 1 27 ILE MD 1 27 ILE MG 2.200 . 2.800 1.906 1.846 1.968 . 0 0 "[ . 1 . 2 .]" 1
940 1 27 ILE MD 1 28 LEU H 3.000 . 4.100 3.724 3.674 3.786 . 0 0 "[ . 1 . 2 .]" 1
941 1 27 ILE MD 1 29 GLU H 3.600 . 5.200 4.510 4.432 4.564 . 0 0 "[ . 1 . 2 .]" 1
942 1 27 ILE MD 1 35 TRP HB2 2.900 . 3.900 3.387 3.269 3.468 . 0 0 "[ . 1 . 2 .]" 1
943 1 27 ILE MD 1 35 TRP HB3 2.800 . 3.800 2.949 2.807 3.098 . 0 0 "[ . 1 . 2 .]" 1
944 1 27 ILE MD 1 35 TRP HE3 2.700 . 3.600 2.281 2.152 2.474 . 0 0 "[ . 1 . 2 .]" 1
945 1 27 ILE MD 1 35 TRP HZ3 3.300 . 4.600 3.765 3.655 3.938 . 0 0 "[ . 1 . 2 .]" 1
946 1 27 ILE MD 1 37 ALA H 3.100 . 4.300 4.233 4.171 4.301 0.001 19 0 "[ . 1 . 2 .]" 1
947 1 27 ILE MD 1 37 ALA HA 3.000 . 4.100 2.956 2.876 3.057 . 0 0 "[ . 1 . 2 .]" 1
948 1 27 ILE MD 1 37 ALA MB 2.400 . 3.100 2.018 1.958 2.054 . 0 0 "[ . 1 . 2 .]" 1
949 1 27 ILE MD 1 48 ILE MD 1.900 . 2.300 2.310 2.252 2.320 0.020 22 0 "[ . 1 . 2 .]" 1
950 1 27 ILE MD 1 48 ILE MG 4.800 3.800 5.800 4.416 4.339 4.487 . 0 0 "[ . 1 . 2 .]" 1
951 1 27 ILE HG12 1 27 ILE MG 2.300 . 3.000 3.164 3.162 3.166 0.166 6 0 "[ . 1 . 2 .]" 1
952 1 27 ILE HG12 1 35 TRP HE3 3.400 . 4.900 4.561 4.409 4.742 . 0 0 "[ . 1 . 2 .]" 1
953 1 27 ILE HG13 1 27 ILE MG 2.300 . 2.900 2.415 2.384 2.447 . 0 0 "[ . 1 . 2 .]" 1
954 1 27 ILE HG13 1 35 TRP HE3 2.900 . 4.000 3.126 2.986 3.303 . 0 0 "[ . 1 . 2 .]" 1
955 1 27 ILE HG13 1 35 TRP HZ3 3.400 . 4.900 3.610 3.408 3.865 . 0 0 "[ . 1 . 2 .]" 1
956 1 27 ILE MG 1 28 LEU H 2.600 . 3.400 2.767 2.706 2.803 . 0 0 "[ . 1 . 2 .]" 1
957 1 27 ILE MG 1 29 GLU H 2.500 . 3.300 2.554 2.484 2.615 . 0 0 "[ . 1 . 2 .]" 1
958 1 27 ILE MG 1 30 GLN H 3.900 . 5.800 3.617 3.392 3.858 . 0 0 "[ . 1 . 2 .]" 1
959 1 27 ILE MG 1 30 GLN HA 3.000 . 4.100 3.179 3.042 3.336 . 0 0 "[ . 1 . 2 .]" 1
960 1 27 ILE MG 1 30 GLN HB2 2.800 . 3.800 3.606 3.467 3.742 . 0 0 "[ . 1 . 2 .]" 1
961 1 27 ILE MG 1 30 GLN HB3 2.800 . 3.800 2.177 2.006 2.342 . 0 0 "[ . 1 . 2 .]" 1
962 1 27 ILE MG 1 30 GLN HE21 5.000 . 6.000 3.926 1.917 4.736 . 0 0 "[ . 1 . 2 .]" 1
963 1 27 ILE MG 1 30 GLN HE22 4.100 . 6.000 4.192 3.200 4.608 . 0 0 "[ . 1 . 2 .]" 1
964 1 27 ILE MG 1 30 GLN HG2 2.600 . 3.400 2.539 2.433 2.631 . 0 0 "[ . 1 . 2 .]" 1
965 1 27 ILE MG 1 30 GLN HG3 2.800 . 3.800 3.836 3.823 3.848 0.048 14 0 "[ . 1 . 2 .]" 1
966 1 27 ILE MG 1 35 TRP HA 3.600 . 5.200 4.208 4.140 4.281 . 0 0 "[ . 1 . 2 .]" 1
967 1 27 ILE MG 1 35 TRP HB2 2.700 . 3.600 3.653 3.644 3.661 0.061 5 0 "[ . 1 . 2 .]" 1
968 1 27 ILE MG 1 35 TRP HB3 2.500 . 3.300 2.391 2.342 2.439 . 0 0 "[ . 1 . 2 .]" 1
969 1 27 ILE MG 1 35 TRP HE3 2.700 . 3.600 2.679 2.524 2.844 . 0 0 "[ . 1 . 2 .]" 1
970 1 27 ILE MG 1 35 TRP HZ3 3.600 . 5.200 4.082 3.946 4.278 . 0 0 "[ . 1 . 2 .]" 1
971 1 27 ILE MG 1 36 LYS H 3.300 . 4.700 3.622 3.574 3.686 . 0 0 "[ . 1 . 2 .]" 1
972 1 27 ILE MG 1 37 ALA HA 4.300 3.100 5.500 3.546 3.495 3.610 . 0 0 "[ . 1 . 2 .]" 1
973 1 28 LEU H 1 28 LEU HA 2.600 . 3.400 2.883 2.881 2.884 . 0 0 "[ . 1 . 2 .]" 1
974 1 28 LEU H 1 28 LEU HB2 2.700 . 3.600 2.593 2.549 2.621 . 0 0 "[ . 1 . 2 .]" 1
975 1 28 LEU H 1 28 LEU HB3 3.700 2.900 4.500 3.577 3.574 3.582 . 0 0 "[ . 1 . 2 .]" 1
976 1 28 LEU H 1 28 LEU MD1 3.300 . 4.600 3.546 3.529 3.561 . 0 0 "[ . 1 . 2 .]" 1
977 1 28 LEU H 1 28 LEU QD 2.800 . 3.800 2.876 2.843 2.937 . 0 0 "[ . 1 . 2 .]" 1
978 1 28 LEU H 1 28 LEU MD2 3.400 . 4.900 3.042 2.988 3.140 . 0 0 "[ . 1 . 2 .]" 1
979 1 28 LEU H 1 28 LEU HG 2.000 . 2.900 2.022 1.992 2.079 . 0 0 "[ . 1 . 2 .]" 1
980 1 28 LEU H 1 29 GLU H 2.200 . 2.800 2.347 2.331 2.370 . 0 0 "[ . 1 . 2 .]" 1
981 1 28 LEU H 1 29 GLU HA 4.000 . 6.000 4.870 4.853 4.887 . 0 0 "[ . 1 . 2 .]" 1
982 1 28 LEU H 1 36 LYS H 4.700 . 6.000 4.707 4.659 4.771 . 0 0 "[ . 1 . 2 .]" 1
983 1 28 LEU H 1 36 LYS HB2 4.500 . 6.000 5.303 5.248 5.334 . 0 0 "[ . 1 . 2 .]" 1
984 1 28 LEU H 1 36 LYS HB3 3.900 . 5.800 3.861 3.793 3.914 . 0 0 "[ . 1 . 2 .]" 1
985 1 28 LEU H 1 36 LYS HD2 4.900 . 6.000 4.209 4.135 4.266 . 0 0 "[ . 1 . 2 .]" 1
986 1 28 LEU H 1 37 ALA H 4.500 . 6.000 4.253 4.205 4.295 . 0 0 "[ . 1 . 2 .]" 1
987 1 28 LEU H 1 37 ALA HA 2.400 . 3.100 2.117 2.053 2.147 . 0 0 "[ . 1 . 2 .]" 1
988 1 28 LEU H 1 37 ALA MB 3.000 . 4.200 3.739 3.686 3.763 . 0 0 "[ . 1 . 2 .]" 1
989 1 28 LEU H 1 38 GLN H 3.200 . 4.500 3.303 3.264 3.338 . 0 0 "[ . 1 . 2 .]" 1
990 1 28 LEU HA 1 28 LEU HB2 2.600 . 3.400 3.014 3.011 3.018 . 0 0 "[ . 1 . 2 .]" 1
991 1 28 LEU HA 1 28 LEU HB3 2.500 . 3.300 2.388 2.377 2.405 . 0 0 "[ . 1 . 2 .]" 1
992 1 28 LEU HA 1 28 LEU MD1 3.400 . 4.900 3.909 3.897 3.924 . 0 0 "[ . 1 . 2 .]" 1
993 1 28 LEU HA 1 28 LEU MD2 2.500 . 3.300 2.165 2.050 2.215 . 0 0 "[ . 1 . 2 .]" 1
994 1 28 LEU HA 1 28 LEU HG 2.500 . 3.300 3.290 3.239 3.311 0.011 9 0 "[ . 1 . 2 .]" 1
995 1 28 LEU HA 1 29 GLU H 3.000 . 4.100 3.511 3.504 3.518 . 0 0 "[ . 1 . 2 .]" 1
996 1 28 LEU HB2 1 28 LEU MD1 2.100 . 2.700 2.414 2.390 2.432 . 0 0 "[ . 1 . 2 .]" 1
997 1 28 LEU HB2 1 29 GLU H 2.500 . 3.300 2.335 2.313 2.359 . 0 0 "[ . 1 . 2 .]" 1
998 1 28 LEU HB2 1 29 GLU HG3 3.900 . 5.800 5.410 5.337 5.516 . 0 0 "[ . 1 . 2 .]" 1
999 1 28 LEU HB2 1 36 LYS HB2 3.400 . 4.800 4.024 3.955 4.115 . 0 0 "[ . 1 . 2 .]" 1
1000 1 28 LEU HB2 1 36 LYS HB3 2.800 . 3.800 2.684 2.591 2.829 . 0 0 "[ . 1 . 2 .]" 1
1001 1 28 LEU HB2 1 37 ALA HA 5.800 4.100 7.500 4.119 4.091 4.180 0.009 2 0 "[ . 1 . 2 .]" 1
1002 1 28 LEU HB3 1 28 LEU MD1 2.200 . 2.800 2.324 2.307 2.351 . 0 0 "[ . 1 . 2 .]" 1
1003 1 28 LEU HB3 1 28 LEU QD 2.200 . 2.800 2.068 2.057 2.081 . 0 0 "[ . 1 . 2 .]" 1
1004 1 28 LEU HB3 1 29 GLU H 2.700 . 3.600 3.640 3.624 3.657 0.057 3 0 "[ . 1 . 2 .]" 1
1005 1 28 LEU HB3 1 29 GLU HG3 3.800 . 5.600 5.667 5.636 5.690 0.090 7 0 "[ . 1 . 2 .]" 1
1006 1 28 LEU HB3 1 37 ALA HA 3.700 . 5.400 5.275 5.218 5.319 . 0 0 "[ . 1 . 2 .]" 1
1007 1 28 LEU QD 1 29 GLU H 3.400 . 4.900 3.846 3.823 3.881 . 0 0 "[ . 1 . 2 .]" 1
1008 1 28 LEU MD1 1 28 LEU HG 2.200 . 2.800 2.092 2.081 2.102 . 0 0 "[ . 1 . 2 .]" 1
1009 1 28 LEU MD1 1 36 LYS HD2 2.400 . 3.100 2.395 2.336 2.454 . 0 0 "[ . 1 . 2 .]" 1
1010 1 28 LEU MD1 1 36 LYS HE2 2.900 . 4.000 2.188 2.162 2.212 . 0 0 "[ . 1 . 2 .]" 1
1011 1 28 LEU MD1 1 36 LYS HE3 3.000 . 4.100 2.148 2.063 2.211 . 0 0 "[ . 1 . 2 .]" 1
1012 1 28 LEU MD1 1 36 LYS HG3 2.900 . 3.900 2.034 1.929 2.210 . 0 0 "[ . 1 . 2 .]" 1
1013 1 28 LEU MD1 1 37 ALA H 4.100 . 6.000 4.044 3.936 4.129 . 0 0 "[ . 1 . 2 .]" 1
1014 1 28 LEU MD1 1 37 ALA HA 4.000 . 6.000 3.845 3.792 3.887 . 0 0 "[ . 1 . 2 .]" 1
1015 1 28 LEU MD1 1 38 GLN H 3.200 . 4.500 3.650 3.622 3.703 . 0 0 "[ . 1 . 2 .]" 1
1016 1 28 LEU MD1 1 38 GLN HA 3.400 . 4.900 3.237 3.169 3.303 . 0 0 "[ . 1 . 2 .]" 1
1017 1 28 LEU MD1 1 38 GLN HB2 2.500 . 3.300 1.793 1.771 1.819 . 0 0 "[ . 1 . 2 .]" 1
1018 1 28 LEU MD1 1 38 GLN HB3 2.700 . 3.600 3.222 3.185 3.260 . 0 0 "[ . 1 . 2 .]" 1
1019 1 28 LEU MD1 1 38 GLN HE21 4.500 3.200 5.800 5.171 5.076 5.307 . 0 0 "[ . 1 . 2 .]" 1
1020 1 28 LEU MD1 1 38 GLN HE22 4.000 . 6.000 5.359 5.232 5.505 . 0 0 "[ . 1 . 2 .]" 1
1021 1 28 LEU MD1 1 38 GLN HG2 3.100 . 4.300 4.407 4.395 4.418 0.118 19 0 "[ . 1 . 2 .]" 1
1022 1 28 LEU MD1 1 38 GLN HG3 3.000 . 4.100 3.464 3.441 3.481 . 0 0 "[ . 1 . 2 .]" 1
1023 1 28 LEU MD1 1 45 GLU HA 3.800 . 5.600 3.574 3.527 3.627 . 0 0 "[ . 1 . 2 .]" 1
1024 1 28 LEU MD1 1 45 GLU HB2 3.000 . 4.100 4.138 4.130 4.153 0.053 16 0 "[ . 1 . 2 .]" 1
1025 1 28 LEU MD1 1 45 GLU HB3 2.900 . 3.900 2.823 2.771 2.962 . 0 0 "[ . 1 . 2 .]" 1
1026 1 28 LEU MD1 1 45 GLU HG2 2.600 . 3.500 2.279 1.971 2.450 . 0 0 "[ . 1 . 2 .]" 1
1027 1 28 LEU MD1 1 45 GLU HG3 3.300 . 4.700 3.547 3.141 3.753 . 0 0 "[ . 1 . 2 .]" 1
1028 1 28 LEU MD1 1 46 GLY H 3.400 . 4.900 3.446 3.372 3.516 . 0 0 "[ . 1 . 2 .]" 1
1029 1 28 LEU MD2 1 28 LEU HG 2.300 . 3.000 2.087 2.081 2.093 . 0 0 "[ . 1 . 2 .]" 1
1030 1 28 LEU MD2 1 29 GLU H 3.500 . 5.100 4.426 4.402 4.473 . 0 0 "[ . 1 . 2 .]" 1
1031 1 28 LEU MD2 1 37 ALA H 4.500 . 6.000 5.564 5.494 5.631 . 0 0 "[ . 1 . 2 .]" 1
1032 1 28 LEU MD2 1 37 ALA HA 3.100 . 4.300 3.777 3.689 3.888 . 0 0 "[ . 1 . 2 .]" 1
1033 1 28 LEU MD2 1 38 GLN H 2.700 . 3.600 2.836 2.732 3.017 . 0 0 "[ . 1 . 2 .]" 1
1034 1 28 LEU MD2 1 38 GLN HE21 4.700 . 6.000 3.768 3.693 3.950 . 0 0 "[ . 1 . 2 .]" 1
1035 1 28 LEU MD2 1 38 GLN HE22 3.800 . 5.600 3.878 3.806 4.010 . 0 0 "[ . 1 . 2 .]" 1
1036 1 28 LEU HG 1 29 GLU H 3.700 . 5.400 3.743 3.696 3.830 . 0 0 "[ . 1 . 2 .]" 1
