NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
631287 |
6gw8   |
34293 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6gw8
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 568
_Distance_constraint_stats_list.Viol_count 1075
_Distance_constraint_stats_list.Viol_total 1635.166
_Distance_constraint_stats_list.Viol_max 0.699
_Distance_constraint_stats_list.Viol_rms 0.0340
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0072
_Distance_constraint_stats_list.Viol_average_violations_only 0.0761
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 3 LEU 2.522 0.197 20 0 "[ . 1 . 2]"
1 4 ARG 2.150 0.197 20 0 "[ . 1 . 2]"
1 5 CYS 2.175 0.149 17 0 "[ . 1 . 2]"
1 6 GLY 8.637 0.316 12 0 "[ . 1 . 2]"
1 7 CYS 4.974 0.316 12 0 "[ . 1 . 2]"
1 8 PRO 3.865 0.277 4 0 "[ . 1 . 2]"
1 9 ASP 0.487 0.090 17 0 "[ . 1 . 2]"
1 10 CYS 1.009 0.180 4 0 "[ . 1 . 2]"
1 11 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 CYS 0.078 0.035 20 0 "[ . 1 . 2]"
1 13 LYS 4.974 0.449 12 0 "[ . 1 . 2]"
1 14 VAL 4.058 0.262 16 0 "[ . 1 . 2]"
1 15 ASP 7.448 0.276 11 0 "[ . 1 . 2]"
1 16 PRO 2.334 0.226 13 0 "[ . 1 . 2]"
1 17 GLU 1.661 0.247 11 0 "[ . 1 . 2]"
1 18 ARG 8.648 0.277 19 0 "[ . 1 . 2]"
1 19 VAL 9.762 0.277 19 0 "[ . 1 . 2]"
1 20 PHE 5.433 0.229 4 0 "[ . 1 . 2]"
1 21 ASN 1.696 0.142 13 0 "[ . 1 . 2]"
1 22 HIS 2.499 0.173 12 0 "[ . 1 . 2]"
1 23 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 GLU 3.347 0.228 13 0 "[ . 1 . 2]"
1 26 ALA 4.372 0.228 13 0 "[ . 1 . 2]"
1 27 TYR 8.972 0.309 12 0 "[ . 1 . 2]"
1 28 CYS 2.566 0.161 3 0 "[ . 1 . 2]"
1 29 SER 1.264 0.261 8 0 "[ . 1 . 2]"
1 30 GLN 5.106 0.275 1 0 "[ . 1 . 2]"
1 31 ALA 3.528 0.275 1 0 "[ . 1 . 2]"
1 32 CYS 2.152 0.177 17 0 "[ . 1 . 2]"
1 33 ALA 5.725 0.221 11 0 "[ . 1 . 2]"
1 34 GLU 4.966 0.309 12 0 "[ . 1 . 2]"
1 35 GLN 1.604 0.182 9 0 "[ . 1 . 2]"
1 36 HIS 5.806 0.217 9 0 "[ . 1 . 2]"
1 37 PRO 0.190 0.045 1 0 "[ . 1 . 2]"
1 38 ASN 3.293 0.301 20 0 "[ . 1 . 2]"
1 39 GLY 0.696 0.113 11 0 "[ . 1 . 2]"
1 40 GLU 1.622 0.135 9 0 "[ . 1 . 2]"
1 41 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 CYS 1.433 0.094 1 0 "[ . 1 . 2]"
1 43 PRO 0.651 0.090 13 0 "[ . 1 . 2]"
1 44 ALA 0.871 0.108 12 0 "[ . 1 . 2]"
1 45 PRO 2.005 0.141 6 0 "[ . 1 . 2]"
1 46 ASP 0.201 0.141 6 0 "[ . 1 . 2]"
1 47 CYS 1.117 0.119 7 0 "[ . 1 . 2]"
1 48 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 CYS 0.291 0.197 19 0 "[ . 1 . 2]"
1 50 GLU 1.615 0.424 9 0 "[ . 1 . 2]"
1 51 ARG 7.567 0.699 13 9 "[* . * * *+ * *-*]"
1 52 SER 6.317 0.699 13 9 "[* . * * *+ * *-*]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 GLU HA 1 2 GLU QG 3.800 . 3.800 2.618 2.369 3.347 . 0 0 "[ . 1 . 2]" 1
2 1 3 LEU H 1 3 LEU HG 4.750 . 4.750 4.543 4.470 4.611 . 0 0 "[ . 1 . 2]" 1
3 1 3 LEU H 1 4 ARG H 5.070 . 5.070 4.327 4.117 4.528 . 0 0 "[ . 1 . 2]" 1
4 1 3 LEU HA 1 4 ARG H 3.070 . 3.070 2.121 2.071 2.165 . 0 0 "[ . 1 . 2]" 1
5 1 3 LEU HA 1 14 VAL MG1 4.770 . 4.770 4.797 4.603 4.913 0.143 11 0 "[ . 1 . 2]" 1
6 1 3 LEU HA 1 26 ALA MB 5.500 . 5.500 4.390 3.783 4.754 . 0 0 "[ . 1 . 2]" 1
7 1 3 LEU QB 1 14 VAL HB 4.160 . 4.160 3.011 2.351 3.633 . 0 0 "[ . 1 . 2]" 1
8 1 3 LEU QB 1 26 ALA MB 5.030 . 5.030 4.353 4.027 4.666 . 0 0 "[ . 1 . 2]" 1
9 1 3 LEU MD1 1 4 ARG H 3.850 . 3.850 2.696 2.260 3.095 . 0 0 "[ . 1 . 2]" 1
10 1 3 LEU MD1 1 4 ARG QD 5.190 . 5.190 4.385 3.377 5.387 0.197 20 0 "[ . 1 . 2]" 1
11 1 3 LEU MD1 1 26 ALA MB 3.380 . 3.380 2.032 1.894 2.157 . 0 0 "[ . 1 . 2]" 1
12 1 3 LEU MD2 1 4 ARG H 4.780 . 4.780 4.787 4.526 4.871 0.091 16 0 "[ . 1 . 2]" 1
13 1 3 LEU MD2 1 14 VAL MG1 2.660 . 2.660 2.067 1.942 2.200 . 0 0 "[ . 1 . 2]" 1
14 1 3 LEU MD2 1 16 PRO HA 3.510 . 3.510 2.385 2.018 2.973 . 0 0 "[ . 1 . 2]" 1
15 1 3 LEU MD2 1 16 PRO HB2 5.020 . 5.020 4.469 3.998 4.944 . 0 0 "[ . 1 . 2]" 1
16 1 3 LEU MD2 1 16 PRO HB3 3.810 . 3.810 3.414 2.830 3.838 0.028 16 0 "[ . 1 . 2]" 1
17 1 3 LEU MD2 1 26 ALA HA 5.430 . 5.430 4.945 4.319 5.501 0.071 1 0 "[ . 1 . 2]" 1
18 1 3 LEU MD2 1 26 ALA MB 4.070 . 4.070 2.785 2.168 3.330 . 0 0 "[ . 1 . 2]" 1
19 1 3 LEU HG 1 4 ARG H 3.540 . 3.540 3.479 3.100 3.582 0.042 17 0 "[ . 1 . 2]" 1
20 1 3 LEU HG 1 5 CYS HA 5.500 . 5.500 5.192 4.868 5.496 . 0 0 "[ . 1 . 2]" 1
21 1 3 LEU HG 1 14 VAL MG2 4.210 . 4.210 3.307 3.067 3.561 . 0 0 "[ . 1 . 2]" 1
22 1 3 LEU HG 1 19 VAL QG 3.640 . 3.640 3.505 3.151 3.706 0.066 17 0 "[ . 1 . 2]" 1
23 1 3 LEU HG 1 26 ALA MB 4.250 . 4.250 2.959 2.437 3.506 . 0 0 "[ . 1 . 2]" 1
24 1 4 ARG H 1 4 ARG HB2 4.070 . 4.070 3.293 2.450 3.911 . 0 0 "[ . 1 . 2]" 1
25 1 4 ARG H 1 4 ARG QB 3.490 . 3.490 2.788 2.415 3.157 . 0 0 "[ . 1 . 2]" 1
26 1 4 ARG H 1 4 ARG HB3 4.070 . 4.070 3.342 2.777 3.824 . 0 0 "[ . 1 . 2]" 1
27 1 4 ARG H 1 4 ARG QD 4.750 . 4.750 2.597 1.667 3.828 . 0 0 "[ . 1 . 2]" 1
28 1 4 ARG H 1 4 ARG QG 4.060 . 4.060 2.852 1.882 4.064 0.004 1 0 "[ . 1 . 2]" 1
29 1 4 ARG H 1 5 CYS H 4.540 . 4.540 4.473 4.397 4.542 0.002 18 0 "[ . 1 . 2]" 1
30 1 4 ARG H 1 5 CYS HA 5.190 . 5.190 5.125 4.892 5.286 0.096 13 0 "[ . 1 . 2]" 1
31 1 4 ARG H 1 14 VAL MG2 5.030 . 5.030 4.151 3.915 4.330 . 0 0 "[ . 1 . 2]" 1
32 1 4 ARG HA 1 4 ARG QD 4.480 . 4.480 3.663 2.736 4.510 0.030 10 0 "[ . 1 . 2]" 1
33 1 4 ARG HA 1 4 ARG HG2 4.220 . 4.220 3.716 3.564 4.244 0.024 11 0 "[ . 1 . 2]" 1
34 1 4 ARG HA 1 4 ARG QG 3.610 . 3.610 3.013 2.292 3.482 . 0 0 "[ . 1 . 2]" 1
35 1 4 ARG HA 1 4 ARG HG3 4.220 . 4.220 3.373 2.319 4.258 0.038 14 0 "[ . 1 . 2]" 1
36 1 4 ARG HA 1 5 CYS H 2.690 . 2.690 2.425 2.327 2.509 . 0 0 "[ . 1 . 2]" 1
37 1 4 ARG HA 1 5 CYS HA 5.250 . 5.250 4.278 4.231 4.386 . 0 0 "[ . 1 . 2]" 1
38 1 4 ARG HA 1 5 CYS QB 4.790 . 4.790 4.136 4.050 4.227 . 0 0 "[ . 1 . 2]" 1
39 1 4 ARG HA 1 14 VAL H 4.050 . 4.050 3.632 2.520 4.221 0.171 8 0 "[ . 1 . 2]" 1
40 1 4 ARG HA 1 14 VAL HB 4.200 . 4.200 3.394 2.859 3.862 . 0 0 "[ . 1 . 2]" 1
41 1 4 ARG HA 1 14 VAL MG2 4.280 . 4.280 2.800 2.528 3.129 . 0 0 "[ . 1 . 2]" 1
42 1 4 ARG QB 1 4 ARG QD 3.140 . 3.140 2.359 2.066 2.772 . 0 0 "[ . 1 . 2]" 1
43 1 4 ARG QB 1 5 CYS H 3.290 . 3.290 2.336 2.195 2.609 . 0 0 "[ . 1 . 2]" 1
44 1 4 ARG QB 1 5 CYS QB 4.830 . 4.830 3.973 3.768 4.294 . 0 0 "[ . 1 . 2]" 1
45 1 4 ARG HB2 1 4 ARG QD 3.600 . 3.600 2.774 2.229 3.524 . 0 0 "[ . 1 . 2]" 1
