NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
438986 |
2k5r   |
15847 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2k5r
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 1579
_Distance_constraint_stats_list.Viol_count 404
_Distance_constraint_stats_list.Viol_total 262.486
_Distance_constraint_stats_list.Viol_max 0.249
_Distance_constraint_stats_list.Viol_rms 0.0050
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0004
_Distance_constraint_stats_list.Viol_average_violations_only 0.0325
_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 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 ASP 0.442 0.074 8 0 "[ . 1 . 2]"
1 3 ARG 0.384 0.082 3 0 "[ . 1 . 2]"
1 4 LYS 0.023 0.023 14 0 "[ . 1 . 2]"
1 5 LEU 0.504 0.074 8 0 "[ . 1 . 2]"
1 6 LEU 0.207 0.082 3 0 "[ . 1 . 2]"
1 7 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 8 LEU 0.214 0.130 10 0 "[ . 1 . 2]"
1 9 LEU 0.418 0.124 4 0 "[ . 1 . 2]"
1 10 CYS 0.195 0.066 5 0 "[ . 1 . 2]"
1 11 SER 0.159 0.124 4 0 "[ . 1 . 2]"
1 12 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 THR 0.175 0.078 5 0 "[ . 1 . 2]"
1 15 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 GLN 0.213 0.078 5 0 "[ . 1 . 2]"
1 17 PRO 0.002 0.002 2 0 "[ . 1 . 2]"
1 18 LEU 0.520 0.191 12 0 "[ . 1 . 2]"
1 19 SER 0.052 0.052 12 0 "[ . 1 . 2]"
1 20 LEU 0.448 0.074 12 0 "[ . 1 . 2]"
1 21 LEU 0.103 0.022 11 0 "[ . 1 . 2]"
1 22 GLU 0.192 0.043 3 0 "[ . 1 . 2]"
1 23 SER 0.081 0.039 6 0 "[ . 1 . 2]"
1 24 LYS 0.057 0.023 16 0 "[ . 1 . 2]"
1 25 GLY 0.222 0.043 3 0 "[ . 1 . 2]"
1 26 LEU 0.206 0.039 6 0 "[ . 1 . 2]"
1 27 GLU 0.258 0.161 1 0 "[ . 1 . 2]"
1 28 ALA 0.259 0.070 17 0 "[ . 1 . 2]"
1 29 LEU 0.037 0.014 13 0 "[ . 1 . 2]"
1 30 ASN 0.359 0.087 1 0 "[ . 1 . 2]"
1 31 LYS 0.770 0.161 1 0 "[ . 1 . 2]"
1 32 ALA 0.006 0.006 16 0 "[ . 1 . 2]"
1 33 ILE 0.127 0.040 16 0 "[ . 1 . 2]"
1 34 VAL 0.561 0.058 19 0 "[ . 1 . 2]"
1 35 SER 0.546 0.058 19 0 "[ . 1 . 2]"
1 36 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 THR 0.095 0.030 5 0 "[ . 1 . 2]"
1 38 VAL 0.270 0.053 6 0 "[ . 1 . 2]"
1 39 GLN 0.506 0.062 2 0 "[ . 1 . 2]"
1 40 ARG 0.160 0.069 14 0 "[ . 1 . 2]"
1 41 ALA 0.218 0.126 7 0 "[ . 1 . 2]"
1 42 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 GLY 0.288 0.062 2 0 "[ . 1 . 2]"
1 44 SER 0.143 0.069 14 0 "[ . 1 . 2]"
1 45 ILE 0.358 0.051 1 0 "[ . 1 . 2]"
1 46 GLN 0.301 0.053 6 0 "[ . 1 . 2]"
1 47 ASN 0.055 0.028 2 0 "[ . 1 . 2]"
1 48 GLN 0.028 0.028 2 0 "[ . 1 . 2]"
1 49 SER 0.040 0.025 15 0 "[ . 1 . 2]"
1 50 LEU 0.189 0.030 7 0 "[ . 1 . 2]"
1 51 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 GLU 0.770 0.074 12 0 "[ . 1 . 2]"
1 53 ALA 0.031 0.018 5 0 "[ . 1 . 2]"
1 54 LEU 1.765 0.191 12 0 "[ . 1 . 2]"
1 55 ILE 0.120 0.040 6 0 "[ . 1 . 2]"
1 56 THR 0.374 0.160 12 0 "[ . 1 . 2]"
1 57 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 ASP 0.029 0.021 12 0 "[ . 1 . 2]"
1 59 ARG 0.466 0.160 12 0 "[ . 1 . 2]"
1 60 LYS 0.033 0.021 12 0 "[ . 1 . 2]"
1 61 GLN 0.124 0.044 3 0 "[ . 1 . 2]"
1 62 VAL 0.016 0.016 18 0 "[ . 1 . 2]"
1 63 PHE 0.633 0.114 18 0 "[ . 1 . 2]"
1 64 ARG 0.388 0.067 9 0 "[ . 1 . 2]"
1 65 ILE 0.966 0.087 1 0 "[ . 1 . 2]"
1 66 GLU 0.061 0.040 1 0 "[ . 1 . 2]"
1 67 ASP 0.350 0.069 1 0 "[ . 1 . 2]"
1 68 SER 0.533 0.103 20 0 "[ . 1 . 2]"
1 69 ILE 0.664 0.103 20 0 "[ . 1 . 2]"
1 70 PRO 0.482 0.048 14 0 "[ . 1 . 2]"
1 71 VAL 0.094 0.040 1 0 "[ . 1 . 2]"
1 72 LEU 0.269 0.047 15 0 "[ . 1 . 2]"
1 73 LEU 0.114 0.037 6 0 "[ . 1 . 2]"
1 74 PRO 0.310 0.064 3 0 "[ . 1 . 2]"
1 75 GLU 0.520 0.126 7 0 "[ . 1 . 2]"
1 76 GLU 0.094 0.037 6 0 "[ . 1 . 2]"
1 77 ALA 0.080 0.044 3 0 "[ . 1 . 2]"
1 78 ILE 0.034 0.034 18 0 "[ . 1 . 2]"
1 79 ALA 0.052 0.037 18 0 "[ . 1 . 2]"
1 80 THR 0.083 0.037 13 0 "[ . 1 . 2]"
1 81 ILE 0.227 0.089 2 0 "[ . 1 . 2]"
1 82 GLN 0.102 0.089 6 0 "[ . 1 . 2]"
1 83 ILE 0.457 0.089 6 0 "[ . 1 . 2]"
1 84 ALA 0.670 0.107 17 0 "[ . 1 . 2]"
1 85 ASN 0.710 0.107 17 0 "[ . 1 . 2]"
1 86 PHE 0.249 0.055 10 0 "[ . 1 . 2]"
1 87 PRO 0.093 0.060 10 0 "[ . 1 . 2]"
1 88 ASP 0.131 0.097 10 0 "[ . 1 . 2]"
1 89 LYS 1.192 0.249 11 0 "[ . 1 . 2]"
1 90 LEU 1.228 0.249 11 0 "[ . 1 . 2]"
1 91 GLU 0.274 0.143 8 0 "[ . 1 . 2]"
1 92 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 82 GLN H 1 83 ILE HG13 5.510 . 6.060 5.213 4.937 5.452 . 0 0 "[ . 1 . 2]" 1
2 1 78 ILE MG 1 82 GLN H 5.720 . 6.290 4.656 3.905 5.308 . 0 0 "[ . 1 . 2]" 1
3 1 80 THR MG 1 82 GLN H 6.230 . 6.850 5.222 5.096 5.346 . 0 0 "[ . 1 . 2]" 1
4 1 80 THR HA 1 82 GLN H 4.580 . 5.040 3.761 3.603 3.934 . 0 0 "[ . 1 . 2]" 1
5 1 81 ILE H 1 82 GLN H 3.780 . 4.160 2.720 2.640 2.775 . 0 0 "[ . 1 . 2]" 1
6 1 82 GLN H 1 82 GLN HG2 5.290 . 5.820 3.527 2.135 4.688 . 0 0 "[ . 1 . 2]" 1
7 1 82 GLN H 1 82 GLN HG3 5.290 . 5.820 3.800 1.963 4.549 . 0 0 "[ . 1 . 2]" 1
8 1 82 GLN H 1 82 GLN HB3 3.710 . 4.080 3.140 2.387 3.676 . 0 0 "[ . 1 . 2]" 1
9 1 79 ALA MB 1 82 GLN H 3.960 . 4.360 3.099 2.851 3.399 . 0 0 "[ . 1 . 2]" 1
10 1 82 GLN H 1 82 GLN HB2 3.710 . 4.080 2.660 2.256 3.727 . 0 0 "[ . 1 . 2]" 1
11 1 81 ILE MG 1 82 GLN H 3.430 . 3.770 2.512 2.363 2.655 . 0 0 "[ . 1 . 2]" 1
12 1 82 GLN H 1 83 ILE MD 4.540 . 4.990 4.387 4.233 4.608 . 0 0 "[ . 1 . 2]" 1
13 1 81 ILE HB 1 82 GLN H 4.340 . 4.770 4.163 4.085 4.237 . 0 0 "[ . 1 . 2]" 1
14 1 80 THR H 1 82 GLN H 4.510 . 4.960 4.308 4.048 4.585 . 0 0 "[ . 1 . 2]" 1
15 1 71 VAL HB 1 73 LEU H 4.580 . 5.040 4.026 3.756 4.331 . 0 0 "[ . 1 . 2]" 1
16 1 73 LEU H 1 73 LEU HG 3.580 . 3.940 2.442 2.154 3.122 . 0 0 "[ . 1 . 2]" 1
17 1 72 LEU MD2 1 73 LEU H 4.560 . 5.020 4.492 4.108 4.648 . 0 0 "[ . 1 . 2]" 1
18 1 73 LEU H 1 74 PRO HD3 5.220 . 5.740 4.952 4.433 5.189 . 0 0 "[ . 1 . 2]" 1
19 1 72 LEU H 1 73 LEU H 4.090 . 4.500 2.844 2.432 3.708 . 0 0 "[ . 1 . 2]" 1
20 1 63 PHE QD 1 73 LEU H 4.180 . 4.600 3.646 2.515 4.325 . 0 0 "[ . 1 . 2]" 1
21 1 63 PHE QE 1 73 LEU H 4.520 . 4.970 4.603 3.455 4.954 . 0 0 "[ . 1 . 2]" 1
22 1 72 LEU HA 1 73 LEU H 3.490 . 3.840 3.016 2.470 3.267 . 0 0 "[ . 1 . 2]" 1
23 1 71 VAL QG 1 73 LEU H 3.280 . 3.610 2.090 1.865 2.595 . 0 0 "[ . 1 . 2]" 1
24 1 73 LEU H 1 74 PRO HD2 5.220 . 5.740 4.847 4.707 5.245 . 0 0 "[ . 1 . 2]" 1
25 1 73 LEU H 1 76 GLU H 4.650 . 5.120 4.657 4.080 5.024 . 0 0 "[ . 1 . 2]" 1
26 1 72 LEU HG 1 73 LEU H 4.810 . 5.290 4.881 4.519 5.220 . 0 0 "[ . 1 . 2]" 1
27 1 73 LEU H 1 73 LEU HB3 3.780 . 4.160 3.627 3.589 3.776 . 0 0 "[ . 1 . 2]" 1
28 1 73 LEU H 1 73 LEU HB2 3.860 . 4.250 2.502 2.412 2.629 . 0 0 "[ . 1 . 2]" 1
29 1 47 ASN H 1 47 ASN HD22 5.040 . 5.540 4.188 3.285 4.999 . 0 0 "[ . 1 . 2]" 1
30 1 45 ILE MG 1 47 ASN HD22 4.150 . 4.570 2.986 1.994 4.597 0.027 20 0 "[ . 1 . 2]" 1
31 1 85 ASN HA 1 85 ASN HD22 5.140 . 5.650 4.333 3.472 5.325 . 0 0 "[ . 1 . 2]" 1
32 1 85 ASN H 1 85 ASN HD22 5.110 . 5.620 4.081 3.360 4.788 . 0 0 "[ . 1 . 2]" 1
33 1 75 GLU H 1 77 ALA H 4.840 . 5.320 4.131 3.919 4.529 . 0 0 "[ . 1 . 2]" 1
34 1 75 GLU HA 1 77 ALA H 4.510 . 4.960 3.806 3.297 4.673 . 0 0 "[ . 1 . 2]" 1
35 1 63 PHE QE 1 77 ALA H 5.000 . 5.500 4.471 3.722 5.200 . 0 0 "[ . 1 . 2]" 1
36 1 76 GLU H 1 77 ALA H 3.300 . 3.630 2.500 1.951 2.799 . 0 0 "[ . 1 . 2]" 1
37 1 41 ALA MB 1 77 ALA H 3.640 . 4.000 3.188 2.459 4.029 0.029 7 0 "[ . 1 . 2]" 1
38 1 41 ALA H 1 77 ALA H 4.530 . 4.980 3.848 3.040 4.747 . 0 0 "[ . 1 . 2]" 1
39 1 47 ASN HB2 1 48 GLN H 4.500 . 4.950 3.366 2.852 4.400 . 0 0 "[ . 1 . 2]" 1
40 1 47 ASN HB3 1 48 GLN H 4.500 . 4.950 4.151 3.853 4.577 . 0 0 "[ . 1 . 2]" 1
41 1 47 ASN H 1 48 GLN H 3.090 . 3.400 2.306 1.960 2.986 . 0 0 "[ . 1 . 2]" 1
42 1 46 GLN HA 1 48 GLN H 4.090 . 4.500 3.495 3.088 3.888 . 0 0 "[ . 1 . 2]" 1
43 1 48 GLN H 1 48 GLN HB3 3.890 . 4.280 3.621 2.993 3.821 . 0 0 "[ . 1 . 2]" 1
44 1 48 GLN H 1 48 GLN HG2 4.490 . 4.940 3.372 2.394 3.911 . 0 0 "[ . 1 . 2]" 1
45 1 48 GLN H 1 48 GLN HG3 4.490 . 4.940 2.935 1.880 4.330 . 0 0 "[ . 1 . 2]" 1
46 1 33 ILE MD 1 48 GLN H 4.970 . 5.470 4.308 3.362 4.816 . 0 0 "[ . 1 . 2]" 1
47 1 33 ILE MG 1 48 GLN H 3.860 . 4.250 3.399 2.344 4.178 . 0 0 "[ . 1 . 2]" 1
48 1 75 GLU HG2 1 76 GLU H 4.570 . 5.030 2.964 2.110 4.456 . 0 0 "[ . 1 . 2]" 1
49 1 73 LEU HB2 1 76 GLU H 4.400 . 4.840 3.181 2.680 3.810 . 0 0 "[ . 1 . 2]" 1
50 1 71 VAL QG 1 76 GLU H 4.680 . 5.150 4.206 3.464 4.624 . 0 0 "[ . 1 . 2]" 1
51 1 73 LEU HB3 1 76 GLU H 4.110 . 4.520 3.604 3.227 4.552 0.032 5 0 "[ . 1 . 2]" 1
52 1 76 GLU H 1 77 ALA HA 5.040 . 5.540 4.844 4.556 5.026 . 0 0 "[ . 1 . 2]" 1
53 1 30 ASN HD21 1 50 LEU H 5.240 . 5.760 5.120 4.485 5.776 0.016 10 0 "[ . 1 . 2]" 1
54 1 26 LEU HG 1 30 ASN HD21 4.170 . 4.590 2.626 2.269 3.603 . 0 0 "[ . 1 . 2]" 1
55 1 37 THR H 1 38 VAL MG2 4.040 . 4.440 3.080 2.801 3.390 . 0 0 "[ . 1 . 2]" 1
56 1 37 THR H 1 45 ILE MG 4.560 . 5.020 4.172 3.521 4.749 . 0 0 "[ . 1 . 2]" 1
57 1 37 THR H 1 38 VAL H 3.490 . 3.840 2.282 2.026 2.736 . 0 0 "[ . 1 . 2]" 1
58 1 37 THR H 1 37 THR HB 4.020 . 4.420 3.080 2.856 3.458 . 0 0 "[ . 1 . 2]" 1
59 1 28 ALA H 1 30 ASN H 4.650 . 5.120 4.286 4.049 4.470 . 0 0 "[ . 1 . 2]" 1
60 1 27 GLU H 1 28 ALA H 3.460 . 3.810 2.725 2.662 2.847 . 0 0 "[ . 1 . 2]" 1
61 1 28 ALA H 1 29 LEU H 3.400 . 3.740 2.687 2.539 2.790 . 0 0 "[ . 1 . 2]" 1
62 1 28 ALA H 1 28 ALA MB 2.950 . 3.250 2.247 2.233 2.258 . 0 0 "[ . 1 . 2]" 1
63 1 28 ALA H 1 29 LEU MD2 4.310 . 4.740 3.722 3.467 3.924 . 0 0 "[ . 1 . 2]" 1
64 1 29 LEU HA 1 32 ALA H 4.110 . 4.520 3.579 3.382 3.806 . 0 0 "[ . 1 . 2]" 1
65 1 32 ALA H 1 38 VAL MG2 4.520 . 4.970 4.099 3.893 4.416 . 0 0 "[ . 1 . 2]" 1
66 1 32 ALA H 1 33 ILE H 3.530 . 3.880 2.641 2.517 2.703 . 0 0 "[ . 1 . 2]" 1
67 1 32 ALA H 1 34 VAL H 4.750 . 5.220 4.355 4.223 4.507 . 0 0 "[ . 1 . 2]" 1
68 1 31 LYS HB2 1 32 ALA H 3.420 . 3.760 2.628 2.424 2.904 . 0 0 "[ . 1 . 2]" 1
69 1 31 LYS HB3 1 32 ALA H 3.870 . 4.260 3.472 2.972 3.717 . 0 0 "[ . 1 . 2]" 1
70 1 32 ALA H 1 32 ALA MB 3.030 . 3.330 2.238 2.221 2.263 . 0 0 "[ . 1 . 2]" 1
71 1 32 ALA H 1 83 ILE MG 4.220 . 4.640 3.856 3.509 4.241 . 0 0 "[ . 1 . 2]" 1
72 1 32 ALA H 1 33 ILE HB 4.970 . 5.470 4.770 4.599 4.871 . 0 0 "[ . 1 . 2]" 1
73 1 32 ALA H 1 35 SER H 4.980 . 5.480 4.642 4.554 4.737 . 0 0 "[ . 1 . 2]" 1
74 1 30 ASN H 1 32 ALA H 4.670 . 5.140 4.260 4.046 4.393 . 0 0 "[ . 1 . 2]" 1
75 1 21 LEU MD2 1 25 GLY H 5.420 . 5.960 5.048 4.595 5.548 . 0 0 "[ . 1 . 2]" 1
76 1 25 GLY H 1 29 LEU MD2 5.940 . 6.530 5.319 4.914 5.652 . 0 0 "[ . 1 . 2]" 1
77 1 24 LYS H 1 25 GLY H 4.480 . 4.930 2.778 2.559 2.949 . 0 0 "[ . 1 . 2]" 1
78 1 22 GLU HG2 1 25 GLY H 4.090 . 4.500 3.204 1.811 3.942 . 0 0 "[ . 1 . 2]" 1
79 1 24 LYS HB3 1 25 GLY H 3.900 . 4.290 3.116 2.341 3.948 . 0 0 "[ . 1 . 2]" 1
80 1 22 GLU HG3 1 25 GLY H 4.090 . 4.500 2.885 1.780 4.543 0.043 3 0 "[ . 1 . 2]" 1
81 1 21 LEU MD1 1 25 GLY H 4.080 . 4.490 4.011 3.289 4.417 . 0 0 "[ . 1 . 2]" 1
82 1 23 SER HA 1 25 GLY H 4.850 . 5.330 4.368 4.191 4.620 . 0 0 "[ . 1 . 2]" 1
83 1 22 GLU H 1 25 GLY H 5.050 . 5.560 4.639 4.319 4.965 . 0 0 "[ . 1 . 2]" 1
84 1 25 GLY H 1 27 GLU H 4.920 . 5.410 4.405 4.168 4.686 . 0 0 "[ . 1 . 2]" 1
85 1 6 LEU H 1 6 LEU HG 3.540 . 3.890 2.464 2.084 2.997 . 0 0 "[ . 1 . 2]" 1
86 1 5 LEU HB2 1 6 LEU H 3.370 . 3.710 3.031 2.027 3.731 0.021 2 0 "[ . 1 . 2]" 1
87 1 6 LEU H 1 6 LEU MD2 4.200 . 4.620 3.320 2.855 3.722 . 0 0 "[ . 1 . 2]" 1
88 1 45 ILE MG 1 47 ASN HD21 4.150 . 4.570 3.564 2.499 4.348 . 0 0 "[ . 1 . 2]" 1
89 1 47 ASN H 1 47 ASN HD21 5.040 . 5.540 3.408 2.135 4.760 . 0 0 "[ . 1 . 2]" 1
90 1 14 THR MG 1 15 ARG H 4.800 . 5.280 3.715 2.483 4.341 . 0 0 "[ . 1 . 2]" 1
91 1 7 HIS HB2 1 8 LEU H 5.070 . 5.580 3.765 2.388 4.468 . 0 0 "[ . 1 . 2]" 1
92 1 7 HIS HB3 1 8 LEU H 5.070 . 5.580 3.746 2.417 4.430 . 0 0 "[ . 1 . 2]" 1
93 1 15 ARG H 1 15 ARG HG2 4.960 . 5.460 4.064 1.986 4.993 . 0 0 "[ . 1 . 2]" 1
94 1 15 ARG H 1 15 ARG HG3 4.960 . 5.460 4.055 2.504 4.784 . 0 0 "[ . 1 . 2]" 1
95 1 8 LEU H 1 8 LEU MD2 4.170 . 4.590 2.980 1.795 4.305 0.005 1 0 "[ . 1 . 2]" 1
96 1 15 ARG H 1 16 GLN H 4.280 . 4.710 3.331 1.996 4.558 . 0 0 "[ . 1 . 2]" 1
97 1 84 ALA MB 1 85 ASN HD21 4.610 . 5.070 4.025 2.530 5.039 . 0 0 "[ . 1 . 2]" 1
98 1 35 SER H 1 35 SER HB3 3.330 . 3.660 2.515 2.446 2.562 . 0 0 "[ . 1 . 2]" 1
99 1 35 SER H 1 37 THR H 4.550 . 5.010 4.323 4.104 4.480 . 0 0 "[ . 1 . 2]" 1
100 1 34 VAL HB 1 35 SER H 3.760 . 4.140 2.737 2.574 2.914 . 0 0 "[ . 1 . 2]" 1
101 1 33 ILE H 1 35 SER H 4.600 . 5.060 3.916 3.779 4.030 . 0 0 "[ . 1 . 2]" 1
102 1 34 VAL H 1 35 SER H 3.430 . 3.770 2.666 2.616 2.707 . 0 0 "[ . 1 . 2]" 1
103 1 35 SER H 1 36 GLY H 3.320 . 3.650 2.577 2.470 2.679 . 0 0 "[ . 1 . 2]" 1
104 1 32 ALA MB 1 35 SER H 4.490 . 4.940 4.502 4.387 4.727 . 0 0 "[ . 1 . 2]" 1
105 1 50 LEU MD1 1 52 GLU H 3.680 . 4.050 3.488 2.642 4.079 0.029 2 0 "[ . 1 . 2]" 1
106 1 52 GLU H 1 52 GLU HB3 3.850 . 4.230 3.342 2.879 3.887 . 0 0 "[ . 1 . 2]" 1
107 1 52 GLU H 1 52 GLU HB2 3.850 . 4.230 2.998 2.476 3.369 . 0 0 "[ . 1 . 2]" 1
108 1 52 GLU H 1 53 ALA H 4.480 . 4.930 4.358 4.124 4.506 . 0 0 "[ . 1 . 2]" 1
109 1 52 GLU H 1 53 ALA MB 4.890 . 5.380 4.278 3.681 4.743 . 0 0 "[ . 1 . 2]" 1
110 1 50 LEU HB2 1 52 GLU H 3.820 . 4.200 2.817 2.395 3.353 . 0 0 "[ . 1 . 2]" 1
111 1 50 LEU HB3 1 52 GLU H 5.380 . 5.920 4.365 3.984 4.968 . 0 0 "[ . 1 . 2]" 1
112 1 59 ARG HA 1 61 GLN H 5.020 . 5.520 4.131 3.611 4.591 . 0 0 "[ . 1 . 2]" 1
113 1 56 THR H 1 61 GLN H 4.170 . 4.590 3.620 3.120 4.161 . 0 0 "[ . 1 . 2]" 1
114 1 61 GLN H 1 61 GLN QB 3.610 . 3.970 2.605 2.460 2.741 . 0 0 "[ . 1 . 2]" 1
115 1 61 GLN H 1 62 VAL QG 4.820 . 5.300 4.342 4.068 4.673 . 0 0 "[ . 1 . 2]" 1
116 1 60 LYS H 1 61 GLN H 3.580 . 3.940 2.349 1.796 2.714 0.004 4 0 "[ . 1 . 2]" 1
117 1 60 LYS HB3 1 61 GLN H 4.190 . 4.610 3.726 3.129 4.257 . 0 0 "[ . 1 . 2]" 1
118 1 56 THR MG 1 61 GLN H 3.550 . 3.900 2.617 2.313 2.996 . 0 0 "[ . 1 . 2]" 1
119 1 9 LEU H 1 9 LEU HB3 4.050 . 4.460 2.672 2.368 3.099 . 0 0 "[ . 1 . 2]" 1
120 1 60 LYS HB2 1 61 GLN H 4.190 . 4.610 2.940 2.083 4.058 . 0 0 "[ . 1 . 2]" 1
121 1 60 LYS HG2 1 61 GLN H 6.050 . 6.660 4.186 2.539 5.215 . 0 0 "[ . 1 . 2]" 1
122 1 60 LYS HG3 1 61 GLN H 6.050 . 6.660 3.859 2.076 4.830 . 0 0 "[ . 1 . 2]" 1
123 1 8 LEU HB2 1 9 LEU H 5.270 . 5.800 3.654 1.930 4.525 . 0 0 "[ . 1 . 2]" 1
124 1 8 LEU HB3 1 9 LEU H 5.270 . 5.800 3.774 1.881 4.501 . 0 0 "[ . 1 . 2]" 1
125 1 56 THR HB 1 61 GLN H 4.490 . 4.940 3.805 3.441 4.853 . 0 0 "[ . 1 . 2]" 1
126 1 55 ILE MD 1 61 GLN H 4.580 . 5.040 3.747 2.936 4.382 . 0 0 "[ . 1 . 2]" 1
127 1 8 LEU H 1 9 LEU H 6.500 . 7.150 3.530 2.307 4.624 . 0 0 "[ . 1 . 2]" 1
128 1 9 LEU H 1 9 LEU HB2 4.050 . 4.460 2.858 2.254 3.880 . 0 0 "[ . 1 . 2]" 1
129 1 9 LEU H 1 9 LEU MD1 5.130 . 5.640 4.287 3.770 4.722 . 0 0 "[ . 1 . 2]" 1
130 1 9 LEU H 1 9 LEU MD2 5.120 . 5.630 3.757 1.736 4.315 0.064 6 0 "[ . 1 . 2]" 1
131 1 27 GLU HA 1 30 ASN HD22 5.090 . 5.600 4.211 3.861 4.784 . 0 0 "[ . 1 . 2]" 1
132 1 26 LEU MD1 1 30 ASN HD22 4.110 . 4.520 2.630 2.324 3.145 . 0 0 "[ . 1 . 2]" 1
133 1 30 ASN HD22 1 50 LEU MD1 4.730 . 5.200 2.569 1.998 3.259 . 0 0 "[ . 1 . 2]" 1
134 1 30 ASN HD22 1 50 LEU H 4.300 . 4.730 4.008 3.208 4.736 0.006 10 0 "[ . 1 . 2]" 1
135 1 85 ASN H 1 86 PHE H 3.570 . 3.930 2.420 2.076 2.725 . 0 0 "[ . 1 . 2]" 1
136 1 83 ILE MG 1 86 PHE H 3.450 . 3.790 2.272 1.792 2.811 0.008 9 0 "[ . 1 . 2]" 1
137 1 86 PHE H 1 86 PHE HB2 3.610 . 3.970 2.257 2.170 2.343 . 0 0 "[ . 1 . 2]" 1
138 1 86 PHE H 1 86 PHE HB3 3.610 . 3.970 2.989 2.749 3.558 . 0 0 "[ . 1 . 2]" 1
139 1 84 ALA MB 1 86 PHE H 5.010 . 5.510 4.502 4.319 4.685 . 0 0 "[ . 1 . 2]" 1
140 1 86 PHE H 1 86 PHE QD 3.710 . 4.080 3.716 2.468 4.048 . 0 0 "[ . 1 . 2]" 1
141 1 80 THR HA 1 83 ILE H 4.010 . 4.410 3.406 3.032 3.880 . 0 0 "[ . 1 . 2]" 1
142 1 28 ALA MB 1 86 PHE H 4.400 . 4.840 4.028 3.252 4.683 . 0 0 "[ . 1 . 2]" 1
143 1 3 ARG H 1 5 LEU H 5.110 . 5.620 4.039 3.237 4.375 . 0 0 "[ . 1 . 2]" 1
144 1 83 ILE H 1 83 ILE HB 3.340 . 3.670 2.574 2.475 2.629 . 0 0 "[ . 1 . 2]" 1
145 1 5 LEU H 1 6 LEU H 3.480 . 3.830 2.570 2.242 2.856 . 0 0 "[ . 1 . 2]" 1
146 1 4 LYS HB2 1 5 LEU H 3.890 . 4.280 3.171 2.431 4.073 . 0 0 "[ . 1 . 2]" 1
147 1 4 LYS HB3 1 5 LEU H 3.890 . 4.280 3.886 3.452 4.303 0.023 14 0 "[ . 1 . 2]" 1
148 1 5 LEU H 1 5 LEU HB3 3.620 . 3.980 3.588 3.507 3.664 . 0 0 "[ . 1 . 2]" 1
149 1 5 LEU H 1 5 LEU HB2 3.130 . 3.440 2.353 2.202 2.465 . 0 0 "[ . 1 . 2]" 1
150 1 5 LEU H 1 5 LEU HG 4.130 . 4.540 4.030 3.855 4.171 . 0 0 "[ . 1 . 2]" 1
151 1 5 LEU H 1 5 LEU MD1 4.400 . 4.840 3.662 3.377 3.956 . 0 0 "[ . 1 . 2]" 1
152 1 5 LEU H 1 5 LEU MD2 4.400 . 4.840 2.141 1.812 2.446 . 0 0 "[ . 1 . 2]" 1
153 1 2 ASP HB2 1 5 LEU H 5.070 . 5.580 3.859 2.499 4.831 . 0 0 "[ . 1 . 2]" 1
154 1 78 ILE MG 1 83 ILE H 5.880 . 6.470 4.848 4.389 5.715 . 0 0 "[ . 1 . 2]" 1
155 1 80 THR MG 1 83 ILE H 6.260 . 6.890 5.180 4.946 5.569 . 0 0 "[ . 1 . 2]" 1
156 1 82 GLN H 1 83 ILE H 3.580 . 3.940 2.416 2.262 2.542 . 0 0 "[ . 1 . 2]" 1
157 1 83 ILE H 1 83 ILE MD 3.770 . 4.150 3.257 3.094 3.713 . 0 0 "[ . 1 . 2]" 1
158 1 83 ILE H 1 83 ILE HG13 3.720 . 4.090 3.735 3.600 3.924 . 0 0 "[ . 1 . 2]" 1
159 1 81 ILE HA 1 83 ILE H 4.420 . 4.860 3.882 3.604 4.165 . 0 0 "[ . 1 . 2]" 1
160 1 83 ILE H 1 83 ILE HG12 3.710 . 4.080 2.273 2.103 2.560 . 0 0 "[ . 1 . 2]" 1
161 1 41 ALA H 1 42 ASP H 3.800 . 4.180 2.857 2.716 2.968 . 0 0 "[ . 1 . 2]" 1
162 1 42 ASP H 1 43 GLY H 3.420 . 3.760 2.670 2.288 2.893 . 0 0 "[ . 1 . 2]" 1
163 1 42 ASP H 1 42 ASP HB2 3.780 . 4.160 2.703 2.358 3.658 . 0 0 "[ . 1 . 2]" 1
