NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
383345 |
1jun   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1jun
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 50
_Distance_constraint_stats_list.Viol_count 0
_Distance_constraint_stats_list.Viol_total 0.000
_Distance_constraint_stats_list.Viol_max 0.000
_Distance_constraint_stats_list.Viol_rms 0.0000
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0000
_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 6 ILE 0.000 0.000 . 0 "[ . ]"
1 9 LEU 0.000 0.000 . 0 "[ . ]"
1 13 VAL 0.000 0.000 . 0 "[ . ]"
1 16 LEU 0.000 0.000 . 0 "[ . ]"
1 17 LYS 0.000 0.000 . 0 "[ . ]"
1 19 GLN 0.000 0.000 . 0 "[ . ]"
1 20 ASN 0.000 0.000 . 0 "[ . ]"
1 23 LEU 0.000 0.000 . 0 "[ . ]"
1 24 ALA 0.000 0.000 . 0 "[ . ]"
1 26 THR 0.000 0.000 . 0 "[ . ]"
1 27 ALA 0.000 0.000 . 0 "[ . ]"
1 30 LEU 0.000 0.000 . 0 "[ . ]"
1 31 ARG 0.000 0.000 . 0 "[ . ]"
1 33 GLN 0.000 0.000 . 0 "[ . ]"
1 34 VAL 0.000 0.000 . 0 "[ . ]"
1 37 LEU 0.000 0.000 . 0 "[ . ]"
2 6 ILE 0.000 0.000 . 0 "[ . ]"
2 9 LEU 0.000 0.000 . 0 "[ . ]"
2 13 VAL 0.000 0.000 . 0 "[ . ]"
2 16 LEU 0.000 0.000 . 0 "[ . ]"
2 17 LYS 0.000 0.000 . 0 "[ . ]"
2 19 GLN 0.000 0.000 . 0 "[ . ]"
2 20 ASN 0.000 0.000 . 0 "[ . ]"
2 23 LEU 0.000 0.000 . 0 "[ . ]"
2 24 ALA 0.000 0.000 . 0 "[ . ]"
2 26 THR 0.000 0.000 . 0 "[ . ]"
2 27 ALA 0.000 0.000 . 0 "[ . ]"
2 30 LEU 0.000 0.000 . 0 "[ . ]"
2 31 ARG 0.000 0.000 . 0 "[ . ]"
2 33 GLN 0.000 0.000 . 0 "[ . ]"
2 34 VAL 0.000 0.000 . 0 "[ . ]"
2 37 LEU 0.000 0.000 . 0 "[ . ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 19 GLN QG 2 20 ASN QD 0.000 . 6.000 3.900 1.833 5.046 . 0 0 "[ . ]" 1
2 1 23 LEU QD 2 24 ALA HA 0.000 . 3.300 2.039 1.770 3.057 . 0 0 "[ . ]" 1
3 1 30 LEU QD 2 31 ARG HA 0.000 . 3.300 2.773 2.169 3.209 . 0 0 "[ . ]" 1
4 1 30 LEU QD 2 31 ARG QD 0.000 . 6.000 3.460 1.868 5.083 . 0 0 "[ . ]" 1
5 1 30 LEU QD 2 31 ARG HE 0.000 . 6.000 4.268 3.554 5.236 . 0 0 "[ . ]" 1
6 1 20 ASN QD 2 19 GLN QG 0.000 . 6.000 4.160 2.707 5.618 . 0 0 "[ . ]" 1
7 1 24 ALA HA 2 23 LEU QD 0.000 . 3.300 2.034 1.781 3.014 . 0 0 "[ . ]" 1
8 1 31 ARG HA 2 30 LEU QD 0.000 . 3.300 2.769 2.116 3.248 . 0 0 "[ . ]" 1
9 1 31 ARG HD3 2 30 LEU QD 0.000 . 6.000 3.982 1.962 5.722 . 0 0 "[ . ]" 1
10 1 31 ARG HE 2 30 LEU QD 0.000 . 6.000 4.263 3.530 5.196 . 0 0 "[ . ]" 1
11 1 13 VAL HA 2 13 VAL QG 0.000 . 5.000 3.218 2.654 3.817 . 0 0 "[ . ]" 1
12 1 16 LEU QB 2 16 LEU QD 0.000 . 5.000 2.368 1.627 3.008 . 0 0 "[ . ]" 1
13 1 16 LEU QB 2 17 LYS QD 0.000 . 5.000 4.430 3.928 4.833 . 0 0 "[ . ]" 1
14 1 16 LEU QD 2 20 ASN QD 0.000 . 5.000 2.944 2.177 4.332 . 0 0 "[ . ]" 1
15 1 9 LEU QD 2 6 ILE HA 0.000 . 5.000 3.933 2.954 4.915 . 0 0 "[ . ]" 1
16 1 16 LEU QD 2 17 LYS H 0.000 . 5.000 3.280 2.872 4.020 . 0 0 "[ . ]" 1
17 1 30 LEU QB 2 27 ALA HA 0.000 . 5.000 4.068 3.674 4.530 . 0 0 "[ . ]" 1
18 1 23 LEU QB 2 24 ALA H 0.000 . 5.000 4.183 3.688 4.817 . 0 0 "[ . ]" 1
19 1 23 LEU QD 2 24 ALA H 0.000 . 5.000 3.160 2.587 3.652 . 0 0 "[ . ]" 1
20 1 23 LEU QD 2 24 ALA MB 0.000 . 5.000 2.337 1.893 3.163 . 0 0 "[ . ]" 1
21 1 26 THR HB 2 27 ALA MB 0.000 . 5.000 3.404 2.791 3.854 . 0 0 "[ . ]" 1
22 1 26 THR MG 2 27 ALA MB 0.000 . 5.000 2.982 2.617 3.313 . 0 0 "[ . ]" 1
23 1 27 ALA HA 2 27 ALA MB 0.000 . 5.000 3.289 2.411 4.293 . 0 0 "[ . ]" 1
24 1 27 ALA HA 2 30 LEU MD1 0.000 . 5.000 2.741 2.514 3.070 . 0 0 "[ . ]" 1
25 1 33 GLN QG 2 34 VAL QG 0.000 . 5.000 3.124 2.544 3.928 . 0 0 "[ . ]" 1
26 1 30 LEU HA 2 34 VAL QG 0.000 . 5.000 3.518 3.052 4.130 . 0 0 "[ . ]" 1
27 1 30 LEU HA 2 34 VAL QG 0.000 . 5.000 3.562 3.085 4.175 . 0 0 "[ . ]" 1
28 1 30 LEU H 2 30 LEU MD1 0.000 . 5.000 4.072 3.752 4.521 . 0 0 "[ . ]" 1
29 1 30 LEU QD 2 31 ARG H 0.000 . 5.000 3.153 2.477 3.547 . 0 0 "[ . ]" 1
30 1 37 LEU QB 2 37 LEU QD 0.000 . 5.000 3.174 1.923 3.956 . 0 0 "[ . ]" 1
31 1 13 VAL QG 2 13 VAL HA 0.000 . 5.000 3.219 2.704 3.813 . 0 0 "[ . ]" 1
32 1 16 LEU QD 2 16 LEU QB 0.000 . 5.000 2.368 1.651 3.029 . 0 0 "[ . ]" 1
33 1 17 LYS QD 2 16 LEU QB 0.000 . 5.000 4.429 3.928 4.811 . 0 0 "[ . ]" 1
34 1 20 ASN QD 2 16 LEU QD 0.000 . 5.000 3.300 2.042 5.000 . 0 0 "[ . ]" 1
35 1 6 ILE HA 2 9 LEU QD 0.000 . 5.000 3.933 2.950 4.921 . 0 0 "[ . ]" 1
36 1 17 LYS H 2 16 LEU QD 0.000 . 5.000 3.277 2.877 3.975 . 0 0 "[ . ]" 1
37 1 27 ALA HA 2 30 LEU QB 0.000 . 5.000 4.070 3.644 4.529 . 0 0 "[ . ]" 1
38 1 24 ALA H 2 23 LEU QB 0.000 . 5.000 4.177 3.666 4.806 . 0 0 "[ . ]" 1
39 1 24 ALA H 2 23 LEU QD 0.000 . 5.000 3.157 2.621 3.634 . 0 0 "[ . ]" 1
40 1 24 ALA MB 2 23 LEU QD 0.000 . 5.000 2.332 1.920 3.119 . 0 0 "[ . ]" 1
41 1 27 ALA MB 2 26 THR HB 0.000 . 5.000 3.405 2.783 3.820 . 0 0 "[ . ]" 1
42 1 27 ALA MB 2 26 THR MG 0.000 . 5.000 2.982 2.571 3.388 . 0 0 "[ . ]" 1
43 1 27 ALA MB 2 27 ALA HA 0.000 . 5.000 3.285 2.358 4.278 . 0 0 "[ . ]" 1
44 1 30 LEU MD1 2 27 ALA HA 0.000 . 5.000 2.740 2.513 3.094 . 0 0 "[ . ]" 1
45 1 34 VAL QG 2 33 GLN QG 0.000 . 5.000 3.121 2.569 3.971 . 0 0 "[ . ]" 1
46 1 34 VAL QG 2 30 LEU HA 0.000 . 5.000 3.520 3.026 4.160 . 0 0 "[ . ]" 1
47 1 34 VAL QG 2 30 LEU HA 0.000 . 5.000 3.565 3.059 4.204 . 0 0 "[ . ]" 1
48 1 30 LEU MD1 2 30 LEU H 0.000 . 5.000 4.074 3.748 4.530 . 0 0 "[ . ]" 1
49 1 31 ARG H 2 30 LEU QD 0.000 . 5.000 3.150 2.458 3.507 . 0 0 "[ . ]" 1
50 1 37 LEU QD 2 37 LEU QB 0.000 . 5.000 3.178 1.958 3.929 . 0 0 "[ . ]" 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 656
_Distance_constraint_stats_list.Viol_count 2
_Distance_constraint_stats_list.Viol_total 0.070
_Distance_constraint_stats_list.Viol_max 0.006
_Distance_constraint_stats_list.Viol_rms 0.0001
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_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 2 CYS 0.000 0.000 . 0 "[ . ]"
1 3 GLY 0.000 0.000 . 0 "[ . ]"
1 4 GLY 0.000 0.000 . 0 "[ . ]"
1 5 ARG 0.000 0.000 . 0 "[ . ]"
1 6 ILE 0.000 0.000 . 0 "[ . ]"
1 7 ALA 0.000 0.000 . 0 "[ . ]"
1 8 ARG 0.000 0.000 . 0 "[ . ]"
1 9 LEU 0.000 0.000 . 0 "[ . ]"
1 10 GLU 0.000 0.000 . 0 "[ . ]"
1 11 GLU 0.006 0.006 6 0 "[ . ]"
1 12 LYS 0.000 0.000 . 0 "[ . ]"
1 13 VAL 0.006 0.006 6 0 "[ . ]"
1 14 LYS 0.000 0.000 . 0 "[ . ]"
1 15 THR 0.000 0.000 . 0 "[ . ]"
1 16 LEU 0.000 0.000 . 0 "[ . ]"
1 17 LYS 0.000 0.000 . 0 "[ . ]"
1 18 ALA 0.000 0.000 . 0 "[ . ]"
1 19 GLN 0.000 0.000 . 0 "[ . ]"
1 20 ASN 0.000 0.000 . 0 "[ . ]"
1 21 SER 0.000 0.000 . 0 "[ . ]"
1 22 GLU 0.000 0.000 . 0 "[ . ]"
1 23 LEU 0.000 0.000 . 0 "[ . ]"
1 24 ALA 0.000 0.000 . 0 "[ . ]"
1 25 SER 0.000 0.000 . 0 "[ . ]"
1 26 THR 0.000 0.000 . 0 "[ . ]"
1 27 ALA 0.000 0.000 . 0 "[ . ]"
1 28 ASN 0.000 0.000 . 0 "[ . ]"
1 29 MET 0.000 0.000 . 0 "[ . ]"
1 30 LEU 0.000 0.000 . 0 "[ . ]"
1 31 ARG 0.000 0.000 . 0 "[ . ]"
1 32 GLU 0.000 0.000 . 0 "[ . ]"
1 33 GLN 0.000 0.000 . 0 "[ . ]"
1 34 VAL 0.000 0.000 . 0 "[ . ]"
1 35 ALA 0.000 0.000 . 0 "[ . ]"
1 36 GLN 0.000 0.000 . 0 "[ . ]"
1 37 LEU 0.000 0.000 . 0 "[ . ]"
1 38 LYS 0.000 0.000 . 0 "[ . ]"
1 39 GLN 0.000 0.000 . 0 "[ . ]"
1 40 LYS 0.000 0.000 . 0 "[ . ]"
1 41 VAL 0.000 0.000 . 0 "[ . ]"
1 42 MET 0.000 0.000 . 0 "[ . ]"
1 43 ASN 0.000 0.000 . 0 "[ . ]"
1 44 TYR 0.000 0.000 . 0 "[ . ]"
2 2 CYS 0.000 0.000 . 0 "[ . ]"