1037 1 28 LEU HG 1 36 LYS HG3 2.200 . 2.800 2.875 2.867 2.881 0.081 9 0 "[ . 1 . 2 .]" 1
1038 1 28 LEU HG 1 37 ALA HA 2.600 . 3.500 2.620 2.556 2.694 . 0 0 "[ . 1 . 2 .]" 1
1039 1 28 LEU HG 1 38 GLN H 3.100 . 4.300 2.625 2.589 2.660 . 0 0 "[ . 1 . 2 .]" 1
1040 1 29 GLU H 1 29 GLU HA 2.300 . 3.000 2.905 2.898 2.912 . 0 0 "[ . 1 . 2 .]" 1
1041 1 29 GLU H 1 29 GLU HB2 2.800 . 3.800 2.763 2.734 2.806 . 0 0 "[ . 1 . 2 .]" 1
1042 1 29 GLU H 1 29 GLU HB3 3.000 . 4.100 3.457 3.425 3.502 . 0 0 "[ . 1 . 2 .]" 1
1043 1 29 GLU H 1 29 GLU HG2 3.800 . 5.600 5.047 5.030 5.066 . 0 0 "[ . 1 . 2 .]" 1
1044 1 29 GLU H 1 29 GLU HG3 4.200 . 6.000 4.363 4.345 4.383 . 0 0 "[ . 1 . 2 .]" 1
1045 1 29 GLU H 1 30 GLN H 3.600 . 5.300 4.301 4.221 4.379 . 0 0 "[ . 1 . 2 .]" 1
1046 1 29 GLU H 1 36 LYS H 2.800 . 3.800 3.131 3.094 3.191 . 0 0 "[ . 1 . 2 .]" 1
1047 1 29 GLU H 1 36 LYS HB2 2.900 . 3.900 3.910 3.902 3.919 0.019 7 0 "[ . 1 . 2 .]" 1
1048 1 29 GLU H 1 36 LYS HB3 2.600 . 3.500 2.189 2.181 2.199 . 0 0 "[ . 1 . 2 .]" 1
1049 1 29 GLU H 1 36 LYS HD2 4.600 . 6.000 4.601 4.496 4.695 . 0 0 "[ . 1 . 2 .]" 1
1050 1 29 GLU H 1 36 LYS HG3 4.000 . 6.000 3.109 2.953 3.221 . 0 0 "[ . 1 . 2 .]" 1
1051 1 29 GLU H 1 37 ALA HA 3.100 . 4.300 3.968 3.901 4.015 . 0 0 "[ . 1 . 2 .]" 1
1052 1 29 GLU H 1 37 ALA MB 4.400 . 6.000 4.950 4.896 4.986 . 0 0 "[ . 1 . 2 .]" 1
1053 1 29 GLU HA 1 29 GLU HB2 2.700 . 3.600 2.855 2.842 2.872 . 0 0 "[ . 1 . 2 .]" 1
1054 1 29 GLU HA 1 29 GLU HB3 2.200 . 2.800 2.834 2.824 2.844 0.044 7 0 "[ . 1 . 2 .]" 1
1055 1 29 GLU HA 1 30 GLN H 2.100 . 2.600 2.242 2.163 2.357 . 0 0 "[ . 1 . 2 .]" 1
1056 1 29 GLU HA 1 30 GLN HA 3.700 . 5.400 4.390 4.358 4.439 . 0 0 "[ . 1 . 2 .]" 1
1057 1 29 GLU HA 1 31 SER H 5.200 . 6.000 4.123 3.987 4.319 . 0 0 "[ . 1 . 2 .]" 1
1058 1 29 GLU HB2 1 30 GLN H 3.300 . 4.700 4.293 4.150 4.388 . 0 0 "[ . 1 . 2 .]" 1
1059 1 29 GLU HB2 1 36 LYS H 3.000 . 4.100 3.811 3.756 3.900 . 0 0 "[ . 1 . 2 .]" 1
1060 1 29 GLU HB2 1 36 LYS HB2 2.900 . 3.900 3.366 3.284 3.512 . 0 0 "[ . 1 . 2 .]" 1
1061 1 29 GLU HB3 1 30 GLN H 4.000 . 6.000 3.248 2.951 3.456 . 0 0 "[ . 1 . 2 .]" 1
1062 1 29 GLU HB3 1 31 SER HB2 3.800 . 5.600 5.186 5.013 5.366 . 0 0 "[ . 1 . 2 .]" 1
1063 1 29 GLU HB3 1 36 LYS H 3.300 . 4.700 3.211 3.132 3.328 . 0 0 "[ . 1 . 2 .]" 1
1064 1 29 GLU HB3 1 36 LYS HB2 3.000 . 4.100 3.623 3.552 3.730 . 0 0 "[ . 1 . 2 .]" 1
1065 1 29 GLU HG2 1 30 GLN H 3.600 . 5.200 3.745 3.502 3.920 . 0 0 "[ . 1 . 2 .]" 1
1066 1 29 GLU HG2 1 31 SER HB2 3.900 . 5.800 4.673 4.595 4.767 . 0 0 "[ . 1 . 2 .]" 1
1067 1 29 GLU HG3 1 30 GLN H 3.500 . 5.000 3.137 3.085 3.167 . 0 0 "[ . 1 . 2 .]" 1
1068 1 29 GLU HG3 1 30 GLN HG2 3.200 . 4.500 4.595 4.577 4.615 0.115 19 0 "[ . 1 . 2 .]" 1
1069 1 29 GLU HG3 1 31 SER HB2 3.900 . 5.800 5.821 5.801 5.836 0.036 14 0 "[ . 1 . 2 .]" 1
1070 1 30 GLN H 1 30 GLN HA 2.800 . 3.800 2.924 2.910 2.932 . 0 0 "[ . 1 . 2 .]" 1
1071 1 30 GLN H 1 30 GLN HB2 2.700 . 3.600 3.621 3.595 3.649 0.049 25 0 "[ . 1 . 2 .]" 1
1072 1 30 GLN H 1 30 GLN HB3 3.200 . 4.500 3.475 3.361 3.611 . 0 0 "[ . 1 . 2 .]" 1
1073 1 30 GLN H 1 30 GLN HG2 3.300 . 4.700 2.115 1.928 2.374 . 0 0 "[ . 1 . 2 .]" 1
1074 1 30 GLN H 1 30 GLN HG3 3.500 . 5.000 2.567 2.475 2.664 . 0 0 "[ . 1 . 2 .]" 1
1075 1 30 GLN H 1 31 SER H 3.200 . 4.400 2.586 2.459 2.696 . 0 0 "[ . 1 . 2 .]" 1
1076 1 30 GLN H 1 31 SER HA 3.900 . 5.800 4.450 4.295 4.561 . 0 0 "[ . 1 . 2 .]" 1
1077 1 30 GLN H 1 31 SER HB2 4.700 . 6.000 5.185 4.722 5.542 . 0 0 "[ . 1 . 2 .]" 1
1078 1 30 GLN HA 1 30 GLN HB2 2.300 . 2.900 2.646 2.610 2.680 . 0 0 "[ . 1 . 2 .]" 1
1079 1 30 GLN HA 1 30 GLN HB3 2.500 . 3.300 2.273 2.255 2.292 . 0 0 "[ . 1 . 2 .]" 1
1080 1 30 GLN HA 1 30 GLN HG2 2.900 . 3.900 3.449 3.422 3.475 . 0 0 "[ . 1 . 2 .]" 1
1081 1 30 GLN HA 1 30 GLN HG3 2.700 . 3.600 3.762 3.731 3.781 0.181 16 0 "[ . 1 . 2 .]" 1
1082 1 30 GLN HA 1 31 SER H 2.200 . 2.800 2.821 2.815 2.828 0.028 8 0 "[ . 1 . 2 .]" 1
1083 1 30 GLN HA 1 35 TRP HA 2.700 . 3.600 2.411 2.141 2.598 . 0 0 "[ . 1 . 2 .]" 1
1084 1 30 GLN HA 1 35 TRP HB3 3.200 . 4.500 2.551 2.416 2.654 . 0 0 "[ . 1 . 2 .]" 1
1085 1 30 GLN HA 1 35 TRP HD1 2.700 . 3.600 2.767 2.644 2.864 . 0 0 "[ . 1 . 2 .]" 1
1086 1 30 GLN HA 1 35 TRP HE1 3.600 . 5.200 3.851 3.743 4.013 . 0 0 "[ . 1 . 2 .]" 1
1087 1 30 GLN HA 1 35 TRP HE3 3.800 . 5.600 4.257 4.121 4.436 . 0 0 "[ . 1 . 2 .]" 1
1088 1 30 GLN HA 1 36 LYS H 3.400 . 4.900 3.187 2.884 3.357 . 0 0 "[ . 1 . 2 .]" 1
1089 1 30 GLN HB2 1 30 GLN HE22 4.400 . 6.000 4.069 3.564 4.536 . 0 0 "[ . 1 . 2 .]" 1
1090 1 30 GLN HB2 1 30 GLN HG2 2.300 . 2.900 2.982 2.978 2.986 0.086 14 0 "[ . 1 . 2 .]" 1
1091 1 30 GLN HB2 1 31 SER H 4.100 . 6.000 4.324 4.308 4.339 . 0 0 "[ . 1 . 2 .]" 1
1092 1 30 GLN HB2 1 35 TRP HD1 4.200 . 6.000 4.096 3.787 4.296 . 0 0 "[ . 1 . 2 .]" 1
1093 1 30 GLN HB2 1 35 TRP HE1 4.200 . 6.000 3.270 3.169 3.342 . 0 0 "[ . 1 . 2 .]" 1
1094 1 30 GLN HB3 1 30 GLN HE22 3.900 . 5.800 4.151 3.458 4.608 . 0 0 "[ . 1 . 2 .]" 1
1095 1 30 GLN HB3 1 30 GLN HG2 2.000 . 2.500 2.468 2.430 2.492 . 0 0 "[ . 1 . 2 .]" 1
1096 1 30 GLN HB3 1 30 GLN HG3 2.300 . 2.900 2.965 2.959 2.973 0.073 9 0 "[ . 1 . 2 .]" 1
1097 1 30 GLN HB3 1 31 SER H 4.500 . 6.000 4.647 4.634 4.662 . 0 0 "[ . 1 . 2 .]" 1
1098 1 30 GLN HB3 1 35 TRP HE1 3.800 . 5.600 4.459 4.299 4.612 . 0 0 "[ . 1 . 2 .]" 1
1099 1 30 GLN HE21 1 30 GLN HG2 4.000 . 6.000 3.144 2.151 3.550 . 0 0 "[ . 1 . 2 .]" 1
1100 1 30 GLN HE21 1 30 GLN HG3 3.500 . 5.000 2.583 2.132 3.535 . 0 0 "[ . 1 . 2 .]" 1
1101 1 30 GLN HE21 1 35 TRP HH2 4.300 . 6.000 4.868 3.147 6.004 0.004 13 0 "[ . 1 . 2 .]" 1
1102 1 30 GLN HE22 1 30 GLN HG2 3.900 . 5.800 3.902 3.455 4.103 . 0 0 "[ . 1 . 2 .]" 1
1103 1 30 GLN HE22 1 30 GLN HG3 3.500 . 5.000 3.644 3.444 4.091 . 0 0 "[ . 1 . 2 .]" 1
1104 1 30 GLN HG2 1 31 SER H 4.500 . 6.000 4.436 4.326 4.593 . 0 0 "[ . 1 . 2 .]" 1
1105 1 30 GLN HG2 1 35 TRP HE1 5.200 . 6.000 6.041 6.030 6.053 0.053 19 0 "[ . 1 . 2 .]" 1
1106 1 30 GLN HG2 1 35 TRP HE3 4.200 . 6.000 5.474 5.274 5.644 . 0 0 "[ . 1 . 2 .]" 1
1107 1 30 GLN HG3 1 31 SER H 3.700 . 5.400 4.284 4.227 4.311 . 0 0 "[ . 1 . 2 .]" 1
1108 1 30 GLN HG3 1 35 TRP HE1 3.900 . 5.800 5.210 5.136 5.265 . 0 0 "[ . 1 . 2 .]" 1
1109 1 30 GLN HG3 1 35 TRP HE3 4.400 . 6.000 6.026 6.011 6.040 0.040 7 0 "[ . 1 . 2 .]" 1
1110 1 31 SER H 1 31 SER HA 2.800 . 3.800 2.911 2.891 2.926 . 0 0 "[ . 1 . 2 .]" 1
1111 1 31 SER H 1 31 SER HB2 2.500 . 3.300 3.320 3.300 3.349 0.049 5 0 "[ . 1 . 2 .]" 1
1112 1 31 SER H 1 32 GLY H 3.500 . 5.000 4.452 4.404 4.523 . 0 0 "[ . 1 . 2 .]" 1
1113 1 31 SER H 1 35 TRP HA 2.900 . 3.900 3.651 3.553 3.714 . 0 0 "[ . 1 . 2 .]" 1
1114 1 31 SER H 1 35 TRP HD1 2.900 . 3.900 3.873 3.820 3.904 0.004 19 0 "[ . 1 . 2 .]" 1
1115 1 31 SER H 1 35 TRP HE1 4.200 . 6.000 4.881 4.746 5.056 . 0 0 "[ . 1 . 2 .]" 1
1116 1 31 SER H 1 36 LYS H 4.100 . 6.000 4.044 3.943 4.112 . 0 0 "[ . 1 . 2 .]" 1
1117 1 31 SER HA 1 31 SER HB2 2.400 . 3.100 2.582 2.232 2.818 . 0 0 "[ . 1 . 2 .]" 1
1118 1 31 SER HA 1 32 GLY H 2.100 . 2.700 2.149 2.141 2.163 . 0 0 "[ . 1 . 2 .]" 1
1119 1 31 SER HA 1 35 TRP HE1 5.500 . 6.000 4.079 3.917 4.313 . 0 0 "[ . 1 . 2 .]" 1
1120 1 31 SER HB2 1 32 GLY H 2.700 . 3.600 3.649 3.645 3.656 0.056 13 0 "[ . 1 . 2 .]" 1
1121 1 32 GLY H 1 32 GLY HA2 2.100 . 2.700 2.345 2.315 2.366 . 0 0 "[ . 1 . 2 .]" 1
1122 1 32 GLY H 1 32 GLY HA3 2.400 . 3.100 2.897 2.857 2.921 . 0 0 "[ . 1 . 2 .]" 1
1123 1 32 GLY H 1 33 GLU H 3.300 . 4.700 4.336 4.280 4.410 . 0 0 "[ . 1 . 2 .]" 1
1124 1 32 GLY H 1 34 TRP H 5.800 . 6.000 5.079 5.060 5.111 . 0 0 "[ . 1 . 2 .]" 1
1125 1 32 GLY H 1 35 TRP HD1 5.300 . 6.000 4.448 4.259 4.669 . 0 0 "[ . 1 . 2 .]" 1
1126 1 32 GLY H 1 35 TRP HE1 5.200 . 6.000 3.811 3.598 4.138 . 0 0 "[ . 1 . 2 .]" 1
1127 1 32 GLY HA2 1 33 GLU H 2.400 . 3.100 2.301 2.272 2.343 . 0 0 "[ . 1 . 2 .]" 1
1128 1 32 GLY HA2 1 33 GLU QB 3.800 . 5.600 4.143 4.121 4.176 . 0 0 "[ . 1 . 2 .]" 1
1129 1 32 GLY HA2 1 33 GLU HG2 4.000 . 6.000 6.148 6.138 6.158 0.158 15 0 "[ . 1 . 2 .]" 1
1130 1 32 GLY HA2 1 34 TRP H 3.200 . 4.500 3.970 3.937 4.013 . 0 0 "[ . 1 . 2 .]" 1
1131 1 32 GLY HA2 1 35 TRP HE1 3.400 . 4.900 4.932 4.924 4.939 0.039 20 0 "[ . 1 . 2 .]" 1
1132 1 32 GLY HA3 1 33 GLU H 2.300 . 2.900 2.734 2.666 2.789 . 0 0 "[ . 1 . 2 .]" 1
1133 1 32 GLY HA3 1 33 GLU QB 3.600 . 5.200 4.363 4.287 4.422 . 0 0 "[ . 1 . 2 .]" 1
1134 1 32 GLY HA3 1 33 GLU HG2 4.500 . 6.000 5.831 5.740 5.896 . 0 0 "[ . 1 . 2 .]" 1