164 1 40 ARG HB2 1 42 ASP H 5.050 . 5.560 3.644 2.738 4.692 . 0 0 "[ . 1 . 2]" 1
165 1 40 ARG HB3 1 42 ASP H 5.050 . 5.560 3.505 2.314 4.846 . 0 0 "[ . 1 . 2]" 1
166 1 41 ALA MB 1 42 ASP H 3.510 . 3.860 2.718 2.373 3.216 . 0 0 "[ . 1 . 2]" 1
167 1 42 ASP H 1 42 ASP HB3 3.780 . 4.160 2.968 2.303 3.630 . 0 0 "[ . 1 . 2]" 1
168 1 68 SER HB2 1 69 ILE H 4.640 . 5.100 4.161 3.644 4.558 . 0 0 "[ . 1 . 2]" 1
169 1 68 SER HB3 1 69 ILE H 4.640 . 5.100 4.018 3.031 4.431 . 0 0 "[ . 1 . 2]" 1
170 1 65 ILE MG 1 69 ILE H 3.580 . 3.940 3.046 2.732 3.805 . 0 0 "[ . 1 . 2]" 1
171 1 68 SER H 1 69 ILE H 3.520 . 3.870 2.358 1.697 2.741 0.103 20 0 "[ . 1 . 2]" 1
172 1 69 ILE H 1 69 ILE HB 3.220 . 3.540 2.571 2.497 2.679 . 0 0 "[ . 1 . 2]" 1
173 1 69 ILE H 1 69 ILE HG12 3.650 . 4.020 2.535 2.059 2.767 . 0 0 "[ . 1 . 2]" 1
174 1 69 ILE H 1 71 VAL QG 4.490 . 4.940 4.545 4.061 4.810 . 0 0 "[ . 1 . 2]" 1
175 1 69 ILE H 1 69 ILE MD 3.830 . 4.210 3.461 3.062 3.650 . 0 0 "[ . 1 . 2]" 1
176 1 50 LEU MD2 1 65 ILE H 4.340 . 4.770 3.552 2.374 4.591 . 0 0 "[ . 1 . 2]" 1
177 1 53 ALA MB 1 65 ILE H 4.410 . 4.850 3.750 3.288 4.446 . 0 0 "[ . 1 . 2]" 1
178 1 53 ALA HA 1 65 ILE H 4.330 . 4.760 2.800 2.186 3.429 . 0 0 "[ . 1 . 2]" 1
179 1 65 ILE H 1 65 ILE HB 3.990 . 4.390 2.645 2.452 2.803 . 0 0 "[ . 1 . 2]" 1
180 1 65 ILE H 1 65 ILE HG13 4.240 . 4.660 2.827 2.495 3.208 . 0 0 "[ . 1 . 2]" 1
181 1 54 LEU MD1 1 65 ILE H 5.890 . 6.480 5.405 4.519 5.764 . 0 0 "[ . 1 . 2]" 1
182 1 65 ILE H 1 65 ILE MG 3.950 . 4.350 3.862 3.784 3.916 . 0 0 "[ . 1 . 2]" 1
183 1 36 GLY H 1 37 THR MG 4.250 . 4.680 3.780 3.547 4.051 . 0 0 "[ . 1 . 2]" 1
184 1 65 ILE H 1 66 GLU H 5.110 . 5.620 4.348 3.960 4.573 . 0 0 "[ . 1 . 2]" 1
185 1 36 GLY H 1 38 VAL MG2 4.630 . 5.090 4.181 3.895 4.421 . 0 0 "[ . 1 . 2]" 1
186 1 36 GLY H 1 45 ILE MG 4.980 . 5.480 4.640 4.192 5.134 . 0 0 "[ . 1 . 2]" 1
187 1 35 SER HB3 1 36 GLY H 3.300 . 3.630 3.119 2.878 3.511 . 0 0 "[ . 1 . 2]" 1
188 1 36 GLY H 1 37 THR H 3.580 . 3.940 2.619 2.465 2.863 . 0 0 "[ . 1 . 2]" 1
189 1 34 VAL HA 1 36 GLY H 3.970 . 4.370 3.915 3.727 4.129 . 0 0 "[ . 1 . 2]" 1
190 1 33 ILE HA 1 36 GLY H 4.840 . 5.320 3.301 3.096 3.546 . 0 0 "[ . 1 . 2]" 1
191 1 57 ARG H 1 57 ARG HB2 3.900 . 4.290 2.635 2.242 3.614 . 0 0 "[ . 1 . 2]" 1
192 1 57 ARG H 1 57 ARG HG2 5.360 . 5.900 3.710 2.076 4.640 . 0 0 "[ . 1 . 2]" 1
193 1 57 ARG H 1 57 ARG HG3 5.360 . 5.900 3.768 1.917 4.522 . 0 0 "[ . 1 . 2]" 1
194 1 57 ARG H 1 57 ARG HB3 3.900 . 4.290 2.919 2.405 3.619 . 0 0 "[ . 1 . 2]" 1
195 1 56 THR HB 1 57 ARG H 3.930 . 4.320 2.743 2.493 2.996 . 0 0 "[ . 1 . 2]" 1
196 1 18 LEU HA 1 57 ARG H 4.760 . 5.240 3.858 3.079 4.809 . 0 0 "[ . 1 . 2]" 1
197 1 56 THR MG 1 57 ARG H 4.260 . 4.690 3.760 3.615 3.928 . 0 0 "[ . 1 . 2]" 1
198 1 58 ASP H 1 59 ARG HA 5.110 . 5.620 4.642 4.426 4.809 . 0 0 "[ . 1 . 2]" 1
199 1 57 ARG HB3 1 58 ASP H 4.310 . 4.740 3.393 2.734 4.216 . 0 0 "[ . 1 . 2]" 1
200 1 57 ARG HG2 1 58 ASP H 5.820 . 6.400 4.352 2.670 5.392 . 0 0 "[ . 1 . 2]" 1
201 1 57 ARG HG3 1 58 ASP H 5.820 . 6.400 4.410 2.110 5.300 . 0 0 "[ . 1 . 2]" 1
202 1 56 THR HB 1 58 ASP H 3.920 . 4.310 2.819 2.441 3.121 . 0 0 "[ . 1 . 2]" 1
203 1 58 ASP H 1 58 ASP HB3 4.110 . 4.520 3.211 2.475 3.676 . 0 0 "[ . 1 . 2]" 1
204 1 57 ARG HB2 1 58 ASP H 4.310 . 4.740 3.673 2.744 4.339 . 0 0 "[ . 1 . 2]" 1
205 1 56 THR MG 1 58 ASP H 4.350 . 4.790 4.392 4.087 4.670 . 0 0 "[ . 1 . 2]" 1
206 1 58 ASP H 1 60 LYS HG2 6.500 . 7.150 5.086 3.477 6.831 . 0 0 "[ . 1 . 2]" 1
207 1 58 ASP H 1 60 LYS HG3 6.500 . 7.150 4.983 3.968 6.448 . 0 0 "[ . 1 . 2]" 1
208 1 58 ASP H 1 58 ASP HB2 4.110 . 4.520 2.794 2.439 3.694 . 0 0 "[ . 1 . 2]" 1
209 1 33 ILE H 1 34 VAL H 3.830 . 4.210 2.771 2.715 2.826 . 0 0 "[ . 1 . 2]" 1
210 1 34 VAL H 1 34 VAL HB 3.330 . 3.660 2.572 2.527 2.628 . 0 0 "[ . 1 . 2]" 1
211 1 34 VAL H 1 35 SER HB2 4.620 . 5.080 5.107 5.087 5.138 0.058 19 0 "[ . 1 . 2]" 1
212 1 34 VAL H 1 34 VAL MG1 3.880 . 4.270 3.785 3.772 3.792 . 0 0 "[ . 1 . 2]" 1
213 1 33 ILE MG 1 34 VAL H 3.710 . 4.080 3.121 2.983 3.296 . 0 0 "[ . 1 . 2]" 1
214 1 33 ILE HB 1 34 VAL H 3.720 . 4.090 2.473 2.381 2.558 . 0 0 "[ . 1 . 2]" 1
215 1 31 LYS HA 1 34 VAL H 4.050 . 4.460 3.561 3.263 3.887 . 0 0 "[ . 1 . 2]" 1
216 1 79 ALA HA 1 80 THR H 3.230 . 3.550 2.177 2.162 2.229 . 0 0 "[ . 1 . 2]" 1
217 1 79 ALA MB 1 80 THR H 3.420 . 3.760 3.223 2.897 3.427 . 0 0 "[ . 1 . 2]" 1
218 1 9 LEU HG 1 10 CYS H 3.900 . 4.290 3.414 2.785 4.298 0.008 13 0 "[ . 1 . 2]" 1
219 1 9 LEU MD2 1 10 CYS H 3.630 . 3.990 2.954 1.807 4.043 0.053 10 0 "[ . 1 . 2]" 1
220 1 9 LEU HA 1 10 CYS H 3.230 . 3.550 2.386 2.149 3.554 0.004 4 0 "[ . 1 . 2]" 1
221 1 10 CYS H 1 11 SER H 4.640 . 5.100 4.494 4.281 4.618 . 0 0 "[ . 1 . 2]" 1
222 1 55 ILE MD 1 60 LYS H 4.830 . 5.310 3.838 3.280 4.448 . 0 0 "[ . 1 . 2]" 1
223 1 80 THR H 1 83 ILE HG12 5.540 . 6.090 4.706 4.410 5.114 . 0 0 "[ . 1 . 2]" 1
224 1 9 LEU H 1 10 CYS H 4.690 . 5.160 4.179 2.425 4.630 . 0 0 "[ . 1 . 2]" 1
225 1 60 LYS H 1 60 LYS HB2 3.830 . 4.210 2.890 2.404 3.872 . 0 0 "[ . 1 . 2]" 1
226 1 60 LYS H 1 60 LYS HB3 3.830 . 4.210 3.467 2.846 3.752 . 0 0 "[ . 1 . 2]" 1
227 1 56 THR HB 1 60 LYS H 4.280 . 4.710 3.646 3.099 4.156 . 0 0 "[ . 1 . 2]" 1
228 1 60 LYS H 1 60 LYS HG2 4.600 . 5.060 2.956 1.985 3.946 . 0 0 "[ . 1 . 2]" 1
229 1 60 LYS H 1 60 LYS HG3 4.600 . 5.060 3.031 1.855 4.140 . 0 0 "[ . 1 . 2]" 1
230 1 15 ARG HG3 1 16 GLN H 5.260 . 5.790 4.457 3.219 5.330 . 0 0 "[ . 1 . 2]" 1
231 1 60 LYS H 1 60 LYS HE2 6.500 . 7.150 5.139 3.901 6.536 . 0 0 "[ . 1 . 2]" 1
232 1 60 LYS H 1 60 LYS HE3 6.500 . 7.150 5.312 4.039 6.032 . 0 0 "[ . 1 . 2]" 1
233 1 60 LYS H 1 61 GLN QB 5.220 . 5.740 4.663 4.117 5.082 . 0 0 "[ . 1 . 2]" 1
234 1 71 VAL HA 1 72 LEU H 3.290 . 3.620 2.201 2.161 2.275 . 0 0 "[ . 1 . 2]" 1
235 1 72 LEU H 1 72 LEU HG 3.700 . 4.070 2.451 2.289 2.828 . 0 0 "[ . 1 . 2]" 1
236 1 71 VAL QG 1 72 LEU H 3.610 . 3.970 3.168 2.513 3.394 . 0 0 "[ . 1 . 2]" 1
237 1 71 VAL H 1 72 LEU H 4.700 . 5.170 4.267 4.063 4.584 . 0 0 "[ . 1 . 2]" 1
238 1 72 LEU H 1 72 LEU HB2 3.730 . 4.100 2.534 2.475 2.673 . 0 0 "[ . 1 . 2]" 1
239 1 71 VAL HB 1 72 LEU H 4.890 . 5.380 4.387 4.018 4.484 . 0 0 "[ . 1 . 2]" 1
240 1 1 MET HB2 1 2 ASP H 4.960 . 5.460 3.939 2.013 4.606 . 0 0 "[ . 1 . 2]" 1
241 1 1 MET HB3 1 2 ASP H 4.960 . 5.460 3.809 1.890 4.620 . 0 0 "[ . 1 . 2]" 1
242 1 18 LEU H 1 18 LEU QD 4.530 . 4.830 3.421 3.106 3.731 . 0 0 "[ . 1 . 2]" 1
243 1 17 PRO HB3 1 18 LEU H 4.250 . 4.680 3.838 2.567 4.621 . 0 0 "[ . 1 . 2]" 1
244 1 17 PRO HB2 1 18 LEU H 4.250 . 4.680 3.665 2.402 4.327 . 0 0 "[ . 1 . 2]" 1
245 1 89 LYS H 1 89 LYS HE2 6.500 . 7.150 4.862 2.911 6.208 . 0 0 "[ . 1 . 2]" 1
246 1 89 LYS H 1 89 LYS HE3 6.500 . 7.150 4.689 1.755 6.492 0.045 13 0 "[ . 1 . 2]" 1
247 1 88 ASP HA 1 89 LYS H 3.160 . 3.480 2.412 2.139 3.032 . 0 0 "[ . 1 . 2]" 1
248 1 89 LYS H 1 89 LYS HB2 3.930 . 4.320 3.105 2.408 4.042 . 0 0 "[ . 1 . 2]" 1
249 1 89 LYS H 1 89 LYS HG2 4.470 . 4.920 3.057 1.881 4.505 . 0 0 "[ . 1 . 2]" 1
250 1 89 LYS H 1 89 LYS HG3 4.470 . 4.920 3.608 2.458 4.532 . 0 0 "[ . 1 . 2]" 1
251 1 89 LYS H 1 89 LYS HB3 3.930 . 4.320 3.422 2.647 4.139 . 0 0 "[ . 1 . 2]" 1
252 1 89 LYS HA 1 90 LEU H 2.940 . 3.230 2.451 2.115 3.479 0.249 11 0 "[ . 1 . 2]" 1
253 1 89 LYS HB2 1 90 LEU H 4.350 . 4.790 3.436 1.966 4.553 . 0 0 "[ . 1 . 2]" 1
254 1 30 ASN H 1 31 LYS H 3.580 . 3.940 2.832 2.729 2.886 . 0 0 "[ . 1 . 2]" 1
255 1 31 LYS H 1 32 ALA H 3.390 . 3.730 2.774 2.683 2.845 . 0 0 "[ . 1 . 2]" 1
256 1 30 ASN HB3 1 31 LYS H 4.110 . 4.520 3.484 3.327 3.635 . 0 0 "[ . 1 . 2]" 1
257 1 31 LYS H 1 31 LYS HG2 4.170 . 4.590 3.637 3.411 4.076 . 0 0 "[ . 1 . 2]" 1
258 1 31 LYS H 1 33 ILE H 4.640 . 5.100 4.077 3.951 4.208 . 0 0 "[ . 1 . 2]" 1
259 1 31 LYS H 1 31 LYS HB2 2.910 . 3.200 2.414 2.172 2.514 . 0 0 "[ . 1 . 2]" 1
260 1 28 ALA HA 1 31 LYS H 3.730 . 4.100 3.606 3.410 3.857 . 0 0 "[ . 1 . 2]" 1
261 1 30 ASN HB2 1 31 LYS H 4.130 . 4.540 2.683 2.514 2.835 . 0 0 "[ . 1 . 2]" 1
262 1 30 ASN HD22 1 31 LYS H 5.780 . 6.360 5.800 5.668 5.954 . 0 0 "[ . 1 . 2]" 1
263 1 80 THR H 1 81 ILE H 3.660 . 4.030 2.738 2.659 2.813 . 0 0 "[ . 1 . 2]" 1
264 1 57 ARG HA 1 59 ARG H 4.920 . 5.410 3.764 3.491 4.158 . 0 0 "[ . 1 . 2]" 1
265 1 80 THR MG 1 81 ILE H 4.390 . 4.830 3.988 3.867 4.183 . 0 0 "[ . 1 . 2]" 1
266 1 56 THR HB 1 59 ARG H 4.710 . 5.180 3.669 3.210 4.284 . 0 0 "[ . 1 . 2]" 1
267 1 79 ALA MB 1 81 ILE H 3.390 . 3.730 3.005 2.665 3.316 . 0 0 "[ . 1 . 2]" 1
268 1 81 ILE H 1 81 ILE MG 3.080 . 3.390 2.071 1.900 2.216 . 0 0 "[ . 1 . 2]" 1
269 1 59 ARG H 1 61 GLN H 4.710 . 5.180 4.590 4.054 5.222 0.042 13 0 "[ . 1 . 2]" 1
270 1 59 ARG H 1 59 ARG HD3 5.300 . 5.830 3.928 2.247 5.457 . 0 0 "[ . 1 . 2]" 1
271 1 81 ILE H 1 81 ILE HB 3.110 . 3.420 2.506 2.413 2.643 . 0 0 "[ . 1 . 2]" 1
272 1 80 THR HB 1 81 ILE H 4.900 . 5.390 3.856 3.561 4.080 . 0 0 "[ . 1 . 2]" 1
273 1 59 ARG H 1 60 LYS H 3.890 . 4.280 2.794 2.633 3.031 . 0 0 "[ . 1 . 2]" 1
274 1 58 ASP H 1 59 ARG H 3.700 . 4.070 2.467 2.264 2.611 . 0 0 "[ . 1 . 2]" 1
275 1 59 ARG H 1 59 ARG HD2 5.300 . 5.830 4.126 2.094 5.509 . 0 0 "[ . 1 . 2]" 1
276 1 42 ASP HB2 1 43 GLY H 5.180 . 5.700 3.728 2.955 4.168 . 0 0 "[ . 1 . 2]" 1
277 1 42 ASP HB3 1 43 GLY H 5.180 . 5.700 3.548 2.391 4.402 . 0 0 "[ . 1 . 2]" 1
278 1 88 ASP H 1 88 ASP HB2 4.020 . 4.420 2.874 2.287 3.610 . 0 0 "[ . 1 . 2]" 1
279 1 88 ASP H 1 88 ASP HB3 4.020 . 4.420 3.078 2.353 3.693 . 0 0 "[ . 1 . 2]" 1
280 1 41 ALA H 1 43 GLY H 4.560 . 5.020 4.251 4.046 4.454 . 0 0 "[ . 1 . 2]" 1
281 1 87 PRO HA 1 88 ASP H 3.040 . 3.340 2.269 2.143 2.542 . 0 0 "[ . 1 . 2]" 1
282 1 41 ALA HA 1 43 GLY H 4.630 . 5.090 3.968 3.471 4.773 . 0 0 "[ . 1 . 2]" 1
283 1 40 ARG H 1 43 GLY H 5.030 . 5.530 3.884 3.351 4.600 . 0 0 "[ . 1 . 2]" 1
284 1 41 ALA MB 1 43 GLY H 5.690 . 6.260 4.443 4.141 4.753 . 0 0 "[ . 1 . 2]" 1
285 1 90 LEU HA 1 91 GLU H 2.740 . 3.010 2.456 2.149 3.153 0.143 8 0 "[ . 1 . 2]" 1
286 1 90 LEU HB2 1 91 GLU H 4.990 . 5.490 4.098 2.536 4.641 . 0 0 "[ . 1 . 2]" 1
287 1 90 LEU HB3 1 91 GLU H 4.990 . 5.490 3.907 1.975 4.608 . 0 0 "[ . 1 . 2]" 1
288 1 91 GLU HB2 1 92 HIS H 5.740 . 6.310 3.722 1.870 4.583 . 0 0 "[ . 1 . 2]" 1
289 1 91 GLU HB3 1 92 HIS H 5.740 . 6.310 3.921 2.593 4.508 . 0 0 "[ . 1 . 2]" 1
290 1 42 ASP H 1 44 SER H 4.760 . 5.240 4.102 3.520 4.877 . 0 0 "[ . 1 . 2]" 1
291 1 40 ARG HB2 1 44 SER H 5.110 . 5.620 4.207 2.756 5.662 0.042 17 0 "[ . 1 . 2]" 1
292 1 40 ARG HB3 1 44 SER H 5.110 . 5.620 4.299 2.557 5.407 . 0 0 "[ . 1 . 2]" 1
293 1 23 SER HA 1 26 LEU H 4.280 . 4.710 3.208 2.863 3.630 . 0 0 "[ . 1 . 2]" 1
294 1 26 LEU H 1 26 LEU HG 4.510 . 4.960 4.502 4.482 4.536 . 0 0 "[ . 1 . 2]" 1
295 1 25 GLY H 1 26 LEU H 3.600 . 3.960 2.533 2.481 2.639 . 0 0 "[ . 1 . 2]" 1
296 1 21 LEU HG 1 26 LEU H 3.790 . 4.170 2.905 2.506 3.440 . 0 0 "[ . 1 . 2]" 1
297 1 26 LEU H 1 26 LEU HB2 3.490 . 3.840 2.449 2.394 2.509 . 0 0 "[ . 1 . 2]" 1
298 1 26 LEU H 1 26 LEU HB3 3.490 . 3.840 2.530 2.483 2.600 . 0 0 "[ . 1 . 2]" 1
299 1 21 LEU MD2 1 26 LEU H 3.620 . 3.980 3.490 3.164 3.999 0.019 13 0 "[ . 1 . 2]" 1
300 1 24 LYS HA 1 26 LEU H 4.640 . 5.100 4.522 4.374 4.765 . 0 0 "[ . 1 . 2]" 1
301 1 56 THR H 1 57 ARG H 5.370 . 5.910 4.651 4.614 4.689 . 0 0 "[ . 1 . 2]" 1
302 1 56 THR H 1 58 ASP H 5.930 . 6.520 5.304 4.889 5.638 . 0 0 "[ . 1 . 2]" 1
303 1 56 THR H 1 62 VAL HA 4.520 . 4.970 3.546 3.220 4.373 . 0 0 "[ . 1 . 2]" 1
304 1 55 ILE HG12 1 56 THR H 4.050 . 4.460 4.221 3.929 4.416 . 0 0 "[ . 1 . 2]" 1
305 1 55 ILE HG13 1 56 THR H 4.050 . 4.460 2.756 2.416 3.000 . 0 0 "[ . 1 . 2]" 1
306 1 56 THR H 1 59 ARG HA 4.940 . 5.430 3.804 3.083 4.185 . 0 0 "[ . 1 . 2]" 1
307 1 56 THR H 1 56 THR MG 3.580 . 3.940 2.306 2.126 2.513 . 0 0 "[ . 1 . 2]" 1
308 1 18 LEU QD 1 56 THR H 4.110 . 4.520 3.591 2.925 3.968 . 0 0 "[ . 1 . 2]" 1
309 1 56 THR H 1 62 VAL QG 4.610 . 5.070 3.784 3.415 4.514 . 0 0 "[ . 1 . 2]" 1
310 1 55 ILE MD 1 56 THR H 4.130 . 4.540 2.172 2.042 2.324 . 0 0 "[ . 1 . 2]" 1
311 1 56 THR H 1 61 GLN QB 4.920 . 5.410 4.261 3.645 4.870 . 0 0 "[ . 1 . 2]" 1
312 1 27 GLU H 1 29 LEU H 4.370 . 4.810 4.357 4.222 4.494 . 0 0 "[ . 1 . 2]" 1
313 1 29 LEU H 1 86 PHE QD 5.370 . 5.910 5.096 4.152 5.791 . 0 0 "[ . 1 . 2]" 1
314 1 48 GLN H 1 49 SER H 4.690 . 5.160 4.382 4.157 4.583 . 0 0 "[ . 1 . 2]" 1
315 1 48 GLN HA 1 49 SER H 2.860 . 3.150 2.173 2.136 2.297 . 0 0 "[ . 1 . 2]" 1
316 1 33 ILE MG 1 49 SER H 4.040 . 4.440 3.206 2.835 3.708 . 0 0 "[ . 1 . 2]" 1
317 1 29 LEU H 1 30 ASN H 3.690 . 4.060 2.806 2.717 2.888 . 0 0 "[ . 1 . 2]" 1
318 1 29 LEU H 1 29 LEU HB2 3.950 . 4.350 2.338 2.232 2.459 . 0 0 "[ . 1 . 2]" 1
319 1 29 LEU H 1 29 LEU HG 4.190 . 4.610 3.916 3.845 3.992 . 0 0 "[ . 1 . 2]" 1
320 1 28 ALA MB 1 29 LEU H 3.280 . 3.610 2.532 2.406 2.603 . 0 0 "[ . 1 . 2]" 1
321 1 26 LEU MD1 1 29 LEU H 4.390 . 4.830 4.404 3.661 4.745 . 0 0 "[ . 1 . 2]" 1
322 1 29 LEU H 1 29 LEU MD1 4.640 . 5.100 3.662 3.332 3.896 . 0 0 "[ . 1 . 2]" 1
323 1 29 LEU H 1 29 LEU MD2 3.480 . 3.830 2.045 1.790 2.266 0.010 13 0 "[ . 1 . 2]" 1
324 1 29 LEU H 1 31 LYS H 4.570 . 5.030 4.251 4.110 4.376 . 0 0 "[ . 1 . 2]" 1
325 1 68 SER H 1 69 ILE HB 5.260 . 5.790 4.626 3.623 5.102 . 0 0 "[ . 1 . 2]" 1
326 1 66 GLU HA 1 68 SER H 4.820 . 5.300 3.891 3.250 5.130 . 0 0 "[ . 1 . 2]" 1
327 1 65 ILE MG 1 68 SER H 3.560 . 3.920 3.253 2.789 4.003 0.083 9 0 "[ . 1 . 2]" 1
328 1 67 ASP HA 1 68 SER H 3.400 . 3.740 3.122 2.760 3.543 . 0 0 "[ . 1 . 2]" 1
329 1 68 SER H 1 69 ILE HG13 6.180 . 6.800 5.615 4.222 6.289 . 0 0 "[ . 1 . 2]" 1
330 1 14 THR H 1 15 ARG H 4.360 . 4.800 2.570 2.173 2.852 . 0 0 "[ . 1 . 2]" 1
331 1 45 ILE H 1 46 GLN H 4.710 . 5.180 4.555 4.425 4.658 . 0 0 "[ . 1 . 2]" 1
332 1 44 SER HA 1 45 ILE H 3.220 . 3.540 2.307 2.145 2.573 . 0 0 "[ . 1 . 2]" 1
333 1 45 ILE H 1 45 ILE HB 3.180 . 3.500 2.497 2.411 2.540 . 0 0 "[ . 1 . 2]" 1
334 1 45 ILE H 1 45 ILE MD 3.490 . 3.840 3.428 3.246 3.644 . 0 0 "[ . 1 . 2]" 1
335 1 44 SER HB2 1 45 ILE H 5.000 . 5.500 3.778 2.510 4.231 . 0 0 "[ . 1 . 2]" 1
336 1 44 SER HB3 1 45 ILE H 5.000 . 5.500 3.508 2.578 4.176 . 0 0 "[ . 1 . 2]" 1
337 1 45 ILE H 1 45 ILE HG12 3.650 . 4.020 2.335 2.121 2.613 . 0 0 "[ . 1 . 2]" 1
338 1 13 ASP HB2 1 14 THR H 5.670 . 6.240 3.418 2.723 4.123 . 0 0 "[ . 1 . 2]" 1
339 1 13 ASP HB3 1 14 THR H 5.670 . 6.240 3.935 2.674 4.395 . 0 0 "[ . 1 . 2]" 1
340 1 66 GLU H 1 67 ASP H 4.970 . 5.470 4.405 4.322 4.590 . 0 0 "[ . 1 . 2]" 1
341 1 66 GLU H 1 66 GLU HB2 3.930 . 4.320 3.651 2.775 3.979 . 0 0 "[ . 1 . 2]" 1
342 1 65 ILE HA 1 66 GLU H 3.400 . 3.740 2.187 2.157 2.230 . 0 0 "[ . 1 . 2]" 1
343 1 66 GLU H 1 66 GLU HB3 3.930 . 4.320 3.061 2.486 3.400 . 0 0 "[ . 1 . 2]" 1
344 1 66 GLU H 1 71 VAL QG 3.710 . 4.080 2.411 1.874 2.836 . 0 0 "[ . 1 . 2]" 1
345 1 65 ILE MG 1 66 GLU H 3.480 . 3.830 2.722 2.419 3.389 . 0 0 "[ . 1 . 2]" 1
346 1 46 GLN HB2 1 47 ASN H 4.850 . 5.330 4.410 4.135 4.580 . 0 0 "[ . 1 . 2]" 1
347 1 66 GLU H 1 69 ILE H 3.860 . 4.250 3.427 3.139 3.837 . 0 0 "[ . 1 . 2]" 1
348 1 65 ILE HB 1 66 GLU H 4.400 . 4.840 4.211 4.104 4.455 . 0 0 "[ . 1 . 2]" 1
349 1 46 GLN HA 1 47 ASN H 3.270 . 3.600 2.181 2.138 2.242 . 0 0 "[ . 1 . 2]" 1
350 1 66 GLU H 1 71 VAL H 4.630 . 5.090 3.646 3.088 4.236 . 0 0 "[ . 1 . 2]" 1
351 1 46 GLN H 1 47 ASN H 4.820 . 5.300 4.316 3.981 4.541 . 0 0 "[ . 1 . 2]" 1
352 1 47 ASN H 1 48 GLN HA 5.210 . 5.730 4.883 4.619 5.099 . 0 0 "[ . 1 . 2]" 1
353 1 46 GLN HB3 1 47 ASN H 4.850 . 5.330 4.365 3.438 4.524 . 0 0 "[ . 1 . 2]" 1
354 1 47 ASN H 1 48 GLN HG2 5.330 . 5.860 4.734 3.386 5.562 . 0 0 "[ . 1 . 2]" 1
355 1 45 ILE MG 1 47 ASN H 4.400 . 4.840 3.795 3.186 4.336 . 0 0 "[ . 1 . 2]" 1
356 1 41 ALA H 1 78 ILE MD 5.580 . 6.140 4.191 2.961 6.007 . 0 0 "[ . 1 . 2]" 1
357 1 41 ALA H 1 41 ALA MB 3.110 . 3.420 2.237 2.218 2.261 . 0 0 "[ . 1 . 2]" 1
358 1 40 ARG HA 1 41 ALA H 3.490 . 3.840 2.488 2.311 2.720 . 0 0 "[ . 1 . 2]" 1
359 1 40 ARG H 1 41 ALA H 4.690 . 5.160 4.619 4.490 4.697 . 0 0 "[ . 1 . 2]" 1
360 1 41 ALA H 1 77 ALA MB 4.410 . 4.850 3.916 3.056 4.671 . 0 0 "[ . 1 . 2]" 1
361 1 2 ASP HA 1 4 LYS H 4.400 . 4.840 3.708 3.047 4.503 . 0 0 "[ . 1 . 2]" 1
362 1 3 ARG H 1 4 LYS H 3.790 . 4.170 2.559 1.971 2.959 . 0 0 "[ . 1 . 2]" 1
363 1 4 LYS H 1 5 LEU H 3.380 . 3.720 2.610 2.281 2.799 . 0 0 "[ . 1 . 2]" 1
364 1 19 SER H 1 56 THR HA 4.240 . 4.660 3.775 3.349 4.237 . 0 0 "[ . 1 . 2]" 1
365 1 4 LYS H 1 4 LYS HB2 3.760 . 4.140 2.813 2.367 3.650 . 0 0 "[ . 1 . 2]" 1
366 1 3 ARG HB3 1 4 LYS H 4.630 . 5.090 3.962 3.189 4.371 . 0 0 "[ . 1 . 2]" 1
367 1 4 LYS H 1 4 LYS HG2 3.720 . 4.090 2.716 1.863 3.991 . 0 0 "[ . 1 . 2]" 1
368 1 4 LYS H 1 4 LYS HG3 3.720 . 4.090 2.997 2.147 3.713 . 0 0 "[ . 1 . 2]" 1
369 1 3 ARG HG3 1 4 LYS H 5.280 . 5.810 3.592 2.230 5.122 . 0 0 "[ . 1 . 2]" 1
370 1 4 LYS H 1 5 LEU HB2 4.550 . 5.010 4.708 4.358 4.935 . 0 0 "[ . 1 . 2]" 1
371 1 4 LYS H 1 6 LEU H 4.630 . 5.090 4.155 3.782 4.656 . 0 0 "[ . 1 . 2]" 1
372 1 18 LEU H 1 19 SER H 4.950 . 5.440 4.516 4.372 4.642 . 0 0 "[ . 1 . 2]" 1
373 1 19 SER H 1 55 ILE H 3.820 . 4.200 3.091 2.553 3.469 . 0 0 "[ . 1 . 2]" 1
374 1 18 LEU HA 1 19 SER H 3.420 . 3.760 2.238 2.112 2.445 . 0 0 "[ . 1 . 2]" 1
375 1 18 LEU HB2 1 19 SER H 4.550 . 5.010 4.057 3.586 4.370 . 0 0 "[ . 1 . 2]" 1
376 1 18 LEU HG 1 19 SER H 5.080 . 5.590 4.881 4.305 5.135 . 0 0 "[ . 1 . 2]" 1
377 1 18 LEU HB3 1 19 SER H 4.550 . 5.010 3.210 2.374 4.247 . 0 0 "[ . 1 . 2]" 1
378 1 19 SER H 1 55 ILE MG 3.960 . 4.360 3.225 2.791 3.542 . 0 0 "[ . 1 . 2]" 1