2 3 GLY 0.000 0.000 . 0 "[ . ]"
2 4 GLY 0.000 0.000 . 0 "[ . ]"
2 5 ARG 0.000 0.000 . 0 "[ . ]"
2 6 ILE 0.000 0.000 . 0 "[ . ]"
2 7 ALA 0.000 0.000 . 0 "[ . ]"
2 8 ARG 0.000 0.000 . 0 "[ . ]"
2 9 LEU 0.000 0.000 . 0 "[ . ]"
2 10 GLU 0.000 0.000 . 0 "[ . ]"
2 11 GLU 0.004 0.004 6 0 "[ . ]"
2 12 LYS 0.000 0.000 . 0 "[ . ]"
2 13 VAL 0.004 0.004 6 0 "[ . ]"
2 14 LYS 0.000 0.000 . 0 "[ . ]"
2 15 THR 0.000 0.000 . 0 "[ . ]"
2 16 LEU 0.000 0.000 . 0 "[ . ]"
2 17 LYS 0.000 0.000 . 0 "[ . ]"
2 18 ALA 0.000 0.000 . 0 "[ . ]"
2 19 GLN 0.000 0.000 . 0 "[ . ]"
2 20 ASN 0.000 0.000 . 0 "[ . ]"
2 21 SER 0.000 0.000 . 0 "[ . ]"
2 22 GLU 0.000 0.000 . 0 "[ . ]"
2 23 LEU 0.000 0.000 . 0 "[ . ]"
2 24 ALA 0.000 0.000 . 0 "[ . ]"
2 25 SER 0.000 0.000 . 0 "[ . ]"
2 26 THR 0.000 0.000 . 0 "[ . ]"
2 27 ALA 0.000 0.000 . 0 "[ . ]"
2 28 ASN 0.000 0.000 . 0 "[ . ]"
2 29 MET 0.000 0.000 . 0 "[ . ]"
2 30 LEU 0.000 0.000 . 0 "[ . ]"
2 31 ARG 0.000 0.000 . 0 "[ . ]"
2 32 GLU 0.000 0.000 . 0 "[ . ]"
2 33 GLN 0.000 0.000 . 0 "[ . ]"
2 34 VAL 0.000 0.000 . 0 "[ . ]"
2 35 ALA 0.000 0.000 . 0 "[ . ]"
2 36 GLN 0.000 0.000 . 0 "[ . ]"
2 37 LEU 0.000 0.000 . 0 "[ . ]"
2 38 LYS 0.000 0.000 . 0 "[ . ]"
2 39 GLN 0.000 0.000 . 0 "[ . ]"
2 40 LYS 0.000 0.000 . 0 "[ . ]"
2 41 VAL 0.000 0.000 . 0 "[ . ]"
2 42 MET 0.000 0.000 . 0 "[ . ]"
2 43 ASN 0.000 0.000 . 0 "[ . ]"
2 44 TYR 0.000 0.000 . 0 "[ . ]"
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 11 GLU HA 1 13 VAL H 0.000 . 5.000 4.597 4.240 5.006 0.006 6 0 "[ . ]" 2
2 2 11 GLU HA 2 13 VAL H 0.000 . 5.000 4.597 4.230 5.004 0.004 6 0 "[ . ]" 2
3 1 11 GLU H 1 12 LYS QB 0.000 . 5.000 4.370 4.230 4.480 . 0 0 "[ . ]" 2
4 2 11 GLU H 2 12 LYS QB 0.000 . 5.000 4.369 4.225 4.484 . 0 0 "[ . ]" 2
5 1 13 VAL HB 1 14 LYS HA 0.000 . 5.000 4.385 4.204 4.487 . 0 0 "[ . ]" 2
6 2 13 VAL HB 2 14 LYS HA 0.000 . 5.000 4.386 4.201 4.489 . 0 0 "[ . ]" 2
7 1 12 LYS HA 1 16 LEU H 0.000 . 7.000 4.108 3.929 4.264 . 0 0 "[ . ]" 2
8 2 12 LYS HA 2 16 LEU H 0.000 . 7.000 4.110 3.939 4.262 . 0 0 "[ . ]" 2
9 1 12 LYS H 1 13 VAL HA 0.000 . 7.000 5.241 5.153 5.313 . 0 0 "[ . ]" 2
10 2 12 LYS H 2 13 VAL HA 0.000 . 7.000 5.240 5.154 5.312 . 0 0 "[ . ]" 2
11 1 12 LYS H 1 13 VAL H 0.000 . 3.300 2.626 2.504 2.746 . 0 0 "[ . ]" 2
12 2 12 LYS H 2 13 VAL H 0.000 . 3.300 2.626 2.508 2.744 . 0 0 "[ . ]" 2
13 1 12 LYS H 1 16 LEU H 0.000 . 7.000 6.087 5.794 6.245 . 0 0 "[ . ]" 2
14 2 12 LYS H 2 16 LEU H 0.000 . 7.000 6.089 5.796 6.245 . 0 0 "[ . ]" 2
15 1 13 VAL HA 1 14 LYS HA 0.000 . 7.000 4.752 4.716 4.807 . 0 0 "[ . ]" 2
16 2 13 VAL HA 2 14 LYS HA 0.000 . 7.000 4.752 4.715 4.808 . 0 0 "[ . ]" 2
17 1 13 VAL HA 1 15 THR H 0.000 . 7.000 4.747 4.461 5.087 . 0 0 "[ . ]" 2
18 2 13 VAL HA 2 15 THR H 0.000 . 7.000 4.752 4.464 5.086 . 0 0 "[ . ]" 2
19 1 13 VAL HA 1 16 LEU H 0.000 . 5.000 3.559 3.416 3.661 . 0 0 "[ . ]" 2
20 2 13 VAL HA 2 16 LEU H 0.000 . 5.000 3.561 3.419 3.661 . 0 0 "[ . ]" 2
21 1 13 VAL HA 1 17 LYS H 0.000 . 7.000 4.084 3.874 4.262 . 0 0 "[ . ]" 2
22 2 13 VAL HA 2 17 LYS H 0.000 . 7.000 4.088 3.874 4.268 . 0 0 "[ . ]" 2
23 1 13 VAL H 1 16 LEU H 0.000 . 7.000 4.845 4.676 4.953 . 0 0 "[ . ]" 2
24 2 13 VAL H 2 16 LEU H 0.000 . 7.000 4.847 4.681 4.957 . 0 0 "[ . ]" 2
25 1 14 LYS HA 1 15 THR H 0.000 . 5.000 3.581 3.565 3.592 . 0 0 "[ . ]" 2
26 2 14 LYS HA 2 15 THR H 0.000 . 5.000 3.581 3.565 3.592 . 0 0 "[ . ]" 2
27 1 14 LYS HA 1 16 LEU H 0.000 . 7.000 4.368 4.201 4.555 . 0 0 "[ . ]" 2
28 2 14 LYS HA 2 16 LEU H 0.000 . 7.000 4.367 4.192 4.570 . 0 0 "[ . ]" 2
29 1 14 LYS HA 1 17 LYS H 0.000 . 5.000 3.468 3.359 3.613 . 0 0 "[ . ]" 2
30 2 14 LYS HA 2 17 LYS H 0.000 . 5.000 3.464 3.353 3.617 . 0 0 "[ . ]" 2
31 1 14 LYS HA 1 17 LYS QB 0.000 . 3.300 2.649 2.391 2.916 . 0 0 "[ . ]" 2
32 2 14 LYS HA 2 17 LYS QB 0.000 . 3.300 2.647 2.388 2.914 . 0 0 "[ . ]" 2
33 1 14 LYS HA 1 18 ALA H 0.000 . 5.000 4.341 4.154 4.536 . 0 0 "[ . ]" 2
34 2 14 LYS HA 2 18 ALA H 0.000 . 5.000 4.343 4.161 4.545 . 0 0 "[ . ]" 2
35 1 14 LYS H 1 15 THR H 0.000 . 3.300 2.690 2.537 2.800 . 0 0 "[ . ]" 2
36 2 14 LYS H 2 15 THR H 0.000 . 3.300 2.694 2.532 2.800 . 0 0 "[ . ]" 2
37 1 14 LYS H 1 16 LEU H 0.000 . 7.000 3.983 3.705 4.266 . 0 0 "[ . ]" 2
38 2 14 LYS H 2 16 LEU H 0.000 . 7.000 3.983 3.701 4.265 . 0 0 "[ . ]" 2
39 1 14 LYS H 1 17 LYS H 0.000 . 7.000 4.745 4.597 4.868 . 0 0 "[ . ]" 2
40 2 14 LYS H 2 17 LYS H 0.000 . 7.000 4.742 4.592 4.862 . 0 0 "[ . ]" 2
41 1 14 LYS QB 1 16 LEU H 0.000 . 7.000 4.553 4.304 4.699 . 0 0 "[ . ]" 2
42 2 14 LYS QB 2 16 LEU H 0.000 . 7.000 4.550 4.296 4.693 . 0 0 "[ . ]" 2
43 1 15 THR HA 1 16 LEU H 0.000 . 5.000 3.556 3.520 3.576 . 0 0 "[ . ]" 2
44 2 15 THR HA 2 16 LEU H 0.000 . 5.000 3.555 3.521 3.577 . 0 0 "[ . ]" 2
45 1 19 GLN H 1 19 GLN QB 0.000 . 3.300 2.357 2.178 2.543 . 0 0 "[ . ]" 2
46 2 19 GLN H 2 19 GLN QB 0.000 . 3.300 2.355 2.186 2.538 . 0 0 "[ . ]" 2
47 1 15 THR H 1 16 LEU H 0.000 . 3.300 2.787 2.611 2.859 . 0 0 "[ . ]" 2
48 2 15 THR H 2 16 LEU H 0.000 . 3.300 2.790 2.611 2.869 . 0 0 "[ . ]" 2
49 1 16 LEU HA 1 17 LYS H 0.000 . 7.000 3.580 3.568 3.587 . 0 0 "[ . ]" 2
50 2 16 LEU HA 2 17 LYS H 0.000 . 7.000 3.580 3.570 3.586 . 0 0 "[ . ]" 2
51 1 16 LEU QB 1 20 ASN H 0.000 . 7.000 4.814 4.540 4.969 . 0 0 "[ . ]" 2
52 2 16 LEU QB 2 20 ASN H 0.000 . 7.000 4.817 4.540 4.972 . 0 0 "[ . ]" 2
53 1 16 LEU H 1 17 LYS H 0.000 . 3.300 2.827 2.694 2.948 . 0 0 "[ . ]" 2
54 2 16 LEU H 2 17 LYS H 0.000 . 3.300 2.826 2.698 2.955 . 0 0 "[ . ]" 2
55 1 16 LEU H 1 17 LYS QB 0.000 . 7.000 4.418 4.317 4.522 . 0 0 "[ . ]" 2
56 2 16 LEU H 2 17 LYS QB 0.000 . 7.000 4.419 4.321 4.528 . 0 0 "[ . ]" 2
57 1 16 LEU H 1 18 ALA H 0.000 . 7.000 4.042 3.756 4.423 . 0 0 "[ . ]" 2
58 2 16 LEU H 2 18 ALA H 0.000 . 7.000 4.035 3.747 4.419 . 0 0 "[ . ]" 2
59 1 16 LEU H 1 18 ALA MB 0.000 . 7.000 4.548 4.321 4.846 . 0 0 "[ . ]" 2
60 2 16 LEU H 2 18 ALA MB 0.000 . 7.000 4.545 4.317 4.842 . 0 0 "[ . ]" 2
61 1 16 LEU H 1 20 ASN H 0.000 . 7.000 6.172 5.969 6.376 . 0 0 "[ . ]" 2
62 2 16 LEU H 2 20 ASN H 0.000 . 7.000 6.165 5.957 6.359 . 0 0 "[ . ]" 2
63 1 17 LYS HA 1 21 SER H 0.000 . 5.000 4.187 3.918 4.468 . 0 0 "[ . ]" 2
64 2 17 LYS HA 2 21 SER H 0.000 . 5.000 4.181 3.893 4.483 . 0 0 "[ . ]" 2
65 1 17 LYS HA 1 18 ALA H 0.000 . 7.000 3.534 3.459 3.581 . 0 0 "[ . ]" 2
66 2 17 LYS HA 2 18 ALA H 0.000 . 7.000 3.534 3.455 3.581 . 0 0 "[ . ]" 2
67 1 17 LYS HA 1 20 ASN QB 0.000 . 3.300 2.435 2.296 2.572 . 0 0 "[ . ]" 2
68 2 17 LYS HA 2 20 ASN QB 0.000 . 3.300 2.351 2.188 2.527 . 0 0 "[ . ]" 2
69 1 17 LYS HA 1 20 ASN H 0.000 . 5.000 3.485 3.388 3.655 . 0 0 "[ . ]" 2
70 2 17 LYS HA 2 20 ASN H 0.000 . 5.000 3.488 3.382 3.647 . 0 0 "[ . ]" 2
71 1 17 LYS H 1 18 ALA H 0.000 . 3.300 2.801 2.646 2.933 . 0 0 "[ . ]" 2
72 2 17 LYS H 2 18 ALA H 0.000 . 3.300 2.796 2.637 2.933 . 0 0 "[ . ]" 2
73 1 17 LYS QB 1 20 ASN H 0.000 . 7.000 4.825 4.681 4.961 . 0 0 "[ . ]" 2
74 2 17 LYS QB 2 20 ASN H 0.000 . 7.000 4.825 4.685 4.933 . 0 0 "[ . ]" 2
75 1 18 ALA H 1 19 GLN H 0.000 . 3.300 2.958 2.797 3.084 . 0 0 "[ . ]" 2
76 2 18 ALA H 2 19 GLN H 0.000 . 3.300 2.958 2.798 3.092 . 0 0 "[ . ]" 2
77 1 18 ALA H 1 20 ASN H 0.000 . 7.000 3.904 3.500 4.056 . 0 0 "[ . ]" 2