1135 1 32 GLY HA3 1 34 TRP H 2.800 . 3.800 3.035 3.018 3.052 . 0 0 "[ . 1 . 2 .]" 1
1136 1 33 GLU H 1 33 GLU HB2 3.300 . 4.600 2.917 2.905 2.930 . 0 0 "[ . 1 . 2 .]" 1
1137 1 33 GLU H 1 33 GLU HB3 3.000 . 4.100 2.125 2.110 2.137 . 0 0 "[ . 1 . 2 .]" 1
1138 1 33 GLU H 1 33 GLU HG2 3.200 . 4.500 3.976 3.951 3.995 . 0 0 "[ . 1 . 2 .]" 1
1139 1 33 GLU H 1 33 GLU HG3 3.200 . 4.500 4.440 4.429 4.448 . 0 0 "[ . 1 . 2 .]" 1
1140 1 33 GLU H 1 34 TRP H 2.400 . 3.100 2.844 2.825 2.866 . 0 0 "[ . 1 . 2 .]" 1
1141 1 33 GLU H 1 34 TRP HD1 4.900 . 6.000 4.461 4.372 4.534 . 0 0 "[ . 1 . 2 .]" 1
1142 1 33 GLU H 1 35 TRP HD1 5.100 . 6.000 5.365 5.299 5.443 . 0 0 "[ . 1 . 2 .]" 1
1143 1 33 GLU HA 1 33 GLU HB2 2.500 . 3.300 2.255 2.248 2.261 . 0 0 "[ . 1 . 2 .]" 1
1144 1 33 GLU HA 1 33 GLU HB3 2.400 . 3.100 2.933 2.925 2.939 . 0 0 "[ . 1 . 2 .]" 1
1145 1 33 GLU HA 1 33 GLU HG2 2.600 . 3.500 3.542 3.535 3.551 0.051 9 0 "[ . 1 . 2 .]" 1
1146 1 33 GLU HA 1 33 GLU HG3 2.200 . 2.800 2.898 2.887 2.912 0.112 9 0 "[ . 1 . 2 .]" 1
1147 1 33 GLU HA 1 34 TRP H 2.800 . 3.800 3.453 3.447 3.458 . 0 0 "[ . 1 . 2 .]" 1
1148 1 33 GLU HA 1 35 TRP HE1 3.200 . 4.500 4.401 4.277 4.501 0.001 18 0 "[ . 1 . 2 .]" 1
1149 1 33 GLU HA 1 50 PHE H 3.600 . 5.200 4.260 4.173 4.322 . 0 0 "[ . 1 . 2 .]" 1
1150 1 33 GLU HA 1 50 PHE HB2 3.400 . 4.800 4.023 3.897 4.148 . 0 0 "[ . 1 . 2 .]" 1
1151 1 33 GLU HA 1 50 PHE HB3 2.800 . 3.800 3.109 2.994 3.205 . 0 0 "[ . 1 . 2 .]" 1
1152 1 33 GLU HA 1 50 PHE QD 2.400 . 3.100 3.085 3.005 3.113 0.013 2 0 "[ . 1 . 2 .]" 1
1153 1 33 GLU QB 1 33 GLU HG2 1.800 . 2.200 2.262 2.258 2.265 0.065 17 0 "[ . 1 . 2 .]" 1
1154 1 33 GLU HB2 1 34 TRP HD1 3.500 . 5.000 4.694 4.651 4.742 . 0 0 "[ . 1 . 2 .]" 1
1155 1 33 GLU HB2 1 50 PHE QD 3.100 . 4.300 4.183 4.056 4.233 . 0 0 "[ . 1 . 2 .]" 1
1156 1 33 GLU HB3 1 34 TRP H 2.500 . 3.300 3.319 3.308 3.331 0.031 3 0 "[ . 1 . 2 .]" 1
1157 1 33 GLU HB3 1 34 TRP HD1 3.700 . 5.400 3.279 3.239 3.317 . 0 0 "[ . 1 . 2 .]" 1
1158 1 33 GLU HB3 1 34 TRP HE1 3.600 . 5.300 4.839 4.729 4.922 . 0 0 "[ . 1 . 2 .]" 1
1159 1 33 GLU HB3 1 50 PHE QD 3.500 . 5.000 5.000 4.913 5.021 0.021 22 0 "[ . 1 . 2 .]" 1
1160 1 33 GLU HG2 1 34 TRP H 4.300 . 6.000 3.337 3.273 3.387 . 0 0 "[ . 1 . 2 .]" 1
1161 1 33 GLU HG2 1 34 TRP HD1 4.000 . 6.000 2.254 2.188 2.360 . 0 0 "[ . 1 . 2 .]" 1
1162 1 33 GLU HG2 1 34 TRP HE1 4.400 . 6.000 3.121 3.087 3.163 . 0 0 "[ . 1 . 2 .]" 1
1163 1 33 GLU HG2 1 50 PHE QD 3.700 . 5.400 3.997 3.915 4.054 . 0 0 "[ . 1 . 2 .]" 1
1164 1 33 GLU HG3 1 34 TRP H 4.200 . 6.000 4.267 4.213 4.308 . 0 0 "[ . 1 . 2 .]" 1
1165 1 33 GLU HG3 1 34 TRP HE1 4.600 . 6.000 4.425 4.390 4.479 . 0 0 "[ . 1 . 2 .]" 1
1166 1 33 GLU HG3 1 50 PHE QD 3.600 . 5.200 2.602 2.469 2.689 . 0 0 "[ . 1 . 2 .]" 1
1167 1 34 TRP H 1 34 TRP HA 2.900 . 3.900 2.941 2.938 2.943 . 0 0 "[ . 1 . 2 .]" 1
1168 1 34 TRP H 1 34 TRP HB2 2.300 . 2.900 2.412 2.399 2.425 . 0 0 "[ . 1 . 2 .]" 1
1169 1 34 TRP H 1 34 TRP HB3 2.700 . 3.600 3.629 3.624 3.636 0.036 19 0 "[ . 1 . 2 .]" 1
1170 1 34 TRP H 1 34 TRP HD1 2.900 . 4.000 3.165 3.049 3.248 . 0 0 "[ . 1 . 2 .]" 1
1171 1 34 TRP H 1 35 TRP H 5.000 . 6.000 4.271 4.171 4.363 . 0 0 "[ . 1 . 2 .]" 1
1172 1 34 TRP H 1 35 TRP HD1 3.100 . 4.300 3.829 3.791 3.867 . 0 0 "[ . 1 . 2 .]" 1
1173 1 34 TRP HA 1 34 TRP HB3 2.200 . 2.800 2.581 2.562 2.594 . 0 0 "[ . 1 . 2 .]" 1
1174 1 34 TRP HA 1 34 TRP HE3 2.600 . 3.400 3.327 3.293 3.368 . 0 0 "[ . 1 . 2 .]" 1
1175 1 34 TRP HA 1 35 TRP H 1.900 . 2.400 2.148 2.141 2.158 . 0 0 "[ . 1 . 2 .]" 1
1176 1 34 TRP HA 1 35 TRP HB2 3.600 . 5.200 4.497 4.477 4.528 . 0 0 "[ . 1 . 2 .]" 1
1177 1 34 TRP HA 1 35 TRP HD1 3.900 . 5.800 4.070 3.965 4.189 . 0 0 "[ . 1 . 2 .]" 1
1178 1 34 TRP HA 1 47 PHE HB3 3.900 . 5.800 4.979 4.870 5.083 . 0 0 "[ . 1 . 2 .]" 1
1179 1 34 TRP HA 1 48 ILE H 3.700 . 5.400 4.304 4.104 4.505 . 0 0 "[ . 1 . 2 .]" 1
1180 1 34 TRP HA 1 49 PRO HA 2.900 . 3.900 3.032 2.869 3.139 . 0 0 "[ . 1 . 2 .]" 1
1181 1 34 TRP HA 1 50 PHE H 3.100 . 4.300 2.442 2.372 2.500 . 0 0 "[ . 1 . 2 .]" 1
1182 1 34 TRP HA 1 50 PHE HA 4.700 . 6.000 4.414 4.328 4.476 . 0 0 "[ . 1 . 2 .]" 1
1183 1 34 TRP QB 1 50 PHE HB3 3.400 . 4.900 4.950 4.932 4.967 0.067 22 0 "[ . 1 . 2 .]" 1
1184 1 34 TRP HB3 1 34 TRP HE3 2.900 . 4.000 2.541 2.531 2.555 . 0 0 "[ . 1 . 2 .]" 1
1185 1 34 TRP HB3 1 35 TRP H 3.100 . 4.300 3.602 3.462 3.746 . 0 0 "[ . 1 . 2 .]" 1
1186 1 34 TRP HE3 1 48 ILE HA 3.400 . 4.800 3.102 3.052 3.143 . 0 0 "[ . 1 . 2 .]" 1
1187 1 34 TRP HE3 1 49 PRO HA 3.400 . 4.900 3.625 3.447 3.753 . 0 0 "[ . 1 . 2 .]" 1
1188 1 34 TRP HE3 1 49 PRO HD2 3.300 . 4.700 4.405 4.357 4.449 . 0 0 "[ . 1 . 2 .]" 1
1189 1 34 TRP HH2 1 49 PRO HG2 3.700 . 5.400 5.449 5.437 5.460 0.060 11 0 "[ . 1 . 2 .]" 1
1190 1 34 TRP HZ3 1 47 PHE HB3 5.000 . 6.000 3.923 3.710 4.170 . 0 0 "[ . 1 . 2 .]" 1
1191 1 34 TRP HZ3 1 48 ILE HA 2.800 . 3.800 2.642 2.572 2.741 . 0 0 "[ . 1 . 2 .]" 1
1192 1 34 TRP HZ3 1 49 PRO HA 3.900 . 5.800 4.120 3.999 4.233 . 0 0 "[ . 1 . 2 .]" 1
1193 1 34 TRP HZ3 1 49 PRO HD2 2.500 . 3.300 3.318 3.310 3.334 0.034 9 0 "[ . 1 . 2 .]" 1
1194 1 35 TRP H 1 35 TRP HA 2.700 . 3.600 2.919 2.902 2.932 . 0 0 "[ . 1 . 2 .]" 1
1195 1 35 TRP H 1 35 TRP HB2 2.600 . 3.400 2.401 2.375 2.435 . 0 0 "[ . 1 . 2 .]" 1
1196 1 35 TRP H 1 35 TRP HB3 2.700 . 3.600 3.623 3.609 3.643 0.043 10 0 "[ . 1 . 2 .]" 1
1197 1 35 TRP H 1 35 TRP HD1 4.200 . 6.000 3.191 3.136 3.258 . 0 0 "[ . 1 . 2 .]" 1
1198 1 35 TRP H 1 36 LYS H 4.500 . 6.000 4.529 4.503 4.551 . 0 0 "[ . 1 . 2 .]" 1
1199 1 35 TRP H 1 47 PHE HA 4.200 . 6.000 5.170 5.035 5.343 . 0 0 "[ . 1 . 2 .]" 1
1200 1 35 TRP H 1 48 ILE H 3.300 . 4.600 3.339 3.169 3.548 . 0 0 "[ . 1 . 2 .]" 1
1201 1 35 TRP H 1 48 ILE MD 3.600 . 5.200 4.282 4.230 4.328 . 0 0 "[ . 1 . 2 .]" 1
1202 1 35 TRP H 1 48 ILE HG12 3.400 . 4.800 4.418 4.299 4.498 . 0 0 "[ . 1 . 2 .]" 1
1203 1 35 TRP H 1 48 ILE HG13 3.200 . 4.400 3.052 2.986 3.140 . 0 0 "[ . 1 . 2 .]" 1
1204 1 35 TRP H 1 48 ILE MG 4.300 . 6.000 5.307 5.218 5.416 . 0 0 "[ . 1 . 2 .]" 1
1205 1 35 TRP H 1 49 PRO HA 3.900 . 5.800 3.960 3.825 4.072 . 0 0 "[ . 1 . 2 .]" 1
1206 1 35 TRP H 1 50 PHE H 4.500 . 6.000 2.938 2.770 3.094 . 0 0 "[ . 1 . 2 .]" 1
1207 1 35 TRP H 1 50 PHE HA 4.300 . 6.000 3.329 3.135 3.533 . 0 0 "[ . 1 . 2 .]" 1
1208 1 35 TRP HA 1 35 TRP HB2 2.900 . 3.900 3.011 3.009 3.013 . 0 0 "[ . 1 . 2 .]" 1
1209 1 35 TRP HA 1 35 TRP HB3 2.600 . 3.400 2.521 2.502 2.539 . 0 0 "[ . 1 . 2 .]" 1
1210 1 35 TRP HA 1 35 TRP HD1 2.200 . 2.800 2.266 2.244 2.280 . 0 0 "[ . 1 . 2 .]" 1
1211 1 35 TRP HA 1 35 TRP HE1 3.500 . 5.100 4.654 4.629 4.674 . 0 0 "[ . 1 . 2 .]" 1
1212 1 35 TRP HA 1 35 TRP HE3 3.500 . 5.000 5.063 5.048 5.083 0.083 25 0 "[ . 1 . 2 .]" 1
1213 1 35 TRP HA 1 36 LYS H 2.100 . 2.600 2.177 2.158 2.205 . 0 0 "[ . 1 . 2 .]" 1
1214 1 35 TRP HA 1 36 LYS HB2 4.800 . 6.000 4.559 4.531 4.588 . 0 0 "[ . 1 . 2 .]" 1
1215 1 35 TRP HB2 1 35 TRP HD1 3.600 . 5.200 3.591 3.562 3.624 . 0 0 "[ . 1 . 2 .]" 1
1216 1 35 TRP HB2 1 35 TRP HE3 2.600 . 3.500 2.943 2.879 2.998 . 0 0 "[ . 1 . 2 .]" 1
1217 1 35 TRP HB2 1 36 LYS H 3.000 . 4.200 4.085 3.999 4.155 . 0 0 "[ . 1 . 2 .]" 1
1218 1 35 TRP HB2 1 36 LYS HB3 6.000 4.300 7.000 6.275 6.213 6.324 . 0 0 "[ . 1 . 2 .]" 1
1219 1 35 TRP HB2 1 37 ALA MB 3.800 . 5.600 4.223 4.167 4.279 . 0 0 "[ . 1 . 2 .]" 1
1220 1 35 TRP HB2 1 48 ILE MD 2.800 . 3.800 2.933 2.886 3.068 . 0 0 "[ . 1 . 2 .]" 1
1221 1 35 TRP HB2 1 48 ILE HG12 2.700 . 3.600 3.626 3.612 3.644 0.044 16 0 "[ . 1 . 2 .]" 1
1222 1 35 TRP HB2 1 48 ILE HG13 2.600 . 3.400 2.586 2.547 2.647 . 0 0 "[ . 1 . 2 .]" 1
1223 1 35 TRP HB2 1 53 VAL MG2 4.600 . 6.000 3.898 3.738 4.065 . 0 0 "[ . 1 . 2 .]" 1
1224 1 35 TRP HB3 1 35 TRP HD1 3.200 . 4.500 3.633 3.602 3.659 . 0 0 "[ . 1 . 2 .]" 1
1225 1 35 TRP HB3 1 35 TRP HE3 2.700 . 3.600 2.859 2.821 2.909 . 0 0 "[ . 1 . 2 .]" 1
1226 1 35 TRP HB3 1 36 LYS H 2.700 . 3.600 2.963 2.846 3.057 . 0 0 "[ . 1 . 2 .]" 1
1227 1 35 TRP HB3 1 36 LYS HB3 4.900 . 6.000 5.013 4.956 5.059 . 0 0 "[ . 1 . 2 .]" 1
1228 1 35 TRP HB3 1 37 ALA MB 3.600 . 5.300 4.108 4.029 4.185 . 0 0 "[ . 1 . 2 .]" 1
1229 1 35 TRP HB3 1 48 ILE MD 3.000 . 4.200 3.730 3.648 3.821 . 0 0 "[ . 1 . 2 .]" 1
1230 1 35 TRP HB3 1 48 ILE HG12 3.200 . 4.500 4.183 4.106 4.280 . 0 0 "[ . 1 . 2 .]" 1
1231 1 35 TRP HB3 1 48 ILE HG13 2.900 . 3.900 3.821 3.754 3.885 . 0 0 "[ . 1 . 2 .]" 1