379 1 18 LEU QD 1 19 SER H 3.650 . 4.020 2.991 1.748 3.483 0.052 12 0 "[ . 1 . 2]" 1
380 1 19 SER H 1 19 SER HB2 4.130 . 4.540 2.918 2.577 3.918 . 0 0 "[ . 1 . 2]" 1
381 1 19 SER H 1 19 SER HB3 4.130 . 4.540 3.538 2.600 3.944 . 0 0 "[ . 1 . 2]" 1
382 1 26 LEU HB2 1 27 GLU H 4.170 . 4.590 3.882 3.755 4.067 . 0 0 "[ . 1 . 2]" 1
383 1 26 LEU HG 1 27 GLU H 4.150 . 4.570 3.738 3.524 3.972 . 0 0 "[ . 1 . 2]" 1
384 1 26 LEU H 1 27 GLU H 3.550 . 3.900 2.885 2.811 2.943 . 0 0 "[ . 1 . 2]" 1
385 1 26 LEU MD1 1 27 GLU H 5.240 . 5.760 4.475 4.361 4.578 . 0 0 "[ . 1 . 2]" 1
386 1 26 LEU MD2 1 27 GLU H 5.850 . 6.430 4.248 4.031 4.549 . 0 0 "[ . 1 . 2]" 1
387 1 27 GLU H 1 29 LEU MD2 5.850 . 6.430 4.749 4.387 5.105 . 0 0 "[ . 1 . 2]" 1
388 1 27 GLU H 1 27 GLU HB2 3.650 . 4.020 3.621 3.605 3.635 . 0 0 "[ . 1 . 2]" 1
389 1 27 GLU H 1 27 GLU HG3 3.970 . 4.370 3.317 3.076 3.627 . 0 0 "[ . 1 . 2]" 1
390 1 26 LEU HB3 1 27 GLU H 4.170 . 4.590 2.562 2.353 2.856 . 0 0 "[ . 1 . 2]" 1
391 1 39 GLN HA 1 46 GLN H 4.110 . 4.520 3.502 2.665 4.182 . 0 0 "[ . 1 . 2]" 1
392 1 45 ILE MG 1 46 GLN H 3.390 . 3.730 2.575 2.176 3.036 . 0 0 "[ . 1 . 2]" 1
393 1 38 VAL HB 1 46 GLN H 4.080 . 4.490 3.045 2.400 3.530 . 0 0 "[ . 1 . 2]" 1
394 1 38 VAL MG1 1 46 GLN H 4.190 . 4.610 3.203 2.930 3.724 . 0 0 "[ . 1 . 2]" 1
395 1 45 ILE HA 1 46 GLN H 3.330 . 3.660 2.193 2.153 2.292 . 0 0 "[ . 1 . 2]" 1
396 1 38 VAL H 1 46 GLN H 4.890 . 5.380 4.205 3.761 4.687 . 0 0 "[ . 1 . 2]" 1
397 1 63 PHE HA 1 78 ILE H 4.830 . 5.310 3.514 3.104 3.899 . 0 0 "[ . 1 . 2]" 1
398 1 78 ILE H 1 78 ILE HG12 4.820 . 5.300 3.349 2.082 4.308 . 0 0 "[ . 1 . 2]" 1
399 1 78 ILE H 1 78 ILE HG13 4.820 . 5.300 3.643 2.099 4.156 . 0 0 "[ . 1 . 2]" 1
400 1 78 ILE H 1 79 ALA H 4.850 . 5.330 4.528 4.409 4.637 . 0 0 "[ . 1 . 2]" 1
401 1 77 ALA H 1 78 ILE H 4.680 . 5.150 4.439 4.075 4.638 . 0 0 "[ . 1 . 2]" 1
402 1 78 ILE H 1 78 ILE HB 3.820 . 4.200 2.536 2.418 2.643 . 0 0 "[ . 1 . 2]" 1
403 1 78 ILE H 1 78 ILE MD 3.960 . 4.360 2.856 1.812 3.945 . 0 0 "[ . 1 . 2]" 1
404 1 23 SER H 1 26 LEU MD2 4.920 . 5.410 4.939 4.443 5.449 0.039 6 0 "[ . 1 . 2]" 1
405 1 61 GLN QB 1 78 ILE H 4.520 . 4.970 4.213 3.850 4.716 . 0 0 "[ . 1 . 2]" 1
406 1 78 ILE H 1 78 ILE MG 4.220 . 4.640 3.810 3.764 3.863 . 0 0 "[ . 1 . 2]" 1
407 1 22 GLU HG3 1 23 SER H 4.820 . 5.300 3.411 2.667 4.886 . 0 0 "[ . 1 . 2]" 1
408 1 23 SER H 1 25 GLY H 4.950 . 5.440 4.380 4.061 4.687 . 0 0 "[ . 1 . 2]" 1
409 1 22 GLU HA 1 23 SER H 3.420 . 3.760 2.241 2.155 2.407 . 0 0 "[ . 1 . 2]" 1
410 1 22 GLU HG2 1 23 SER H 4.820 . 5.300 4.125 2.952 5.021 . 0 0 "[ . 1 . 2]" 1
411 1 22 GLU H 1 23 SER H 4.850 . 5.330 4.621 4.510 4.679 . 0 0 "[ . 1 . 2]" 1
412 1 23 SER H 1 24 LYS H 4.370 . 4.810 2.836 2.743 2.915 . 0 0 "[ . 1 . 2]" 1
413 1 62 VAL H 1 63 PHE QD 5.130 . 5.640 4.872 4.120 5.336 . 0 0 "[ . 1 . 2]" 1
414 1 83 ILE H 1 84 ALA H 4.970 . 5.470 4.232 4.041 4.490 . 0 0 "[ . 1 . 2]" 1
415 1 84 ALA H 1 86 PHE H 5.240 . 5.760 4.375 4.077 4.654 . 0 0 "[ . 1 . 2]" 1
416 1 61 GLN QB 1 62 VAL H 3.920 . 4.310 2.692 2.269 3.076 . 0 0 "[ . 1 . 2]" 1
417 1 32 ALA MB 1 84 ALA H 4.030 . 4.430 3.534 2.884 4.000 . 0 0 "[ . 1 . 2]" 1
418 1 62 VAL H 1 80 THR H 4.510 . 4.960 4.321 3.914 4.780 . 0 0 "[ . 1 . 2]" 1
419 1 61 GLN H 1 62 VAL H 4.770 . 5.250 4.466 4.346 4.536 . 0 0 "[ . 1 . 2]" 1
420 1 62 VAL H 1 62 VAL HB 3.690 . 4.060 2.689 2.525 2.761 . 0 0 "[ . 1 . 2]" 1
421 1 62 VAL H 1 62 VAL QG 3.620 . 3.980 2.689 2.412 2.870 . 0 0 "[ . 1 . 2]" 1
422 1 62 VAL H 1 63 PHE H 4.760 . 5.240 4.358 4.201 4.522 . 0 0 "[ . 1 . 2]" 1
423 1 61 GLN HA 1 62 VAL H 3.390 . 3.730 2.271 2.176 2.432 . 0 0 "[ . 1 . 2]" 1
424 1 62 VAL H 1 80 THR MG 4.150 . 4.570 3.756 3.053 4.255 . 0 0 "[ . 1 . 2]" 1
425 1 83 ILE HA 1 84 ALA H 2.970 . 3.270 2.204 2.152 2.288 . 0 0 "[ . 1 . 2]" 1
426 1 83 ILE HB 1 84 ALA H 4.540 . 4.990 4.410 4.187 4.454 . 0 0 "[ . 1 . 2]" 1
427 1 84 ALA H 1 84 ALA MB 2.920 . 3.210 2.232 2.219 2.251 . 0 0 "[ . 1 . 2]" 1
428 1 83 ILE MD 1 84 ALA H 4.130 . 4.540 3.909 3.758 4.069 . 0 0 "[ . 1 . 2]" 1
429 1 83 ILE MG 1 84 ALA H 3.480 . 3.830 3.297 2.820 3.544 . 0 0 "[ . 1 . 2]" 1
430 1 62 VAL H 1 78 ILE HB 4.310 . 4.740 3.376 3.029 3.672 . 0 0 "[ . 1 . 2]" 1
431 1 84 ALA H 1 85 ASN H 4.330 . 4.760 2.790 2.584 2.947 . 0 0 "[ . 1 . 2]" 1
432 1 20 LEU H 1 54 LEU HA 5.170 . 5.690 4.952 4.728 5.084 . 0 0 "[ . 1 . 2]" 1
433 1 19 SER HA 1 20 LEU H 3.230 . 3.550 2.499 2.379 2.595 . 0 0 "[ . 1 . 2]" 1
434 1 19 SER HB3 1 20 LEU H 3.700 . 4.070 2.666 2.158 3.718 . 0 0 "[ . 1 . 2]" 1
435 1 20 LEU H 1 20 LEU HB3 3.260 . 3.590 2.749 2.612 2.883 . 0 0 "[ . 1 . 2]" 1
436 1 20 LEU H 1 20 LEU HB2 3.260 . 3.590 2.333 2.210 2.472 . 0 0 "[ . 1 . 2]" 1
437 1 20 LEU H 1 20 LEU MD2 3.910 . 4.300 3.897 3.709 4.059 . 0 0 "[ . 1 . 2]" 1
438 1 20 LEU H 1 54 LEU MD2 4.240 . 4.660 3.993 3.728 4.398 . 0 0 "[ . 1 . 2]" 1
439 1 19 SER H 1 20 LEU H 4.660 . 5.130 4.462 4.412 4.556 . 0 0 "[ . 1 . 2]" 1
440 1 33 ILE H 1 33 ILE MD 3.780 . 4.160 3.625 3.555 3.691 . 0 0 "[ . 1 . 2]" 1
441 1 33 ILE H 1 33 ILE HG12 3.740 . 4.110 3.530 3.394 3.582 . 0 0 "[ . 1 . 2]" 1
442 1 32 ALA MB 1 33 ILE H 3.630 . 3.990 2.676 2.566 2.748 . 0 0 "[ . 1 . 2]" 1
443 1 33 ILE H 1 33 ILE HG13 3.740 . 4.110 2.271 2.119 2.343 . 0 0 "[ . 1 . 2]" 1
444 1 33 ILE H 1 38 VAL MG2 3.530 . 3.880 2.873 2.709 3.204 . 0 0 "[ . 1 . 2]" 1
445 1 33 ILE H 1 33 ILE HB 3.530 . 3.880 2.455 2.418 2.537 . 0 0 "[ . 1 . 2]" 1
446 1 2 ASP HA 1 3 ARG H 3.050 . 3.360 2.443 2.156 3.030 . 0 0 "[ . 1 . 2]" 1
447 1 3 ARG H 1 3 ARG HD2 5.640 . 6.200 4.112 2.305 5.079 . 0 0 "[ . 1 . 2]" 1
448 1 3 ARG H 1 3 ARG HD3 5.640 . 6.200 4.063 1.756 5.106 0.044 20 0 "[ . 1 . 2]" 1
449 1 2 ASP HB3 1 3 ARG H 4.680 . 5.150 3.888 2.359 4.676 . 0 0 "[ . 1 . 2]" 1
450 1 2 ASP HB2 1 3 ARG H 4.680 . 5.150 4.209 3.718 4.536 . 0 0 "[ . 1 . 2]" 1
451 1 3 ARG H 1 3 ARG HB2 3.770 . 4.150 3.234 2.387 3.779 . 0 0 "[ . 1 . 2]" 1
452 1 3 ARG H 1 3 ARG HB3 3.770 . 4.150 3.038 2.365 3.728 . 0 0 "[ . 1 . 2]" 1
453 1 3 ARG H 1 3 ARG HG2 3.800 . 4.180 2.657 1.887 4.024 . 0 0 "[ . 1 . 2]" 1
454 1 24 LYS H 1 24 LYS HB3 4.060 . 4.470 3.088 2.410 3.621 . 0 0 "[ . 1 . 2]" 1
455 1 22 GLU HG2 1 24 LYS H 4.860 . 5.350 3.436 1.813 5.228 . 0 0 "[ . 1 . 2]" 1
456 1 22 GLU HG3 1 24 LYS H 4.860 . 5.350 2.812 1.802 3.665 . 0 0 "[ . 1 . 2]" 1
457 1 24 LYS H 1 24 LYS HB2 4.060 . 4.470 2.474 2.205 2.647 . 0 0 "[ . 1 . 2]" 1
458 1 24 LYS H 1 24 LYS HG2 5.160 . 5.680 3.594 1.933 4.648 . 0 0 "[ . 1 . 2]" 1
459 1 24 LYS H 1 24 LYS HG3 5.160 . 5.680 4.075 3.446 4.554 . 0 0 "[ . 1 . 2]" 1
460 1 12 PRO HB2 1 13 ASP H 4.660 . 5.130 3.847 2.590 4.406 . 0 0 "[ . 1 . 2]" 1
461 1 12 PRO HB3 1 13 ASP H 4.660 . 5.130 3.971 2.503 4.724 . 0 0 "[ . 1 . 2]" 1
462 1 13 ASP H 1 14 THR H 4.540 . 4.990 2.763 2.402 3.017 . 0 0 "[ . 1 . 2]" 1
463 1 65 ILE MG 1 71 VAL H 4.370 . 4.810 3.779 3.487 3.976 . 0 0 "[ . 1 . 2]" 1
464 1 71 VAL H 1 71 VAL HB 3.960 . 4.360 2.589 2.531 2.661 . 0 0 "[ . 1 . 2]" 1
465 1 71 VAL H 1 71 VAL QG 3.450 . 3.790 2.095 1.972 2.272 . 0 0 "[ . 1 . 2]" 1
466 1 70 PRO HA 1 71 VAL H 3.530 . 3.880 2.233 2.204 2.297 . 0 0 "[ . 1 . 2]" 1
467 1 65 ILE HA 1 71 VAL H 4.170 . 4.590 2.447 2.179 2.653 . 0 0 "[ . 1 . 2]" 1
468 1 65 ILE HG12 1 71 VAL H 5.360 . 5.900 3.182 2.578 3.742 . 0 0 "[ . 1 . 2]" 1
469 1 38 VAL H 1 38 VAL HB 3.450 . 3.790 2.545 2.470 2.681 . 0 0 "[ . 1 . 2]" 1
470 1 38 VAL H 1 38 VAL MG2 3.220 . 3.540 2.385 2.134 2.754 . 0 0 "[ . 1 . 2]" 1
471 1 32 ALA MB 1 38 VAL H 4.930 . 5.420 4.060 3.611 4.792 . 0 0 "[ . 1 . 2]" 1
472 1 38 VAL H 1 38 VAL MG1 3.890 . 4.280 3.816 3.787 3.883 . 0 0 "[ . 1 . 2]" 1
473 1 33 ILE HA 1 38 VAL H 4.390 . 4.830 3.606 3.271 4.231 . 0 0 "[ . 1 . 2]" 1
474 1 37 THR MG 1 38 VAL H 4.100 . 4.510 3.243 2.866 4.015 . 0 0 "[ . 1 . 2]" 1
475 1 9 LEU MD2 1 11 SER H 4.860 . 5.350 4.508 3.689 5.474 0.124 4 0 "[ . 1 . 2]" 1
476 1 10 CYS HB2 1 11 SER H 4.700 . 5.170 3.439 2.158 4.135 . 0 0 "[ . 1 . 2]" 1
477 1 10 CYS HB3 1 11 SER H 4.700 . 5.170 3.642 2.216 4.189 . 0 0 "[ . 1 . 2]" 1
478 1 21 LEU H 1 54 LEU H 4.900 . 5.390 4.581 4.317 4.883 . 0 0 "[ . 1 . 2]" 1
479 1 21 LEU H 1 21 LEU HG 4.550 . 5.010 4.470 4.428 4.508 . 0 0 "[ . 1 . 2]" 1
480 1 20 LEU HA 1 21 LEU H 3.480 . 3.830 2.201 2.160 2.271 . 0 0 "[ . 1 . 2]" 1
481 1 21 LEU H 1 21 LEU HB2 3.840 . 4.220 2.589 2.506 2.708 . 0 0 "[ . 1 . 2]" 1
482 1 21 LEU H 1 21 LEU HB3 3.840 . 4.220 2.459 2.386 2.525 . 0 0 "[ . 1 . 2]" 1
483 1 21 LEU H 1 21 LEU MD2 4.400 . 4.840 4.272 4.241 4.318 . 0 0 "[ . 1 . 2]" 1
484 1 21 LEU H 1 54 LEU HA 4.230 . 4.650 2.698 2.228 3.173 . 0 0 "[ . 1 . 2]" 1
485 1 30 ASN H 1 30 ASN HB3 3.660 . 4.030 3.596 3.582 3.611 . 0 0 "[ . 1 . 2]" 1
486 1 29 LEU HB3 1 30 ASN H 3.830 . 4.210 3.229 3.074 3.453 . 0 0 "[ . 1 . 2]" 1
487 1 30 ASN H 1 33 ILE MD 4.490 . 4.940 3.982 3.811 4.187 . 0 0 "[ . 1 . 2]" 1
488 1 21 LEU H 1 55 ILE HB 5.540 . 6.090 4.335 4.078 4.621 . 0 0 "[ . 1 . 2]" 1
489 1 29 LEU HB2 1 30 ASN H 3.830 . 4.210 2.528 2.420 2.668 . 0 0 "[ . 1 . 2]" 1
490 1 30 ASN H 1 30 ASN HD21 4.400 . 4.840 2.267 1.880 3.463 . 0 0 "[ . 1 . 2]" 1
491 1 30 ASN H 1 31 LYS HB2 4.620 . 5.080 4.870 4.624 5.034 . 0 0 "[ . 1 . 2]" 1
492 1 30 ASN H 1 30 ASN HB2 3.660 . 4.030 2.400 2.333 2.481 . 0 0 "[ . 1 . 2]" 1
493 1 20 LEU H 1 21 LEU H 4.760 . 5.240 4.573 4.491 4.640 . 0 0 "[ . 1 . 2]" 1
494 1 30 ASN H 1 30 ASN HD22 4.730 . 5.200 3.584 3.403 3.943 . 0 0 "[ . 1 . 2]" 1
495 1 62 VAL HA 1 63 PHE H 3.470 . 3.820 2.216 2.152 2.317 . 0 0 "[ . 1 . 2]" 1
496 1 62 VAL QG 1 63 PHE H 3.350 . 3.690 2.582 2.127 2.926 . 0 0 "[ . 1 . 2]" 1
497 1 55 ILE HA 1 63 PHE H 4.520 . 4.970 3.717 3.161 4.154 . 0 0 "[ . 1 . 2]" 1
498 1 63 PHE H 1 63 PHE QD 4.300 . 4.730 2.624 2.103 3.078 . 0 0 "[ . 1 . 2]" 1
499 1 62 VAL HB 1 63 PHE H 4.340 . 4.770 4.128 3.795 4.328 . 0 0 "[ . 1 . 2]" 1
500 1 53 ALA MB 1 63 PHE H 4.510 . 4.960 3.918 3.555 4.572 . 0 0 "[ . 1 . 2]" 1
501 1 83 ILE MD 1 85 ASN H 5.090 . 5.600 4.533 4.414 4.880 . 0 0 "[ . 1 . 2]" 1
502 1 83 ILE MG 1 85 ASN H 4.570 . 5.030 2.093 1.760 2.540 0.040 10 0 "[ . 1 . 2]" 1
503 1 85 ASN H 1 85 ASN HD21 5.110 . 5.620 3.235 2.312 4.387 . 0 0 "[ . 1 . 2]" 1
504 1 38 VAL H 1 39 GLN H 4.650 . 5.120 4.281 3.949 4.554 . 0 0 "[ . 1 . 2]" 1
505 1 39 GLN H 1 78 ILE MG 4.850 . 5.330 3.915 3.196 4.587 . 0 0 "[ . 1 . 2]" 1
506 1 38 VAL HA 1 39 GLN H 3.170 . 3.490 2.199 2.150 2.249 . 0 0 "[ . 1 . 2]" 1
507 1 39 GLN H 1 39 GLN HB3 4.070 . 4.480 3.619 3.038 3.840 . 0 0 "[ . 1 . 2]" 1
508 1 38 VAL MG2 1 39 GLN H 4.230 . 4.650 4.186 3.940 4.281 . 0 0 "[ . 1 . 2]" 1
509 1 38 VAL MG1 1 39 GLN H 3.600 . 3.960 3.141 2.512 3.452 . 0 0 "[ . 1 . 2]" 1
510 1 39 GLN H 1 39 GLN HB2 3.830 . 4.210 2.632 2.320 3.735 . 0 0 "[ . 1 . 2]" 1
511 1 38 VAL MG1 1 79 ALA H 4.600 . 5.060 4.551 3.801 5.097 0.037 18 0 "[ . 1 . 2]" 1
512 1 79 ALA H 1 80 THR H 4.650 . 5.120 4.464 4.311 4.616 . 0 0 "[ . 1 . 2]" 1
513 1 78 ILE HA 1 79 ALA H 3.330 . 3.660 2.218 2.176 2.292 . 0 0 "[ . 1 . 2]" 1
514 1 79 ALA H 1 79 ALA MB 3.170 . 3.490 2.305 2.270 2.368 . 0 0 "[ . 1 . 2]" 1
515 1 78 ILE MG 1 79 ALA H 3.810 . 4.190 2.501 2.223 2.719 . 0 0 "[ . 1 . 2]" 1
516 1 78 ILE HB 1 79 ALA H 4.790 . 5.270 4.102 3.875 4.259 . 0 0 "[ . 1 . 2]" 1
517 1 78 ILE HG12 1 79 ALA H 6.080 . 6.690 5.067 4.393 5.318 . 0 0 "[ . 1 . 2]" 1
518 1 78 ILE HG13 1 79 ALA H 6.080 . 6.690 4.821 4.110 5.425 . 0 0 "[ . 1 . 2]" 1
519 1 54 LEU H 1 54 LEU HB2 4.130 . 4.540 2.549 2.410 2.673 . 0 0 "[ . 1 . 2]" 1
520 1 53 ALA MB 1 54 LEU H 3.520 . 3.870 2.323 2.072 2.660 . 0 0 "[ . 1 . 2]" 1
521 1 54 LEU H 1 64 ARG HA 4.950 . 5.440 3.658 2.746 4.061 . 0 0 "[ . 1 . 2]" 1
522 1 54 LEU H 1 63 PHE H 4.210 . 4.630 3.015 2.577 3.549 . 0 0 "[ . 1 . 2]" 1
523 1 54 LEU H 1 62 VAL QG 3.590 . 3.950 3.109 2.751 3.573 . 0 0 "[ . 1 . 2]" 1
524 1 54 LEU H 1 54 LEU HB3 4.130 . 4.540 3.716 3.638 3.797 . 0 0 "[ . 1 . 2]" 1
525 1 54 LEU H 1 65 ILE HG13 4.630 . 5.090 3.498 2.973 4.004 . 0 0 "[ . 1 . 2]" 1
526 1 54 LEU H 1 54 LEU HG 3.940 . 4.330 2.876 2.674 3.014 . 0 0 "[ . 1 . 2]" 1
527 1 21 LEU MD2 1 54 LEU H 4.540 . 4.990 4.388 3.908 4.805 . 0 0 "[ . 1 . 2]" 1
528 1 53 ALA HA 1 54 LEU H 3.550 . 3.900 2.427 2.261 2.569 . 0 0 "[ . 1 . 2]" 1
529 1 52 GLU HA 1 53 ALA H 3.040 . 3.340 2.253 2.151 2.378 . 0 0 "[ . 1 . 2]" 1
530 1 21 LEU H 1 53 ALA H 4.270 . 4.700 3.763 3.325 4.091 . 0 0 "[ . 1 . 2]" 1
531 1 26 LEU MD1 1 53 ALA H 4.290 . 4.720 3.342 2.576 4.149 . 0 0 "[ . 1 . 2]" 1
532 1 53 ALA H 1 65 ILE MD 3.920 . 4.310 3.213 2.650 3.759 . 0 0 "[ . 1 . 2]" 1
533 1 40 ARG H 1 44 SER H 4.740 . 5.210 3.792 3.064 4.574 . 0 0 "[ . 1 . 2]" 1
534 1 20 LEU MD2 1 53 ALA H 3.660 . 4.030 3.365 2.989 3.859 . 0 0 "[ . 1 . 2]" 1
535 1 20 LEU MD1 1 53 ALA H 3.980 . 4.380 3.389 2.634 4.124 . 0 0 "[ . 1 . 2]" 1
536 1 40 ARG H 1 40 ARG HG2 4.970 . 5.470 3.327 1.898 4.600 . 0 0 "[ . 1 . 2]" 1
537 1 40 ARG H 1 40 ARG HG3 4.970 . 5.470 3.483 2.232 4.609 . 0 0 "[ . 1 . 2]" 1
538 1 40 ARG H 1 40 ARG HD2 5.870 . 6.460 4.512 3.567 5.890 . 0 0 "[ . 1 . 2]" 1
539 1 40 ARG H 1 40 ARG HD3 5.870 . 6.460 4.629 2.171 5.881 . 0 0 "[ . 1 . 2]" 1
540 1 39 GLN HA 1 40 ARG H 3.410 . 3.750 2.164 2.123 2.236 . 0 0 "[ . 1 . 2]" 1
541 1 40 ARG H 1 45 ILE HA 4.100 . 4.510 3.545 2.918 4.164 . 0 0 "[ . 1 . 2]" 1
542 1 40 ARG H 1 46 GLN H 4.550 . 5.010 3.951 3.119 4.526 . 0 0 "[ . 1 . 2]" 1
543 1 21 LEU HG 1 22 GLU H 4.490 . 4.940 3.367 3.127 3.827 . 0 0 "[ . 1 . 2]" 1
544 1 21 LEU HA 1 22 GLU H 3.380 . 3.720 2.142 2.113 2.170 . 0 0 "[ . 1 . 2]" 1
545 1 22 GLU H 1 55 ILE MG 3.910 . 4.300 3.123 2.681 3.761 . 0 0 "[ . 1 . 2]" 1
546 1 21 LEU MD1 1 22 GLU H 3.520 . 3.870 2.246 1.944 2.614 . 0 0 "[ . 1 . 2]" 1
547 1 22 GLU H 1 22 GLU HG3 4.590 . 5.050 4.025 2.999 4.484 . 0 0 "[ . 1 . 2]" 1
548 1 21 LEU MD2 1 22 GLU H 4.790 . 5.270 4.630 4.468 4.959 . 0 0 "[ . 1 . 2]" 1
549 1 22 GLU H 1 22 GLU HG2 4.590 . 5.050 3.718 1.912 4.621 . 0 0 "[ . 1 . 2]" 1
550 1 21 LEU H 1 22 GLU H 4.720 . 5.190 4.515 4.334 4.590 . 0 0 "[ . 1 . 2]" 1
551 1 50 LEU H 1 50 LEU HG 3.800 . 4.180 2.033 1.770 2.622 0.030 7 0 "[ . 1 . 2]" 1
552 1 33 ILE MD 1 50 LEU H 4.130 . 4.540 2.629 2.015 3.502 . 0 0 "[ . 1 . 2]" 1
553 1 49 SER H 1 50 LEU H 4.750 . 5.220 4.490 4.046 4.672 . 0 0 "[ . 1 . 2]" 1
554 1 49 SER HA 1 50 LEU H 3.360 . 3.700 2.263 2.133 2.532 . 0 0 "[ . 1 . 2]" 1
555 1 50 LEU H 1 50 LEU HB3 3.850 . 4.230 3.206 2.817 3.628 . 0 0 "[ . 1 . 2]" 1
556 1 50 LEU H 1 50 LEU MD1 3.750 . 4.130 2.676 2.176 3.148 . 0 0 "[ . 1 . 2]" 1
557 1 66 GLU HG2 1 67 ASP H 5.100 . 5.610 4.839 4.203 5.280 . 0 0 "[ . 1 . 2]" 1
558 1 66 GLU HG3 1 67 ASP H 5.100 . 5.610 3.840 2.780 4.477 . 0 0 "[ . 1 . 2]" 1
559 1 67 ASP H 1 69 ILE H 5.130 . 5.640 4.343 3.990 4.904 . 0 0 "[ . 1 . 2]" 1
560 1 66 GLU HB3 1 67 ASP H 4.820 . 5.300 4.089 3.910 4.320 . 0 0 "[ . 1 . 2]" 1
561 1 64 ARG H 1 65 ILE H 5.000 . 5.500 4.550 4.460 4.634 . 0 0 "[ . 1 . 2]" 1
562 1 66 GLU HB2 1 67 ASP H 4.820 . 5.300 3.269 2.620 4.282 . 0 0 "[ . 1 . 2]" 1
563 1 66 GLU HA 1 67 ASP H 3.520 . 3.870 2.232 2.146 2.371 . 0 0 "[ . 1 . 2]" 1
564 1 65 ILE MG 1 67 ASP H 4.750 . 5.220 4.360 4.006 4.830 . 0 0 "[ . 1 . 2]" 1
565 1 67 ASP H 1 68 SER H 4.020 . 4.420 3.097 2.591 4.171 . 0 0 "[ . 1 . 2]" 1
566 1 63 PHE HB2 1 64 ARG H 4.590 . 5.050 3.699 3.306 4.085 . 0 0 "[ . 1 . 2]" 1
567 1 63 PHE HB3 1 64 ARG H 4.590 . 5.050 2.480 2.042 3.006 . 0 0 "[ . 1 . 2]" 1
568 1 50 LEU MD2 1 64 ARG H 5.180 . 5.700 4.736 4.027 5.543 . 0 0 "[ . 1 . 2]" 1
569 1 54 LEU MD1 1 64 ARG H 4.470 . 4.920 4.563 3.851 4.970 0.050 7 0 "[ . 1 . 2]" 1
570 1 63 PHE H 1 64 ARG H 5.280 . 5.810 4.534 4.472 4.588 . 0 0 "[ . 1 . 2]" 1
571 1 64 ARG H 1 64 ARG HD2 6.500 . 7.150 5.274 3.100 6.051 . 0 0 "[ . 1 . 2]" 1
572 1 64 ARG H 1 64 ARG HD3 6.500 . 7.150 4.943 3.587 5.990 . 0 0 "[ . 1 . 2]" 1
573 1 21 LEU H 1 55 ILE H 4.560 . 5.020 3.519 2.987 4.104 . 0 0 "[ . 1 . 2]" 1
574 1 21 LEU MD1 1 55 ILE H 6.230 . 6.850 4.313 3.940 4.812 . 0 0 "[ . 1 . 2]" 1
575 1 20 LEU HA 1 55 ILE H 4.350 . 4.790 3.675 3.348 4.306 . 0 0 "[ . 1 . 2]" 1
576 1 55 ILE H 1 55 ILE MG 3.440 . 3.780 2.102 1.943 2.375 . 0 0 "[ . 1 . 2]" 1
577 1 18 LEU QD 1 55 ILE H 4.280 . 4.710 3.856 2.657 4.611 . 0 0 "[ . 1 . 2]" 1
578 1 18 LEU HA 1 55 ILE H 5.470 . 6.020 4.800 3.763 5.351 . 0 0 "[ . 1 . 2]" 1
579 1 54 LEU H 1 55 ILE H 4.790 . 5.270 4.461 4.338 4.567 . 0 0 "[ . 1 . 2]" 1
580 1 55 ILE H 1 56 THR H 5.010 . 5.510 4.427 4.300 4.555 . 0 0 "[ . 1 . 2]" 1
581 1 55 ILE H 1 55 ILE HB 4.170 . 4.590 3.053 2.851 3.318 . 0 0 "[ . 1 . 2]" 1
582 1 75 GLU H 1 76 GLU H 3.860 . 4.250 2.660 2.487 2.887 . 0 0 "[ . 1 . 2]" 1
583 1 73 LEU HB3 1 75 GLU H 4.380 . 4.820 2.971 2.671 3.296 . 0 0 "[ . 1 . 2]" 1
584 1 73 LEU MD1 1 75 GLU H 4.730 . 5.200 4.655 4.360 4.877 . 0 0 "[ . 1 . 2]" 1
585 1 73 LEU MD2 1 75 GLU H 4.950 . 5.440 4.574 4.372 4.924 . 0 0 "[ . 1 . 2]" 1
586 1 74 PRO HG2 1 75 GLU H 4.070 . 4.480 2.850 2.353 3.969 . 0 0 "[ . 1 . 2]" 1
587 1 74 PRO HG3 1 75 GLU H 4.070 . 4.480 4.214 3.926 4.538 0.058 15 0 "[ . 1 . 2]" 1
588 1 73 LEU HB2 1 75 GLU H 4.680 . 5.150 3.861 3.240 4.198 . 0 0 "[ . 1 . 2]" 1
589 1 30 ASN HD21 1 31 LYS HB2 5.990 . 6.590 6.542 6.185 6.677 0.087 1 0 "[ . 1 . 2]" 1
590 1 40 ARG H 1 45 ILE MD 4.930 . 5.420 4.266 3.690 5.248 . 0 0 "[ . 1 . 2]" 1
591 1 45 ILE HA 1 45 ILE MD 3.340 . 3.670 2.025 1.969 2.072 . 0 0 "[ . 1 . 2]" 1
592 1 45 ILE MD 1 46 GLN H 3.980 . 4.380 3.601 3.456 3.746 . 0 0 "[ . 1 . 2]" 1