46 1 4 ARG HB2 1 5 CYS H 4.020 . 4.020 2.853 2.214 3.726 . 0 0 "[ . 1 . 2]" 1
47 1 4 ARG HB3 1 4 ARG QD 3.600 . 3.600 2.903 2.175 3.521 . 0 0 "[ . 1 . 2]" 1
48 1 4 ARG HB3 1 5 CYS H 4.020 . 4.020 3.166 2.232 3.935 . 0 0 "[ . 1 . 2]" 1
49 1 4 ARG QD 1 5 CYS H 5.440 . 5.440 4.687 3.312 5.124 . 0 0 "[ . 1 . 2]" 1
50 1 4 ARG QG 1 5 CYS H 4.280 . 4.280 3.632 3.083 4.294 0.014 11 0 "[ . 1 . 2]" 1
51 1 5 CYS H 1 5 CYS QB 2.630 . 2.630 2.244 2.195 2.295 . 0 0 "[ . 1 . 2]" 1
52 1 5 CYS H 1 6 GLY H 4.650 . 4.650 4.581 4.512 4.633 . 0 0 "[ . 1 . 2]" 1
53 1 5 CYS H 1 12 CYS H 4.450 . 4.450 3.246 2.804 3.914 . 0 0 "[ . 1 . 2]" 1
54 1 5 CYS H 1 14 VAL H 4.970 . 4.970 4.785 3.699 5.008 0.038 15 0 "[ . 1 . 2]" 1
55 1 5 CYS H 1 14 VAL MG2 3.380 . 3.380 2.706 2.547 2.842 . 0 0 "[ . 1 . 2]" 1
56 1 5 CYS H 1 27 TYR HA 5.480 . 5.480 5.140 4.943 5.309 . 0 0 "[ . 1 . 2]" 1
57 1 5 CYS H 1 28 CYS H 5.230 . 5.230 5.289 5.218 5.379 0.149 17 0 "[ . 1 . 2]" 1
58 1 5 CYS H 1 28 CYS HB3 5.110 . 5.110 4.975 4.690 5.220 0.110 8 0 "[ . 1 . 2]" 1
59 1 5 CYS HA 1 6 GLY H 2.670 . 2.670 2.242 2.181 2.342 . 0 0 "[ . 1 . 2]" 1
60 1 5 CYS HA 1 14 VAL MG2 3.020 . 3.020 2.174 1.952 2.354 . 0 0 "[ . 1 . 2]" 1
61 1 5 CYS HA 1 26 ALA MB 4.940 . 4.940 4.106 3.893 4.283 . 0 0 "[ . 1 . 2]" 1
62 1 5 CYS HA 1 27 TYR HA 3.350 . 3.350 2.346 2.125 2.499 . 0 0 "[ . 1 . 2]" 1
63 1 5 CYS HA 1 27 TYR HB3 5.500 . 5.500 4.578 4.380 4.717 . 0 0 "[ . 1 . 2]" 1
64 1 5 CYS HA 1 27 TYR QD 4.360 . 4.360 4.228 3.954 4.429 0.069 13 0 "[ . 1 . 2]" 1
65 1 5 CYS HA 1 28 CYS H 3.500 . 3.500 3.274 3.056 3.456 . 0 0 "[ . 1 . 2]" 1
66 1 5 CYS HA 1 28 CYS HB3 4.950 . 4.950 4.307 3.950 4.530 . 0 0 "[ . 1 . 2]" 1
67 1 5 CYS QB 1 6 GLY H 4.550 . 4.550 3.483 3.300 3.658 . 0 0 "[ . 1 . 2]" 1
68 1 5 CYS QB 1 12 CYS H 5.040 . 5.040 2.279 1.778 2.928 . 0 0 "[ . 1 . 2]" 1
69 1 5 CYS QB 1 14 VAL H 5.250 . 5.250 4.952 4.284 5.262 0.012 20 0 "[ . 1 . 2]" 1
70 1 5 CYS QB 1 14 VAL MG1 4.810 . 4.810 4.686 4.473 4.848 0.038 11 0 "[ . 1 . 2]" 1
71 1 5 CYS QB 1 14 VAL MG2 3.410 . 3.410 2.491 2.324 2.618 . 0 0 "[ . 1 . 2]" 1
72 1 5 CYS QB 1 27 TYR HA 4.510 . 4.510 3.769 3.542 4.071 . 0 0 "[ . 1 . 2]" 1
73 1 5 CYS QB 1 27 TYR QD 4.820 . 4.820 4.444 4.105 4.850 0.030 1 0 "[ . 1 . 2]" 1
74 1 5 CYS QB 1 28 CYS H 4.150 . 4.150 3.197 3.029 3.396 . 0 0 "[ . 1 . 2]" 1
75 1 5 CYS QB 1 28 CYS HB3 3.490 . 3.490 2.908 2.729 3.236 . 0 0 "[ . 1 . 2]" 1
76 1 6 GLY H 1 6 GLY HA3 2.870 . 2.870 2.278 2.265 2.297 . 0 0 "[ . 1 . 2]" 1
77 1 6 GLY H 1 7 CYS H 3.450 . 3.450 2.535 2.307 2.758 . 0 0 "[ . 1 . 2]" 1
78 1 6 GLY H 1 14 VAL MG1 5.500 . 5.500 5.295 5.027 5.481 . 0 0 "[ . 1 . 2]" 1
79 1 6 GLY H 1 14 VAL MG2 4.150 . 4.150 3.981 3.692 4.198 0.048 4 0 "[ . 1 . 2]" 1
80 1 6 GLY H 1 25 GLU QG 4.720 . 4.720 3.521 3.207 3.893 . 0 0 "[ . 1 . 2]" 1
81 1 6 GLY H 1 26 ALA MB 4.640 . 4.640 4.455 4.313 4.643 0.003 19 0 "[ . 1 . 2]" 1
82 1 6 GLY H 1 27 TYR HA 2.940 . 2.940 2.240 1.998 2.397 . 0 0 "[ . 1 . 2]" 1
83 1 6 GLY H 1 27 TYR QD 3.680 . 3.680 2.673 2.408 3.026 . 0 0 "[ . 1 . 2]" 1
84 1 6 GLY H 1 27 TYR QE 4.360 . 4.360 3.699 3.390 4.002 . 0 0 "[ . 1 . 2]" 1
85 1 6 GLY H 1 28 CYS H 4.000 . 4.000 3.961 3.575 4.161 0.161 3 0 "[ . 1 . 2]" 1
86 1 6 GLY H 1 33 ALA HA 5.410 . 5.410 5.493 5.265 5.631 0.221 11 0 "[ . 1 . 2]" 1
87 1 6 GLY HA2 1 8 PRO HD3 4.690 . 4.690 4.833 4.726 4.967 0.277 4 0 "[ . 1 . 2]" 1
88 1 6 GLY HA2 1 25 GLU QG 3.840 . 3.840 2.666 2.175 2.986 . 0 0 "[ . 1 . 2]" 1
89 1 6 GLY HA2 1 26 ALA MB 5.500 . 5.500 5.145 4.937 5.431 . 0 0 "[ . 1 . 2]" 1
90 1 6 GLY HA3 1 7 CYS H 2.820 . 2.820 2.984 2.847 3.136 0.316 12 0 "[ . 1 . 2]" 1
91 1 6 GLY HA3 1 25 GLU QB 3.920 . 3.920 3.670 3.343 3.972 0.052 17 0 "[ . 1 . 2]" 1
92 1 6 GLY HA3 1 25 GLU QG 4.990 . 4.990 2.253 1.866 2.796 . 0 0 "[ . 1 . 2]" 1
93 1 6 GLY HA3 1 27 TYR HB3 5.500 . 5.500 5.240 4.919 5.396 . 0 0 "[ . 1 . 2]" 1
94 1 6 GLY HA3 1 27 TYR QD 4.050 . 4.050 3.326 3.067 3.665 . 0 0 "[ . 1 . 2]" 1
95 1 7 CYS H 1 7 CYS HB2 2.770 . 2.770 2.139 2.040 2.309 . 0 0 "[ . 1 . 2]" 1
96 1 7 CYS H 1 7 CYS HB3 3.460 . 3.460 3.070 2.736 3.422 . 0 0 "[ . 1 . 2]" 1
97 1 7 CYS H 1 8 PRO HD3 5.060 . 5.060 4.415 4.164 4.622 . 0 0 "[ . 1 . 2]" 1
98 1 7 CYS H 1 25 GLU QG 5.500 . 5.500 4.919 4.522 5.384 . 0 0 "[ . 1 . 2]" 1
99 1 7 CYS H 1 27 TYR HA 4.520 . 4.520 4.192 3.975 4.388 . 0 0 "[ . 1 . 2]" 1
100 1 7 CYS H 1 27 TYR QD 3.110 . 3.110 2.677 2.381 3.067 . 0 0 "[ . 1 . 2]" 1
101 1 7 CYS H 1 27 TYR QE 3.890 . 3.890 3.085 2.745 3.406 . 0 0 "[ . 1 . 2]" 1
102 1 7 CYS H 1 32 CYS HB3 4.400 . 4.400 3.118 2.889 3.347 . 0 0 "[ . 1 . 2]" 1
103 1 7 CYS HA 1 8 PRO HD2 3.100 . 3.100 2.152 1.873 2.577 . 0 0 "[ . 1 . 2]" 1
104 1 7 CYS HA 1 8 PRO HD3 2.830 . 2.830 2.266 1.915 2.465 . 0 0 "[ . 1 . 2]" 1
105 1 7 CYS HA 1 8 PRO QG 4.420 . 4.420 3.826 3.730 3.899 . 0 0 "[ . 1 . 2]" 1
106 1 7 CYS HA 1 27 TYR QD 4.930 . 4.930 4.356 3.824 4.905 . 0 0 "[ . 1 . 2]" 1
107 1 7 CYS HA 1 27 TYR QE 4.150 . 4.150 3.255 2.673 3.842 . 0 0 "[ . 1 . 2]" 1
108 1 7 CYS HB2 1 9 ASP H 5.020 . 5.020 4.781 4.483 5.110 0.090 17 0 "[ . 1 . 2]" 1
109 1 7 CYS HB2 1 27 TYR QD 3.580 . 3.580 3.355 2.886 3.718 0.138 15 0 "[ . 1 . 2]" 1
110 1 7 CYS HB2 1 27 TYR QE 4.480 . 4.480 3.986 3.524 4.331 . 0 0 "[ . 1 . 2]" 1
111 1 7 CYS HB2 1 32 CYS HA 4.560 . 4.560 4.043 3.536 4.618 0.058 3 0 "[ . 1 . 2]" 1
112 1 7 CYS HB2 1 32 CYS HB2 4.290 . 4.290 3.460 3.254 3.846 . 0 0 "[ . 1 . 2]" 1
113 1 7 CYS HB2 1 32 CYS HB3 3.010 . 3.010 2.050 1.794 2.533 . 0 0 "[ . 1 . 2]" 1
114 1 7 CYS HB3 1 9 ASP H 3.510 . 3.510 3.450 3.120 3.577 0.067 17 0 "[ . 1 . 2]" 1
115 1 7 CYS HB3 1 10 CYS HB2 3.660 . 3.660 3.328 2.757 3.571 . 0 0 "[ . 1 . 2]" 1
116 1 7 CYS HB3 1 10 CYS QB 3.200 . 3.200 2.197 1.927 2.438 . 0 0 "[ . 1 . 2]" 1
117 1 7 CYS HB3 1 10 CYS HB3 3.660 . 3.660 2.233 1.950 2.507 . 0 0 "[ . 1 . 2]" 1
118 1 7 CYS HB3 1 27 TYR QD 5.350 . 5.350 4.979 4.290 5.377 0.027 17 0 "[ . 1 . 2]" 1
119 1 7 CYS HB3 1 27 TYR QE 5.440 . 5.440 5.255 4.801 5.521 0.081 17 0 "[ . 1 . 2]" 1
120 1 7 CYS HB3 1 32 CYS HB3 3.810 . 3.810 3.686 3.443 3.987 0.177 17 0 "[ . 1 . 2]" 1
121 1 8 PRO HA 1 10 CYS H 3.940 . 3.940 3.962 3.775 4.120 0.180 4 0 "[ . 1 . 2]" 1