1232 1 35 TRP HD1 1 36 LYS H 3.700 . 5.400 4.366 4.330 4.404 . 0 0 "[ . 1 . 2 .]" 1
1233 1 35 TRP HD1 1 48 ILE MD 4.200 . 6.000 6.050 6.029 6.063 0.063 23 0 "[ . 1 . 2 .]" 1
1234 1 35 TRP HE1 1 50 PHE HA 4.000 . 6.000 5.021 4.831 5.129 . 0 0 "[ . 1 . 2 .]" 1
1235 1 35 TRP HE1 1 50 PHE HB2 3.400 . 4.900 3.094 2.993 3.269 . 0 0 "[ . 1 . 2 .]" 1
1236 1 35 TRP HE1 1 50 PHE HB3 3.500 . 5.000 3.567 3.405 3.748 . 0 0 "[ . 1 . 2 .]" 1
1237 1 35 TRP HE3 1 37 ALA MB 4.400 . 6.000 4.809 4.742 4.892 . 0 0 "[ . 1 . 2 .]" 1
1238 1 35 TRP HE3 1 48 ILE MD 2.800 . 3.800 3.558 3.433 3.753 . 0 0 "[ . 1 . 2 .]" 1
1239 1 35 TRP HE3 1 48 ILE HG13 3.800 . 5.600 4.859 4.747 4.960 . 0 0 "[ . 1 . 2 .]" 1
1240 1 35 TRP HE3 1 53 VAL MG1 4.600 . 6.000 5.123 4.961 5.306 . 0 0 "[ . 1 . 2 .]" 1
1241 1 35 TRP HE3 1 53 VAL MG2 2.600 . 3.500 3.025 2.953 3.133 . 0 0 "[ . 1 . 2 .]" 1
1242 1 35 TRP HE3 1 55 LYS QE 6.000 . 6.000 5.876 5.557 6.009 0.009 17 0 "[ . 1 . 2 .]" 1
1243 1 35 TRP HZ3 1 53 VAL MG2 2.500 . 3.300 3.333 3.324 3.342 0.042 21 0 "[ . 1 . 2 .]" 1
1244 1 36 LYS H 1 36 LYS HA 2.600 . 3.500 2.902 2.893 2.912 . 0 0 "[ . 1 . 2 .]" 1
1245 1 36 LYS H 1 36 LYS HB2 2.700 . 3.600 2.796 2.763 2.827 . 0 0 "[ . 1 . 2 .]" 1
1246 1 36 LYS H 1 36 LYS HB3 2.700 . 3.600 2.398 2.373 2.427 . 0 0 "[ . 1 . 2 .]" 1
1247 1 36 LYS H 1 36 LYS HD3 3.300 . 4.600 4.622 4.611 4.636 0.036 25 0 "[ . 1 . 2 .]" 1
1248 1 36 LYS H 1 36 LYS HG3 3.600 . 5.200 4.371 4.345 4.400 . 0 0 "[ . 1 . 2 .]" 1
1249 1 36 LYS H 1 37 ALA H 4.500 . 6.000 4.377 4.362 4.404 . 0 0 "[ . 1 . 2 .]" 1
1250 1 36 LYS H 1 47 PHE QD 5.200 . 6.000 5.112 5.053 5.175 . 0 0 "[ . 1 . 2 .]" 1
1251 1 36 LYS HA 1 36 LYS HB2 2.500 . 3.300 2.435 2.424 2.449 . 0 0 "[ . 1 . 2 .]" 1
1252 1 36 LYS HA 1 36 LYS HB3 2.600 . 3.400 3.024 3.022 3.026 . 0 0 "[ . 1 . 2 .]" 1
1253 1 36 LYS HA 1 36 LYS HD2 2.800 . 3.800 2.487 2.430 2.523 . 0 0 "[ . 1 . 2 .]" 1
1254 1 36 LYS HA 1 36 LYS HD3 2.500 . 3.300 2.146 2.117 2.178 . 0 0 "[ . 1 . 2 .]" 1
1255 1 36 LYS HA 1 36 LYS HG3 3.300 . 4.600 3.464 3.443 3.488 . 0 0 "[ . 1 . 2 .]" 1
1256 1 36 LYS HA 1 37 ALA H 2.000 . 2.500 2.176 2.172 2.180 . 0 0 "[ . 1 . 2 .]" 1
1257 1 36 LYS HA 1 37 ALA MB 3.400 . 4.800 4.022 4.006 4.037 . 0 0 "[ . 1 . 2 .]" 1
1258 1 36 LYS HA 1 46 GLY H 3.900 . 5.800 4.604 4.572 4.639 . 0 0 "[ . 1 . 2 .]" 1
1259 1 36 LYS HA 1 47 PHE H 4.000 . 6.000 4.721 4.643 4.811 . 0 0 "[ . 1 . 2 .]" 1
1260 1 36 LYS HA 1 47 PHE HA 2.200 . 2.800 2.224 2.154 2.313 . 0 0 "[ . 1 . 2 .]" 1
1261 1 36 LYS HA 1 47 PHE HB3 4.100 . 6.000 4.711 4.617 4.832 . 0 0 "[ . 1 . 2 .]" 1
1262 1 36 LYS HA 1 48 ILE H 3.000 . 4.200 3.306 3.180 3.454 . 0 0 "[ . 1 . 2 .]" 1
1263 1 36 LYS HB2 1 36 LYS HD2 2.700 . 3.600 3.532 3.508 3.548 . 0 0 "[ . 1 . 2 .]" 1
1264 1 36 LYS HB2 1 36 LYS HD3 2.500 . 3.300 2.664 2.631 2.682 . 0 0 "[ . 1 . 2 .]" 1
1265 1 36 LYS HB2 1 36 LYS HE2 3.300 . 4.700 4.223 4.202 4.243 . 0 0 "[ . 1 . 2 .]" 1
1266 1 36 LYS HB2 1 36 LYS HE3 3.700 . 5.400 4.982 4.962 4.991 . 0 0 "[ . 1 . 2 .]" 1
1267 1 36 LYS HB2 1 36 LYS HG3 3.000 . 4.100 2.981 2.979 2.985 . 0 0 "[ . 1 . 2 .]" 1
1268 1 36 LYS HB2 1 37 ALA H 3.700 . 5.400 4.367 4.341 4.386 . 0 0 "[ . 1 . 2 .]" 1
1269 1 36 LYS HB2 1 37 ALA HA 4.200 . 6.000 5.795 5.787 5.801 . 0 0 "[ . 1 . 2 .]" 1
1270 1 36 LYS HB2 1 47 PHE HA 4.100 . 6.000 3.891 3.816 3.992 . 0 0 "[ . 1 . 2 .]" 1
1271 1 36 LYS HB2 1 47 PHE QD 3.700 . 5.400 3.437 3.318 3.529 . 0 0 "[ . 1 . 2 .]" 1
1272 1 36 LYS HB3 1 36 LYS HD2 2.700 . 3.600 3.656 3.645 3.668 0.068 3 0 "[ . 1 . 2 .]" 1
1273 1 36 LYS HB3 1 36 LYS HD3 2.900 . 3.900 3.629 3.622 3.636 . 0 0 "[ . 1 . 2 .]" 1
1274 1 36 LYS HB3 1 36 LYS HG3 2.400 . 3.100 2.304 2.300 2.311 . 0 0 "[ . 1 . 2 .]" 1
1275 1 36 LYS HB3 1 37 ALA H 3.900 . 5.800 4.381 4.361 4.404 . 0 0 "[ . 1 . 2 .]" 1
1276 1 36 LYS HB3 1 37 ALA HA 4.000 . 6.000 4.841 4.817 4.866 . 0 0 "[ . 1 . 2 .]" 1
1277 1 36 LYS HB3 1 47 PHE HA 4.000 . 6.000 5.056 4.983 5.151 . 0 0 "[ . 1 . 2 .]" 1
1278 1 36 LYS HD2 1 36 LYS HG3 2.200 . 2.800 2.304 2.297 2.315 . 0 0 "[ . 1 . 2 .]" 1
1279 1 36 LYS HD2 1 37 ALA H 3.000 . 4.100 2.199 2.138 2.244 . 0 0 "[ . 1 . 2 .]" 1
1280 1 36 LYS HD2 1 46 GLY H 3.900 . 5.800 2.701 2.659 2.739 . 0 0 "[ . 1 . 2 .]" 1
1281 1 36 LYS HD2 1 47 PHE H 3.500 . 5.000 5.008 4.978 5.019 0.019 3 0 "[ . 1 . 2 .]" 1
1282 1 36 LYS HD2 1 47 PHE HA 3.000 . 4.100 3.782 3.745 3.805 . 0 0 "[ . 1 . 2 .]" 1
1283 1 36 LYS HD3 1 36 LYS HE2 2.800 . 3.800 2.861 2.853 2.867 . 0 0 "[ . 1 . 2 .]" 1
1284 1 36 LYS HD3 1 36 LYS HG3 2.500 . 3.300 2.987 2.983 2.992 . 0 0 "[ . 1 . 2 .]" 1
1285 1 36 LYS HD3 1 37 ALA H 3.100 . 4.300 3.114 3.071 3.162 . 0 0 "[ . 1 . 2 .]" 1
1286 1 36 LYS HD3 1 46 GLY H 2.800 . 3.800 3.355 3.301 3.423 . 0 0 "[ . 1 . 2 .]" 1
1287 1 36 LYS HD3 1 47 PHE HA 3.800 . 5.600 2.808 2.767 2.848 . 0 0 "[ . 1 . 2 .]" 1
1288 1 36 LYS HE2 1 36 LYS HG3 2.500 . 3.300 2.663 2.647 2.679 . 0 0 "[ . 1 . 2 .]" 1
1289 1 36 LYS HE2 1 45 GLU HB3 3.600 . 5.200 2.950 2.907 3.002 . 0 0 "[ . 1 . 2 .]" 1
1290 1 36 LYS HE2 1 47 PHE QD 3.600 . 5.200 4.439 4.354 4.503 . 0 0 "[ . 1 . 2 .]" 1
1291 1 36 LYS HE3 1 36 LYS HG3 2.500 . 3.300 3.322 3.308 3.332 0.032 22 0 "[ . 1 . 2 .]" 1
1292 1 36 LYS HE3 1 45 GLU HB3 3.700 . 5.400 1.979 1.965 1.987 0.035 16 0 "[ . 1 . 2 .]" 1
1293 1 36 LYS HE3 1 47 PHE QD 3.500 . 5.000 4.589 4.506 4.681 . 0 0 "[ . 1 . 2 .]" 1
1294 1 36 LYS HG3 1 37 ALA H 3.800 . 5.600 3.925 3.841 3.981 . 0 0 "[ . 1 . 2 .]" 1
1295 1 36 LYS HG3 1 46 GLY HA2 4.000 . 6.000 5.991 5.962 6.009 0.009 3 0 "[ . 1 . 2 .]" 1
1296 1 36 LYS HG3 1 47 PHE QD 3.500 . 5.000 5.025 5.013 5.038 0.038 19 0 "[ . 1 . 2 .]" 1
1297 1 37 ALA H 1 37 ALA HA 2.700 . 3.600 2.949 2.948 2.950 . 0 0 "[ . 1 . 2 .]" 1
1298 1 37 ALA H 1 37 ALA MB 2.400 . 3.100 2.494 2.485 2.514 . 0 0 "[ . 1 . 2 .]" 1
1299 1 37 ALA H 1 38 GLN H 4.700 . 6.000 4.458 4.449 4.465 . 0 0 "[ . 1 . 2 .]" 1
1300 1 37 ALA H 1 45 GLU HA 3.800 . 5.600 5.200 5.129 5.240 . 0 0 "[ . 1 . 2 .]" 1
1301 1 37 ALA H 1 46 GLY H 2.700 . 3.600 3.628 3.620 3.637 0.037 22 0 "[ . 1 . 2 .]" 1
1302 1 37 ALA H 1 47 PHE HA 2.800 . 3.800 3.256 3.178 3.381 . 0 0 "[ . 1 . 2 .]" 1
1303 1 37 ALA H 1 48 ILE H 3.400 . 4.900 3.837 3.619 4.044 . 0 0 "[ . 1 . 2 .]" 1
1304 1 37 ALA H 1 48 ILE MD 4.700 . 6.000 4.038 3.953 4.161 . 0 0 "[ . 1 . 2 .]" 1
1305 1 37 ALA H 1 48 ILE MG 3.500 . 5.000 2.966 2.844 3.105 . 0 0 "[ . 1 . 2 .]" 1
1306 1 37 ALA HA 1 37 ALA MB 2.000 . 2.500 2.101 2.097 2.104 . 0 0 "[ . 1 . 2 .]" 1
1307 1 37 ALA HA 1 38 GLN H 2.100 . 2.700 2.202 2.194 2.213 . 0 0 "[ . 1 . 2 .]" 1
1308 1 37 ALA HA 1 46 GLY H 5.000 . 6.000 5.295 5.245 5.363 . 0 0 "[ . 1 . 2 .]" 1
1309 1 37 ALA HA 1 48 ILE MD 3.800 . 5.600 4.266 4.224 4.427 . 0 0 "[ . 1 . 2 .]" 1
1310 1 37 ALA HA 1 48 ILE HG13 4.600 . 6.000 5.801 5.730 5.843 . 0 0 "[ . 1 . 2 .]" 1
1311 1 37 ALA MB 1 38 GLN H 3.600 2.600 4.600 2.820 2.782 2.843 . 0 0 "[ . 1 . 2 .]" 1
1312 1 37 ALA MB 1 38 GLN HA 3.700 . 5.400 4.051 4.038 4.064 . 0 0 "[ . 1 . 2 .]" 1
1313 1 37 ALA MB 1 39 SER H 4.800 . 6.000 4.292 4.275 4.309 . 0 0 "[ . 1 . 2 .]" 1
1314 1 37 ALA MB 1 45 GLU HA 4.400 . 6.000 5.131 5.067 5.165 . 0 0 "[ . 1 . 2 .]" 1
1315 1 37 ALA MB 1 46 GLY H 3.800 . 5.600 4.599 4.539 4.684 . 0 0 "[ . 1 . 2 .]" 1
1316 1 37 ALA MB 1 47 PHE HA 4.400 . 6.000 4.814 4.746 4.924 . 0 0 "[ . 1 . 2 .]" 1
1317 1 37 ALA MB 1 48 ILE H 4.200 . 6.000 4.375 4.193 4.552 . 0 0 "[ . 1 . 2 .]" 1
1318 1 37 ALA MB 1 48 ILE MD 2.200 . 2.800 1.903 1.866 2.112 . 0 0 "[ . 1 . 2 .]" 1
1319 1 37 ALA MB 1 48 ILE HG12 2.300 . 3.000 2.044 1.962 2.129 . 0 0 "[ . 1 . 2 .]" 1
1320 1 38 GLN H 1 38 GLN HA 2.700 . 3.600 2.940 2.939 2.943 . 0 0 "[ . 1 . 2 .]" 1
1321 1 38 GLN H 1 38 GLN HB2 2.500 . 3.300 3.101 3.085 3.112 . 0 0 "[ . 1 . 2 .]" 1
1322 1 38 GLN H 1 38 GLN HB3 2.400 . 3.100 2.503 2.486 2.517 . 0 0 "[ . 1 . 2 .]" 1
1323 1 38 GLN H 1 38 GLN HG2 3.500 . 5.000 4.250 4.242 4.255 . 0 0 "[ . 1 . 2 .]" 1
1324 1 38 GLN H 1 38 GLN HG3 3.400 . 4.800 4.729 4.725 4.736 . 0 0 "[ . 1 . 2 .]" 1
1325 1 38 GLN H 1 39 SER H 5.800 . 6.000 4.174 4.156 4.195 . 0 0 "[ . 1 . 2 .]" 1
1326 1 38 GLN H 1 45 GLU HA 3.700 . 5.400 5.083 5.043 5.131 . 0 0 "[ . 1 . 2 .]" 1
1327 1 38 GLN H 1 48 ILE MD 4.300 . 6.000 5.440 5.339 5.595 . 0 0 "[ . 1 . 2 .]" 1
1328 1 38 GLN HA 1 38 GLN HB2 2.500 . 3.300 2.399 2.396 2.402 . 0 0 "[ . 1 . 2 .]" 1
1329 1 38 GLN HA 1 38 GLN HB3 3.000 . 4.100 3.026 3.025 3.027 . 0 0 "[ . 1 . 2 .]" 1