593 1 39 GLN HA 1 45 ILE MD 3.900 . 4.290 2.646 2.196 3.360 . 0 0 "[ . 1 . 2]" 1
594 1 39 GLN HG3 1 45 ILE MD 4.100 . 4.510 2.851 1.796 4.532 0.022 1 0 "[ . 1 . 2]" 1
595 1 45 ILE HB 1 45 ILE MD 3.440 . 3.780 3.244 3.239 3.249 . 0 0 "[ . 1 . 2]" 1
596 1 37 THR H 1 45 ILE MD 4.650 . 5.120 4.693 4.013 5.150 0.030 5 0 "[ . 1 . 2]" 1
597 1 67 ASP HB2 1 69 ILE MD 5.340 . 5.870 5.794 5.444 5.939 0.069 1 0 "[ . 1 . 2]" 1
598 1 69 ILE MD 1 69 ILE MG 3.070 . 3.380 2.032 1.994 2.068 . 0 0 "[ . 1 . 2]" 1
599 1 69 ILE HB 1 69 ILE MD 3.290 . 3.620 3.246 3.240 3.252 . 0 0 "[ . 1 . 2]" 1
600 1 68 SER HB3 1 69 ILE MD 4.810 . 5.290 3.839 3.131 4.395 . 0 0 "[ . 1 . 2]" 1
601 1 78 ILE HB 1 78 ILE MD 3.540 . 3.890 2.767 2.334 3.249 . 0 0 "[ . 1 . 2]" 1
602 1 78 ILE MD 1 78 ILE MG 3.070 . 3.380 2.571 1.971 3.259 . 0 0 "[ . 1 . 2]" 1
603 1 65 ILE H 1 65 ILE MD 4.400 . 4.840 4.078 3.897 4.381 . 0 0 "[ . 1 . 2]" 1
604 1 54 LEU HA 1 65 ILE MD 4.950 . 5.440 3.832 3.354 4.430 . 0 0 "[ . 1 . 2]" 1
605 1 52 GLU HB2 1 65 ILE MD 4.270 . 4.700 3.836 2.689 4.600 . 0 0 "[ . 1 . 2]" 1
606 1 40 ARG HA 1 78 ILE MD 4.600 . 5.060 3.082 1.904 4.518 . 0 0 "[ . 1 . 2]" 1
607 1 81 ILE H 1 81 ILE MD 4.340 . 4.770 4.124 3.989 4.416 . 0 0 "[ . 1 . 2]" 1
608 1 81 ILE HA 1 81 ILE MD 3.360 . 3.700 2.283 1.952 3.789 0.089 2 0 "[ . 1 . 2]" 1
609 1 81 ILE HB 1 81 ILE MD 3.170 . 3.490 2.418 2.402 2.436 . 0 0 "[ . 1 . 2]" 1
610 1 52 GLU HB3 1 65 ILE MD 4.270 . 4.700 2.858 1.775 4.027 0.025 12 0 "[ . 1 . 2]" 1
611 1 54 LEU HG 1 65 ILE MD 3.090 . 3.400 2.334 1.893 2.880 . 0 0 "[ . 1 . 2]" 1
612 1 65 ILE MD 1 66 GLU H 5.680 . 6.250 5.105 4.788 5.515 . 0 0 "[ . 1 . 2]" 1
613 1 65 ILE MD 1 68 SER H 6.240 . 6.860 5.971 5.448 6.730 . 0 0 "[ . 1 . 2]" 1
614 1 83 ILE MD 1 83 ILE MG 2.810 . 3.090 2.026 1.962 2.070 . 0 0 "[ . 1 . 2]" 1
615 1 33 ILE HB 1 33 ILE MD 3.330 . 3.660 2.435 2.404 2.457 . 0 0 "[ . 1 . 2]" 1
616 1 30 ASN HD21 1 33 ILE MD 5.010 . 5.510 4.567 3.413 5.334 . 0 0 "[ . 1 . 2]" 1
617 1 29 LEU MD1 1 83 ILE MD 3.260 . 3.590 2.200 1.787 2.577 0.013 18 0 "[ . 1 . 2]" 1
618 1 33 ILE MD 1 49 SER H 4.370 . 4.810 4.019 3.726 4.279 . 0 0 "[ . 1 . 2]" 1
619 1 78 ILE MG 1 83 ILE MD 3.290 . 3.620 2.281 1.860 3.008 . 0 0 "[ . 1 . 2]" 1
620 1 33 ILE MD 1 34 VAL H 4.720 . 5.190 4.515 4.412 4.599 . 0 0 "[ . 1 . 2]" 1
621 1 83 ILE MD 1 86 PHE QD 4.350 . 4.790 4.578 4.113 4.769 . 0 0 "[ . 1 . 2]" 1
622 1 32 ALA MB 1 83 ILE MD 3.100 . 3.410 2.210 1.952 2.465 . 0 0 "[ . 1 . 2]" 1
623 1 83 ILE HA 1 83 ILE MD 3.760 . 4.140 2.071 2.020 2.141 . 0 0 "[ . 1 . 2]" 1
624 1 29 LEU HA 1 83 ILE MD 3.650 . 4.020 2.884 2.093 3.401 . 0 0 "[ . 1 . 2]" 1
625 1 82 GLN HG2 1 83 ILE MD 6.500 . 7.150 4.935 3.104 5.963 . 0 0 "[ . 1 . 2]" 1
626 1 82 GLN HG3 1 83 ILE MD 6.500 . 7.150 4.594 2.099 5.798 . 0 0 "[ . 1 . 2]" 1
627 1 18 LEU HA 1 55 ILE MG 5.890 . 6.480 4.705 4.182 5.152 . 0 0 "[ . 1 . 2]" 1
628 1 55 ILE MG 1 62 VAL HA 6.500 . 7.150 5.324 4.931 5.578 . 0 0 "[ . 1 . 2]" 1
629 1 20 LEU HA 1 55 ILE MG 4.790 . 5.270 3.875 3.447 4.179 . 0 0 "[ . 1 . 2]" 1
630 1 55 ILE MG 1 56 THR HA 5.210 . 5.730 4.335 4.120 4.464 . 0 0 "[ . 1 . 2]" 1
631 1 54 LEU HA 1 55 ILE MG 4.460 . 4.910 3.679 3.594 3.746 . 0 0 "[ . 1 . 2]" 1
632 1 21 LEU HA 1 55 ILE MG 3.810 . 4.190 2.175 1.916 2.489 . 0 0 "[ . 1 . 2]" 1
633 1 21 LEU H 1 55 ILE MG 4.560 . 5.020 3.433 3.161 3.857 . 0 0 "[ . 1 . 2]" 1
634 1 21 LEU MD1 1 55 ILE MG 3.260 . 3.590 2.748 2.409 3.214 . 0 0 "[ . 1 . 2]" 1
635 1 19 SER HB2 1 55 ILE MG 4.110 . 4.520 2.984 2.194 4.176 . 0 0 "[ . 1 . 2]" 1
636 1 55 ILE MG 1 56 THR H 5.010 . 5.510 3.907 3.722 4.013 . 0 0 "[ . 1 . 2]" 1
637 1 33 ILE MD 1 33 ILE MG 3.010 . 3.310 1.959 1.930 2.000 . 0 0 "[ . 1 . 2]" 1
638 1 33 ILE MG 1 48 GLN HA 3.970 . 4.370 3.748 3.336 4.321 . 0 0 "[ . 1 . 2]" 1
639 1 30 ASN HA 1 33 ILE MG 4.200 . 4.620 3.797 3.631 4.092 . 0 0 "[ . 1 . 2]" 1
640 1 33 ILE MG 1 47 ASN H 4.630 . 5.090 4.098 3.723 4.508 . 0 0 "[ . 1 . 2]" 1
641 1 33 ILE MG 1 49 SER HA 3.600 . 3.960 2.407 2.090 3.084 . 0 0 "[ . 1 . 2]" 1
642 1 33 ILE H 1 33 ILE MG 4.050 . 4.460 3.769 3.753 3.783 . 0 0 "[ . 1 . 2]" 1
643 1 55 ILE HB 1 55 ILE MD 3.500 . 3.850 2.419 2.403 2.437 . 0 0 "[ . 1 . 2]" 1
644 1 33 ILE MG 1 50 LEU H 4.750 . 5.220 4.213 3.663 5.188 . 0 0 "[ . 1 . 2]" 1
645 1 55 ILE MD 1 80 THR MG 3.530 . 3.880 2.715 2.292 3.381 . 0 0 "[ . 1 . 2]" 1
646 1 55 ILE MD 1 59 ARG H 4.340 . 4.770 3.789 3.633 3.961 . 0 0 "[ . 1 . 2]" 1
647 1 55 ILE HA 1 55 ILE MD 4.280 . 4.710 2.035 1.996 2.091 . 0 0 "[ . 1 . 2]" 1
648 1 55 ILE MD 1 59 ARG HA 3.890 . 4.280 2.007 1.791 2.265 0.009 7 0 "[ . 1 . 2]" 1
649 1 55 ILE MD 1 59 ARG HB2 4.520 . 4.970 4.298 3.936 4.648 . 0 0 "[ . 1 . 2]" 1
650 1 55 ILE MD 1 59 ARG HB3 4.520 . 4.970 3.178 2.660 3.630 . 0 0 "[ . 1 . 2]" 1
651 1 55 ILE MD 1 59 ARG HD2 4.990 . 5.490 4.352 2.905 5.530 0.040 6 0 "[ . 1 . 2]" 1
652 1 55 ILE MD 1 59 ARG HD3 4.990 . 5.490 4.173 2.186 5.441 . 0 0 "[ . 1 . 2]" 1
653 1 69 ILE H 1 69 ILE MG 3.970 . 4.370 3.827 3.781 3.874 . 0 0 "[ . 1 . 2]" 1
654 1 69 ILE HA 1 69 ILE MG 3.360 . 3.700 2.400 2.339 2.435 . 0 0 "[ . 1 . 2]" 1
655 1 69 ILE HG12 1 69 ILE MG 3.370 . 3.710 3.216 3.212 3.219 . 0 0 "[ . 1 . 2]" 1
656 1 40 ARG HA 1 78 ILE MG 4.990 . 5.490 4.035 3.397 4.758 . 0 0 "[ . 1 . 2]" 1
657 1 38 VAL MG1 1 78 ILE MG 2.940 . 3.230 1.990 1.766 2.319 0.034 18 0 "[ . 1 . 2]" 1
658 1 78 ILE MG 1 80 THR H 4.250 . 4.680 4.158 3.831 4.494 . 0 0 "[ . 1 . 2]" 1
659 1 38 VAL HB 1 78 ILE MG 5.430 . 5.970 4.553 4.277 4.940 . 0 0 "[ . 1 . 2]" 1
660 1 69 ILE MG 1 70 PRO HB2 4.480 . 4.930 4.566 4.028 4.942 0.012 8 0 "[ . 1 . 2]" 1
661 1 62 VAL H 1 78 ILE MG 4.480 . 4.930 4.149 3.843 4.375 . 0 0 "[ . 1 . 2]" 1
662 1 38 VAL HA 1 78 ILE MG 4.780 . 5.260 3.745 3.402 4.382 . 0 0 "[ . 1 . 2]" 1
663 1 29 LEU MD1 1 78 ILE MG 3.320 . 3.650 2.441 1.937 3.087 . 0 0 "[ . 1 . 2]" 1
664 1 69 ILE HG13 1 69 ILE MG 3.230 . 3.550 2.356 2.344 2.380 . 0 0 "[ . 1 . 2]" 1
665 1 81 ILE MG 1 82 GLN HA 4.210 . 4.630 3.488 3.331 3.766 . 0 0 "[ . 1 . 2]" 1
666 1 81 ILE HG13 1 81 ILE MG 3.340 . 3.670 2.567 2.440 3.224 . 0 0 "[ . 1 . 2]" 1
667 1 79 ALA HA 1 81 ILE MG 4.880 . 5.370 3.919 3.739 4.122 . 0 0 "[ . 1 . 2]" 1
668 1 80 THR H 1 81 ILE MG 4.300 . 4.730 3.912 3.757 4.089 . 0 0 "[ . 1 . 2]" 1
669 1 79 ALA MB 1 81 ILE MG 3.010 . 3.310 2.040 1.797 2.294 0.003 20 0 "[ . 1 . 2]" 1
670 1 81 ILE HA 1 81 ILE MG 3.480 . 3.830 3.220 3.212 3.226 . 0 0 "[ . 1 . 2]" 1
671 1 37 THR MG 1 45 ILE MG 5.110 . 5.620 5.180 4.770 5.622 0.002 7 0 "[ . 1 . 2]" 1
672 1 45 ILE MG 1 47 ASN HB3 4.990 . 5.490 4.719 3.066 5.299 . 0 0 "[ . 1 . 2]" 1
673 1 45 ILE MG 1 47 ASN HB2 4.990 . 5.490 4.719 3.649 5.314 . 0 0 "[ . 1 . 2]" 1
674 1 38 VAL H 1 45 ILE MG 4.380 . 4.820 3.090 1.862 3.542 . 0 0 "[ . 1 . 2]" 1
675 1 45 ILE H 1 45 ILE MG 3.970 . 4.370 3.790 3.767 3.806 . 0 0 "[ . 1 . 2]" 1
676 1 45 ILE MG 1 47 ASN HA 4.160 . 4.580 3.654 3.061 4.039 . 0 0 "[ . 1 . 2]" 1
677 1 39 GLN HA 1 45 ILE MG 4.700 . 5.170 4.169 3.817 4.529 . 0 0 "[ . 1 . 2]" 1
678 1 45 ILE HG12 1 45 ILE MG 3.520 . 3.870 3.217 3.211 3.220 . 0 0 "[ . 1 . 2]" 1
679 1 45 ILE HA 1 45 ILE MG 3.380 . 3.720 2.438 2.404 2.496 . 0 0 "[ . 1 . 2]" 1
680 1 33 ILE MG 1 45 ILE MG 5.230 . 5.750 4.400 3.959 4.691 . 0 0 "[ . 1 . 2]" 1
681 1 38 VAL MG1 1 45 ILE MG 5.650 . 6.210 4.441 3.929 4.794 . 0 0 "[ . 1 . 2]" 1
682 1 45 ILE HG13 1 45 ILE MG 3.340 . 3.670 2.381 2.361 2.445 . 0 0 "[ . 1 . 2]" 1
683 1 37 THR HA 1 45 ILE MG 4.360 . 4.800 4.131 3.448 4.650 . 0 0 "[ . 1 . 2]" 1
684 1 65 ILE MG 1 71 VAL QG 3.690 . 4.060 3.841 3.409 4.090 0.030 19 0 "[ . 1 . 2]" 1
685 1 54 LEU MD2 1 65 ILE MG 3.990 . 4.390 4.367 4.027 4.435 0.045 20 0 "[ . 1 . 2]" 1
686 1 83 ILE HA 1 83 ILE MG 3.360 . 3.700 2.383 2.351 2.452 . 0 0 "[ . 1 . 2]" 1
687 1 83 ILE MG 1 84 ALA HA 4.570 . 5.030 4.397 4.195 4.507 . 0 0 "[ . 1 . 2]" 1
688 1 32 ALA MB 1 83 ILE MG 2.940 . 3.230 2.000 1.794 2.371 0.006 16 0 "[ . 1 . 2]" 1
689 1 52 GLU HB2 1 65 ILE MG 4.850 . 5.330 3.786 2.484 4.786 . 0 0 "[ . 1 . 2]" 1
690 1 52 GLU HB3 1 65 ILE MG 4.850 . 5.330 3.201 2.580 3.916 . 0 0 "[ . 1 . 2]" 1
691 1 65 ILE MG 1 69 ILE HB 5.570 . 6.130 4.356 3.953 4.803 . 0 0 "[ . 1 . 2]" 1
692 1 65 ILE MG 1 69 ILE HA 4.370 . 4.810 3.849 3.578 4.115 . 0 0 "[ . 1 . 2]" 1
693 1 65 ILE HA 1 65 ILE MG 3.420 . 3.760 2.422 2.367 2.491 . 0 0 "[ . 1 . 2]" 1
694 1 65 ILE MG 1 68 SER HA 3.380 . 3.720 2.863 2.422 3.361 . 0 0 "[ . 1 . 2]" 1
695 1 83 ILE MG 1 86 PHE QD 3.450 . 3.790 2.379 1.934 2.801 . 0 0 "[ . 1 . 2]" 1
696 1 83 ILE MG 1 86 PHE HB2 4.350 . 4.790 2.681 2.134 3.638 . 0 0 "[ . 1 . 2]" 1
697 1 78 ILE MG 1 83 ILE MG 5.670 . 6.240 4.643 4.253 5.481 . 0 0 "[ . 1 . 2]" 1
698 1 80 THR MG 1 83 ILE MG 5.970 . 6.570 4.802 4.130 5.439 . 0 0 "[ . 1 . 2]" 1
699 1 28 ALA MB 1 31 LYS HB2 4.050 . 4.460 4.159 3.889 4.516 0.056 20 0 "[ . 1 . 2]" 1
700 1 84 ALA MB 1 85 ASN HD22 4.610 . 5.070 3.987 3.144 4.922 . 0 0 "[ . 1 . 2]" 1
701 1 84 ALA MB 1 85 ASN H 3.690 . 4.060 3.059 2.597 3.479 . 0 0 "[ . 1 . 2]" 1
702 1 28 ALA MB 1 86 PHE QD 3.560 . 3.920 3.042 2.266 3.910 . 0 0 "[ . 1 . 2]" 1
703 1 84 ALA MB 1 85 ASN HA 4.610 . 5.070 4.024 3.823 4.232 . 0 0 "[ . 1 . 2]" 1
704 1 78 ILE MG 1 79 ALA MB 3.850 . 4.230 3.743 3.548 3.905 . 0 0 "[ . 1 . 2]" 1
705 1 29 LEU HA 1 32 ALA MB 3.700 . 4.070 2.734 2.467 2.900 . 0 0 "[ . 1 . 2]" 1
706 1 65 ILE HG12 1 71 VAL QG 5.330 . 5.860 4.341 3.746 4.847 . 0 0 "[ . 1 . 2]" 1
707 1 71 VAL QG 1 73 LEU HB2 . . 4.250 2.348 2.162 2.587 . 0 0 "[ . 1 . 2]" 1
708 1 63 PHE QE 1 77 ALA MB 3.600 . 3.960 2.678 2.343 3.097 . 0 0 "[ . 1 . 2]" 1
709 1 74 PRO HA 1 77 ALA MB 3.910 . 4.300 2.718 2.153 3.394 . 0 0 "[ . 1 . 2]" 1
710 1 77 ALA MB 1 78 ILE H 3.500 . 3.850 3.193 2.563 3.624 . 0 0 "[ . 1 . 2]" 1
711 1 61 GLN QB 1 77 ALA MB . . 5.020 2.859 1.756 3.818 0.044 3 0 "[ . 1 . 2]" 1
712 1 41 ALA MB 1 77 ALA MB 3.170 . 3.490 2.538 1.935 3.302 . 0 0 "[ . 1 . 2]" 1
713 1 77 ALA H 1 77 ALA MB 3.050 . 3.360 2.270 2.223 2.323 . 0 0 "[ . 1 . 2]" 1
714 1 61 GLN HA 1 77 ALA MB 5.770 . 6.350 4.627 3.928 5.370 . 0 0 "[ . 1 . 2]" 1
715 1 63 PHE HA 1 77 ALA MB 5.980 . 6.580 3.998 3.313 4.747 . 0 0 "[ . 1 . 2]" 1
716 1 65 ILE HA 1 71 VAL QG 4.180 . 4.600 2.606 2.194 2.973 . 0 0 "[ . 1 . 2]" 1
717 1 70 PRO HA 1 71 VAL QG 4.160 . 4.580 3.692 3.557 3.804 . 0 0 "[ . 1 . 2]" 1
718 1 76 GLU H 1 77 ALA MB 4.350 . 4.790 4.012 3.675 4.206 . 0 0 "[ . 1 . 2]" 1
719 1 33 ILE MG 1 34 VAL MG1 4.630 . 5.090 4.778 4.607 4.978 . 0 0 "[ . 1 . 2]" 1
720 1 34 VAL MG1 1 35 SER H 4.170 . 4.590 3.583 3.466 3.725 . 0 0 "[ . 1 . 2]" 1
721 1 37 THR MG 1 38 VAL MG2 3.370 . 3.710 2.845 2.408 3.348 . 0 0 "[ . 1 . 2]" 1
722 1 37 THR H 1 37 THR MG 3.470 . 3.820 2.112 1.959 2.390 . 0 0 "[ . 1 . 2]" 1
723 1 35 SER HB3 1 37 THR MG 3.130 . 3.440 2.369 2.153 2.585 . 0 0 "[ . 1 . 2]" 1
724 1 53 ALA HA 1 62 VAL QG 4.300 . 4.730 4.155 3.834 4.701 . 0 0 "[ . 1 . 2]" 1
725 1 34 VAL HA 1 34 VAL MG2 3.040 . 3.340 2.412 2.389 2.442 . 0 0 "[ . 1 . 2]" 1
726 1 34 VAL MG2 1 35 SER H 4.210 . 4.630 3.844 3.730 3.904 . 0 0 "[ . 1 . 2]" 1
727 1 35 SER H 1 37 THR MG 4.620 . 5.080 4.233 4.047 4.397 . 0 0 "[ . 1 . 2]" 1
728 1 34 VAL H 1 34 VAL MG2 3.030 . 3.330 2.022 1.965 2.069 . 0 0 "[ . 1 . 2]" 1
729 1 33 ILE HB 1 34 VAL MG2 4.140 . 4.550 3.213 3.100 3.327 . 0 0 "[ . 1 . 2]" 1
730 1 62 VAL QG 1 78 ILE MG 4.680 . 5.150 3.433 3.139 3.863 . 0 0 "[ . 1 . 2]" 1
731 1 62 VAL QG 1 80 THR MG . . 3.170 2.087 1.918 2.584 . 0 0 "[ . 1 . 2]" 1
732 1 62 VAL QG 1 63 PHE QD 4.840 . 5.320 4.336 4.131 4.574 . 0 0 "[ . 1 . 2]" 1
733 1 31 LYS H 1 34 VAL MG2 4.900 . 5.390 4.561 4.353 4.798 . 0 0 "[ . 1 . 2]" 1
734 1 32 ALA MB 1 37 THR MG 4.100 . 4.510 2.110 1.873 2.702 . 0 0 "[ . 1 . 2]" 1
735 1 53 ALA MB 1 62 VAL QG 3.050 . 3.360 2.252 2.019 2.689 . 0 0 "[ . 1 . 2]" 1
736 1 71 VAL QG 1 76 GLU HB2 4.130 . 4.540 2.992 2.419 4.002 . 0 0 "[ . 1 . 2]" 1
737 1 14 THR H 1 14 THR MG 3.880 . 4.270 2.247 1.993 2.738 . 0 0 "[ . 1 . 2]" 1
738 1 79 ALA HA 1 80 THR MG 4.120 . 4.530 3.775 3.664 3.872 . 0 0 "[ . 1 . 2]" 1
739 1 60 LYS HA 1 80 THR MG 4.020 . 4.420 3.377 2.583 4.000 . 0 0 "[ . 1 . 2]" 1
740 1 80 THR H 1 80 THR MG 3.410 . 3.750 2.141 1.984 2.279 . 0 0 "[ . 1 . 2]" 1
741 1 33 ILE HA 1 38 VAL MG1 4.480 . 4.930 4.190 3.943 4.424 . 0 0 "[ . 1 . 2]" 1
742 1 38 VAL MG1 1 78 ILE HA 4.820 . 5.300 4.088 3.572 4.678 . 0 0 "[ . 1 . 2]" 1
743 1 38 VAL MG1 1 46 GLN HB2 4.170 . 4.590 2.929 2.366 3.412 . 0 0 "[ . 1 . 2]" 1
744 1 61 GLN H 1 80 THR MG 4.670 . 5.140 3.812 3.388 4.280 . 0 0 "[ . 1 . 2]" 1
745 1 38 VAL MG1 1 39 GLN HA 4.840 . 5.320 3.822 3.420 4.065 . 0 0 "[ . 1 . 2]" 1
746 1 61 GLN QB 1 80 THR MG . . 5.670 4.631 4.290 4.970 . 0 0 "[ . 1 . 2]" 1
747 1 61 GLN HG3 1 80 THR MG 6.500 . 7.150 5.327 4.515 6.392 . 0 0 "[ . 1 . 2]" 1
748 1 62 VAL HB 1 80 THR MG 4.190 . 4.610 4.015 3.622 4.626 0.016 18 0 "[ . 1 . 2]" 1
749 1 38 VAL MG1 1 45 ILE HA 5.080 . 5.590 4.480 4.141 4.894 . 0 0 "[ . 1 . 2]" 1
750 1 38 VAL MG1 1 46 GLN HA 5.510 . 6.060 4.663 4.406 5.044 . 0 0 "[ . 1 . 2]" 1
751 1 79 ALA MB 1 80 THR MG 5.500 . 6.050 4.624 4.408 4.718 . 0 0 "[ . 1 . 2]" 1
752 1 38 VAL MG1 1 46 GLN HB3 4.170 . 4.590 2.374 2.132 3.969 . 0 0 "[ . 1 . 2]" 1
753 1 80 THR MG 1 83 ILE HG13 4.090 . 4.500 3.841 3.006 4.501 0.001 13 0 "[ . 1 . 2]" 1
754 1 21 LEU HA 1 53 ALA MB 5.150 . 5.670 4.918 4.446 5.275 . 0 0 "[ . 1 . 2]" 1
755 1 53 ALA MB 1 54 LEU HG 4.540 . 4.990 4.543 4.271 4.974 . 0 0 "[ . 1 . 2]" 1
756 1 21 LEU HG 1 53 ALA MB 4.070 . 4.480 3.943 3.635 4.247 . 0 0 "[ . 1 . 2]" 1
757 1 50 LEU HB2 1 53 ALA MB 4.660 . 5.130 3.702 2.986 4.567 . 0 0 "[ . 1 . 2]" 1
758 1 53 ALA MB 1 65 ILE HG13 4.910 . 5.400 4.079 3.734 4.746 . 0 0 "[ . 1 . 2]" 1
759 1 26 LEU MD1 1 53 ALA MB 2.980 . 3.280 2.401 1.936 2.958 . 0 0 "[ . 1 . 2]" 1
760 1 50 LEU MD1 1 53 ALA MB 3.320 . 3.650 2.202 1.792 2.947 0.008 7 0 "[ . 1 . 2]" 1
761 1 21 LEU H 1 53 ALA MB 4.400 . 4.840 4.000 3.660 4.273 . 0 0 "[ . 1 . 2]" 1
762 1 55 ILE HA 1 62 VAL QG 3.850 . 4.230 2.822 2.514 3.324 . 0 0 "[ . 1 . 2]" 1
763 1 70 PRO HG2 1 72 LEU MD2 4.490 . 4.940 4.503 3.599 4.987 0.047 15 0 "[ . 1 . 2]" 1
764 1 9 LEU HA 1 9 LEU MD2 3.600 . 3.960 3.147 2.603 3.958 . 0 0 "[ . 1 . 2]" 1
765 1 63 PHE HB3 1 72 LEU MD2 4.360 . 4.800 3.497 2.592 4.710 . 0 0 "[ . 1 . 2]" 1
766 1 18 LEU QD 1 72 LEU MD2 3.200 . 3.520 2.056 1.797 2.431 0.003 2 0 "[ . 1 . 2]" 1
767 1 70 PRO HB2 1 72 LEU MD2 3.610 . 3.970 2.962 2.383 3.412 . 0 0 "[ . 1 . 2]" 1
768 1 63 PHE HB2 1 72 LEU MD2 4.360 . 4.800 3.619 2.821 4.545 . 0 0 "[ . 1 . 2]" 1
769 1 18 LEU HG 1 72 LEU MD2 4.460 . 4.910 3.616 1.805 4.627 . 0 0 "[ . 1 . 2]" 1
770 1 71 VAL H 1 72 LEU MD2 4.890 . 5.380 4.458 4.074 4.708 . 0 0 "[ . 1 . 2]" 1
771 1 72 LEU H 1 72 LEU MD2 4.110 . 4.520 3.338 3.167 3.594 . 0 0 "[ . 1 . 2]" 1
772 1 63 PHE QE 1 72 LEU MD2 5.690 . 6.260 4.321 3.762 5.039 . 0 0 "[ . 1 . 2]" 1
773 1 72 LEU HA 1 72 LEU MD2 3.290 . 3.620 2.073 2.020 2.118 . 0 0 "[ . 1 . 2]" 1
774 1 54 LEU MD1 1 72 LEU MD2 3.190 . 3.510 2.115 1.949 2.504 . 0 0 "[ . 1 . 2]" 1
775 1 73 LEU HB3 1 73 LEU MD2 3.350 . 3.690 2.418 2.383 2.460 . 0 0 "[ . 1 . 2]" 1
776 1 29 LEU HA 1 38 VAL MG2 5.230 . 5.750 3.646 3.197 4.403 . 0 0 "[ . 1 . 2]" 1
777 1 35 SER HB3 1 38 VAL MG2 5.850 . 6.430 4.593 4.052 4.959 . 0 0 "[ . 1 . 2]" 1
778 1 32 ALA MB 1 38 VAL MG2 2.780 . 3.060 2.058 1.923 2.196 . 0 0 "[ . 1 . 2]" 1
779 1 73 LEU MD2 1 74 PRO HD2 4.280 . 4.710 2.884 2.630 3.367 . 0 0 "[ . 1 . 2]" 1
780 1 21 LEU H 1 54 LEU MD2 3.920 . 4.310 3.499 2.953 4.021 . 0 0 "[ . 1 . 2]" 1
781 1 5 LEU HA 1 5 LEU MD2 3.050 . 3.360 2.775 2.396 3.052 . 0 0 "[ . 1 . 2]" 1
782 1 50 LEU H 1 50 LEU MD2 4.280 . 4.710 3.685 3.410 4.186 . 0 0 "[ . 1 . 2]" 1
783 1 50 LEU HB3 1 50 LEU MD2 3.230 . 3.550 2.260 2.215 2.305 . 0 0 "[ . 1 . 2]" 1
784 1 20 LEU HA 1 54 LEU MD2 3.560 . 3.920 2.375 1.923 3.005 . 0 0 "[ . 1 . 2]" 1
785 1 50 LEU MD2 1 64 ARG HG2 3.900 . 4.290 3.616 2.210 4.127 . 0 0 "[ . 1 . 2]" 1
786 1 50 LEU MD2 1 64 ARG HG3 3.900 . 4.290 2.432 1.915 4.309 0.019 3 0 "[ . 1 . 2]" 1
787 1 20 LEU HA 1 20 LEU MD2 2.950 . 3.250 1.942 1.917 1.987 . 0 0 "[ . 1 . 2]" 1
788 1 50 LEU MD2 1 64 ARG HA 3.940 . 4.330 2.766 2.081 3.477 . 0 0 "[ . 1 . 2]" 1
789 1 54 LEU H 1 54 LEU MD2 4.210 . 4.630 3.803 3.636 3.995 . 0 0 "[ . 1 . 2]" 1
790 1 54 LEU HA 1 54 LEU MD2 3.440 . 3.780 2.086 2.001 2.235 . 0 0 "[ . 1 . 2]" 1
791 1 54 LEU MD2 1 55 ILE H 4.120 . 4.530 3.554 3.165 3.681 . 0 0 "[ . 1 . 2]" 1
792 1 29 LEU HA 1 29 LEU MD1 3.280 . 3.610 1.994 1.942 2.044 . 0 0 "[ . 1 . 2]" 1
793 1 20 LEU MD2 1 54 LEU HA 4.410 . 4.850 3.410 3.058 4.121 . 0 0 "[ . 1 . 2]" 1
794 1 20 LEU MD2 1 21 LEU H 3.960 . 4.360 2.719 2.275 3.019 . 0 0 "[ . 1 . 2]" 1
795 1 26 LEU HA 1 26 LEU MD1 3.690 . 4.060 2.106 2.072 2.157 . 0 0 "[ . 1 . 2]" 1
796 1 26 LEU MD1 1 30 ASN H 4.330 . 4.760 4.063 3.706 4.379 . 0 0 "[ . 1 . 2]" 1
797 1 21 LEU HG 1 26 LEU MD1 3.610 . 3.970 3.459 2.998 3.882 . 0 0 "[ . 1 . 2]" 1
798 1 26 LEU H 1 26 LEU MD1 4.620 . 5.080 4.058 4.008 4.118 . 0 0 "[ . 1 . 2]" 1
799 1 26 LEU MD1 1 30 ASN HD21 4.100 . 4.510 3.175 2.772 3.999 . 0 0 "[ . 1 . 2]" 1
800 1 21 LEU MD1 1 55 ILE MD 3.160 . 3.480 2.396 2.050 3.016 . 0 0 "[ . 1 . 2]" 1
801 1 21 LEU H 1 21 LEU MD1 4.460 . 4.910 4.155 4.096 4.221 . 0 0 "[ . 1 . 2]" 1
802 1 21 LEU MD1 1 26 LEU H 4.160 . 4.580 3.621 3.096 3.929 . 0 0 "[ . 1 . 2]" 1
803 1 21 LEU MD1 1 25 GLY HA3 4.380 . 4.820 2.682 1.818 3.413 . 0 0 "[ . 1 . 2]" 1
