Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
427266 | 2hjq RC | 7201 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2hjq
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 790
_Distance_constraint_stats_list.Viol_count 846
_Distance_constraint_stats_list.Viol_total 119.997
_Distance_constraint_stats_list.Viol_max 0.051
_Distance_constraint_stats_list.Viol_rms 0.0023
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0004
_Distance_constraint_stats_list.Viol_average_violations_only 0.0071
_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 PHE 0.022 0.011 9 0 "[ . 1 . 2]"
1 3 THR 0.147 0.015 7 0 "[ . 1 . 2]"
1 4 ALA 0.001 0.001 11 0 "[ . 1 . 2]"
1 5 LYS 0.251 0.027 14 0 "[ . 1 . 2]"
1 6 LEU 0.355 0.024 17 0 "[ . 1 . 2]"
1 7 ILE 0.354 0.024 7 0 "[ . 1 . 2]"
1 8 LYS 0.182 0.020 18 0 "[ . 1 . 2]"
1 9 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 LYS 0.291 0.029 1 0 "[ . 1 . 2]"
1 11 THR 0.042 0.006 9 0 "[ . 1 . 2]"
1 12 TYR 0.236 0.024 17 0 "[ . 1 . 2]"
1 13 ASN 0.021 0.009 4 0 "[ . 1 . 2]"
1 14 VAL 0.116 0.010 1 0 "[ . 1 . 2]"
1 15 MET 0.042 0.010 2 0 "[ . 1 . 2]"
1 16 GLY 0.007 0.003 19 0 "[ . 1 . 2]"
1 17 ILE 0.175 0.012 9 0 "[ . 1 . 2]"
1 18 THR 0.046 0.009 7 0 "[ . 1 . 2]"
1 19 PHE 0.056 0.006 12 0 "[ . 1 . 2]"
1 20 ARG 0.027 0.009 7 0 "[ . 1 . 2]"
1 21 ALA 0.342 0.029 1 0 "[ . 1 . 2]"
1 22 GLY 0.037 0.018 14 0 "[ . 1 . 2]"
1 23 VAL 0.018 0.004 14 0 "[ . 1 . 2]"
1 24 SER 0.146 0.027 14 0 "[ . 1 . 2]"
1 25 GLN 0.039 0.013 2 0 "[ . 1 . 2]"
1 26 THR 0.003 0.002 10 0 "[ . 1 . 2]"
1 27 VAL 0.210 0.013 16 0 "[ . 1 . 2]"
1 28 PRO 0.039 0.010 3 0 "[ . 1 . 2]"
1 29 LYS 0.003 0.003 9 0 "[ . 1 . 2]"
1 30 LYS 0.022 0.010 3 0 "[ . 1 . 2]"
1 31 LEU 0.052 0.007 7 0 "[ . 1 . 2]"
1 32 TYR 0.051 0.011 9 0 "[ . 1 . 2]"
1 33 GLU 0.167 0.024 11 0 "[ . 1 . 2]"
1 34 TYR 0.002 0.002 18 0 "[ . 1 . 2]"
1 35 LEU 0.099 0.012 9 0 "[ . 1 . 2]"
1 36 ASN 0.117 0.024 11 0 "[ . 1 . 2]"
1 37 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 ASN 0.055 0.011 7 0 "[ . 1 . 2]"
1 39 PRO 0.036 0.011 7 0 "[ . 1 . 2]"
1 40 TYR 0.348 0.021 14 0 "[ . 1 . 2]"
1 41 PHE 0.197 0.015 20 0 "[ . 1 . 2]"
1 42 ILE 0.389 0.024 7 0 "[ . 1 . 2]"
1 43 LEU 0.174 0.013 2 0 "[ . 1 . 2]"
1 44 THR 0.055 0.017 12 0 "[ . 1 . 2]"
1 45 GLN 0.052 0.015 7 0 "[ . 1 . 2]"
1 46 GLU 0.020 0.014 17 0 "[ . 1 . 2]"
1 47 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 ASP 0.027 0.025 5 0 "[ . 1 . 2]"
1 53 ASP 0.045 0.025 5 0 "[ . 1 . 2]"
1 54 PRO 0.067 0.034 5 0 "[ . 1 . 2]"
1 55 ILE 0.617 0.034 5 0 "[ . 1 . 2]"
1 56 ASN 0.352 0.028 20 0 "[ . 1 . 2]"
1 57 TYR 0.137 0.013 10 0 "[ . 1 . 2]"
1 58 THR 0.711 0.051 3 0 "[ . 1 . 2]"
1 59 GLU 0.203 0.020 11 0 "[ . 1 . 2]"
1 60 SER 0.050 0.011 11 0 "[ . 1 . 2]"
1 61 GLU 0.721 0.051 3 0 "[ . 1 . 2]"
1 62 LEU 0.219 0.019 4 0 "[ . 1 . 2]"
1 63 LYS 0.111 0.011 14 0 "[ . 1 . 2]"
1 64 GLY 0.010 0.005 9 0 "[ . 1 . 2]"
1 65 MET 0.033 0.010 2 0 "[ . 1 . 2]"
1 66 ASN 0.032 0.017 2 0 "[ . 1 . 2]"
1 67 LYS 0.011 0.011 15 0 "[ . 1 . 2]"
1 68 ALA 0.021 0.009 5 0 "[ . 1 . 2]"
1 69 GLU 0.030 0.017 2 0 "[ . 1 . 2]"
1 70 HIS 0.644 0.031 11 0 "[ . 1 . 2]"
1 71 GLU 0.077 0.012 20 0 "[ . 1 . 2]"
1 72 SER 0.025 0.009 11 0 "[ . 1 . 2]"
1 73 ILE 0.125 0.010 6 0 "[ . 1 . 2]"
1 74 ILE 0.572 0.033 19 0 "[ . 1 . 2]"
1 75 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ASN 0.021 0.009 11 0 "[ . 1 . 2]"
1 77 LEU 0.140 0.008 7 0 "[ . 1 . 2]"
1 78 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 ARG 0.074 0.012 18 0 "[ . 1 . 2]"
1 80 ASN 0.133 0.032 19 0 "[ . 1 . 2]"
1 81 PRO 0.167 0.012 20 0 "[ . 1 . 2]"
1 82 SER 0.018 0.016 15 0 "[ . 1 . 2]"
1 83 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 PHE 0.049 0.009 2 0 "[ . 1 . 2]"
1 85 LYS 0.007 0.005 20 0 "[ . 1 . 2]"
1 86 ASN 0.016 0.007 20 0 "[ . 1 . 2]"
1 87 ALA 0.038 0.011 14 0 "[ . 1 . 2]"
1 88 ASP 0.016 0.010 13 0 "[ . 1 . 2]"
1 89 GLU 0.029 0.007 20 0 "[ . 1 . 2]"
1 90 ARG 0.172 0.016 7 0 "[ . 1 . 2]"
1 91 ILE 0.080 0.016 17 0 "[ . 1 . 2]"
1 92 ALA 0.000 0.000 10 0 "[ . 1 . 2]"
1 93 TYR 0.211 0.013 5 0 "[ . 1 . 2]"
1 94 ILE 0.508 0.031 11 0 "[ . 1 . 2]"
1 95 LEU 0.196 0.020 11 0 "[ . 1 . 2]"
1 96 LYS 0.016 0.009 13 0 "[ . 1 . 2]"
1 97 GLN 0.060 0.016 19 0 "[ . 1 . 2]"
1 98 ILE 0.128 0.013 7 0 "[ . 1 . 2]"
1 99 ASP 0.018 0.007 4 0 "[ . 1 . 2]"
1 100 ASN 0.008 0.004 19 0 "[ . 1 . 2]"
1 101 LYS 0.010 0.006 14 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET HA 1 2 PHE H 1.800 . 2.900 2.423 2.126 2.812 . 0 0 "[ . 1 . 2]" 1
2 1 2 PHE HA 1 3 THR H 1.800 . 2.900 2.201 2.144 2.367 . 0 0 "[ . 1 . 2]" 1
3 1 2 PHE HA 1 45 GLN HA 1.800 . 3.000 2.673 2.331 3.002 0.002 7 0 "[ . 1 . 2]" 1
4 1 2 PHE HB3 1 27 VAL MG2 1.800 . 5.000 3.086 2.731 3.493 . 0 0 "[ . 1 . 2]" 1
5 1 2 PHE HB3 1 32 TYR QD 1.800 . 5.000 2.313 1.977 3.230 . 0 0 "[ . 1 . 2]" 1
6 1 2 PHE HB2 1 27 VAL MG2 1.800 . 5.000 2.830 2.304 3.428 . 0 0 "[ . 1 . 2]" 1
7 1 2 PHE HB2 1 32 TYR QD 1.800 . 5.000 3.578 2.829 4.789 . 0 0 "[ . 1 . 2]" 1
8 1 2 PHE QB 1 27 VAL H 1.800 . 5.000 3.383 2.761 3.763 . 0 0 "[ . 1 . 2]" 1
9 1 2 PHE QB 1 32 TYR QB 1.800 . 5.000 2.735 2.345 3.238 . 0 0 "[ . 1 . 2]" 1
10 1 2 PHE QD 1 27 VAL MG2 1.800 . 5.000 4.081 3.074 4.602 . 0 0 "[ . 1 . 2]" 1
11 1 2 PHE QD 1 29 LYS HA 1.800 . 5.000 3.636 2.352 5.003 0.003 9 0 "[ . 1 . 2]" 1
12 1 2 PHE QD 1 45 GLN HB3 1.800 . 5.000 2.982 1.813 5.001 0.001 14 0 "[ . 1 . 2]" 1
13 1 2 PHE QD 1 45 GLN HB2 1.800 . 5.000 3.617 2.984 5.004 0.004 2 0 "[ . 1 . 2]" 1
14 1 2 PHE H 1 26 THR MG 1.800 . 5.000 3.562 2.567 4.655 . 0 0 "[ . 1 . 2]" 1
15 1 2 PHE H 1 27 VAL MG2 1.800 . 5.000 4.508 3.308 5.011 0.011 9 0 "[ . 1 . 2]" 1
16 1 2 PHE H 1 3 THR H 1.800 . 5.000 4.373 4.018 4.584 . 0 0 "[ . 1 . 2]" 1
17 1 3 THR HA 1 26 THR HA 1.800 . 3.000 2.310 1.799 2.591 0.001 2 0 "[ . 1 . 2]" 1
18 1 3 THR HA 1 26 THR MG 1.800 . 5.000 3.609 3.091 4.112 . 0 0 "[ . 1 . 2]" 1
19 1 3 THR HA 1 27 VAL MG1 1.800 . 5.000 3.687 3.281 4.536 . 0 0 "[ . 1 . 2]" 1
20 1 3 THR HA 1 27 VAL MG2 1.800 . 5.000 3.223 2.542 4.013 . 0 0 "[ . 1 . 2]" 1
21 1 3 THR HA 1 27 VAL H 1.800 . 4.000 2.994 2.433 3.713 . 0 0 "[ . 1 . 2]" 1
22 1 3 THR HA 1 4 ALA H 1.800 . 2.900 2.186 2.117 2.316 . 0 0 "[ . 1 . 2]" 1
23 1 3 THR HB 1 24 SER QB 1.800 . 5.000 2.814 1.798 4.205 0.002 5 0 "[ . 1 . 2]" 1
24 1 3 THR HB 1 25 GLN H 1.800 . 5.000 4.255 3.214 5.013 0.013 2 0 "[ . 1 . 2]" 1
25 1 3 THR MG 1 24 SER HB3 1.800 . 5.000 3.208 1.799 4.971 0.001 3 0 "[ . 1 . 2]" 1
26 1 3 THR MG 1 24 SER HB2 1.800 . 5.000 3.639 2.770 4.882 . 0 0 "[ . 1 . 2]" 1
27 1 3 THR MG 1 25 GLN H 1.800 . 5.000 3.929 2.315 4.851 . 0 0 "[ . 1 . 2]" 1
28 1 3 THR MG 1 26 THR HA 1.800 . 5.000 2.731 1.798 4.203 0.002 10 0 "[ . 1 . 2]" 1
29 1 3 THR MG 1 27 VAL H 1.800 . 5.000 4.226 3.447 5.013 0.013 16 0 "[ . 1 . 2]" 1
30 1 3 THR MG 1 46 GLU QG 1.800 . 5.000 3.633 2.234 5.003 0.003 12 0 "[ . 1 . 2]" 1
31 1 3 THR H 1 27 VAL MG2 1.800 . 5.000 4.206 3.663 4.904 . 0 0 "[ . 1 . 2]" 1
32 1 3 THR H 1 32 TYR QD 1.800 . 5.000 4.309 3.520 5.001 0.001 5 0 "[ . 1 . 2]" 1
33 1 3 THR H 1 32 TYR QE 1.800 . 5.000 4.147 3.234 5.006 0.006 19 0 "[ . 1 . 2]" 1
34 1 3 THR H 1 43 LEU MD2 1.800 . 5.000 4.925 4.693 5.005 0.005 12 0 "[ . 1 . 2]" 1
35 1 3 THR H 1 44 THR HB 1.800 . 5.000 4.116 3.489 4.797 . 0 0 "[ . 1 . 2]" 1
36 1 3 THR H 1 44 THR H 1.800 . 4.000 3.359 2.917 3.864 . 0 0 "[ . 1 . 2]" 1
37 1 3 THR H 1 45 GLN QB 1.800 . 5.000 4.633 3.831 5.015 0.015 7 0 "[ . 1 . 2]" 1
38 1 4 ALA HA 1 27 VAL MG2 1.800 . 5.000 4.351 4.024 4.846 . 0 0 "[ . 1 . 2]" 1
39 1 4 ALA HA 1 43 LEU HA 1.800 . 3.000 2.329 1.868 2.772 . 0 0 "[ . 1 . 2]" 1
40 1 4 ALA HA 1 43 LEU MD2 1.800 . 5.000 3.060 2.113 3.662 . 0 0 "[ . 1 . 2]" 1
41 1 4 ALA HA 1 44 THR H 1.800 . 4.000 3.356 2.856 3.626 . 0 0 "[ . 1 . 2]" 1
42 1 4 ALA HA 1 5 LYS H 1.800 . 2.900 2.187 2.129 2.294 . 0 0 "[ . 1 . 2]" 1
43 1 4 ALA MB 1 19 PHE QD 1.800 . 5.000 3.606 3.171 3.912 . 0 0 "[ . 1 . 2]" 1
44 1 4 ALA MB 1 19 PHE QE 1.800 . 5.000 2.428 1.833 2.939 . 0 0 "[ . 1 . 2]" 1
45 1 4 ALA MB 1 19 PHE HZ 1.800 . 5.000 3.396 2.762 3.956 . 0 0 "[ . 1 . 2]" 1
46 1 4 ALA MB 1 25 GLN H 1.800 . 5.000 3.863 3.712 4.149 . 0 0 "[ . 1 . 2]" 1
47 1 4 ALA MB 1 27 VAL MG2 1.800 . 5.000 2.519 2.326 2.830 . 0 0 "[ . 1 . 2]" 1
48 1 4 ALA MB 1 27 VAL H 1.800 . 5.000 4.562 4.181 4.960 . 0 0 "[ . 1 . 2]" 1
49 1 4 ALA MB 1 32 TYR HA 1.800 . 5.000 3.903 3.579 4.173 . 0 0 "[ . 1 . 2]" 1
50 1 4 ALA MB 1 35 LEU MD1 1.800 . 5.000 2.202 2.055 2.425 . 0 0 "[ . 1 . 2]" 1
51 1 4 ALA MB 1 41 PHE QB 1.800 . 5.000 2.883 2.300 3.435 . 0 0 "[ . 1 . 2]" 1
52 1 4 ALA MB 1 41 PHE QD 1.800 . 5.000 2.741 2.172 3.306 . 0 0 "[ . 1 . 2]" 1
53 1 4 ALA MB 1 41 PHE QE 1.800 . 5.000 3.843 3.184 4.488 . 0 0 "[ . 1 . 2]" 1
54 1 4 ALA MB 1 43 LEU HA 1.800 . 5.000 3.543 3.260 3.978 . 0 0 "[ . 1 . 2]" 1
55 1 4 ALA MB 1 43 LEU MD2 1.800 . 5.000 2.297 1.938 2.805 . 0 0 "[ . 1 . 2]" 1
56 1 4 ALA H 1 24 SER QB 1.800 . 5.000 4.255 3.387 4.784 . 0 0 "[ . 1 . 2]" 1
57 1 4 ALA H 1 25 GLN H 1.800 . 4.000 2.934 2.660 3.415 . 0 0 "[ . 1 . 2]" 1
58 1 4 ALA H 1 26 THR HA 1.800 . 4.000 3.683 3.289 3.991 . 0 0 "[ . 1 . 2]" 1
59 1 4 ALA H 1 27 VAL MG1 1.800 . 5.000 2.922 2.554 4.058 . 0 0 "[ . 1 . 2]" 1
60 1 4 ALA H 1 27 VAL MG2 1.800 . 5.000 3.321 2.834 3.791 . 0 0 "[ . 1 . 2]" 1
61 1 4 ALA H 1 43 LEU MD2 1.800 . 5.000 4.602 4.145 5.001 0.001 11 0 "[ . 1 . 2]" 1
62 1 4 ALA H 1 5 LYS H 1.800 . 5.000 4.388 4.229 4.526 . 0 0 "[ . 1 . 2]" 1
63 1 5 LYS HA 1 24 SER HA 1.800 . 3.000 2.522 2.056 2.984 . 0 0 "[ . 1 . 2]" 1