1330 1 38 GLN HA 1 38 GLN HG2 2.700 . 3.600 3.004 2.997 3.013 . 0 0 "[ . 1 . 2 .]" 1
1331 1 38 GLN HA 1 38 GLN HG3 3.600 . 5.200 2.777 2.766 2.792 . 0 0 "[ . 1 . 2 .]" 1
1332 1 38 GLN HA 1 39 SER H 2.100 . 2.600 2.125 2.120 2.132 . 0 0 "[ . 1 . 2 .]" 1
1333 1 38 GLN HA 1 39 SER HB2 3.400 . 4.900 4.082 4.071 4.095 . 0 0 "[ . 1 . 2 .]" 1
1334 1 38 GLN HA 1 39 SER HB3 4.000 . 6.000 5.345 5.338 5.355 . 0 0 "[ . 1 . 2 .]" 1
1335 1 38 GLN HA 1 45 GLU H 4.300 . 6.000 4.794 4.762 4.840 . 0 0 "[ . 1 . 2 .]" 1
1336 1 38 GLN HA 1 45 GLU HA 2.100 . 2.600 2.396 2.351 2.462 . 0 0 "[ . 1 . 2 .]" 1
1337 1 38 GLN HA 1 45 GLU HB2 3.500 . 5.000 4.985 4.909 5.007 0.007 25 0 "[ . 1 . 2 .]" 1
1338 1 38 GLN HA 1 45 GLU HB3 3.800 . 5.700 4.049 3.951 4.189 . 0 0 "[ . 1 . 2 .]" 1
1339 1 38 GLN HA 1 45 GLU HG3 4.400 . 6.000 3.162 2.708 3.384 . 0 0 "[ . 1 . 2 .]" 1
1340 1 38 GLN HA 1 46 GLY H 3.000 . 4.100 3.664 3.585 3.799 . 0 0 "[ . 1 . 2 .]" 1
1341 1 38 GLN HB2 1 38 GLN HE21 3.200 . 4.400 3.922 3.879 4.000 . 0 0 "[ . 1 . 2 .]" 1
1342 1 38 GLN HB2 1 38 GLN HE22 4.200 . 6.000 4.509 4.485 4.556 . 0 0 "[ . 1 . 2 .]" 1
1343 1 38 GLN HB2 1 38 GLN HG2 2.200 . 2.800 2.953 2.951 2.955 0.155 25 0 "[ . 1 . 2 .]" 1
1344 1 38 GLN HB2 1 38 GLN HG3 2.300 . 3.000 2.334 2.328 2.336 . 0 0 "[ . 1 . 2 .]" 1
1345 1 38 GLN HB2 1 39 SER H 3.100 . 4.300 4.306 4.302 4.309 0.009 7 0 "[ . 1 . 2 .]" 1
1346 1 38 GLN HB2 1 45 GLU HA 3.400 . 4.900 3.862 3.749 4.001 . 0 0 "[ . 1 . 2 .]" 1
1347 1 38 GLN HB3 1 38 GLN HE21 3.300 . 4.700 2.709 2.647 2.822 . 0 0 "[ . 1 . 2 .]" 1
1348 1 38 GLN HB3 1 38 GLN HE22 4.200 . 6.000 3.673 3.646 3.722 . 0 0 "[ . 1 . 2 .]" 1
1349 1 38 GLN HB3 1 38 GLN HG2 2.200 . 2.800 2.523 2.520 2.527 . 0 0 "[ . 1 . 2 .]" 1
1350 1 38 GLN HB3 1 39 SER H 3.200 . 4.500 4.403 4.399 4.409 . 0 0 "[ . 1 . 2 .]" 1
1351 1 38 GLN HB3 1 45 GLU HA 3.700 . 5.400 5.130 5.039 5.242 . 0 0 "[ . 1 . 2 .]" 1
1352 1 38 GLN HE21 1 38 GLN HG2 2.700 . 3.600 2.289 2.250 2.312 . 0 0 "[ . 1 . 2 .]" 1
1353 1 38 GLN HE21 1 38 GLN HG3 2.800 . 3.700 3.495 3.474 3.506 . 0 0 "[ . 1 . 2 .]" 1
1354 1 38 GLN HE21 1 40 LEU HG 5.900 . 6.000 3.450 3.293 3.541 . 0 0 "[ . 1 . 2 .]" 1
1355 1 38 GLN HE21 1 43 GLY HA2 4.200 . 6.000 4.501 4.430 4.546 . 0 0 "[ . 1 . 2 .]" 1
1356 1 38 GLN HE21 1 45 GLU HG3 4.000 . 6.000 5.565 5.444 5.624 . 0 0 "[ . 1 . 2 .]" 1
1357 1 38 GLN HE22 1 38 GLN HG2 3.400 . 4.800 3.500 3.484 3.509 . 0 0 "[ . 1 . 2 .]" 1
1358 1 38 GLN HE22 1 38 GLN HG3 3.000 . 4.100 4.072 4.061 4.078 . 0 0 "[ . 1 . 2 .]" 1
1359 1 38 GLN HE22 1 43 GLY HA2 5.300 . 6.000 5.641 5.615 5.661 . 0 0 "[ . 1 . 2 .]" 1
1360 1 38 GLN HE22 1 43 GLY HA3 4.000 . 6.000 6.006 6.002 6.011 0.011 2 0 "[ . 1 . 2 .]" 1
1361 1 38 GLN HE22 1 45 GLU HG3 4.900 . 6.000 6.001 5.947 6.012 0.012 19 0 "[ . 1 . 2 .]" 1
1362 1 38 GLN HG2 1 39 SER H 2.500 . 3.300 3.340 3.329 3.348 0.048 24 0 "[ . 1 . 2 .]" 1
1363 1 38 GLN HG2 1 43 GLY HA2 3.700 . 5.400 2.972 2.959 2.998 . 0 0 "[ . 1 . 2 .]" 1
1364 1 38 GLN HG2 1 43 GLY HA3 3.100 . 4.300 3.999 3.973 4.046 . 0 0 "[ . 1 . 2 .]" 1
1365 1 38 GLN HG2 1 45 GLU HA 3.800 . 5.600 4.702 4.627 4.818 . 0 0 "[ . 1 . 2 .]" 1
1366 1 38 GLN HG3 1 39 SER H 2.800 . 3.700 3.735 3.729 3.743 0.043 21 0 "[ . 1 . 2 .]" 1
1367 1 38 GLN HG3 1 43 GLY HA2 3.300 . 4.600 3.826 3.813 3.837 . 0 0 "[ . 1 . 2 .]" 1
1368 1 38 GLN HG3 1 43 GLY HA3 3.100 . 4.300 4.369 4.361 4.374 0.074 16 0 "[ . 1 . 2 .]" 1
1369 1 38 GLN HG3 1 45 GLU HA 6.000 . 6.000 3.703 3.590 3.873 . 0 0 "[ . 1 . 2 .]" 1
1370 1 39 SER H 1 39 SER HA 2.700 . 3.600 2.739 2.734 2.747 . 0 0 "[ . 1 . 2 .]" 1
1371 1 39 SER H 1 39 SER HB2 2.800 . 3.700 2.032 2.026 2.038 . 0 0 "[ . 1 . 2 .]" 1
1372 1 39 SER H 1 39 SER HB3 2.600 . 3.200 3.321 3.316 3.326 0.126 2 0 "[ . 1 . 2 .]" 1
1373 1 39 SER H 1 40 LEU H 3.400 . 4.800 4.621 4.616 4.630 . 0 0 "[ . 1 . 2 .]" 1
1374 1 39 SER H 1 42 THR H 4.600 . 6.000 5.842 5.830 5.865 . 0 0 "[ . 1 . 2 .]" 1
1375 1 39 SER H 1 43 GLY H 3.800 . 5.600 4.447 4.434 4.460 . 0 0 "[ . 1 . 2 .]" 1
1376 1 39 SER H 1 43 GLY HA2 3.800 . 5.600 3.523 3.498 3.539 . 0 0 "[ . 1 . 2 .]" 1
1377 1 39 SER H 1 43 GLY HA3 4.400 . 6.000 4.959 4.931 4.978 . 0 0 "[ . 1 . 2 .]" 1
1378 1 39 SER H 1 44 GLN H 3.300 . 4.700 4.262 4.233 4.293 . 0 0 "[ . 1 . 2 .]" 1
1379 1 39 SER H 1 44 GLN QG 4.500 . 6.000 6.020 6.013 6.025 0.025 16 0 "[ . 1 . 2 .]" 1
1380 1 39 SER H 1 45 GLU HA 2.800 . 3.800 3.268 3.202 3.302 . 0 0 "[ . 1 . 2 .]" 1
1381 1 39 SER H 1 45 GLU HG3 4.500 . 6.000 4.103 3.828 4.265 . 0 0 "[ . 1 . 2 .]" 1
1382 1 39 SER HA 1 40 LEU H 2.100 . 2.700 2.447 2.434 2.454 . 0 0 "[ . 1 . 2 .]" 1
1383 1 39 SER HA 1 41 THR H 3.000 . 4.100 4.158 4.153 4.166 0.066 3 0 "[ . 1 . 2 .]" 1
1384 1 39 SER HB2 1 40 LEU H 3.500 . 5.100 3.977 3.956 4.020 . 0 0 "[ . 1 . 2 .]" 1
1385 1 39 SER HB2 1 42 THR H 3.400 . 4.800 4.184 4.163 4.230 . 0 0 "[ . 1 . 2 .]" 1
1386 1 39 SER HB2 1 42 THR HG1 4.100 . 6.000 2.817 2.616 3.512 . 0 0 "[ . 1 . 2 .]" 1
1387 1 39 SER HB2 1 42 THR MG 3.800 . 5.600 4.207 4.175 4.253 . 0 0 "[ . 1 . 2 .]" 1
1388 1 39 SER HB2 1 43 GLY H 2.500 . 3.300 2.986 2.970 3.015 . 0 0 "[ . 1 . 2 .]" 1
1389 1 39 SER HB2 1 43 GLY HA2 2.400 . 3.100 3.153 3.140 3.159 0.059 22 0 "[ . 1 . 2 .]" 1
1390 1 39 SER HB2 1 44 GLN H 4.000 . 6.000 2.730 2.707 2.758 . 0 0 "[ . 1 . 2 .]" 1
1391 1 39 SER HB3 1 40 LEU H 4.300 . 6.000 2.658 2.628 2.721 . 0 0 "[ . 1 . 2 .]" 1
1392 1 39 SER HB3 1 41 THR H 3.100 . 4.300 3.187 3.156 3.238 . 0 0 "[ . 1 . 2 .]" 1
1393 1 39 SER HB3 1 42 THR H 3.300 . 4.600 2.557 2.543 2.588 . 0 0 "[ . 1 . 2 .]" 1
1394 1 39 SER HB3 1 42 THR HG1 3.500 . 5.000 2.316 2.033 3.393 . 0 0 "[ . 1 . 2 .]" 1
1395 1 39 SER HB3 1 42 THR MG 3.500 . 5.000 3.239 3.217 3.256 . 0 0 "[ . 1 . 2 .]" 1
1396 1 39 SER HB3 1 43 GLY H 2.800 . 3.800 1.693 1.686 1.698 0.114 12 0 "[ . 1 . 2 .]" 1
1397 1 39 SER HB3 1 43 GLY HA2 2.100 . 2.700 2.763 2.759 2.768 0.068 18 0 "[ . 1 . 2 .]" 1
1398 1 39 SER HB3 1 44 GLN H 2.700 . 3.600 2.965 2.915 2.989 . 0 0 "[ . 1 . 2 .]" 1
1399 1 40 LEU H 1 40 LEU HA 2.500 . 3.300 2.946 2.945 2.949 . 0 0 "[ . 1 . 2 .]" 1
1400 1 40 LEU H 1 40 LEU HB2 2.100 . 2.600 2.536 2.526 2.544 . 0 0 "[ . 1 . 2 .]" 1
1401 1 40 LEU H 1 40 LEU HB3 3.500 2.700 4.300 3.701 3.695 3.707 . 0 0 "[ . 1 . 2 .]" 1
1402 1 40 LEU H 1 40 LEU MD1 2.800 . 3.800 2.803 2.774 2.825 . 0 0 "[ . 1 . 2 .]" 1
1403 1 40 LEU H 1 40 LEU HG 2.800 . 3.800 3.774 3.763 3.791 . 0 0 "[ . 1 . 2 .]" 1
1404 1 40 LEU H 1 41 THR H 2.400 . 3.100 1.860 1.849 1.885 . 0 0 "[ . 1 . 2 .]" 1
1405 1 40 LEU H 1 41 THR MG 4.900 . 6.000 5.195 5.184 5.218 . 0 0 "[ . 1 . 2 .]" 1
1406 1 40 LEU H 1 42 THR H 6.000 . 6.000 3.329 3.308 3.358 . 0 0 "[ . 1 . 2 .]" 1
1407 1 40 LEU H 1 43 GLY H 6.000 . 6.000 3.358 3.333 3.387 . 0 0 "[ . 1 . 2 .]" 1
1408 1 40 LEU HA 1 40 LEU HB3 2.000 . 2.500 2.542 2.540 2.545 0.045 16 0 "[ . 1 . 2 .]" 1
1409 1 40 LEU HA 1 40 LEU HG 2.600 . 3.500 2.205 2.197 2.212 . 0 0 "[ . 1 . 2 .]" 1
1410 1 40 LEU HA 1 41 THR H 3.500 . 5.000 3.439 3.436 3.442 . 0 0 "[ . 1 . 2 .]" 1
1411 1 40 LEU HA 1 42 THR H 3.700 . 5.400 4.402 4.380 4.433 . 0 0 "[ . 1 . 2 .]" 1
1412 1 40 LEU HA 1 43 GLY H 5.000 . 6.000 3.801 3.777 3.821 . 0 0 "[ . 1 . 2 .]" 1
1413 1 40 LEU HB2 1 41 THR H 2.500 . 3.300 3.105 3.090 3.121 . 0 0 "[ . 1 . 2 .]" 1
1414 1 40 LEU HB3 1 40 LEU MD1 2.400 . 3.000 3.058 3.054 3.065 0.065 3 0 "[ . 1 . 2 .]" 1
1415 1 40 LEU HB3 1 41 THR H 2.800 . 3.800 3.832 3.828 3.836 0.036 3 0 "[ . 1 . 2 .]" 1
1416 1 40 LEU HB3 1 41 THR HA 3.400 . 4.800 4.416 4.405 4.423 . 0 0 "[ . 1 . 2 .]" 1
1417 1 40 LEU MD1 1 41 THR H 3.500 . 5.000 4.152 4.125 4.172 . 0 0 "[ . 1 . 2 .]" 1
1418 1 40 LEU MD1 1 43 GLY HA3 4.700 . 6.000 6.064 6.059 6.069 0.069 10 0 "[ . 1 . 2 .]" 1
1419 1 40 LEU HG 1 41 THR H 4.100 . 6.000 4.913 4.903 4.930 . 0 0 "[ . 1 . 2 .]" 1
1420 1 41 THR H 1 41 THR HA 2.400 . 3.100 2.890 2.888 2.892 . 0 0 "[ . 1 . 2 .]" 1
1421 1 41 THR H 1 41 THR HB 2.400 . 3.100 2.719 2.705 2.725 . 0 0 "[ . 1 . 2 .]" 1
1422 1 41 THR H 1 41 THR MG 2.700 . 3.600 3.714 3.712 3.721 0.121 3 0 "[ . 1 . 2 .]" 1
1423 1 41 THR H 1 42 THR H 2.300 . 3.000 2.223 2.219 2.226 . 0 0 "[ . 1 . 2 .]" 1
1424 1 41 THR H 1 42 THR HB 3.900 . 5.800 5.844 5.839 5.847 0.047 24 0 "[ . 1 . 2 .]" 1
1425 1 41 THR H 1 42 THR MG 3.600 . 5.200 3.446 3.437 3.458 . 0 0 "[ . 1 . 2 .]" 1
1426 1 41 THR H 1 43 GLY H 3.200 . 4.500 3.189 3.179 3.201 . 0 0 "[ . 1 . 2 .]" 1