804 1 21 LEU HA 1 21 LEU MD1 3.410 . 3.750 2.105 2.058 2.170 . 0 0 "[ . 1 . 2]" 1
805 1 21 LEU MD1 1 55 ILE HB 3.710 . 4.080 1.902 1.780 2.177 0.020 2 0 "[ . 1 . 2]" 1
806 1 20 LEU MD1 1 21 LEU MD1 4.800 . 5.280 4.775 4.677 4.867 . 0 0 "[ . 1 . 2]" 1
807 1 20 LEU MD1 1 21 LEU H 4.350 . 4.790 2.164 1.796 2.653 0.004 4 0 "[ . 1 . 2]" 1
808 1 20 LEU H 1 20 LEU MD1 4.390 . 4.830 4.305 4.253 4.340 . 0 0 "[ . 1 . 2]" 1
809 1 20 LEU MD1 1 54 LEU HA 4.780 . 5.260 4.350 3.670 4.974 . 0 0 "[ . 1 . 2]" 1
810 1 18 LEU QD 1 56 THR HA 3.390 . 3.730 2.404 1.815 3.209 . 0 0 "[ . 1 . 2]" 1
811 1 20 LEU HA 1 20 LEU MD1 3.570 . 3.930 2.797 2.572 3.106 . 0 0 "[ . 1 . 2]" 1
812 1 56 THR MG 1 59 ARG HA 4.490 . 4.940 4.837 4.389 5.100 0.160 12 0 "[ . 1 . 2]" 1
813 1 18 LEU QD 1 72 LEU HA 5.200 . 5.680 3.929 2.558 4.772 . 0 0 "[ . 1 . 2]" 1
814 1 18 LEU QD 1 63 PHE QE 4.090 . 4.500 2.547 1.942 3.151 . 0 0 "[ . 1 . 2]" 1
815 1 20 LEU MD1 1 21 LEU HG 4.460 . 4.910 4.665 4.469 4.873 . 0 0 "[ . 1 . 2]" 1
816 1 18 LEU QD 1 56 THR MG 3.300 . 3.630 2.238 1.906 2.937 . 0 0 "[ . 1 . 2]" 1
817 1 18 LEU QD 1 57 ARG H 4.750 . 5.220 3.919 3.045 4.945 . 0 0 "[ . 1 . 2]" 1
818 1 73 LEU HB2 1 73 LEU MD1 3.210 . 3.530 2.363 2.341 2.399 . 0 0 "[ . 1 . 2]" 1
819 1 18 LEU QD 1 55 ILE HA 4.960 . 5.460 4.014 3.357 4.542 . 0 0 "[ . 1 . 2]" 1
820 1 18 LEU HA 1 18 LEU QD 3.390 . 3.730 1.991 1.913 2.066 . 0 0 "[ . 1 . 2]" 1
821 1 56 THR MG 1 60 LYS H 4.420 . 4.860 3.783 3.219 4.223 . 0 0 "[ . 1 . 2]" 1
822 1 56 THR MG 1 61 GLN QB 3.550 . 3.900 2.081 1.773 3.305 0.027 12 0 "[ . 1 . 2]" 1
823 1 55 ILE HA 1 56 THR MG 4.650 . 5.120 3.845 3.617 4.011 . 0 0 "[ . 1 . 2]" 1
824 1 6 LEU H 1 6 LEU MD1 4.200 . 4.620 3.786 3.460 4.441 . 0 0 "[ . 1 . 2]" 1
825 1 18 LEU HA 1 56 THR MG 4.660 . 5.130 3.985 3.582 4.503 . 0 0 "[ . 1 . 2]" 1
826 1 56 THR MG 1 61 GLN HA 4.990 . 5.490 4.143 3.935 4.867 . 0 0 "[ . 1 . 2]" 1
827 1 73 LEU H 1 73 LEU MD1 4.030 . 4.430 3.754 3.598 4.147 . 0 0 "[ . 1 . 2]" 1
828 1 26 LEU MD2 1 53 ALA H 4.190 . 4.610 3.889 3.035 4.628 0.018 5 0 "[ . 1 . 2]" 1
829 1 73 LEU HA 1 73 LEU MD1 4.300 . 4.730 3.861 3.833 3.883 . 0 0 "[ . 1 . 2]" 1
830 1 26 LEU MD2 1 30 ASN HD21 4.420 . 4.860 4.127 3.795 4.878 0.018 9 0 "[ . 1 . 2]" 1
831 1 26 LEU MD2 1 51 HIS HA 3.710 . 4.080 3.032 2.201 3.763 . 0 0 "[ . 1 . 2]" 1
832 1 26 LEU MD2 1 52 GLU HA 3.970 . 4.370 3.006 2.102 4.026 . 0 0 "[ . 1 . 2]" 1
833 1 31 LYS H 1 31 LYS HG3 4.170 . 4.590 2.581 2.173 4.116 . 0 0 "[ . 1 . 2]" 1
834 1 72 LEU HB2 1 72 LEU MD1 3.380 . 3.720 2.368 2.340 2.424 . 0 0 "[ . 1 . 2]" 1
835 1 8 LEU H 1 8 LEU MD1 4.170 . 4.590 3.521 1.875 4.245 . 0 0 "[ . 1 . 2]" 1
836 1 26 LEU H 1 26 LEU MD2 4.300 . 4.730 4.243 4.213 4.269 . 0 0 "[ . 1 . 2]" 1
837 1 18 LEU QD 1 72 LEU MD1 3.560 . 3.920 3.252 2.412 3.856 . 0 0 "[ . 1 . 2]" 1
838 1 72 LEU HA 1 72 LEU MD1 4.240 . 4.660 3.876 3.825 3.908 . 0 0 "[ . 1 . 2]" 1
839 1 72 LEU H 1 72 LEU MD1 4.220 . 4.640 3.780 3.637 4.030 . 0 0 "[ . 1 . 2]" 1
840 1 70 PRO HB2 1 72 LEU MD1 3.740 . 4.110 3.781 3.442 4.151 0.041 11 0 "[ . 1 . 2]" 1
841 1 70 PRO HG2 1 72 LEU MD1 4.540 . 4.990 4.477 3.874 5.012 0.022 7 0 "[ . 1 . 2]" 1
842 1 9 LEU HB3 1 9 LEU MD1 3.460 . 3.810 2.516 2.367 3.179 . 0 0 "[ . 1 . 2]" 1
843 1 26 LEU MD2 1 30 ASN HD22 3.820 . 4.200 3.469 2.819 3.948 . 0 0 "[ . 1 . 2]" 1
844 1 58 ASP HB2 1 60 LYS HG2 6.280 . 6.910 3.762 1.792 5.671 0.008 12 0 "[ . 1 . 2]" 1
845 1 58 ASP HB2 1 60 LYS HG3 6.280 . 6.910 3.778 2.302 6.332 . 0 0 "[ . 1 . 2]" 1
846 1 21 LEU HG 1 26 LEU MD2 4.330 . 4.760 4.369 3.848 4.782 0.022 11 0 "[ . 1 . 2]" 1
847 1 23 SER HA 1 26 LEU MD2 3.520 . 3.870 2.957 2.610 3.363 . 0 0 "[ . 1 . 2]" 1
848 1 50 LEU MD1 1 53 ALA HA 4.780 . 5.260 4.140 3.568 5.089 . 0 0 "[ . 1 . 2]" 1
849 1 50 LEU MD1 1 64 ARG HA 4.550 . 5.010 4.377 3.639 5.015 0.005 19 0 "[ . 1 . 2]" 1
850 1 9 LEU HA 1 9 LEU MD1 4.480 . 4.930 3.753 2.342 4.145 . 0 0 "[ . 1 . 2]" 1
851 1 9 LEU HB2 1 9 LEU MD1 3.460 . 3.810 2.273 2.199 2.365 . 0 0 "[ . 1 . 2]" 1
852 1 9 LEU H 1 9 LEU HG 4.460 . 4.910 4.365 3.416 4.785 . 0 0 "[ . 1 . 2]" 1
853 1 57 ARG HA 1 57 ARG HG2 4.190 . 4.610 3.224 2.419 3.853 . 0 0 "[ . 1 . 2]" 1
854 1 8 LEU H 1 8 LEU HG 4.370 . 4.810 3.331 1.968 4.705 . 0 0 "[ . 1 . 2]" 1
855 1 26 LEU HG 1 30 ASN HD22 4.160 . 4.580 2.494 1.859 2.872 . 0 0 "[ . 1 . 2]" 1
856 1 69 ILE H 1 69 ILE HG13 4.160 . 4.580 3.929 3.581 4.117 . 0 0 "[ . 1 . 2]" 1
857 1 69 ILE HA 1 69 ILE HG12 3.750 . 4.130 3.133 3.064 3.261 . 0 0 "[ . 1 . 2]" 1
858 1 54 LEU MD1 1 65 ILE HG12 4.150 . 4.570 2.980 2.357 3.249 . 0 0 "[ . 1 . 2]" 1
859 1 54 LEU MD1 1 70 PRO HA 4.430 . 4.870 2.842 2.173 3.528 . 0 0 "[ . 1 . 2]" 1
860 1 54 LEU HA 1 54 LEU MD1 4.520 . 4.970 3.900 3.871 3.941 . 0 0 "[ . 1 . 2]" 1
861 1 54 LEU H 1 54 LEU MD1 4.320 . 4.750 3.889 3.792 4.074 . 0 0 "[ . 1 . 2]" 1
862 1 32 ALA MB 1 83 ILE HG12 4.470 . 4.920 4.544 4.170 4.868 . 0 0 "[ . 1 . 2]" 1
863 1 20 LEU HG 1 21 LEU H 5.360 . 5.900 4.637 4.451 4.855 . 0 0 "[ . 1 . 2]" 1
864 1 29 LEU HG 1 30 ASN H 5.880 . 6.470 4.913 4.827 5.039 . 0 0 "[ . 1 . 2]" 1
865 1 5 LEU HA 1 5 LEU HG 3.780 . 4.160 3.722 3.681 3.757 . 0 0 "[ . 1 . 2]" 1
866 1 21 LEU MD2 1 29 LEU H 5.250 . 5.780 4.143 3.792 4.446 . 0 0 "[ . 1 . 2]" 1
867 1 21 LEU MD2 1 53 ALA H 5.200 . 5.720 4.165 3.737 4.563 . 0 0 "[ . 1 . 2]" 1
868 1 20 LEU HA 1 20 LEU HG 3.740 . 4.110 3.721 3.704 3.739 . 0 0 "[ . 1 . 2]" 1
869 1 50 LEU HA 1 50 LEU HG 4.110 . 4.520 3.651 3.574 3.697 . 0 0 "[ . 1 . 2]" 1
870 1 18 LEU QD 1 54 LEU MD1 3.470 . 3.820 2.312 1.735 3.228 0.065 8 0 "[ . 1 . 2]" 1
871 1 17 PRO HA 1 18 LEU QD 5.790 . 6.370 4.617 4.033 5.178 . 0 0 "[ . 1 . 2]" 1
872 1 3 ARG H 1 3 ARG HG3 3.800 . 4.180 3.288 1.749 4.087 0.051 10 0 "[ . 1 . 2]" 1
873 1 18 LEU QD 1 72 LEU H 5.510 . 6.060 5.571 4.650 5.887 . 0 0 "[ . 1 . 2]" 1
874 1 3 ARG HG2 1 4 LYS H 5.280 . 5.810 3.490 2.157 5.388 . 0 0 "[ . 1 . 2]" 1
875 1 33 ILE MG 1 46 GLN HB2 4.830 . 5.310 4.966 3.382 5.330 0.020 16 0 "[ . 1 . 2]" 1
876 1 33 ILE MG 1 46 GLN HB3 4.830 . 5.310 3.852 3.114 4.344 . 0 0 "[ . 1 . 2]" 1
877 1 29 LEU MD2 1 30 ASN H 4.410 . 4.850 4.023 3.793 4.238 . 0 0 "[ . 1 . 2]" 1
878 1 29 LEU HA 1 29 LEU MD2 4.210 . 4.630 2.654 2.389 2.950 . 0 0 "[ . 1 . 2]" 1
879 1 28 ALA MB 1 29 LEU MD2 3.300 . 3.630 2.567 2.306 2.788 . 0 0 "[ . 1 . 2]" 1
880 1 45 ILE HA 1 45 ILE HG12 4.090 . 4.500 3.035 2.919 3.094 . 0 0 "[ . 1 . 2]" 1
881 1 45 ILE H 1 45 ILE HG13 3.880 . 4.270 3.728 3.584 3.922 . 0 0 "[ . 1 . 2]" 1
882 1 65 ILE HG12 1 70 PRO HA 4.420 . 4.860 1.965 1.754 2.355 0.046 4 0 "[ . 1 . 2]" 1
883 1 65 ILE HG12 1 65 ILE MG 3.500 . 3.850 2.437 2.401 2.499 . 0 0 "[ . 1 . 2]" 1
884 1 81 ILE HG12 1 81 ILE MG 3.340 . 3.670 2.343 2.322 2.402 . 0 0 "[ . 1 . 2]" 1
885 1 81 ILE H 1 81 ILE HG12 4.730 . 5.200 4.645 4.464 4.692 . 0 0 "[ . 1 . 2]" 1
886 1 81 ILE H 1 81 ILE HG13 4.730 . 5.200 4.505 4.412 4.535 . 0 0 "[ . 1 . 2]" 1
887 1 81 ILE HA 1 81 ILE HG13 3.820 . 4.200 2.950 2.422 3.072 . 0 0 "[ . 1 . 2]" 1
888 1 81 ILE HG13 1 82 GLN H 5.190 . 5.710 4.346 4.125 4.994 . 0 0 "[ . 1 . 2]" 1
889 1 81 ILE HG12 1 82 GLN H 5.190 . 5.710 5.071 4.019 5.365 . 0 0 "[ . 1 . 2]" 1
890 1 55 ILE HG13 1 62 VAL QG 4.960 . 5.460 4.215 4.118 4.369 . 0 0 "[ . 1 . 2]" 1
891 1 55 ILE HG12 1 62 VAL QG 4.960 . 5.460 4.084 3.593 4.352 . 0 0 "[ . 1 . 2]" 1
892 1 60 LYS HA 1 60 LYS HD2 5.330 . 5.860 4.335 2.096 5.564 . 0 0 "[ . 1 . 2]" 1
893 1 60 LYS HA 1 60 LYS HD3 5.330 . 5.860 4.156 2.002 4.912 . 0 0 "[ . 1 . 2]" 1
894 1 4 LYS H 1 4 LYS HD2 5.660 . 6.230 4.402 3.615 4.878 . 0 0 "[ . 1 . 2]" 1
895 1 4 LYS H 1 4 LYS HD3 5.660 . 6.230 4.374 3.583 5.138 . 0 0 "[ . 1 . 2]" 1
896 1 27 GLU HB2 1 28 ALA H 4.220 . 4.640 3.893 3.649 4.032 . 0 0 "[ . 1 . 2]" 1
897 1 27 GLU H 1 27 GLU HB3 3.650 . 4.020 2.550 2.420 2.638 . 0 0 "[ . 1 . 2]" 1
898 1 27 GLU HB3 1 28 ALA H 4.220 . 4.640 4.024 3.823 4.152 . 0 0 "[ . 1 . 2]" 1
899 1 71 VAL QG 1 76 GLU HB3 4.130 . 4.540 3.348 2.377 4.109 . 0 0 "[ . 1 . 2]" 1
900 1 3 ARG HB2 1 4 LYS H 4.630 . 5.090 3.507 2.254 4.150 . 0 0 "[ . 1 . 2]" 1
901 1 51 HIS HB2 1 52 GLU H 4.810 . 5.290 3.348 2.532 4.185 . 0 0 "[ . 1 . 2]" 1
902 1 51 HIS HB3 1 52 GLU H 4.810 . 5.290 3.898 3.033 4.406 . 0 0 "[ . 1 . 2]" 1
903 1 48 GLN H 1 48 GLN HB2 3.890 . 4.280 2.557 2.360 3.696 . 0 0 "[ . 1 . 2]" 1
904 1 40 ARG HB2 1 43 GLY H 5.330 . 5.860 4.043 2.563 5.335 . 0 0 "[ . 1 . 2]" 1
905 1 40 ARG HB3 1 43 GLY H 5.330 . 5.860 4.046 2.143 5.729 . 0 0 "[ . 1 . 2]" 1
906 1 31 LYS HA 1 34 VAL HB 3.970 . 4.370 3.005 2.506 3.342 . 0 0 "[ . 1 . 2]" 1
907 1 4 LYS H 1 4 LYS HB3 3.760 . 4.140 3.331 2.438 3.643 . 0 0 "[ . 1 . 2]" 1
908 1 74 PRO HB3 1 75 GLU H 4.520 . 4.970 4.192 3.847 4.475 . 0 0 "[ . 1 . 2]" 1
909 1 74 PRO HB2 1 75 GLU H 4.520 . 4.970 3.222 2.439 3.826 . 0 0 "[ . 1 . 2]" 1
910 1 54 LEU MD1 1 70 PRO HB2 3.650 . 4.020 2.555 2.047 3.101 . 0 0 "[ . 1 . 2]" 1
911 1 70 PRO HB2 1 72 LEU HG 4.190 . 4.610 3.243 2.853 3.761 . 0 0 "[ . 1 . 2]" 1
912 1 54 LEU MD1 1 70 PRO HB3 3.960 . 4.360 2.189 1.752 2.926 0.048 14 0 "[ . 1 . 2]" 1
913 1 54 LEU MD2 1 70 PRO HB3 4.320 . 4.750 2.990 2.220 3.906 . 0 0 "[ . 1 . 2]" 1
914 1 24 LYS HB2 1 25 GLY H 3.900 . 4.290 3.299 2.408 4.032 . 0 0 "[ . 1 . 2]" 1
915 1 28 ALA HA 1 31 LYS HB2 3.440 . 3.780 2.696 2.382 3.029 . 0 0 "[ . 1 . 2]" 1
916 1 39 GLN HB2 1 45 ILE MD 4.300 . 4.730 4.181 3.104 4.566 . 0 0 "[ . 1 . 2]" 1
917 1 38 VAL HB 1 39 GLN H 4.900 . 5.390 4.381 4.081 4.483 . 0 0 "[ . 1 . 2]" 1
918 1 39 GLN HB3 1 40 ARG H 4.600 . 5.060 3.436 2.856 4.140 . 0 0 "[ . 1 . 2]" 1
919 1 89 LYS HB3 1 90 LEU H 4.350 . 4.790 3.578 2.069 4.433 . 0 0 "[ . 1 . 2]" 1
920 1 47 ASN H 1 48 GLN HG3 5.330 . 5.860 4.170 3.138 5.612 . 0 0 "[ . 1 . 2]" 1
921 1 61 GLN HG2 1 80 THR MG 6.500 . 7.150 5.147 4.539 6.522 . 0 0 "[ . 1 . 2]" 1
922 1 16 GLN H 1 16 GLN HG2 4.610 . 5.070 3.523 2.238 4.452 . 0 0 "[ . 1 . 2]" 1
923 1 79 ALA MB 1 82 GLN HG2 5.370 . 5.910 3.443 2.219 5.231 . 0 0 "[ . 1 . 2]" 1
924 1 79 ALA MB 1 82 GLN HG3 5.370 . 5.910 3.864 2.115 5.372 . 0 0 "[ . 1 . 2]" 1
925 1 16 GLN H 1 16 GLN HG3 4.610 . 5.070 3.499 1.785 4.623 0.015 1 0 "[ . 1 . 2]" 1
926 1 61 GLN QB 1 63 PHE QD 4.630 . 5.090 4.045 3.446 4.489 . 0 0 "[ . 1 . 2]" 1
927 1 39 GLN HG2 1 45 ILE MD 4.100 . 4.510 2.377 1.796 3.690 0.004 18 0 "[ . 1 . 2]" 1
928 1 62 VAL HB 1 78 ILE MG 4.270 . 4.700 3.394 3.020 3.722 . 0 0 "[ . 1 . 2]" 1
929 1 61 GLN HA 1 62 VAL HB 4.780 . 5.260 4.603 4.474 4.687 . 0 0 "[ . 1 . 2]" 1
930 1 52 GLU HG2 1 65 ILE MD 4.480 . 4.930 2.826 1.785 4.435 0.015 4 0 "[ . 1 . 2]" 1
931 1 52 GLU HG3 1 65 ILE MD 4.480 . 4.930 3.520 1.803 4.912 . 0 0 "[ . 1 . 2]" 1
932 1 20 LEU MD2 1 52 GLU HG2 4.560 . 5.020 3.410 2.565 4.542 . 0 0 "[ . 1 . 2]" 1
933 1 20 LEU MD2 1 52 GLU HG3 4.560 . 5.020 3.534 1.914 5.060 0.040 18 0 "[ . 1 . 2]" 1
934 1 73 LEU HB2 1 76 GLU HG3 5.010 . 5.510 3.703 1.926 5.491 . 0 0 "[ . 1 . 2]" 1
935 1 66 GLU H 1 66 GLU HG2 5.200 . 5.720 3.051 2.090 5.033 . 0 0 "[ . 1 . 2]" 1
936 1 66 GLU H 1 66 GLU HG3 5.200 . 5.720 3.497 2.902 4.541 . 0 0 "[ . 1 . 2]" 1
937 1 71 VAL QG 1 76 GLU HG2 3.710 . 4.080 2.699 1.919 3.369 . 0 0 "[ . 1 . 2]" 1
938 1 73 LEU HB2 1 76 GLU HG2 5.010 . 5.510 3.259 1.796 4.484 0.004 6 0 "[ . 1 . 2]" 1
939 1 75 GLU HG3 1 76 GLU H 4.570 . 5.030 3.306 2.256 4.918 . 0 0 "[ . 1 . 2]" 1
940 1 71 VAL QG 1 76 GLU HG3 3.710 . 4.080 2.621 1.831 3.721 . 0 0 "[ . 1 . 2]" 1
941 1 66 GLU HG2 1 71 VAL QG 3.940 . 4.330 2.581 1.868 3.948 . 0 0 "[ . 1 . 2]" 1
942 1 66 GLU HG3 1 71 VAL QG 3.940 . 4.330 3.561 2.857 4.328 . 0 0 "[ . 1 . 2]" 1
943 1 27 GLU HG3 1 28 ALA MB 4.470 . 4.920 3.251 2.975 3.423 . 0 0 "[ . 1 . 2]" 1
944 1 27 GLU H 1 27 GLU HG2 3.970 . 4.370 2.260 2.054 2.570 . 0 0 "[ . 1 . 2]" 1
945 1 27 GLU HG3 1 28 ALA H 4.480 . 4.930 2.384 2.049 2.657 . 0 0 "[ . 1 . 2]" 1
946 1 27 GLU HG2 1 28 ALA H 4.480 . 4.930 2.794 2.445 3.150 . 0 0 "[ . 1 . 2]" 1
947 1 27 GLU HG2 1 28 ALA MB 4.470 . 4.920 4.016 3.610 4.295 . 0 0 "[ . 1 . 2]" 1
948 1 83 ILE HB 1 86 PHE HB2 4.920 . 5.410 2.273 1.788 3.476 0.012 15 0 "[ . 1 . 2]" 1
949 1 83 ILE HB 1 86 PHE HB3 4.920 . 5.410 3.787 2.955 4.909 . 0 0 "[ . 1 . 2]" 1
950 1 85 ASN HB2 1 86 PHE H 5.190 . 5.710 3.684 3.105 4.443 . 0 0 "[ . 1 . 2]" 1
951 1 85 ASN HB3 1 86 PHE H 5.190 . 5.710 4.318 3.896 4.612 . 0 0 "[ . 1 . 2]" 1
952 1 30 ASN HB2 1 31 LYS HA 5.450 . 6.000 4.578 4.442 4.730 . 0 0 "[ . 1 . 2]" 1
953 1 80 THR H 1 81 ILE HB 4.950 . 5.440 5.024 4.856 5.158 . 0 0 "[ . 1 . 2]" 1
954 1 83 ILE MG 1 86 PHE HB3 4.350 . 4.790 4.041 3.453 4.845 0.055 10 0 "[ . 1 . 2]" 1
955 1 67 ASP HB3 1 69 ILE MD 4.550 . 5.010 4.404 4.011 4.620 . 0 0 "[ . 1 . 2]" 1
956 1 67 ASP H 1 67 ASP HB3 4.180 . 4.600 3.642 3.502 3.763 . 0 0 "[ . 1 . 2]" 1
957 1 67 ASP HB2 1 68 SER H 4.500 . 4.950 4.208 3.380 4.604 . 0 0 "[ . 1 . 2]" 1
958 1 67 ASP HB3 1 68 SER H 4.260 . 4.690 3.405 1.789 4.264 0.011 2 0 "[ . 1 . 2]" 1
959 1 52 GLU HB2 1 65 ILE HB 4.420 . 4.860 3.369 1.896 4.664 . 0 0 "[ . 1 . 2]" 1
960 1 58 ASP HB3 1 60 LYS HG2 6.280 . 6.910 3.945 2.497 5.904 . 0 0 "[ . 1 . 2]" 1
961 1 58 ASP HB3 1 60 LYS HG3 6.280 . 6.910 3.924 1.952 5.830 . 0 0 "[ . 1 . 2]" 1
962 1 47 ASN HB3 1 48 GLN HG2 5.950 . 6.540 5.349 3.891 6.568 0.028 2 0 "[ . 1 . 2]" 1
963 1 47 ASN HB3 1 48 GLN HG3 5.950 . 6.540 5.353 4.428 6.525 . 0 0 "[ . 1 . 2]" 1
964 1 47 ASN H 1 47 ASN HB3 3.900 . 4.290 3.645 3.051 3.787 . 0 0 "[ . 1 . 2]" 1
965 1 47 ASN H 1 47 ASN HB2 3.900 . 4.290 2.570 2.404 3.674 . 0 0 "[ . 1 . 2]" 1
966 1 47 ASN HB2 1 48 GLN HG2 5.950 . 6.540 4.397 2.989 5.607 . 0 0 "[ . 1 . 2]" 1
967 1 47 ASN HB2 1 48 GLN HG3 5.950 . 6.540 4.241 3.220 5.661 . 0 0 "[ . 1 . 2]" 1
968 1 62 VAL QG 1 78 ILE HB 4.290 . 4.720 3.115 2.710 3.565 . 0 0 "[ . 1 . 2]" 1
969 1 2 ASP HB3 1 5 LEU HB3 4.750 . 5.220 4.319 3.311 5.272 0.052 4 0 "[ . 1 . 2]" 1
970 1 2 ASP HB2 1 5 LEU HB3 4.750 . 5.220 4.493 3.597 5.294 0.074 8 0 "[ . 1 . 2]" 1
971 1 2 ASP HB3 1 5 LEU HB2 4.350 . 4.790 2.740 1.791 3.614 0.009 17 0 "[ . 1 . 2]" 1
972 1 2 ASP HB2 1 5 LEU HB2 4.350 . 4.790 2.972 1.935 3.881 . 0 0 "[ . 1 . 2]" 1
973 1 2 ASP HB3 1 5 LEU H 5.070 . 5.580 3.200 2.571 4.561 . 0 0 "[ . 1 . 2]" 1
974 1 23 SER HA 1 26 LEU HB3 4.580 . 5.040 2.257 1.795 2.928 0.005 3 0 "[ . 1 . 2]" 1
975 1 23 SER HA 1 26 LEU HB2 4.580 . 5.040 2.852 2.388 3.456 . 0 0 "[ . 1 . 2]" 1
976 1 54 LEU MD1 1 63 PHE HB3 4.600 . 5.060 3.021 2.636 3.572 . 0 0 "[ . 1 . 2]" 1
977 1 24 LYS HA 1 24 LYS HE2 4.410 . 4.850 3.469 1.805 4.854 0.004 2 0 "[ . 1 . 2]" 1
978 1 24 LYS HA 1 24 LYS HE3 4.410 . 4.850 3.878 1.792 4.873 0.023 16 0 "[ . 1 . 2]" 1
979 1 21 LEU HG 1 26 LEU HB3 4.660 . 5.130 4.144 3.659 4.432 . 0 0 "[ . 1 . 2]" 1
980 1 28 ALA HA 1 31 LYS HE2 5.000 . 5.500 3.745 2.190 5.570 0.070 17 0 "[ . 1 . 2]" 1
981 1 28 ALA HA 1 31 LYS HE3 5.000 . 5.500 3.959 2.244 5.500 0.000 1 0 "[ . 1 . 2]" 1
982 1 54 LEU MD1 1 63 PHE HB2 4.600 . 5.060 2.581 1.977 3.236 . 0 0 "[ . 1 . 2]" 1
983 1 29 LEU H 1 29 LEU HB3 3.950 . 4.350 3.573 3.524 3.614 . 0 0 "[ . 1 . 2]" 1
984 1 27 GLU HG3 1 31 LYS HE2 5.620 . 6.180 3.522 2.182 5.154 . 0 0 "[ . 1 . 2]" 1
985 1 27 GLU HG3 1 31 LYS HE3 5.620 . 6.180 4.097 2.981 5.026 . 0 0 "[ . 1 . 2]" 1
986 1 60 LYS HB2 1 60 LYS HE2 4.970 . 5.470 3.894 2.091 4.898 . 0 0 "[ . 1 . 2]" 1
987 1 60 LYS HB2 1 60 LYS HE3 4.970 . 5.470 4.056 1.897 5.069 . 0 0 "[ . 1 . 2]" 1
988 1 60 LYS HB3 1 60 LYS HE2 4.970 . 5.470 3.494 1.864 4.704 . 0 0 "[ . 1 . 2]" 1
989 1 60 LYS HB3 1 60 LYS HE3 4.970 . 5.470 3.610 1.944 4.748 . 0 0 "[ . 1 . 2]" 1
990 1 27 GLU HG2 1 31 LYS HE2 5.620 . 6.180 5.014 3.918 6.059 . 0 0 "[ . 1 . 2]" 1
991 1 27 GLU HG2 1 31 LYS HE3 5.620 . 6.180 5.697 4.353 6.341 0.161 1 0 "[ . 1 . 2]" 1
992 1 21 LEU HB2 1 54 LEU H 6.180 . 6.800 4.094 3.496 4.757 . 0 0 "[ . 1 . 2]" 1
993 1 21 LEU HB3 1 54 LEU H 6.180 . 6.800 4.705 4.182 5.232 . 0 0 "[ . 1 . 2]" 1
994 1 50 LEU MD2 1 64 ARG HD2 5.360 . 5.900 3.030 2.306 4.229 . 0 0 "[ . 1 . 2]" 1
995 1 50 LEU MD2 1 64 ARG HD3 5.360 . 5.900 3.718 2.049 4.601 . 0 0 "[ . 1 . 2]" 1
996 1 39 GLN HB3 1 43 GLY HA3 4.750 . 5.220 4.828 3.600 5.282 0.062 2 0 "[ . 1 . 2]" 1
997 1 21 LEU MD2 1 25 GLY HA3 5.790 . 6.370 3.818 3.219 4.635 . 0 0 "[ . 1 . 2]" 1
998 1 25 GLY HA3 1 29 LEU MD2 5.980 . 6.580 3.734 3.144 4.376 . 0 0 "[ . 1 . 2]" 1
999 1 21 LEU MD1 1 25 GLY HA2 4.380 . 4.820 4.100 3.374 4.830 0.010 13 0 "[ . 1 . 2]" 1
1000 1 21 LEU MD2 1 25 GLY HA2 5.790 . 6.370 4.769 4.178 5.646 . 0 0 "[ . 1 . 2]" 1
1001 1 25 GLY HA2 1 29 LEU MD2 5.980 . 6.580 3.878 3.456 4.724 . 0 0 "[ . 1 . 2]" 1
1002 1 25 GLY HA3 1 28 ALA MB 4.530 . 4.980 4.036 3.740 4.443 . 0 0 "[ . 1 . 2]" 1
1003 1 11 SER HB2 1 12 PRO HD3 5.090 . 5.600 4.095 2.854 5.215 . 0 0 "[ . 1 . 2]" 1
1004 1 11 SER HB3 1 12 PRO HD3 5.090 . 5.600 4.037 2.995 5.058 . 0 0 "[ . 1 . 2]" 1
1005 1 73 LEU MD2 1 74 PRO HD3 4.280 . 4.710 3.618 3.033 3.997 . 0 0 "[ . 1 . 2]" 1
1006 1 73 LEU HA 1 74 PRO HD3 3.980 . 4.380 2.423 1.920 2.603 . 0 0 "[ . 1 . 2]" 1
1007 1 73 LEU HA 1 74 PRO HD2 3.980 . 4.380 2.158 1.912 2.707 . 0 0 "[ . 1 . 2]" 1
1008 1 16 GLN HA 1 17 PRO HD3 3.840 . 4.220 2.187 1.819 2.601 . 0 0 "[ . 1 . 2]" 1
1009 1 69 ILE MD 1 70 PRO HD3 4.300 . 4.730 3.660 3.202 4.160 . 0 0 "[ . 1 . 2]" 1
1010 1 69 ILE MD 1 70 PRO HD2 4.300 . 4.730 3.339 2.992 3.648 . 0 0 "[ . 1 . 2]" 1
1011 1 53 ALA HA 1 65 ILE HG13 4.200 . 4.620 2.443 2.079 3.262 . 0 0 "[ . 1 . 2]" 1
1012 1 53 ALA HA 1 65 ILE MD 4.100 . 4.510 3.337 2.791 4.042 . 0 0 "[ . 1 . 2]" 1