122 1 8 PRO HB2 1 9 ASP HA 4.330 . 4.330 4.226 4.055 4.344 0.014 1 0 "[ . 1 . 2]" 1
123 1 8 PRO HB2 1 10 CYS H 5.500 . 5.500 5.221 5.036 5.463 . 0 0 "[ . 1 . 2]" 1
124 1 8 PRO QG 1 9 ASP H 4.460 . 4.460 3.079 2.499 4.034 . 0 0 "[ . 1 . 2]" 1
125 1 9 ASP H 1 9 ASP QB 3.290 . 3.290 2.435 2.261 2.754 . 0 0 "[ . 1 . 2]" 1
126 1 9 ASP H 1 10 CYS H 3.180 . 3.180 2.231 2.061 2.377 . 0 0 "[ . 1 . 2]" 1
127 1 9 ASP H 1 10 CYS QB 4.560 . 4.560 3.952 3.847 4.102 . 0 0 "[ . 1 . 2]" 1
128 1 9 ASP QB 1 10 CYS H 3.860 . 3.860 3.377 3.102 3.905 0.045 15 0 "[ . 1 . 2]" 1
129 1 10 CYS H 1 10 CYS HB2 3.520 . 3.520 3.044 2.707 3.224 . 0 0 "[ . 1 . 2]" 1
130 1 10 CYS H 1 10 CYS HB3 3.520 . 3.520 2.893 2.658 3.105 . 0 0 "[ . 1 . 2]" 1
131 1 10 CYS HA 1 48 HIS QB 5.050 . 5.050 2.772 1.969 4.056 . 0 0 "[ . 1 . 2]" 1
132 1 10 CYS QB 1 48 HIS QB 5.150 . 5.150 3.552 2.942 4.627 . 0 0 "[ . 1 . 2]" 1
133 1 11 HIS H 1 11 HIS HD2 5.500 . 5.500 4.138 2.172 5.400 . 0 0 "[ . 1 . 2]" 1
134 1 11 HIS H 1 12 CYS H 4.900 . 4.900 3.961 3.882 4.158 . 0 0 "[ . 1 . 2]" 1
135 1 12 CYS H 1 12 CYS HB2 3.160 . 3.160 2.758 2.649 2.966 . 0 0 "[ . 1 . 2]" 1
136 1 12 CYS H 1 12 CYS HB3 3.730 . 3.730 3.685 3.534 3.765 0.035 20 0 "[ . 1 . 2]" 1
137 1 12 CYS H 1 44 ALA MB 4.840 . 4.840 4.239 3.946 4.528 . 0 0 "[ . 1 . 2]" 1
138 1 12 CYS HA 1 13 LYS H 2.680 . 2.680 2.315 2.193 2.459 . 0 0 "[ . 1 . 2]" 1
139 1 12 CYS HA 1 44 ALA MB 3.380 . 3.380 2.503 2.021 3.173 . 0 0 "[ . 1 . 2]" 1
140 1 12 CYS HB2 1 13 LYS H 4.710 . 4.710 3.465 3.099 4.012 . 0 0 "[ . 1 . 2]" 1
141 1 12 CYS HB2 1 28 CYS HB3 4.240 . 4.240 2.102 1.899 2.564 . 0 0 "[ . 1 . 2]" 1
142 1 12 CYS HB2 1 44 ALA MB 4.070 . 4.070 3.617 3.330 4.011 . 0 0 "[ . 1 . 2]" 1
143 1 12 CYS HB3 1 13 LYS H 5.180 . 5.180 2.761 2.254 3.455 . 0 0 "[ . 1 . 2]" 1
144 1 12 CYS HB3 1 44 ALA H 5.400 . 5.400 4.535 4.140 5.083 . 0 0 "[ . 1 . 2]" 1
145 1 12 CYS HB3 1 44 ALA HA 4.990 . 4.990 3.548 2.738 4.253 . 0 0 "[ . 1 . 2]" 1
146 1 12 CYS HB3 1 44 ALA MB 3.590 . 3.590 2.300 1.879 2.997 . 0 0 "[ . 1 . 2]" 1
147 1 13 LYS H 1 13 LYS QB 2.810 . 2.810 2.653 2.094 2.924 0.114 6 0 "[ . 1 . 2]" 1
148 1 13 LYS H 1 13 LYS QE 4.890 . 4.890 4.483 4.069 4.844 . 0 0 "[ . 1 . 2]" 1
149 1 13 LYS H 1 13 LYS HG2 3.760 . 3.760 2.927 2.038 4.191 0.431 12 0 "[ . 1 . 2]" 1
150 1 13 LYS H 1 13 LYS HG3 3.760 . 3.760 2.618 1.669 4.209 0.449 12 0 "[ . 1 . 2]" 1
151 1 13 LYS H 1 14 VAL H 4.700 . 4.700 4.407 4.219 4.591 . 0 0 "[ . 1 . 2]" 1
152 1 13 LYS H 1 14 VAL MG2 5.500 . 5.500 4.440 4.192 4.694 . 0 0 "[ . 1 . 2]" 1
153 1 13 LYS HA 1 13 LYS QD 4.330 . 4.330 4.166 3.590 4.492 0.162 9 0 "[ . 1 . 2]" 1
154 1 13 LYS HA 1 13 LYS QE 4.500 . 4.500 4.062 2.342 4.301 . 0 0 "[ . 1 . 2]" 1
155 1 13 LYS HA 1 14 VAL H 2.470 . 2.470 2.153 2.080 2.231 . 0 0 "[ . 1 . 2]" 1
156 1 13 LYS HA 1 14 VAL HA 4.880 . 4.880 4.355 4.311 4.398 . 0 0 "[ . 1 . 2]" 1
157 1 13 LYS QE 1 14 VAL H 4.660 . 4.660 4.359 2.709 4.784 0.124 10 0 "[ . 1 . 2]" 1
158 1 13 LYS QE 1 14 VAL HA 5.080 . 5.080 4.568 3.811 5.342 0.262 16 0 "[ . 1 . 2]" 1
159 1 13 LYS QE 1 15 ASP H 5.330 . 5.330 4.702 3.605 5.373 0.043 2 0 "[ . 1 . 2]" 1
160 1 13 LYS QE 1 15 ASP HB2 4.320 . 4.320 3.935 3.011 4.450 0.130 19 0 "[ . 1 . 2]" 1
161 1 13 LYS QG 1 14 VAL H 4.710 . 4.710 4.254 2.641 4.862 0.152 1 0 "[ . 1 . 2]" 1
162 1 14 VAL H 1 14 VAL HB 2.750 . 2.750 2.590 2.445 2.684 . 0 0 "[ . 1 . 2]" 1
163 1 14 VAL H 1 14 VAL MG1 3.950 . 3.950 3.821 3.746 3.864 . 0 0 "[ . 1 . 2]" 1
164 1 14 VAL H 1 14 VAL MG2 3.000 . 3.000 2.551 2.275 2.769 . 0 0 "[ . 1 . 2]" 1
165 1 14 VAL HA 1 14 VAL MG1 2.990 . 2.990 2.394 2.335 2.458 . 0 0 "[ . 1 . 2]" 1
166 1 14 VAL HA 1 14 VAL MG2 3.310 . 3.310 2.368 2.312 2.411 . 0 0 "[ . 1 . 2]" 1
167 1 14 VAL HA 1 15 ASP H 2.540 . 2.540 2.117 2.019 2.190 . 0 0 "[ . 1 . 2]" 1
168 1 14 VAL HA 1 15 ASP HB3 5.500 . 5.500 4.653 4.442 4.821 . 0 0 "[ . 1 . 2]" 1
169 1 14 VAL HA 1 28 CYS HA 3.300 . 3.300 2.711 2.183 3.102 . 0 0 "[ . 1 . 2]" 1
170 1 14 VAL HA 1 28 CYS HB2 4.410 . 4.410 3.693 3.299 4.166 . 0 0 "[ . 1 . 2]" 1
171 1 14 VAL HB 1 15 ASP H 4.100 . 4.100 4.090 3.939 4.237 0.137 16 0 "[ . 1 . 2]" 1
172 1 14 VAL MG1 1 15 ASP H 3.190 . 3.190 2.546 2.329 2.861 . 0 0 "[ . 1 . 2]" 1
173 1 14 VAL MG1 1 19 VAL QG 3.570 . 3.570 2.105 1.979 2.309 . 0 0 "[ . 1 . 2]" 1
174 1 14 VAL MG1 1 26 ALA MB 3.520 . 3.520 2.577 2.243 2.995 . 0 0 "[ . 1 . 2]" 1
175 1 14 VAL MG1 1 28 CYS HA 3.430 . 3.430 2.531 2.245 2.770 . 0 0 "[ . 1 . 2]" 1
176 1 14 VAL MG1 1 28 CYS HB2 4.870 . 4.870 4.544 4.297 4.805 . 0 0 "[ . 1 . 2]" 1
177 1 14 VAL MG1 1 28 CYS HB3 4.420 . 4.420 4.106 3.893 4.344 . 0 0 "[ . 1 . 2]" 1
178 1 14 VAL MG2 1 15 ASP H 3.910 . 3.910 3.927 3.812 4.008 0.098 17 0 "[ . 1 . 2]" 1
179 1 14 VAL MG2 1 26 ALA MB 3.740 . 3.740 3.533 3.252 3.828 0.088 10 0 "[ . 1 . 2]" 1
180 1 14 VAL MG2 1 27 TYR HA 4.030 . 4.030 3.108 2.636 3.382 . 0 0 "[ . 1 . 2]" 1
181 1 14 VAL MG2 1 28 CYS H 3.540 . 3.540 2.765 2.523 2.961 . 0 0 "[ . 1 . 2]" 1
182 1 14 VAL MG2 1 28 CYS HA 3.240 . 3.240 2.231 2.084 2.457 . 0 0 "[ . 1 . 2]" 1
183 1 14 VAL MG2 1 28 CYS HB2 4.020 . 4.020 3.412 3.291 3.612 . 0 0 "[ . 1 . 2]" 1
184 1 14 VAL MG2 1 28 CYS HB3 3.450 . 3.450 2.292 2.177 2.488 . 0 0 "[ . 1 . 2]" 1
185 1 14 VAL MG2 1 29 SER H 5.180 . 5.180 4.571 4.343 4.789 . 0 0 "[ . 1 . 2]" 1
186 1 15 ASP H 1 15 ASP HB2 2.980 . 2.980 2.651 2.485 3.002 0.022 19 0 "[ . 1 . 2]" 1
187 1 15 ASP H 1 15 ASP HB3 3.290 . 3.290 2.590 2.466 2.735 . 0 0 "[ . 1 . 2]" 1
188 1 15 ASP H 1 16 PRO QD 5.010 . 5.010 4.294 4.178 4.380 . 0 0 "[ . 1 . 2]" 1
189 1 15 ASP H 1 18 ARG H 5.040 . 5.040 4.185 3.787 4.652 . 0 0 "[ . 1 . 2]" 1
190 1 15 ASP H 1 18 ARG QB 4.800 . 4.800 3.771 3.270 4.285 . 0 0 "[ . 1 . 2]" 1
191 1 15 ASP H 1 18 ARG QD 5.500 . 5.500 5.145 4.608 5.613 0.113 4 0 "[ . 1 . 2]" 1
192 1 15 ASP H 1 28 CYS HA 4.010 . 4.010 3.753 3.258 4.057 0.047 7 0 "[ . 1 . 2]" 1
193 1 15 ASP HA 1 16 PRO HA 4.430 . 4.430 4.447 4.412 4.478 0.048 1 0 "[ . 1 . 2]" 1
194 1 15 ASP HA 1 16 PRO QD 2.880 . 2.880 1.901 1.840 2.004 . 0 0 "[ . 1 . 2]" 1
195 1 15 ASP HA 1 18 ARG H 4.270 . 4.270 4.269 4.050 4.406 0.136 16 0 "[ . 1 . 2]" 1