1427 1 41 THR HA 1 41 THR HB 3.200 2.700 3.700 3.002 3.001 3.005 . 0 0 "[ . 1 . 2 .]" 1
1428 1 41 THR HA 1 41 THR MG 2.500 . 3.300 2.174 2.171 2.181 . 0 0 "[ . 1 . 2 .]" 1
1429 1 41 THR HA 1 42 THR H 3.000 . 4.100 3.473 3.471 3.475 . 0 0 "[ . 1 . 2 .]" 1
1430 1 41 THR HB 1 41 THR MG 2.000 . 2.500 2.097 2.094 2.098 . 0 0 "[ . 1 . 2 .]" 1
1431 1 41 THR HB 1 42 THR H 2.500 . 3.300 2.530 2.497 2.552 . 0 0 "[ . 1 . 2 .]" 1
1432 1 41 THR HB 1 42 THR MG 2.700 . 3.600 2.273 2.253 2.290 . 0 0 "[ . 1 . 2 .]" 1
1433 1 41 THR MG 1 42 THR H 3.500 . 5.000 3.807 3.787 3.822 . 0 0 "[ . 1 . 2 .]" 1
1434 1 41 THR MG 1 42 THR HB 3.600 . 5.200 5.273 5.260 5.280 0.080 20 0 "[ . 1 . 2 .]" 1
1435 1 41 THR MG 1 42 THR HG1 5.000 . 6.000 5.649 5.547 6.020 0.020 8 0 "[ . 1 . 2 .]" 1
1436 1 42 THR H 1 42 THR HB 2.700 . 3.600 3.641 3.636 3.645 0.045 9 0 "[ . 1 . 2 .]" 1
1437 1 42 THR H 1 42 THR MG 2.300 . 3.000 1.983 1.967 1.996 . 0 0 "[ . 1 . 2 .]" 1
1438 1 42 THR H 1 43 GLY H 2.300 . 3.000 1.857 1.848 1.870 . 0 0 "[ . 1 . 2 .]" 1
1439 1 42 THR H 1 43 GLY HA2 3.900 . 5.800 3.993 3.981 4.011 . 0 0 "[ . 1 . 2 .]" 1
1440 1 42 THR H 1 43 GLY HA3 3.700 . 5.400 4.485 4.473 4.501 . 0 0 "[ . 1 . 2 .]" 1
1441 1 42 THR H 1 44 GLN H 3.200 . 4.400 3.927 3.916 3.940 . 0 0 "[ . 1 . 2 .]" 1
1442 1 42 THR HA 1 42 THR HB 1.600 . 2.200 2.277 2.275 2.280 0.080 11 0 "[ . 1 . 2 .]" 1
1443 1 42 THR HA 1 42 THR MG 3.000 . 4.100 2.716 2.708 2.723 . 0 0 "[ . 1 . 2 .]" 1
1444 1 42 THR HB 1 42 THR HG1 2.800 . 3.800 2.728 2.346 2.822 . 0 0 "[ . 1 . 2 .]" 1
1445 1 42 THR HB 1 42 THR MG 2.200 . 2.800 2.115 2.114 2.117 . 0 0 "[ . 1 . 2 .]" 1
1446 1 42 THR HB 1 43 GLY H 2.800 . 3.800 3.913 3.908 3.921 0.121 6 0 "[ . 1 . 2 .]" 1
1447 1 42 THR HB 1 44 GLN HG2 3.300 . 4.700 4.762 4.758 4.767 0.067 24 0 "[ . 1 . 2 .]" 1
1448 1 42 THR HB 1 44 GLN HG3 3.200 . 4.500 4.512 4.506 4.517 0.017 1 0 "[ . 1 . 2 .]" 1
1449 1 42 THR HG1 1 42 THR MG 2.600 . 3.400 2.196 2.098 2.241 . 0 0 "[ . 1 . 2 .]" 1
1450 1 42 THR HG1 1 44 GLN HB2 3.100 . 4.300 2.569 2.052 2.732 . 0 0 "[ . 1 . 2 .]" 1
1451 1 42 THR HG1 1 44 GLN HB3 3.300 . 4.700 4.293 3.755 4.461 . 0 0 "[ . 1 . 2 .]" 1
1452 1 42 THR HG1 1 44 GLN HG2 4.300 . 6.000 4.775 3.929 4.999 . 0 0 "[ . 1 . 2 .]" 1
1453 1 42 THR HG1 1 44 GLN HG3 4.300 . 6.000 4.568 4.046 4.710 . 0 0 "[ . 1 . 2 .]" 1
1454 1 42 THR MG 1 43 GLY H 3.100 . 4.300 3.157 3.151 3.166 . 0 0 "[ . 1 . 2 .]" 1
1455 1 42 THR MG 1 43 GLY HA2 3.500 . 5.000 5.064 5.056 5.071 0.071 11 0 "[ . 1 . 2 .]" 1
1456 1 42 THR MG 1 44 GLN H 3.800 . 5.600 3.752 3.741 3.772 . 0 0 "[ . 1 . 2 .]" 1
1457 1 42 THR MG 1 44 GLN HG2 3.700 . 5.400 5.123 5.089 5.151 . 0 0 "[ . 1 . 2 .]" 1
1458 1 42 THR MG 1 44 GLN QG 3.800 . 5.600 4.634 4.610 4.658 . 0 0 "[ . 1 . 2 .]" 1
1459 1 43 GLY H 1 43 GLY HA2 2.100 . 2.700 2.251 2.248 2.255 . 0 0 "[ . 1 . 2 .]" 1
1460 1 43 GLY H 1 43 GLY HA3 2.100 . 2.700 2.842 2.839 2.846 0.146 16 0 "[ . 1 . 2 .]" 1
1461 1 43 GLY H 1 44 GLN H 2.200 . 2.800 2.602 2.590 2.615 . 0 0 "[ . 1 . 2 .]" 1
1462 1 43 GLY HA2 1 44 GLN H 2.900 . 4.000 3.273 3.260 3.293 . 0 0 "[ . 1 . 2 .]" 1
1463 1 43 GLY HA3 1 44 GLN H 3.000 . 4.100 3.299 3.279 3.313 . 0 0 "[ . 1 . 2 .]" 1
1464 1 44 GLN H 1 44 GLN HA 2.200 . 2.800 2.722 2.714 2.728 . 0 0 "[ . 1 . 2 .]" 1
1465 1 44 GLN H 1 44 GLN HB2 2.200 . 2.800 2.175 2.170 2.180 . 0 0 "[ . 1 . 2 .]" 1
1466 1 44 GLN H 1 44 GLN HB3 2.400 . 3.400 3.470 3.467 3.473 0.073 12 0 "[ . 1 . 2 .]" 1
1467 1 44 GLN H 1 44 GLN HG2 2.900 . 4.000 4.049 4.044 4.054 0.054 23 0 "[ . 1 . 2 .]" 1
1468 1 44 GLN H 1 44 GLN HG3 2.400 . 3.100 3.188 3.185 3.191 0.091 1 0 "[ . 1 . 2 .]" 1
1469 1 44 GLN H 1 45 GLU H 3.200 . 4.500 4.453 4.443 4.473 . 0 0 "[ . 1 . 2 .]" 1
1470 1 44 GLN HA 1 44 GLN HB2 2.200 . 2.800 2.944 2.942 2.946 0.146 17 0 "[ . 1 . 2 .]" 1
1471 1 44 GLN HA 1 44 GLN HB3 2.500 . 3.300 2.628 2.624 2.634 . 0 0 "[ . 1 . 2 .]" 1
1472 1 44 GLN HA 1 44 GLN HG2 2.800 . 3.800 3.270 3.262 3.278 . 0 0 "[ . 1 . 2 .]" 1
1473 1 44 GLN HA 1 44 GLN QG 2.400 . 3.100 1.998 1.993 2.004 . 0 0 "[ . 1 . 2 .]" 1
1474 1 44 GLN HA 1 44 GLN HG3 3.000 . 4.200 2.016 2.011 2.022 . 0 0 "[ . 1 . 2 .]" 1
1475 1 44 GLN HA 1 45 GLU H 1.900 . 2.300 2.101 2.096 2.111 . 0 0 "[ . 1 . 2 .]" 1
1476 1 44 GLN HA 1 45 GLU HA 4.900 3.900 5.900 4.348 4.345 4.352 . 0 0 "[ . 1 . 2 .]" 1
1477 1 44 GLN HB2 1 44 GLN HG2 3.000 . 4.100 2.720 2.717 2.723 . 0 0 "[ . 1 . 2 .]" 1
1478 1 44 GLN HB2 1 44 GLN QG 2.200 . 2.800 2.491 2.490 2.492 . 0 0 "[ . 1 . 2 .]" 1
1479 1 44 GLN HB2 1 44 GLN HG3 2.800 . 3.800 2.891 2.888 2.893 . 0 0 "[ . 1 . 2 .]" 1
1480 1 44 GLN HB2 1 45 GLU H 3.200 . 4.400 4.392 4.381 4.401 0.001 18 0 "[ . 1 . 2 .]" 1
1481 1 44 GLN HB3 1 44 GLN HG2 2.500 . 3.300 2.219 2.217 2.221 . 0 0 "[ . 1 . 2 .]" 1
1482 1 44 GLN HB3 1 44 GLN QG 2.300 . 3.000 2.123 2.122 2.125 . 0 0 "[ . 1 . 2 .]" 1
1483 1 44 GLN HB3 1 44 GLN HG3 2.500 . 3.300 2.709 2.706 2.713 . 0 0 "[ . 1 . 2 .]" 1
1484 1 44 GLN HB3 1 45 GLU H 3.000 . 4.100 3.467 3.429 3.489 . 0 0 "[ . 1 . 2 .]" 1
1485 1 44 GLN HE21 1 44 GLN HG2 3.100 . 4.300 2.759 2.375 3.223 . 0 0 "[ . 1 . 2 .]" 1
1486 1 44 GLN HE21 1 44 GLN HG3 3.100 . 4.300 2.974 2.117 3.553 . 0 0 "[ . 1 . 2 .]" 1
1487 1 44 GLN HE22 1 44 GLN HG2 3.900 . 5.800 3.711 3.537 3.925 . 0 0 "[ . 1 . 2 .]" 1
1488 1 44 GLN HE22 1 44 GLN HG3 3.500 . 5.000 3.832 3.436 4.101 . 0 0 "[ . 1 . 2 .]" 1
1489 1 44 GLN HG2 1 45 GLU H 3.300 . 4.700 4.706 4.665 4.717 0.017 24 0 "[ . 1 . 2 .]" 1
1490 1 44 GLN HG3 1 45 GLU H 2.800 . 3.700 3.834 3.818 3.843 0.143 24 0 "[ . 1 . 2 .]" 1
1491 1 45 GLU H 1 45 GLU HA 2.600 . 3.400 2.907 2.903 2.917 . 0 0 "[ . 1 . 2 .]" 1
1492 1 45 GLU H 1 45 GLU HB2 2.400 . 3.100 2.481 2.372 2.537 . 0 0 "[ . 1 . 2 .]" 1
1493 1 45 GLU H 1 45 GLU HB3 2.700 . 3.600 3.632 3.610 3.641 0.041 4 0 "[ . 1 . 2 .]" 1
1494 1 45 GLU H 1 45 GLU HG3 2.700 . 3.600 2.741 2.568 3.113 . 0 0 "[ . 1 . 2 .]" 1
1495 1 45 GLU H 1 46 GLY H 3.800 . 5.600 4.580 4.573 4.586 . 0 0 "[ . 1 . 2 .]" 1
1496 1 45 GLU HA 1 45 GLU HB2 2.500 . 3.300 3.013 3.006 3.015 . 0 0 "[ . 1 . 2 .]" 1
1497 1 45 GLU HA 1 45 GLU HB3 2.600 . 3.400 2.462 2.427 2.544 . 0 0 "[ . 1 . 2 .]" 1
1498 1 45 GLU HA 1 45 GLU HG2 2.400 . 3.100 3.126 3.117 3.132 0.032 4 0 "[ . 1 . 2 .]" 1
1499 1 45 GLU HA 1 45 GLU HG3 3.000 . 4.100 2.501 2.337 2.582 . 0 0 "[ . 1 . 2 .]" 1
1500 1 45 GLU HA 1 46 GLY H 2.100 . 2.600 2.225 2.205 2.258 . 0 0 "[ . 1 . 2 .]" 1
1501 1 45 GLU HA 1 46 GLY HA2 3.900 . 5.800 4.498 4.479 4.529 . 0 0 "[ . 1 . 2 .]" 1
1502 1 45 GLU HA 1 46 GLY HA3 3.600 . 5.200 4.314 4.305 4.318 . 0 0 "[ . 1 . 2 .]" 1
1503 1 45 GLU HB2 1 45 GLU HG2 2.200 . 2.800 2.853 2.842 2.859 0.059 24 0 "[ . 1 . 2 .]" 1
1504 1 45 GLU HB2 1 45 GLU HG3 2.900 . 4.000 2.791 2.782 2.804 . 0 0 "[ . 1 . 2 .]" 1
1505 1 45 GLU HB2 1 46 GLY H 2.900 . 3.900 3.924 3.915 3.945 0.045 16 0 "[ . 1 . 2 .]" 1
1506 1 45 GLU HB3 1 45 GLU HG2 2.000 . 2.500 2.198 2.197 2.199 . 0 0 "[ . 1 . 2 .]" 1
1507 1 45 GLU HB3 1 45 GLU HG3 2.500 . 3.300 2.867 2.856 2.875 . 0 0 "[ . 1 . 2 .]" 1
1508 1 45 GLU HB3 1 46 GLY H 2.600 . 3.400 2.848 2.719 2.928 . 0 0 "[ . 1 . 2 .]" 1
1509 1 45 GLU HG2 1 46 GLY H 3.400 . 4.900 4.425 4.144 4.553 . 0 0 "[ . 1 . 2 .]" 1
1510 1 45 GLU HG3 1 46 GLY H 4.000 . 6.000 4.489 4.225 4.603 . 0 0 "[ . 1 . 2 .]" 1
1511 1 46 GLY H 1 46 GLY HA2 2.600 . 3.400 2.772 2.745 2.792 . 0 0 "[ . 1 . 2 .]" 1
1512 1 46 GLY H 1 46 GLY HA3 2.600 . 3.400 2.841 2.824 2.860 . 0 0 "[ . 1 . 2 .]" 1
1513 1 46 GLY H 1 48 ILE MD 6.000 3.500 7.600 6.576 6.477 6.681 . 0 0 "[ . 1 . 2 .]" 1
1514 1 46 GLY H 1 48 ILE MG 3.700 . 5.400 4.493 4.389 4.579 . 0 0 "[ . 1 . 2 .]" 1
1515 1 46 GLY HA2 1 47 PHE H 2.400 . 3.100 2.534 2.518 2.559 . 0 0 "[ . 1 . 2 .]" 1
1516 1 46 GLY HA2 1 47 PHE HB3 4.300 . 6.000 5.741 5.722 5.753 . 0 0 "[ . 1 . 2 .]" 1
1517 1 46 GLY HA3 1 47 PHE H 2.300 . 3.000 2.582 2.552 2.596 . 0 0 "[ . 1 . 2 .]" 1
1518 1 46 GLY HA3 1 47 PHE HA 4.300 . 6.000 4.550 4.530 4.565 . 0 0 "[ . 1 . 2 .]" 1
1519 1 47 PHE H 1 47 PHE HA 2.700 . 3.600 2.892 2.884 2.901 . 0 0 "[ . 1 . 2 .]" 1
1520 1 47 PHE H 1 47 PHE HB2 2.300 . 3.000 2.139 2.126 2.153 . 0 0 "[ . 1 . 2 .]" 1
1521 1 47 PHE H 1 47 PHE HB3 2.500 . 3.300 3.404 3.392 3.414 0.114 19 0 "[ . 1 . 2 .]" 1
1522 1 47 PHE H 1 47 PHE QD 2.800 . 3.800 2.860 2.789 2.943 . 0 0 "[ . 1 . 2 .]" 1
1523 1 47 PHE H 1 48 ILE H 4.600 . 6.000 4.573 4.545 4.594 . 0 0 "[ . 1 . 2 .]" 1
1524 1 47 PHE HA 1 47 PHE HB3 2.200 . 2.800 2.708 2.693 2.721 . 0 0 "[ . 1 . 2 .]" 1