1013 1 53 ALA HA 1 64 ARG HA 4.250 . 4.680 2.824 1.901 3.447 . 0 0 "[ . 1 . 2]" 1
1014 1 41 ALA MB 1 77 ALA HA 5.470 . 6.020 4.687 4.132 5.559 . 0 0 "[ . 1 . 2]" 1
1015 1 61 GLN QB 1 77 ALA HA 5.840 . 6.420 4.248 3.258 5.235 . 0 0 "[ . 1 . 2]" 1
1016 1 63 PHE QE 1 77 ALA HA 4.980 . 5.480 4.220 3.561 4.743 . 0 0 "[ . 1 . 2]" 1
1017 1 63 PHE HA 1 77 ALA HA 4.640 . 5.100 2.772 2.248 3.270 . 0 0 "[ . 1 . 2]" 1
1018 1 77 ALA HA 1 78 ILE HB 4.810 . 5.290 4.628 4.536 4.773 . 0 0 "[ . 1 . 2]" 1
1019 1 77 ALA HA 1 78 ILE H 3.450 . 3.790 2.179 2.135 2.310 . 0 0 "[ . 1 . 2]" 1
1020 1 53 ALA MB 1 54 LEU HA 4.770 . 5.250 4.120 4.042 4.207 . 0 0 "[ . 1 . 2]" 1
1021 1 20 LEU HA 1 54 LEU HA 4.210 . 4.630 2.749 2.434 3.236 . 0 0 "[ . 1 . 2]" 1
1022 1 33 ILE MG 1 47 ASN HA 3.800 . 4.180 2.525 2.027 3.085 . 0 0 "[ . 1 . 2]" 1
1023 1 18 LEU HA 1 56 THR HA 4.030 . 4.430 2.837 2.244 3.399 . 0 0 "[ . 1 . 2]" 1
1024 1 16 GLN HA 1 17 PRO HG2 5.390 . 5.930 4.542 4.180 4.816 . 0 0 "[ . 1 . 2]" 1
1025 1 16 GLN HA 1 17 PRO HG3 5.390 . 5.930 4.330 3.936 4.679 . 0 0 "[ . 1 . 2]" 1
1026 1 84 ALA HA 1 85 ASN H 3.120 . 3.430 3.395 3.178 3.537 0.107 17 0 "[ . 1 . 2]" 1
1027 1 84 ALA HA 1 86 PHE H 4.180 . 4.600 3.813 3.559 4.027 . 0 0 "[ . 1 . 2]" 1
1028 1 46 GLN HA 1 47 ASN HA 4.530 . 4.980 4.443 4.403 4.466 . 0 0 "[ . 1 . 2]" 1
1029 1 41 ALA MB 1 42 ASP HA 4.410 . 4.850 3.970 3.862 4.081 . 0 0 "[ . 1 . 2]" 1
1030 1 16 GLN HA 1 17 PRO HD2 3.840 . 4.220 2.606 1.985 3.080 . 0 0 "[ . 1 . 2]" 1
1031 1 50 LEU HA 1 50 LEU MD2 4.220 . 4.640 4.082 4.048 4.100 . 0 0 "[ . 1 . 2]" 1
1032 1 50 LEU HA 1 50 LEU MD1 4.140 . 4.550 3.663 3.618 3.714 . 0 0 "[ . 1 . 2]" 1
1033 1 84 ALA HA 1 85 ASN HA 4.550 . 5.010 4.636 4.503 4.785 . 0 0 "[ . 1 . 2]" 1
1034 1 39 GLN HA 1 45 ILE HA 3.870 . 4.260 2.568 2.112 2.849 . 0 0 "[ . 1 . 2]" 1
1035 1 26 LEU MD1 1 52 GLU HA 3.940 . 4.330 3.300 2.195 4.361 0.031 13 0 "[ . 1 . 2]" 1
1036 1 52 GLU HA 1 53 ALA MB 4.610 . 5.070 3.879 3.764 4.018 . 0 0 "[ . 1 . 2]" 1
1037 1 52 GLU HA 1 65 ILE MD 5.250 . 5.780 4.145 3.567 4.638 . 0 0 "[ . 1 . 2]" 1
1038 1 48 GLN HA 1 48 GLN HG2 4.200 . 4.620 2.862 2.486 4.210 . 0 0 "[ . 1 . 2]" 1
1039 1 48 GLN HA 1 48 GLN HG3 4.200 . 4.620 3.280 2.566 3.792 . 0 0 "[ . 1 . 2]" 1
1040 1 9 LEU HA 1 9 LEU HG 4.200 . 4.620 2.780 2.459 3.758 . 0 0 "[ . 1 . 2]" 1
1041 1 61 GLN HA 1 80 THR MG 4.070 . 4.480 3.047 2.524 3.538 . 0 0 "[ . 1 . 2]" 1
1042 1 64 ARG HA 1 65 ILE HG13 4.000 . 4.400 3.791 3.442 4.042 . 0 0 "[ . 1 . 2]" 1
1043 1 5 LEU HA 1 5 LEU MD1 3.050 . 3.360 1.959 1.914 1.995 . 0 0 "[ . 1 . 2]" 1
1044 1 41 ALA HA 1 77 ALA MB 4.860 . 5.350 4.569 3.596 5.202 . 0 0 "[ . 1 . 2]" 1
1045 1 9 LEU MD2 1 10 CYS HA 3.980 . 4.380 3.655 2.795 4.446 0.066 5 0 "[ . 1 . 2]" 1
1046 1 30 ASN HA 1 33 ILE MD 3.880 . 4.270 2.143 1.800 2.517 . 0 0 "[ . 1 . 2]" 1
1047 1 21 LEU HA 1 21 LEU MD2 4.120 . 4.530 3.879 3.855 3.902 . 0 0 "[ . 1 . 2]" 1
1048 1 66 GLU HA 1 67 ASP HA 4.570 . 5.030 4.420 4.355 4.502 . 0 0 "[ . 1 . 2]" 1
1049 1 67 ASP HA 1 68 SER HA 4.900 . 5.390 4.843 4.666 4.983 . 0 0 "[ . 1 . 2]" 1
1050 1 30 ASN HA 1 33 ILE HB 4.050 . 4.460 2.482 2.272 2.797 . 0 0 "[ . 1 . 2]" 1
1051 1 40 ARG HA 1 78 ILE HA 4.150 . 4.570 3.089 2.341 3.949 . 0 0 "[ . 1 . 2]" 1
1052 1 21 LEU HA 1 55 ILE HB 4.590 . 5.050 2.626 1.988 3.286 . 0 0 "[ . 1 . 2]" 1
1053 1 62 VAL QG 1 63 PHE HA 4.310 . 4.740 3.683 3.422 3.928 . 0 0 "[ . 1 . 2]" 1
1054 1 38 VAL MG1 1 40 ARG HA 4.560 . 5.020 4.046 3.630 4.535 . 0 0 "[ . 1 . 2]" 1
1055 1 86 PHE HA 1 87 PRO HD3 3.590 . 3.950 2.177 1.793 2.693 0.007 18 0 "[ . 1 . 2]" 1
1056 1 55 ILE HG13 1 59 ARG HA 4.720 . 5.190 2.722 2.182 3.280 . 0 0 "[ . 1 . 2]" 1
1057 1 55 ILE HG12 1 59 ARG HA 4.720 . 5.190 3.362 2.800 3.966 . 0 0 "[ . 1 . 2]" 1
1058 1 69 ILE HA 1 69 ILE MD 3.510 . 3.860 2.055 1.991 2.149 . 0 0 "[ . 1 . 2]" 1
1059 1 6 LEU HA 1 6 LEU HG 3.910 . 4.300 3.179 3.075 3.726 . 0 0 "[ . 1 . 2]" 1
1060 1 6 LEU HA 1 6 LEU MD2 4.010 . 4.410 2.137 1.974 4.102 . 0 0 "[ . 1 . 2]" 1
1061 1 6 LEU HA 1 6 LEU MD1 4.010 . 4.410 3.860 3.653 3.897 . 0 0 "[ . 1 . 2]" 1
1062 1 83 ILE MG 1 86 PHE HA 4.330 . 4.760 3.395 2.789 4.405 . 0 0 "[ . 1 . 2]" 1
1063 1 69 ILE HA 1 70 PRO HD2 3.560 . 3.920 2.276 1.938 2.662 . 0 0 "[ . 1 . 2]" 1
1064 1 69 ILE HA 1 70 PRO HD3 3.560 . 3.920 2.248 1.858 2.608 . 0 0 "[ . 1 . 2]" 1
1065 1 28 ALA MB 1 86 PHE HA 3.620 . 3.980 2.911 1.893 3.751 . 0 0 "[ . 1 . 2]" 1
1066 1 69 ILE HA 1 69 ILE HG13 4.170 . 4.590 3.754 3.733 3.799 . 0 0 "[ . 1 . 2]" 1
1067 1 86 PHE HA 1 87 PRO HD2 3.590 . 3.950 2.388 1.905 2.754 . 0 0 "[ . 1 . 2]" 1
1068 1 26 LEU HA 1 26 LEU HG 3.740 . 4.110 3.161 3.105 3.224 . 0 0 "[ . 1 . 2]" 1
1069 1 21 LEU MD2 1 26 LEU HA 3.420 . 3.760 2.134 1.997 2.463 . 0 0 "[ . 1 . 2]" 1
1070 1 26 LEU HA 1 29 LEU MD2 3.750 . 4.130 2.568 1.786 3.124 0.014 13 0 "[ . 1 . 2]" 1
1071 1 3 ARG HA 1 6 LEU H 4.420 . 4.860 3.530 2.698 4.387 . 0 0 "[ . 1 . 2]" 1
1072 1 2 ASP HA 1 3 ARG HA 4.560 . 5.020 4.548 4.356 4.862 . 0 0 "[ . 1 . 2]" 1
1073 1 3 ARG HA 1 5 LEU H 4.510 . 4.960 4.126 3.665 4.474 . 0 0 "[ . 1 . 2]" 1
1074 1 3 ARG HA 1 6 LEU HG 4.170 . 4.590 2.933 2.032 4.582 . 0 0 "[ . 1 . 2]" 1
1075 1 26 LEU HA 1 29 LEU H 4.680 . 5.150 3.481 3.234 3.588 . 0 0 "[ . 1 . 2]" 1
1076 1 26 LEU HA 1 29 LEU HB2 4.560 . 5.020 2.982 2.646 3.329 . 0 0 "[ . 1 . 2]" 1
1077 1 29 LEU HA 1 83 ILE MG 4.000 . 4.400 2.996 2.699 3.418 . 0 0 "[ . 1 . 2]" 1
1078 1 44 SER HA 1 45 ILE HG12 4.680 . 5.150 3.694 3.469 3.889 . 0 0 "[ . 1 . 2]" 1
1079 1 44 SER HA 1 45 ILE MD 4.520 . 4.970 4.350 4.106 4.756 . 0 0 "[ . 1 . 2]" 1
1080 1 44 SER HA 1 45 ILE HG13 6.500 . 7.150 5.412 5.212 5.555 . 0 0 "[ . 1 . 2]" 1
1081 1 44 SER HA 1 45 ILE HB 4.970 . 5.470 4.747 4.647 4.862 . 0 0 "[ . 1 . 2]" 1
1082 1 33 ILE MD 1 49 SER HA 3.720 . 4.090 2.016 1.775 2.466 0.025 15 0 "[ . 1 . 2]" 1
1083 1 27 GLU HA 1 30 ASN H 4.080 . 4.490 3.407 3.221 3.720 . 0 0 "[ . 1 . 2]" 1
1084 1 57 ARG HA 1 57 ARG HG3 4.190 . 4.610 3.144 2.469 4.241 . 0 0 "[ . 1 . 2]" 1
1085 1 48 GLN HA 1 49 SER HA 4.810 . 5.290 4.426 4.345 4.472 . 0 0 "[ . 1 . 2]" 1
1086 1 56 THR HA 1 57 ARG HA 5.130 . 5.640 4.311 4.235 4.378 . 0 0 "[ . 1 . 2]" 1
1087 1 33 ILE HB 1 49 SER HA 4.150 . 4.570 3.581 3.204 4.169 . 0 0 "[ . 1 . 2]" 1
1088 1 27 GLU HA 1 30 ASN HB2 4.000 . 4.400 2.617 2.213 3.154 . 0 0 "[ . 1 . 2]" 1
1089 1 27 GLU HA 1 30 ASN HD21 4.250 . 4.680 2.760 2.326 3.910 . 0 0 "[ . 1 . 2]" 1
1090 1 30 ASN HB3 1 31 LYS HA 4.600 . 5.060 4.361 4.204 4.523 . 0 0 "[ . 1 . 2]" 1
1091 1 55 ILE HA 1 62 VAL HA 4.040 . 4.440 2.657 2.356 2.949 . 0 0 "[ . 1 . 2]" 1
1092 1 32 ALA MB 1 83 ILE HA 4.090 . 4.500 2.964 2.258 3.606 . 0 0 "[ . 1 . 2]" 1
1093 1 31 LYS HA 1 34 VAL MG2 3.480 . 3.830 3.139 2.775 3.675 . 0 0 "[ . 1 . 2]" 1
1094 1 55 ILE MD 1 62 VAL HA 4.620 . 5.080 3.058 2.300 3.681 . 0 0 "[ . 1 . 2]" 1
1095 1 83 ILE HA 1 84 ALA MB 3.960 . 4.360 4.053 4.006 4.112 . 0 0 "[ . 1 . 2]" 1
1096 1 83 ILE HA 1 83 ILE HG12 4.180 . 4.600 3.152 2.916 3.228 . 0 0 "[ . 1 . 2]" 1
1097 1 31 LYS HA 1 31 LYS HG3 3.720 . 4.090 2.889 2.445 3.078 . 0 0 "[ . 1 . 2]" 1
1098 1 31 LYS HA 1 31 LYS HG2 3.720 . 4.090 2.721 2.360 3.662 . 0 0 "[ . 1 . 2]" 1
1099 1 78 ILE HA 1 78 ILE MD 3.830 . 4.210 2.682 1.970 3.877 . 0 0 "[ . 1 . 2]" 1
1100 1 78 ILE HA 1 78 ILE HG12 4.250 . 4.680 3.317 2.596 3.676 . 0 0 "[ . 1 . 2]" 1
1101 1 78 ILE HA 1 78 ILE HG13 4.250 . 4.680 3.088 2.400 3.825 . 0 0 "[ . 1 . 2]" 1
1102 1 41 ALA H 1 78 ILE HA 4.660 . 5.130 4.046 3.274 4.813 . 0 0 "[ . 1 . 2]" 1
1103 1 65 ILE HA 1 70 PRO HA 4.070 . 4.480 2.902 2.263 3.521 . 0 0 "[ . 1 . 2]" 1
1104 1 37 THR HA 1 37 THR MG 3.320 . 3.650 3.225 3.217 3.231 . 0 0 "[ . 1 . 2]" 1
1105 1 37 THR HA 1 45 ILE MD 3.720 . 4.090 3.311 2.780 3.877 . 0 0 "[ . 1 . 2]" 1
1106 1 14 THR HA 1 14 THR MG 3.200 . 3.520 2.670 2.302 3.226 . 0 0 "[ . 1 . 2]" 1
1107 1 71 VAL HA 1 72 LEU HG 4.250 . 4.680 4.039 3.590 4.296 . 0 0 "[ . 1 . 2]" 1
1108 1 81 ILE HA 1 81 ILE HG12 3.820 . 4.200 3.648 3.109 3.757 . 0 0 "[ . 1 . 2]" 1
1109 1 71 VAL HA 1 72 LEU HB2 5.030 . 5.530 4.699 4.596 4.763 . 0 0 "[ . 1 . 2]" 1
1110 1 14 THR HA 1 16 GLN H 5.300 . 5.830 4.746 3.547 5.908 0.078 5 0 "[ . 1 . 2]" 1
1111 1 65 ILE MG 1 70 PRO HA 3.990 . 4.390 2.758 2.454 3.087 . 0 0 "[ . 1 . 2]" 1
1112 1 23 SER HB2 1 26 LEU MD2 5.400 . 5.940 4.209 3.575 4.921 . 0 0 "[ . 1 . 2]" 1
1113 1 23 SER HB3 1 26 LEU MD2 5.400 . 5.940 4.356 3.449 5.322 . 0 0 "[ . 1 . 2]" 1
1114 1 22 GLU HA 1 23 SER HA 4.320 . 4.750 4.333 4.254 4.395 . 0 0 "[ . 1 . 2]" 1
1115 1 23 SER HA 1 26 LEU HG 4.940 . 5.430 4.504 4.038 5.162 . 0 0 "[ . 1 . 2]" 1
1116 1 68 SER H 1 68 SER HB3 4.090 . 4.500 3.729 2.843 4.131 . 0 0 "[ . 1 . 2]" 1
1117 1 32 ALA MB 1 38 VAL HA 4.320 . 4.750 3.992 3.536 4.615 . 0 0 "[ . 1 . 2]" 1
1118 1 65 ILE MG 1 68 SER HB2 4.980 . 5.480 4.958 4.497 5.440 . 0 0 "[ . 1 . 2]" 1
1119 1 11 SER HB3 1 12 PRO HD2 5.090 . 5.600 3.426 1.992 4.534 . 0 0 "[ . 1 . 2]" 1
1120 1 68 SER H 1 68 SER HB2 4.090 . 4.500 3.355 2.832 3.661 . 0 0 "[ . 1 . 2]" 1
1121 1 65 ILE MG 1 68 SER HB3 4.980 . 5.480 4.882 4.271 5.391 . 0 0 "[ . 1 . 2]" 1
1122 1 38 VAL HA 1 39 GLN HB2 5.380 . 5.920 4.773 4.541 5.854 . 0 0 "[ . 1 . 2]" 1
1123 1 38 VAL HA 1 38 VAL MG2 3.430 . 3.770 2.392 2.352 2.446 . 0 0 "[ . 1 . 2]" 1
1124 1 38 VAL HA 1 38 VAL MG1 3.560 . 3.920 2.416 2.365 2.472 . 0 0 "[ . 1 . 2]" 1
1125 1 79 ALA MB 1 80 THR HA 4.870 . 5.360 4.582 4.517 4.628 . 0 0 "[ . 1 . 2]" 1
1126 1 80 THR HA 1 83 ILE HB 4.870 . 5.360 3.311 2.731 3.891 . 0 0 "[ . 1 . 2]" 1
1127 1 80 THR HA 1 83 ILE HG13 4.260 . 4.690 2.835 2.404 3.268 . 0 0 "[ . 1 . 2]" 1
1128 1 80 THR HA 1 83 ILE HG12 4.150 . 4.570 2.349 1.898 2.676 . 0 0 "[ . 1 . 2]" 1
1129 1 80 THR HA 1 81 ILE HA 4.960 . 5.460 4.848 4.818 4.865 . 0 0 "[ . 1 . 2]" 1
1130 1 80 THR HA 1 83 ILE MD 3.680 . 4.050 3.821 3.399 4.087 0.037 13 0 "[ . 1 . 2]" 1
1131 1 80 THR HA 1 80 THR MG 3.340 . 3.670 2.364 2.321 2.424 . 0 0 "[ . 1 . 2]" 1
1132 1 80 THR HA 1 83 ILE MG 4.580 . 5.040 4.339 3.978 4.789 . 0 0 "[ . 1 . 2]" 1
1133 1 62 VAL QG 1 80 THR HA 4.570 . 5.030 3.778 3.308 4.274 . 0 0 "[ . 1 . 2]" 1
1134 1 33 ILE MG 1 49 SER HB2 4.900 . 5.390 4.044 3.602 4.528 . 0 0 "[ . 1 . 2]" 1
1135 1 33 ILE MG 1 49 SER HB3 4.900 . 5.390 3.187 2.509 4.292 . 0 0 "[ . 1 . 2]" 1
1136 1 33 ILE HB 1 49 SER HB2 5.420 . 5.960 4.724 3.987 5.667 . 0 0 "[ . 1 . 2]" 1
1137 1 33 ILE HB 1 49 SER HB3 5.420 . 5.960 3.961 3.125 4.882 . 0 0 "[ . 1 . 2]" 1
1138 1 79 ALA HA 1 80 THR HA 4.990 . 5.490 4.415 4.349 4.478 . 0 0 "[ . 1 . 2]" 1
1139 1 35 SER HB2 1 37 THR MG 4.310 . 4.740 3.819 3.638 4.072 . 0 0 "[ . 1 . 2]" 1
1140 1 35 SER HB3 1 37 THR H 5.070 . 5.580 3.216 2.804 3.744 . 0 0 "[ . 1 . 2]" 1
1141 1 35 SER HB2 1 36 GLY H 4.830 . 5.310 4.172 4.040 4.348 . 0 0 "[ . 1 . 2]" 1
1142 1 35 SER H 1 35 SER HB2 3.830 . 4.210 2.606 2.549 2.723 . 0 0 "[ . 1 . 2]" 1
1143 1 32 ALA H 1 35 SER HB2 5.700 . 6.270 5.332 5.147 5.502 . 0 0 "[ . 1 . 2]" 1
1144 1 35 SER HB2 1 37 THR H 6.000 . 6.600 4.905 4.477 5.397 . 0 0 "[ . 1 . 2]" 1
1145 1 33 ILE HB 1 34 VAL HA 4.940 . 5.430 4.450 4.375 4.497 . 0 0 "[ . 1 . 2]" 1
1146 1 33 ILE MG 1 34 VAL HA 3.870 . 4.260 3.301 3.197 3.474 . 0 0 "[ . 1 . 2]" 1
1147 1 34 VAL HA 1 34 VAL MG1 3.160 . 3.480 2.418 2.385 2.451 . 0 0 "[ . 1 . 2]" 1
1148 1 33 ILE HA 1 38 VAL MG2 3.990 . 4.390 2.458 2.171 2.687 . 0 0 "[ . 1 . 2]" 1
1149 1 33 ILE HA 1 33 ILE MD 4.130 . 4.540 3.823 3.800 3.843 . 0 0 "[ . 1 . 2]" 1
1150 1 33 ILE HA 1 38 VAL HB 4.380 . 4.820 3.082 2.707 3.531 . 0 0 "[ . 1 . 2]" 1
1151 1 32 ALA MB 1 33 ILE HA 4.670 . 5.140 3.967 3.913 4.034 . 0 0 "[ . 1 . 2]" 1
1152 1 74 PRO HA 1 77 ALA H 4.370 . 4.810 3.679 3.175 4.287 . 0 0 "[ . 1 . 2]" 1
1153 1 63 PHE QE 1 74 PRO HA 4.110 . 4.520 2.890 2.060 3.746 . 0 0 "[ . 1 . 2]" 1
1154 1 19 SER HB2 1 20 LEU H 3.700 . 4.070 3.499 2.198 3.876 . 0 0 "[ . 1 . 2]" 1
1155 1 19 SER HB3 1 55 ILE MG 4.110 . 4.520 3.388 2.214 4.427 . 0 0 "[ . 1 . 2]" 1
1156 1 80 THR HB 1 83 ILE HG12 4.810 . 5.290 4.446 3.926 4.807 . 0 0 "[ . 1 . 2]" 1
1157 1 62 VAL QG 1 80 THR HB 4.820 . 5.300 4.333 4.097 4.771 . 0 0 "[ . 1 . 2]" 1
1158 1 80 THR HB 1 83 ILE MD 5.420 . 5.960 5.589 5.093 5.978 0.018 13 0 "[ . 1 . 2]" 1
1159 1 80 THR HB 1 86 PHE QD 4.490 . 4.940 3.638 3.193 4.191 . 0 0 "[ . 1 . 2]" 1
1160 1 80 THR HB 1 83 ILE H 5.140 . 5.650 4.743 4.437 5.093 . 0 0 "[ . 1 . 2]" 1
1161 1 60 LYS HA 1 80 THR HB 5.530 . 6.080 4.768 4.113 5.789 . 0 0 "[ . 1 . 2]" 1
1162 1 80 THR HB 1 81 ILE HA 5.790 . 6.370 4.508 4.338 4.690 . 0 0 "[ . 1 . 2]" 1
1163 1 37 THR HB 1 38 VAL H 4.570 . 5.030 4.493 4.371 4.674 . 0 0 "[ . 1 . 2]" 1
1164 1 37 THR HB 1 38 VAL MG2 5.560 . 6.120 5.068 4.613 5.263 . 0 0 "[ . 1 . 2]" 1
1165 1 37 THR HB 1 45 ILE MD 6.080 . 6.690 5.391 4.864 5.948 . 0 0 "[ . 1 . 2]" 1
1166 1 26 LEU HA 1 29 LEU HB3 4.560 . 5.020 4.591 4.237 4.943 . 0 0 "[ . 1 . 2]" 1
1167 1 54 LEU MD2 1 65 ILE HG12 5.280 . 5.810 3.396 2.859 3.636 . 0 0 "[ . 1 . 2]" 1
1168 1 21 LEU MD1 1 29 LEU MD2 3.890 . 4.280 3.114 2.712 3.368 . 0 0 "[ . 1 . 2]" 1
1169 1 15 ARG HG2 1 16 GLN H 5.260 . 5.790 4.654 3.620 5.596 . 0 0 "[ . 1 . 2]" 1
1170 1 53 ALA MB 1 64 ARG HA 3.730 . 4.100 3.047 2.411 3.928 . 0 0 "[ . 1 . 2]" 1
1171 1 21 LEU MD2 1 53 ALA MB 2.930 . 3.220 2.022 1.796 2.249 0.004 8 0 "[ . 1 . 2]" 1
1172 1 49 SER HA 1 50 LEU MD1 4.860 . 5.350 4.299 3.757 4.709 . 0 0 "[ . 1 . 2]" 1
1173 1 55 ILE HB 1 56 THR H 4.900 . 5.390 4.163 4.062 4.229 . 0 0 "[ . 1 . 2]" 1
1174 1 61 GLN HA 1 80 THR H 3.960 . 4.360 3.047 2.561 3.461 . 0 0 "[ . 1 . 2]" 1
1175 1 52 GLU HB3 1 65 ILE HB 4.420 . 4.860 2.640 2.084 3.854 . 0 0 "[ . 1 . 2]" 1
1176 1 20 LEU HA 1 54 LEU MD1 5.260 . 5.790 5.133 4.636 5.761 . 0 0 "[ . 1 . 2]" 1
1177 1 53 ALA HA 1 54 LEU MD1 5.500 . 6.050 4.856 4.412 5.176 . 0 0 "[ . 1 . 2]" 1
1178 1 38 VAL MG1 1 78 ILE HG12 5.120 . 5.630 3.251 2.194 4.381 . 0 0 "[ . 1 . 2]" 1
1179 1 38 VAL MG1 1 78 ILE HG13 5.120 . 5.630 3.036 2.514 4.286 . 0 0 "[ . 1 . 2]" 1
1180 1 32 ALA HA 1 37 THR MG 3.770 . 4.150 2.606 2.210 3.180 . 0 0 "[ . 1 . 2]" 1
1181 1 29 LEU HG 1 62 VAL QG 3.520 . 3.870 2.447 1.954 2.782 . 0 0 "[ . 1 . 2]" 1
1182 1 41 ALA MB 1 75 GLU HA 3.030 . 3.330 2.487 1.767 3.456 0.126 7 0 "[ . 1 . 2]" 1
1183 1 25 GLY HA2 1 28 ALA MB 4.530 . 4.980 2.893 2.426 3.516 . 0 0 "[ . 1 . 2]" 1
1184 1 11 SER HB2 1 12 PRO HD2 5.090 . 5.600 3.432 1.921 5.073 . 0 0 "[ . 1 . 2]" 1
1185 1 18 LEU QD 1 63 PHE H 5.180 . 5.700 3.960 3.094 4.690 . 0 0 "[ . 1 . 2]" 1
1186 1 68 SER HA 1 69 ILE HB 5.690 . 6.260 5.670 5.525 5.915 . 0 0 "[ . 1 . 2]" 1
1187 1 68 SER HB2 1 69 ILE MD 4.810 . 5.290 4.365 3.064 5.318 0.028 17 0 "[ . 1 . 2]" 1
1188 1 66 GLU H 1 69 ILE HB 4.660 . 5.130 3.716 3.402 4.153 . 0 0 "[ . 1 . 2]" 1
1189 1 45 ILE HB 1 46 GLN H 4.740 . 5.210 4.144 3.879 4.365 . 0 0 "[ . 1 . 2]" 1
1190 1 66 GLU H 1 70 PRO HA 5.280 . 5.810 4.292 3.741 4.989 . 0 0 "[ . 1 . 2]" 1
1191 1 70 PRO HB3 1 72 LEU MD2 4.600 . 5.060 3.845 3.142 4.449 . 0 0 "[ . 1 . 2]" 1
1192 1 74 PRO HA 1 76 GLU H 4.790 . 5.270 4.059 3.797 4.543 . 0 0 "[ . 1 . 2]" 1
1193 1 41 ALA MB 1 74 PRO HA 4.950 . 5.440 4.197 2.985 4.979 . 0 0 "[ . 1 . 2]" 1
1194 1 77 ALA HA 1 78 ILE MD 4.840 . 5.320 3.833 2.564 5.290 . 0 0 "[ . 1 . 2]" 1
1195 1 32 ALA H 1 83 ILE MD 4.600 . 5.060 4.470 3.845 4.873 . 0 0 "[ . 1 . 2]" 1
1196 1 83 ILE HA 1 84 ALA HA 4.570 . 5.030 4.482 4.427 4.547 . 0 0 "[ . 1 . 2]" 1
1197 1 21 LEU MD1 1 80 THR MG 5.510 . 6.060 4.487 3.847 5.153 . 0 0 "[ . 1 . 2]" 1
1198 1 21 LEU MD1 1 22 GLU HB2 5.670 . 6.240 4.455 3.925 5.206 . 0 0 "[ . 1 . 2]" 1
1199 1 21 LEU MD1 1 22 GLU HB3 5.670 . 6.240 3.721 3.078 4.521 . 0 0 "[ . 1 . 2]" 1
1200 1 21 LEU HA 1 22 GLU HA 4.640 . 5.100 4.402 4.367 4.448 . 0 0 "[ . 1 . 2]" 1
1201 1 21 LEU HG 1 26 LEU HB2 4.660 . 5.130 2.635 2.106 2.994 . 0 0 "[ . 1 . 2]" 1
1202 1 25 GLY H 1 26 LEU HB3 5.290 . 5.820 4.717 4.642 4.816 . 0 0 "[ . 1 . 2]" 1
1203 1 25 GLY H 1 26 LEU HB2 5.290 . 5.820 4.768 4.688 4.915 . 0 0 "[ . 1 . 2]" 1
1204 1 34 VAL HA 1 35 SER HA 5.070 . 5.580 4.788 4.715 4.841 . 0 0 "[ . 1 . 2]" 1
1205 1 34 VAL MG1 1 35 SER HA 4.210 . 4.630 3.669 3.605 3.797 . 0 0 "[ . 1 . 2]" 1
1206 1 35 SER HA 1 37 THR MG 4.770 . 5.250 4.817 4.534 5.026 . 0 0 "[ . 1 . 2]" 1
1207 1 39 GLN HB3 1 43 GLY HA2 4.750 . 5.220 3.239 2.066 4.027 . 0 0 "[ . 1 . 2]" 1
1208 1 45 ILE HG13 1 46 GLN H 5.630 . 6.190 5.339 5.082 5.623 . 0 0 "[ . 1 . 2]" 1
1209 1 45 ILE HG12 1 46 GLN H 5.260 . 5.790 5.050 4.943 5.149 . 0 0 "[ . 1 . 2]" 1
1210 1 45 ILE HA 1 45 ILE HG13 3.830 . 4.210 3.740 3.720 3.765 . 0 0 "[ . 1 . 2]" 1
1211 1 34 VAL MG2 1 49 SER HB2 5.280 . 5.810 4.515 3.669 5.137 . 0 0 "[ . 1 . 2]" 1
1212 1 34 VAL MG2 1 49 SER HB3 5.280 . 5.810 3.760 2.665 4.438 . 0 0 "[ . 1 . 2]" 1
1213 1 50 LEU MD1 1 65 ILE H 5.130 . 5.640 4.655 3.982 5.487 . 0 0 "[ . 1 . 2]" 1
1214 1 30 ASN HD21 1 50 LEU MD1 4.780 . 5.260 3.594 2.649 4.513 . 0 0 "[ . 1 . 2]" 1
1215 1 61 GLN QB 1 62 VAL QG 4.890 . 5.380 4.217 4.100 4.361 . 0 0 "[ . 1 . 2]" 1
1216 1 61 GLN QB 1 78 ILE HB 5.590 . 6.150 5.536 5.075 5.889 . 0 0 "[ . 1 . 2]" 1
1217 1 64 ARG HA 1 65 ILE HB 4.990 . 5.490 4.678 4.556 4.798 . 0 0 "[ . 1 . 2]" 1
1218 1 52 GLU HA 1 65 ILE HB 5.400 . 5.940 4.536 4.120 5.361 . 0 0 "[ . 1 . 2]" 1
1219 1 66 GLU HA 1 67 ASP HB3 5.300 . 5.830 4.884 4.722 5.015 . 0 0 "[ . 1 . 2]" 1
1220 1 66 GLU HA 1 67 ASP HB2 4.660 . 5.130 4.736 4.371 4.999 . 0 0 "[ . 1 . 2]" 1
1221 1 67 ASP HB3 1 69 ILE H 4.740 . 5.210 3.233 2.750 3.658 . 0 0 "[ . 1 . 2]" 1