78 2 18 ALA H 2 20 ASN H 0.000 . 7.000 3.891 3.455 4.120 . 0 0 "[ . ]" 2
79 1 18 ALA H 1 21 SER H 0.000 . 7.000 4.871 4.784 4.965 . 0 0 "[ . ]" 2
80 2 18 ALA H 2 21 SER H 0.000 . 7.000 4.871 4.786 5.016 . 0 0 "[ . ]" 2
81 1 18 ALA MB 1 22 GLU H 0.000 . 7.000 4.679 4.512 4.892 . 0 0 "[ . ]" 2
82 2 18 ALA MB 2 22 GLU H 0.000 . 7.000 4.684 4.509 4.895 . 0 0 "[ . ]" 2
83 1 19 GLN H 1 20 ASN QB 0.000 . 7.000 4.547 4.415 4.598 . 0 0 "[ . ]" 2
84 2 19 GLN H 2 20 ASN QB 0.000 . 7.000 4.545 4.408 4.633 . 0 0 "[ . ]" 2
85 1 19 GLN H 1 20 ASN H 0.000 . 3.300 2.832 2.707 2.904 . 0 0 "[ . ]" 2
86 2 19 GLN H 2 20 ASN H 0.000 . 3.300 2.824 2.678 2.909 . 0 0 "[ . ]" 2
87 1 19 GLN H 1 21 SER H 0.000 . 5.000 4.670 4.416 4.925 . 0 0 "[ . ]" 2
88 2 19 GLN H 2 21 SER H 0.000 . 5.000 4.679 4.429 4.897 . 0 0 "[ . ]" 2
89 1 19 GLN H 1 22 GLU H 0.000 . 7.000 4.738 4.626 4.859 . 0 0 "[ . ]" 2
90 2 19 GLN H 2 22 GLU H 0.000 . 7.000 4.741 4.632 4.865 . 0 0 "[ . ]" 2
91 1 20 ASN HA 1 21 SER H 0.000 . 7.000 3.582 3.568 3.588 . 0 0 "[ . ]" 2
92 2 20 ASN HA 2 21 SER H 0.000 . 7.000 3.582 3.571 3.590 . 0 0 "[ . ]" 2
93 1 20 ASN HA 1 22 GLU H 0.000 . 7.000 4.148 3.966 4.485 . 0 0 "[ . ]" 2
94 2 20 ASN HA 2 22 GLU H 0.000 . 7.000 4.151 3.919 4.486 . 0 0 "[ . ]" 2
95 1 20 ASN HA 1 23 LEU HA 0.000 . 7.000 6.003 5.669 6.349 . 0 0 "[ . ]" 2
96 2 20 ASN HA 2 23 LEU HA 0.000 . 7.000 6.019 5.653 6.250 . 0 0 "[ . ]" 2
97 1 20 ASN HA 1 23 LEU H 0.000 . 5.000 3.887 3.505 4.292 . 0 0 "[ . ]" 2
98 2 20 ASN HA 2 23 LEU H 0.000 . 5.000 3.898 3.490 4.196 . 0 0 "[ . ]" 2
99 1 20 ASN H 1 21 SER H 0.000 . 5.000 2.843 2.660 3.047 . 0 0 "[ . ]" 2
100 2 20 ASN H 2 21 SER H 0.000 . 5.000 2.851 2.715 3.094 . 0 0 "[ . ]" 2
101 1 20 ASN H 1 21 SER QB 0.000 . 7.000 4.775 4.411 5.295 . 0 0 "[ . ]" 2
102 2 20 ASN H 2 21 SER QB 0.000 . 7.000 4.780 4.431 5.311 . 0 0 "[ . ]" 2
103 1 20 ASN H 1 22 GLU H 0.000 . 7.000 3.833 3.620 4.016 . 0 0 "[ . ]" 2
104 2 20 ASN H 2 22 GLU H 0.000 . 7.000 3.833 3.628 4.011 . 0 0 "[ . ]" 2
105 1 21 SER HA 1 23 LEU QB 0.000 . 7.000 5.566 5.348 5.911 . 0 0 "[ . ]" 2
106 2 21 SER HA 2 23 LEU QB 0.000 . 7.000 5.565 5.354 5.915 . 0 0 "[ . ]" 2
107 1 21 SER HA 1 24 ALA H 0.000 . 5.000 3.636 3.330 4.029 . 0 0 "[ . ]" 2
108 2 21 SER HA 2 24 ALA H 0.000 . 5.000 3.632 3.339 4.018 . 0 0 "[ . ]" 2
109 1 21 SER HA 1 24 ALA MB 0.000 . 3.300 2.286 2.178 2.413 . 0 0 "[ . ]" 2
110 2 21 SER HA 2 24 ALA MB 0.000 . 3.300 2.285 2.186 2.408 . 0 0 "[ . ]" 2
111 1 21 SER H 1 22 GLU HA 0.000 . 7.000 5.251 5.170 5.436 . 0 0 "[ . ]" 2
112 2 21 SER H 2 22 GLU HA 0.000 . 7.000 5.254 5.187 5.419 . 0 0 "[ . ]" 2
113 1 21 SER H 1 22 GLU H 0.000 . 3.300 2.650 2.556 2.864 . 0 0 "[ . ]" 2
114 2 21 SER H 2 22 GLU H 0.000 . 3.300 2.654 2.574 2.843 . 0 0 "[ . ]" 2
115 1 21 SER H 1 23 LEU QB 0.000 . 7.000 5.554 5.224 5.894 . 0 0 "[ . ]" 2
116 2 21 SER H 2 23 LEU QB 0.000 . 7.000 5.562 5.219 5.884 . 0 0 "[ . ]" 2
117 1 21 SER H 1 23 LEU H 0.000 . 7.000 4.850 4.394 5.183 . 0 0 "[ . ]" 2
118 2 21 SER H 2 23 LEU H 0.000 . 7.000 4.855 4.396 5.185 . 0 0 "[ . ]" 2
119 1 21 SER H 1 24 ALA H 0.000 . 7.000 4.799 4.673 4.926 . 0 0 "[ . ]" 2
120 2 21 SER H 2 24 ALA H 0.000 . 7.000 4.802 4.671 4.901 . 0 0 "[ . ]" 2
121 1 22 GLU HA 1 25 SER H 0.000 . 5.000 3.651 3.522 3.982 . 0 0 "[ . ]" 2
122 2 22 GLU HA 2 25 SER H 0.000 . 5.000 3.648 3.516 3.988 . 0 0 "[ . ]" 2
123 1 22 GLU HA 1 26 THR H 0.000 . 7.000 4.287 3.869 4.508 . 0 0 "[ . ]" 2
124 2 22 GLU HA 2 26 THR H 0.000 . 7.000 4.289 3.879 4.503 . 0 0 "[ . ]" 2
125 1 22 GLU HA 1 23 LEU H 0.000 . 7.000 3.578 3.563 3.589 . 0 0 "[ . ]" 2
126 2 22 GLU HA 2 23 LEU H 0.000 . 7.000 3.579 3.564 3.587 . 0 0 "[ . ]" 2
127 1 22 GLU H 1 22 GLU QB 0.000 . 3.300 2.194 2.067 2.433 . 0 0 "[ . ]" 2
128 2 22 GLU H 2 22 GLU QB 0.000 . 3.300 2.193 2.069 2.430 . 0 0 "[ . ]" 2
129 1 22 GLU H 1 23 LEU QB 0.000 . 7.000 4.540 4.347 4.736 . 0 0 "[ . ]" 2
130 2 22 GLU H 2 23 LEU QB 0.000 . 7.000 4.540 4.348 4.744 . 0 0 "[ . ]" 2
131 1 22 GLU H 1 23 LEU H 0.000 . 3.300 2.914 2.658 3.113 . 0 0 "[ . ]" 2
132 2 22 GLU H 2 23 LEU H 0.000 . 3.300 2.914 2.660 3.108 . 0 0 "[ . ]" 2
133 1 22 GLU H 1 24 ALA H 0.000 . 7.000 3.843 3.548 4.340 . 0 0 "[ . ]" 2
134 2 22 GLU H 2 24 ALA H 0.000 . 7.000 3.841 3.535 4.332 . 0 0 "[ . ]" 2
135 1 22 GLU H 1 24 ALA MB 0.000 . 7.000 4.298 4.091 4.527 . 0 0 "[ . ]" 2
136 2 22 GLU H 2 24 ALA MB 0.000 . 7.000 4.300 4.093 4.527 . 0 0 "[ . ]" 2
137 1 22 GLU H 1 25 SER H 0.000 . 7.000 4.714 4.595 4.903 . 0 0 "[ . ]" 2
138 2 22 GLU H 2 25 SER H 0.000 . 7.000 4.714 4.600 4.909 . 0 0 "[ . ]" 2
139 1 22 GLU QB 1 24 ALA H 0.000 . 7.000 4.298 4.044 4.543 . 0 0 "[ . ]" 2
140 2 22 GLU QB 2 24 ALA H 0.000 . 7.000 4.296 4.036 4.540 . 0 0 "[ . ]" 2
141 1 22 GLU QB 1 26 THR H 0.000 . 7.000 4.912 4.667 5.128 . 0 0 "[ . ]" 2
142 2 22 GLU QB 2 26 THR H 0.000 . 7.000 4.912 4.673 5.134 . 0 0 "[ . ]" 2
143 1 23 LEU HA 1 24 ALA H 0.000 . 7.000 3.532 3.454 3.585 . 0 0 "[ . ]" 2
144 2 23 LEU HA 2 24 ALA H 0.000 . 7.000 3.531 3.451 3.584 . 0 0 "[ . ]" 2
145 1 23 LEU HA 1 26 THR HB 0.000 . 5.000 2.738 2.340 3.252 . 0 0 "[ . ]" 2
146 2 23 LEU HA 2 26 THR HB 0.000 . 5.000 2.739 2.342 3.247 . 0 0 "[ . ]" 2
147 1 23 LEU HA 1 26 THR H 0.000 . 5.000 3.462 3.281 3.641 . 0 0 "[ . ]" 2
148 2 23 LEU HA 2 26 THR H 0.000 . 5.000 3.458 3.289 3.646 . 0 0 "[ . ]" 2
149 1 23 LEU HA 1 27 ALA H 0.000 . 7.000 3.963 3.609 4.234 . 0 0 "[ . ]" 2
150 2 23 LEU HA 2 27 ALA H 0.000 . 7.000 3.959 3.613 4.229 . 0 0 "[ . ]" 2
151 1 23 LEU QB 1 26 THR H 0.000 . 7.000 4.964 4.801 5.185 . 0 0 "[ . ]" 2
152 2 23 LEU QB 2 26 THR H 0.000 . 7.000 4.964 4.812 5.191 . 0 0 "[ . ]" 2
153 1 23 LEU H 1 24 ALA MB 0.000 . 5.000 4.385 4.226 4.490 . 0 0 "[ . ]" 2
154 2 23 LEU H 2 24 ALA MB 0.000 . 5.000 4.384 4.223 4.489 . 0 0 "[ . ]" 2
155 1 23 LEU H 1 25 SER H 0.000 . 7.000 4.514 4.231 4.737 . 0 0 "[ . ]" 2
156 2 23 LEU H 2 25 SER H 0.000 . 7.000 4.510 4.231 4.715 . 0 0 "[ . ]" 2
157 1 24 ALA H 1 24 ALA MB 0.000 . 3.300 2.142 2.043 2.240 . 0 0 "[ . ]" 2
158 2 24 ALA H 2 24 ALA MB 0.000 . 3.300 2.144 2.046 2.240 . 0 0 "[ . ]" 2
159 1 24 ALA H 1 25 SER H 0.000 . 3.300 2.810 2.645 3.060 . 0 0 "[ . ]" 2
160 2 24 ALA H 2 25 SER H 0.000 . 3.300 2.806 2.641 3.054 . 0 0 "[ . ]" 2
161 1 24 ALA H 1 26 THR H 0.000 . 7.000 4.265 3.828 4.767 . 0 0 "[ . ]" 2
162 2 24 ALA H 2 26 THR H 0.000 . 7.000 4.264 3.826 4.762 . 0 0 "[ . ]" 2
163 1 24 ALA H 1 27 ALA H 0.000 . 7.000 4.774 4.721 4.869 . 0 0 "[ . ]" 2
164 2 24 ALA H 2 27 ALA H 0.000 . 7.000 4.776 4.720 4.866 . 0 0 "[ . ]" 2
165 1 24 ALA H 1 27 ALA MB 0.000 . 7.000 4.687 4.445 4.919 . 0 0 "[ . ]" 2
166 2 24 ALA H 2 27 ALA MB 0.000 . 7.000 4.689 4.448 4.920 . 0 0 "[ . ]" 2
167 1 24 ALA MB 1 26 THR H 0.000 . 7.000 4.552 4.320 4.895 . 0 0 "[ . ]" 2
168 2 24 ALA MB 2 26 THR H 0.000 . 7.000 4.554 4.323 4.896 . 0 0 "[ . ]" 2
169 1 24 ALA MB 1 27 ALA H 0.000 . 7.000 4.701 4.456 4.847 . 0 0 "[ . ]" 2
170 2 24 ALA MB 2 27 ALA H 0.000 . 7.000 4.705 4.459 4.845 . 0 0 "[ . ]" 2
171 1 24 ALA MB 1 28 ASN H 0.000 . 7.000 4.659 4.478 4.813 . 0 0 "[ . ]" 2
172 2 24 ALA MB 2 28 ASN H 0.000 . 7.000 4.660 4.483 4.810 . 0 0 "[ . ]" 2