1525 1 47 PHE HA 1 47 PHE QD 3.200 . 4.500 2.554 2.458 2.686 . 0 0 "[ . 1 . 2 .]" 1
1526 1 47 PHE HA 1 48 ILE H 2.000 . 2.500 2.268 2.210 2.347 . 0 0 "[ . 1 . 2 .]" 1
1527 1 47 PHE HA 1 48 ILE MD 5.500 . 6.000 5.379 5.319 5.462 . 0 0 "[ . 1 . 2 .]" 1
1528 1 47 PHE HA 1 48 ILE HG12 3.500 . 5.000 4.020 3.935 4.137 . 0 0 "[ . 1 . 2 .]" 1
1529 1 47 PHE HA 1 48 ILE HG13 3.700 . 5.400 4.640 4.571 4.715 . 0 0 "[ . 1 . 2 .]" 1
1530 1 47 PHE HA 1 48 ILE MG 3.700 . 5.400 3.568 3.487 3.663 . 0 0 "[ . 1 . 2 .]" 1
1531 1 47 PHE HB2 1 48 ILE H 3.100 . 4.300 4.210 4.079 4.305 0.005 16 0 "[ . 1 . 2 .]" 1
1532 1 47 PHE HB3 1 47 PHE QD 2.300 . 2.900 2.290 2.275 2.299 . 0 0 "[ . 1 . 2 .]" 1
1533 1 47 PHE HB3 1 48 ILE H 2.900 . 4.000 3.011 2.787 3.185 . 0 0 "[ . 1 . 2 .]" 1
1534 1 47 PHE QD 1 48 ILE H 3.300 . 4.600 4.008 3.905 4.098 . 0 0 "[ . 1 . 2 .]" 1
1535 1 48 ILE H 1 48 ILE HA 2.800 . 3.800 2.929 2.912 2.942 . 0 0 "[ . 1 . 2 .]" 1
1536 1 48 ILE H 1 48 ILE HB 3.500 . 5.100 3.896 3.846 3.945 . 0 0 "[ . 1 . 2 .]" 1
1537 1 48 ILE H 1 48 ILE MD 3.600 . 5.200 4.086 3.999 4.161 . 0 0 "[ . 1 . 2 .]" 1
1538 1 48 ILE H 1 48 ILE HG12 2.600 . 3.400 2.801 2.631 2.981 . 0 0 "[ . 1 . 2 .]" 1
1539 1 48 ILE H 1 48 ILE HG13 2.700 . 3.600 2.666 2.581 2.751 . 0 0 "[ . 1 . 2 .]" 1
1540 1 48 ILE H 1 48 ILE MG 2.900 . 3.900 3.053 2.995 3.130 . 0 0 "[ . 1 . 2 .]" 1
1541 1 48 ILE H 1 49 PRO HD2 4.300 . 6.000 4.644 4.623 4.665 . 0 0 "[ . 1 . 2 .]" 1
1542 1 48 ILE HA 1 48 ILE HB 2.200 . 2.800 2.440 2.424 2.458 . 0 0 "[ . 1 . 2 .]" 1
1543 1 48 ILE HA 1 48 ILE MD 3.300 . 4.600 4.092 4.067 4.123 . 0 0 "[ . 1 . 2 .]" 1
1544 1 48 ILE HA 1 48 ILE HG12 3.100 . 4.300 3.911 3.874 3.943 . 0 0 "[ . 1 . 2 .]" 1
1545 1 48 ILE HA 1 48 ILE HG13 3.100 . 4.300 3.547 3.533 3.562 . 0 0 "[ . 1 . 2 .]" 1
1546 1 48 ILE HA 1 48 ILE MG 2.300 . 2.900 2.280 2.254 2.301 . 0 0 "[ . 1 . 2 .]" 1
1547 1 48 ILE HA 1 49 PRO HD2 1.900 . 2.400 2.022 1.990 2.061 . 0 0 "[ . 1 . 2 .]" 1
1548 1 48 ILE HA 1 49 PRO HG3 3.100 . 4.300 4.376 4.369 4.382 0.082 2 0 "[ . 1 . 2 .]" 1
1549 1 48 ILE HB 1 48 ILE MD 2.200 . 2.800 2.143 2.090 2.276 . 0 0 "[ . 1 . 2 .]" 1
1550 1 48 ILE HB 1 48 ILE HG12 2.700 . 3.600 2.986 2.974 2.996 . 0 0 "[ . 1 . 2 .]" 1
1551 1 48 ILE HB 1 48 ILE HG13 2.500 . 3.300 2.646 2.619 2.675 . 0 0 "[ . 1 . 2 .]" 1
1552 1 48 ILE HB 1 48 ILE MG 2.100 . 2.700 2.111 2.108 2.114 . 0 0 "[ . 1 . 2 .]" 1
1553 1 48 ILE HB 1 49 PRO HD2 2.100 . 2.700 2.229 2.153 2.290 . 0 0 "[ . 1 . 2 .]" 1
1554 1 48 ILE HB 1 52 PHE HB2 4.100 . 6.000 4.359 4.277 4.431 . 0 0 "[ . 1 . 2 .]" 1
1555 1 48 ILE HB 1 52 PHE HB3 3.700 . 5.400 4.071 3.880 4.256 . 0 0 "[ . 1 . 2 .]" 1
1556 1 48 ILE HB 1 52 PHE QE 5.700 4.000 6.700 6.525 6.452 6.601 . 0 0 "[ . 1 . 2 .]" 1
1557 1 48 ILE MD 1 48 ILE HG12 2.300 . 3.000 2.091 2.072 2.110 . 0 0 "[ . 1 . 2 .]" 1
1558 1 48 ILE MD 1 48 ILE HG13 2.200 . 2.800 2.084 2.066 2.102 . 0 0 "[ . 1 . 2 .]" 1
1559 1 48 ILE MD 1 48 ILE MG 2.100 . 2.700 2.499 2.355 2.551 . 0 0 "[ . 1 . 2 .]" 1
1560 1 48 ILE MD 1 50 PHE HA 2.800 . 3.800 3.761 3.627 3.819 0.019 22 0 "[ . 1 . 2 .]" 1
1561 1 48 ILE MD 1 52 PHE H 4.500 . 6.000 4.409 4.155 4.562 . 0 0 "[ . 1 . 2 .]" 1
1562 1 48 ILE MD 1 52 PHE HB2 4.500 . 6.000 4.309 4.182 4.412 . 0 0 "[ . 1 . 2 .]" 1
1563 1 48 ILE MD 1 52 PHE HB3 4.000 . 6.000 3.741 3.612 3.907 . 0 0 "[ . 1 . 2 .]" 1
1564 1 48 ILE MD 1 53 VAL MG2 2.300 . 3.000 1.997 1.869 2.215 . 0 0 "[ . 1 . 2 .]" 1
1565 1 48 ILE HG12 1 48 ILE MG 2.400 . 3.100 2.128 2.094 2.159 . 0 0 "[ . 1 . 2 .]" 1
1566 1 48 ILE HG12 1 49 PRO HD2 3.500 . 5.000 4.913 4.867 4.951 . 0 0 "[ . 1 . 2 .]" 1
1567 1 48 ILE HG13 1 49 PRO HD2 3.000 . 4.100 4.198 4.177 4.215 0.115 3 0 "[ . 1 . 2 .]" 1
1568 1 48 ILE MG 1 49 PRO HD2 3.000 . 4.100 3.132 3.052 3.219 . 0 0 "[ . 1 . 2 .]" 1
1569 1 48 ILE MG 1 52 PHE QE 5.400 3.000 6.400 6.512 6.487 6.560 0.160 5 0 "[ . 1 . 2 .]" 1
1570 1 48 ILE MG 1 53 VAL MG1 4.800 3.800 5.800 3.940 3.776 4.129 0.024 5 0 "[ . 1 . 2 .]" 1
1571 1 49 PRO HA 1 49 PRO HB3 2.400 . 3.100 2.270 2.266 2.274 . 0 0 "[ . 1 . 2 .]" 1
1572 1 49 PRO HA 1 49 PRO HD2 2.900 . 3.900 4.019 4.011 4.029 0.129 16 0 "[ . 1 . 2 .]" 1
1573 1 49 PRO HA 1 49 PRO HG3 2.900 . 3.900 3.881 3.846 3.918 0.018 5 0 "[ . 1 . 2 .]" 1
1574 1 49 PRO HA 1 50 PHE H 2.000 . 2.500 2.189 2.172 2.205 . 0 0 "[ . 1 . 2 .]" 1
1575 1 49 PRO HA 1 50 PHE HA 3.600 . 5.200 4.435 4.407 4.459 . 0 0 "[ . 1 . 2 .]" 1
1576 1 49 PRO HA 1 50 PHE HB3 3.600 . 5.200 4.416 4.380 4.447 . 0 0 "[ . 1 . 2 .]" 1
1577 1 49 PRO HA 1 50 PHE QD 4.000 . 6.000 3.483 3.361 3.640 . 0 0 "[ . 1 . 2 .]" 1
1578 1 49 PRO HA 1 51 ASN H 3.300 . 4.700 3.586 3.543 3.627 . 0 0 "[ . 1 . 2 .]" 1
1579 1 49 PRO HB2 1 49 PRO HD2 3.500 . 5.000 3.986 3.967 4.009 . 0 0 "[ . 1 . 2 .]" 1
1580 1 49 PRO HB2 1 49 PRO HG3 2.600 . 3.500 2.715 2.696 2.728 . 0 0 "[ . 1 . 2 .]" 1
1581 1 49 PRO HB2 1 50 PHE H 3.900 . 5.800 3.913 3.793 3.997 . 0 0 "[ . 1 . 2 .]" 1
1582 1 49 PRO HB2 1 51 ASN H 4.100 . 6.000 2.950 2.807 3.072 . 0 0 "[ . 1 . 2 .]" 1
1583 1 49 PRO HB2 1 52 PHE H 3.600 . 5.200 3.434 3.346 3.568 . 0 0 "[ . 1 . 2 .]" 1
1584 1 49 PRO HB2 1 52 PHE HB2 3.300 . 4.700 2.092 1.964 2.319 . 0 0 "[ . 1 . 2 .]" 1
1585 1 49 PRO HB2 1 52 PHE HB3 4.200 . 6.000 3.813 3.680 4.049 . 0 0 "[ . 1 . 2 .]" 1
1586 1 49 PRO HB2 1 52 PHE QD 4.200 . 6.000 2.792 2.225 3.176 . 0 0 "[ . 1 . 2 .]" 1
1587 1 49 PRO HB2 1 52 PHE QE 3.300 . 4.700 4.628 4.424 4.720 0.020 2 0 "[ . 1 . 2 .]" 1
1588 1 49 PRO HB3 1 49 PRO HD2 3.500 2.700 4.300 3.934 3.907 3.955 . 0 0 "[ . 1 . 2 .]" 1
1589 1 49 PRO HB3 1 50 PHE H 4.500 . 6.000 4.120 4.028 4.181 . 0 0 "[ . 1 . 2 .]" 1
1590 1 49 PRO HB3 1 51 ASN H 3.700 . 5.400 4.022 3.960 4.063 . 0 0 "[ . 1 . 2 .]" 1
1591 1 49 PRO HB3 1 52 PHE H 3.900 . 5.800 5.131 5.034 5.279 . 0 0 "[ . 1 . 2 .]" 1
1592 1 49 PRO HB3 1 52 PHE HB2 4.000 . 6.000 3.646 3.540 3.827 . 0 0 "[ . 1 . 2 .]" 1
1593 1 49 PRO HB3 1 52 PHE HB3 4.300 . 6.000 5.218 5.093 5.418 . 0 0 "[ . 1 . 2 .]" 1
1594 1 49 PRO HD2 1 49 PRO HG3 2.300 . 3.000 2.690 2.676 2.701 . 0 0 "[ . 1 . 2 .]" 1
1595 1 49 PRO HD2 1 52 PHE HB2 2.800 . 3.800 3.787 3.727 3.819 0.019 2 0 "[ . 1 . 2 .]" 1
1596 1 49 PRO HD2 1 52 PHE HB3 4.000 . 6.000 4.089 3.942 4.200 . 0 0 "[ . 1 . 2 .]" 1
1597 1 49 PRO HD2 1 53 VAL MG1 4.000 . 6.000 4.944 4.814 5.064 . 0 0 "[ . 1 . 2 .]" 1
1598 1 49 PRO HG2 1 52 PHE H 4.200 . 6.000 4.208 4.163 4.235 . 0 0 "[ . 1 . 2 .]" 1
1599 1 49 PRO HG2 1 52 PHE HB2 2.700 . 3.600 1.829 1.786 1.868 0.014 4 0 "[ . 1 . 2 .]" 1
1600 1 49 PRO HG2 1 52 PHE HB3 3.000 . 4.100 2.632 2.531 2.751 . 0 0 "[ . 1 . 2 .]" 1
1601 1 49 PRO HG3 1 52 PHE H 3.800 . 5.600 5.629 5.613 5.645 0.045 15 0 "[ . 1 . 2 .]" 1
1602 1 49 PRO HG3 1 52 PHE HB2 3.200 . 4.500 3.339 3.278 3.361 . 0 0 "[ . 1 . 2 .]" 1
1603 1 49 PRO HG3 1 52 PHE QD 3.600 . 5.200 3.147 2.240 3.702 . 0 0 "[ . 1 . 2 .]" 1
1604 1 50 PHE H 1 50 PHE HA 2.600 . 3.400 2.757 2.732 2.784 . 0 0 "[ . 1 . 2 .]" 1
1605 1 50 PHE H 1 50 PHE HB2 2.700 . 3.600 3.539 3.519 3.554 . 0 0 "[ . 1 . 2 .]" 1
1606 1 50 PHE H 1 50 PHE HB3 2.500 . 3.300 2.264 2.225 2.298 . 0 0 "[ . 1 . 2 .]" 1
1607 1 50 PHE H 1 50 PHE QD 2.500 . 3.300 2.199 2.083 2.321 . 0 0 "[ . 1 . 2 .]" 1
1608 1 50 PHE H 1 51 ASN H 3.500 . 5.100 2.819 2.764 2.870 . 0 0 "[ . 1 . 2 .]" 1
1609 1 50 PHE HA 1 50 PHE HB2 2.200 . 2.800 2.328 2.306 2.343 . 0 0 "[ . 1 . 2 .]" 1
1610 1 50 PHE HA 1 50 PHE HB3 2.600 . 3.400 2.584 2.562 2.610 . 0 0 "[ . 1 . 2 .]" 1
1611 1 50 PHE HA 1 50 PHE QD 3.300 . 4.700 3.613 3.594 3.642 . 0 0 "[ . 1 . 2 .]" 1
1612 1 50 PHE HA 1 51 ASN H 3.100 . 4.300 3.455 3.435 3.473 . 0 0 "[ . 1 . 2 .]" 1
1613 1 50 PHE HA 1 52 PHE H 3.400 . 4.900 3.621 3.564 3.706 . 0 0 "[ . 1 . 2 .]" 1
1614 1 50 PHE HA 1 53 VAL H 4.100 . 6.000 4.409 4.078 5.040 . 0 0 "[ . 1 . 2 .]" 1
1615 1 50 PHE HA 1 53 VAL MG2 2.700 . 3.600 3.379 3.177 3.585 . 0 0 "[ . 1 . 2 .]" 1
1616 1 50 PHE HB2 1 50 PHE QD 2.600 . 3.400 2.290 2.272 2.304 . 0 0 "[ . 1 . 2 .]" 1
1617 1 50 PHE HB2 1 51 ASN H 3.300 . 4.700 4.236 4.169 4.305 . 0 0 "[ . 1 . 2 .]" 1
1618 1 50 PHE HB3 1 50 PHE QD 2.700 . 3.600 2.739 2.717 2.750 . 0 0 "[ . 1 . 2 .]" 1
1619 1 50 PHE HB3 1 51 ASN H 3.400 . 4.900 3.994 3.924 4.056 . 0 0 "[ . 1 . 2 .]" 1
1620 1 50 PHE QD 1 51 ASN H 3.400 . 4.900 1.949 1.918 1.976 . 0 0 "[ . 1 . 2 .]" 1
1621 1 50 PHE QD 1 51 ASN HA 3.500 . 5.100 4.125 4.013 4.202 . 0 0 "[ . 1 . 2 .]" 1