64 1 5 LYS HA 1 6 LEU H 1.800 . 3.500 2.152 2.099 2.206 . 0 0 "[ . 1 . 2]" 1
65 1 5 LYS HB3 1 24 SER QB 1.800 . 5.000 4.272 3.109 4.988 . 0 0 "[ . 1 . 2]" 1
66 1 5 LYS HB3 1 42 ILE MG 1.800 . 5.000 2.848 1.799 4.637 0.001 19 0 "[ . 1 . 2]" 1
67 1 5 LYS HB2 1 24 SER QB 1.800 . 5.000 2.984 1.796 4.580 0.004 18 0 "[ . 1 . 2]" 1
68 1 5 LYS HB2 1 42 ILE MG 1.800 . 5.000 4.006 3.101 5.005 0.005 4 0 "[ . 1 . 2]" 1
69 1 5 LYS QB 1 24 SER HA 1.800 . 5.000 2.281 1.873 3.037 . 0 0 "[ . 1 . 2]" 1
70 1 5 LYS QB 1 25 GLN H 1.800 . 5.000 4.033 3.360 4.636 . 0 0 "[ . 1 . 2]" 1
71 1 5 LYS QB 1 42 ILE H 1.800 . 5.000 3.512 2.799 4.832 . 0 0 "[ . 1 . 2]" 1
72 1 5 LYS QD 1 22 GLY QA 1.800 . 5.000 2.521 2.013 4.295 . 0 0 "[ . 1 . 2]" 1
73 1 5 LYS QD 1 22 GLY H 1.800 . 5.000 3.504 2.689 5.006 0.006 11 0 "[ . 1 . 2]" 1
74 1 5 LYS QD 1 24 SER HB3 1.800 . 5.000 3.997 2.161 5.010 0.010 14 0 "[ . 1 . 2]" 1
75 1 5 LYS QD 1 24 SER HB2 1.800 . 5.000 4.195 3.792 5.027 0.027 14 0 "[ . 1 . 2]" 1
76 1 5 LYS QD 1 24 SER H 1.800 . 5.000 3.424 2.884 4.994 . 0 0 "[ . 1 . 2]" 1
77 1 5 LYS QD 1 42 ILE MG 1.800 . 5.000 4.010 3.166 5.001 0.001 5 0 "[ . 1 . 2]" 1
78 1 5 LYS QE 1 22 GLY QA 1.800 . 5.000 3.697 2.202 4.199 . 0 0 "[ . 1 . 2]" 1
79 1 5 LYS QE 1 22 GLY H 1.800 . 5.000 4.515 3.430 5.018 0.018 14 0 "[ . 1 . 2]" 1
80 1 5 LYS QE 1 24 SER H 1.800 . 5.000 4.822 3.689 5.012 0.012 18 0 "[ . 1 . 2]" 1
81 1 5 LYS QE 1 42 ILE MD 1.800 . 5.000 3.885 3.042 5.001 0.001 3 0 "[ . 1 . 2]" 1
82 1 5 LYS QE 1 42 ILE MG 1.800 . 5.000 2.994 1.942 5.004 0.004 11 0 "[ . 1 . 2]" 1
83 1 5 LYS QE 1 7 ILE MG 1.800 . 5.000 3.221 2.493 4.943 . 0 0 "[ . 1 . 2]" 1
84 1 5 LYS QG 1 21 ALA HA 1.800 . 5.000 4.105 3.465 5.004 0.004 4 0 "[ . 1 . 2]" 1
85 1 5 LYS QG 1 22 GLY QA 1.800 . 5.000 3.152 2.842 4.126 . 0 0 "[ . 1 . 2]" 1
86 1 5 LYS QG 1 22 GLY H 1.800 . 5.000 2.707 2.334 3.744 . 0 0 "[ . 1 . 2]" 1
87 1 5 LYS QG 1 23 VAL H 1.800 . 5.000 2.926 2.377 4.998 . 0 0 "[ . 1 . 2]" 1
88 1 5 LYS QG 1 24 SER HA 1.800 . 5.000 3.248 2.410 3.848 . 0 0 "[ . 1 . 2]" 1
89 1 5 LYS QG 1 24 SER H 1.800 . 5.000 3.685 3.031 5.009 0.009 4 0 "[ . 1 . 2]" 1
90 1 5 LYS QG 1 42 ILE MG 1.800 . 5.000 3.831 2.419 5.009 0.009 14 0 "[ . 1 . 2]" 1
91 1 5 LYS H 1 41 PHE QB 1.800 . 5.000 3.367 2.605 3.953 . 0 0 "[ . 1 . 2]" 1
92 1 5 LYS H 1 41 PHE QD 1.800 . 5.000 3.448 2.893 4.106 . 0 0 "[ . 1 . 2]" 1
93 1 5 LYS H 1 42 ILE HB 1.800 . 5.000 4.607 3.909 5.014 0.014 17 0 "[ . 1 . 2]" 1
94 1 5 LYS H 1 42 ILE MG 1.800 . 5.000 3.584 2.624 4.636 . 0 0 "[ . 1 . 2]" 1
95 1 5 LYS H 1 42 ILE H 1.800 . 4.000 3.249 2.839 3.697 . 0 0 "[ . 1 . 2]" 1
96 1 5 LYS H 1 43 LEU HA 1.800 . 4.000 3.297 2.386 3.975 . 0 0 "[ . 1 . 2]" 1
97 1 5 LYS H 1 43 LEU MD2 1.800 . 5.000 4.402 3.123 5.005 0.005 12 0 "[ . 1 . 2]" 1
98 1 5 LYS H 1 6 LEU H 1.800 . 5.000 4.257 4.144 4.377 . 0 0 "[ . 1 . 2]" 1
99 1 6 LEU HA 1 41 PHE HA 1.800 . 3.000 2.616 2.327 2.947 . 0 0 "[ . 1 . 2]" 1
100 1 6 LEU HA 1 41 PHE QD 1.800 . 5.000 2.906 2.170 3.964 . 0 0 "[ . 1 . 2]" 1
101 1 6 LEU HA 1 42 ILE H 1.800 . 4.000 3.863 3.691 4.005 0.005 1 0 "[ . 1 . 2]" 1
102 1 6 LEU HA 1 7 ILE H 1.800 . 3.500 2.161 2.126 2.241 . 0 0 "[ . 1 . 2]" 1
103 1 6 LEU QB 1 19 PHE HB3 1.800 . 5.000 2.524 1.796 4.373 0.004 18 0 "[ . 1 . 2]" 1
104 1 6 LEU QB 1 19 PHE HB2 1.800 . 5.000 3.203 2.272 4.512 . 0 0 "[ . 1 . 2]" 1
105 1 6 LEU QB 1 20 ARG H 1.800 . 5.000 3.531 2.958 4.571 . 0 0 "[ . 1 . 2]" 1
106 1 6 LEU QD 1 12 TYR HB3 1.800 . 5.000 2.449 1.789 3.274 0.011 14 0 "[ . 1 . 2]" 1
107 1 6 LEU QD 1 12 TYR HB2 1.800 . 5.000 2.632 1.844 3.381 . 0 0 "[ . 1 . 2]" 1
108 1 6 LEU QD 1 12 TYR QD 1.800 . 5.000 3.257 2.323 3.802 . 0 0 "[ . 1 . 2]" 1
109 1 6 LEU QD 1 12 TYR QE 1.800 . 5.000 4.574 3.915 5.001 0.001 2 0 "[ . 1 . 2]" 1
110 1 6 LEU QD 1 19 PHE HB3 1.800 . 5.000 3.173 1.885 4.026 . 0 0 "[ . 1 . 2]" 1
111 1 6 LEU QD 1 19 PHE HB2 1.800 . 5.000 2.924 1.860 3.880 . 0 0 "[ . 1 . 2]" 1
112 1 6 LEU QD 1 40 TYR HA 1.800 . 5.000 4.258 3.570 4.813 . 0 0 "[ . 1 . 2]" 1
113 1 6 LEU QD 1 40 TYR HB3 1.800 . 5.000 3.767 2.128 4.739 . 0 0 "[ . 1 . 2]" 1
114 1 6 LEU QD 1 40 TYR HB2 1.800 . 5.000 2.944 2.251 3.391 . 0 0 "[ . 1 . 2]" 1
115 1 6 LEU QD 1 40 TYR QD 1.800 . 5.000 2.690 2.094 3.615 . 0 0 "[ . 1 . 2]" 1
116 1 6 LEU QD 1 40 TYR QE 1.800 . 5.000 3.943 2.900 5.021 0.021 14 0 "[ . 1 . 2]" 1
117 1 6 LEU QD 1 40 TYR H 1.800 . 5.000 4.845 4.420 5.013 0.013 16 0 "[ . 1 . 2]" 1
118 1 6 LEU QD 1 41 PHE HA 1.800 . 5.000 3.236 2.929 3.469 . 0 0 "[ . 1 . 2]" 1
119 1 6 LEU QD 1 41 PHE QE 1.800 . 5.000 2.639 2.153 3.069 . 0 0 "[ . 1 . 2]" 1
120 1 6 LEU QD 1 41 PHE H 1.800 . 5.000 4.508 4.171 4.809 . 0 0 "[ . 1 . 2]" 1
121 1 6 LEU QD 1 41 PHE HZ 1.800 . 5.000 2.759 2.352 3.232 . 0 0 "[ . 1 . 2]" 1
122 1 6 LEU QD 1 8 LYS HB3 1.800 . 5.000 4.067 3.026 4.882 . 0 0 "[ . 1 . 2]" 1
123 1 6 LEU QD 1 8 LYS HB2 1.800 . 5.000 3.839 3.319 4.870 . 0 0 "[ . 1 . 2]" 1
124 1 6 LEU QD 1 8 LYS QD 1.800 . 5.000 4.847 4.435 5.010 0.010 1 0 "[ . 1 . 2]" 1
125 1 6 LEU HG 1 12 TYR HB3 1.800 . 5.000 3.345 2.643 4.821 . 0 0 "[ . 1 . 2]" 1
126 1 6 LEU HG 1 12 TYR HB2 1.800 . 5.000 3.609 2.674 5.000 0.000 14 0 "[ . 1 . 2]" 1
127 1 6 LEU HG 1 12 TYR QD 1.800 . 5.000 4.697 4.052 5.024 0.024 17 0 "[ . 1 . 2]" 1
128 1 6 LEU HG 1 12 TYR H 1.800 . 5.000 4.049 3.206 5.018 0.018 15 0 "[ . 1 . 2]" 1
129 1 6 LEU HG 1 19 PHE HB3 1.800 . 5.000 3.889 2.458 5.002 0.002 13 0 "[ . 1 . 2]" 1
130 1 6 LEU HG 1 19 PHE HB2 1.800 . 5.000 3.708 2.678 5.003 0.003 17 0 "[ . 1 . 2]" 1
131 1 6 LEU HG 1 20 ARG HA 1.800 . 5.000 4.327 3.581 5.004 0.004 13 0 "[ . 1 . 2]" 1
132 1 6 LEU HG 1 21 ALA HA 1.800 . 5.000 4.160 2.937 4.849 . 0 0 "[ . 1 . 2]" 1
133 1 6 LEU HG 1 21 ALA MB 1.800 . 5.000 4.244 2.820 5.011 0.011 1 0 "[ . 1 . 2]" 1
134 1 6 LEU HG 1 21 ALA H 1.800 . 5.000 4.385 3.926 5.011 0.011 16 0 "[ . 1 . 2]" 1
135 1 6 LEU H 1 19 PHE QB 1.800 . 5.000 3.093 2.488 3.467 . 0 0 "[ . 1 . 2]" 1
136 1 6 LEU H 1 19 PHE QD 1.800 . 5.000 3.799 2.972 5.002 0.002 5 0 "[ . 1 . 2]" 1
137 1 6 LEU H 1 23 VAL H 1.800 . 4.000 3.911 3.683 4.004 0.004 14 0 "[ . 1 . 2]" 1
138 1 6 LEU H 1 7 ILE H 1.800 . 5.000 4.512 4.447 4.608 . 0 0 "[ . 1 . 2]" 1
139 1 7 ILE HA 1 21 ALA MB 1.800 . 5.000 3.670 3.075 4.652 . 0 0 "[ . 1 . 2]" 1
140 1 7 ILE HB 1 42 ILE H 1.800 . 5.000 5.011 5.001 5.024 0.024 7 0 "[ . 1 . 2]" 1
141 1 7 ILE MD 1 40 TYR HA 1.800 . 5.000 3.196 2.000 4.606 . 0 0 "[ . 1 . 2]" 1
142 1 7 ILE MD 1 41 PHE HA 1.800 . 5.000 3.928 3.509 4.554 . 0 0 "[ . 1 . 2]" 1
143 1 7 ILE MD 1 41 PHE H 1.800 . 5.000 3.872 3.252 4.644 . 0 0 "[ . 1 . 2]" 1
144 1 7 ILE MD 1 42 ILE HB 1.800 . 5.000 3.237 2.260 4.753 . 0 0 "[ . 1 . 2]" 1
145 1 7 ILE MD 1 42 ILE MD 1.800 . 5.000 3.095 2.014 3.895 . 0 0 "[ . 1 . 2]" 1
146 1 7 ILE MD 1 42 ILE HG13 1.800 . 5.000 2.921 1.792 4.989 0.008 16 0 "[ . 1 . 2]" 1
147 1 7 ILE MD 1 42 ILE HG12 1.800 . 5.000 3.906 1.793 5.002 0.007 20 0 "[ . 1 . 2]" 1
148 1 7 ILE MD 1 42 ILE H 1.800 . 5.000 3.587 3.181 4.604 . 0 0 "[ . 1 . 2]" 1
149 1 7 ILE QG 1 40 TYR HA 1.800 . 5.000 2.956 2.345 3.761 . 0 0 "[ . 1 . 2]" 1
150 1 7 ILE QG 1 41 PHE HA 1.800 . 5.000 2.693 2.380 3.087 . 0 0 "[ . 1 . 2]" 1
151 1 7 ILE QG 1 41 PHE H 1.800 . 5.000 3.653 3.419 3.907 . 0 0 "[ . 1 . 2]" 1
152 1 7 ILE MG 1 41 PHE HA 1.800 . 5.000 3.147 2.839 3.652 . 0 0 "[ . 1 . 2]" 1
153 1 7 ILE MG 1 41 PHE H 1.800 . 5.000 4.986 4.858 5.015 0.015 20 0 "[ . 1 . 2]" 1
154 1 7 ILE MG 1 42 ILE HA 1.800 . 5.000 3.829 3.508 4.126 . 0 0 "[ . 1 . 2]" 1
155 1 7 ILE MG 1 42 ILE QG 1.800 . 5.000 2.726 1.795 3.926 0.005 15 0 "[ . 1 . 2]" 1
156 1 7 ILE MG 1 42 ILE H 1.800 . 5.000 2.189 2.073 2.349 . 0 0 "[ . 1 . 2]" 1
157 1 7 ILE H 1 40 TYR QB 1.800 . 5.000 3.934 3.511 4.281 . 0 0 "[ . 1 . 2]" 1
158 1 7 ILE H 1 41 PHE HA 1.800 . 4.000 2.681 2.194 3.086 . 0 0 "[ . 1 . 2]" 1
159 1 7 ILE H 1 8 LYS H 1.800 . 3.500 2.010 1.845 2.117 . 0 0 "[ . 1 . 2]" 1
160 1 8 LYS HB3 1 40 TYR HA 1.800 . 5.000 3.896 2.099 5.014 0.014 6 0 "[ . 1 . 2]" 1
161 1 8 LYS HB3 1 40 TYR QB 1.800 . 5.000 2.924 1.780 4.605 0.020 18 0 "[ . 1 . 2]" 1
162 1 8 LYS HB3 1 40 TYR QD 1.800 . 5.000 4.105 2.333 5.010 0.010 19 0 "[ . 1 . 2]" 1
163 1 8 LYS HB2 1 40 TYR HA 1.800 . 5.000 2.942 1.866 3.592 . 0 0 "[ . 1 . 2]" 1
164 1 8 LYS HB2 1 40 TYR QB 1.800 . 5.000 2.486 1.792 4.331 0.008 4 0 "[ . 1 . 2]" 1
165 1 8 LYS HB2 1 40 TYR QD 1.800 . 5.000 3.948 3.021 5.015 0.015 18 0 "[ . 1 . 2]" 1
166 1 8 LYS HD3 1 40 TYR HA 1.800 . 5.000 3.705 1.948 4.721 . 0 0 "[ . 1 . 2]" 1
167 1 8 LYS HD2 1 40 TYR HA 1.800 . 5.000 3.139 1.955 4.720 . 0 0 "[ . 1 . 2]" 1
168 1 8 LYS QD 1 40 TYR QB 1.800 . 5.000 2.787 1.859 5.010 0.010 1 0 "[ . 1 . 2]" 1
169 1 8 LYS QG 1 40 TYR HA 1.800 . 5.000 3.722 2.631 5.006 0.006 18 0 "[ . 1 . 2]" 1
170 1 8 LYS H 1 40 TYR QB 1.800 . 5.000 3.183 2.780 3.783 . 0 0 "[ . 1 . 2]" 1
171 1 8 LYS H 1 9 GLY H 1.800 . 5.000 3.992 2.288 4.409 . 0 0 "[ . 1 . 2]" 1
172 1 9 GLY H 1 10 LYS H 1.800 . 5.000 3.847 1.996 4.435 . 0 0 "[ . 1 . 2]" 1
173 1 10 LYS HA 1 21 ALA MB 1.800 . 5.000 1.989 1.791 2.503 0.009 6 0 "[ . 1 . 2]" 1
174 1 10 LYS QB 1 21 ALA H 1.800 . 5.000 4.391 3.972 4.837 . 0 0 "[ . 1 . 2]" 1
175 1 10 LYS H 1 11 THR H 1.800 . 3.500 2.486 1.798 3.506 0.006 9 0 "[ . 1 . 2]" 1
176 1 10 LYS H 1 21 ALA MB 1.800 . 5.000 3.129 2.283 3.709 . 0 0 "[ . 1 . 2]" 1
177 1 10 LYS H 1 21 ALA H 1.800 . 4.000 4.013 4.005 4.029 0.029 1 0 "[ . 1 . 2]" 1
178 1 11 THR HA 1 12 TYR H 1.800 . 2.900 2.175 2.131 2.316 . 0 0 "[ . 1 . 2]" 1