196 1 15 ASP HB2 1 16 PRO QD 4.900 . 4.900 3.864 3.676 4.029 . 0 0 "[ . 1 . 2]" 1
197 1 15 ASP HB2 1 18 ARG H 4.670 . 4.670 3.931 3.626 4.222 . 0 0 "[ . 1 . 2]" 1
198 1 15 ASP HB2 1 18 ARG QB 4.520 . 4.520 3.150 2.682 3.869 . 0 0 "[ . 1 . 2]" 1
199 1 15 ASP HB2 1 18 ARG HG3 5.420 . 5.420 5.094 3.995 5.609 0.189 8 0 "[ . 1 . 2]" 1
200 1 15 ASP HB2 1 19 VAL QG 5.440 . 5.440 5.609 5.533 5.716 0.276 11 0 "[ . 1 . 2]" 1
201 1 15 ASP HB3 1 17 GLU H 3.670 . 3.670 3.374 3.060 3.690 0.020 20 0 "[ . 1 . 2]" 1
202 1 15 ASP HB3 1 18 ARG H 3.480 . 3.480 2.291 1.926 2.578 . 0 0 "[ . 1 . 2]" 1
203 1 15 ASP HB3 1 18 ARG QB 3.910 . 3.910 2.014 1.835 2.689 . 0 0 "[ . 1 . 2]" 1
204 1 15 ASP HB3 1 19 VAL HA 5.500 . 5.500 4.752 3.842 5.495 . 0 0 "[ . 1 . 2]" 1
205 1 15 ASP HB3 1 19 VAL QG 4.690 . 4.690 4.542 4.405 4.698 0.008 16 0 "[ . 1 . 2]" 1
206 1 16 PRO HA 1 17 GLU HA 4.610 . 4.610 4.598 4.542 4.670 0.060 3 0 "[ . 1 . 2]" 1
207 1 16 PRO HA 1 18 ARG H 4.280 . 4.280 4.342 3.977 4.506 0.226 13 0 "[ . 1 . 2]" 1
208 1 16 PRO HA 1 19 VAL H 5.370 . 5.370 4.707 3.923 5.369 . 0 0 "[ . 1 . 2]" 1
209 1 16 PRO HA 1 19 VAL HB 4.490 . 4.490 3.597 3.179 3.991 . 0 0 "[ . 1 . 2]" 1
210 1 16 PRO HA 1 19 VAL QG 3.380 . 3.380 2.727 2.126 3.381 0.001 4 0 "[ . 1 . 2]" 1
211 1 16 PRO HB2 1 17 GLU H 3.660 . 3.660 3.147 2.827 3.603 . 0 0 "[ . 1 . 2]" 1
212 1 16 PRO QD 1 17 GLU H 4.810 . 4.810 2.806 2.653 2.962 . 0 0 "[ . 1 . 2]" 1
213 1 16 PRO QG 1 17 GLU H 5.190 . 5.190 3.751 2.639 4.088 . 0 0 "[ . 1 . 2]" 1
214 1 17 GLU H 1 17 GLU HB2 3.250 . 3.250 2.811 2.601 3.005 . 0 0 "[ . 1 . 2]" 1
215 1 17 GLU H 1 17 GLU HB3 2.860 . 2.860 2.487 2.376 2.628 . 0 0 "[ . 1 . 2]" 1
216 1 17 GLU H 1 17 GLU QG 4.400 . 4.400 4.011 3.945 4.119 . 0 0 "[ . 1 . 2]" 1
217 1 17 GLU H 1 18 ARG H 2.800 . 2.800 2.123 1.973 2.359 . 0 0 "[ . 1 . 2]" 1
218 1 17 GLU H 1 18 ARG HG3 4.960 . 4.960 4.377 3.671 5.185 0.225 4 0 "[ . 1 . 2]" 1
219 1 17 GLU H 1 19 VAL H 5.240 . 5.240 4.369 3.681 5.146 . 0 0 "[ . 1 . 2]" 1
220 1 17 GLU H 1 19 VAL QG 4.470 . 4.470 3.919 3.625 4.211 . 0 0 "[ . 1 . 2]" 1
221 1 17 GLU HA 1 17 GLU HG2 3.840 . 3.840 3.352 3.008 3.832 . 0 0 "[ . 1 . 2]" 1
222 1 17 GLU HA 1 17 GLU QG 3.300 . 3.300 2.646 2.377 2.970 . 0 0 "[ . 1 . 2]" 1
223 1 17 GLU HA 1 17 GLU HG3 3.840 . 3.840 2.775 2.491 3.105 . 0 0 "[ . 1 . 2]" 1
224 1 17 GLU HA 1 19 VAL QG 4.280 . 4.280 3.740 3.441 4.188 . 0 0 "[ . 1 . 2]" 1
225 1 17 GLU HB3 1 18 ARG H 3.770 . 3.770 3.044 2.916 3.359 . 0 0 "[ . 1 . 2]" 1
226 1 17 GLU QG 1 18 ARG QB 5.180 . 5.180 4.625 4.251 4.952 . 0 0 "[ . 1 . 2]" 1
227 1 17 GLU QG 1 18 ARG QD 4.560 . 4.560 3.958 2.519 4.807 0.247 11 0 "[ . 1 . 2]" 1
228 1 17 GLU QG 1 18 ARG HG2 4.730 . 4.730 4.049 3.123 4.803 0.073 10 0 "[ . 1 . 2]" 1
229 1 18 ARG H 1 18 ARG QB 3.590 . 3.590 2.602 2.421 2.738 . 0 0 "[ . 1 . 2]" 1
230 1 18 ARG H 1 18 ARG QD 5.180 . 5.180 3.354 2.330 4.212 . 0 0 "[ . 1 . 2]" 1
231 1 18 ARG H 1 19 VAL H 3.120 . 3.120 2.843 2.176 3.292 0.172 14 0 "[ . 1 . 2]" 1
232 1 18 ARG H 1 19 VAL HA 4.750 . 4.750 4.581 4.308 4.781 0.031 19 0 "[ . 1 . 2]" 1
233 1 18 ARG H 1 19 VAL HB 4.480 . 4.480 4.239 4.043 4.413 . 0 0 "[ . 1 . 2]" 1
234 1 18 ARG H 1 19 VAL QG 3.830 . 3.830 3.385 3.084 3.608 . 0 0 "[ . 1 . 2]" 1
235 1 18 ARG HA 1 18 ARG QD 4.630 . 4.630 3.888 3.293 4.217 . 0 0 "[ . 1 . 2]" 1
236 1 18 ARG HA 1 18 ARG HG3 3.280 . 3.280 2.718 2.273 3.236 . 0 0 "[ . 1 . 2]" 1
237 1 18 ARG HA 1 19 VAL H 2.790 . 2.790 2.663 2.291 3.010 0.220 5 0 "[ . 1 . 2]" 1
238 1 18 ARG QB 1 19 VAL HA 4.750 . 4.750 4.245 4.073 4.353 . 0 0 "[ . 1 . 2]" 1
239 1 18 ARG QD 1 19 VAL H 5.500 . 5.500 5.392 4.447 5.777 0.277 19 0 "[ . 1 . 2]" 1
240 1 19 VAL H 1 19 VAL HB 3.320 . 3.320 3.083 2.786 3.336 0.016 3 0 "[ . 1 . 2]" 1
241 1 19 VAL H 1 19 VAL MG1 3.940 . 3.940 1.948 1.804 2.125 . 0 0 "[ . 1 . 2]" 1
242 1 19 VAL H 1 19 VAL QG 2.800 . 2.800 1.941 1.800 2.115 . 0 0 "[ . 1 . 2]" 1
243 1 19 VAL H 1 19 VAL MG2 3.940 . 3.940 3.776 3.742 3.824 . 0 0 "[ . 1 . 2]" 1
244 1 19 VAL H 1 20 PHE H 4.850 . 4.850 4.442 4.284 4.544 . 0 0 "[ . 1 . 2]" 1
245 1 19 VAL HA 1 19 VAL MG1 3.390 . 3.390 3.198 3.181 3.205 . 0 0 "[ . 1 . 2]" 1
246 1 19 VAL HA 1 19 VAL QG 2.880 . 2.880 2.416 2.390 2.457 . 0 0 "[ . 1 . 2]" 1
247 1 19 VAL HA 1 19 VAL MG2 3.390 . 3.390 2.500 2.467 2.557 . 0 0 "[ . 1 . 2]" 1
248 1 19 VAL HA 1 20 PHE H 2.670 . 2.670 2.149 2.098 2.191 . 0 0 "[ . 1 . 2]" 1
249 1 19 VAL HB 1 20 PHE H 4.170 . 4.170 4.020 3.905 4.116 . 0 0 "[ . 1 . 2]" 1
250 1 19 VAL HB 1 27 TYR H 4.660 . 4.660 4.724 4.686 4.774 0.114 15 0 "[ . 1 . 2]" 1
251 1 19 VAL QG 1 20 PHE H 3.210 . 3.210 2.541 2.391 2.714 . 0 0 "[ . 1 . 2]" 1
252 1 19 VAL QG 1 20 PHE HA 3.920 . 3.920 3.498 3.384 3.658 . 0 0 "[ . 1 . 2]" 1
253 1 19 VAL QG 1 20 PHE HB3 4.720 . 4.720 4.589 4.152 4.749 0.029 10 0 "[ . 1 . 2]" 1
254 1 19 VAL QG 1 21 ASN HA 4.780 . 4.780 3.441 3.144 3.749 . 0 0 "[ . 1 . 2]" 1
255 1 19 VAL QG 1 21 ASN QB 4.750 . 4.750 3.270 2.864 3.574 . 0 0 "[ . 1 . 2]" 1
256 1 19 VAL QG 1 26 ALA HA 3.770 . 3.770 2.676 2.401 2.852 . 0 0 "[ . 1 . 2]" 1
257 1 19 VAL QG 1 27 TYR H 3.620 . 3.620 2.194 2.110 2.261 . 0 0 "[ . 1 . 2]" 1
258 1 19 VAL MG1 1 26 ALA MB 3.570 . 3.570 3.618 3.465 3.703 0.133 12 0 "[ . 1 . 2]" 1
259 1 19 VAL MG2 1 26 ALA MB 3.570 . 3.570 1.861 1.793 1.913 . 0 0 "[ . 1 . 2]" 1
260 1 20 PHE H 1 20 PHE HB2 3.190 . 3.190 2.288 2.172 2.357 . 0 0 "[ . 1 . 2]" 1
261 1 20 PHE H 1 20 PHE HB3 3.540 . 3.540 3.462 2.938 3.597 0.057 19 0 "[ . 1 . 2]" 1
262 1 20 PHE H 1 20 PHE HD1 3.790 . 3.790 3.145 2.545 4.019 0.229 4 0 "[ . 1 . 2]" 1
263 1 20 PHE H 1 26 ALA HA 5.240 . 5.240 4.867 4.647 5.069 . 0 0 "[ . 1 . 2]" 1
264 1 20 PHE H 1 27 TYR H 3.860 . 3.860 3.092 2.814 3.302 . 0 0 "[ . 1 . 2]" 1
265 1 20 PHE H 1 27 TYR HB2 5.170 . 5.170 3.580 3.362 3.844 . 0 0 "[ . 1 . 2]" 1
266 1 20 PHE H 1 28 CYS HA 4.970 . 4.970 4.132 3.647 4.492 . 0 0 "[ . 1 . 2]" 1
267 1 20 PHE H 1 29 SER H 5.440 . 5.440 4.673 4.417 4.944 . 0 0 "[ . 1 . 2]" 1
268 1 20 PHE HA 1 20 PHE HD1 3.960 . 3.960 3.814 3.252 4.105 0.145 16 0 "[ . 1 . 2]" 1
269 1 20 PHE HA 1 21 ASN HA 4.750 . 4.750 4.373 4.344 4.405 . 0 0 "[ . 1 . 2]" 1
270 1 20 PHE HA 1 33 ALA MB 5.040 . 5.040 4.696 4.431 5.055 0.015 3 0 "[ . 1 . 2]" 1