1222 1 67 ASP HB2 1 69 ILE H 4.850 . 5.330 4.644 4.436 4.892 . 0 0 "[ . 1 . 2]" 1
1223 1 63 PHE QD 1 64 ARG H 4.480 . 4.930 3.681 3.431 3.970 . 0 0 "[ . 1 . 2]" 1
1224 1 63 PHE QD 1 72 LEU HA 3.700 . 4.070 2.820 2.283 3.677 . 0 0 "[ . 1 . 2]" 1
1225 1 56 THR MG 1 63 PHE QD 3.780 . 4.160 3.337 2.922 3.889 . 0 0 "[ . 1 . 2]" 1
1226 1 63 PHE QD 1 71 VAL QG 4.380 . 4.820 4.148 3.586 4.559 . 0 0 "[ . 1 . 2]" 1
1227 1 63 PHE QD 1 77 ALA MB 4.790 . 5.270 3.361 2.694 3.991 . 0 0 "[ . 1 . 2]" 1
1228 1 18 LEU QD 1 63 PHE QD 3.510 . 3.860 2.412 1.947 2.934 . 0 0 "[ . 1 . 2]" 1
1229 1 63 PHE QD 1 72 LEU MD2 4.840 . 5.320 3.685 3.096 4.508 . 0 0 "[ . 1 . 2]" 1
1230 1 86 PHE HA 1 86 PHE QD 3.740 . 4.110 2.685 2.348 3.070 . 0 0 "[ . 1 . 2]" 1
1231 1 83 ILE HB 1 86 PHE QD 4.190 . 4.610 2.965 1.780 3.526 0.020 13 0 "[ . 1 . 2]" 1
1232 1 29 LEU MD2 1 86 PHE QD 4.440 . 4.880 3.263 2.288 4.540 . 0 0 "[ . 1 . 2]" 1
1233 1 80 THR MG 1 86 PHE QD 4.620 . 5.080 3.959 3.237 4.791 . 0 0 "[ . 1 . 2]" 1
1234 1 63 PHE QE 1 72 LEU HA 4.110 . 4.520 3.757 3.260 4.268 . 0 0 "[ . 1 . 2]" 1
1235 1 61 GLN QB 1 63 PHE QE 4.220 . 4.640 3.076 2.470 3.627 . 0 0 "[ . 1 . 2]" 1
1236 1 56 THR MG 1 63 PHE QE 3.650 . 4.020 2.535 2.099 3.051 . 0 0 "[ . 1 . 2]" 1
1237 1 1 MET QB 1 2 ASP H 4.230 . 4.650 3.338 1.874 4.056 . 0 0 "[ . 1 . 2]" 1
1238 1 2 ASP QB 1 3 ARG H 4.050 . 4.460 3.531 2.335 4.034 . 0 0 "[ . 1 . 2]" 1
1239 1 2 ASP QB 1 5 LEU H 4.320 . 4.750 2.922 2.286 3.518 . 0 0 "[ . 1 . 2]" 1
1240 1 2 ASP QB 1 5 LEU HB2 3.800 . 4.180 2.248 1.783 2.939 0.017 17 0 "[ . 1 . 2]" 1
1241 1 2 ASP QB 1 5 LEU HB3 4.170 . 4.590 3.726 3.241 4.358 . 0 0 "[ . 1 . 2]" 1
1242 1 2 ASP QB 1 5 LEU QD 4.310 . 4.740 2.017 1.763 2.774 0.037 10 0 "[ . 1 . 2]" 1
1243 1 3 ARG H 1 3 ARG QB 3.140 . 3.450 2.568 2.335 3.077 . 0 0 "[ . 1 . 2]" 1
1244 1 3 ARG H 1 3 ARG QG 3.300 . 3.630 2.351 1.740 3.282 0.060 10 0 "[ . 1 . 2]" 1
1245 1 3 ARG H 1 3 ARG QD 4.850 . 5.330 3.517 1.748 4.453 0.052 20 0 "[ . 1 . 2]" 1
1246 1 3 ARG H 1 6 LEU QD 4.710 . 5.180 4.316 3.653 5.191 0.011 19 0 "[ . 1 . 2]" 1
1247 1 3 ARG HA 1 3 ARG QG 3.670 . 4.040 3.092 2.319 3.517 . 0 0 "[ . 1 . 2]" 1
1248 1 3 ARG HA 1 6 LEU QB 4.160 . 4.580 3.221 1.784 4.662 0.082 3 0 "[ . 1 . 2]" 1
1249 1 3 ARG HA 1 6 LEU QD 3.600 . 3.960 2.458 1.845 3.911 . 0 0 "[ . 1 . 2]" 1
1250 1 3 ARG QB 1 4 LYS H 3.760 . 4.140 3.249 2.210 3.733 . 0 0 "[ . 1 . 2]" 1
1251 1 3 ARG QG 1 4 LYS H 4.410 . 4.850 3.045 2.146 4.641 . 0 0 "[ . 1 . 2]" 1
1252 1 4 LYS H 1 4 LYS QB 3.020 . 3.320 2.486 2.338 2.763 . 0 0 "[ . 1 . 2]" 1
1253 1 4 LYS H 1 4 LYS QG 3.230 . 3.550 2.218 1.845 2.916 . 0 0 "[ . 1 . 2]" 1
1254 1 4 LYS H 1 4 LYS QD 4.800 . 5.280 3.837 3.467 4.348 . 0 0 "[ . 1 . 2]" 1
1255 1 4 LYS H 1 4 LYS QE 5.600 . 6.160 4.373 3.326 5.608 . 0 0 "[ . 1 . 2]" 1
1256 1 4 LYS HA 1 4 LYS QG 3.260 . 3.590 2.837 2.275 3.355 . 0 0 "[ . 1 . 2]" 1
1257 1 4 LYS QB 1 5 LEU H 3.370 . 3.710 3.010 2.384 3.677 . 0 0 "[ . 1 . 2]" 1
1258 1 5 LEU H 1 5 LEU QD 3.610 . 3.970 2.127 1.805 2.424 . 0 0 "[ . 1 . 2]" 1
1259 1 5 LEU H 1 6 LEU QD 5.000 . 5.500 4.436 3.917 4.880 . 0 0 "[ . 1 . 2]" 1
1260 1 5 LEU HA 1 5 LEU QD 2.570 . 2.830 1.918 1.873 1.966 . 0 0 "[ . 1 . 2]" 1
1261 1 5 LEU QD 1 6 LEU H 4.660 . 5.130 3.829 3.566 4.031 . 0 0 "[ . 1 . 2]" 1
1262 1 6 LEU H 1 6 LEU QB 3.190 . 3.510 2.556 2.415 3.369 . 0 0 "[ . 1 . 2]" 1
1263 1 6 LEU H 1 6 LEU QD 3.600 . 3.960 3.100 2.820 3.412 . 0 0 "[ . 1 . 2]" 1
1264 1 6 LEU HA 1 6 LEU QD 3.060 . 3.370 2.096 1.968 3.414 0.044 6 0 "[ . 1 . 2]" 1
1265 1 6 LEU QB 1 6 LEU QD 2.700 . 2.970 1.963 1.924 1.973 . 0 0 "[ . 1 . 2]" 1
1266 1 7 HIS QB 1 8 LEU H 4.280 . 4.710 3.207 2.350 3.932 . 0 0 "[ . 1 . 2]" 1
1267 1 8 LEU H 1 8 LEU QB 3.480 . 3.830 2.590 2.265 3.320 . 0 0 "[ . 1 . 2]" 1
1268 1 8 LEU H 1 8 LEU QD 3.650 . 4.020 2.642 1.792 3.783 0.008 3 0 "[ . 1 . 2]" 1
1269 1 8 LEU HA 1 8 LEU QD 2.950 . 3.250 2.176 1.909 3.380 0.130 10 0 "[ . 1 . 2]" 1
1270 1 8 LEU QB 1 8 LEU QD 2.770 . 3.050 1.998 1.939 2.073 . 0 0 "[ . 1 . 2]" 1
1271 1 8 LEU QD 1 9 LEU H 4.800 . 5.280 3.701 1.948 4.456 . 0 0 "[ . 1 . 2]" 1
1272 1 9 LEU H 1 9 LEU QB 3.320 . 3.650 2.403 2.155 2.982 . 0 0 "[ . 1 . 2]" 1
1273 1 9 LEU QB 1 9 LEU MD1 2.930 . 3.220 2.106 2.091 2.214 . 0 0 "[ . 1 . 2]" 1
1274 1 9 LEU QB 1 10 CYS H 3.740 . 4.110 3.527 2.061 3.985 . 0 0 "[ . 1 . 2]" 1
1275 1 10 CYS QB 1 11 SER H 4.070 . 4.480 2.981 2.141 3.642 . 0 0 "[ . 1 . 2]" 1
1276 1 11 SER QB 1 12 PRO QD 3.660 . 4.030 2.617 1.888 3.615 . 0 0 "[ . 1 . 2]" 1
1277 1 12 PRO QB 1 13 ASP H 3.980 . 4.380 3.431 2.267 4.050 . 0 0 "[ . 1 . 2]" 1
1278 1 13 ASP QB 1 14 THR MG 4.850 . 5.330 3.846 3.086 4.798 . 0 0 "[ . 1 . 2]" 1
1279 1 15 ARG H 1 15 ARG QG 4.180 . 4.600 3.528 1.956 4.258 . 0 0 "[ . 1 . 2]" 1
1280 1 15 ARG H 1 15 ARG QD 5.140 . 5.650 4.621 3.741 5.404 . 0 0 "[ . 1 . 2]" 1
1281 1 15 ARG HA 1 15 ARG QG 3.440 . 3.780 2.702 2.291 3.371 . 0 0 "[ . 1 . 2]" 1
1282 1 15 ARG HA 1 15 ARG QD 4.790 . 5.270 3.930 2.123 4.522 . 0 0 "[ . 1 . 2]" 1
1283 1 15 ARG QB 1 16 GLN H 4.310 . 4.740 3.746 2.574 4.051 . 0 0 "[ . 1 . 2]" 1
1284 1 15 ARG QG 1 16 GLN H 4.610 . 5.070 4.004 3.010 4.522 . 0 0 "[ . 1 . 2]" 1
1285 1 16 GLN H 1 16 GLN QB 3.600 . 3.960 2.561 2.314 3.299 . 0 0 "[ . 1 . 2]" 1
1286 1 16 GLN H 1 16 GLN QG 3.820 . 4.200 2.895 1.779 3.918 0.021 1 0 "[ . 1 . 2]" 1
1287 1 16 GLN HA 1 17 PRO QG 4.600 . 5.060 3.935 3.681 4.158 . 0 0 "[ . 1 . 2]" 1
1288 1 16 GLN HA 1 17 PRO QD 3.370 . 3.710 2.034 1.798 2.241 0.002 2 0 "[ . 1 . 2]" 1
1289 1 16 GLN QB 1 17 PRO QD 4.050 . 4.460 2.519 1.885 3.594 . 0 0 "[ . 1 . 2]" 1
1290 1 17 PRO QB 1 18 LEU H 3.700 . 4.070 3.283 2.221 3.868 . 0 0 "[ . 1 . 2]" 1
1291 1 17 PRO QG 1 18 LEU H 4.560 . 5.020 4.281 2.693 4.887 . 0 0 "[ . 1 . 2]" 1
1292 1 18 LEU H 1 18 LEU QB 3.440 . 3.780 2.435 2.279 2.650 . 0 0 "[ . 1 . 2]" 1
1293 1 18 LEU QB 1 19 SER H 3.990 . 4.390 3.062 2.342 3.836 . 0 0 "[ . 1 . 2]" 1
1294 1 18 LEU QB 1 54 LEU QB 4.610 . 5.070 3.054 1.766 4.657 0.034 2 0 "[ . 1 . 2]" 1
1295 1 18 LEU QB 1 55 ILE H 5.560 . 6.120 4.644 3.096 5.991 . 0 0 "[ . 1 . 2]" 1
1296 1 18 LEU QB 1 72 LEU MD2 3.870 . 4.260 3.455 2.778 4.090 . 0 0 "[ . 1 . 2]" 1
1297 1 18 LEU QD 1 54 LEU QB 3.860 . 4.250 2.428 1.609 3.127 0.191 12 0 "[ . 1 . 2]" 1
1298 1 18 LEU QD 1 19 SER QB 4.760 . 5.240 4.700 3.570 5.109 . 0 0 "[ . 1 . 2]" 1
1299 1 19 SER H 1 54 LEU QB 4.650 . 5.120 3.769 3.424 4.136 . 0 0 "[ . 1 . 2]" 1
1300 1 19 SER QB 1 20 LEU H 3.170 . 3.490 2.501 2.137 3.378 . 0 0 "[ . 1 . 2]" 1
1301 1 19 SER QB 1 20 LEU QB 4.560 . 5.020 4.079 3.648 4.763 . 0 0 "[ . 1 . 2]" 1
1302 1 19 SER QB 1 54 LEU MD2 6.270 . 6.900 4.792 4.382 5.187 . 0 0 "[ . 1 . 2]" 1
1303 1 19 SER QB 1 55 ILE H 4.880 . 5.370 3.968 3.411 4.781 . 0 0 "[ . 1 . 2]" 1
1304 1 19 SER QB 1 55 ILE MG 3.590 . 3.950 2.562 2.165 3.793 . 0 0 "[ . 1 . 2]" 1
1305 1 20 LEU QB 1 20 LEU MD2 2.840 . 3.120 2.358 2.303 2.423 . 0 0 "[ . 1 . 2]" 1
1306 1 20 LEU QB 1 21 LEU H 3.910 . 4.300 3.700 3.580 3.835 . 0 0 "[ . 1 . 2]" 1
1307 1 20 LEU MD1 1 52 GLU QG 3.380 . 3.720 3.444 2.003 3.794 0.074 12 0 "[ . 1 . 2]" 1
1308 1 20 LEU MD2 1 52 GLU QG 3.750 . 4.130 2.991 1.887 3.860 . 0 0 "[ . 1 . 2]" 1
1309 1 21 LEU H 1 21 LEU QB 3.300 . 3.630 2.242 2.216 2.279 . 0 0 "[ . 1 . 2]" 1
1310 1 21 LEU QB 1 22 GLU H 4.350 . 4.790 3.795 3.727 3.928 . 0 0 "[ . 1 . 2]" 1
1311 1 21 LEU QB 1 53 ALA H 4.200 . 4.620 3.222 2.896 3.603 . 0 0 "[ . 1 . 2]" 1
1312 1 21 LEU QB 1 53 ALA MB 3.650 . 4.020 2.401 2.122 2.695 . 0 0 "[ . 1 . 2]" 1
1313 1 21 LEU QB 1 54 LEU H 5.300 . 5.830 3.842 3.341 4.269 . 0 0 "[ . 1 . 2]" 1
1314 1 21 LEU QB 1 54 LEU HA 5.240 . 5.760 3.334 2.892 3.700 . 0 0 "[ . 1 . 2]" 1
1315 1 21 LEU QB 1 55 ILE H 4.910 . 5.400 3.460 2.829 4.118 . 0 0 "[ . 1 . 2]" 1
1316 1 21 LEU QB 1 55 ILE HB 4.110 . 4.520 2.627 2.107 3.306 . 0 0 "[ . 1 . 2]" 1
1317 1 21 LEU HG 1 26 LEU QB 4.090 . 4.500 2.606 2.094 2.946 . 0 0 "[ . 1 . 2]" 1
1318 1 21 LEU MD1 1 22 GLU QB 4.900 . 5.390 3.536 2.987 4.260 . 0 0 "[ . 1 . 2]" 1
1319 1 21 LEU MD1 1 22 GLU QG 4.590 . 5.050 4.028 2.431 5.048 . 0 0 "[ . 1 . 2]" 1
1320 1 21 LEU MD1 1 25 GLY QA 3.670 . 4.040 2.647 1.811 3.347 . 0 0 "[ . 1 . 2]" 1
1321 1 21 LEU MD1 1 55 ILE QG 4.100 . 4.510 2.800 2.488 3.048 . 0 0 "[ . 1 . 2]" 1
1322 1 21 LEU MD2 1 25 GLY QA 5.010 . 5.510 3.671 3.120 4.433 . 0 0 "[ . 1 . 2]" 1
1323 1 21 LEU MD2 1 26 LEU QB 3.830 . 4.210 2.872 2.657 3.047 . 0 0 "[ . 1 . 2]" 1
1324 1 22 GLU H 1 22 GLU QB 3.550 . 3.900 2.336 2.197 2.617 . 0 0 "[ . 1 . 2]" 1
1325 1 22 GLU HA 1 23 SER QB 5.050 . 5.560 4.388 4.138 4.560 . 0 0 "[ . 1 . 2]" 1
1326 1 22 GLU QB 1 23 SER H 3.630 . 3.990 3.339 2.394 3.843 . 0 0 "[ . 1 . 2]" 1
1327 1 22 GLU QB 1 23 SER HA 5.220 . 5.740 5.001 4.663 5.152 . 0 0 "[ . 1 . 2]" 1
1328 1 22 GLU QB 1 24 LYS H 4.880 . 5.370 3.579 2.873 4.034 . 0 0 "[ . 1 . 2]" 1
1329 1 22 GLU QB 1 25 GLY H 4.220 . 4.640 3.152 2.796 3.858 . 0 0 "[ . 1 . 2]" 1
1330 1 22 GLU QG 1 23 SER H 4.080 . 4.490 3.204 2.481 4.078 . 0 0 "[ . 1 . 2]" 1
1331 1 22 GLU QG 1 23 SER HA 5.090 . 5.600 4.565 4.272 4.929 . 0 0 "[ . 1 . 2]" 1
1332 1 22 GLU QG 1 24 LYS H 4.150 . 4.570 2.370 1.796 3.595 0.004 17 0 "[ . 1 . 2]" 1
1333 1 22 GLU QG 1 25 GLY H 3.430 . 3.770 2.282 1.775 2.856 0.025 1 0 "[ . 1 . 2]" 1
1334 1 22 GLU QG 1 25 GLY QA 4.450 . 4.890 3.690 2.313 4.579 . 0 0 "[ . 1 . 2]" 1
1335 1 23 SER H 1 24 LYS QB 5.080 . 5.590 4.684 4.444 4.988 . 0 0 "[ . 1 . 2]" 1
1336 1 23 SER HA 1 26 LEU QB 3.840 . 4.220 2.166 1.763 2.771 0.037 3 0 "[ . 1 . 2]" 1
1337 1 23 SER QB 1 26 LEU QB 4.560 . 5.020 3.706 3.232 4.209 . 0 0 "[ . 1 . 2]" 1
1338 1 23 SER QB 1 26 LEU MD2 4.640 . 5.100 3.758 3.149 4.352 . 0 0 "[ . 1 . 2]" 1
1339 1 24 LYS H 1 24 LYS QB 3.550 . 3.900 2.336 2.180 2.582 . 0 0 "[ . 1 . 2]" 1
1340 1 24 LYS H 1 24 LYS QG 4.360 . 4.800 3.258 1.923 4.078 . 0 0 "[ . 1 . 2]" 1
1341 1 24 LYS HA 1 24 LYS QG 3.560 . 3.920 2.863 2.280 3.115 . 0 0 "[ . 1 . 2]" 1
1342 1 24 LYS HA 1 24 LYS QD 3.920 . 4.310 2.380 1.932 4.014 . 0 0 "[ . 1 . 2]" 1
1343 1 24 LYS HA 1 24 LYS QE 3.820 . 4.200 3.030 1.785 4.058 0.015 3 0 "[ . 1 . 2]" 1
1344 1 24 LYS QB 1 25 GLY H 3.420 . 3.760 2.605 2.318 2.874 . 0 0 "[ . 1 . 2]" 1
1345 1 24 LYS QE 1 24 LYS QG 3.320 . 3.650 2.453 2.155 2.853 . 0 0 "[ . 1 . 2]" 1
1346 1 24 LYS QG 1 25 GLY H 4.720 . 5.190 3.922 3.222 4.582 . 0 0 "[ . 1 . 2]" 1
1347 1 25 GLY H 1 26 LEU QB 4.640 . 5.100 4.224 4.159 4.300 . 0 0 "[ . 1 . 2]" 1
1348 1 25 GLY QA 1 28 ALA H 4.350 . 4.790 3.422 3.253 3.627 . 0 0 "[ . 1 . 2]" 1
1349 1 25 GLY QA 1 28 ALA MB 3.750 . 4.130 2.827 2.397 3.362 . 0 0 "[ . 1 . 2]" 1
1350 1 25 GLY QA 1 29 LEU MD2 5.250 . 5.780 3.385 2.917 4.033 . 0 0 "[ . 1 . 2]" 1
1351 1 25 GLY QA 1 87 PRO QD 5.230 . 5.750 4.030 2.325 5.776 0.026 4 0 "[ . 1 . 2]" 1
1352 1 26 LEU HA 1 29 LEU QB 3.900 . 4.290 2.946 2.621 3.279 . 0 0 "[ . 1 . 2]" 1
1353 1 26 LEU QB 1 26 LEU MD2 3.070 . 3.380 2.104 2.095 2.111 . 0 0 "[ . 1 . 2]" 1
1354 1 26 LEU QB 1 27 GLU H 3.440 . 3.780 2.528 2.330 2.803 . 0 0 "[ . 1 . 2]" 1
1355 1 26 LEU QB 1 27 GLU HA 5.460 . 6.010 4.194 4.153 4.239 . 0 0 "[ . 1 . 2]" 1
1356 1 26 LEU QB 1 28 ALA H 5.630 . 6.190 4.661 4.458 4.827 . 0 0 "[ . 1 . 2]" 1
1357 1 26 LEU QB 1 30 ASN HD22 4.900 . 5.390 4.512 3.952 4.795 . 0 0 "[ . 1 . 2]" 1
1358 1 26 LEU HG 1 27 GLU QB 5.620 . 6.180 4.726 4.391 5.082 . 0 0 "[ . 1 . 2]" 1
1359 1 26 LEU MD1 1 29 LEU QB 3.820 . 4.200 2.872 2.201 3.247 . 0 0 "[ . 1 . 2]" 1
1360 1 27 GLU H 1 27 GLU QB 2.990 . 3.290 2.501 2.385 2.577 . 0 0 "[ . 1 . 2]" 1
1361 1 27 GLU H 1 27 GLU QG 3.300 . 3.630 2.223 2.034 2.519 . 0 0 "[ . 1 . 2]" 1
1362 1 27 GLU HA 1 27 GLU QG 3.660 . 4.030 3.353 3.338 3.361 . 0 0 "[ . 1 . 2]" 1
1363 1 27 GLU QB 1 28 ALA H 3.700 . 4.070 3.521 3.369 3.603 . 0 0 "[ . 1 . 2]" 1
1364 1 27 GLU QB 1 28 ALA MB 4.960 . 5.460 4.651 4.461 4.749 . 0 0 "[ . 1 . 2]" 1
1365 1 27 GLU QG 1 28 ALA H 3.870 . 4.260 2.245 1.981 2.456 . 0 0 "[ . 1 . 2]" 1
1366 1 27 GLU QG 1 28 ALA MB 3.810 . 4.190 3.115 2.893 3.244 . 0 0 "[ . 1 . 2]" 1
1367 1 27 GLU QG 1 31 LYS QE 3.930 . 4.320 3.153 2.156 4.310 . 0 0 "[ . 1 . 2]" 1
1368 1 28 ALA H 1 31 LYS QG 5.510 . 6.060 5.001 4.624 5.770 . 0 0 "[ . 1 . 2]" 1
1369 1 28 ALA HA 1 31 LYS QE 4.320 . 4.750 3.344 2.029 4.767 0.017 19 0 "[ . 1 . 2]" 1
1370 1 28 ALA HA 1 85 ASN QB 4.560 . 5.020 3.114 2.211 4.579 . 0 0 "[ . 1 . 2]" 1
1371 1 28 ALA MB 1 85 ASN QB 4.550 . 5.010 2.828 2.026 4.531 . 0 0 "[ . 1 . 2]" 1
1372 1 28 ALA MB 1 87 PRO QD 3.810 . 4.190 3.001 1.867 4.250 0.060 10 0 "[ . 1 . 2]" 1
1373 1 29 LEU H 1 29 LEU QB 3.300 . 3.630 2.309 2.209 2.420 . 0 0 "[ . 1 . 2]" 1
1374 1 29 LEU QB 1 30 ASN H 3.310 . 3.640 2.439 2.359 2.556 . 0 0 "[ . 1 . 2]" 1
1375 1 29 LEU QB 1 33 ILE MD 4.670 . 5.140 3.118 2.823 3.382 . 0 0 "[ . 1 . 2]" 1
1376 1 30 ASN HB2 1 49 SER QB 4.570 . 5.030 4.718 4.203 5.027 . 0 0 "[ . 1 . 2]" 1
1377 1 30 ASN HD21 1 49 SER QB 5.060 . 5.570 5.115 4.296 5.561 . 0 0 "[ . 1 . 2]" 1
1378 1 30 ASN HD22 1 49 SER QB 4.680 . 5.150 4.515 3.880 4.961 . 0 0 "[ . 1 . 2]" 1
1379 1 31 LYS H 1 31 LYS QG 3.530 . 3.880 2.493 2.153 3.649 . 0 0 "[ . 1 . 2]" 1
1380 1 31 LYS H 1 31 LYS QE 5.480 . 6.030 4.141 3.352 5.183 . 0 0 "[ . 1 . 2]" 1
1381 1 31 LYS HA 1 31 LYS QG 3.250 . 3.580 2.412 2.261 2.475 . 0 0 "[ . 1 . 2]" 1
1382 1 31 LYS QE 1 31 LYS QG 2.920 . 3.210 2.366 2.152 2.694 . 0 0 "[ . 1 . 2]" 1
1383 1 31 LYS QG 1 32 ALA H 4.760 . 5.240 4.207 4.071 4.590 . 0 0 "[ . 1 . 2]" 1
1384 1 31 LYS QG 1 34 VAL MG2 5.110 . 5.620 4.415 3.817 5.060 . 0 0 "[ . 1 . 2]" 1
1385 1 33 ILE HA 1 33 ILE QG 3.730 . 4.100 2.367 2.331 2.408 . 0 0 "[ . 1 . 2]" 1
1386 1 33 ILE HB 1 49 SER QB 4.620 . 5.080 3.763 3.025 4.611 . 0 0 "[ . 1 . 2]" 1
1387 1 33 ILE MG 1 46 GLN QB 4.200 . 4.620 3.723 2.877 4.161 . 0 0 "[ . 1 . 2]" 1
1388 1 33 ILE MG 1 46 GLN QG 4.270 . 4.700 2.943 1.916 4.729 0.029 4 0 "[ . 1 . 2]" 1
1389 1 33 ILE MG 1 48 GLN QG 5.680 . 6.250 4.923 4.510 5.489 . 0 0 "[ . 1 . 2]" 1
1390 1 33 ILE MG 1 49 SER QB 4.260 . 4.690 3.050 2.464 3.855 . 0 0 "[ . 1 . 2]" 1
1391 1 33 ILE QG 1 38 VAL MG1 3.980 . 4.380 2.872 2.570 3.175 . 0 0 "[ . 1 . 2]" 1
1392 1 33 ILE QG 1 38 VAL MG2 3.570 . 3.930 2.051 1.818 2.767 . 0 0 "[ . 1 . 2]" 1
1393 1 33 ILE MD 1 46 GLN QE 4.120 . 4.530 3.331 1.910 4.570 0.040 16 0 "[ . 1 . 2]" 1
1394 1 33 ILE MD 1 49 SER QB 4.110 . 4.520 3.283 2.663 4.054 . 0 0 "[ . 1 . 2]" 1
1395 1 34 VAL MG1 1 49 SER QB 5.700 . 6.270 5.718 4.815 6.286 0.016 3 0 "[ . 1 . 2]" 1
1396 1 34 VAL MG2 1 49 SER QB 4.620 . 5.080 3.576 2.605 4.172 . 0 0 "[ . 1 . 2]" 1
1397 1 36 GLY QA 1 37 THR MG 4.960 . 5.460 4.233 4.016 4.343 . 0 0 "[ . 1 . 2]" 1
1398 1 36 GLY QA 1 45 ILE MG 4.170 . 4.590 2.707 2.319 3.240 . 0 0 "[ . 1 . 2]" 1
1399 1 38 VAL H 1 46 GLN QB 4.670 . 5.140 4.617 4.005 5.067 . 0 0 "[ . 1 . 2]" 1
1400 1 38 VAL HA 1 46 GLN QB 5.630 . 6.190 4.762 4.370 5.101 . 0 0 "[ . 1 . 2]" 1
1401 1 38 VAL HB 1 46 GLN QB 4.020 . 4.420 2.434 1.976 3.141 . 0 0 "[ . 1 . 2]" 1
1402 1 38 VAL MG1 1 46 GLN QB 3.600 . 3.960 2.227 2.050 2.738 . 0 0 "[ . 1 . 2]" 1
1403 1 38 VAL MG1 1 46 GLN QG 3.700 . 4.070 3.279 2.608 3.722 . 0 0 "[ . 1 . 2]" 1
1404 1 38 VAL MG1 1 78 ILE QG 4.360 . 4.800 2.645 2.066 3.290 . 0 0 "[ . 1 . 2]" 1
1405 1 38 VAL MG2 1 46 GLN QG 4.210 . 4.630 4.298 3.799 4.683 0.053 6 0 "[ . 1 . 2]" 1
1406 1 39 GLN H 1 39 GLN QG 4.290 . 4.720 2.695 1.944 3.594 . 0 0 "[ . 1 . 2]" 1
1407 1 39 GLN QG 1 40 ARG H 5.040 . 5.540 4.184 3.894 4.584 . 0 0 "[ . 1 . 2]" 1
1408 1 39 GLN QG 1 45 ILE HA 4.440 . 4.880 3.656 2.662 4.931 0.051 1 0 "[ . 1 . 2]" 1
1409 1 39 GLN QG 1 45 ILE MD 3.240 . 3.560 2.117 1.774 3.536 0.026 17 0 "[ . 1 . 2]" 1
1410 1 40 ARG H 1 40 ARG QB 3.200 . 3.520 2.418 2.152 2.910 . 0 0 "[ . 1 . 2]" 1
1411 1 40 ARG H 1 40 ARG QG 4.200 . 4.620 2.856 1.888 4.054 . 0 0 "[ . 1 . 2]" 1
1412 1 40 ARG H 1 40 ARG QD 5.030 . 5.530 3.976 2.160 4.789 . 0 0 "[ . 1 . 2]" 1
1413 1 40 ARG HA 1 40 ARG QG 3.700 . 4.070 2.794 2.345 3.387 . 0 0 "[ . 1 . 2]" 1
1414 1 40 ARG QB 1 41 ALA H 3.930 . 4.320 2.667 1.857 3.565 . 0 0 "[ . 1 . 2]" 1
1415 1 40 ARG QB 1 42 ASP H 4.200 . 4.620 2.961 2.256 3.689 . 0 0 "[ . 1 . 2]" 1
1416 1 40 ARG QB 1 43 GLY H 4.520 . 4.970 3.378 2.116 4.907 . 0 0 "[ . 1 . 2]" 1
1417 1 40 ARG QB 1 44 SER H 4.450 . 4.890 3.540 2.532 4.922 0.032 17 0 "[ . 1 . 2]" 1
1418 1 40 ARG QG 1 43 GLY H 5.070 . 5.580 3.920 2.480 5.597 0.017 8 0 "[ . 1 . 2]" 1
1419 1 40 ARG QG 1 44 SER H 5.040 . 5.540 4.017 2.251 5.426 . 0 0 "[ . 1 . 2]" 1
1420 1 40 ARG QG 1 44 SER HA 6.240 . 6.860 5.549 4.100 6.929 0.069 14 0 "[ . 1 . 2]" 1
1421 1 40 ARG QD 1 41 ALA H 5.570 . 6.130 4.196 2.571 4.873 . 0 0 "[ . 1 . 2]" 1
1422 1 41 ALA MB 1 75 GLU QB 4.900 . 5.390 3.953 3.049 4.807 . 0 0 "[ . 1 . 2]" 1
1423 1 42 ASP H 1 43 GLY QA 4.970 . 5.470 4.573 4.311 4.726 . 0 0 "[ . 1 . 2]" 1
1424 1 44 SER QB 1 45 ILE H 4.320 . 4.750 3.137 2.480 3.680 . 0 0 "[ . 1 . 2]" 1
1425 1 45 ILE HB 1 47 ASN QD 4.230 . 4.650 3.345 2.354 4.604 . 0 0 "[ . 1 . 2]" 1
1426 1 45 ILE MG 1 47 ASN QB 4.300 . 4.730 4.176 3.021 4.727 . 0 0 "[ . 1 . 2]" 1
1427 1 46 GLN H 1 46 GLN QB 3.470 . 3.820 2.303 2.247 2.412 . 0 0 "[ . 1 . 2]" 1
1428 1 46 GLN QB 1 47 ASN H 4.160 . 4.580 3.900 3.312 4.020 . 0 0 "[ . 1 . 2]" 1
1429 1 46 GLN QG 1 47 ASN H 4.210 . 4.630 3.439 2.665 4.127 . 0 0 "[ . 1 . 2]" 1
1430 1 46 GLN QG 1 48 GLN H 4.080 . 4.490 2.843 2.093 4.354 . 0 0 "[ . 1 . 2]" 1
1431 1 46 GLN QG 1 78 ILE MG 5.890 . 6.480 5.285 3.969 6.076 . 0 0 "[ . 1 . 2]" 1