179 1 11 THR HA 1 18 THR MG 1.800 . 5.000 4.039 3.425 4.604 . 0 0 "[ . 1 . 2]" 1
180 1 11 THR HA 1 20 ARG HA 1.800 . 3.000 2.262 1.984 2.509 . 0 0 "[ . 1 . 2]" 1
181 1 11 THR HA 1 20 ARG QB 1.800 . 5.000 4.005 3.510 4.290 . 0 0 "[ . 1 . 2]" 1
182 1 11 THR HA 1 20 ARG QG 1.800 . 5.000 2.964 2.495 3.366 . 0 0 "[ . 1 . 2]" 1
183 1 11 THR HA 1 21 ALA H 1.800 . 4.000 3.579 3.369 3.848 . 0 0 "[ . 1 . 2]" 1
184 1 11 THR MG 1 20 ARG HA 1.800 . 5.000 3.270 2.712 3.548 . 0 0 "[ . 1 . 2]" 1
185 1 11 THR MG 1 20 ARG HB3 1.800 . 5.000 4.015 3.387 4.670 . 0 0 "[ . 1 . 2]" 1
186 1 11 THR MG 1 20 ARG HB2 1.800 . 5.000 4.616 4.214 5.003 0.003 6 0 "[ . 1 . 2]" 1
187 1 11 THR MG 1 20 ARG QD 1.800 . 5.000 3.422 2.935 3.863 . 0 0 "[ . 1 . 2]" 1
188 1 11 THR MG 1 20 ARG QG 1.800 . 5.000 2.047 1.798 2.469 0.002 18 0 "[ . 1 . 2]" 1
189 1 11 THR MG 1 21 ALA H 1.800 . 5.000 4.568 3.738 5.005 0.005 9 0 "[ . 1 . 2]" 1
190 1 11 THR H 1 12 TYR H 1.800 . 5.000 4.141 3.988 4.408 . 0 0 "[ . 1 . 2]" 1
191 1 11 THR H 1 21 ALA MB 1.800 . 5.000 4.570 4.302 4.725 . 0 0 "[ . 1 . 2]" 1
192 1 12 TYR HA 1 13 ASN H 1.800 . 2.900 2.177 2.136 2.302 . 0 0 "[ . 1 . 2]" 1
193 1 12 TYR HA 1 18 THR MG 1.800 . 5.000 4.589 4.019 5.005 0.005 17 0 "[ . 1 . 2]" 1
194 1 12 TYR HB3 1 41 PHE HZ 1.800 . 5.000 2.963 2.016 3.575 . 0 0 "[ . 1 . 2]" 1
195 1 12 TYR HB2 1 41 PHE HZ 1.800 . 5.000 4.394 3.477 5.009 0.009 14 0 "[ . 1 . 2]" 1
196 1 12 TYR QB 1 14 VAL MG2 1.800 . 5.000 3.658 3.331 4.218 . 0 0 "[ . 1 . 2]" 1
197 1 12 TYR QB 1 19 PHE QD 1.800 . 5.000 3.842 2.902 4.500 . 0 0 "[ . 1 . 2]" 1
198 1 12 TYR QD 1 14 VAL MG1 1.800 . 5.000 4.571 4.125 5.005 0.005 14 0 "[ . 1 . 2]" 1
199 1 12 TYR QD 1 14 VAL MG2 1.800 . 5.000 2.136 1.832 2.836 . 0 0 "[ . 1 . 2]" 1
200 1 12 TYR QD 1 41 PHE HZ 1.800 . 5.000 2.269 1.795 3.468 0.005 9 0 "[ . 1 . 2]" 1
201 1 12 TYR QE 1 14 VAL HB 1.800 . 5.000 4.962 4.775 5.009 0.009 13 0 "[ . 1 . 2]" 1
202 1 12 TYR QE 1 14 VAL MG1 1.800 . 5.000 3.748 3.340 3.980 . 0 0 "[ . 1 . 2]" 1
203 1 12 TYR QE 1 14 VAL MG2 1.800 . 5.000 2.020 1.813 2.204 . 0 0 "[ . 1 . 2]" 1
204 1 12 TYR QE 1 35 LEU MD2 1.800 . 5.000 3.820 3.072 4.778 . 0 0 "[ . 1 . 2]" 1
205 1 12 TYR H 1 18 THR MG 1.800 . 5.000 3.556 2.846 4.022 . 0 0 "[ . 1 . 2]" 1
206 1 12 TYR H 1 19 PHE QB 1.800 . 5.000 3.311 3.021 3.639 . 0 0 "[ . 1 . 2]" 1
207 1 12 TYR H 1 19 PHE QD 1.800 . 5.000 4.750 4.460 4.998 . 0 0 "[ . 1 . 2]" 1
208 1 12 TYR H 1 19 PHE H 1.800 . 4.000 3.263 3.035 3.542 . 0 0 "[ . 1 . 2]" 1
209 1 12 TYR H 1 20 ARG HA 1.800 . 4.000 3.463 3.269 3.795 . 0 0 "[ . 1 . 2]" 1
210 1 13 ASN HA 1 14 VAL H 1.800 . 3.500 2.149 2.123 2.224 . 0 0 "[ . 1 . 2]" 1
211 1 13 ASN HA 1 18 THR HA 1.800 . 3.000 2.096 1.795 2.468 0.005 16 0 "[ . 1 . 2]" 1
212 1 13 ASN HA 1 18 THR MG 1.800 . 5.000 3.286 2.575 3.940 . 0 0 "[ . 1 . 2]" 1
213 1 13 ASN HA 1 19 PHE H 1.800 . 4.000 2.942 2.226 3.331 . 0 0 "[ . 1 . 2]" 1
214 1 13 ASN QB 1 18 THR HA 1.800 . 5.000 3.440 1.998 4.223 . 0 0 "[ . 1 . 2]" 1
215 1 13 ASN QB 1 18 THR MG 1.800 . 5.000 3.227 1.964 4.633 . 0 0 "[ . 1 . 2]" 1
216 1 13 ASN HD21 1 18 THR MG 1.800 . 5.000 3.749 2.829 4.856 . 0 0 "[ . 1 . 2]" 1
217 1 13 ASN HD22 1 18 THR MG 1.800 . 5.000 4.064 2.196 5.009 0.009 4 0 "[ . 1 . 2]" 1
218 1 13 ASN H 1 14 VAL H 1.800 . 5.000 4.375 4.248 4.494 . 0 0 "[ . 1 . 2]" 1
219 1 14 VAL HB 1 19 PHE QE 1.800 . 5.000 1.875 1.796 2.120 0.004 6 0 "[ . 1 . 2]" 1
220 1 14 VAL MG1 1 17 ILE HB 1.800 . 5.000 4.223 3.618 4.720 . 0 0 "[ . 1 . 2]" 1
221 1 14 VAL MG1 1 17 ILE MD 1.800 . 5.000 4.112 3.334 5.010 0.010 1 0 "[ . 1 . 2]" 1
222 1 14 VAL MG1 1 19 PHE QD 1.800 . 5.000 4.509 4.118 4.970 . 0 0 "[ . 1 . 2]" 1
223 1 14 VAL MG1 1 19 PHE QE 1.800 . 5.000 3.228 2.941 3.610 . 0 0 "[ . 1 . 2]" 1
224 1 14 VAL MG1 1 19 PHE HZ 1.800 . 5.000 4.500 4.128 4.968 . 0 0 "[ . 1 . 2]" 1
225 1 14 VAL MG1 1 31 LEU MD1 1.800 . 5.000 3.096 2.115 3.787 . 0 0 "[ . 1 . 2]" 1
226 1 14 VAL MG1 1 31 LEU MD2 1.800 . 5.000 2.285 1.808 3.029 . 0 0 "[ . 1 . 2]" 1
227 1 14 VAL MG1 1 34 TYR QD 1.800 . 5.000 2.762 2.350 3.121 . 0 0 "[ . 1 . 2]" 1
228 1 14 VAL MG1 1 34 TYR QE 1.800 . 5.000 2.614 1.934 3.165 . 0 0 "[ . 1 . 2]" 1
229 1 14 VAL MG1 1 35 LEU MD1 1.800 . 5.000 3.175 2.522 3.777 . 0 0 "[ . 1 . 2]" 1
230 1 14 VAL MG1 1 35 LEU MD2 1.800 . 5.000 2.263 1.806 2.981 . 0 0 "[ . 1 . 2]" 1
231 1 14 VAL MG1 1 35 LEU HG 1.800 . 5.000 3.447 2.725 4.109 . 0 0 "[ . 1 . 2]" 1
232 1 14 VAL MG2 1 17 ILE MG 1.800 . 5.000 4.640 4.287 4.882 . 0 0 "[ . 1 . 2]" 1
233 1 14 VAL MG2 1 19 PHE QB 1.800 . 5.000 3.755 3.317 4.199 . 0 0 "[ . 1 . 2]" 1
234 1 14 VAL MG2 1 19 PHE QD 1.800 . 5.000 2.293 2.023 2.551 . 0 0 "[ . 1 . 2]" 1
235 1 14 VAL MG2 1 19 PHE HZ 1.800 . 5.000 4.301 4.066 4.673 . 0 0 "[ . 1 . 2]" 1
236 1 14 VAL MG2 1 34 TYR QD 1.800 . 5.000 4.069 3.579 4.585 . 0 0 "[ . 1 . 2]" 1
237 1 14 VAL MG2 1 34 TYR QE 1.800 . 5.000 3.776 3.034 4.466 . 0 0 "[ . 1 . 2]" 1
238 1 14 VAL MG2 1 35 LEU MD1 1.800 . 5.000 2.838 2.372 3.318 . 0 0 "[ . 1 . 2]" 1
239 1 14 VAL H 1 17 ILE HB 1.800 . 5.000 3.641 3.026 4.057 . 0 0 "[ . 1 . 2]" 1
240 1 14 VAL H 1 17 ILE MG 1.800 . 5.000 4.248 3.940 4.461 . 0 0 "[ . 1 . 2]" 1
241 1 14 VAL H 1 17 ILE H 1.800 . 4.000 3.403 3.123 3.668 . 0 0 "[ . 1 . 2]" 1
242 1 14 VAL H 1 18 THR HA 1.800 . 4.000 3.316 2.820 3.807 . 0 0 "[ . 1 . 2]" 1
243 1 14 VAL H 1 19 PHE QD 1.800 . 5.000 3.022 2.514 3.526 . 0 0 "[ . 1 . 2]" 1
244 1 14 VAL H 1 19 PHE QE 1.800 . 5.000 3.378 2.556 3.785 . 0 0 "[ . 1 . 2]" 1
245 1 15 MET HB3 1 31 LEU MD1 1.800 . 5.000 4.491 2.992 5.005 0.005 2 0 "[ . 1 . 2]" 1
246 1 15 MET HB3 1 31 LEU MD2 1.800 . 5.000 4.254 1.992 4.825 . 0 0 "[ . 1 . 2]" 1
247 1 15 MET HB2 1 31 LEU MD1 1.800 . 5.000 3.579 2.405 5.002 0.002 1 0 "[ . 1 . 2]" 1
248 1 15 MET HB2 1 31 LEU MD2 1.800 . 5.000 3.397 2.150 4.045 . 0 0 "[ . 1 . 2]" 1
249 1 15 MET QB 1 17 ILE MD 1.800 . 5.000 3.211 2.719 4.574 . 0 0 "[ . 1 . 2]" 1
250 1 15 MET QB 1 17 ILE QG 1.800 . 5.000 4.583 3.156 5.010 0.010 2 0 "[ . 1 . 2]" 1
251 1 15 MET ME 1 31 LEU HA 1.800 . 5.000 4.574 4.137 4.907 . 0 0 "[ . 1 . 2]" 1
252 1 15 MET ME 1 31 LEU MD1 1.800 . 5.000 4.237 3.024 4.895 . 0 0 "[ . 1 . 2]" 1
253 1 15 MET ME 1 31 LEU MD2 1.800 . 5.000 2.534 1.818 3.065 . 0 0 "[ . 1 . 2]" 1
254 1 15 MET ME 1 34 TYR HB3 1.800 . 5.000 4.585 3.939 5.002 0.002 18 0 "[ . 1 . 2]" 1
255 1 15 MET ME 1 34 TYR HB2 1.800 . 5.000 4.338 3.801 4.779 . 0 0 "[ . 1 . 2]" 1
256 1 15 MET ME 1 34 TYR QD 1.800 . 5.000 3.739 3.344 4.367 . 0 0 "[ . 1 . 2]" 1
257 1 15 MET ME 1 34 TYR QE 1.800 . 5.000 3.584 2.985 4.344 . 0 0 "[ . 1 . 2]" 1
258 1 15 MET QG 1 31 LEU MD2 1.800 . 5.000 3.238 2.191 4.387 . 0 0 "[ . 1 . 2]" 1
259 1 15 MET H 1 16 GLY H 1.800 . 5.000 3.711 2.674 4.224 . 0 0 "[ . 1 . 2]" 1
260 1 16 GLY H 1 17 ILE H 1.800 . 3.500 2.089 1.797 2.976 0.003 19 0 "[ . 1 . 2]" 1
261 1 17 ILE HA 1 18 THR H 1.800 . 3.500 2.158 2.127 2.240 . 0 0 "[ . 1 . 2]" 1
262 1 17 ILE HB 1 19 PHE QE 1.800 . 5.000 2.687 2.239 3.231 . 0 0 "[ . 1 . 2]" 1
263 1 17 ILE MD 1 19 PHE QE 1.800 . 5.000 4.172 3.284 4.863 . 0 0 "[ . 1 . 2]" 1
264 1 17 ILE MD 1 19 PHE HZ 1.800 . 5.000 4.372 3.682 4.963 . 0 0 "[ . 1 . 2]" 1
265 1 17 ILE MD 1 27 VAL HA 1.800 . 5.000 4.813 3.830 5.012 0.012 9 0 "[ . 1 . 2]" 1
266 1 17 ILE MD 1 27 VAL MG1 1.800 . 5.000 4.141 3.554 4.556 . 0 0 "[ . 1 . 2]" 1
267 1 17 ILE MD 1 28 PRO HD3 1.800 . 5.000 4.097 3.436 4.556 . 0 0 "[ . 1 . 2]" 1
268 1 17 ILE MD 1 28 PRO HD2 1.800 . 5.000 4.263 3.610 4.911 . 0 0 "[ . 1 . 2]" 1
269 1 17 ILE MD 1 31 LEU MD1 1.800 . 5.000 2.210 1.797 3.645 0.003 3 0 "[ . 1 . 2]" 1
270 1 17 ILE QG 1 27 VAL HB 1.800 . 5.000 4.941 4.570 5.008 0.008 5 0 "[ . 1 . 2]" 1
271 1 17 ILE MG 1 19 PHE QD 1.800 . 5.000 3.399 3.195 3.564 . 0 0 "[ . 1 . 2]" 1
272 1 17 ILE MG 1 19 PHE QE 1.800 . 5.000 2.870 2.783 2.958 . 0 0 "[ . 1 . 2]" 1
273 1 17 ILE MG 1 19 PHE HZ 1.800 . 5.000 2.795 2.477 3.145 . 0 0 "[ . 1 . 2]" 1
274 1 17 ILE MG 1 25 GLN HE21 1.800 . 5.000 3.531 2.484 5.000 0.000 11 0 "[ . 1 . 2]" 1
275 1 17 ILE MG 1 25 GLN HE22 1.800 . 5.000 3.298 2.428 4.932 . 0 0 "[ . 1 . 2]" 1
276 1 17 ILE MG 1 25 GLN QG 1.800 . 5.000 3.980 2.022 4.605 . 0 0 "[ . 1 . 2]" 1
277 1 17 ILE MG 1 27 VAL MG1 1.800 . 5.000 2.909 2.546 3.354 . 0 0 "[ . 1 . 2]" 1
278 1 17 ILE MG 1 31 LEU MD1 1.800 . 5.000 3.761 3.084 4.406 . 0 0 "[ . 1 . 2]" 1
279 1 17 ILE H 1 18 THR H 1.800 . 5.000 4.337 4.111 4.492 . 0 0 "[ . 1 . 2]" 1
280 1 18 THR HA 1 19 PHE H 1.800 . 2.900 2.150 2.122 2.183 . 0 0 "[ . 1 . 2]" 1
281 1 18 THR HB 1 20 ARG QG 1.800 . 5.000 4.589 4.193 5.009 0.009 7 0 "[ . 1 . 2]" 1
282 1 18 THR MG 1 20 ARG HA 1.800 . 5.000 4.582 4.143 4.959 . 0 0 "[ . 1 . 2]" 1
283 1 18 THR MG 1 20 ARG QD 1.800 . 5.000 4.031 2.830 5.002 0.002 6 0 "[ . 1 . 2]" 1
284 1 18 THR MG 1 20 ARG QG 1.800 . 5.000 3.004 2.428 3.631 . 0 0 "[ . 1 . 2]" 1
285 1 18 THR H 1 19 PHE H 1.800 . 5.000 4.330 4.209 4.462 . 0 0 "[ . 1 . 2]" 1
286 1 19 PHE HA 1 20 ARG H 1.800 . 2.900 2.250 2.149 2.383 . 0 0 "[ . 1 . 2]" 1
287 1 19 PHE HA 1 25 GLN HE21 1.800 . 5.000 3.552 2.320 4.995 . 0 0 "[ . 1 . 2]" 1
288 1 19 PHE HA 1 25 GLN HE22 1.800 . 5.000 3.166 2.226 5.001 0.001 17 0 "[ . 1 . 2]" 1
289 1 19 PHE QD 1 25 GLN QB 1.800 . 5.000 2.700 1.974 3.442 . 0 0 "[ . 1 . 2]" 1
290 1 19 PHE QD 1 41 PHE QE 1.800 . 5.000 2.934 2.641 3.353 . 0 0 "[ . 1 . 2]" 1
291 1 19 PHE QD 1 41 PHE HZ 1.800 . 5.000 3.216 2.719 4.139 . 0 0 "[ . 1 . 2]" 1
292 1 19 PHE QE 1 25 GLN QB 1.800 . 5.000 2.379 1.990 2.804 . 0 0 "[ . 1 . 2]" 1