271 1 20 PHE HB2 1 20 PHE HD1 3.500 . 3.500 2.349 2.274 2.419 . 0 0 "[ . 1 . 2]" 1
272 1 20 PHE HB2 1 27 TYR HB2 3.920 . 3.920 2.750 2.318 3.407 . 0 0 "[ . 1 . 2]" 1
273 1 20 PHE HB2 1 27 TYR QD 5.080 . 5.080 4.290 3.982 5.086 0.006 17 0 "[ . 1 . 2]" 1
274 1 20 PHE HB2 1 29 SER HA 4.420 . 4.420 3.430 2.565 3.875 . 0 0 "[ . 1 . 2]" 1
275 1 20 PHE HB2 1 33 ALA MB 3.820 . 3.820 2.975 2.568 3.865 0.045 17 0 "[ . 1 . 2]" 1
276 1 20 PHE HB3 1 20 PHE HD1 3.560 . 3.560 3.590 3.494 3.642 0.082 1 0 "[ . 1 . 2]" 1
277 1 20 PHE HB3 1 27 TYR QD 3.980 . 3.980 3.933 3.485 4.078 0.098 3 0 "[ . 1 . 2]" 1
278 1 20 PHE HB3 1 29 SER HA 5.450 . 5.450 4.816 3.860 5.210 . 0 0 "[ . 1 . 2]" 1
279 1 20 PHE HB3 1 30 GLN HA 4.610 . 4.610 3.516 3.216 4.082 . 0 0 "[ . 1 . 2]" 1
280 1 20 PHE HB3 1 33 ALA MB 3.940 . 3.940 2.598 2.166 2.951 . 0 0 "[ . 1 . 2]" 1
281 1 20 PHE HD1 1 29 SER HA 4.000 . 4.000 2.148 1.889 2.751 . 0 0 "[ . 1 . 2]" 1
282 1 20 PHE HD1 1 30 GLN HA 4.350 . 4.350 4.236 3.915 4.475 0.125 7 0 "[ . 1 . 2]" 1
283 1 20 PHE HD1 1 30 GLN QB 4.770 . 4.770 4.258 3.753 4.836 0.066 7 0 "[ . 1 . 2]" 1
284 1 20 PHE HD1 1 30 GLN QG 5.500 . 5.500 5.445 4.752 5.692 0.192 20 0 "[ . 1 . 2]" 1
285 1 20 PHE HD2 1 30 GLN HA 5.500 . 5.500 4.199 3.416 5.520 0.020 16 0 "[ . 1 . 2]" 1
286 1 20 PHE QE 1 29 SER HA 4.400 . 4.400 3.213 2.580 4.406 0.006 4 0 "[ . 1 . 2]" 1
287 1 20 PHE QE 1 30 GLN HA 5.200 . 5.200 4.472 3.558 5.026 . 0 0 "[ . 1 . 2]" 1
288 1 20 PHE QE 1 30 GLN QB 4.220 . 4.220 3.254 2.600 3.825 . 0 0 "[ . 1 . 2]" 1
289 1 21 ASN H 1 33 ALA MB 5.010 . 5.010 4.943 4.287 5.067 0.057 11 0 "[ . 1 . 2]" 1
290 1 21 ASN HA 1 22 HIS HB2 5.370 . 5.370 4.581 4.435 4.798 . 0 0 "[ . 1 . 2]" 1
291 1 21 ASN HA 1 22 HIS QB 4.700 . 4.700 4.031 3.942 4.121 . 0 0 "[ . 1 . 2]" 1
292 1 21 ASN HA 1 22 HIS HB3 5.370 . 5.370 4.477 4.290 4.579 . 0 0 "[ . 1 . 2]" 1
293 1 21 ASN HA 1 26 ALA H 5.500 . 5.500 4.934 4.775 5.167 . 0 0 "[ . 1 . 2]" 1
294 1 21 ASN HA 1 26 ALA HA 3.550 . 3.550 2.615 2.249 2.998 . 0 0 "[ . 1 . 2]" 1
295 1 21 ASN HA 1 27 TYR H 4.330 . 4.330 3.495 3.215 3.660 . 0 0 "[ . 1 . 2]" 1
296 1 21 ASN HA 1 27 TYR HB2 5.500 . 5.500 4.694 4.509 4.939 . 0 0 "[ . 1 . 2]" 1
297 1 21 ASN HA 1 27 TYR QD 4.240 . 4.240 3.245 3.033 3.468 . 0 0 "[ . 1 . 2]" 1
298 1 21 ASN QB 1 22 HIS HA 5.000 . 5.000 4.366 4.175 4.529 . 0 0 "[ . 1 . 2]" 1
299 1 21 ASN QB 1 26 ALA HA 5.200 . 5.200 3.803 3.279 4.347 . 0 0 "[ . 1 . 2]" 1
300 1 21 ASN QD 1 22 HIS HA 3.300 . 3.300 3.366 3.227 3.442 0.142 13 0 "[ . 1 . 2]" 1
301 1 22 HIS HA 1 22 HIS HD2 4.550 . 4.550 4.378 4.096 4.607 0.057 13 0 "[ . 1 . 2]" 1
302 1 22 HIS HA 1 23 ASP HA 4.470 . 4.470 4.361 4.285 4.416 . 0 0 "[ . 1 . 2]" 1
303 1 22 HIS HA 1 23 ASP QB 5.160 . 5.160 4.193 4.120 4.274 . 0 0 "[ . 1 . 2]" 1
304 1 22 HIS HA 1 24 GLY H 3.660 . 3.660 3.456 3.339 3.643 . 0 0 "[ . 1 . 2]" 1
305 1 22 HIS HA 1 25 GLU H 4.630 . 4.630 4.431 4.156 4.645 0.015 12 0 "[ . 1 . 2]" 1
306 1 22 HIS HA 1 27 TYR QE 4.700 . 4.700 4.268 4.069 4.497 . 0 0 "[ . 1 . 2]" 1
307 1 22 HIS HA 1 33 ALA MB 4.850 . 4.850 4.638 4.320 5.023 0.173 12 0 "[ . 1 . 2]" 1
308 1 22 HIS QB 1 25 GLU QB 5.170 . 5.170 4.128 3.820 4.810 . 0 0 "[ . 1 . 2]" 1
309 1 22 HIS QB 1 27 TYR QD 3.940 . 3.940 2.734 2.490 2.975 . 0 0 "[ . 1 . 2]" 1
310 1 22 HIS QB 1 27 TYR QE 3.490 . 3.490 1.984 1.853 2.181 . 0 0 "[ . 1 . 2]" 1
311 1 22 HIS QB 1 33 ALA MB 3.460 . 3.460 2.289 1.978 2.737 . 0 0 "[ . 1 . 2]" 1
312 1 22 HIS QB 1 34 GLU HA 5.340 . 5.340 4.611 3.858 5.048 . 0 0 "[ . 1 . 2]" 1
313 1 22 HIS HB2 1 27 TYR QD 4.750 . 4.750 3.720 3.326 4.061 . 0 0 "[ . 1 . 2]" 1
314 1 22 HIS HB2 1 27 TYR QE 4.050 . 4.050 3.667 3.551 3.843 . 0 0 "[ . 1 . 2]" 1
315 1 22 HIS HB2 1 33 ALA MB 3.970 . 3.970 2.514 2.117 3.037 . 0 0 "[ . 1 . 2]" 1
316 1 22 HIS HB3 1 27 TYR QD 4.750 . 4.750 2.814 2.572 3.060 . 0 0 "[ . 1 . 2]" 1
317 1 22 HIS HB3 1 27 TYR QE 4.050 . 4.050 1.992 1.860 2.194 . 0 0 "[ . 1 . 2]" 1
318 1 22 HIS HB3 1 33 ALA MB 3.970 . 3.970 2.671 2.372 3.109 . 0 0 "[ . 1 . 2]" 1
319 1 22 HIS HD2 1 23 ASP QB 3.710 . 3.710 2.645 2.230 3.227 . 0 0 "[ . 1 . 2]" 1
320 1 22 HIS HD2 1 27 TYR QD 5.070 . 5.070 5.084 4.937 5.187 0.117 18 0 "[ . 1 . 2]" 1
321 1 22 HIS HD2 1 27 TYR QE 3.380 . 3.380 3.226 2.941 3.392 0.012 7 0 "[ . 1 . 2]" 1
322 1 22 HIS HD2 1 33 ALA MB 4.910 . 4.910 4.518 4.139 4.889 . 0 0 "[ . 1 . 2]" 1
323 1 23 ASP QB 1 27 TYR QE 4.490 . 4.490 3.740 3.352 4.433 . 0 0 "[ . 1 . 2]" 1
324 1 24 GLY H 1 25 GLU H 5.020 . 5.020 2.505 2.432 2.644 . 0 0 "[ . 1 . 2]" 1
325 1 25 GLU H 1 25 GLU HB2 2.910 . 2.910 2.748 2.592 2.977 0.067 15 0 "[ . 1 . 2]" 1
326 1 25 GLU H 1 25 GLU QG 4.090 . 4.090 4.064 4.024 4.146 0.056 15 0 "[ . 1 . 2]" 1
327 1 25 GLU H 1 26 ALA H 4.640 . 4.640 4.483 4.395 4.522 . 0 0 "[ . 1 . 2]" 1
328 1 25 GLU H 1 27 TYR QE 4.260 . 4.260 3.644 3.386 4.178 . 0 0 "[ . 1 . 2]" 1
329 1 25 GLU HA 1 25 GLU QG 3.530 . 3.530 2.556 2.281 3.021 . 0 0 "[ . 1 . 2]" 1
330 1 25 GLU HA 1 26 ALA H 2.620 . 2.620 2.326 2.260 2.414 . 0 0 "[ . 1 . 2]" 1
331 1 25 GLU QB 1 25 GLU QG 2.440 . 2.440 2.040 1.973 2.076 . 0 0 "[ . 1 . 2]" 1
332 1 25 GLU QB 1 27 TYR QE 3.760 . 3.760 2.468 1.974 3.128 . 0 0 "[ . 1 . 2]" 1
333 1 25 GLU HB3 1 26 ALA H 3.400 . 3.400 3.550 3.438 3.628 0.228 13 0 "[ . 1 . 2]" 1
334 1 25 GLU HB3 1 27 TYR QE 3.680 . 3.680 2.490 1.983 3.177 . 0 0 "[ . 1 . 2]" 1
335 1 25 GLU QG 1 26 ALA H 3.220 . 3.220 2.182 1.946 2.292 . 0 0 "[ . 1 . 2]" 1
336 1 25 GLU QG 1 26 ALA MB 5.280 . 5.280 3.738 3.439 3.881 . 0 0 "[ . 1 . 2]" 1
337 1 25 GLU QG 1 27 TYR QE 4.230 . 4.230 3.564 3.159 4.181 . 0 0 "[ . 1 . 2]" 1
338 1 26 ALA H 1 26 ALA MB 2.760 . 2.760 2.331 2.295 2.407 . 0 0 "[ . 1 . 2]" 1
339 1 26 ALA H 1 27 TYR HA 5.430 . 5.430 5.113 5.011 5.256 . 0 0 "[ . 1 . 2]" 1
340 1 26 ALA HA 1 27 TYR H 2.620 . 2.620 2.208 2.166 2.255 . 0 0 "[ . 1 . 2]" 1
341 1 26 ALA HA 1 27 TYR QD 4.770 . 4.770 3.543 3.343 3.741 . 0 0 "[ . 1 . 2]" 1
342 1 26 ALA MB 1 27 TYR H 3.310 . 3.310 2.883 2.733 3.035 . 0 0 "[ . 1 . 2]" 1
343 1 26 ALA MB 1 27 TYR HA 5.030 . 5.030 4.019 3.969 4.093 . 0 0 "[ . 1 . 2]" 1
344 1 26 ALA MB 1 27 TYR HB2 5.500 . 5.500 5.115 4.986 5.212 . 0 0 "[ . 1 . 2]" 1
345 1 27 TYR H 1 27 TYR HB2 3.120 . 3.120 2.714 2.602 2.775 . 0 0 "[ . 1 . 2]" 1