173 1 25 SER H 1 25 SER QB 0.000 . 3.300 2.205 2.048 2.620 . 0 0 "[ . ]" 2
174 2 25 SER H 2 25 SER QB 0.000 . 3.300 2.205 2.045 2.621 . 0 0 "[ . ]" 2
175 1 25 SER H 1 26 THR H 0.000 . 3.300 2.790 2.626 2.946 . 0 0 "[ . ]" 2
176 2 25 SER H 2 26 THR H 0.000 . 3.300 2.787 2.624 2.942 . 0 0 "[ . ]" 2
177 1 25 SER H 1 27 ALA H 0.000 . 7.000 4.270 3.846 4.517 . 0 0 "[ . ]" 2
178 2 25 SER H 2 27 ALA H 0.000 . 7.000 4.270 3.855 4.514 . 0 0 "[ . ]" 2
179 1 25 SER H 1 27 ALA MB 0.000 . 7.000 4.844 4.514 5.060 . 0 0 "[ . ]" 2
180 2 25 SER H 2 27 ALA MB 0.000 . 7.000 4.844 4.519 5.064 . 0 0 "[ . ]" 2
181 1 26 THR HA 1 30 LEU H 0.000 . 7.000 4.178 3.899 4.406 . 0 0 "[ . ]" 2
182 2 26 THR HA 2 30 LEU H 0.000 . 7.000 4.177 3.893 4.395 . 0 0 "[ . ]" 2
183 1 26 THR H 1 27 ALA H 0.000 . 3.300 2.846 2.778 2.910 . 0 0 "[ . ]" 2
184 2 26 THR H 2 27 ALA H 0.000 . 3.300 2.847 2.783 2.906 . 0 0 "[ . ]" 2
185 1 26 THR H 1 27 ALA MB 0.000 . 7.000 4.392 4.326 4.483 . 0 0 "[ . ]" 2
186 2 26 THR H 2 27 ALA MB 0.000 . 7.000 4.392 4.333 4.482 . 0 0 "[ . ]" 2
187 1 26 THR H 1 28 ASN H 0.000 . 7.000 4.311 3.840 4.826 . 0 0 "[ . ]" 2
188 2 26 THR H 2 28 ASN H 0.000 . 7.000 4.312 3.846 4.834 . 0 0 "[ . ]" 2
189 1 26 THR H 1 29 MET QB 0.000 . 7.000 4.842 4.477 5.241 . 0 0 "[ . ]" 2
190 2 26 THR H 2 29 MET QB 0.000 . 7.000 4.840 4.472 5.227 . 0 0 "[ . ]" 2
191 1 27 ALA HA 1 30 LEU H 0.000 . 5.000 3.517 3.332 3.755 . 0 0 "[ . ]" 2
192 2 27 ALA HA 2 30 LEU H 0.000 . 5.000 3.516 3.327 3.757 . 0 0 "[ . ]" 2
193 1 27 ALA HA 1 31 ARG H 0.000 . 7.000 4.193 3.683 4.553 . 0 0 "[ . ]" 2
194 2 27 ALA HA 2 31 ARG H 0.000 . 7.000 4.193 3.690 4.550 . 0 0 "[ . ]" 2
195 1 27 ALA H 1 27 ALA MB 0.000 . 3.300 2.063 2.016 2.185 . 0 0 "[ . ]" 2
196 2 27 ALA H 2 27 ALA MB 0.000 . 3.300 2.064 2.015 2.184 . 0 0 "[ . ]" 2
197 1 27 ALA H 1 28 ASN QB 0.000 . 7.000 4.617 4.383 4.961 . 0 0 "[ . ]" 2
198 2 27 ALA H 2 28 ASN QB 0.000 . 7.000 4.618 4.376 4.966 . 0 0 "[ . ]" 2
199 1 27 ALA H 1 29 MET QB 0.000 . 7.000 4.890 4.536 5.415 . 0 0 "[ . ]" 2
200 2 27 ALA H 2 29 MET QB 0.000 . 7.000 4.890 4.531 5.411 . 0 0 "[ . ]" 2
201 1 27 ALA MB 1 30 LEU H 0.000 . 7.000 4.716 4.491 4.959 . 0 0 "[ . ]" 2
202 2 27 ALA MB 2 30 LEU H 0.000 . 7.000 4.714 4.494 4.957 . 0 0 "[ . ]" 2
203 1 27 ALA MB 1 31 ARG H 0.000 . 7.000 4.665 4.420 4.833 . 0 0 "[ . ]" 2
204 2 27 ALA MB 2 31 ARG H 0.000 . 7.000 4.664 4.427 4.829 . 0 0 "[ . ]" 2
205 1 28 ASN HA 1 29 MET H 0.000 . 7.000 3.525 3.451 3.589 . 0 0 "[ . ]" 2
206 2 28 ASN HA 2 29 MET H 0.000 . 7.000 3.525 3.451 3.588 . 0 0 "[ . ]" 2
207 1 28 ASN HA 1 31 ARG H 0.000 . 7.000 3.505 3.206 3.982 . 0 0 "[ . ]" 2
208 2 28 ASN HA 2 31 ARG H 0.000 . 7.000 3.503 3.202 3.978 . 0 0 "[ . ]" 2
209 1 28 ASN QB 1 30 LEU H 0.000 . 7.000 4.988 4.695 5.366 . 0 0 "[ . ]" 2
210 2 28 ASN QB 2 30 LEU H 0.000 . 7.000 4.984 4.685 5.367 . 0 0 "[ . ]" 2
211 1 29 MET HA 1 30 LEU H 0.000 . 7.000 3.576 3.561 3.589 . 0 0 "[ . ]" 2
212 2 29 MET HA 2 30 LEU H 0.000 . 7.000 3.576 3.561 3.588 . 0 0 "[ . ]" 2
213 1 29 MET HA 1 31 ARG H 0.000 . 7.000 4.102 3.843 4.724 . 0 0 "[ . ]" 2
214 2 29 MET HA 2 31 ARG H 0.000 . 7.000 4.104 3.855 4.727 . 0 0 "[ . ]" 2
215 1 29 MET HA 1 32 GLU H 0.000 . 5.000 3.445 2.941 3.650 . 0 0 "[ . ]" 2
216 2 29 MET HA 2 32 GLU H 0.000 . 5.000 3.446 2.937 3.657 . 0 0 "[ . ]" 2
217 1 29 MET H 1 31 ARG H 0.000 . 7.000 3.856 3.481 4.448 . 0 0 "[ . ]" 2
218 2 29 MET H 2 31 ARG H 0.000 . 7.000 3.858 3.478 4.449 . 0 0 "[ . ]" 2
219 1 30 LEU HA 1 31 ARG H 0.000 . 7.000 3.494 3.430 3.589 . 0 0 "[ . ]" 2
220 2 30 LEU HA 2 31 ARG H 0.000 . 7.000 3.494 3.433 3.587 . 0 0 "[ . ]" 2
221 1 30 LEU QB 1 32 GLU H 0.000 . 7.000 4.909 4.438 5.201 . 0 0 "[ . ]" 2
222 2 30 LEU QB 2 32 GLU H 0.000 . 7.000 4.908 4.440 5.190 . 0 0 "[ . ]" 2
223 1 30 LEU H 1 31 ARG HA 0.000 . 7.000 5.270 5.137 5.565 . 0 0 "[ . ]" 2
224 2 30 LEU H 2 31 ARG HA 0.000 . 7.000 5.270 5.142 5.559 . 0 0 "[ . ]" 2
225 1 30 LEU H 1 31 ARG H 0.000 . 3.300 2.684 2.492 3.050 . 0 0 "[ . ]" 2
226 2 30 LEU H 2 31 ARG H 0.000 . 3.300 2.681 2.497 3.041 . 0 0 "[ . ]" 2
227 1 30 LEU H 1 32 GLU H 0.000 . 7.000 4.353 3.991 4.610 . 0 0 "[ . ]" 2
228 2 30 LEU H 2 32 GLU H 0.000 . 7.000 4.351 3.985 4.605 . 0 0 "[ . ]" 2
229 1 30 LEU H 1 33 GLN H 0.000 . 7.000 4.880 4.789 4.982 . 0 0 "[ . ]" 2
230 2 30 LEU H 2 33 GLN H 0.000 . 7.000 4.881 4.796 4.983 . 0 0 "[ . ]" 2
231 1 3 GLY QA 1 4 GLY H 0.000 . 5.000 2.314 2.162 2.822 . 0 0 "[ . ]" 2
232 2 3 GLY QA 2 4 GLY H 0.000 . 5.000 2.312 2.161 2.816 . 0 0 "[ . ]" 2
233 1 3 GLY QA 1 5 ARG H 0.000 . 7.000 4.043 3.409 4.545 . 0 0 "[ . ]" 2
234 2 3 GLY QA 2 5 ARG H 0.000 . 7.000 4.043 3.410 4.549 . 0 0 "[ . ]" 2
235 1 3 GLY QA 1 6 ILE HB 0.000 . 5.000 3.935 3.230 4.963 . 0 0 "[ . ]" 2
236 2 3 GLY QA 2 6 ILE HB 0.000 . 5.000 3.934 3.229 4.962 . 0 0 "[ . ]" 2
237 1 3 GLY QA 1 6 ILE H 0.000 . 7.000 3.981 3.742 4.181 . 0 0 "[ . ]" 2
238 2 3 GLY QA 2 6 ILE H 0.000 . 7.000 3.981 3.740 4.182 . 0 0 "[ . ]" 2
239 1 3 GLY QA 1 7 ALA H 0.000 . 7.000 4.563 3.795 5.466 . 0 0 "[ . ]" 2
240 2 3 GLY QA 2 7 ALA H 0.000 . 7.000 4.564 3.793 5.466 . 0 0 "[ . ]" 2
241 1 3 GLY H 1 4 GLY H 0.000 . 5.000 3.320 2.033 4.076 . 0 0 "[ . ]" 2
242 2 3 GLY H 2 4 GLY H 0.000 . 5.000 3.328 2.049 4.075 . 0 0 "[ . ]" 2
243 1 3 GLY H 1 5 ARG H 0.000 . 7.000 3.708 2.461 4.498 . 0 0 "[ . ]" 2
244 2 3 GLY H 2 5 ARG H 0.000 . 7.000 3.712 2.464 4.498 . 0 0 "[ . ]" 2
245 1 31 ARG HA 1 32 GLU H 0.000 . 7.000 3.559 3.484 3.586 . 0 0 "[ . ]" 2
246 2 31 ARG HA 2 32 GLU H 0.000 . 7.000 3.559 3.485 3.585 . 0 0 "[ . ]" 2
247 1 31 ARG HA 1 33 GLN H 0.000 . 7.000 4.351 4.177 4.499 . 0 0 "[ . ]" 2
248 2 31 ARG HA 2 33 GLN H 0.000 . 7.000 4.352 4.175 4.497 . 0 0 "[ . ]" 2
249 1 31 ARG HA 1 34 VAL HA 0.000 . 7.000 5.435 5.071 5.814 . 0 0 "[ . ]" 2
250 2 31 ARG HA 2 34 VAL HA 0.000 . 7.000 5.435 5.072 5.809 . 0 0 "[ . ]" 2
251 1 31 ARG HA 1 34 VAL HB 0.000 . 3.300 2.675 2.167 2.993 . 0 0 "[ . ]" 2
252 2 31 ARG HA 2 34 VAL HB 0.000 . 3.300 2.673 2.171 2.984 . 0 0 "[ . ]" 2
253 1 31 ARG HA 1 34 VAL H 0.000 . 5.000 3.489 3.264 3.882 . 0 0 "[ . ]" 2
254 2 31 ARG HA 2 34 VAL H 0.000 . 5.000 3.490 3.266 3.871 . 0 0 "[ . ]" 2
255 1 31 ARG HA 1 35 ALA H 0.000 . 7.000 4.058 3.641 4.288 . 0 0 "[ . ]" 2
256 2 31 ARG HA 2 35 ALA H 0.000 . 7.000 4.057 3.637 4.289 . 0 0 "[ . ]" 2
257 1 31 ARG QB 1 34 VAL H 0.000 . 7.000 4.993 4.793 5.340 . 0 0 "[ . ]" 2
258 2 31 ARG QB 2 34 VAL H 0.000 . 7.000 4.993 4.790 5.344 . 0 0 "[ . ]" 2
259 1 31 ARG H 1 32 GLU H 0.000 . 3.300 2.585 2.461 2.791 . 0 0 "[ . ]" 2
260 2 31 ARG H 2 32 GLU H 0.000 . 3.300 2.587 2.462 2.792 . 0 0 "[ . ]" 2
261 1 31 ARG H 1 33 GLN H 0.000 . 7.000 3.978 3.734 4.353 . 0 0 "[ . ]" 2
262 2 31 ARG H 2 33 GLN H 0.000 . 7.000 3.981 3.739 4.361 . 0 0 "[ . ]" 2
263 1 32 GLU HA 1 33 GLN H 0.000 . 5.000 3.549 3.525 3.567 . 0 0 "[ . ]" 2
264 2 32 GLU HA 2 33 GLN H 0.000 . 5.000 3.549 3.525 3.567 . 0 0 "[ . ]" 2
265 1 32 GLU HA 1 34 VAL H 0.000 . 7.000 4.604 4.253 5.061 . 0 0 "[ . ]" 2
266 2 32 GLU HA 2 34 VAL H 0.000 . 7.000 4.601 4.249 5.059 . 0 0 "[ . ]" 2
267 1 32 GLU HA 1 35 ALA H 0.000 . 5.000 3.558 3.448 3.792 . 0 0 "[ . ]" 2