293 1 19 PHE QE 1 25 GLN QG 1.800 . 5.000 4.201 3.434 4.739 . 0 0 "[ . 1 . 2]" 1
294 1 19 PHE QE 1 25 GLN H 1.800 . 5.000 3.594 2.693 4.317 . 0 0 "[ . 1 . 2]" 1
295 1 19 PHE QE 1 27 VAL MG1 1.800 . 5.000 2.327 1.992 2.723 . 0 0 "[ . 1 . 2]" 1
296 1 19 PHE QE 1 27 VAL MG2 1.800 . 5.000 4.202 3.649 4.564 . 0 0 "[ . 1 . 2]" 1
297 1 19 PHE QE 1 31 LEU MD1 1.800 . 5.000 3.596 2.846 4.183 . 0 0 "[ . 1 . 2]" 1
298 1 19 PHE QE 1 31 LEU MD2 1.800 . 5.000 4.508 3.802 5.004 0.004 11 0 "[ . 1 . 2]" 1
299 1 19 PHE QE 1 35 LEU MD1 1.800 . 5.000 2.832 2.569 3.244 . 0 0 "[ . 1 . 2]" 1
300 1 19 PHE H 1 20 ARG H 1.800 . 5.000 4.528 4.452 4.582 . 0 0 "[ . 1 . 2]" 1
301 1 19 PHE HZ 1 25 GLN QB 1.800 . 5.000 4.185 3.679 4.761 . 0 0 "[ . 1 . 2]" 1
302 1 19 PHE HZ 1 27 VAL MG1 1.800 . 5.000 1.904 1.794 2.124 0.006 12 0 "[ . 1 . 2]" 1
303 1 19 PHE HZ 1 31 LEU MD1 1.800 . 5.000 3.299 2.426 4.003 . 0 0 "[ . 1 . 2]" 1
304 1 19 PHE HZ 1 35 LEU MD1 1.800 . 5.000 2.768 2.340 3.426 . 0 0 "[ . 1 . 2]" 1
305 1 20 ARG HA 1 21 ALA H 1.800 . 2.900 2.244 2.170 2.346 . 0 0 "[ . 1 . 2]" 1
306 1 20 ARG HB3 1 23 VAL MG2 1.800 . 5.000 2.977 2.465 3.410 . 0 0 "[ . 1 . 2]" 1
307 1 20 ARG HB2 1 23 VAL MG2 1.800 . 5.000 2.168 1.926 2.410 . 0 0 "[ . 1 . 2]" 1
308 1 20 ARG QB 1 23 VAL HB 1.800 . 5.000 2.487 1.933 2.995 . 0 0 "[ . 1 . 2]" 1
309 1 20 ARG QD 1 23 VAL MG2 1.800 . 5.000 3.058 2.456 4.150 . 0 0 "[ . 1 . 2]" 1
310 1 20 ARG QG 1 23 VAL MG2 1.800 . 5.000 3.686 3.342 4.068 . 0 0 "[ . 1 . 2]" 1
311 1 20 ARG H 1 21 ALA H 1.800 . 5.000 4.407 4.332 4.476 . 0 0 "[ . 1 . 2]" 1
312 1 20 ARG H 1 23 VAL HB 1.800 . 5.000 2.594 2.247 3.010 . 0 0 "[ . 1 . 2]" 1
313 1 20 ARG H 1 23 VAL MG1 1.800 . 5.000 3.714 3.342 4.115 . 0 0 "[ . 1 . 2]" 1
314 1 20 ARG H 1 23 VAL MG2 1.800 . 5.000 3.749 3.457 4.134 . 0 0 "[ . 1 . 2]" 1
315 1 21 ALA HA 1 23 VAL MG2 1.800 . 5.000 4.886 4.726 5.003 0.003 12 0 "[ . 1 . 2]" 1
316 1 21 ALA MB 1 23 VAL MG2 1.800 . 5.000 4.751 4.486 4.997 . 0 0 "[ . 1 . 2]" 1
317 1 21 ALA H 1 22 GLY H 1.800 . 5.000 4.444 4.328 4.562 . 0 0 "[ . 1 . 2]" 1
318 1 21 ALA H 1 23 VAL MG2 1.800 . 5.000 4.551 4.296 4.835 . 0 0 "[ . 1 . 2]" 1
319 1 22 GLY H 1 23 VAL H 1.800 . 5.000 2.398 2.221 2.614 . 0 0 "[ . 1 . 2]" 1
320 1 23 VAL HA 1 24 SER H 1.800 . 2.900 2.143 2.114 2.169 . 0 0 "[ . 1 . 2]" 1
321 1 23 VAL H 1 24 SER H 1.800 . 5.000 4.265 4.145 4.418 . 0 0 "[ . 1 . 2]" 1
322 1 24 SER HA 1 25 GLN H 1.800 . 2.900 2.168 2.140 2.212 . 0 0 "[ . 1 . 2]" 1
323 1 24 SER H 1 25 GLN H 1.800 . 5.000 4.443 4.200 4.586 . 0 0 "[ . 1 . 2]" 1
324 1 25 GLN HA 1 26 THR H 1.800 . 2.900 2.249 2.166 2.391 . 0 0 "[ . 1 . 2]" 1
325 1 25 GLN QB 1 27 VAL MG1 1.800 . 5.000 3.321 2.859 3.698 . 0 0 "[ . 1 . 2]" 1
326 1 25 GLN H 1 26 THR H 1.800 . 5.000 4.437 4.205 4.575 . 0 0 "[ . 1 . 2]" 1
327 1 26 THR HA 1 27 VAL H 1.800 . 3.500 2.165 2.134 2.204 . 0 0 "[ . 1 . 2]" 1
328 1 27 VAL HA 1 28 PRO QD 1.800 . 3.900 1.880 1.805 1.986 . 0 0 "[ . 1 . 2]" 1
329 1 27 VAL HA 1 31 LEU MD1 1.800 . 5.000 3.486 3.034 3.995 . 0 0 "[ . 1 . 2]" 1
330 1 27 VAL HB 1 31 LEU QB 1.800 . 5.000 2.037 1.796 2.373 0.004 3 0 "[ . 1 . 2]" 1
331 1 27 VAL HB 1 31 LEU MD1 1.800 . 5.000 2.807 2.348 3.364 . 0 0 "[ . 1 . 2]" 1
332 1 27 VAL MG1 1 31 LEU MD1 1.800 . 5.000 2.983 2.513 3.549 . 0 0 "[ . 1 . 2]" 1
333 1 27 VAL MG1 1 35 LEU MD1 1.800 . 5.000 2.573 2.110 2.990 . 0 0 "[ . 1 . 2]" 1
334 1 27 VAL MG2 1 31 LEU MD1 1.800 . 5.000 4.053 3.599 4.543 . 0 0 "[ . 1 . 2]" 1
335 1 27 VAL MG2 1 32 TYR HA 1.800 . 5.000 2.577 2.319 2.886 . 0 0 "[ . 1 . 2]" 1
336 1 27 VAL MG2 1 32 TYR HB3 1.800 . 5.000 3.872 3.657 4.103 . 0 0 "[ . 1 . 2]" 1
337 1 27 VAL MG2 1 32 TYR HB2 1.800 . 5.000 2.482 2.355 2.792 . 0 0 "[ . 1 . 2]" 1
338 1 27 VAL MG2 1 32 TYR QD 1.800 . 5.000 2.933 2.439 3.218 . 0 0 "[ . 1 . 2]" 1
339 1 27 VAL MG2 1 32 TYR QE 1.800 . 5.000 4.684 4.151 5.003 0.003 17 0 "[ . 1 . 2]" 1
340 1 27 VAL MG2 1 32 TYR H 1.800 . 5.000 3.029 2.859 3.242 . 0 0 "[ . 1 . 2]" 1
341 1 27 VAL MG2 1 33 GLU H 1.800 . 5.000 4.984 4.856 5.007 0.007 2 0 "[ . 1 . 2]" 1
342 1 27 VAL MG2 1 35 LEU MD1 1.800 . 5.000 3.015 2.386 3.521 . 0 0 "[ . 1 . 2]" 1
343 1 27 VAL MG2 1 43 LEU MD2 1.800 . 5.000 3.105 2.455 3.563 . 0 0 "[ . 1 . 2]" 1
344 1 27 VAL H 1 28 PRO QD 1.800 . 5.000 4.341 4.253 4.409 . 0 0 "[ . 1 . 2]" 1
345 1 28 PRO HA 1 30 LYS H 1.800 . 5.000 4.311 4.062 4.639 . 0 0 "[ . 1 . 2]" 1
346 1 28 PRO HB3 1 30 LYS QG 1.800 . 5.000 4.558 3.103 5.010 0.010 3 0 "[ . 1 . 2]" 1
347 1 28 PRO HB2 1 30 LYS QG 1.800 . 5.000 3.796 2.108 4.271 . 0 0 "[ . 1 . 2]" 1
348 1 28 PRO QB 1 31 LEU MD1 1.800 . 5.000 3.864 3.359 4.293 . 0 0 "[ . 1 . 2]" 1
349 1 28 PRO HD3 1 31 LEU QB 1.800 . 5.000 3.694 3.417 3.976 . 0 0 "[ . 1 . 2]" 1
350 1 28 PRO HD3 1 31 LEU MD1 1.800 . 5.000 2.717 2.437 3.051 . 0 0 "[ . 1 . 2]" 1
351 1 28 PRO HD2 1 31 LEU QB 1.800 . 5.000 2.158 1.895 2.461 . 0 0 "[ . 1 . 2]" 1
352 1 28 PRO HD2 1 31 LEU MD1 1.800 . 5.000 1.830 1.793 1.993 0.007 7 0 "[ . 1 . 2]" 1
353 1 28 PRO QG 1 31 LEU QB 1.800 . 5.000 3.797 3.508 4.075 . 0 0 "[ . 1 . 2]" 1
354 1 28 PRO QG 1 31 LEU MD1 1.800 . 5.000 2.855 2.335 3.248 . 0 0 "[ . 1 . 2]" 1
355 1 29 LYS HA 1 31 LEU H 1.800 . 5.000 4.436 3.899 4.776 . 0 0 "[ . 1 . 2]" 1
356 1 29 LYS H 1 30 LYS H 1.800 . 5.000 2.721 2.514 2.916 . 0 0 "[ . 1 . 2]" 1
357 1 30 LYS HA 1 33 GLU QB 1.800 . 5.000 3.492 2.753 3.911 . 0 0 "[ . 1 . 2]" 1
358 1 30 LYS HA 1 33 GLU H 1.800 . 4.000 3.820 3.476 4.002 0.002 9 0 "[ . 1 . 2]" 1
359 1 30 LYS H 1 31 LEU H 1.800 . 5.000 2.739 2.501 2.892 . 0 0 "[ . 1 . 2]" 1
360 1 31 LEU HA 1 33 GLU H 1.800 . 5.000 4.319 4.137 4.547 . 0 0 "[ . 1 . 2]" 1
361 1 31 LEU HA 1 34 TYR QB 1.800 . 5.000 2.027 1.800 2.403 . 0 0 "[ . 1 . 2]" 1
362 1 31 LEU HA 1 34 TYR QD 1.800 . 5.000 3.752 3.327 4.271 . 0 0 "[ . 1 . 2]" 1
363 1 31 LEU HA 1 34 TYR H 1.800 . 4.000 3.087 2.911 3.264 . 0 0 "[ . 1 . 2]" 1
364 1 31 LEU HA 1 35 LEU H 1.800 . 5.000 3.654 3.480 3.905 . 0 0 "[ . 1 . 2]" 1
365 1 31 LEU MD1 1 35 LEU MD1 1.800 . 5.000 3.749 3.265 4.018 . 0 0 "[ . 1 . 2]" 1
366 1 31 LEU MD1 1 35 LEU MD2 1.800 . 5.000 4.614 4.200 4.922 . 0 0 "[ . 1 . 2]" 1
367 1 31 LEU MD2 1 34 TYR HB3 1.800 . 5.000 2.857 2.609 3.124 . 0 0 "[ . 1 . 2]" 1
368 1 31 LEU MD2 1 34 TYR HB2 1.800 . 5.000 3.264 2.974 3.633 . 0 0 "[ . 1 . 2]" 1
369 1 31 LEU MD2 1 34 TYR QD 1.800 . 5.000 3.151 2.689 3.743 . 0 0 "[ . 1 . 2]" 1
370 1 31 LEU MD2 1 34 TYR QE 1.800 . 5.000 4.238 3.786 4.870 . 0 0 "[ . 1 . 2]" 1
371 1 31 LEU MD2 1 35 LEU MD1 1.800 . 5.000 3.891 3.186 4.304 . 0 0 "[ . 1 . 2]" 1
372 1 31 LEU MD2 1 35 LEU MD2 1.800 . 5.000 3.783 3.182 4.103 . 0 0 "[ . 1 . 2]" 1
373 1 31 LEU MD2 1 35 LEU HG 1.800 . 5.000 3.660 3.062 3.967 . 0 0 "[ . 1 . 2]" 1
374 1 31 LEU H 1 32 TYR H 1.800 . 5.000 2.484 2.322 2.603 . 0 0 "[ . 1 . 2]" 1
375 1 32 TYR HA 1 35 LEU QB 1.800 . 5.000 3.331 3.067 3.623 . 0 0 "[ . 1 . 2]" 1
376 1 32 TYR HA 1 35 LEU MD1 1.800 . 5.000 3.788 3.399 4.142 . 0 0 "[ . 1 . 2]" 1
377 1 32 TYR HA 1 35 LEU HG 1.800 . 5.000 4.431 4.083 4.752 . 0 0 "[ . 1 . 2]" 1
378 1 32 TYR HA 1 35 LEU H 1.800 . 4.000 3.775 3.620 3.910 . 0 0 "[ . 1 . 2]" 1
379 1 32 TYR HA 1 36 ASN H 1.800 . 5.000 4.282 4.116 4.518 . 0 0 "[ . 1 . 2]" 1
380 1 32 TYR HA 1 43 LEU MD1 1.800 . 5.000 4.292 3.416 5.004 0.004 20 0 "[ . 1 . 2]" 1
381 1 32 TYR HA 1 43 LEU MD2 1.800 . 5.000 2.531 1.960 3.126 . 0 0 "[ . 1 . 2]" 1
382 1 32 TYR QD 1 43 LEU QB 1.800 . 5.000 3.222 2.531 3.826 . 0 0 "[ . 1 . 2]" 1
383 1 32 TYR QD 1 43 LEU MD1 1.800 . 5.000 4.295 3.557 4.999 . 0 0 "[ . 1 . 2]" 1
384 1 32 TYR QD 1 43 LEU MD2 1.800 . 5.000 2.393 1.997 2.853 . 0 0 "[ . 1 . 2]" 1
385 1 32 TYR QE 1 43 LEU HB3 1.800 . 5.000 2.248 1.803 3.074 . 0 0 "[ . 1 . 2]" 1
386 1 32 TYR QE 1 43 LEU HB2 1.800 . 5.000 3.434 2.860 3.940 . 0 0 "[ . 1 . 2]" 1
387 1 32 TYR QE 1 43 LEU MD1 1.800 . 5.000 4.074 3.355 4.749 . 0 0 "[ . 1 . 2]" 1
388 1 32 TYR QE 1 43 LEU MD2 1.800 . 5.000 3.056 2.638 3.399 . 0 0 "[ . 1 . 2]" 1
389 1 32 TYR QE 1 43 LEU HG 1.800 . 5.000 4.836 4.444 5.006 0.006 9 0 "[ . 1 . 2]" 1
390 1 32 TYR QE 1 44 THR H 1.800 . 5.000 3.871 2.706 5.011 0.011 9 0 "[ . 1 . 2]" 1
391 1 32 TYR H 1 33 GLU H 1.800 . 5.000 2.776 2.666 2.927 . 0 0 "[ . 1 . 2]" 1
392 1 33 GLU HA 1 36 ASN QB 1.800 . 5.000 2.072 1.791 2.315 0.009 9 0 "[ . 1 . 2]" 1
393 1 33 GLU HA 1 36 ASN H 1.800 . 4.000 3.112 2.827 3.322 . 0 0 "[ . 1 . 2]" 1
394 1 33 GLU QG 1 36 ASN HD21 1.800 . 5.000 3.691 2.909 4.470 . 0 0 "[ . 1 . 2]" 1
395 1 33 GLU QG 1 36 ASN HD22 1.800 . 5.000 4.911 4.396 5.024 0.024 11 0 "[ . 1 . 2]" 1
396 1 33 GLU H 1 34 TYR H 1.800 . 5.000 2.485 2.377 2.650 . 0 0 "[ . 1 . 2]" 1
397 1 34 TYR HA 1 36 ASN H 1.800 . 5.000 4.184 3.970 4.323 . 0 0 "[ . 1 . 2]" 1
398 1 35 LEU HA 1 38 ASN QB 1.800 . 5.000 2.153 1.859 2.496 . 0 0 "[ . 1 . 2]" 1
399 1 35 LEU HA 1 38 ASN QD 1.800 . 5.000 2.802 2.075 3.993 . 0 0 "[ . 1 . 2]" 1
400 1 35 LEU HB3 1 43 LEU MD2 1.800 . 5.000 2.924 2.461 3.660 . 0 0 "[ . 1 . 2]" 1
401 1 35 LEU HB2 1 43 LEU MD2 1.800 . 5.000 2.117 1.797 2.663 0.003 4 0 "[ . 1 . 2]" 1
402 1 35 LEU QB 1 38 ASN HB3 1.800 . 5.000 4.476 3.299 5.003 0.003 12 0 "[ . 1 . 2]" 1
403 1 35 LEU QB 1 38 ASN HB2 1.800 . 5.000 3.698 3.036 4.168 . 0 0 "[ . 1 . 2]" 1
404 1 35 LEU QB 1 41 PHE QB 1.800 . 5.000 2.639 2.158 3.194 . 0 0 "[ . 1 . 2]" 1
405 1 35 LEU QB 1 43 LEU MD1 1.800 . 5.000 2.752 2.114 3.603 . 0 0 "[ . 1 . 2]" 1
406 1 35 LEU MD1 1 41 PHE QB 1.800 . 5.000 3.298 2.792 3.753 . 0 0 "[ . 1 . 2]" 1
407 1 35 LEU MD1 1 41 PHE QD 1.800 . 5.000 3.019 2.582 3.327 . 0 0 "[ . 1 . 2]" 1