346 1 27 TYR H 1 27 TYR HB3 3.910 . 3.910 3.817 3.750 3.852 . 0 0 "[ . 1 . 2]" 1
347 1 27 TYR H 1 27 TYR QD 3.290 . 3.290 3.053 2.849 3.280 . 0 0 "[ . 1 . 2]" 1
348 1 27 TYR H 1 27 TYR QE 5.500 . 5.500 5.037 4.855 5.193 . 0 0 "[ . 1 . 2]" 1
349 1 27 TYR H 1 28 CYS H 5.110 . 5.110 4.419 4.380 4.462 . 0 0 "[ . 1 . 2]" 1
350 1 27 TYR H 1 29 SER H 5.470 . 5.470 5.409 5.283 5.501 0.031 19 0 "[ . 1 . 2]" 1
351 1 27 TYR HA 1 27 TYR QD 3.480 . 3.480 2.924 2.782 3.066 . 0 0 "[ . 1 . 2]" 1
352 1 27 TYR HA 1 28 CYS H 2.740 . 2.740 2.314 2.234 2.375 . 0 0 "[ . 1 . 2]" 1
353 1 27 TYR HA 1 28 CYS HA 4.540 . 4.540 4.320 4.298 4.345 . 0 0 "[ . 1 . 2]" 1
354 1 27 TYR HA 1 28 CYS HB3 5.180 . 5.180 4.519 4.454 4.609 . 0 0 "[ . 1 . 2]" 1
355 1 27 TYR HA 1 29 SER H 4.320 . 4.320 4.274 4.151 4.355 0.035 14 0 "[ . 1 . 2]" 1
356 1 27 TYR HA 1 32 CYS HB2 4.660 . 4.660 4.240 4.071 4.414 . 0 0 "[ . 1 . 2]" 1
357 1 27 TYR HB2 1 28 CYS H 3.990 . 3.990 3.744 3.645 3.886 . 0 0 "[ . 1 . 2]" 1
358 1 27 TYR HB2 1 33 ALA H 4.480 . 4.480 3.849 3.604 4.224 . 0 0 "[ . 1 . 2]" 1
359 1 27 TYR HB2 1 33 ALA HA 4.570 . 4.570 3.462 2.985 3.800 . 0 0 "[ . 1 . 2]" 1
360 1 27 TYR HB3 1 28 CYS H 2.960 . 2.960 2.596 2.451 2.712 . 0 0 "[ . 1 . 2]" 1
361 1 27 TYR HB3 1 28 CYS HA 4.810 . 4.810 4.807 4.699 4.860 0.050 7 0 "[ . 1 . 2]" 1
362 1 27 TYR HB3 1 29 SER H 3.100 . 3.100 2.825 2.720 2.895 . 0 0 "[ . 1 . 2]" 1
363 1 27 TYR HB3 1 32 CYS HB2 3.340 . 3.340 2.609 2.387 2.949 . 0 0 "[ . 1 . 2]" 1
364 1 27 TYR HB3 1 33 ALA H 3.640 . 3.640 3.220 3.073 3.356 . 0 0 "[ . 1 . 2]" 1
365 1 27 TYR HB3 1 33 ALA HA 4.520 . 4.520 3.525 3.153 3.791 . 0 0 "[ . 1 . 2]" 1
366 1 27 TYR HB3 1 33 ALA MB 3.280 . 3.280 2.873 2.634 3.091 . 0 0 "[ . 1 . 2]" 1
367 1 27 TYR QD 1 32 CYS HA 4.430 . 4.430 4.364 4.149 4.483 0.053 16 0 "[ . 1 . 2]" 1
368 1 27 TYR QD 1 32 CYS HB2 3.970 . 3.970 2.573 2.181 3.192 . 0 0 "[ . 1 . 2]" 1
369 1 27 TYR QD 1 32 CYS HB3 3.180 . 3.180 2.400 2.149 2.638 . 0 0 "[ . 1 . 2]" 1
370 1 27 TYR QD 1 33 ALA HA 3.620 . 3.620 2.845 2.611 3.023 . 0 0 "[ . 1 . 2]" 1
371 1 27 TYR QD 1 33 ALA MB 3.700 . 3.700 2.715 2.564 3.091 . 0 0 "[ . 1 . 2]" 1
372 1 27 TYR QE 1 33 ALA HA 4.400 . 4.400 3.071 2.990 3.226 . 0 0 "[ . 1 . 2]" 1
373 1 27 TYR QE 1 33 ALA MB 4.390 . 4.390 3.639 3.480 3.933 . 0 0 "[ . 1 . 2]" 1
374 1 27 TYR QE 1 34 GLU H 5.500 . 5.500 5.727 5.668 5.809 0.309 12 0 "[ . 1 . 2]" 1
375 1 28 CYS H 1 28 CYS HB2 3.870 . 3.870 3.572 3.532 3.606 . 0 0 "[ . 1 . 2]" 1
376 1 28 CYS H 1 28 CYS HB3 2.940 . 2.940 2.539 2.451 2.650 . 0 0 "[ . 1 . 2]" 1
377 1 28 CYS H 1 29 SER H 3.020 . 3.020 2.544 2.462 2.658 . 0 0 "[ . 1 . 2]" 1
378 1 28 CYS H 1 32 CYS H 5.500 . 5.500 5.236 5.113 5.424 . 0 0 "[ . 1 . 2]" 1
379 1 28 CYS H 1 32 CYS HB2 4.430 . 4.430 3.506 3.357 3.619 . 0 0 "[ . 1 . 2]" 1
380 1 28 CYS H 1 32 CYS HB3 4.760 . 4.760 4.658 4.200 4.818 0.058 6 0 "[ . 1 . 2]" 1
381 1 28 CYS HA 1 28 CYS HB2 3.000 . 3.000 2.445 2.419 2.489 . 0 0 "[ . 1 . 2]" 1
382 1 29 SER H 1 30 GLN H 5.500 . 5.500 4.338 4.290 4.377 . 0 0 "[ . 1 . 2]" 1
383 1 29 SER H 1 32 CYS HB2 3.450 . 3.450 3.341 2.885 3.543 0.093 17 0 "[ . 1 . 2]" 1
384 1 29 SER H 1 33 ALA MB 4.700 . 4.700 4.181 3.978 4.334 . 0 0 "[ . 1 . 2]" 1
385 1 29 SER HA 1 31 ALA H 4.820 . 4.820 4.230 3.985 4.750 . 0 0 "[ . 1 . 2]" 1
386 1 29 SER QB 1 30 GLN QG 4.400 . 4.400 4.161 3.626 4.661 0.261 8 0 "[ . 1 . 2]" 1
387 1 29 SER QB 1 31 ALA H 3.230 . 3.230 2.710 2.317 3.172 . 0 0 "[ . 1 . 2]" 1
388 1 29 SER QB 1 31 ALA MB 4.400 . 4.400 3.086 2.732 3.448 . 0 0 "[ . 1 . 2]" 1
389 1 29 SER QB 1 32 CYS H 4.300 . 4.300 3.687 2.984 4.317 0.017 15 0 "[ . 1 . 2]" 1
390 1 30 GLN H 1 31 ALA H 5.500 . 5.500 2.601 2.473 2.719 . 0 0 "[ . 1 . 2]" 1
391 1 30 GLN HA 1 30 GLN HE21 5.500 . 5.500 4.625 4.257 5.454 . 0 0 "[ . 1 . 2]" 1
392 1 30 GLN HA 1 30 GLN QG 3.370 . 3.370 3.440 3.280 3.510 0.140 13 0 "[ . 1 . 2]" 1
393 1 30 GLN HA 1 32 CYS H 5.500 . 5.500 4.738 4.630 4.873 . 0 0 "[ . 1 . 2]" 1
394 1 30 GLN HA 1 33 ALA H 4.420 . 4.420 3.297 3.117 3.605 . 0 0 "[ . 1 . 2]" 1
395 1 30 GLN HA 1 33 ALA MB 3.290 . 3.290 2.015 1.861 2.430 . 0 0 "[ . 1 . 2]" 1
396 1 30 GLN HA 1 34 GLU H 4.380 . 4.380 3.641 3.387 4.019 . 0 0 "[ . 1 . 2]" 1
397 1 30 GLN QB 1 31 ALA H 4.420 . 4.420 3.665 3.296 3.802 . 0 0 "[ . 1 . 2]" 1
398 1 30 GLN HE21 1 31 ALA H 3.460 . 3.460 2.643 1.939 3.735 0.275 1 0 "[ . 1 . 2]" 1
399 1 30 GLN QG 1 31 ALA H 3.990 . 3.990 2.690 1.834 3.211 . 0 0 "[ . 1 . 2]" 1
400 1 30 GLN QG 1 31 ALA HA 4.360 . 4.360 3.546 3.181 4.330 . 0 0 "[ . 1 . 2]" 1
401 1 30 GLN QG 1 32 CYS H 5.500 . 5.500 5.278 4.733 5.557 0.057 18 0 "[ . 1 . 2]" 1
402 1 30 GLN QG 1 33 ALA H 5.500 . 5.500 5.293 5.081 5.539 0.039 14 0 "[ . 1 . 2]" 1
403 1 30 GLN QG 1 34 GLU H 5.500 . 5.500 5.079 4.706 5.540 0.040 5 0 "[ . 1 . 2]" 1
404 1 31 ALA H 1 31 ALA MB 2.580 . 2.580 2.235 2.211 2.261 . 0 0 "[ . 1 . 2]" 1
405 1 31 ALA H 1 32 CYS H 3.330 . 3.330 2.937 2.778 3.146 . 0 0 "[ . 1 . 2]" 1
406 1 31 ALA H 1 33 ALA H 5.120 . 5.120 3.764 3.544 4.171 . 0 0 "[ . 1 . 2]" 1
407 1 31 ALA H 1 43 PRO HD2 5.080 . 5.080 5.059 4.699 5.170 0.090 13 0 "[ . 1 . 2]" 1
408 1 31 ALA HA 1 33 ALA H 5.500 . 5.500 4.315 4.149 4.481 . 0 0 "[ . 1 . 2]" 1
409 1 31 ALA HA 1 33 ALA MB 5.200 . 5.200 4.961 4.791 5.172 . 0 0 "[ . 1 . 2]" 1
410 1 31 ALA HA 1 34 GLU H 4.210 . 4.210 4.005 3.806 4.125 . 0 0 "[ . 1 . 2]" 1
411 1 31 ALA HA 1 34 GLU HB2 4.800 . 4.800 3.885 3.366 4.567 . 0 0 "[ . 1 . 2]" 1
412 1 31 ALA HA 1 35 GLN H 5.200 . 5.200 5.233 5.080 5.382 0.182 9 0 "[ . 1 . 2]" 1
413 1 31 ALA HA 1 36 HIS HD2 5.460 . 5.460 5.488 5.372 5.593 0.133 15 0 "[ . 1 . 2]" 1
414 1 31 ALA HA 1 40 GLU QB 4.750 . 4.750 4.236 2.657 4.885 0.135 9 0 "[ . 1 . 2]" 1
415 1 31 ALA HA 1 40 GLU QG 5.080 . 5.080 2.999 2.115 4.572 . 0 0 "[ . 1 . 2]" 1
416 1 31 ALA MB 1 32 CYS H 2.940 . 2.940 2.152 2.102 2.229 . 0 0 "[ . 1 . 2]" 1
417 1 31 ALA MB 1 32 CYS HA 4.670 . 4.670 3.797 3.765 3.824 . 0 0 "[ . 1 . 2]" 1
418 1 31 ALA MB 1 36 HIS H 4.610 . 4.610 4.446 4.197 4.592 . 0 0 "[ . 1 . 2]" 1
419 1 31 ALA MB 1 36 HIS HE1 3.080 . 3.080 2.855 2.691 3.083 0.003 2 0 "[ . 1 . 2]" 1