1622 1 51 ASN H 1 51 ASN HA 2.400 . 3.100 2.929 2.918 2.937 . 0 0 "[ . 1 . 2 .]" 1
1623 1 51 ASN H 1 51 ASN HB2 2.700 . 3.600 3.466 2.248 3.661 0.061 23 0 "[ . 1 . 2 .]" 1
1624 1 51 ASN H 1 51 ASN HB3 2.800 . 3.800 3.052 2.724 3.234 . 0 0 "[ . 1 . 2 .]" 1
1625 1 51 ASN H 1 52 PHE H 2.600 . 3.400 2.840 2.799 2.872 . 0 0 "[ . 1 . 2 .]" 1
1626 1 51 ASN H 1 53 VAL H 3.600 . 5.200 4.708 4.605 4.931 . 0 0 "[ . 1 . 2 .]" 1
1627 1 51 ASN HA 1 51 ASN HB2 2.100 . 2.700 2.571 2.406 2.815 0.115 11 0 "[ . 1 . 2 .]" 1
1628 1 51 ASN HA 1 51 ASN HB3 2.100 . 2.700 2.430 2.356 2.823 0.123 20 0 "[ . 1 . 2 .]" 1
1629 1 51 ASN HA 1 51 ASN HD22 5.300 . 6.000 5.155 4.206 5.392 . 0 0 "[ . 1 . 2 .]" 1
1630 1 51 ASN HA 1 52 PHE H 2.900 . 3.900 2.901 2.863 2.947 . 0 0 "[ . 1 . 2 .]" 1
1631 1 51 ASN HA 1 53 VAL H 3.000 . 4.100 3.860 3.483 4.110 0.010 10 0 "[ . 1 . 2 .]" 1
1632 1 51 ASN HA 1 53 VAL MG2 3.400 . 4.800 4.640 4.279 4.808 0.008 9 0 "[ . 1 . 2 .]" 1
1633 1 51 ASN HB2 1 51 ASN HD21 2.900 . 3.900 2.453 2.115 3.494 . 0 0 "[ . 1 . 2 .]" 1
1634 1 51 ASN HB2 1 51 ASN HD22 3.600 . 5.200 3.577 3.433 4.065 . 0 0 "[ . 1 . 2 .]" 1
1635 1 51 ASN HB3 1 51 ASN HD21 2.700 . 3.600 2.863 2.143 3.528 . 0 0 "[ . 1 . 2 .]" 1
1636 1 51 ASN HB3 1 51 ASN HD22 3.000 . 4.100 3.765 3.444 4.086 . 0 0 "[ . 1 . 2 .]" 1
1637 1 52 PHE H 1 52 PHE HA 2.700 . 3.600 2.951 2.949 2.954 . 0 0 "[ . 1 . 2 .]" 1
1638 1 52 PHE H 1 52 PHE HB2 2.300 . 3.000 2.493 2.468 2.538 . 0 0 "[ . 1 . 2 .]" 1
1639 1 52 PHE H 1 52 PHE HB3 2.700 . 3.600 3.193 3.088 3.251 . 0 0 "[ . 1 . 2 .]" 1
1640 1 52 PHE H 1 53 VAL H 2.200 . 2.800 2.018 1.893 2.363 . 0 0 "[ . 1 . 2 .]" 1
1641 1 52 PHE H 1 53 VAL HA 4.400 . 6.000 4.703 4.643 4.817 . 0 0 "[ . 1 . 2 .]" 1
1642 1 52 PHE H 1 53 VAL MG1 3.500 . 5.000 3.948 3.673 4.133 . 0 0 "[ . 1 . 2 .]" 1
1643 1 52 PHE H 1 53 VAL MG2 3.000 . 4.100 3.091 2.940 3.233 . 0 0 "[ . 1 . 2 .]" 1
1644 1 52 PHE HA 1 52 PHE HB2 2.700 . 3.600 2.800 2.745 2.823 . 0 0 "[ . 1 . 2 .]" 1
1645 1 52 PHE HA 1 52 PHE HB3 2.900 . 3.900 2.890 2.872 2.925 . 0 0 "[ . 1 . 2 .]" 1
1646 1 52 PHE HA 1 52 PHE QD 2.700 . 3.600 2.508 2.096 3.004 . 0 0 "[ . 1 . 2 .]" 1
1647 1 52 PHE HA 1 53 VAL H 3.400 . 4.800 3.393 3.111 3.503 . 0 0 "[ . 1 . 2 .]" 1
1648 1 52 PHE HB2 1 52 PHE QD 2.600 . 3.400 2.559 2.291 2.729 . 0 0 "[ . 1 . 2 .]" 1
1649 1 52 PHE HB2 1 53 VAL H 4.300 . 6.000 3.700 3.439 4.216 . 0 0 "[ . 1 . 2 .]" 1
1650 1 52 PHE HB2 1 53 VAL MG1 3.100 . 4.300 3.942 3.752 4.154 . 0 0 "[ . 1 . 2 .]" 1
1651 1 52 PHE HB2 1 53 VAL MG2 4.500 . 6.000 4.386 4.201 4.499 . 0 0 "[ . 1 . 2 .]" 1
1652 1 52 PHE HB3 1 52 PHE QD 2.400 . 3.100 2.341 2.242 2.508 . 0 0 "[ . 1 . 2 .]" 1
1653 1 52 PHE HB3 1 53 VAL H 4.800 . 6.000 3.401 3.001 4.041 . 0 0 "[ . 1 . 2 .]" 1
1654 1 52 PHE HB3 1 53 VAL MG1 3.000 . 4.100 2.736 2.439 2.904 . 0 0 "[ . 1 . 2 .]" 1
1655 1 53 VAL H 1 53 VAL HB 3.800 . 5.600 3.774 3.695 3.925 . 0 0 "[ . 1 . 2 .]" 1
1656 1 53 VAL H 1 53 VAL MG1 2.700 . 3.600 2.986 2.687 3.286 . 0 0 "[ . 1 . 2 .]" 1
1657 1 53 VAL H 1 53 VAL MG2 2.300 . 2.900 1.959 1.866 2.182 . 0 0 "[ . 1 . 2 .]" 1
1658 1 53 VAL H 1 54 ALA H 4.400 2.600 6.200 4.464 4.351 4.523 . 0 0 "[ . 1 . 2 .]" 1
1659 1 53 VAL HA 1 53 VAL HB 2.800 . 3.800 2.484 2.456 2.506 . 0 0 "[ . 1 . 2 .]" 1
1660 1 53 VAL HA 1 53 VAL MG1 2.300 . 3.000 2.218 2.126 2.374 . 0 0 "[ . 1 . 2 .]" 1
1661 1 53 VAL HA 1 53 VAL MG2 3.000 . 4.100 3.194 3.185 3.205 . 0 0 "[ . 1 . 2 .]" 1
1662 1 53 VAL HA 1 54 ALA H 2.300 . 3.000 2.215 2.189 2.242 . 0 0 "[ . 1 . 2 .]" 1
1663 1 53 VAL HA 1 54 ALA MB 4.500 2.800 6.200 3.814 3.761 3.880 . 0 0 "[ . 1 . 2 .]" 1
1664 1 53 VAL HB 1 53 VAL MG1 2.300 . 2.900 2.101 2.082 2.119 . 0 0 "[ . 1 . 2 .]" 1
1665 1 53 VAL HB 1 53 VAL MG2 2.300 . 2.900 2.109 2.092 2.131 . 0 0 "[ . 1 . 2 .]" 1
1666 1 53 VAL HB 1 54 ALA H 2.600 . 3.400 2.662 2.595 2.728 . 0 0 "[ . 1 . 2 .]" 1
1667 1 53 VAL HB 1 54 ALA MB 5.200 4.000 6.400 4.652 4.598 4.712 . 0 0 "[ . 1 . 2 .]" 1
1668 1 53 VAL MG1 1 53 VAL MG2 1.900 . 2.300 2.024 1.921 2.099 . 0 0 "[ . 1 . 2 .]" 1
1669 1 53 VAL MG1 1 54 ALA H 4.000 3.100 4.900 3.605 3.543 3.702 . 0 0 "[ . 1 . 2 .]" 1
1670 1 53 VAL MG1 1 54 ALA MB 6.000 3.500 7.500 5.039 4.979 5.115 . 0 0 "[ . 1 . 2 .]" 1
1671 1 53 VAL MG2 1 54 ALA H 4.800 3.800 5.800 3.768 3.755 3.781 0.045 16 0 "[ . 1 . 2 .]" 1
1672 1 53 VAL MG2 1 55 LYS HA 3.800 . 5.600 5.563 5.409 5.611 0.011 14 0 "[ . 1 . 2 .]" 1
1673 1 54 ALA H 1 54 ALA MB 2.700 . 3.400 2.557 2.497 2.630 . 0 0 "[ . 1 . 2 .]" 1
1674 1 54 ALA MB 1 55 LYS H 2.800 2.200 3.400 2.927 2.857 2.974 . 0 0 "[ . 1 . 2 .]" 1
1675 1 54 ALA MB 1 55 LYS HA 4.900 2.800 6.800 4.568 4.549 4.604 . 0 0 "[ . 1 . 2 .]" 1
1676 1 54 ALA MB 1 55 LYS HB2 5.800 4.200 7.400 4.202 4.182 4.264 0.018 6 0 "[ . 1 . 2 .]" 1
1677 1 54 ALA MB 1 56 ALA H 5.700 2.900 7.000 5.536 5.513 5.576 . 0 0 "[ . 1 . 2 .]" 1
1678 1 55 LYS H 1 55 LYS HA 2.500 . 3.300 2.686 2.684 2.688 . 0 0 "[ . 1 . 2 .]" 1
1679 1 55 LYS H 1 55 LYS HB2 2.400 . 3.100 2.527 2.139 2.643 . 0 0 "[ . 1 . 2 .]" 1
1680 1 55 LYS H 1 55 LYS HB3 3.400 2.700 4.100 3.577 3.434 3.616 . 0 0 "[ . 1 . 2 .]" 1
1681 1 55 LYS H 1 55 LYS HD2 3.000 . 4.100 4.039 3.655 4.122 0.022 4 0 "[ . 1 . 2 .]" 1
1682 1 55 LYS H 1 55 LYS HD3 3.400 . 4.900 2.778 2.381 2.875 . 0 0 "[ . 1 . 2 .]" 1
1683 1 55 LYS H 1 55 LYS HG3 3.600 . 5.200 3.803 3.643 4.338 . 0 0 "[ . 1 . 2 .]" 1
1684 1 55 LYS H 1 56 ALA H 3.700 . 5.400 4.600 4.593 4.605 . 0 0 "[ . 1 . 2 .]" 1
1685 1 55 LYS HA 1 55 LYS HB2 2.400 . 3.100 2.993 2.876 3.023 . 0 0 "[ . 1 . 2 .]" 1
1686 1 55 LYS HA 1 55 LYS HB3 2.300 . 2.900 2.556 2.482 2.821 . 0 0 "[ . 1 . 2 .]" 1
1687 1 55 LYS HA 1 55 LYS HD2 2.500 . 3.300 2.494 2.056 2.635 . 0 0 "[ . 1 . 2 .]" 1
1688 1 55 LYS HA 1 55 LYS HD3 2.900 . 4.000 2.035 1.925 2.444 . 0 0 "[ . 1 . 2 .]" 1
1689 1 55 LYS HA 1 55 LYS HG3 3.000 . 4.100 3.480 2.710 3.684 . 0 0 "[ . 1 . 2 .]" 1
1690 1 55 LYS HA 1 56 ALA H 1.900 . 2.300 2.190 2.182 2.197 . 0 0 "[ . 1 . 2 .]" 1
1691 1 55 LYS HA 1 56 ALA MB 4.800 3.600 6.000 4.016 4.010 4.022 . 0 0 "[ . 1 . 2 .]" 1
1692 1 55 LYS HB2 1 55 LYS QE 4.000 . 6.000 4.289 3.644 4.588 . 0 0 "[ . 1 . 2 .]" 1
1693 1 55 LYS HB2 1 56 ALA H 3.100 . 4.300 4.122 4.056 4.320 0.020 22 0 "[ . 1 . 2 .]" 1
1694 1 55 LYS HB2 1 57 ASN H 4.000 . 6.000 3.690 3.515 4.239 . 0 0 "[ . 1 . 2 .]" 1
1695 1 55 LYS HB3 1 55 LYS QE 3.800 . 5.600 4.170 3.981 4.551 . 0 0 "[ . 1 . 2 .]" 1
1696 1 55 LYS HB3 1 56 ALA H 2.900 . 4.000 3.067 2.997 3.288 . 0 0 "[ . 1 . 2 .]" 1
1697 1 55 LYS HB3 1 57 ASN H 3.600 . 5.200 3.547 3.015 3.683 . 0 0 "[ . 1 . 2 .]" 1
1698 1 55 LYS HD2 1 56 ALA H 3.400 . 4.900 3.743 3.532 3.844 . 0 0 "[ . 1 . 2 .]" 1
1699 1 55 LYS HD2 1 57 ASN H 4.300 . 6.000 6.017 6.008 6.030 0.030 21 0 "[ . 1 . 2 .]" 1
1700 1 55 LYS HD3 1 55 LYS QE 3.000 . 4.100 2.251 2.141 2.424 . 0 0 "[ . 1 . 2 .]" 1
1701 1 55 LYS HD3 1 56 ALA H 3.500 . 5.000 4.023 3.893 4.520 . 0 0 "[ . 1 . 2 .]" 1
1702 1 55 LYS HD3 1 57 ASN H 4.000 . 6.000 6.036 6.026 6.047 0.047 16 0 "[ . 1 . 2 .]" 1
1703 1 55 LYS QE 1 55 LYS HG3 2.300 . 3.000 2.608 2.293 3.006 0.006 17 0 "[ . 1 . 2 .]" 1
1704 1 55 LYS HG3 1 56 ALA H 3.700 . 5.500 4.696 3.239 5.082 . 0 0 "[ . 1 . 2 .]" 1
1705 1 55 LYS HG3 1 57 ASN H 4.400 . 6.000 5.599 4.890 5.795 . 0 0 "[ . 1 . 2 .]" 1
1706 1 56 ALA H 1 56 ALA HA 2.600 . 3.500 2.848 2.845 2.852 . 0 0 "[ . 1 . 2 .]" 1
1707 1 56 ALA H 1 56 ALA MB 2.800 2.200 3.400 2.162 2.156 2.169 0.044 13 0 "[ . 1 . 2 .]" 1
1708 1 56 ALA H 1 57 ASN H 2.700 . 3.600 3.537 3.480 3.563 . 0 0 "[ . 1 . 2 .]" 1
1709 1 56 ALA HA 1 57 ASN H 2.100 . 2.700 2.636 2.619 2.673 . 0 0 "[ . 1 . 2 .]" 1
1710 1 56 ALA MB 1 57 ASN H 4.500 3.700 5.300 3.724 3.721 3.726 . 0 0 "[ . 1 . 2 .]" 1
1711 1 56 ALA MB 1 57 ASN HA 4.800 2.700 6.700 4.197 4.160 4.274 . 0 0 "[ . 1 . 2 .]" 1
1712 1 56 ALA MB 1 57 ASN QB 6.100 2.800 7.000 4.578 4.018 5.033 . 0 0 "[ . 1 . 2 .]" 1
1713 1 57 ASN H 1 57 ASN HA 2.600 . 3.500 2.923 2.872 2.947 . 0 0 "[ . 1 . 2 .]" 1
1714 1 57 ASN H 1 57 ASN HB2 2.900 . 3.900 2.876 2.263 3.908 0.008 2 0 "[ . 1 . 2 .]" 1
1715 1 57 ASN H 1 57 ASN HB3 3.100 . 4.300 3.404 2.840 3.783 . 0 0 "[ . 1 . 2 .]" 1
1716 1 57 ASN HA 1 57 ASN QB 2.500 . 3.300 2.434 2.179 2.541 . 0 0 "[ . 1 . 2 .]" 1
1717 1 57 ASN HB2 1 57 ASN HD22 4.000 . 6.000 3.661 3.434 4.092 . 0 0 "[ . 1 . 2 .]" 1
1718 1 57 ASN HB3 1 57 ASN HD22 3.100 . 4.300 3.748 3.435 4.098 . 0 0 "[ . 1 . 2 .]" 1
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