408 1 35 LEU MD1 1 43 LEU MD1 1.800 . 5.000 4.127 3.358 5.002 0.002 9 0 "[ . 1 . 2]" 1
409 1 35 LEU MD1 1 43 LEU MD2 1.800 . 5.000 2.976 2.521 3.674 . 0 0 "[ . 1 . 2]" 1
410 1 35 LEU MD2 1 38 ASN HB3 1.800 . 5.000 3.643 2.786 4.283 . 0 0 "[ . 1 . 2]" 1
411 1 35 LEU MD2 1 38 ASN HB2 1.800 . 5.000 2.962 2.588 3.389 . 0 0 "[ . 1 . 2]" 1
412 1 35 LEU MD2 1 38 ASN HD21 1.800 . 5.000 3.170 2.207 4.351 . 0 0 "[ . 1 . 2]" 1
413 1 35 LEU MD2 1 38 ASN HD22 1.800 . 5.000 4.048 3.459 4.539 . 0 0 "[ . 1 . 2]" 1
414 1 35 LEU MD2 1 40 TYR QD 1.800 . 5.000 4.609 3.700 5.012 0.012 9 0 "[ . 1 . 2]" 1
415 1 35 LEU MD2 1 40 TYR QE 1.800 . 5.000 4.419 3.253 5.008 0.008 14 0 "[ . 1 . 2]" 1
416 1 35 LEU MD2 1 41 PHE QB 1.800 . 5.000 3.735 3.119 4.465 . 0 0 "[ . 1 . 2]" 1
417 1 35 LEU MD2 1 41 PHE QD 1.800 . 5.000 2.909 2.587 3.386 . 0 0 "[ . 1 . 2]" 1
418 1 35 LEU MD2 1 41 PHE QE 1.800 . 5.000 2.531 1.896 2.979 . 0 0 "[ . 1 . 2]" 1
419 1 35 LEU MD2 1 41 PHE HZ 1.800 . 5.000 3.284 2.743 3.791 . 0 0 "[ . 1 . 2]" 1
420 1 35 LEU MD2 1 43 LEU MD2 1.800 . 5.000 4.391 4.020 5.001 0.001 10 0 "[ . 1 . 2]" 1
421 1 35 LEU H 1 36 ASN H 1.800 . 5.000 2.352 2.185 2.452 . 0 0 "[ . 1 . 2]" 1
422 1 35 LEU H 1 43 LEU MD1 1.800 . 5.000 4.530 3.802 5.005 0.005 10 0 "[ . 1 . 2]" 1
423 1 35 LEU H 1 43 LEU MD2 1.800 . 5.000 3.885 3.363 4.331 . 0 0 "[ . 1 . 2]" 1
424 1 36 ASN HA 1 43 LEU MD1 1.800 . 5.000 2.183 1.793 2.934 0.007 9 0 "[ . 1 . 2]" 1
425 1 36 ASN HA 1 43 LEU MD2 1.800 . 5.000 3.655 2.765 4.404 . 0 0 "[ . 1 . 2]" 1
426 1 36 ASN H 1 37 GLU H 1.800 . 5.000 2.536 2.317 2.643 . 0 0 "[ . 1 . 2]" 1
427 1 36 ASN H 1 43 LEU MD1 1.800 . 5.000 3.406 2.790 4.076 . 0 0 "[ . 1 . 2]" 1
428 1 37 GLU H 1 38 ASN H 1.800 . 5.000 2.563 2.364 2.778 . 0 0 "[ . 1 . 2]" 1
429 1 38 ASN HA 1 39 PRO QD 1.800 . 3.900 1.873 1.789 1.995 0.011 7 0 "[ . 1 . 2]" 1
430 1 38 ASN HA 1 40 TYR H 1.800 . 5.000 4.040 3.683 4.495 . 0 0 "[ . 1 . 2]" 1
431 1 38 ASN HB3 1 41 PHE QD 1.800 . 5.000 3.092 2.128 3.820 . 0 0 "[ . 1 . 2]" 1
432 1 38 ASN HB2 1 41 PHE QD 1.800 . 5.000 3.448 2.337 4.619 . 0 0 "[ . 1 . 2]" 1
433 1 38 ASN QB 1 41 PHE QB 1.800 . 5.000 3.897 2.189 5.008 0.008 13 0 "[ . 1 . 2]" 1
434 1 39 PRO HA 1 41 PHE H 1.800 . 5.000 3.429 3.090 3.970 . 0 0 "[ . 1 . 2]" 1
435 1 39 PRO QD 1 40 TYR H 1.800 . 5.000 3.401 2.795 4.084 . 0 0 "[ . 1 . 2]" 1
436 1 40 TYR H 1 41 PHE H 1.800 . 3.500 2.211 1.891 2.676 . 0 0 "[ . 1 . 2]" 1
437 1 41 PHE HA 1 42 ILE H 1.800 . 2.900 2.218 2.145 2.296 . 0 0 "[ . 1 . 2]" 1
438 1 41 PHE QB 1 43 LEU MD1 1.800 . 5.000 2.875 2.090 3.853 . 0 0 "[ . 1 . 2]" 1
439 1 41 PHE QB 1 43 LEU MD2 1.800 . 5.000 3.334 2.468 4.023 . 0 0 "[ . 1 . 2]" 1
440 1 41 PHE QB 1 43 LEU HG 1.800 . 5.000 3.028 2.628 3.585 . 0 0 "[ . 1 . 2]" 1
441 1 41 PHE H 1 42 ILE H 1.800 . 5.000 4.359 4.151 4.466 . 0 0 "[ . 1 . 2]" 1
442 1 41 PHE H 1 43 LEU MD1 1.800 . 5.000 4.522 3.629 5.013 0.013 2 0 "[ . 1 . 2]" 1
443 1 42 ILE HA 1 43 LEU H 1.800 . 2.900 2.134 2.078 2.204 . 0 0 "[ . 1 . 2]" 1
444 1 42 ILE MG 1 44 THR MG 1.800 . 5.000 4.472 2.268 5.017 0.017 12 0 "[ . 1 . 2]" 1
445 1 43 LEU HA 1 44 THR H 1.800 . 2.900 2.176 2.081 2.438 . 0 0 "[ . 1 . 2]" 1
446 1 44 THR HA 1 45 GLN H 1.800 . 2.900 2.183 2.123 2.416 . 0 0 "[ . 1 . 2]" 1
447 1 44 THR HB 1 46 GLU QG 1.800 . 5.000 3.635 2.611 4.327 . 0 0 "[ . 1 . 2]" 1
448 1 44 THR MG 1 46 GLU QG 1.800 . 5.000 2.808 2.058 5.014 0.014 17 0 "[ . 1 . 2]" 1
449 1 44 THR H 1 45 GLN H 1.800 . 5.000 4.280 4.116 4.458 . 0 0 "[ . 1 . 2]" 1
450 1 46 GLU HA 1 47 LEU H 1.800 . 3.500 2.223 2.104 2.663 . 0 0 "[ . 1 . 2]" 1
451 1 52 ASP HA 1 53 ASP H 1.800 . 3.500 2.643 2.095 3.525 0.025 5 0 "[ . 1 . 2]" 1
452 1 53 ASP HA 1 54 PRO QD 1.800 . 3.900 1.984 1.791 3.587 0.009 8 0 "[ . 1 . 2]" 1
453 1 53 ASP H 1 54 PRO QD 1.800 . 5.000 3.635 1.832 4.401 . 0 0 "[ . 1 . 2]" 1
454 1 54 PRO HA 1 55 ILE H 1.800 . 2.900 2.477 2.153 2.934 0.034 5 0 "[ . 1 . 2]" 1
455 1 54 PRO HA 1 56 ASN H 1.800 . 5.000 3.696 3.187 5.008 0.008 5 0 "[ . 1 . 2]" 1
456 1 55 ILE HA 1 56 ASN H 1.800 . 2.900 2.843 2.301 2.928 0.028 20 0 "[ . 1 . 2]" 1
457 1 55 ILE HA 1 57 TYR QD 1.800 . 5.000 3.580 3.123 3.948 . 0 0 "[ . 1 . 2]" 1
458 1 55 ILE HA 1 57 TYR QE 1.800 . 5.000 3.271 2.964 3.550 . 0 0 "[ . 1 . 2]" 1
459 1 55 ILE HA 1 74 ILE MG 1.800 . 5.000 5.017 5.001 5.033 0.033 19 0 "[ . 1 . 2]" 1
460 1 55 ILE HB 1 57 TYR QE 1.800 . 5.000 4.996 4.946 5.013 0.013 10 0 "[ . 1 . 2]" 1
461 1 55 ILE MD 1 57 TYR QD 1.800 . 5.000 4.448 3.578 4.794 . 0 0 "[ . 1 . 2]" 1
462 1 55 ILE MD 1 57 TYR QE 1.800 . 5.000 4.483 4.215 4.776 . 0 0 "[ . 1 . 2]" 1
463 1 55 ILE MD 1 74 ILE MD 1.800 . 5.000 3.654 3.054 4.964 . 0 0 "[ . 1 . 2]" 1
464 1 55 ILE MD 1 74 ILE MG 1.800 . 5.000 2.287 2.024 2.797 . 0 0 "[ . 1 . 2]" 1
465 1 55 ILE MD 1 77 LEU QB 1.800 . 5.000 2.507 1.845 3.226 . 0 0 "[ . 1 . 2]" 1
466 1 55 ILE MD 1 77 LEU MD1 1.800 . 5.000 3.263 2.667 3.683 . 0 0 "[ . 1 . 2]" 1
467 1 55 ILE MD 1 77 LEU MD2 1.800 . 5.000 2.115 1.803 2.377 . 0 0 "[ . 1 . 2]" 1
468 1 55 ILE MD 1 94 ILE QG 1.800 . 5.000 2.124 1.797 2.781 0.003 20 0 "[ . 1 . 2]" 1
469 1 55 ILE QG 1 74 ILE MG 1.800 . 5.000 3.786 3.230 4.486 . 0 0 "[ . 1 . 2]" 1
470 1 56 ASN HA 1 57 TYR H 1.800 . 2.900 2.274 2.108 2.807 . 0 0 "[ . 1 . 2]" 1
471 1 56 ASN HA 1 94 ILE MG 1.800 . 5.000 3.104 2.079 3.661 . 0 0 "[ . 1 . 2]" 1
472 1 56 ASN HA 1 98 ILE MD 1.800 . 5.000 2.434 1.798 3.446 0.002 4 0 "[ . 1 . 2]" 1
473 1 56 ASN HA 1 98 ILE QG 1.800 . 5.000 2.431 1.837 4.787 . 0 0 "[ . 1 . 2]" 1
474 1 56 ASN HA 1 98 ILE MG 1.800 . 5.000 4.110 3.567 4.998 . 0 0 "[ . 1 . 2]" 1
475 1 56 ASN QB 1 98 ILE HA 1.800 . 5.000 3.950 2.155 4.850 . 0 0 "[ . 1 . 2]" 1
476 1 56 ASN QD 1 98 ILE MD 1.800 . 5.000 4.078 2.803 5.006 0.006 18 0 "[ . 1 . 2]" 1
477 1 56 ASN H 1 57 TYR H 1.800 . 5.000 3.433 2.511 3.793 . 0 0 "[ . 1 . 2]" 1
478 1 56 ASN H 1 62 LEU MD1 1.800 . 5.000 5.009 5.001 5.019 0.019 4 0 "[ . 1 . 2]" 1
479 1 56 ASN H 1 98 ILE MD 1.800 . 5.000 4.589 4.028 5.004 0.004 11 0 "[ . 1 . 2]" 1
480 1 57 TYR HA 1 58 THR H 1.800 . 3.500 2.375 2.268 2.636 . 0 0 "[ . 1 . 2]" 1
481 1 57 TYR QB 1 61 GLU QB 1.800 . 5.000 2.850 2.171 3.335 . 0 0 "[ . 1 . 2]" 1
482 1 57 TYR QB 1 62 LEU QB 1.800 . 5.000 3.963 3.767 4.172 . 0 0 "[ . 1 . 2]" 1
483 1 57 TYR QB 1 62 LEU MD1 1.800 . 5.000 2.190 1.793 2.612 0.007 2 0 "[ . 1 . 2]" 1
484 1 57 TYR QB 1 62 LEU HG 1.800 . 5.000 2.185 1.794 2.416 0.006 12 0 "[ . 1 . 2]" 1
485 1 57 TYR QB 1 62 LEU H 1.800 . 5.000 3.908 3.545 4.243 . 0 0 "[ . 1 . 2]" 1
486 1 57 TYR QB 1 98 ILE MD 1.800 . 5.000 4.121 3.590 4.635 . 0 0 "[ . 1 . 2]" 1
487 1 57 TYR QD 1 61 GLU QB 1.800 . 5.000 4.128 3.312 4.837 . 0 0 "[ . 1 . 2]" 1
488 1 57 TYR QD 1 62 LEU MD1 1.800 . 5.000 3.114 2.614 3.574 . 0 0 "[ . 1 . 2]" 1
489 1 57 TYR QD 1 62 LEU MD2 1.800 . 5.000 2.647 2.013 3.160 . 0 0 "[ . 1 . 2]" 1
490 1 57 TYR QD 1 65 MET ME 1.800 . 5.000 3.524 2.510 4.805 . 0 0 "[ . 1 . 2]" 1
491 1 57 TYR QD 1 73 ILE MD 1.800 . 5.000 2.841 2.513 3.284 . 0 0 "[ . 1 . 2]" 1
492 1 57 TYR QD 1 73 ILE MG 1.800 . 5.000 3.148 2.446 4.323 . 0 0 "[ . 1 . 2]" 1
493 1 57 TYR QD 1 94 ILE QG 1.800 . 5.000 4.703 4.378 5.003 0.003 14 0 "[ . 1 . 2]" 1
494 1 57 TYR QD 1 94 ILE MG 1.800 . 5.000 2.476 1.946 3.037 . 0 0 "[ . 1 . 2]" 1
495 1 57 TYR QD 1 98 ILE MD 1.800 . 5.000 4.592 3.899 5.001 0.001 6 0 "[ . 1 . 2]" 1
496 1 57 TYR QE 1 62 LEU MD2 1.800 . 5.000 4.021 3.507 4.360 . 0 0 "[ . 1 . 2]" 1
497 1 57 TYR QE 1 65 MET ME 1.800 . 5.000 3.983 2.760 5.010 0.010 2 0 "[ . 1 . 2]" 1
498 1 57 TYR QE 1 73 ILE MD 1.800 . 5.000 2.584 1.794 3.089 0.006 19 0 "[ . 1 . 2]" 1
499 1 57 TYR QE 1 73 ILE MG 1.800 . 5.000 2.291 1.797 3.191 0.003 20 0 "[ . 1 . 2]" 1
500 1 57 TYR QE 1 94 ILE MG 1.800 . 5.000 3.936 3.323 4.521 . 0 0 "[ . 1 . 2]" 1
501 1 57 TYR H 1 62 LEU MD1 1.800 . 5.000 3.112 2.579 3.701 . 0 0 "[ . 1 . 2]" 1
502 1 57 TYR H 1 62 LEU MD2 1.800 . 5.000 4.239 3.312 4.957 . 0 0 "[ . 1 . 2]" 1
503 1 57 TYR H 1 98 ILE MD 1.800 . 5.000 2.238 1.795 3.295 0.005 10 0 "[ . 1 . 2]" 1
504 1 58 THR HA 1 59 GLU H 1.800 . 3.500 2.214 2.159 2.289 . 0 0 "[ . 1 . 2]" 1
505 1 58 THR HA 1 60 SER H 1.800 . 5.000 3.943 3.621 4.274 . 0 0 "[ . 1 . 2]" 1
506 1 58 THR HA 1 61 GLU H 1.800 . 4.000 4.036 4.020 4.051 0.051 3 0 "[ . 1 . 2]" 1
507 1 58 THR H 1 61 GLU QB 1.800 . 5.000 2.699 2.238 3.247 . 0 0 "[ . 1 . 2]" 1
508 1 58 THR H 1 62 LEU MD1 1.800 . 5.000 4.613 4.196 4.911 . 0 0 "[ . 1 . 2]" 1
509 1 58 THR H 1 62 LEU HG 1.800 . 5.000 4.108 3.661 4.429 . 0 0 "[ . 1 . 2]" 1
510 1 59 GLU HA 1 61 GLU H 1.800 . 5.000 3.963 3.791 4.195 . 0 0 "[ . 1 . 2]" 1
511 1 59 GLU HA 1 62 LEU QB 1.800 . 5.000 2.418 2.011 2.878 . 0 0 "[ . 1 . 2]" 1
512 1 59 GLU HA 1 62 LEU MD1 1.800 . 5.000 2.631 2.070 3.168 . 0 0 "[ . 1 . 2]" 1
513 1 59 GLU HA 1 62 LEU HG 1.800 . 5.000 3.576 3.077 3.965 . 0 0 "[ . 1 . 2]" 1
514 1 59 GLU HA 1 62 LEU H 1.800 . 4.000 3.124 2.953 3.575 . 0 0 "[ . 1 . 2]" 1
515 1 59 GLU HA 1 63 LYS H 1.800 . 5.000 4.050 3.830 4.263 . 0 0 "[ . 1 . 2]" 1
516 1 59 GLU HA 1 91 ILE MG 1.800 . 5.000 2.660 2.257 3.150 . 0 0 "[ . 1 . 2]" 1
517 1 59 GLU HA 1 95 LEU MD1 1.800 . 5.000 3.894 3.226 4.823 . 0 0 "[ . 1 . 2]" 1
518 1 59 GLU HA 1 95 LEU MD2 1.800 . 5.000 3.116 1.830 5.006 0.006 9 0 "[ . 1 . 2]" 1
519 1 59 GLU HA 1 95 LEU HG 1.800 . 5.000 4.053 3.461 4.733 . 0 0 "[ . 1 . 2]" 1
520 1 59 GLU QB 1 91 ILE QG 1.800 . 5.000 4.804 4.490 5.016 0.016 17 0 "[ . 1 . 2]" 1