420 1 31 ALA MB 1 40 GLU QB 3.560 . 3.560 3.308 2.267 3.611 0.051 5 0 "[ . 1 . 2]" 1
421 1 31 ALA MB 1 40 GLU HG2 4.440 . 4.440 2.476 2.128 4.403 . 0 0 "[ . 1 . 2]" 1
422 1 31 ALA MB 1 40 GLU QG 3.590 . 3.590 2.280 1.998 3.680 0.090 11 0 "[ . 1 . 2]" 1
423 1 31 ALA MB 1 40 GLU HG3 4.440 . 4.440 3.031 2.019 4.440 0.000 8 0 "[ . 1 . 2]" 1
424 1 31 ALA MB 1 42 CYS HA 3.630 . 3.630 2.586 2.189 2.856 . 0 0 "[ . 1 . 2]" 1
425 1 31 ALA MB 1 42 CYS HB2 5.170 . 5.170 3.375 2.976 3.704 . 0 0 "[ . 1 . 2]" 1
426 1 31 ALA MB 1 42 CYS HB3 4.380 . 4.380 2.411 2.208 2.666 . 0 0 "[ . 1 . 2]" 1
427 1 31 ALA MB 1 43 PRO HD2 4.640 . 4.640 3.861 3.454 4.154 . 0 0 "[ . 1 . 2]" 1
428 1 32 CYS H 1 32 CYS HB2 2.710 . 2.710 2.471 2.342 2.571 . 0 0 "[ . 1 . 2]" 1
429 1 32 CYS H 1 32 CYS HB3 3.630 . 3.630 3.580 3.557 3.606 . 0 0 "[ . 1 . 2]" 1
430 1 32 CYS H 1 33 ALA H 3.050 . 3.050 2.539 2.486 2.657 . 0 0 "[ . 1 . 2]" 1
431 1 32 CYS H 1 33 ALA MB 4.520 . 4.520 4.223 4.153 4.338 . 0 0 "[ . 1 . 2]" 1
432 1 32 CYS H 1 36 HIS H 5.100 . 5.100 5.050 4.935 5.131 0.031 16 0 "[ . 1 . 2]" 1
433 1 32 CYS HA 1 35 GLN H 3.640 . 3.640 3.632 3.549 3.724 0.084 3 0 "[ . 1 . 2]" 1
434 1 32 CYS HA 1 35 GLN HA 4.860 . 4.860 3.595 3.381 3.789 . 0 0 "[ . 1 . 2]" 1
435 1 32 CYS HA 1 36 HIS H 4.980 . 4.980 3.766 3.608 3.894 . 0 0 "[ . 1 . 2]" 1
436 1 32 CYS HA 1 36 HIS HD2 4.440 . 4.440 2.668 2.547 2.773 . 0 0 "[ . 1 . 2]" 1
437 1 32 CYS HB2 1 33 ALA H 3.620 . 3.620 2.888 2.721 3.006 . 0 0 "[ . 1 . 2]" 1
438 1 32 CYS HB2 1 33 ALA MB 5.400 . 5.400 4.126 3.992 4.239 . 0 0 "[ . 1 . 2]" 1
439 1 32 CYS HB2 1 35 GLN H 5.500 . 5.500 5.453 5.295 5.546 0.046 1 0 "[ . 1 . 2]" 1
440 1 32 CYS HB3 1 33 ALA H 4.340 . 4.340 3.863 3.637 3.991 . 0 0 "[ . 1 . 2]" 1
441 1 33 ALA H 1 33 ALA MB 2.750 . 2.750 2.246 2.231 2.280 . 0 0 "[ . 1 . 2]" 1
442 1 33 ALA H 1 34 GLU HA 5.500 . 5.500 5.306 5.221 5.383 . 0 0 "[ . 1 . 2]" 1
443 1 33 ALA H 1 34 GLU HB2 5.500 . 5.500 4.909 4.734 5.106 . 0 0 "[ . 1 . 2]" 1
444 1 33 ALA H 1 35 GLN HA 5.500 . 5.500 5.441 5.269 5.560 0.060 11 0 "[ . 1 . 2]" 1
445 1 33 ALA H 1 36 HIS HD2 5.500 . 5.500 5.653 5.590 5.717 0.217 9 0 "[ . 1 . 2]" 1
446 1 33 ALA HA 1 34 GLU HA 4.830 . 4.830 4.644 4.544 4.691 . 0 0 "[ . 1 . 2]" 1
447 1 33 ALA MB 1 34 GLU H 3.010 . 3.010 2.374 2.234 2.584 . 0 0 "[ . 1 . 2]" 1
448 1 33 ALA MB 1 34 GLU HA 4.160 . 4.160 3.823 3.752 3.906 . 0 0 "[ . 1 . 2]" 1
449 1 33 ALA MB 1 35 GLN H 4.480 . 4.480 4.073 3.948 4.178 . 0 0 "[ . 1 . 2]" 1
450 1 34 GLU H 1 34 GLU HB2 2.850 . 2.850 2.442 2.320 2.527 . 0 0 "[ . 1 . 2]" 1
451 1 34 GLU H 1 34 GLU HB3 3.760 . 3.760 3.617 3.571 3.678 . 0 0 "[ . 1 . 2]" 1
452 1 34 GLU H 1 34 GLU HG2 4.230 . 4.230 2.773 2.244 3.794 . 0 0 "[ . 1 . 2]" 1
453 1 34 GLU H 1 34 GLU QG 3.460 . 3.460 2.471 2.224 2.750 . 0 0 "[ . 1 . 2]" 1
454 1 34 GLU H 1 34 GLU HG3 4.230 . 4.230 3.480 2.526 3.883 . 0 0 "[ . 1 . 2]" 1
455 1 34 GLU H 1 36 HIS H 4.140 . 4.140 3.450 3.152 3.588 . 0 0 "[ . 1 . 2]" 1
456 1 34 GLU H 1 36 HIS HA 5.170 . 5.170 5.044 4.697 5.195 0.025 12 0 "[ . 1 . 2]" 1
457 1 34 GLU H 1 37 PRO HD2 5.240 . 5.240 5.015 4.701 5.277 0.037 1 0 "[ . 1 . 2]" 1
458 1 34 GLU H 1 37 PRO HD3 5.240 . 5.240 4.202 3.774 4.511 . 0 0 "[ . 1 . 2]" 1
459 1 34 GLU HA 1 34 GLU HG2 3.750 . 3.750 2.889 2.421 3.190 . 0 0 "[ . 1 . 2]" 1
460 1 34 GLU HA 1 34 GLU QG 3.090 . 3.090 2.774 2.356 3.023 . 0 0 "[ . 1 . 2]" 1
461 1 34 GLU HA 1 34 GLU HG3 3.750 . 3.750 3.595 3.015 3.815 0.065 10 0 "[ . 1 . 2]" 1
462 1 34 GLU HA 1 36 HIS H 4.500 . 4.500 4.479 4.372 4.536 0.036 8 0 "[ . 1 . 2]" 1
463 1 34 GLU HB2 1 35 GLN H 4.230 . 4.230 3.723 3.588 3.916 . 0 0 "[ . 1 . 2]" 1
464 1 34 GLU HB2 1 36 HIS H 4.390 . 4.390 3.187 2.945 3.553 . 0 0 "[ . 1 . 2]" 1
465 1 34 GLU HB2 1 37 PRO HD2 4.190 . 4.190 3.111 2.688 3.531 . 0 0 "[ . 1 . 2]" 1
466 1 34 GLU HB2 1 37 PRO QD 3.510 . 3.510 2.182 2.007 2.458 . 0 0 "[ . 1 . 2]" 1
467 1 34 GLU HB2 1 37 PRO HD3 4.190 . 4.190 2.242 2.033 2.639 . 0 0 "[ . 1 . 2]" 1
468 1 34 GLU HB3 1 37 PRO QD 3.210 . 3.210 2.483 2.176 2.966 . 0 0 "[ . 1 . 2]" 1
469 1 34 GLU QG 1 35 GLN H 4.750 . 4.750 4.476 4.375 4.619 . 0 0 "[ . 1 . 2]" 1
470 1 35 GLN H 1 35 GLN HA 2.450 . 2.450 2.254 2.234 2.266 . 0 0 "[ . 1 . 2]" 1
471 1 35 GLN H 1 35 GLN QG 3.420 . 3.420 2.842 2.714 3.062 . 0 0 "[ . 1 . 2]" 1
472 1 35 GLN H 1 36 HIS H 3.090 . 3.090 2.545 2.510 2.582 . 0 0 "[ . 1 . 2]" 1
473 1 35 GLN H 1 36 HIS HD2 4.490 . 4.490 3.834 3.685 3.907 . 0 0 "[ . 1 . 2]" 1
474 1 35 GLN HA 1 35 GLN QE 4.750 . 4.750 4.236 2.246 4.758 0.008 16 0 "[ . 1 . 2]" 1
475 1 35 GLN HA 1 35 GLN HG2 3.710 . 3.710 2.620 2.449 3.027 . 0 0 "[ . 1 . 2]" 1
476 1 35 GLN HA 1 35 GLN HG3 3.710 . 3.710 3.170 2.827 3.771 0.061 5 0 "[ . 1 . 2]" 1
477 1 35 GLN HA 1 36 HIS HD2 3.660 . 3.660 2.452 2.286 2.627 . 0 0 "[ . 1 . 2]" 1
478 1 36 HIS H 1 36 HIS HD2 4.170 . 4.170 3.010 2.930 3.104 . 0 0 "[ . 1 . 2]" 1
479 1 36 HIS H 1 37 PRO HD2 4.110 . 4.110 3.349 3.076 3.504 . 0 0 "[ . 1 . 2]" 1
480 1 36 HIS H 1 37 PRO QD 3.400 . 3.400 2.563 2.412 2.760 . 0 0 "[ . 1 . 2]" 1
481 1 36 HIS H 1 37 PRO HD3 4.110 . 4.110 2.668 2.479 2.921 . 0 0 "[ . 1 . 2]" 1
482 1 36 HIS HA 1 37 PRO HD2 3.900 . 3.900 2.165 1.967 2.367 . 0 0 "[ . 1 . 2]" 1
483 1 36 HIS HA 1 37 PRO QD 3.220 . 3.220 2.089 1.928 2.261 . 0 0 "[ . 1 . 2]" 1
484 1 36 HIS HA 1 37 PRO HD3 3.900 . 3.900 2.781 2.642 3.077 . 0 0 "[ . 1 . 2]" 1
485 1 36 HIS HA 1 40 GLU QB 5.340 . 5.340 4.684 3.015 5.277 . 0 0 "[ . 1 . 2]" 1
486 1 36 HIS HA 1 40 GLU QG 5.340 . 5.340 3.870 3.028 5.469 0.129 8 0 "[ . 1 . 2]" 1
487 1 36 HIS QB 1 39 GLY H 4.330 . 4.330 2.858 2.525 3.386 . 0 0 "[ . 1 . 2]" 1
488 1 36 HIS QB 1 39 GLY HA2 4.060 . 4.060 2.650 2.005 3.571 . 0 0 "[ . 1 . 2]" 1
489 1 36 HIS HE1 1 42 CYS HB2 4.450 . 4.450 4.494 4.432 4.528 0.078 12 0 "[ . 1 . 2]" 1
490 1 36 HIS HE1 1 42 CYS HB3 2.770 . 2.770 2.796 2.756 2.864 0.094 1 0 "[ . 1 . 2]" 1
491 1 37 PRO QD 1 40 GLU QB 5.160 . 5.160 4.597 2.557 5.161 0.001 4 0 "[ . 1 . 2]" 1
492 1 37 PRO HG2 1 38 ASN HA 4.620 . 4.620 4.518 4.244 4.665 0.045 1 0 "[ . 1 . 2]" 1
493 1 37 PRO HG2 1 39 GLY H 5.500 . 5.500 4.553 4.060 4.989 . 0 0 "[ . 1 . 2]" 1
494 1 38 ASN HA 1 38 ASN HD21 3.660 . 3.660 2.270 1.765 2.661 . 0 0 "[ . 1 . 2]" 1