268 2 32 GLU HA 2 35 ALA H 0.000 . 5.000 3.558 3.444 3.799 . 0 0 "[ . ]" 2
269 1 32 GLU HA 1 35 ALA MB 0.000 . 3.300 2.661 2.263 3.114 . 0 0 "[ . ]" 2
270 2 32 GLU HA 2 35 ALA MB 0.000 . 3.300 2.662 2.272 3.116 . 0 0 "[ . ]" 2
271 1 32 GLU H 1 33 GLN H 0.000 . 3.300 2.664 2.553 2.745 . 0 0 "[ . ]" 2
272 2 32 GLU H 2 33 GLN H 0.000 . 3.300 2.665 2.551 2.753 . 0 0 "[ . ]" 2
273 1 32 GLU H 1 34 VAL H 0.000 . 7.000 4.222 3.695 4.639 . 0 0 "[ . ]" 2
274 2 32 GLU H 2 34 VAL H 0.000 . 7.000 4.220 3.692 4.628 . 0 0 "[ . ]" 2
275 1 32 GLU QB 1 33 GLN HA 0.000 . 5.000 4.266 3.884 4.426 . 0 0 "[ . ]" 2
276 2 32 GLU QB 2 33 GLN HA 0.000 . 5.000 4.265 3.883 4.426 . 0 0 "[ . ]" 2
277 1 32 GLU QB 1 34 VAL H 0.000 . 7.000 5.112 4.522 5.534 . 0 0 "[ . ]" 2
278 2 32 GLU QB 2 34 VAL H 0.000 . 7.000 5.110 4.518 5.522 . 0 0 "[ . ]" 2
279 1 34 VAL HA 1 35 ALA HA 0.000 . 7.000 4.751 4.697 4.790 . 0 0 "[ . ]" 2
280 2 34 VAL HA 2 35 ALA HA 0.000 . 7.000 4.750 4.696 4.787 . 0 0 "[ . ]" 2
281 1 34 VAL HA 1 35 ALA H 0.000 . 5.000 3.518 3.423 3.582 . 0 0 "[ . ]" 2
282 2 34 VAL HA 2 35 ALA H 0.000 . 5.000 3.519 3.424 3.581 . 0 0 "[ . ]" 2
283 1 34 VAL HA 1 37 LEU QB 0.000 . 5.000 2.346 2.043 2.708 . 0 0 "[ . ]" 2
284 2 34 VAL HA 2 37 LEU QB 0.000 . 5.000 2.349 2.052 2.712 . 0 0 "[ . ]" 2
285 1 34 VAL HA 1 38 LYS H 0.000 . 7.000 3.888 3.443 4.365 . 0 0 "[ . ]" 2
286 2 34 VAL HA 2 38 LYS H 0.000 . 7.000 3.890 3.448 4.363 . 0 0 "[ . ]" 2
287 1 34 VAL H 1 35 ALA HA 0.000 . 7.000 5.263 5.120 5.431 . 0 0 "[ . ]" 2
288 2 34 VAL H 2 35 ALA HA 0.000 . 7.000 5.263 5.119 5.419 . 0 0 "[ . ]" 2
289 1 34 VAL H 1 35 ALA H 0.000 . 3.300 2.656 2.513 2.850 . 0 0 "[ . ]" 2
290 2 34 VAL H 2 35 ALA H 0.000 . 3.300 2.656 2.517 2.836 . 0 0 "[ . ]" 2
291 1 34 VAL H 1 35 ALA MB 0.000 . 7.000 4.277 4.095 4.438 . 0 0 "[ . ]" 2
292 2 34 VAL H 2 35 ALA MB 0.000 . 7.000 4.278 4.096 4.429 . 0 0 "[ . ]" 2
293 1 35 ALA HA 1 38 LYS H 0.000 . 5.000 3.567 3.380 3.730 . 0 0 "[ . ]" 2
294 2 35 ALA HA 2 38 LYS H 0.000 . 5.000 3.565 3.378 3.726 . 0 0 "[ . ]" 2
295 1 35 ALA HA 1 39 GLN H 0.000 . 7.000 4.012 3.523 4.423 . 0 0 "[ . ]" 2
296 2 35 ALA HA 2 39 GLN H 0.000 . 7.000 4.010 3.511 4.421 . 0 0 "[ . ]" 2
297 1 35 ALA H 1 37 LEU H 0.000 . 7.000 3.865 3.587 4.360 . 0 0 "[ . ]" 2
298 2 35 ALA H 2 37 LEU H 0.000 . 7.000 3.866 3.596 4.347 . 0 0 "[ . ]" 2
299 1 35 ALA H 1 38 LYS H 0.000 . 7.000 4.715 4.426 4.919 . 0 0 "[ . ]" 2
300 2 35 ALA H 2 38 LYS H 0.000 . 7.000 4.715 4.420 4.917 . 0 0 "[ . ]" 2
301 1 35 ALA MB 1 37 LEU H 0.000 . 7.000 4.349 4.100 4.807 . 0 0 "[ . ]" 2
302 2 35 ALA MB 2 37 LEU H 0.000 . 7.000 4.349 4.104 4.813 . 0 0 "[ . ]" 2
303 1 35 ALA MB 1 38 LYS H 0.000 . 7.000 4.719 4.615 4.845 . 0 0 "[ . ]" 2
304 2 35 ALA MB 2 38 LYS H 0.000 . 7.000 4.718 4.608 4.842 . 0 0 "[ . ]" 2
305 1 36 GLN H 1 38 LYS H 0.000 . 7.000 4.305 3.767 4.536 . 0 0 "[ . ]" 2
306 2 36 GLN H 2 38 LYS H 0.000 . 7.000 4.305 3.749 4.545 . 0 0 "[ . ]" 2
307 1 36 GLN QB 1 38 LYS H 0.000 . 7.000 5.073 4.390 5.531 . 0 0 "[ . ]" 2
308 2 36 GLN QB 2 38 LYS H 0.000 . 7.000 5.073 4.385 5.536 . 0 0 "[ . ]" 2
309 1 37 LEU H 1 38 LYS H 0.000 . 3.300 2.656 2.469 2.801 . 0 0 "[ . ]" 2
310 2 37 LEU H 2 38 LYS H 0.000 . 3.300 2.655 2.470 2.803 . 0 0 "[ . ]" 2
311 1 37 LEU H 1 39 GLN H 0.000 . 7.000 4.008 3.664 4.635 . 0 0 "[ . ]" 2
312 2 37 LEU H 2 39 GLN H 0.000 . 7.000 4.009 3.664 4.636 . 0 0 "[ . ]" 2
313 1 37 LEU H 1 40 LYS H 0.000 . 7.000 4.842 4.474 5.190 . 0 0 "[ . ]" 2
314 2 37 LEU H 2 40 LYS H 0.000 . 7.000 4.840 4.467 5.191 . 0 0 "[ . ]" 2
315 1 38 LYS HA 1 39 GLN H 0.000 . 4.200 3.538 3.448 3.592 . 0 0 "[ . ]" 2
316 2 38 LYS HA 2 39 GLN H 0.000 . 4.200 3.538 3.447 3.592 . 0 0 "[ . ]" 2
317 1 38 LYS HA 1 40 LYS H 0.000 . 7.000 4.274 3.714 4.714 . 0 0 "[ . ]" 2
318 2 38 LYS HA 2 40 LYS H 0.000 . 7.000 4.272 3.716 4.708 . 0 0 "[ . ]" 2
319 1 38 LYS H 1 39 GLN H 0.000 . 3.300 2.698 2.449 2.877 . 0 0 "[ . ]" 2
320 2 38 LYS H 2 39 GLN H 0.000 . 3.300 2.699 2.446 2.881 . 0 0 "[ . ]" 2
321 1 38 LYS H 1 40 LYS H 0.000 . 7.000 4.234 3.848 4.618 . 0 0 "[ . ]" 2
322 2 38 LYS H 2 40 LYS H 0.000 . 7.000 4.232 3.841 4.612 . 0 0 "[ . ]" 2
323 1 39 GLN H 1 39 GLN QB 0.000 . 3.300 2.347 2.163 2.497 . 0 0 "[ . ]" 2
324 2 39 GLN H 2 39 GLN QB 0.000 . 3.300 2.348 2.165 2.498 . 0 0 "[ . ]" 2
325 1 39 GLN H 1 40 LYS HA 0.000 . 7.000 5.370 5.227 5.463 . 0 0 "[ . ]" 2
326 2 39 GLN H 2 40 LYS HA 0.000 . 7.000 5.369 5.229 5.462 . 0 0 "[ . ]" 2
327 1 39 GLN H 1 40 LYS H 0.000 . 3.300 2.780 2.605 2.911 . 0 0 "[ . ]" 2
328 2 39 GLN H 2 40 LYS H 0.000 . 3.300 2.779 2.606 2.909 . 0 0 "[ . ]" 2
329 1 39 GLN H 1 40 LYS QB 0.000 . 5.000 4.536 4.401 4.715 . 0 0 "[ . ]" 2
330 2 39 GLN H 2 40 LYS QB 0.000 . 5.000 4.535 4.401 4.704 . 0 0 "[ . ]" 2
331 1 39 GLN H 1 41 VAL H 0.000 . 5.000 4.097 3.799 4.424 . 0 0 "[ . ]" 2
332 2 39 GLN H 2 41 VAL H 0.000 . 5.000 4.096 3.789 4.424 . 0 0 "[ . ]" 2
333 1 39 GLN H 1 42 MET H 0.000 . 7.000 4.789 4.600 5.067 . 0 0 "[ . ]" 2
334 2 39 GLN H 2 42 MET H 0.000 . 7.000 4.789 4.600 5.070 . 0 0 "[ . ]" 2
335 1 40 LYS HA 1 41 VAL H 0.000 . 4.200 3.518 3.448 3.579 . 0 0 "[ . ]" 2
336 2 40 LYS HA 2 41 VAL H 0.000 . 4.200 3.517 3.448 3.581 . 0 0 "[ . ]" 2
337 1 40 LYS H 1 40 LYS QB 0.000 . 3.300 2.199 2.052 2.382 . 0 0 "[ . ]" 2
338 2 40 LYS H 2 40 LYS QB 0.000 . 3.300 2.198 2.051 2.381 . 0 0 "[ . ]" 2
339 1 40 LYS H 1 41 VAL H 0.000 . 3.300 2.633 2.310 2.883 . 0 0 "[ . ]" 2
340 2 40 LYS H 2 41 VAL H 0.000 . 3.300 2.632 2.308 2.877 . 0 0 "[ . ]" 2
341 1 40 LYS H 1 42 MET H 0.000 . 5.000 4.141 3.901 4.731 . 0 0 "[ . ]" 2
342 2 40 LYS H 2 42 MET H 0.000 . 5.000 4.144 3.901 4.740 . 0 0 "[ . ]" 2
343 1 4 GLY QA 1 7 ALA MB 0.000 . 5.000 3.284 2.609 3.920 . 0 0 "[ . ]" 2
344 2 4 GLY QA 2 7 ALA MB 0.000 . 5.000 3.280 2.593 3.923 . 0 0 "[ . ]" 2
345 1 4 GLY QA 1 8 ARG H 0.000 . 7.000 4.578 4.095 4.978 . 0 0 "[ . ]" 2
346 2 4 GLY QA 2 8 ARG H 0.000 . 7.000 4.576 4.083 4.973 . 0 0 "[ . ]" 2
347 1 4 GLY H 1 5 ARG H 0.000 . 3.300 2.592 2.063 3.109 . 0 0 "[ . ]" 2
348 2 4 GLY H 2 5 ARG H 0.000 . 3.300 2.599 2.073 3.130 . 0 0 "[ . ]" 2
349 1 4 GLY H 1 5 ARG QB 0.000 . 7.000 4.393 3.895 4.798 . 0 0 "[ . ]" 2
350 2 4 GLY H 2 5 ARG QB 0.000 . 7.000 4.398 3.897 4.805 . 0 0 "[ . ]" 2
351 1 4 GLY H 1 6 ILE H 0.000 . 7.000 2.989 2.346 3.912 . 0 0 "[ . ]" 2
352 2 4 GLY H 2 6 ILE H 0.000 . 7.000 2.993 2.342 3.912 . 0 0 "[ . ]" 2
353 1 4 GLY H 1 7 ALA MB 0.000 . 7.000 4.096 3.098 5.199 . 0 0 "[ . ]" 2
354 2 4 GLY H 2 7 ALA MB 0.000 . 7.000 4.092 3.101 5.194 . 0 0 "[ . ]" 2
355 1 41 VAL H 1 43 ASN H 0.000 . 7.000 5.765 3.806 6.662 . 0 0 "[ . ]" 2
356 2 41 VAL H 2 43 ASN H 0.000 . 7.000 5.762 3.805 6.658 . 0 0 "[ . ]" 2
357 1 42 MET HA 1 43 ASN H 0.000 . 5.000 2.470 2.192 3.500 . 0 0 "[ . ]" 2
358 2 42 MET HA 2 43 ASN H 0.000 . 5.000 2.471 2.191 3.501 . 0 0 "[ . ]" 2
359 1 5 ARG HA 1 9 LEU H 0.000 . 5.000 4.077 3.954 4.359 . 0 0 "[ . ]" 2
360 2 5 ARG HA 2 9 LEU H 0.000 . 5.000 4.077 3.954 4.355 . 0 0 "[ . ]" 2
361 1 5 ARG H 1 6 ILE HA 0.000 . 7.000 5.020 4.856 5.262 . 0 0 "[ . ]" 2
362 2 5 ARG H 2 6 ILE HA 0.000 . 7.000 5.022 4.844 5.262 . 0 0 "[ . ]" 2
363 1 5 ARG H 1 7 ALA H 0.000 . 5.000 4.285 4.023 4.736 . 0 0 "[ . ]" 2