521 1 59 GLU QB 1 91 ILE MG 1.800 . 5.000 2.546 2.156 3.306 . 0 0 "[ . 1 . 2]" 1
522 1 59 GLU QB 1 95 LEU QD 1.800 . 5.000 1.982 1.780 2.433 0.020 11 0 "[ . 1 . 2]" 1
523 1 59 GLU QB 1 95 LEU MD2 1.800 . 5.000 2.266 1.808 3.061 . 0 0 "[ . 1 . 2]" 1
524 1 59 GLU QG 1 63 LYS QE 1.800 . 5.000 4.067 2.076 5.008 0.008 20 0 "[ . 1 . 2]" 1
525 1 59 GLU QG 1 91 ILE MG 1.800 . 5.000 3.864 2.058 4.493 . 0 0 "[ . 1 . 2]" 1
526 1 59 GLU QG 1 95 LEU QD 1.800 . 5.000 2.888 1.929 3.625 . 0 0 "[ . 1 . 2]" 1
527 1 59 GLU QG 1 95 LEU HG 1.800 . 5.000 4.348 2.642 5.009 0.009 4 0 "[ . 1 . 2]" 1
528 1 59 GLU H 1 60 SER H 1.800 . 5.000 2.649 2.535 2.899 . 0 0 "[ . 1 . 2]" 1
529 1 59 GLU H 1 95 LEU QD 1.800 . 5.000 2.898 1.995 3.929 . 0 0 "[ . 1 . 2]" 1
530 1 60 SER HA 1 63 LYS QB 1.800 . 5.000 2.548 2.008 2.910 . 0 0 "[ . 1 . 2]" 1
531 1 60 SER HA 1 63 LYS QD 1.800 . 5.000 4.195 2.717 5.006 0.006 2 0 "[ . 1 . 2]" 1
532 1 60 SER HA 1 63 LYS H 1.800 . 4.000 3.436 3.108 3.885 . 0 0 "[ . 1 . 2]" 1
533 1 60 SER QB 1 63 LYS QB 1.800 . 5.000 4.104 3.622 4.648 . 0 0 "[ . 1 . 2]" 1
534 1 60 SER H 1 61 GLU H 1.800 . 5.000 2.576 2.396 2.736 . 0 0 "[ . 1 . 2]" 1
535 1 60 SER H 1 63 LYS QB 1.800 . 5.000 4.789 4.316 5.011 0.011 11 0 "[ . 1 . 2]" 1
536 1 61 GLU HA 1 63 LYS H 1.800 . 5.000 4.033 3.715 4.427 . 0 0 "[ . 1 . 2]" 1
537 1 61 GLU HA 1 64 GLY H 1.800 . 4.000 3.727 3.299 4.005 0.005 9 0 "[ . 1 . 2]" 1
538 1 61 GLU QB 1 65 MET ME 1.800 . 5.000 3.346 2.048 4.845 . 0 0 "[ . 1 . 2]" 1
539 1 61 GLU H 1 62 LEU H 1.800 . 5.000 2.422 2.335 2.564 . 0 0 "[ . 1 . 2]" 1
540 1 62 LEU HA 1 65 MET ME 1.800 . 5.000 3.406 2.639 4.109 . 0 0 "[ . 1 . 2]" 1
541 1 62 LEU HA 1 65 MET QG 1.800 . 5.000 2.841 1.872 4.665 . 0 0 "[ . 1 . 2]" 1
542 1 62 LEU HA 1 70 HIS HE1 1.800 . 5.000 3.686 2.188 4.464 . 0 0 "[ . 1 . 2]" 1
543 1 62 LEU QB 1 91 ILE HA 1.800 . 5.000 3.377 2.840 3.889 . 0 0 "[ . 1 . 2]" 1
544 1 62 LEU QB 1 91 ILE QG 1.800 . 5.000 2.404 1.808 4.400 . 0 0 "[ . 1 . 2]" 1
545 1 62 LEU QB 1 91 ILE MG 1.800 . 5.000 2.539 2.007 3.116 . 0 0 "[ . 1 . 2]" 1
546 1 62 LEU MD1 1 73 ILE MD 1.800 . 5.000 3.809 2.944 4.999 . 0 0 "[ . 1 . 2]" 1
547 1 62 LEU MD1 1 91 ILE MG 1.800 . 5.000 2.586 1.896 3.353 . 0 0 "[ . 1 . 2]" 1
548 1 62 LEU MD1 1 94 ILE HB 1.800 . 5.000 2.345 2.001 2.842 . 0 0 "[ . 1 . 2]" 1
549 1 62 LEU MD1 1 94 ILE MD 1.800 . 5.000 2.167 1.900 2.897 . 0 0 "[ . 1 . 2]" 1
550 1 62 LEU MD1 1 94 ILE MG 1.800 . 5.000 1.948 1.798 2.129 0.002 5 0 "[ . 1 . 2]" 1
551 1 62 LEU MD1 1 95 LEU HA 1.800 . 5.000 4.363 3.602 4.923 . 0 0 "[ . 1 . 2]" 1
552 1 62 LEU MD1 1 98 ILE MD 1.800 . 5.000 3.745 2.544 5.003 0.003 1 0 "[ . 1 . 2]" 1
553 1 62 LEU MD2 1 65 MET ME 1.800 . 5.000 2.794 2.190 3.410 . 0 0 "[ . 1 . 2]" 1
554 1 62 LEU MD2 1 65 MET QG 1.800 . 5.000 3.229 1.963 5.005 0.005 19 0 "[ . 1 . 2]" 1
555 1 62 LEU MD2 1 70 HIS HE1 1.800 . 5.000 3.031 2.083 3.603 . 0 0 "[ . 1 . 2]" 1
556 1 62 LEU MD2 1 73 ILE MD 1.800 . 5.000 2.483 2.135 3.575 . 0 0 "[ . 1 . 2]" 1
557 1 62 LEU MD2 1 94 ILE MD 1.800 . 5.000 2.350 1.889 2.898 . 0 0 "[ . 1 . 2]" 1
558 1 62 LEU MD2 1 94 ILE MG 1.800 . 5.000 2.873 2.251 3.695 . 0 0 "[ . 1 . 2]" 1
559 1 62 LEU HG 1 65 MET ME 1.800 . 5.000 4.272 3.665 5.004 0.004 3 0 "[ . 1 . 2]" 1
560 1 62 LEU HG 1 91 ILE MG 1.800 . 5.000 4.399 3.814 5.006 0.006 5 0 "[ . 1 . 2]" 1
561 1 62 LEU H 1 63 LYS H 1.800 . 5.000 2.511 2.316 2.674 . 0 0 "[ . 1 . 2]" 1
562 1 63 LYS HA 1 91 ILE MD 1.800 . 5.000 2.461 1.918 3.206 . 0 0 "[ . 1 . 2]" 1
563 1 63 LYS HA 1 91 ILE QG 1.800 . 5.000 3.947 3.140 4.478 . 0 0 "[ . 1 . 2]" 1
564 1 63 LYS HA 1 91 ILE MG 1.800 . 5.000 4.535 3.637 5.006 0.006 18 0 "[ . 1 . 2]" 1
565 1 63 LYS QB 1 91 ILE MD 1.800 . 5.000 3.779 3.281 4.275 . 0 0 "[ . 1 . 2]" 1
566 1 63 LYS QD 1 87 ALA MB 1.800 . 5.000 4.799 3.651 5.011 0.011 14 0 "[ . 1 . 2]" 1
567 1 63 LYS QE 1 91 ILE MD 1.800 . 5.000 2.781 2.073 3.684 . 0 0 "[ . 1 . 2]" 1
568 1 63 LYS QE 1 91 ILE MG 1.800 . 5.000 2.988 1.969 4.262 . 0 0 "[ . 1 . 2]" 1
569 1 63 LYS QG 1 91 ILE MD 1.800 . 5.000 2.995 1.811 3.976 . 0 0 "[ . 1 . 2]" 1
570 1 63 LYS QG 1 91 ILE MG 1.800 . 5.000 4.014 2.849 5.003 0.003 7 0 "[ . 1 . 2]" 1
571 1 63 LYS H 1 64 GLY H 1.800 . 5.000 2.576 2.424 2.725 . 0 0 "[ . 1 . 2]" 1
572 1 63 LYS H 1 91 ILE MD 1.800 . 5.000 3.705 3.277 4.048 . 0 0 "[ . 1 . 2]" 1
573 1 64 GLY H 1 65 MET H 1.800 . 5.000 2.950 2.203 4.183 . 0 0 "[ . 1 . 2]" 1
574 1 65 MET QB 1 69 GLU QG 1.800 . 5.000 3.189 1.796 5.006 0.006 11 0 "[ . 1 . 2]" 1
575 1 65 MET QB 1 70 HIS HE1 1.800 . 5.000 3.880 1.912 4.429 . 0 0 "[ . 1 . 2]" 1
576 1 65 MET QB 1 70 HIS H 1.800 . 5.000 4.124 3.582 4.939 . 0 0 "[ . 1 . 2]" 1
577 1 65 MET ME 1 69 GLU QB 1.800 . 5.000 3.755 1.835 4.634 . 0 0 "[ . 1 . 2]" 1
578 1 65 MET ME 1 73 ILE MD 1.800 . 5.000 3.422 1.913 4.629 . 0 0 "[ . 1 . 2]" 1
579 1 65 MET H 1 66 ASN H 1.800 . 5.000 4.468 4.145 4.642 . 0 0 "[ . 1 . 2]" 1
580 1 66 ASN QD 1 68 ALA MB 1.800 . 5.000 3.439 1.883 5.009 0.009 5 0 "[ . 1 . 2]" 1
581 1 66 ASN QD 1 69 GLU QG 1.800 . 5.000 3.700 1.995 5.017 0.017 2 0 "[ . 1 . 2]" 1
582 1 66 ASN H 1 67 LYS H 1.800 . 5.000 4.516 4.226 4.621 . 0 0 "[ . 1 . 2]" 1
583 1 66 ASN H 1 69 GLU QG 1.800 . 5.000 2.974 1.906 5.001 0.001 3 0 "[ . 1 . 2]" 1
584 1 67 LYS HA 1 70 HIS QB 1.800 . 5.000 2.927 2.181 3.468 . 0 0 "[ . 1 . 2]" 1
585 1 67 LYS HA 1 70 HIS H 1.800 . 4.000 3.689 3.290 3.954 . 0 0 "[ . 1 . 2]" 1
586 1 67 LYS HA 1 71 GLU H 1.800 . 5.000 4.292 3.912 4.633 . 0 0 "[ . 1 . 2]" 1
587 1 67 LYS QB 1 71 GLU QG 1.800 . 5.000 3.604 2.583 4.851 . 0 0 "[ . 1 . 2]" 1
588 1 67 LYS QG 1 71 GLU QG 1.800 . 5.000 3.842 2.410 5.011 0.011 15 0 "[ . 1 . 2]" 1
589 1 68 ALA HA 1 71 GLU QB 1.800 . 5.000 2.637 2.039 3.276 . 0 0 "[ . 1 . 2]" 1
590 1 68 ALA HA 1 71 GLU QG 1.800 . 5.000 3.099 2.223 4.084 . 0 0 "[ . 1 . 2]" 1
591 1 68 ALA HA 1 71 GLU H 1.800 . 4.000 3.447 3.107 3.816 . 0 0 "[ . 1 . 2]" 1
592 1 68 ALA HA 1 72 SER H 1.800 . 5.000 4.067 3.891 4.462 . 0 0 "[ . 1 . 2]" 1
593 1 68 ALA MB 1 71 GLU QB 1.800 . 5.000 3.884 3.416 4.553 . 0 0 "[ . 1 . 2]" 1
594 1 68 ALA MB 1 72 SER QB 1.800 . 5.000 4.696 4.075 5.004 0.004 9 0 "[ . 1 . 2]" 1
595 1 69 GLU HA 1 71 GLU H 1.800 . 5.000 4.360 4.168 4.622 . 0 0 "[ . 1 . 2]" 1
596 1 69 GLU HA 1 72 SER QB 1.800 . 5.000 3.191 2.487 4.161 . 0 0 "[ . 1 . 2]" 1
597 1 69 GLU HA 1 72 SER H 1.800 . 4.000 3.507 3.172 3.912 . 0 0 "[ . 1 . 2]" 1
598 1 69 GLU HA 1 73 ILE H 1.800 . 5.000 4.065 3.710 4.518 . 0 0 "[ . 1 . 2]" 1
599 1 69 GLU QB 1 73 ILE MD 1.800 . 5.000 3.058 2.533 3.703 . 0 0 "[ . 1 . 2]" 1
600 1 69 GLU H 1 70 HIS H 1.800 . 3.500 2.768 2.528 2.925 . 0 0 "[ . 1 . 2]" 1
601 1 70 HIS HA 1 73 ILE HB 1.800 . 5.000 2.689 2.210 3.015 . 0 0 "[ . 1 . 2]" 1
602 1 70 HIS HA 1 73 ILE MD 1.800 . 5.000 2.064 1.795 2.536 0.005 19 0 "[ . 1 . 2]" 1
603 1 70 HIS HA 1 73 ILE MG 1.800 . 5.000 3.884 3.428 4.215 . 0 0 "[ . 1 . 2]" 1
604 1 70 HIS HA 1 73 ILE H 1.800 . 4.000 3.602 3.313 3.889 . 0 0 "[ . 1 . 2]" 1
605 1 70 HIS HA 1 74 ILE QG 1.800 . 5.000 3.689 3.201 4.089 . 0 0 "[ . 1 . 2]" 1
606 1 70 HIS HA 1 74 ILE H 1.800 . 5.000 4.155 3.796 4.382 . 0 0 "[ . 1 . 2]" 1
607 1 70 HIS HA 1 94 ILE MD 1.800 . 5.000 2.896 2.770 3.100 . 0 0 "[ . 1 . 2]" 1
608 1 70 HIS HB3 1 90 ARG QD 1.800 . 5.000 2.508 2.060 3.211 . 0 0 "[ . 1 . 2]" 1
609 1 70 HIS HB2 1 90 ARG QD 1.800 . 5.000 2.711 1.799 3.612 0.001 8 0 "[ . 1 . 2]" 1
610 1 70 HIS QB 1 74 ILE MD 1.800 . 5.000 3.150 2.715 3.524 . 0 0 "[ . 1 . 2]" 1
611 1 70 HIS QB 1 81 PRO QG 1.800 . 5.000 4.231 2.901 5.010 0.010 17 0 "[ . 1 . 2]" 1
612 1 70 HIS QB 1 90 ARG QB 1.800 . 5.000 2.657 2.054 4.546 . 0 0 "[ . 1 . 2]" 1
613 1 70 HIS QB 1 90 ARG HE 1.800 . 5.000 4.321 3.051 5.012 0.012 15 0 "[ . 1 . 2]" 1
614 1 70 HIS QB 1 94 ILE MD 1.800 . 5.000 3.181 2.575 3.655 . 0 0 "[ . 1 . 2]" 1
615 1 70 HIS HE1 1 73 ILE MD 1.800 . 5.000 4.950 4.580 5.010 0.010 6 0 "[ . 1 . 2]" 1
616 1 70 HIS HE1 1 90 ARG QD 1.800 . 5.000 4.915 3.652 5.016 0.016 7 0 "[ . 1 . 2]" 1
617 1 70 HIS HE1 1 94 ILE MD 1.800 . 5.000 3.458 2.591 5.004 0.004 2 0 "[ . 1 . 2]" 1
618 1 70 HIS H 1 71 GLU H 1.800 . 5.000 2.802 2.568 3.037 . 0 0 "[ . 1 . 2]" 1
619 1 70 HIS H 1 73 ILE MD 1.800 . 5.000 3.796 3.413 4.156 . 0 0 "[ . 1 . 2]" 1
620 1 70 HIS H 1 94 ILE MD 1.800 . 5.000 5.018 5.008 5.031 0.031 11 0 "[ . 1 . 2]" 1
621 1 71 GLU HA 1 74 ILE HB 1.800 . 5.000 4.191 3.532 5.009 0.009 18 0 "[ . 1 . 2]" 1
622 1 71 GLU HA 1 74 ILE MD 1.800 . 5.000 3.683 2.731 4.306 . 0 0 "[ . 1 . 2]" 1
623 1 71 GLU HA 1 74 ILE H 1.800 . 4.000 3.773 3.432 4.011 0.011 9 0 "[ . 1 . 2]" 1
624 1 71 GLU HA 1 75 SER H 1.800 . 5.000 4.109 3.957 4.340 . 0 0 "[ . 1 . 2]" 1
625 1 71 GLU HA 1 81 PRO QB 1.800 . 5.000 3.235 2.137 4.095 . 0 0 "[ . 1 . 2]" 1
626 1 71 GLU HA 1 81 PRO QG 1.800 . 5.000 1.916 1.788 2.300 0.012 20 0 "[ . 1 . 2]" 1
627 1 71 GLU QB 1 75 SER QB 1.800 . 5.000 4.366 3.879 4.955 . 0 0 "[ . 1 . 2]" 1
628 1 71 GLU QG 1 81 PRO QB 1.800 . 5.000 3.251 2.019 4.650 . 0 0 "[ . 1 . 2]" 1
629 1 71 GLU H 1 72 SER H 1.800 . 5.000 2.743 2.636 3.033 . 0 0 "[ . 1 . 2]" 1
630 1 71 GLU H 1 74 ILE QG 1.800 . 5.000 4.775 4.166 5.004 0.004 13 0 "[ . 1 . 2]" 1
631 1 72 SER HA 1 75 SER QB 1.800 . 5.000 2.780 2.076 3.771 . 0 0 "[ . 1 . 2]" 1
632 1 72 SER HA 1 75 SER H 1.800 . 4.000 3.638 3.330 3.876 . 0 0 "[ . 1 . 2]" 1
633 1 72 SER HA 1 76 ASN QD 1.800 . 5.000 4.100 3.142 5.009 0.009 11 0 "[ . 1 . 2]" 1
634 1 72 SER HA 1 76 ASN H 1.800 . 5.000 4.188 3.751 4.477 . 0 0 "[ . 1 . 2]" 1
635 1 72 SER H 1 73 ILE H 1.800 . 5.000 2.672 2.511 2.828 . 0 0 "[ . 1 . 2]" 1