495 1 38 ASN HA 1 38 ASN HD22 3.420 . 3.420 3.559 3.362 3.721 0.301 20 0 "[ . 1 . 2]" 1
496 1 38 ASN HA 1 39 GLY HA3 4.590 . 4.590 4.485 4.368 4.539 . 0 0 "[ . 1 . 2]" 1
497 1 38 ASN HD21 1 39 GLY H 5.500 . 5.500 5.098 4.175 5.555 0.055 18 0 "[ . 1 . 2]" 1
498 1 39 GLY H 1 40 GLU HA 4.880 . 4.880 4.774 4.602 4.993 0.113 11 0 "[ . 1 . 2]" 1
499 1 39 GLY HA2 1 40 GLU HA 5.040 . 5.040 4.683 4.610 4.780 . 0 0 "[ . 1 . 2]" 1
500 1 40 GLU HA 1 40 GLU HG2 4.240 . 4.240 3.587 3.111 3.819 . 0 0 "[ . 1 . 2]" 1
501 1 40 GLU HA 1 40 GLU QG 3.520 . 3.520 3.250 2.517 3.517 . 0 0 "[ . 1 . 2]" 1
502 1 40 GLU HA 1 40 GLU HG3 4.240 . 4.240 3.840 2.643 4.274 0.034 5 0 "[ . 1 . 2]" 1
503 1 40 GLU HA 1 41 PRO HD2 3.000 . 3.000 2.451 2.121 2.705 . 0 0 "[ . 1 . 2]" 1
504 1 40 GLU HA 1 41 PRO HD3 3.000 . 3.000 2.065 1.861 2.296 . 0 0 "[ . 1 . 2]" 1
505 1 40 GLU HA 1 41 PRO QG 5.050 . 5.050 3.850 3.731 3.950 . 0 0 "[ . 1 . 2]" 1
506 1 42 CYS HA 1 42 CYS HB3 2.580 . 2.580 2.437 2.387 2.461 . 0 0 "[ . 1 . 2]" 1
507 1 42 CYS HA 1 43 PRO HD2 3.610 . 3.610 2.612 2.446 2.803 . 0 0 "[ . 1 . 2]" 1
508 1 42 CYS HA 1 43 PRO HD3 2.990 . 2.990 2.369 2.245 2.470 . 0 0 "[ . 1 . 2]" 1
509 1 42 CYS HA 1 43 PRO QG 4.840 . 4.840 4.123 4.045 4.206 . 0 0 "[ . 1 . 2]" 1
510 1 42 CYS HB2 1 43 PRO HD2 2.850 . 2.850 1.987 1.878 2.127 . 0 0 "[ . 1 . 2]" 1
511 1 42 CYS HB2 1 44 ALA H 5.260 . 5.260 3.392 3.111 3.796 . 0 0 "[ . 1 . 2]" 1
512 1 42 CYS HB2 1 44 ALA MB 5.440 . 5.440 3.600 3.379 3.770 . 0 0 "[ . 1 . 2]" 1
513 1 42 CYS HB3 1 43 PRO HD2 3.990 . 3.990 3.408 3.307 3.538 . 0 0 "[ . 1 . 2]" 1
514 1 42 CYS HB3 1 43 PRO HD3 4.600 . 4.600 4.253 4.016 4.423 . 0 0 "[ . 1 . 2]" 1
515 1 43 PRO QB 1 44 ALA H 4.100 . 4.100 3.969 3.901 4.002 . 0 0 "[ . 1 . 2]" 1
516 1 43 PRO HD2 1 44 ALA H 4.900 . 4.900 3.714 3.300 3.992 . 0 0 "[ . 1 . 2]" 1
517 1 43 PRO HD3 1 44 ALA H 5.500 . 5.500 4.468 4.251 4.627 . 0 0 "[ . 1 . 2]" 1
518 1 44 ALA H 1 44 ALA MB 3.010 . 3.010 2.285 2.225 2.373 . 0 0 "[ . 1 . 2]" 1
519 1 44 ALA H 1 45 PRO QD 4.750 . 4.750 4.353 4.284 4.447 . 0 0 "[ . 1 . 2]" 1
520 1 44 ALA H 1 47 CYS H 5.050 . 5.050 4.809 4.419 5.108 0.058 1 0 "[ . 1 . 2]" 1
521 1 44 ALA HA 1 45 PRO HD2 3.010 . 3.010 2.190 1.944 2.890 . 0 0 "[ . 1 . 2]" 1
522 1 44 ALA HA 1 45 PRO HD3 3.010 . 3.010 2.376 2.077 2.542 . 0 0 "[ . 1 . 2]" 1
523 1 44 ALA HA 1 45 PRO QG 4.170 . 4.170 3.874 3.766 4.015 . 0 0 "[ . 1 . 2]" 1
524 1 44 ALA HA 1 47 CYS H 5.500 . 5.500 4.689 4.401 4.816 . 0 0 "[ . 1 . 2]" 1
525 1 44 ALA MB 1 45 PRO HA 4.690 . 4.690 4.541 4.456 4.619 . 0 0 "[ . 1 . 2]" 1
526 1 44 ALA MB 1 45 PRO HD2 4.120 . 4.120 2.496 2.029 2.760 . 0 0 "[ . 1 . 2]" 1
527 1 44 ALA MB 1 45 PRO QD 3.500 . 3.500 2.454 1.992 2.705 . 0 0 "[ . 1 . 2]" 1
528 1 44 ALA MB 1 45 PRO HD3 4.120 . 4.120 3.624 2.907 3.911 . 0 0 "[ . 1 . 2]" 1
529 1 44 ALA MB 1 45 PRO QG 3.800 . 3.800 3.807 3.546 3.908 0.108 12 0 "[ . 1 . 2]" 1
530 1 44 ALA MB 1 46 ASP H 4.020 . 4.020 3.002 2.605 3.623 . 0 0 "[ . 1 . 2]" 1
531 1 44 ALA MB 1 47 CYS H 3.460 . 3.460 2.847 2.398 3.061 . 0 0 "[ . 1 . 2]" 1
532 1 45 PRO HB2 1 46 ASP QB 4.250 . 4.250 3.803 3.249 4.391 0.141 6 0 "[ . 1 . 2]" 1
533 1 45 PRO QD 1 46 ASP H 4.050 . 4.050 2.852 2.514 3.336 . 0 0 "[ . 1 . 2]" 1
534 1 45 PRO HD2 1 46 ASP H 4.880 . 4.880 2.921 2.553 3.475 . 0 0 "[ . 1 . 2]" 1
535 1 45 PRO HD3 1 46 ASP H 4.880 . 4.880 4.014 3.759 4.427 . 0 0 "[ . 1 . 2]" 1
536 1 45 PRO QG 1 46 ASP H 4.800 . 4.800 2.467 1.974 3.557 . 0 0 "[ . 1 . 2]" 1
537 1 45 PRO QG 1 47 CYS H 4.600 . 4.600 4.580 3.482 4.719 0.119 7 0 "[ . 1 . 2]" 1
538 1 46 ASP H 1 46 ASP HB2 4.040 . 4.040 2.921 2.423 3.737 . 0 0 "[ . 1 . 2]" 1
539 1 46 ASP H 1 46 ASP HB3 4.040 . 4.040 2.928 2.552 3.735 . 0 0 "[ . 1 . 2]" 1
540 1 46 ASP H 1 47 CYS H 3.580 . 3.580 2.498 1.836 2.843 . 0 0 "[ . 1 . 2]" 1
541 1 47 CYS H 1 47 CYS QB 3.310 . 3.310 2.378 2.164 2.945 . 0 0 "[ . 1 . 2]" 1
542 1 48 HIS QB 1 48 HIS HD2 3.700 . 3.700 2.927 2.687 3.291 . 0 0 "[ . 1 . 2]" 1
543 1 49 CYS HA 1 50 GLU QB 4.900 . 4.900 4.362 3.942 5.097 0.197 19 0 "[ . 1 . 2]" 1
544 1 49 CYS HA 1 51 ARG H 4.860 . 4.860 3.768 2.968 4.720 . 0 0 "[ . 1 . 2]" 1
545 1 49 CYS HA 1 51 ARG QG 5.500 . 5.500 4.102 2.713 5.548 0.048 12 0 "[ . 1 . 2]" 1
546 1 50 GLU H 1 50 GLU HG2 5.500 . 5.500 3.918 1.854 5.077 . 0 0 "[ . 1 . 2]" 1
547 1 50 GLU H 1 50 GLU HG3 5.500 . 5.500 4.158 2.677 4.905 . 0 0 "[ . 1 . 2]" 1
548 1 50 GLU H 1 51 ARG H 3.330 . 3.330 2.428 1.598 3.305 . 0 0 "[ . 1 . 2]" 1
549 1 50 GLU H 1 51 ARG QB 5.500 . 5.500 4.609 3.589 5.267 . 0 0 "[ . 1 . 2]" 1
550 1 50 GLU QB 1 51 ARG H 4.400 . 4.400 3.012 2.059 4.035 . 0 0 "[ . 1 . 2]" 1
551 1 50 GLU HB2 1 51 ARG H 5.210 . 5.210 3.809 2.859 4.579 . 0 0 "[ . 1 . 2]" 1
552 1 50 GLU HB3 1 51 ARG H 5.210 . 5.210 3.345 2.073 4.483 . 0 0 "[ . 1 . 2]" 1
553 1 50 GLU QG 1 51 ARG H 4.460 . 4.460 3.660 1.610 4.660 0.200 13 0 "[ . 1 . 2]" 1
554 1 50 GLU HG2 1 51 ARG H 5.320 . 5.320 4.142 2.519 5.744 0.424 9 0 "[ . 1 . 2]" 1
555 1 50 GLU HG3 1 51 ARG H 5.320 . 5.320 4.309 1.625 5.703 0.383 2 0 "[ . 1 . 2]" 1
556 1 51 ARG H 1 51 ARG QB 2.830 . 2.830 2.684 2.341 2.833 0.003 3 0 "[ . 1 . 2]" 1
557 1 51 ARG H 1 51 ARG QD 4.660 . 4.660 3.816 2.182 4.183 . 0 0 "[ . 1 . 2]" 1
558 1 51 ARG H 1 51 ARG QG 3.030 . 3.030 2.096 1.854 2.720 . 0 0 "[ . 1 . 2]" 1
559 1 51 ARG H 1 52 SER H 4.710 . 4.710 4.462 4.333 4.582 . 0 0 "[ . 1 . 2]" 1
560 1 51 ARG H 1 52 SER HA 5.420 . 5.420 5.648 5.110 6.119 0.699 13 9 "[* . * * *+ * *-*]" 1
561 1 51 ARG HA 1 51 ARG QG 3.470 . 3.470 3.253 2.265 3.456 . 0 0 "[ . 1 . 2]" 1
562 1 51 ARG HA 1 52 SER H 2.720 . 2.720 2.240 2.076 2.369 . 0 0 "[ . 1 . 2]" 1
563 1 51 ARG QB 1 51 ARG HD2 3.690 . 3.690 2.588 2.301 3.290 . 0 0 "[ . 1 . 2]" 1
564 1 51 ARG QB 1 51 ARG HD3 3.690 . 3.690 2.556 2.266 3.335 . 0 0 "[ . 1 . 2]" 1
565 1 51 ARG QB 1 52 SER H 3.340 . 3.340 2.759 2.324 3.314 . 0 0 "[ . 1 . 2]" 1
566 1 51 ARG QG 1 52 SER H 4.330 . 4.330 3.843 3.162 4.386 0.056 3 0 "[ . 1 . 2]" 1
567 1 51 ARG QG 1 52 SER HA 5.500 . 5.500 4.590 3.786 5.735 0.235 2 0 "[ . 1 . 2]" 1
568 1 52 SER H 1 52 SER QB 3.350 . 3.350 3.058 2.510 3.442 0.092 18 0 "[ . 1 . 2]" 1
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