364 2 5 ARG H 2 7 ALA H 0.000 . 5.000 4.284 4.020 4.743 . 0 0 "[ . ]" 2
365 1 5 ARG QB 1 9 LEU H 0.000 . 5.000 4.513 4.354 4.727 . 0 0 "[ . ]" 2
366 2 5 ARG QB 2 9 LEU H 0.000 . 5.000 4.515 4.354 4.729 . 0 0 "[ . ]" 2
367 1 6 ILE HA 1 7 ALA H 0.000 . 5.000 3.563 3.516 3.589 . 0 0 "[ . ]" 2
368 2 6 ILE HA 2 7 ALA H 0.000 . 5.000 3.562 3.516 3.588 . 0 0 "[ . ]" 2
369 1 6 ILE HA 1 7 ALA MB 0.000 . 7.000 5.007 4.994 5.028 . 0 0 "[ . ]" 2
370 2 6 ILE HA 2 7 ALA MB 0.000 . 7.000 5.007 4.993 5.029 . 0 0 "[ . ]" 2
371 1 6 ILE HA 1 8 ARG H 0.000 . 7.000 4.341 4.009 4.774 . 0 0 "[ . ]" 2
372 2 6 ILE HA 2 8 ARG H 0.000 . 7.000 4.342 4.010 4.769 . 0 0 "[ . ]" 2
373 1 6 ILE HA 1 9 LEU QB 0.000 . 3.300 2.526 2.020 3.222 . 0 0 "[ . ]" 2
374 2 6 ILE HA 2 9 LEU QB 0.000 . 3.300 2.526 2.028 3.217 . 0 0 "[ . ]" 2
375 1 6 ILE HA 1 9 LEU H 0.000 . 5.000 3.477 3.271 3.791 . 0 0 "[ . ]" 2
376 2 6 ILE HA 2 9 LEU H 0.000 . 5.000 3.475 3.256 3.790 . 0 0 "[ . ]" 2
377 1 6 ILE HA 1 10 GLU H 0.000 . 5.000 3.962 3.611 4.457 . 0 0 "[ . ]" 2
378 2 6 ILE HA 2 10 GLU H 0.000 . 5.000 3.961 3.608 4.456 . 0 0 "[ . ]" 2
379 1 6 ILE H 1 7 ALA H 0.000 . 3.300 2.667 2.526 2.902 . 0 0 "[ . ]" 2
380 2 6 ILE H 2 7 ALA H 0.000 . 3.300 2.665 2.521 2.905 . 0 0 "[ . ]" 2
381 1 7 ALA H 1 7 ALA MB 0.000 . 3.300 2.088 2.022 2.212 . 0 0 "[ . ]" 2
382 2 7 ALA H 2 7 ALA MB 0.000 . 3.300 2.089 2.025 2.212 . 0 0 "[ . ]" 2
383 1 7 ALA H 1 8 ARG H 0.000 . 3.300 2.794 2.574 2.944 . 0 0 "[ . ]" 2
384 2 7 ALA H 2 8 ARG H 0.000 . 3.300 2.791 2.570 2.936 . 0 0 "[ . ]" 2
385 1 7 ALA H 1 9 LEU H 0.000 . 5.000 4.449 4.110 4.851 . 0 0 "[ . ]" 2
386 2 7 ALA H 2 9 LEU H 0.000 . 5.000 4.445 4.110 4.850 . 0 0 "[ . ]" 2
387 1 7 ALA H 1 10 GLU H 0.000 . 7.000 4.778 4.666 4.856 . 0 0 "[ . ]" 2
388 2 7 ALA H 2 10 GLU H 0.000 . 7.000 4.778 4.666 4.857 . 0 0 "[ . ]" 2
389 1 7 ALA MB 1 9 LEU H 0.000 . 7.000 4.715 4.341 5.126 . 0 0 "[ . ]" 2
390 2 7 ALA MB 2 9 LEU H 0.000 . 7.000 4.715 4.347 5.128 . 0 0 "[ . ]" 2
391 1 7 ALA MB 1 10 GLU H 0.000 . 7.000 4.683 4.446 4.966 . 0 0 "[ . ]" 2
392 2 7 ALA MB 2 10 GLU H 0.000 . 7.000 4.685 4.443 4.972 . 0 0 "[ . ]" 2
393 1 7 ALA MB 1 10 GLU QB 0.000 . 5.000 4.028 3.496 4.446 . 0 0 "[ . ]" 2
394 2 7 ALA MB 2 10 GLU QB 0.000 . 5.000 4.029 3.499 4.444 . 0 0 "[ . ]" 2
395 1 8 ARG H 1 9 LEU H 0.000 . 3.300 2.764 2.600 2.902 . 0 0 "[ . ]" 2
396 2 8 ARG H 2 9 LEU H 0.000 . 3.300 2.764 2.596 2.897 . 0 0 "[ . ]" 2
397 1 8 ARG H 1 10 GLU H 0.000 . 7.000 4.046 3.537 4.485 . 0 0 "[ . ]" 2
398 2 8 ARG H 2 10 GLU H 0.000 . 7.000 4.048 3.541 4.494 . 0 0 "[ . ]" 2
399 1 9 LEU H 1 10 GLU HA 0.000 . 7.000 5.411 5.292 5.472 . 0 0 "[ . ]" 2
400 2 9 LEU H 2 10 GLU HA 0.000 . 7.000 5.411 5.295 5.476 . 0 0 "[ . ]" 2
401 1 9 LEU H 1 10 GLU H 0.000 . 3.300 2.839 2.718 2.937 . 0 0 "[ . ]" 2
402 2 9 LEU H 2 10 GLU H 0.000 . 3.300 2.839 2.723 2.944 . 0 0 "[ . ]" 2
403 1 9 LEU H 1 10 GLU QB 0.000 . 5.000 4.619 4.494 4.892 . 0 0 "[ . ]" 2
404 2 9 LEU H 2 10 GLU QB 0.000 . 5.000 4.618 4.501 4.880 . 0 0 "[ . ]" 2
405 1 12 LYS HA 1 15 THR HB 0.000 . 4.200 3.368 2.487 4.095 . 0 0 "[ . ]" 2
406 1 14 LYS H 1 14 LYS QB 0.000 . 3.300 2.117 2.052 2.260 . 0 0 "[ . ]" 2
407 1 6 ILE H 1 6 ILE QG 0.000 . 3.300 2.547 1.811 3.265 . 0 0 "[ . ]" 2
408 1 11 GLU H 1 11 GLU QG 0.000 . 3.300 3.037 2.676 3.217 . 0 0 "[ . ]" 2
409 1 10 GLU HA 1 11 GLU H 0.000 . 4.200 3.568 3.530 3.587 . 0 0 "[ . ]" 2
410 1 10 GLU H 1 11 GLU H 0.000 . 3.300 2.712 2.542 2.879 . 0 0 "[ . ]" 2
411 1 10 GLU H 1 10 GLU QB 0.000 . 3.300 2.181 2.069 2.399 . 0 0 "[ . ]" 2
412 1 32 GLU H 1 32 GLU QG 0.000 . 4.200 2.378 1.829 3.902 . 0 0 "[ . ]" 2
413 1 32 GLU QG 1 33 GLN H 0.000 . 6.000 2.444 1.851 4.101 . 0 0 "[ . ]" 2
414 1 10 GLU H 1 11 GLU QG 0.000 . 6.000 5.341 5.028 5.661 . 0 0 "[ . ]" 2
415 1 38 LYS HA 1 41 VAL H 0.000 . 4.200 3.261 3.015 3.403 . 0 0 "[ . ]" 2
416 1 41 VAL H 1 41 VAL QG 0.000 . 3.300 2.264 1.991 2.483 . 0 0 "[ . ]" 2
417 1 12 LYS H 1 12 LYS QD 0.000 . 6.000 4.209 3.057 4.684 . 0 0 "[ . ]" 2
418 1 10 GLU H 1 12 LYS H 0.000 . 6.000 3.955 3.790 4.178 . 0 0 "[ . ]" 2
419 1 14 LYS HA 1 17 LYS QD 0.000 . 6.000 3.770 2.556 4.356 . 0 0 "[ . ]" 2
420 1 25 SER HA 1 28 ASN QB 0.000 . 4.200 2.776 2.235 4.095 . 0 0 "[ . ]" 2
421 1 10 GLU HA 1 13 VAL H 0.000 . 4.200 3.317 3.262 3.394 . 0 0 "[ . ]" 2
422 1 37 LEU H 1 37 LEU QB 0.000 . 3.300 2.127 2.054 2.341 . 0 0 "[ . ]" 2
423 1 10 GLU H 1 13 VAL H 0.000 . 6.000 4.741 4.646 4.882 . 0 0 "[ . ]" 2
424 1 13 VAL QG 1 14 LYS HA 0.000 . 6.000 3.462 3.351 3.543 . 0 0 "[ . ]" 2
425 1 14 LYS HA 1 14 LYS QD 0.000 . 4.200 2.037 1.888 2.163 . 0 0 "[ . ]" 2
426 1 14 LYS HA 1 17 LYS QE 0.000 . 6.000 3.121 2.707 3.494 . 0 0 "[ . ]" 2
427 1 14 LYS QD 1 17 LYS QE 0.000 . 3.300 3.101 2.803 3.264 . 0 0 "[ . ]" 2
428 1 14 LYS QD 1 17 LYS H 0.000 . 6.000 4.860 4.264 5.112 . 0 0 "[ . ]" 2
429 1 40 LYS HA 1 40 LYS QD 0.000 . 4.200 3.458 2.240 4.020 . 0 0 "[ . ]" 2
430 1 29 MET HA 1 33 GLN H 0.000 . 6.000 4.195 4.052 4.424 . 0 0 "[ . ]" 2
431 1 14 LYS QB 1 15 THR H 0.000 . 3.300 2.411 2.264 2.647 . 0 0 "[ . ]" 2
432 1 14 LYS QE 1 17 LYS QB 0.000 . 6.000 4.600 3.317 5.783 . 0 0 "[ . ]" 2
433 1 15 THR HB 1 16 LEU H 0.000 . 4.200 2.678 2.516 2.819 . 0 0 "[ . ]" 2
434 1 18 ALA MB 1 19 GLN H 0.000 . 3.300 2.185 2.088 2.260 . 0 0 "[ . ]" 2
435 1 18 ALA HA 1 19 GLN H 0.000 . 6.000 3.581 3.576 3.585 . 0 0 "[ . ]" 2
436 1 19 GLN H 1 19 GLN QG 0.000 . 3.300 2.346 1.856 2.784 . 0 0 "[ . ]" 2
437 1 16 LEU H 1 16 LEU QB 0.000 . 3.300 2.186 2.079 2.377 . 0 0 "[ . ]" 2
438 1 16 LEU QB 1 17 LYS H 0.000 . 4.200 2.443 2.306 2.585 . 0 0 "[ . ]" 2
439 1 17 LYS HA 1 17 LYS QG 0.000 . 3.300 1.980 1.900 2.087 . 0 0 "[ . ]" 2
440 1 10 GLU HA 1 10 GLU QG 0.000 . 3.300 2.233 1.985 2.508 . 0 0 "[ . ]" 2
441 1 18 ALA H 1 18 ALA MB 0.000 . 3.300 2.033 2.021 2.063 . 0 0 "[ . ]" 2
442 1 17 LYS QB 1 17 LYS QD 0.000 . 3.300 2.168 1.934 2.337 . 0 0 "[ . ]" 2
443 1 31 ARG QB 1 31 ARG QD 0.000 . 3.300 2.026 1.914 2.126 . 0 0 "[ . ]" 2
444 1 17 LYS QB 1 18 ALA H 0.000 . 3.300 2.760 2.495 3.030 . 0 0 "[ . ]" 2
445 1 40 LYS HA 1 40 LYS QG 0.000 . 3.300 2.205 1.911 2.400 . 0 0 "[ . ]" 2
446 1 17 LYS QG 1 18 ALA H 0.000 . 6.000 4.455 4.317 4.563 . 0 0 "[ . ]" 2
447 1 18 ALA H 1 19 GLN QG 0.000 . 6.000 4.820 3.638 5.390 . 0 0 "[ . ]" 2
448 1 19 GLN QB 1 20 ASN H 0.000 . 4.200 2.837 2.546 3.706 . 0 0 "[ . ]" 2
449 1 19 GLN H 1 19 GLN QE 0.000 . 6.000 4.588 3.748 4.787 . 0 0 "[ . ]" 2
450 1 19 GLN QG 1 20 ASN H 0.000 . 6.000 4.034 2.578 4.397 . 0 0 "[ . ]" 2
451 1 20 ASN H 1 20 ASN QB 0.000 . 3.300 2.159 2.090 2.258 . 0 0 "[ . ]" 2
452 1 20 ASN QB 1 21 SER H 0.000 . 4.200 2.281 1.963 2.562 . 0 0 "[ . ]" 2
453 1 2 CYS QB 1 3 GLY H 0.000 . 4.200 2.763 1.921 3.899 . 0 0 "[ . ]" 2
454 1 25 SER QB 1 26 THR H 0.000 . 4.200 2.516 2.111 3.233 . 0 0 "[ . ]" 2
455 1 21 SER QB 1 22 GLU H 0.000 . 3.300 2.999 2.866 3.253 . 0 0 "[ . ]" 2
456 1 22 GLU QG 1 23 LEU H 0.000 . 6.000 4.083 3.770 4.216 . 0 0 "[ . ]" 2
457 1 26 THR HA 1 29 MET QG 0.000 . 6.000 4.327 2.732 5.200 . 0 0 "[ . ]" 2
458 1 22 GLU QB 1 23 LEU H 0.000 . 3.300 2.214 1.956 2.400 . 0 0 "[ . ]" 2
459 1 23 LEU H 1 23 LEU QB 0.000 . 3.300 2.217 2.096 2.434 . 0 0 "[ . ]" 2