636 1 73 ILE HA 1 76 ASN QB 1.800 . 5.000 3.237 2.947 3.568 . 0 0 "[ . 1 . 2]" 1
637 1 73 ILE HA 1 76 ASN H 1.800 . 4.000 3.838 3.643 4.002 0.002 18 0 "[ . 1 . 2]" 1
638 1 73 ILE HA 1 77 LEU H 1.800 . 5.000 4.686 4.390 4.771 . 0 0 "[ . 1 . 2]" 1
639 1 73 ILE HB 1 94 ILE MD 1.800 . 5.000 3.084 2.788 3.650 . 0 0 "[ . 1 . 2]" 1
640 1 73 ILE MD 1 94 ILE MG 1.800 . 5.000 3.403 2.750 4.051 . 0 0 "[ . 1 . 2]" 1
641 1 73 ILE MG 1 77 LEU MD1 1.800 . 5.000 4.850 3.927 5.007 0.007 20 0 "[ . 1 . 2]" 1
642 1 73 ILE MG 1 77 LEU MD2 1.800 . 5.000 4.323 3.403 4.656 . 0 0 "[ . 1 . 2]" 1
643 1 73 ILE MG 1 94 ILE HA 1.800 . 5.000 4.559 4.077 5.005 0.005 19 0 "[ . 1 . 2]" 1
644 1 73 ILE MG 1 94 ILE MD 1.800 . 5.000 2.406 2.017 3.333 . 0 0 "[ . 1 . 2]" 1
645 1 73 ILE MG 1 94 ILE QG 1.800 . 5.000 2.902 2.142 3.578 . 0 0 "[ . 1 . 2]" 1
646 1 73 ILE H 1 74 ILE H 1.800 . 5.000 2.943 2.812 3.039 . 0 0 "[ . 1 . 2]" 1
647 1 74 ILE HA 1 77 LEU QB 1.800 . 5.000 2.232 1.892 2.481 . 0 0 "[ . 1 . 2]" 1
648 1 74 ILE HA 1 77 LEU MD1 1.800 . 5.000 4.502 4.252 4.731 . 0 0 "[ . 1 . 2]" 1
649 1 74 ILE HA 1 77 LEU H 1.800 . 4.000 2.876 2.723 3.178 . 0 0 "[ . 1 . 2]" 1
650 1 74 ILE HA 1 78 GLY H 1.800 . 5.000 4.235 3.847 4.872 . 0 0 "[ . 1 . 2]" 1
651 1 74 ILE HA 1 93 TYR QD 1.800 . 5.000 4.906 4.543 5.013 0.013 5 0 "[ . 1 . 2]" 1
652 1 74 ILE HA 1 93 TYR QE 1.800 . 5.000 4.768 4.393 5.003 0.003 1 0 "[ . 1 . 2]" 1
653 1 74 ILE HB 1 81 PRO QB 1.800 . 5.000 3.445 2.085 5.003 0.003 18 0 "[ . 1 . 2]" 1
654 1 74 ILE MD 1 81 PRO HA 1.800 . 5.000 3.307 1.796 4.236 0.004 5 0 "[ . 1 . 2]" 1
655 1 74 ILE MD 1 81 PRO QB 1.800 . 5.000 2.107 1.790 3.304 0.010 6 0 "[ . 1 . 2]" 1
656 1 74 ILE MD 1 81 PRO QG 1.800 . 5.000 2.692 1.797 4.039 0.003 15 0 "[ . 1 . 2]" 1
657 1 74 ILE MD 1 84 PHE QB 1.800 . 5.000 3.994 2.983 4.771 . 0 0 "[ . 1 . 2]" 1
658 1 74 ILE MD 1 84 PHE QD 1.800 . 5.000 3.555 2.300 4.408 . 0 0 "[ . 1 . 2]" 1
659 1 74 ILE MD 1 84 PHE QE 1.800 . 5.000 3.905 2.582 4.954 . 0 0 "[ . 1 . 2]" 1
660 1 74 ILE MD 1 90 ARG HA 1.800 . 5.000 3.125 2.689 4.151 . 0 0 "[ . 1 . 2]" 1
661 1 74 ILE MD 1 90 ARG QB 1.800 . 5.000 2.925 2.051 4.673 . 0 0 "[ . 1 . 2]" 1
662 1 74 ILE MD 1 90 ARG QD 1.800 . 5.000 3.831 2.530 5.004 0.004 19 0 "[ . 1 . 2]" 1
663 1 74 ILE MD 1 90 ARG QG 1.800 . 5.000 3.210 2.141 3.967 . 0 0 "[ . 1 . 2]" 1
664 1 74 ILE MD 1 93 TYR QB 1.800 . 5.000 2.996 2.598 4.338 . 0 0 "[ . 1 . 2]" 1
665 1 74 ILE MD 1 93 TYR QD 1.800 . 5.000 2.733 1.947 4.294 . 0 0 "[ . 1 . 2]" 1
666 1 74 ILE QG 1 81 PRO QG 1.800 . 5.000 3.187 2.331 4.366 . 0 0 "[ . 1 . 2]" 1
667 1 74 ILE MG 1 79 ARG HA 1.800 . 5.000 4.539 4.196 5.012 0.012 18 0 "[ . 1 . 2]" 1
668 1 74 ILE MG 1 79 ARG QB 1.800 . 5.000 2.351 1.794 3.508 0.006 17 0 "[ . 1 . 2]" 1
669 1 74 ILE MG 1 79 ARG QD 1.800 . 5.000 3.961 3.379 4.642 . 0 0 "[ . 1 . 2]" 1
670 1 74 ILE MG 1 79 ARG QG 1.800 . 5.000 3.483 2.720 4.312 . 0 0 "[ . 1 . 2]" 1
671 1 74 ILE MG 1 79 ARG H 1.800 . 5.000 3.280 2.787 4.237 . 0 0 "[ . 1 . 2]" 1
672 1 74 ILE MG 1 80 ASN HA 1.800 . 5.000 4.514 3.170 5.007 0.007 12 0 "[ . 1 . 2]" 1
673 1 74 ILE MG 1 80 ASN H 1.800 . 5.000 4.604 2.952 5.032 0.032 19 0 "[ . 1 . 2]" 1
674 1 74 ILE MG 1 81 PRO HA 1.800 . 5.000 4.244 3.652 4.780 . 0 0 "[ . 1 . 2]" 1
675 1 74 ILE MG 1 81 PRO QB 1.800 . 5.000 3.865 2.904 4.830 . 0 0 "[ . 1 . 2]" 1
676 1 74 ILE MG 1 81 PRO QD 1.800 . 5.000 3.888 3.184 5.007 0.007 5 0 "[ . 1 . 2]" 1
677 1 74 ILE MG 1 81 PRO QG 1.800 . 5.000 4.123 3.080 5.007 0.007 18 0 "[ . 1 . 2]" 1
678 1 74 ILE MG 1 84 PHE QD 1.800 . 5.000 4.514 3.768 5.004 0.004 15 0 "[ . 1 . 2]" 1
679 1 74 ILE MG 1 84 PHE QE 1.800 . 5.000 3.842 2.546 4.834 . 0 0 "[ . 1 . 2]" 1
680 1 74 ILE MG 1 93 TYR QE 1.800 . 5.000 2.406 2.118 2.780 . 0 0 "[ . 1 . 2]" 1
681 1 74 ILE H 1 75 SER H 1.800 . 5.000 2.505 2.367 2.649 . 0 0 "[ . 1 . 2]" 1
682 1 74 ILE H 1 77 LEU QB 1.800 . 5.000 4.666 4.241 4.808 . 0 0 "[ . 1 . 2]" 1
683 1 74 ILE H 1 94 ILE MD 1.800 . 5.000 4.204 3.820 4.667 . 0 0 "[ . 1 . 2]" 1
684 1 75 SER HA 1 77 LEU H 1.800 . 5.000 4.168 4.011 4.372 . 0 0 "[ . 1 . 2]" 1
685 1 75 SER HA 1 78 GLY H 1.800 . 4.000 3.219 2.882 3.575 . 0 0 "[ . 1 . 2]" 1
686 1 75 SER H 1 76 ASN H 1.800 . 5.000 2.523 2.331 2.615 . 0 0 "[ . 1 . 2]" 1
687 1 75 SER H 1 81 PRO QG 1.800 . 5.000 3.950 2.959 4.845 . 0 0 "[ . 1 . 2]" 1
688 1 77 LEU HB3 1 93 TYR QE 1.800 . 5.000 4.221 3.936 4.489 . 0 0 "[ . 1 . 2]" 1
689 1 77 LEU HB2 1 93 TYR QE 1.800 . 5.000 4.997 4.932 5.007 0.007 8 0 "[ . 1 . 2]" 1
690 1 77 LEU MD1 1 93 TYR QE 1.800 . 5.000 4.462 4.248 4.734 . 0 0 "[ . 1 . 2]" 1
691 1 77 LEU MD1 1 97 GLN QB 1.800 . 5.000 3.836 3.321 4.527 . 0 0 "[ . 1 . 2]" 1
692 1 77 LEU MD1 1 97 GLN QG 1.800 . 5.000 2.757 2.158 3.625 . 0 0 "[ . 1 . 2]" 1
693 1 77 LEU MD2 1 93 TYR QB 1.800 . 5.000 4.973 4.636 5.008 0.008 7 0 "[ . 1 . 2]" 1
694 1 77 LEU MD2 1 93 TYR QE 1.800 . 5.000 1.937 1.798 2.105 0.002 16 0 "[ . 1 . 2]" 1
695 1 77 LEU MD2 1 94 ILE HA 1.800 . 5.000 4.339 4.009 4.651 . 0 0 "[ . 1 . 2]" 1
696 1 77 LEU MD2 1 97 GLN QB 1.800 . 5.000 3.665 2.950 4.396 . 0 0 "[ . 1 . 2]" 1
697 1 77 LEU MD2 1 97 GLN QG 1.800 . 5.000 2.485 1.872 3.231 . 0 0 "[ . 1 . 2]" 1
698 1 78 GLY H 1 79 ARG H 1.800 . 3.500 2.282 1.901 3.233 . 0 0 "[ . 1 . 2]" 1
699 1 79 ARG QB 1 93 TYR QD 1.800 . 5.000 4.333 3.944 4.999 . 0 0 "[ . 1 . 2]" 1
700 1 79 ARG QB 1 93 TYR QE 1.800 . 5.000 2.771 2.326 3.198 . 0 0 "[ . 1 . 2]" 1
701 1 79 ARG QD 1 93 TYR QD 1.800 . 5.000 4.549 3.844 5.010 0.010 11 0 "[ . 1 . 2]" 1
702 1 79 ARG QD 1 93 TYR QE 1.800 . 5.000 3.271 2.834 3.808 . 0 0 "[ . 1 . 2]" 1
703 1 79 ARG QG 1 93 TYR QD 1.800 . 5.000 4.570 3.482 5.006 0.006 15 0 "[ . 1 . 2]" 1
704 1 79 ARG QG 1 93 TYR QE 1.800 . 5.000 3.253 1.889 4.206 . 0 0 "[ . 1 . 2]" 1
705 1 79 ARG H 1 80 ASN H 1.800 . 5.000 3.761 2.094 4.497 . 0 0 "[ . 1 . 2]" 1
706 1 80 ASN HA 1 81 PRO QD 1.800 . 3.900 1.901 1.789 2.135 0.011 5 0 "[ . 1 . 2]" 1
707 1 80 ASN HA 1 82 SER H 1.800 . 5.000 4.123 3.421 5.016 0.016 15 0 "[ . 1 . 2]" 1
708 1 80 ASN H 1 81 PRO QD 1.800 . 5.000 4.038 3.000 4.397 . 0 0 "[ . 1 . 2]" 1
709 1 81 PRO HA 1 84 PHE QD 1.800 . 5.000 1.984 1.791 2.350 0.009 2 0 "[ . 1 . 2]" 1
710 1 81 PRO HA 1 84 PHE QE 1.800 . 5.000 3.283 2.322 4.507 . 0 0 "[ . 1 . 2]" 1
711 1 81 PRO QB 1 84 PHE QD 1.800 . 5.000 2.991 2.006 3.879 . 0 0 "[ . 1 . 2]" 1
712 1 82 SER HA 1 84 PHE H 1.800 . 5.000 4.016 3.350 5.002 0.002 18 0 "[ . 1 . 2]" 1
713 1 82 SER H 1 83 ASP H 1.800 . 5.000 2.548 2.008 4.308 . 0 0 "[ . 1 . 2]" 1
714 1 83 ASP H 1 84 PHE H 1.800 . 3.500 2.489 2.157 3.310 . 0 0 "[ . 1 . 2]" 1
715 1 84 PHE QB 1 90 ARG HA 1.800 . 5.000 3.392 2.656 4.060 . 0 0 "[ . 1 . 2]" 1
716 1 84 PHE QB 1 90 ARG QG 1.800 . 5.000 2.439 1.950 4.437 . 0 0 "[ . 1 . 2]" 1
717 1 84 PHE QD 1 89 GLU QB 1.800 . 5.000 2.110 1.794 3.662 0.006 1 0 "[ . 1 . 2]" 1
718 1 84 PHE QD 1 90 ARG HA 1.800 . 5.000 3.840 2.895 4.473 . 0 0 "[ . 1 . 2]" 1
719 1 84 PHE QE 1 89 GLU QB 1.800 . 5.000 3.715 3.180 5.001 0.001 15 0 "[ . 1 . 2]" 1
720 1 84 PHE H 1 85 LYS H 1.800 . 5.000 4.317 3.933 4.486 . 0 0 "[ . 1 . 2]" 1
721 1 85 LYS H 1 86 ASN H 1.800 . 5.000 2.282 1.798 2.774 0.002 19 0 "[ . 1 . 2]" 1
722 1 85 LYS H 1 89 GLU QB 1.800 . 5.000 3.653 2.899 5.005 0.005 20 0 "[ . 1 . 2]" 1
723 1 86 ASN HA 1 88 ASP H 1.800 . 5.000 4.242 3.998 4.586 . 0 0 "[ . 1 . 2]" 1
724 1 86 ASN QD 1 89 GLU QG 1.800 . 5.000 3.460 1.799 5.007 0.007 20 0 "[ . 1 . 2]" 1
725 1 86 ASN H 1 89 GLU QB 1.800 . 5.000 3.290 2.783 4.713 . 0 0 "[ . 1 . 2]" 1
726 1 87 ALA HA 1 90 ARG QD 1.800 . 5.000 2.570 1.909 3.949 . 0 0 "[ . 1 . 2]" 1
727 1 87 ALA HA 1 90 ARG H 1.800 . 4.000 3.473 3.275 3.782 . 0 0 "[ . 1 . 2]" 1
728 1 87 ALA HA 1 91 ILE H 1.800 . 5.000 4.254 3.842 4.780 . 0 0 "[ . 1 . 2]" 1
729 1 87 ALA MB 1 91 ILE MD 1.800 . 5.000 3.028 2.297 3.375 . 0 0 "[ . 1 . 2]" 1
730 1 87 ALA H 1 88 ASP H 1.800 . 5.000 2.605 2.297 2.991 . 0 0 "[ . 1 . 2]" 1
731 1 88 ASP HA 1 91 ILE HB 1.800 . 5.000 2.767 2.294 3.153 . 0 0 "[ . 1 . 2]" 1
732 1 88 ASP HA 1 91 ILE MD 1.800 . 5.000 2.602 1.799 3.997 0.001 11 0 "[ . 1 . 2]" 1
733 1 88 ASP HA 1 91 ILE MG 1.800 . 5.000 4.093 3.675 4.446 . 0 0 "[ . 1 . 2]" 1
734 1 88 ASP HA 1 91 ILE H 1.800 . 4.000 3.363 3.051 3.877 . 0 0 "[ . 1 . 2]" 1
735 1 88 ASP HA 1 92 ALA H 1.800 . 5.000 3.963 3.818 4.367 . 0 0 "[ . 1 . 2]" 1
736 1 88 ASP H 1 89 GLU H 1.800 . 3.500 2.740 2.539 2.920 . 0 0 "[ . 1 . 2]" 1
737 1 88 ASP H 1 91 ILE MD 1.800 . 5.000 4.273 3.748 5.010 0.010 13 0 "[ . 1 . 2]" 1
738 1 89 GLU HA 1 92 ALA MB 1.800 . 5.000 2.633 2.282 3.101 . 0 0 "[ . 1 . 2]" 1
739 1 89 GLU HA 1 92 ALA H 1.800 . 4.000 3.503 3.253 3.978 . 0 0 "[ . 1 . 2]" 1
740 1 89 GLU HA 1 93 TYR H 1.800 . 5.000 4.169 3.745 4.512 . 0 0 "[ . 1 . 2]" 1
741 1 89 GLU QG 1 92 ALA MB 1.800 . 5.000 4.520 3.964 5.000 0.000 10 0 "[ . 1 . 2]" 1
742 1 89 GLU H 1 90 ARG H 1.800 . 3.500 2.674 2.520 2.753 . 0 0 "[ . 1 . 2]" 1
743 1 89 GLU H 1 92 ALA MB 1.800 . 5.000 4.631 4.415 4.845 . 0 0 "[ . 1 . 2]" 1
744 1 90 ARG HA 1 93 TYR QB 1.800 . 5.000 3.099 2.880 3.631 . 0 0 "[ . 1 . 2]" 1
745 1 90 ARG HA 1 93 TYR H 1.800 . 4.000 3.595 3.321 3.929 . 0 0 "[ . 1 . 2]" 1
746 1 90 ARG HA 1 94 ILE QG 1.800 . 5.000 3.992 3.748 4.190 . 0 0 "[ . 1 . 2]" 1
747 1 90 ARG QB 1 94 ILE MD 1.800 . 5.000 3.432 3.068 4.515 . 0 0 "[ . 1 . 2]" 1
748 1 90 ARG H 1 91 ILE H 1.800 . 5.000 2.621 2.494 2.843 . 0 0 "[ . 1 . 2]" 1
749 1 91 ILE HA 1 94 ILE HB 1.800 . 5.000 2.966 2.745 3.437 . 0 0 "[ . 1 . 2]" 1