1432 1 47 ASN H 1 47 ASN QD 4.270 . 4.700 3.213 2.109 4.334 . 0 0 "[ . 1 . 2]" 1
1433 1 47 ASN H 1 48 GLN QB 4.530 . 4.980 4.328 4.015 4.735 . 0 0 "[ . 1 . 2]" 1
1434 1 47 ASN H 1 48 GLN QG 4.530 . 4.980 3.637 3.090 4.344 . 0 0 "[ . 1 . 2]" 1
1435 1 47 ASN QB 1 48 GLN H 3.890 . 4.280 3.216 2.784 3.993 . 0 0 "[ . 1 . 2]" 1
1436 1 47 ASN QB 1 48 GLN HA 4.680 . 5.150 4.119 3.962 4.597 . 0 0 "[ . 1 . 2]" 1
1437 1 47 ASN QB 1 48 GLN QG 4.570 . 5.030 3.473 2.863 4.412 . 0 0 "[ . 1 . 2]" 1
1438 1 48 GLN H 1 48 GLN QB 3.200 . 3.520 2.477 2.330 2.872 . 0 0 "[ . 1 . 2]" 1
1439 1 48 GLN H 1 48 GLN QG 3.930 . 4.320 2.512 1.870 3.260 . 0 0 "[ . 1 . 2]" 1
1440 1 48 GLN HA 1 48 GLN QG 3.540 . 3.890 2.645 2.388 3.434 . 0 0 "[ . 1 . 2]" 1
1441 1 48 GLN HA 1 49 SER QB 4.330 . 4.760 4.467 4.316 4.600 . 0 0 "[ . 1 . 2]" 1
1442 1 48 GLN QB 1 48 GLN QE 3.820 . 4.200 3.185 2.650 3.727 . 0 0 "[ . 1 . 2]" 1
1443 1 48 GLN QB 1 49 SER H 3.650 . 4.020 3.395 2.666 3.615 . 0 0 "[ . 1 . 2]" 1
1444 1 49 SER H 1 49 SER QB 3.130 . 3.440 2.570 2.427 2.747 . 0 0 "[ . 1 . 2]" 1
1445 1 49 SER QB 1 50 LEU H 3.570 . 3.930 3.088 2.269 3.830 . 0 0 "[ . 1 . 2]" 1
1446 1 49 SER QB 1 50 LEU MD1 4.970 . 5.470 4.607 3.999 4.964 . 0 0 "[ . 1 . 2]" 1
1447 1 50 LEU MD2 1 64 ARG QB 4.250 . 4.680 2.744 2.033 3.729 . 0 0 "[ . 1 . 2]" 1
1448 1 50 LEU MD2 1 64 ARG QG 3.400 . 3.740 2.346 1.903 3.752 0.012 3 0 "[ . 1 . 2]" 1
1449 1 50 LEU MD2 1 64 ARG QD 4.500 . 4.950 2.779 2.037 3.685 . 0 0 "[ . 1 . 2]" 1
1450 1 51 HIS QB 1 52 GLU H 4.010 . 4.410 3.074 2.473 3.700 . 0 0 "[ . 1 . 2]" 1
1451 1 51 HIS QB 1 52 GLU QB 4.760 . 5.240 3.768 3.252 4.335 . 0 0 "[ . 1 . 2]" 1
1452 1 52 GLU H 1 52 GLU QB 3.140 . 3.450 2.693 2.439 2.898 . 0 0 "[ . 1 . 2]" 1
1453 1 52 GLU H 1 52 GLU QG 4.770 . 5.250 3.890 3.079 4.341 . 0 0 "[ . 1 . 2]" 1
1454 1 52 GLU HA 1 52 GLU QG 3.500 . 3.850 2.480 2.359 2.863 . 0 0 "[ . 1 . 2]" 1
1455 1 52 GLU QB 1 53 ALA H 3.730 . 4.100 3.284 2.687 3.801 . 0 0 "[ . 1 . 2]" 1
1456 1 52 GLU QB 1 65 ILE HB 3.710 . 4.080 2.371 1.872 3.196 . 0 0 "[ . 1 . 2]" 1
1457 1 52 GLU QB 1 65 ILE MG 4.090 . 4.500 2.956 2.348 3.663 . 0 0 "[ . 1 . 2]" 1
1458 1 52 GLU QB 1 65 ILE MD 3.410 . 3.750 2.769 1.768 3.785 0.035 16 0 "[ . 1 . 2]" 1
1459 1 52 GLU QG 1 53 ALA H 4.000 . 4.400 3.143 2.165 4.234 . 0 0 "[ . 1 . 2]" 1
1460 1 52 GLU QG 1 65 ILE MG 5.270 . 5.800 3.370 2.373 5.089 . 0 0 "[ . 1 . 2]" 1
1461 1 52 GLU QG 1 65 ILE MD 3.800 . 4.180 2.580 1.778 4.126 0.022 7 0 "[ . 1 . 2]" 1
1462 1 53 ALA MB 1 54 LEU QB 6.250 . 6.870 4.306 4.187 4.556 . 0 0 "[ . 1 . 2]" 1
1463 1 54 LEU QB 1 55 ILE H 4.140 . 4.550 2.944 2.518 3.257 . 0 0 "[ . 1 . 2]" 1
1464 1 54 LEU QB 1 63 PHE QB 4.810 . 5.290 1.793 1.686 1.957 0.114 18 0 "[ . 1 . 2]" 1
1465 1 54 LEU QB 1 72 LEU MD2 4.470 . 4.920 3.650 3.162 4.244 . 0 0 "[ . 1 . 2]" 1
1466 1 55 ILE QG 1 56 THR H 3.530 . 3.880 2.722 2.394 2.954 . 0 0 "[ . 1 . 2]" 1
1467 1 55 ILE QG 1 59 ARG H 4.170 . 4.590 3.423 3.115 3.698 . 0 0 "[ . 1 . 2]" 1
1468 1 55 ILE QG 1 59 ARG QD 4.410 . 4.850 3.212 1.855 4.074 . 0 0 "[ . 1 . 2]" 1
1469 1 55 ILE QG 1 62 VAL QG 4.220 . 4.640 3.689 3.408 3.843 . 0 0 "[ . 1 . 2]" 1
1470 1 55 ILE MD 1 59 ARG QD 4.370 . 4.810 3.683 2.156 4.523 . 0 0 "[ . 1 . 2]" 1
1471 1 57 ARG H 1 57 ARG QG 4.560 . 5.020 3.189 1.892 4.078 . 0 0 "[ . 1 . 2]" 1
1472 1 57 ARG HA 1 57 ARG QG 3.630 . 3.990 2.755 2.252 3.461 . 0 0 "[ . 1 . 2]" 1
1473 1 57 ARG HA 1 57 ARG QD 4.800 . 5.280 3.472 1.962 4.302 . 0 0 "[ . 1 . 2]" 1
1474 1 57 ARG QB 1 58 ASP H 3.650 . 4.020 2.959 2.672 3.761 . 0 0 "[ . 1 . 2]" 1
1475 1 57 ARG QG 1 58 ASP H 4.970 . 5.470 3.788 2.066 4.647 . 0 0 "[ . 1 . 2]" 1
1476 1 58 ASP H 1 58 ASP QB 3.580 . 3.940 2.525 2.246 3.004 . 0 0 "[ . 1 . 2]" 1
1477 1 58 ASP H 1 60 LYS QG 5.680 . 6.250 4.187 3.400 5.002 . 0 0 "[ . 1 . 2]" 1
1478 1 58 ASP QB 1 60 LYS QG 4.610 . 5.070 2.456 1.779 3.944 0.021 12 0 "[ . 1 . 2]" 1
1479 1 59 ARG H 1 59 ARG QG 3.780 . 4.160 3.037 2.571 3.661 . 0 0 "[ . 1 . 2]" 1
1480 1 59 ARG H 1 59 ARG QD 4.440 . 4.880 3.343 2.074 4.805 . 0 0 "[ . 1 . 2]" 1
1481 1 59 ARG H 1 60 LYS QG 5.600 . 6.160 4.134 3.818 4.499 . 0 0 "[ . 1 . 2]" 1
1482 1 60 LYS H 1 60 LYS QB 3.340 . 3.670 2.601 2.371 3.091 . 0 0 "[ . 1 . 2]" 1
1483 1 60 LYS H 1 60 LYS QG 3.940 . 4.330 2.399 1.842 2.887 . 0 0 "[ . 1 . 2]" 1
1484 1 60 LYS H 1 61 GLN QG 5.690 . 6.260 4.629 4.142 5.838 . 0 0 "[ . 1 . 2]" 1
1485 1 60 LYS HA 1 60 LYS QG 3.590 . 3.950 2.844 2.338 3.408 . 0 0 "[ . 1 . 2]" 1
1486 1 60 LYS HA 1 60 LYS QD 4.520 . 4.970 3.669 1.968 4.567 . 0 0 "[ . 1 . 2]" 1
1487 1 60 LYS QB 1 60 LYS QE 3.580 . 3.940 2.661 1.818 3.671 . 0 0 "[ . 1 . 2]" 1
1488 1 60 LYS QB 1 61 GLN H 3.600 . 3.960 2.803 2.054 3.673 . 0 0 "[ . 1 . 2]" 1
1489 1 60 LYS QE 1 60 LYS QG 3.300 . 3.630 2.442 2.135 2.880 . 0 0 "[ . 1 . 2]" 1
1490 1 60 LYS QG 1 61 GLN H 5.230 . 5.750 3.504 2.014 4.373 . 0 0 "[ . 1 . 2]" 1
1491 1 61 GLN H 1 61 GLN QG 4.030 . 4.430 2.993 2.673 3.767 . 0 0 "[ . 1 . 2]" 1
1492 1 61 GLN QG 1 62 VAL H 5.150 . 5.670 3.983 3.641 4.564 . 0 0 "[ . 1 . 2]" 1
1493 1 61 GLN QG 1 80 THR H 5.720 . 6.290 4.313 3.503 4.998 . 0 0 "[ . 1 . 2]" 1
1494 1 63 PHE QB 1 64 ARG H 4.020 . 4.420 2.442 2.027 2.933 . 0 0 "[ . 1 . 2]" 1
1495 1 63 PHE QB 1 72 LEU MD2 3.720 . 4.090 3.160 2.429 4.118 0.028 18 0 "[ . 1 . 2]" 1
1496 1 64 ARG H 1 64 ARG QB 3.620 . 3.980 2.365 2.224 2.905 . 0 0 "[ . 1 . 2]" 1
1497 1 64 ARG QB 1 65 ILE H 3.860 . 4.250 3.478 2.220 3.756 . 0 0 "[ . 1 . 2]" 1
1498 1 64 ARG QG 1 65 ILE H 3.990 . 4.390 2.545 2.070 3.249 . 0 0 "[ . 1 . 2]" 1
1499 1 64 ARG QG 1 65 ILE HG13 4.710 . 5.180 4.830 4.533 5.247 0.067 9 0 "[ . 1 . 2]" 1
1500 1 65 ILE MG 1 68 SER QB 4.250 . 4.680 4.366 3.983 4.767 0.087 1 0 "[ . 1 . 2]" 1
1501 1 66 GLU H 1 66 GLU QB 3.410 . 3.750 2.910 2.339 3.219 . 0 0 "[ . 1 . 2]" 1
1502 1 66 GLU H 1 66 GLU QG 4.400 . 4.840 2.805 2.058 4.224 . 0 0 "[ . 1 . 2]" 1
1503 1 66 GLU QB 1 67 ASP H 4.210 . 4.630 3.097 2.583 3.831 . 0 0 "[ . 1 . 2]" 1
1504 1 66 GLU QB 1 71 VAL QG 3.410 . 3.750 3.177 2.133 3.771 0.021 7 0 "[ . 1 . 2]" 1
1505 1 66 GLU QG 1 67 ASP H 4.430 . 4.870 3.689 2.743 4.223 . 0 0 "[ . 1 . 2]" 1
1506 1 66 GLU QG 1 67 ASP HB2 4.490 . 4.940 3.473 2.652 4.214 . 0 0 "[ . 1 . 2]" 1
1507 1 66 GLU QG 1 67 ASP HB3 4.270 . 4.700 3.435 3.072 3.790 . 0 0 "[ . 1 . 2]" 1
1508 1 66 GLU QG 1 71 VAL QG 3.290 . 3.620 2.493 1.844 3.660 0.040 1 0 "[ . 1 . 2]" 1
1509 1 68 SER QB 1 69 ILE H 3.870 . 4.260 3.559 2.958 3.785 . 0 0 "[ . 1 . 2]" 1
1510 1 68 SER QB 1 69 ILE HG12 4.060 . 4.470 3.681 3.211 4.019 . 0 0 "[ . 1 . 2]" 1
1511 1 69 ILE HB 1 70 PRO QD 4.860 . 5.350 4.171 4.024 4.276 . 0 0 "[ . 1 . 2]" 1
1512 1 69 ILE MG 1 70 PRO QD 3.550 . 3.900 2.443 2.098 2.686 . 0 0 "[ . 1 . 2]" 1
1513 1 71 VAL QG 1 76 GLU QB 3.620 . 3.980 2.763 2.234 3.572 . 0 0 "[ . 1 . 2]" 1
1514 1 73 LEU H 1 74 PRO QD 4.500 . 4.950 4.346 4.192 4.433 . 0 0 "[ . 1 . 2]" 1
1515 1 73 LEU H 1 76 GLU QB 4.770 . 5.250 3.811 2.882 5.170 . 0 0 "[ . 1 . 2]" 1
1516 1 73 LEU H 1 76 GLU QG 4.650 . 5.120 4.067 2.870 5.141 0.021 16 0 "[ . 1 . 2]" 1
1517 1 73 LEU HB2 1 74 PRO QD 5.040 . 5.540 3.947 3.673 4.199 . 0 0 "[ . 1 . 2]" 1
1518 1 73 LEU HB2 1 75 GLU QG 4.360 . 4.800 3.092 2.471 4.471 . 0 0 "[ . 1 . 2]" 1
1519 1 73 LEU HB2 1 76 GLU QG 4.140 . 4.550 2.991 1.763 4.294 0.037 6 0 "[ . 1 . 2]" 1
1520 1 73 LEU HB3 1 75 GLU QG 4.160 . 4.580 2.463 1.872 3.392 . 0 0 "[ . 1 . 2]" 1
1521 1 73 LEU MD1 1 75 GLU QG 3.740 . 4.110 3.227 2.880 4.130 0.020 4 0 "[ . 1 . 2]" 1
1522 1 73 LEU MD2 1 74 PRO QG 4.600 . 5.060 4.265 4.048 4.694 . 0 0 "[ . 1 . 2]" 1
1523 1 73 LEU MD2 1 74 PRO QD 3.640 . 4.000 2.758 2.552 3.027 . 0 0 "[ . 1 . 2]" 1
1524 1 74 PRO QB 1 75 GLU H 3.870 . 4.260 3.115 2.414 3.622 . 0 0 "[ . 1 . 2]" 1
1525 1 74 PRO QB 1 77 ALA MB 5.150 . 5.670 3.920 3.367 4.517 . 0 0 "[ . 1 . 2]" 1
1526 1 74 PRO QG 1 75 GLU H 3.330 . 3.660 2.789 2.335 3.724 0.064 3 0 "[ . 1 . 2]" 1
1527 1 74 PRO QD 1 75 GLU H 3.680 . 4.050 2.971 2.627 3.149 . 0 0 "[ . 1 . 2]" 1
1528 1 75 GLU H 1 75 GLU QB 3.530 . 3.880 2.585 2.474 2.929 . 0 0 "[ . 1 . 2]" 1
1529 1 75 GLU H 1 75 GLU QG 3.500 . 3.850 2.152 1.810 2.858 . 0 0 "[ . 1 . 2]" 1
1530 1 75 GLU QG 1 76 GLU H 3.760 . 4.140 2.639 2.101 4.035 . 0 0 "[ . 1 . 2]" 1
1531 1 76 GLU H 1 76 GLU QG 4.200 . 4.620 2.879 1.874 4.117 . 0 0 "[ . 1 . 2]" 1
1532 1 76 GLU QB 1 77 ALA H 4.420 . 4.860 3.477 3.072 3.733 . 0 0 "[ . 1 . 2]" 1
1533 1 78 ILE H 1 78 ILE QG 4.120 . 4.530 2.896 2.069 3.598 . 0 0 "[ . 1 . 2]" 1
1534 1 78 ILE HA 1 78 ILE QG 3.680 . 4.050 2.667 2.369 3.081 . 0 0 "[ . 1 . 2]" 1
1535 1 78 ILE MG 1 82 GLN QB 5.710 . 6.280 3.792 2.624 5.990 . 0 0 "[ . 1 . 2]" 1
1536 1 78 ILE QG 1 79 ALA H 5.240 . 5.760 4.337 3.930 4.710 . 0 0 "[ . 1 . 2]" 1
1537 1 79 ALA MB 1 82 GLN QB 3.780 . 4.160 3.062 2.102 4.172 0.012 18 0 "[ . 1 . 2]" 1
1538 1 79 ALA MB 1 82 GLN QG 4.580 . 5.040 3.112 2.033 4.481 . 0 0 "[ . 1 . 2]" 1
1539 1 81 ILE H 1 81 ILE QG 4.140 . 4.550 4.072 3.982 4.098 . 0 0 "[ . 1 . 2]" 1
1540 1 81 ILE HA 1 81 ILE QG 3.350 . 3.690 2.831 2.342 2.940 . 0 0 "[ . 1 . 2]" 1
1541 1 81 ILE QG 1 81 ILE MG 2.830 . 3.110 2.158 2.122 2.339 . 0 0 "[ . 1 . 2]" 1
1542 1 81 ILE MG 1 82 GLN QG 4.960 . 5.460 3.354 1.979 4.950 . 0 0 "[ . 1 . 2]" 1
1543 1 81 ILE QG 1 82 GLN H 4.530 . 4.980 4.052 3.836 4.199 . 0 0 "[ . 1 . 2]" 1
1544 1 82 GLN H 1 82 GLN QB 3.080 . 3.390 2.401 2.224 2.965 . 0 0 "[ . 1 . 2]" 1
1545 1 82 GLN H 1 82 GLN QG 4.490 . 4.940 3.064 1.954 4.073 . 0 0 "[ . 1 . 2]" 1
1546 1 82 GLN QB 1 82 GLN QE 3.630 . 3.990 3.187 1.800 3.738 0.000 3 0 "[ . 1 . 2]" 1
1547 1 82 GLN QB 1 83 ILE HG12 4.310 . 4.740 3.668 3.271 4.829 0.089 6 0 "[ . 1 . 2]" 1
1548 1 82 GLN QG 1 83 ILE H 5.270 . 5.800 4.170 2.444 4.972 . 0 0 "[ . 1 . 2]" 1
1549 1 82 GLN QG 1 83 ILE MD 5.680 . 6.250 4.164 2.067 5.099 . 0 0 "[ . 1 . 2]" 1
1550 1 83 ILE HB 1 86 PHE QB 4.110 . 4.520 2.254 1.774 3.408 0.026 15 0 "[ . 1 . 2]" 1
1551 1 83 ILE MG 1 86 PHE QB 3.650 . 4.020 2.642 2.115 3.539 . 0 0 "[ . 1 . 2]" 1
1552 1 84 ALA HA 1 85 ASN QB 5.170 . 5.690 5.415 5.152 5.534 . 0 0 "[ . 1 . 2]" 1
1553 1 84 ALA MB 1 85 ASN QB 4.560 . 5.020 4.372 3.620 4.672 . 0 0 "[ . 1 . 2]" 1
1554 1 84 ALA MB 1 85 ASN QD 3.760 . 4.140 3.525 2.459 4.206 0.066 14 0 "[ . 1 . 2]" 1
1555 1 85 ASN H 1 85 ASN QB 3.520 . 3.870 2.515 2.335 3.004 . 0 0 "[ . 1 . 2]" 1
1556 1 85 ASN H 1 85 ASN QD 4.440 . 4.880 3.071 2.292 3.937 . 0 0 "[ . 1 . 2]" 1
1557 1 85 ASN H 1 86 PHE QB 5.100 . 5.610 4.028 3.664 4.466 . 0 0 "[ . 1 . 2]" 1
1558 1 85 ASN QB 1 85 ASN QD 2.850 . 3.130 2.245 2.125 2.713 . 0 0 "[ . 1 . 2]" 1
1559 1 85 ASN QB 1 86 PHE H 4.420 . 4.860 3.481 2.989 4.013 . 0 0 "[ . 1 . 2]" 1
1560 1 86 PHE H 1 86 PHE QB 3.000 . 3.300 2.185 2.124 2.266 . 0 0 "[ . 1 . 2]" 1
1561 1 86 PHE QB 1 87 PRO QD 3.860 . 4.250 3.405 2.841 3.664 . 0 0 "[ . 1 . 2]" 1
1562 1 86 PHE QD 1 87 PRO QD . . 4.620 3.108 2.716 3.491 . 0 0 "[ . 1 . 2]" 1
1563 1 87 PRO HA 1 88 ASP QB 4.390 . 4.830 4.422 4.094 4.620 . 0 0 "[ . 1 . 2]" 1
1564 1 87 PRO QB 1 88 ASP H 3.720 . 4.090 3.244 2.520 3.987 . 0 0 "[ . 1 . 2]" 1
1565 1 88 ASP H 1 88 ASP QB 3.300 . 3.630 2.460 2.228 2.814 . 0 0 "[ . 1 . 2]" 1
1566 1 88 ASP HA 1 89 LYS QG 5.580 . 6.140 4.299 3.541 5.800 . 0 0 "[ . 1 . 2]" 1
1567 1 88 ASP QB 1 89 LYS H 3.300 . 3.630 3.022 1.792 3.727 0.097 10 0 "[ . 1 . 2]" 1
1568 1 89 LYS H 1 89 LYS QB 3.210 . 3.530 2.721 2.297 3.395 . 0 0 "[ . 1 . 2]" 1
1569 1 89 LYS H 1 89 LYS QG 3.830 . 4.210 2.750 1.868 4.005 . 0 0 "[ . 1 . 2]" 1
1570 1 89 LYS H 1 89 LYS QE 5.650 . 6.210 4.104 1.750 5.182 0.050 13 0 "[ . 1 . 2]" 1
1571 1 89 LYS HA 1 89 LYS QG 3.740 . 4.110 2.967 2.392 3.526 . 0 0 "[ . 1 . 2]" 1
1572 1 89 LYS QB 1 89 LYS QE 4.290 . 4.720 2.484 1.788 3.827 0.012 6 0 "[ . 1 . 2]" 1
1573 1 89 LYS QB 1 90 LEU H 3.710 . 4.080 2.927 1.956 3.820 . 0 0 "[ . 1 . 2]" 1
1574 1 89 LYS QE 1 89 LYS QG 3.320 . 3.650 2.461 2.248 2.865 . 0 0 "[ . 1 . 2]" 1
1575 1 89 LYS QD 1 90 LEU H 5.600 . 6.160 4.719 3.822 5.869 . 0 0 "[ . 1 . 2]" 1
1576 1 89 LYS QE 1 90 LEU H 4.990 . 5.490 4.681 3.122 5.689 0.199 17 0 "[ . 1 . 2]" 1
1577 1 90 LEU H 1 90 LEU QB 3.520 . 3.870 2.503 2.247 3.295 . 0 0 "[ . 1 . 2]" 1
1578 1 90 LEU QB 1 91 GLU H 4.320 . 4.750 3.468 1.961 4.040 . 0 0 "[ . 1 . 2]" 1
1579 1 91 GLU H 1 91 GLU QB 3.620 . 3.980 2.699 2.195 3.381 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 42
_Distance_constraint_stats_list.Viol_count 59
_Distance_constraint_stats_list.Viol_total 19.233
_Distance_constraint_stats_list.Viol_max 0.053
_Distance_constraint_stats_list.Viol_rms 0.0053
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0011
_Distance_constraint_stats_list.Viol_average_violations_only 0.0163
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 19 SER 0.027 0.011 12 0 "[ . 1 . 2]"
1 21 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 GLU 0.017 0.017 6 0 "[ . 1 . 2]"
1 25 GLY 0.372 0.053 11 0 "[ . 1 . 2]"
1 26 LEU 0.197 0.044 14 0 "[ . 1 . 2]"
1 28 ALA 0.401 0.053 11 0 "[ . 1 . 2]"
1 29 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 ASN 0.180 0.044 14 0 "[ . 1 . 2]"
1 31 LYS 0.052 0.023 18 0 "[ . 1 . 2]"
1 32 ALA 0.029 0.014 15 0 "[ . 1 . 2]"
1 33 ILE 0.127 0.025 18 0 "[ . 1 . 2]"
1 34 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 SER 0.052 0.023 18 0 "[ . 1 . 2]"
1 36 GLY 0.127 0.025 18 0 "[ . 1 . 2]"
1 38 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 ARG 0.027 0.027 17 0 "[ . 1 . 2]"
1 44 SER 0.027 0.027 17 0 "[ . 1 . 2]"
1 46 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ILE 0.027 0.011 12 0 "[ . 1 . 2]"
1 56 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 VAL 0.039 0.027 6 0 "[ . 1 . 2]"
1 63 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 GLU 0.041 0.030 20 0 "[ . 1 . 2]"
1 69 ILE 0.041 0.030 20 0 "[ . 1 . 2]"
1 78 ILE 0.039 0.027 6 0 "[ . 1 . 2]"
1 79 ALA 0.051 0.022 9 0 "[ . 1 . 2]"
1 80 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 GLN 0.051 0.022 9 0 "[ . 1 . 2]"
1 83 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 19 SER H 1 55 ILE O 2.000 . 2.200 2.039 1.926 2.211 0.011 12 0 "[ . 1 . 2]" 2
2 1 19 SER N 1 55 ILE O 3.000 . 3.300 2.962 2.728 3.181 . 0 0 "[ . 1 . 2]" 2
3 1 21 LEU H 1 53 ALA O 2.000 . 2.200 1.970 1.864 2.115 . 0 0 "[ . 1 . 2]" 2
4 1 21 LEU N 1 53 ALA O 3.000 . 3.300 2.929 2.821 3.076 . 0 0 "[ . 1 . 2]" 2
5 1 22 GLU O 1 26 LEU H 2.000 . 2.200 1.878 1.783 2.082 0.017 6 0 "[ . 1 . 2]" 2
6 1 22 GLU O 1 26 LEU N 3.000 . 3.300 2.805 2.715 2.946 . 0 0 "[ . 1 . 2]" 2
7 1 25 GLY O 1 28 ALA H 2.000 . 2.200 2.211 2.089 2.253 0.053 11 0 "[ . 1 . 2]" 2
8 1 25 GLY O 1 28 ALA N 3.000 . 3.300 2.878 2.818 2.994 . 0 0 "[ . 1 . 2]" 2
9 1 26 LEU O 1 30 ASN H 2.000 . 2.200 2.154 1.938 2.244 0.044 14 0 "[ . 1 . 2]" 2
10 1 26 LEU O 1 30 ASN N 3.000 . 3.300 3.125 2.911 3.216 . 0 0 "[ . 1 . 2]" 2
11 1 28 ALA O 1 32 ALA H 2.000 . 2.200 2.106 1.993 2.214 0.014 15 0 "[ . 1 . 2]" 2
12 1 28 ALA O 1 32 ALA N 3.000 . 3.300 3.027 2.857 3.158 . 0 0 "[ . 1 . 2]" 2
13 1 29 LEU O 1 33 ILE H 2.000 . 2.200 1.934 1.856 2.016 . 0 0 "[ . 1 . 2]" 2
14 1 29 LEU O 1 33 ILE N 3.000 . 3.300 2.824 2.737 2.905 . 0 0 "[ . 1 . 2]" 2
15 1 30 ASN O 1 34 VAL H 2.000 . 2.200 1.986 1.862 2.121 . 0 0 "[ . 1 . 2]" 2
16 1 30 ASN O 1 34 VAL N 3.000 . 3.300 2.952 2.833 3.098 . 0 0 "[ . 1 . 2]" 2
17 1 31 LYS O 1 35 SER H 2.000 . 2.200 2.053 1.955 2.223 0.023 18 0 "[ . 1 . 2]" 2
18 1 31 LYS O 1 35 SER N 3.000 . 3.300 2.929 2.814 3.110 . 0 0 "[ . 1 . 2]" 2
19 1 33 ILE O 1 36 GLY H 2.000 . 2.200 2.161 2.019 2.225 0.025 18 0 "[ . 1 . 2]" 2
20 1 33 ILE O 1 36 GLY N 3.000 . 3.300 2.928 2.836 3.006 . 0 0 "[ . 1 . 2]" 2
21 1 40 ARG H 1 44 SER O 2.000 . 2.200 1.940 1.804 2.227 0.027 17 0 "[ . 1 . 2]" 2
22 1 40 ARG N 1 44 SER O 3.000 . 3.300 2.864 2.735 3.091 . 0 0 "[ . 1 . 2]" 2
23 1 38 VAL O 1 46 GLN H 2.000 . 2.200 1.926 1.830 2.155 . 0 0 "[ . 1 . 2]" 2
24 1 38 VAL O 1 46 GLN N 3.000 . 3.300 2.869 2.743 3.065 . 0 0 "[ . 1 . 2]" 2
25 1 54 LEU H 1 63 PHE O 2.000 . 2.200 1.868 1.808 1.935 . 0 0 "[ . 1 . 2]" 2
26 1 54 LEU N 1 63 PHE O 3.000 . 3.300 2.811 2.754 2.898 . 0 0 "[ . 1 . 2]" 2
27 1 19 SER O 1 55 ILE H 2.000 . 2.200 1.841 1.792 1.910 0.008 16 0 "[ . 1 . 2]" 2
28 1 19 SER O 1 55 ILE N 3.000 . 3.300 2.751 2.663 2.830 . 0 0 "[ . 1 . 2]" 2
29 1 56 THR O 1 59 ARG H 2.000 . 2.200 1.935 1.830 2.181 . 0 0 "[ . 1 . 2]" 2
30 1 56 THR O 1 59 ARG N 3.000 . 3.300 2.821 2.695 2.994 . 0 0 "[ . 1 . 2]" 2
31 1 62 VAL H 1 78 ILE O 2.000 . 2.200 1.893 1.802 2.227 0.027 6 0 "[ . 1 . 2]" 2
32 1 62 VAL N 1 78 ILE O 3.000 . 3.300 2.812 2.691 3.208 . 0 0 "[ . 1 . 2]" 2
33 1 54 LEU O 1 63 PHE H 2.000 . 2.200 1.924 1.839 2.061 . 0 0 "[ . 1 . 2]" 2
34 1 54 LEU O 1 63 PHE N 3.000 . 3.300 2.834 2.728 2.999 . 0 0 "[ . 1 . 2]" 2
35 1 66 GLU O 1 69 ILE H 2.000 . 2.200 1.949 1.819 2.230 0.030 20 0 "[ . 1 . 2]" 2
36 1 66 GLU O 1 69 ILE N 3.000 . 3.300 2.862 2.757 3.037 . 0 0 "[ . 1 . 2]" 2
37 1 62 VAL O 1 78 ILE H 2.000 . 2.200 1.852 1.790 1.908 0.010 20 0 "[ . 1 . 2]" 2
38 1 62 VAL O 1 78 ILE N 3.000 . 3.300 2.781 2.721 2.885 . 0 0 "[ . 1 . 2]" 2
39 1 79 ALA O 1 82 GLN H 2.000 . 2.200 2.112 1.977 2.222 0.022 9 0 "[ . 1 . 2]" 2
40 1 79 ALA O 1 82 GLN N 3.000 . 3.300 3.026 2.915 3.176 . 0 0 "[ . 1 . 2]" 2
41 1 80 THR O 1 83 ILE H 2.000 . 2.200 2.050 1.966 2.200 . 0 0 "[ . 1 . 2]" 2
42 1 80 THR O 1 83 ILE N 3.000 . 3.300 2.938 2.870 3.131 . 0 0 "[ . 1 . 2]" 2
stop_
save_
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