460 1 38 LYS H 1 38 LYS QB 0.000 . 3.300 2.306 2.120 2.531 . 0 0 "[ . ]" 2
461 1 24 ALA MB 1 25 SER HA 0.000 . 6.000 3.732 3.671 3.798 . 0 0 "[ . ]" 2
462 1 24 ALA MB 1 25 SER H 0.000 . 3.300 2.426 2.143 2.694 . 0 0 "[ . ]" 2
463 1 24 ALA MB 1 28 ASN QD 0.000 . 6.000 4.254 3.029 4.897 . 0 0 "[ . ]" 2
464 1 25 SER HA 1 28 ASN QD 0.000 . 6.000 3.623 1.853 4.720 . 0 0 "[ . ]" 2
465 1 25 SER HA 1 29 MET QB 0.000 . 6.000 5.029 4.710 5.275 . 0 0 "[ . ]" 2
466 1 26 THR HA 1 29 MET QB 0.000 . 3.300 2.692 2.313 3.069 . 0 0 "[ . ]" 2
467 1 26 THR HA 1 26 THR MG 0.000 . 3.300 2.296 2.147 2.400 . 0 0 "[ . ]" 2
468 1 26 THR H 1 26 THR MG 0.000 . 4.200 3.726 3.687 3.748 . 0 0 "[ . ]" 2
469 1 26 THR MG 1 29 MET QB 0.000 . 4.200 3.516 3.188 3.869 . 0 0 "[ . ]" 2
470 1 26 THR MG 1 30 LEU HG 0.000 . 3.300 2.939 2.458 3.251 . 0 0 "[ . ]" 2
471 1 33 GLN QG 1 34 VAL H 0.000 . 4.200 2.396 1.935 3.393 . 0 0 "[ . ]" 2
472 1 27 ALA MB 1 28 ASN HA 0.000 . 6.000 3.696 3.611 3.787 . 0 0 "[ . ]" 2
473 1 28 ASN HA 1 31 ARG QB 0.000 . 6.000 2.555 2.198 3.226 . 0 0 "[ . ]" 2
474 1 28 ASN QD 1 29 MET H 0.000 . 6.000 4.877 4.120 5.254 . 0 0 "[ . ]" 2
475 1 28 ASN QB 1 29 MET HA 0.000 . 6.000 4.005 3.811 4.421 . 0 0 "[ . ]" 2
476 1 29 MET QG 1 30 LEU H 0.000 . 6.000 3.813 3.109 4.381 . 0 0 "[ . ]" 2
477 1 33 GLN H 1 33 GLN QG 0.000 . 3.300 2.046 1.833 2.275 . 0 0 "[ . ]" 2
478 1 30 LEU H 1 30 LEU HG 0.000 . 3.300 2.066 1.875 2.531 . 0 0 "[ . ]" 2
479 1 31 ARG H 1 31 ARG QB 0.000 . 3.300 2.144 2.074 2.269 . 0 0 "[ . ]" 2
480 1 31 ARG QB 1 32 GLU HA 0.000 . 6.000 3.835 3.701 4.023 . 0 0 "[ . ]" 2
481 1 31 ARG QB 1 32 GLU H 0.000 . 3.300 2.576 2.369 2.913 . 0 0 "[ . ]" 2
482 1 3 GLY QA 1 6 ILE MD 0.000 . 4.200 2.746 2.251 3.233 . 0 0 "[ . ]" 2
483 1 3 GLY H 1 6 ILE MD 0.000 . 6.000 3.012 1.885 4.844 . 0 0 "[ . ]" 2
484 1 31 ARG HA 1 31 ARG HE 0.000 . 6.000 4.867 3.937 5.893 . 0 0 "[ . ]" 2
485 1 31 ARG HA 1 31 ARG QG 0.000 . 3.300 2.104 1.951 2.277 . 0 0 "[ . ]" 2
486 1 31 ARG HA 1 35 ALA MB 0.000 . 6.000 4.526 4.230 4.979 . 0 0 "[ . ]" 2
487 1 5 ARG H 1 5 ARG QB 0.000 . 3.300 2.201 2.087 2.449 . 0 0 "[ . ]" 2
488 1 31 ARG H 1 31 ARG QD 0.000 . 6.000 4.284 3.806 4.578 . 0 0 "[ . ]" 2
489 1 31 ARG H 1 31 ARG QG 0.000 . 4.200 3.684 3.221 3.970 . 0 0 "[ . ]" 2
490 1 31 ARG QG 1 32 GLU H 0.000 . 6.000 4.188 3.579 4.412 . 0 0 "[ . ]" 2
491 1 36 GLN H 1 36 GLN QG 0.000 . 3.300 2.237 1.853 3.000 . 0 0 "[ . ]" 2
492 1 33 GLN HA 1 34 VAL H 0.000 . 4.200 3.553 3.505 3.583 . 0 0 "[ . ]" 2
493 1 35 ALA HA 1 36 GLN H 0.000 . 4.200 3.563 3.536 3.582 . 0 0 "[ . ]" 2
494 1 34 VAL QG 1 38 LYS QE 0.000 . 3.300 2.485 1.788 3.276 . 0 0 "[ . ]" 2
495 1 34 VAL QG 1 35 ALA HA 0.000 . 6.000 3.417 3.181 3.986 . 0 0 "[ . ]" 2
496 1 36 GLN HA 1 39 GLN QG 0.000 . 4.200 3.267 2.390 4.023 . 0 0 "[ . ]" 2
497 1 36 GLN H 1 36 GLN QE 0.000 . 6.000 4.134 3.370 4.780 . 0 0 "[ . ]" 2
498 1 39 GLN HA 1 39 GLN QG 0.000 . 3.300 2.498 2.055 2.849 . 0 0 "[ . ]" 2
499 1 39 GLN H 1 39 GLN QG 0.000 . 4.200 2.742 1.935 4.037 . 0 0 "[ . ]" 2
500 1 36 GLN QG 1 37 LEU H 0.000 . 6.000 3.243 2.027 4.471 . 0 0 "[ . ]" 2
501 1 37 LEU QB 1 38 LYS H 0.000 . 3.300 2.558 2.374 2.780 . 0 0 "[ . ]" 2
502 1 42 MET H 1 42 MET QB 0.000 . 3.300 2.216 2.106 2.430 . 0 0 "[ . ]" 2
503 1 38 LYS QB 1 39 GLN H 0.000 . 3.300 2.638 2.247 3.015 . 0 0 "[ . ]" 2
504 1 38 LYS HA 1 38 LYS QD 0.000 . 4.200 2.500 1.927 3.379 . 0 0 "[ . ]" 2
505 1 38 LYS HA 1 41 VAL HB 0.000 . 3.300 2.775 2.350 3.028 . 0 0 "[ . ]" 2
506 1 38 LYS HA 1 41 VAL QG 0.000 . 3.300 2.626 1.899 2.965 . 0 0 "[ . ]" 2
507 1 42 MET H 1 42 MET QG 0.000 . 4.200 3.515 2.251 3.993 . 0 0 "[ . ]" 2
508 1 39 GLN QB 1 40 LYS H 0.000 . 3.300 2.562 2.249 2.913 . 0 0 "[ . ]" 2
509 1 40 LYS H 1 40 LYS QG 0.000 . 4.200 3.640 2.455 3.981 . 0 0 "[ . ]" 2
510 1 41 VAL HA 1 41 VAL QG 0.000 . 3.300 2.088 2.030 2.149 . 0 0 "[ . ]" 2
511 1 41 VAL H 1 41 VAL HB 0.000 . 3.300 2.498 2.392 2.684 . 0 0 "[ . ]" 2
512 1 41 VAL QG 1 42 MET H 0.000 . 4.200 3.303 2.870 3.500 . 0 0 "[ . ]" 2
513 1 41 VAL QG 1 43 ASN H 0.000 . 6.000 4.404 3.780 5.062 . 0 0 "[ . ]" 2
514 1 41 VAL QG 1 42 MET HA 0.000 . 6.000 3.623 3.339 4.029 . 0 0 "[ . ]" 2
515 1 42 MET QB 1 43 ASN H 0.000 . 4.200 3.667 2.936 4.057 . 0 0 "[ . ]" 2
516 1 43 ASN QB 1 44 TYR H 0.000 . 6.000 3.176 1.862 3.970 . 0 0 "[ . ]" 2
517 1 44 TYR HA 1 44 TYR QE 0.000 . 6.000 4.349 4.106 4.528 . 0 0 "[ . ]" 2
518 1 5 ARG H 1 5 ARG HE 0.000 . 6.000 5.164 4.482 5.899 . 0 0 "[ . ]" 2
519 1 7 ALA MB 1 8 ARG H 0.000 . 3.300 2.571 2.092 2.928 . 0 0 "[ . ]" 2
520 1 5 ARG H 1 5 ARG QD 0.000 . 6.000 3.570 2.400 4.654 . 0 0 "[ . ]" 2
521 1 5 ARG QB 1 5 ARG QD 0.000 . 3.300 2.129 1.891 2.286 . 0 0 "[ . ]" 2
522 1 8 ARG QB 1 8 ARG QD 0.000 . 3.300 2.190 1.980 2.431 . 0 0 "[ . ]" 2
523 1 8 ARG H 1 8 ARG QB 0.000 . 3.300 2.276 2.034 2.651 . 0 0 "[ . ]" 2
524 1 8 ARG QB 1 9 LEU H 0.000 . 3.300 2.387 2.242 2.542 . 0 0 "[ . ]" 2
525 1 6 ILE QG 1 7 ALA H 0.000 . 6.000 3.900 1.825 4.512 . 0 0 "[ . ]" 2
526 1 8 ARG H 1 8 ARG HE 0.000 . 6.000 5.064 3.767 5.812 . 0 0 "[ . ]" 2
527 1 8 ARG H 1 8 ARG QD 0.000 . 6.000 3.785 2.503 4.703 . 0 0 "[ . ]" 2
528 1 9 LEU H 1 9 LEU QB 0.000 . 3.300 2.183 2.076 2.509 . 0 0 "[ . ]" 2
529 1 9 LEU QB 1 10 GLU H 0.000 . 4.200 2.692 2.385 3.031 . 0 0 "[ . ]" 2
530 1 10 GLU H 1 10 GLU QG 0.000 . 3.300 2.830 2.286 3.197 . 0 0 "[ . ]" 2
531 2 12 LYS HA 2 15 THR HB 0.000 . 4.200 3.372 2.496 4.102 . 0 0 "[ . ]" 2
532 2 14 LYS H 2 14 LYS QB 0.000 . 3.300 2.117 2.053 2.263 . 0 0 "[ . ]" 2
533 2 6 ILE H 2 6 ILE QG 0.000 . 3.300 2.550 1.811 3.271 . 0 0 "[ . ]" 2
534 2 11 GLU H 2 11 GLU QG 0.000 . 3.300 3.038 2.683 3.210 . 0 0 "[ . ]" 2
535 2 10 GLU HA 2 11 GLU H 0.000 . 4.200 3.568 3.530 3.587 . 0 0 "[ . ]" 2
536 2 10 GLU H 2 11 GLU H 0.000 . 3.300 2.714 2.542 2.883 . 0 0 "[ . ]" 2
537 2 10 GLU H 2 10 GLU QB 0.000 . 3.300 2.181 2.072 2.393 . 0 0 "[ . ]" 2
538 2 32 GLU H 2 32 GLU QG 0.000 . 4.200 2.378 1.828 3.904 . 0 0 "[ . ]" 2
539 2 32 GLU QG 2 33 GLN H 0.000 . 6.000 2.446 1.853 4.102 . 0 0 "[ . ]" 2
540 2 10 GLU H 2 11 GLU QG 0.000 . 6.000 5.343 5.028 5.659 . 0 0 "[ . ]" 2
541 2 38 LYS HA 2 41 VAL H 0.000 . 4.200 3.261 3.018 3.403 . 0 0 "[ . ]" 2
542 2 41 VAL H 2 41 VAL QG 0.000 . 3.300 2.265 1.995 2.485 . 0 0 "[ . ]" 2
543 2 12 LYS H 2 12 LYS QD 0.000 . 6.000 4.210 3.058 4.684 . 0 0 "[ . ]" 2
544 2 10 GLU H 2 12 LYS H 0.000 . 6.000 3.955 3.792 4.173 . 0 0 "[ . ]" 2
545 2 14 LYS HA 2 17 LYS QD 0.000 . 6.000 3.768 2.563 4.355 . 0 0 "[ . ]" 2
546 2 25 SER HA 2 28 ASN QB 0.000 . 4.200 2.776 2.230 4.094 . 0 0 "[ . ]" 2
547 2 10 GLU HA 2 13 VAL H 0.000 . 4.200 3.316 3.257 3.382 . 0 0 "[ . ]" 2
548 2 37 LEU H 2 37 LEU QB 0.000 . 3.300 2.126 2.057 2.334 . 0 0 "[ . ]" 2
549 2 10 GLU H 2 13 VAL H 0.000 . 6.000 4.741 4.644 4.882 . 0 0 "[ . ]" 2
550 2 13 VAL QG 2 14 LYS HA 0.000 . 6.000 3.459 3.352 3.538 . 0 0 "[ . ]" 2
551 2 14 LYS HA 2 14 LYS QD 0.000 . 4.200 2.040 1.892 2.164 . 0 0 "[ . ]" 2
552 2 14 LYS HA 2 17 LYS QE 0.000 . 6.000 3.114 2.701 3.486 . 0 0 "[ . ]" 2
553 2 14 LYS QD 2 17 LYS QE 0.000 . 3.300 3.098 2.799 3.251 . 0 0 "[ . ]" 2