750 1 91 ILE HA 1 94 ILE MD 1.800 . 5.000 2.919 2.478 3.594 . 0 0 "[ . 1 . 2]" 1
751 1 91 ILE HA 1 94 ILE H 1.800 . 4.000 3.586 3.451 3.912 . 0 0 "[ . 1 . 2]" 1
752 1 91 ILE MG 1 95 LEU QB 1.800 . 5.000 3.482 2.917 4.150 . 0 0 "[ . 1 . 2]" 1
753 1 91 ILE MG 1 95 LEU QD 1.800 . 5.000 2.227 1.832 2.764 . 0 0 "[ . 1 . 2]" 1
754 1 91 ILE H 1 92 ALA H 1.800 . 5.000 2.628 2.562 2.699 . 0 0 "[ . 1 . 2]" 1
755 1 92 ALA HA 1 95 LEU QB 1.800 . 5.000 2.553 2.248 2.882 . 0 0 "[ . 1 . 2]" 1
756 1 92 ALA HA 1 95 LEU QD 1.800 . 5.000 3.058 1.831 4.155 . 0 0 "[ . 1 . 2]" 1
757 1 92 ALA HA 1 95 LEU HG 1.800 . 5.000 4.020 3.249 4.886 . 0 0 "[ . 1 . 2]" 1
758 1 92 ALA HA 1 95 LEU H 1.800 . 4.000 3.544 3.340 3.841 . 0 0 "[ . 1 . 2]" 1
759 1 92 ALA HA 1 96 LYS H 1.800 . 5.000 4.178 3.626 4.526 . 0 0 "[ . 1 . 2]" 1
760 1 92 ALA H 1 93 TYR H 1.800 . 5.000 2.762 2.674 2.884 . 0 0 "[ . 1 . 2]" 1
761 1 93 TYR HA 1 96 LYS QB 1.800 . 5.000 2.712 2.284 3.314 . 0 0 "[ . 1 . 2]" 1
762 1 93 TYR HA 1 96 LYS QD 1.800 . 5.000 3.881 2.692 5.009 0.009 13 0 "[ . 1 . 2]" 1
763 1 93 TYR HA 1 96 LYS H 1.800 . 4.000 3.391 3.083 3.740 . 0 0 "[ . 1 . 2]" 1
764 1 93 TYR QE 1 97 GLN QG 1.800 . 5.000 4.284 2.753 4.926 . 0 0 "[ . 1 . 2]" 1
765 1 93 TYR H 1 94 ILE H 1.800 . 5.000 2.635 2.504 2.718 . 0 0 "[ . 1 . 2]" 1
766 1 94 ILE HA 1 97 GLN QB 1.800 . 5.000 3.128 2.523 3.843 . 0 0 "[ . 1 . 2]" 1
767 1 94 ILE HA 1 97 GLN H 1.800 . 4.000 3.540 3.315 3.771 . 0 0 "[ . 1 . 2]" 1
768 1 94 ILE HA 1 98 ILE H 1.800 . 5.000 4.763 3.911 5.013 0.013 7 0 "[ . 1 . 2]" 1
769 1 94 ILE QG 1 97 GLN QE 1.800 . 5.000 4.652 3.532 5.016 0.016 19 0 "[ . 1 . 2]" 1
770 1 94 ILE MG 1 98 ILE MD 1.800 . 5.000 3.045 1.981 4.417 . 0 0 "[ . 1 . 2]" 1
771 1 94 ILE H 1 95 LEU H 1.800 . 5.000 2.622 2.532 2.731 . 0 0 "[ . 1 . 2]" 1
772 1 95 LEU HA 1 97 GLN H 1.800 . 5.000 4.079 3.814 4.362 . 0 0 "[ . 1 . 2]" 1
773 1 95 LEU HA 1 98 ILE HB 1.800 . 5.000 3.085 2.204 4.083 . 0 0 "[ . 1 . 2]" 1
774 1 95 LEU HA 1 98 ILE MD 1.800 . 5.000 2.555 1.798 4.856 0.002 14 0 "[ . 1 . 2]" 1
775 1 95 LEU HA 1 98 ILE QG 1.800 . 5.000 3.042 1.888 4.928 . 0 0 "[ . 1 . 2]" 1
776 1 95 LEU HA 1 98 ILE MG 1.800 . 5.000 3.859 1.795 5.001 0.005 5 0 "[ . 1 . 2]" 1
777 1 95 LEU HA 1 98 ILE H 1.800 . 4.000 3.336 3.013 3.727 . 0 0 "[ . 1 . 2]" 1
778 1 95 LEU QD 1 98 ILE MD 1.800 . 5.000 2.256 1.794 4.266 0.006 13 0 "[ . 1 . 2]" 1
779 1 95 LEU QD 1 98 ILE QG 1.800 . 5.000 3.530 2.232 4.835 . 0 0 "[ . 1 . 2]" 1
780 1 95 LEU H 1 96 LYS H 1.800 . 5.000 2.658 2.495 2.814 . 0 0 "[ . 1 . 2]" 1
781 1 96 LYS HA 1 99 ASP QB 1.800 . 5.000 2.801 1.989 4.632 . 0 0 "[ . 1 . 2]" 1
782 1 96 LYS HA 1 99 ASP H 1.800 . 4.000 3.378 2.631 4.007 0.007 4 0 "[ . 1 . 2]" 1
783 1 96 LYS H 1 97 GLN H 1.800 . 3.500 2.607 2.380 2.736 . 0 0 "[ . 1 . 2]" 1
784 1 97 GLN HA 1 100 ASN QB 1.800 . 5.000 2.775 1.853 3.797 . 0 0 "[ . 1 . 2]" 1
785 1 97 GLN HA 1 100 ASN H 1.800 . 4.000 3.179 2.628 4.004 0.004 19 0 "[ . 1 . 2]" 1
786 1 98 ILE HA 1 100 ASN H 1.800 . 5.000 4.369 3.661 5.003 0.003 3 0 "[ . 1 . 2]" 1
787 1 98 ILE HA 1 101 LYS QB 1.800 . 5.000 3.305 2.302 4.398 . 0 0 "[ . 1 . 2]" 1
788 1 98 ILE H 1 99 ASP H 1.800 . 5.000 2.520 2.381 2.695 . 0 0 "[ . 1 . 2]" 1
789 1 99 ASP HA 1 101 LYS H 1.800 . 5.000 4.293 3.426 5.006 0.006 14 0 "[ . 1 . 2]" 1
790 1 99 ASP H 1 100 ASN H 1.800 . 5.000 2.556 2.248 2.727 . 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 50
_Distance_constraint_stats_list.Viol_count 135
_Distance_constraint_stats_list.Viol_total 13.388
_Distance_constraint_stats_list.Viol_max 0.020
_Distance_constraint_stats_list.Viol_rms 0.0023
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0007
_Distance_constraint_stats_list.Viol_average_violations_only 0.0050
_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 3 THR 0.025 0.009 15 0 "[ . 1 . 2]"
1 4 ALA 0.020 0.006 5 0 "[ . 1 . 2]"
1 5 LYS 0.029 0.012 17 0 "[ . 1 . 2]"
1 12 TYR 0.061 0.013 8 0 "[ . 1 . 2]"
1 19 PHE 0.061 0.013 8 0 "[ . 1 . 2]"
1 25 GLN 0.020 0.006 5 0 "[ . 1 . 2]"
1 30 LYS 0.006 0.003 7 0 "[ . 1 . 2]"
1 31 LEU 0.008 0.002 13 0 "[ . 1 . 2]"
1 32 TYR 0.018 0.004 15 0 "[ . 1 . 2]"
1 33 GLU 0.148 0.020 3 0 "[ . 1 . 2]"
1 34 TYR 0.006 0.003 7 0 "[ . 1 . 2]"
1 35 LEU 0.008 0.002 13 0 "[ . 1 . 2]"
1 36 ASN 0.018 0.004 15 0 "[ . 1 . 2]"
1 37 GLU 0.148 0.020 3 0 "[ . 1 . 2]"
1 42 ILE 0.029 0.012 17 0 "[ . 1 . 2]"
1 44 THR 0.025 0.009 15 0 "[ . 1 . 2]"
1 59 GLU 0.015 0.005 2 0 "[ . 1 . 2]"
1 63 LYS 0.015 0.005 2 0 "[ . 1 . 2]"
1 67 LYS 0.017 0.009 1 0 "[ . 1 . 2]"
1 68 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 GLU 0.024 0.012 5 0 "[ . 1 . 2]"
1 70 HIS 0.014 0.007 16 0 "[ . 1 . 2]"
1 71 GLU 0.022 0.009 1 0 "[ . 1 . 2]"
1 72 SER 0.022 0.009 19 0 "[ . 1 . 2]"
1 73 ILE 0.168 0.015 16 0 "[ . 1 . 2]"
1 74 ILE 0.014 0.007 16 0 "[ . 1 . 2]"
1 75 SER 0.005 0.002 16 0 "[ . 1 . 2]"
1 76 ASN 0.022 0.009 19 0 "[ . 1 . 2]"
1 77 LEU 0.143 0.015 16 0 "[ . 1 . 2]"
1 88 ASP 0.008 0.003 15 0 "[ . 1 . 2]"
1 89 GLU 0.018 0.005 9 0 "[ . 1 . 2]"
1 90 ARG 0.057 0.017 19 0 "[ . 1 . 2]"
1 91 ILE 0.006 0.006 9 0 "[ . 1 . 2]"
1 92 ALA 0.034 0.008 14 0 "[ . 1 . 2]"
1 93 TYR 0.018 0.005 9 0 "[ . 1 . 2]"
1 94 ILE 0.057 0.017 19 0 "[ . 1 . 2]"
1 95 LEU 0.006 0.006 9 0 "[ . 1 . 2]"
1 96 LYS 0.026 0.008 14 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 3 THR O 1 44 THR H 1.800 . 2.300 1.875 1.797 2.141 0.003 12 0 "[ . 1 . 2]" 2
2 1 3 THR O 1 44 THR N 2.700 2.700 3.300 2.808 2.714 3.107 . 0 0 "[ . 1 . 2]" 2
3 1 4 ALA O 1 25 GLN H 1.800 . 2.300 1.954 1.797 2.177 0.003 4 0 "[ . 1 . 2]" 2
4 1 4 ALA O 1 25 GLN N 2.700 2.700 3.300 2.899 2.772 3.055 . 0 0 "[ . 1 . 2]" 2
5 1 5 LYS O 1 42 ILE H 1.800 . 2.400 1.895 1.797 2.106 0.003 13 0 "[ . 1 . 2]" 2
6 1 5 LYS O 1 42 ILE N 2.700 2.700 3.300 2.813 2.718 2.996 . 0 0 "[ . 1 . 2]" 2
7 1 12 TYR O 1 19 PHE H 1.800 . 2.300 1.851 1.787 2.014 0.013 8 0 "[ . 1 . 2]" 2
8 1 12 TYR O 1 19 PHE N 2.700 2.700 3.300 2.779 2.719 2.905 . 0 0 "[ . 1 . 2]" 2
9 1 12 TYR H 1 19 PHE O 1.800 . 2.300 1.864 1.791 2.041 0.009 1 0 "[ . 1 . 2]" 2
10 1 12 TYR N 1 19 PHE O 2.700 2.700 3.300 2.821 2.739 3.007 . 0 0 "[ . 1 . 2]" 2
11 1 4 ALA H 1 25 GLN O 1.800 . 2.300 1.849 1.794 2.050 0.006 5 0 "[ . 1 . 2]" 2
12 1 4 ALA N 1 25 GLN O 2.700 2.700 3.300 2.808 2.745 3.008 . 0 0 "[ . 1 . 2]" 2
13 1 30 LYS O 1 34 TYR H 1.800 . 2.300 2.075 1.804 2.303 0.003 7 0 "[ . 1 . 2]" 2
14 1 30 LYS O 1 34 TYR N 2.700 2.700 3.300 2.981 2.739 3.211 . 0 0 "[ . 1 . 2]" 2
15 1 31 LEU O 1 35 LEU H 1.800 . 2.300 1.846 1.798 2.041 0.002 13 0 "[ . 1 . 2]" 2
16 1 31 LEU O 1 35 LEU N 2.700 2.700 3.300 2.771 2.698 2.856 0.002 17 0 "[ . 1 . 2]" 2
17 1 32 TYR O 1 36 ASN H 1.800 . 2.300 2.205 1.918 2.304 0.004 15 0 "[ . 1 . 2]" 2
18 1 32 TYR O 1 36 ASN N 2.700 2.700 3.300 2.899 2.723 3.056 . 0 0 "[ . 1 . 2]" 2
19 1 33 GLU O 1 37 GLU H 1.800 . 2.300 2.304 2.227 2.320 0.020 3 0 "[ . 1 . 2]" 2
20 1 33 GLU O 1 37 GLU N 2.700 2.700 3.300 3.123 3.017 3.224 . 0 0 "[ . 1 . 2]" 2
21 1 5 LYS H 1 42 ILE O 1.800 . 2.300 2.084 1.788 2.304 0.012 17 0 "[ . 1 . 2]" 2
22 1 5 LYS N 1 42 ILE O 2.700 2.700 3.300 2.969 2.771 3.150 . 0 0 "[ . 1 . 2]" 2
23 1 3 THR H 1 44 THR O 1.800 . 2.300 2.003 1.791 2.233 0.009 15 0 "[ . 1 . 2]" 2
24 1 3 THR N 1 44 THR O 2.700 2.700 3.300 2.923 2.770 3.140 . 0 0 "[ . 1 . 2]" 2
25 1 59 GLU O 1 63 LYS H 1.800 . 2.300 2.118 1.911 2.305 0.005 2 0 "[ . 1 . 2]" 2
26 1 59 GLU O 1 63 LYS N 2.700 2.700 3.300 2.841 2.697 3.184 0.003 1 0 "[ . 1 . 2]" 2
27 1 67 LYS O 1 71 GLU H 1.800 . 2.300 2.030 1.792 2.309 0.009 1 0 "[ . 1 . 2]" 2
28 1 67 LYS O 1 71 GLU N 2.700 2.700 3.300 2.959 2.763 3.225 . 0 0 "[ . 1 . 2]" 2
29 1 68 ALA O 1 72 SER H 1.800 . 2.300 1.996 1.861 2.263 . 0 0 "[ . 1 . 2]" 2
30 1 68 ALA O 1 72 SER N 2.700 2.700 3.300 2.945 2.814 3.191 . 0 0 "[ . 1 . 2]" 2
31 1 69 GLU O 1 73 ILE H 1.800 . 2.300 1.947 1.794 2.312 0.012 5 0 "[ . 1 . 2]" 2
32 1 69 GLU O 1 73 ILE N 2.700 2.700 3.300 2.891 2.693 3.242 0.007 2 0 "[ . 1 . 2]" 2
33 1 70 HIS O 1 74 ILE H 1.800 . 2.300 2.148 1.949 2.307 0.007 16 0 "[ . 1 . 2]" 2
34 1 70 HIS O 1 74 ILE N 2.700 2.700 3.300 3.119 2.925 3.284 . 0 0 "[ . 1 . 2]" 2
35 1 71 GLU O 1 75 SER H 1.800 . 2.300 2.114 1.930 2.302 0.002 16 0 "[ . 1 . 2]" 2
36 1 71 GLU O 1 75 SER N 2.700 2.700 3.300 2.958 2.759 3.157 . 0 0 "[ . 1 . 2]" 2
37 1 72 SER O 1 76 ASN H 1.800 . 2.300 2.201 1.914 2.309 0.009 19 0 "[ . 1 . 2]" 2
38 1 72 SER O 1 76 ASN N 2.700 2.700 3.300 3.064 2.779 3.190 . 0 0 "[ . 1 . 2]" 2
39 1 73 ILE O 1 77 LEU H 1.800 . 2.300 2.278 2.069 2.315 0.015 16 0 "[ . 1 . 2]" 2
40 1 73 ILE O 1 77 LEU N 2.700 2.700 3.300 3.143 2.823 3.227 . 0 0 "[ . 1 . 2]" 2
41 1 88 ASP O 1 92 ALA H 1.800 . 2.300 1.881 1.797 2.097 0.003 15 0 "[ . 1 . 2]" 2
42 1 88 ASP O 1 92 ALA N 2.700 2.700 3.300 2.824 2.700 3.047 0.000 15 0 "[ . 1 . 2]" 2
43 1 89 GLU O 1 93 TYR H 1.800 . 2.300 2.149 1.881 2.305 0.005 9 0 "[ . 1 . 2]" 2
44 1 89 GLU O 1 93 TYR N 2.700 2.700 3.300 3.058 2.790 3.253 . 0 0 "[ . 1 . 2]" 2
45 1 90 ARG O 1 94 ILE H 1.800 . 2.300 2.243 1.833 2.317 0.017 19 0 "[ . 1 . 2]" 2
46 1 90 ARG O 1 94 ILE N 2.700 2.700 3.300 3.183 2.801 3.301 0.001 19 0 "[ . 1 . 2]" 2
47 1 91 ILE O 1 95 LEU H 1.800 . 2.300 1.876 1.794 2.029 0.006 9 0 "[ . 1 . 2]" 2
48 1 91 ILE O 1 95 LEU N 2.700 2.700 3.300 2.819 2.731 2.945 . 0 0 "[ . 1 . 2]" 2
49 1 92 ALA O 1 96 LYS H 1.800 . 2.300 2.124 1.816 2.308 0.008 14 0 "[ . 1 . 2]" 2
50 1 92 ALA O 1 96 LYS N 2.700 2.700 3.300 2.926 2.695 3.166 0.005 15 0 "[ . 1 . 2]" 2
stop_
save_