554 2 14 LYS QD 2 17 LYS H 0.000 . 6.000 4.861 4.273 5.111 . 0 0 "[ . ]" 2
555 2 40 LYS HA 2 40 LYS QD 0.000 . 4.200 3.457 2.243 4.017 . 0 0 "[ . ]" 2
556 2 29 MET HA 2 33 GLN H 0.000 . 6.000 4.199 4.057 4.423 . 0 0 "[ . ]" 2
557 2 14 LYS QB 2 15 THR H 0.000 . 3.300 2.406 2.254 2.641 . 0 0 "[ . ]" 2
558 2 14 LYS QE 2 17 LYS QB 0.000 . 6.000 4.601 3.318 5.784 . 0 0 "[ . ]" 2
559 2 15 THR HB 2 16 LEU H 0.000 . 4.200 2.677 2.511 2.808 . 0 0 "[ . ]" 2
560 2 18 ALA MB 2 19 GLN H 0.000 . 3.300 2.178 2.075 2.257 . 0 0 "[ . ]" 2
561 2 18 ALA HA 2 19 GLN H 0.000 . 6.000 3.581 3.576 3.584 . 0 0 "[ . ]" 2
562 2 19 GLN H 2 19 GLN QG 0.000 . 3.300 2.348 1.867 2.781 . 0 0 "[ . ]" 2
563 2 16 LEU H 2 16 LEU QB 0.000 . 3.300 2.187 2.079 2.379 . 0 0 "[ . ]" 2
564 2 16 LEU QB 2 17 LYS H 0.000 . 4.200 2.445 2.302 2.588 . 0 0 "[ . ]" 2
565 2 17 LYS HA 2 17 LYS QG 0.000 . 3.300 1.980 1.901 2.086 . 0 0 "[ . ]" 2
566 2 10 GLU HA 2 10 GLU QG 0.000 . 3.300 2.234 1.987 2.509 . 0 0 "[ . ]" 2
567 2 18 ALA H 2 18 ALA MB 0.000 . 3.300 2.033 2.021 2.066 . 0 0 "[ . ]" 2
568 2 17 LYS QB 2 17 LYS QD 0.000 . 3.300 2.170 1.937 2.339 . 0 0 "[ . ]" 2
569 2 31 ARG QB 2 31 ARG QD 0.000 . 3.300 2.025 1.912 2.125 . 0 0 "[ . ]" 2
570 2 17 LYS QB 2 18 ALA H 0.000 . 3.300 2.767 2.497 3.040 . 0 0 "[ . ]" 2
571 2 40 LYS HA 2 40 LYS QG 0.000 . 3.300 2.204 1.912 2.399 . 0 0 "[ . ]" 2
572 2 17 LYS QG 2 18 ALA H 0.000 . 6.000 4.460 4.318 4.569 . 0 0 "[ . ]" 2
573 2 18 ALA H 2 19 GLN QG 0.000 . 6.000 4.818 3.630 5.395 . 0 0 "[ . ]" 2
574 2 19 GLN QB 2 20 ASN H 0.000 . 4.200 2.836 2.516 3.686 . 0 0 "[ . ]" 2
575 2 19 GLN H 2 19 GLN QE 0.000 . 6.000 4.587 3.732 4.787 . 0 0 "[ . ]" 2
576 2 19 GLN QG 2 20 ASN H 0.000 . 6.000 4.029 2.543 4.408 . 0 0 "[ . ]" 2
577 2 20 ASN H 2 20 ASN QB 0.000 . 3.300 2.156 2.050 2.251 . 0 0 "[ . ]" 2
578 2 20 ASN QB 2 21 SER H 0.000 . 4.200 2.326 2.001 2.608 . 0 0 "[ . ]" 2
579 2 2 CYS QB 2 3 GLY H 0.000 . 4.200 2.765 1.925 3.901 . 0 0 "[ . ]" 2
580 2 25 SER QB 2 26 THR H 0.000 . 4.200 2.518 2.112 3.223 . 0 0 "[ . ]" 2
581 2 21 SER QB 2 22 GLU H 0.000 . 3.300 3.002 2.859 3.260 . 0 0 "[ . ]" 2
582 2 22 GLU QG 2 23 LEU H 0.000 . 6.000 4.084 3.774 4.215 . 0 0 "[ . ]" 2
583 2 26 THR HA 2 29 MET QG 0.000 . 6.000 4.327 2.731 5.203 . 0 0 "[ . ]" 2
584 2 22 GLU QB 2 23 LEU H 0.000 . 3.300 2.215 1.958 2.408 . 0 0 "[ . ]" 2
585 2 23 LEU H 2 23 LEU QB 0.000 . 3.300 2.215 2.092 2.429 . 0 0 "[ . ]" 2
586 2 38 LYS H 2 38 LYS QB 0.000 . 3.300 2.305 2.121 2.534 . 0 0 "[ . ]" 2
587 2 24 ALA MB 2 25 SER HA 0.000 . 6.000 3.733 3.673 3.798 . 0 0 "[ . ]" 2
588 2 24 ALA MB 2 25 SER H 0.000 . 3.300 2.427 2.146 2.695 . 0 0 "[ . ]" 2
589 2 24 ALA MB 2 28 ASN QD 0.000 . 6.000 4.256 3.024 4.889 . 0 0 "[ . ]" 2
590 2 25 SER HA 2 28 ASN QD 0.000 . 6.000 3.622 1.853 4.705 . 0 0 "[ . ]" 2
591 2 25 SER HA 2 29 MET QB 0.000 . 6.000 5.027 4.712 5.280 . 0 0 "[ . ]" 2
592 2 26 THR HA 2 29 MET QB 0.000 . 3.300 2.691 2.309 3.070 . 0 0 "[ . ]" 2
593 2 26 THR HA 2 26 THR MG 0.000 . 3.300 2.296 2.143 2.410 . 0 0 "[ . ]" 2
594 2 26 THR H 2 26 THR MG 0.000 . 4.200 3.726 3.687 3.749 . 0 0 "[ . ]" 2
595 2 26 THR MG 2 29 MET QB 0.000 . 4.200 3.516 3.184 3.868 . 0 0 "[ . ]" 2
596 2 26 THR MG 2 30 LEU HG 0.000 . 3.300 2.941 2.455 3.250 . 0 0 "[ . ]" 2
597 2 33 GLN QG 2 34 VAL H 0.000 . 4.200 2.394 1.928 3.391 . 0 0 "[ . ]" 2
598 2 27 ALA MB 2 28 ASN HA 0.000 . 6.000 3.695 3.613 3.783 . 0 0 "[ . ]" 2
599 2 28 ASN HA 2 31 ARG QB 0.000 . 6.000 2.552 2.194 3.219 . 0 0 "[ . ]" 2
600 2 28 ASN QD 2 29 MET H 0.000 . 6.000 4.876 4.125 5.246 . 0 0 "[ . ]" 2
601 2 28 ASN QB 2 29 MET HA 0.000 . 6.000 4.003 3.806 4.420 . 0 0 "[ . ]" 2
602 2 29 MET QG 2 30 LEU H 0.000 . 6.000 3.816 3.126 4.379 . 0 0 "[ . ]" 2
603 2 33 GLN H 2 33 GLN QG 0.000 . 3.300 2.045 1.832 2.276 . 0 0 "[ . ]" 2
604 2 30 LEU H 2 30 LEU HG 0.000 . 3.300 2.067 1.874 2.539 . 0 0 "[ . ]" 2
605 2 31 ARG H 2 31 ARG QB 0.000 . 3.300 2.143 2.075 2.268 . 0 0 "[ . ]" 2
606 2 31 ARG QB 2 32 GLU HA 0.000 . 6.000 3.834 3.698 4.021 . 0 0 "[ . ]" 2
607 2 31 ARG QB 2 32 GLU H 0.000 . 3.300 2.577 2.356 2.922 . 0 0 "[ . ]" 2
608 2 3 GLY QA 2 6 ILE MD 0.000 . 4.200 2.749 2.243 3.234 . 0 0 "[ . ]" 2
609 2 3 GLY H 2 6 ILE MD 0.000 . 6.000 3.014 1.882 4.842 . 0 0 "[ . ]" 2
610 2 31 ARG HA 2 31 ARG HE 0.000 . 6.000 4.865 3.936 5.890 . 0 0 "[ . ]" 2
611 2 31 ARG HA 2 31 ARG QG 0.000 . 3.300 2.103 1.953 2.274 . 0 0 "[ . ]" 2
612 2 31 ARG HA 2 35 ALA MB 0.000 . 6.000 4.526 4.234 4.981 . 0 0 "[ . ]" 2
613 2 5 ARG H 2 5 ARG QB 0.000 . 3.300 2.201 2.087 2.453 . 0 0 "[ . ]" 2
614 2 31 ARG H 2 31 ARG QD 0.000 . 6.000 4.285 3.800 4.578 . 0 0 "[ . ]" 2
615 2 31 ARG H 2 31 ARG QG 0.000 . 4.200 3.683 3.218 3.971 . 0 0 "[ . ]" 2
616 2 31 ARG QG 2 32 GLU H 0.000 . 6.000 4.187 3.566 4.411 . 0 0 "[ . ]" 2
617 2 36 GLN H 2 36 GLN QG 0.000 . 3.300 2.237 1.853 2.992 . 0 0 "[ . ]" 2
618 2 33 GLN HA 2 34 VAL H 0.000 . 4.200 3.552 3.502 3.585 . 0 0 "[ . ]" 2
619 2 35 ALA HA 2 36 GLN H 0.000 . 4.200 3.562 3.529 3.581 . 0 0 "[ . ]" 2
620 2 34 VAL QG 2 38 LYS QE 0.000 . 3.300 2.488 1.790 3.277 . 0 0 "[ . ]" 2
621 2 34 VAL QG 2 35 ALA HA 0.000 . 6.000 3.417 3.183 3.984 . 0 0 "[ . ]" 2
622 2 36 GLN HA 2 39 GLN QG 0.000 . 4.200 3.267 2.391 4.013 . 0 0 "[ . ]" 2
623 2 36 GLN H 2 36 GLN QE 0.000 . 6.000 4.136 3.364 4.780 . 0 0 "[ . ]" 2
624 2 39 GLN HA 2 39 GLN QG 0.000 . 3.300 2.498 2.055 2.848 . 0 0 "[ . ]" 2
625 2 39 GLN H 2 39 GLN QG 0.000 . 4.200 2.741 1.928 4.038 . 0 0 "[ . ]" 2
626 2 36 GLN QG 2 37 LEU H 0.000 . 6.000 3.243 2.021 4.473 . 0 0 "[ . ]" 2
627 2 37 LEU QB 2 38 LYS H 0.000 . 3.300 2.558 2.375 2.783 . 0 0 "[ . ]" 2
628 2 42 MET H 2 42 MET QB 0.000 . 3.300 2.216 2.104 2.431 . 0 0 "[ . ]" 2
629 2 38 LYS QB 2 39 GLN H 0.000 . 3.300 2.637 2.248 3.027 . 0 0 "[ . ]" 2
630 2 38 LYS HA 2 38 LYS QD 0.000 . 4.200 2.499 1.929 3.375 . 0 0 "[ . ]" 2
631 2 38 LYS HA 2 41 VAL HB 0.000 . 3.300 2.775 2.348 3.029 . 0 0 "[ . ]" 2
632 2 38 LYS HA 2 41 VAL QG 0.000 . 3.300 2.625 1.905 2.970 . 0 0 "[ . ]" 2
633 2 42 MET H 2 42 MET QG 0.000 . 4.200 3.511 2.246 3.992 . 0 0 "[ . ]" 2
634 2 39 GLN QB 2 40 LYS H 0.000 . 3.300 2.563 2.250 2.912 . 0 0 "[ . ]" 2
635 2 40 LYS H 2 40 LYS QG 0.000 . 4.200 3.641 2.458 3.981 . 0 0 "[ . ]" 2
636 2 41 VAL HA 2 41 VAL QG 0.000 . 3.300 2.088 2.031 2.149 . 0 0 "[ . ]" 2
637 2 41 VAL H 2 41 VAL HB 0.000 . 3.300 2.498 2.393 2.683 . 0 0 "[ . ]" 2
638 2 41 VAL QG 2 42 MET H 0.000 . 4.200 3.301 2.868 3.500 . 0 0 "[ . ]" 2
639 2 41 VAL QG 2 43 ASN H 0.000 . 6.000 4.400 3.774 5.061 . 0 0 "[ . ]" 2
640 2 41 VAL QG 2 42 MET HA 0.000 . 6.000 3.621 3.338 4.024 . 0 0 "[ . ]" 2
641 2 42 MET QB 2 43 ASN H 0.000 . 4.200 3.667 2.931 4.056 . 0 0 "[ . ]" 2
642 2 43 ASN QB 2 44 TYR H 0.000 . 6.000 3.174 1.863 3.969 . 0 0 "[ . ]" 2
643 2 44 TYR HA 2 44 TYR QE 0.000 . 6.000 4.349 4.104 4.529 . 0 0 "[ . ]" 2
644 2 5 ARG H 2 5 ARG HE 0.000 . 6.000 5.163 4.494 5.902 . 0 0 "[ . ]" 2
645 2 7 ALA MB 2 8 ARG H 0.000 . 3.300 2.572 2.096 2.927 . 0 0 "[ . ]" 2
646 2 5 ARG H 2 5 ARG QD 0.000 . 6.000 3.571 2.389 4.650 . 0 0 "[ . ]" 2
647 2 5 ARG QB 2 5 ARG QD 0.000 . 3.300 2.128 1.892 2.287 . 0 0 "[ . ]" 2
648 2 8 ARG QB 2 8 ARG QD 0.000 . 3.300 2.191 1.980 2.431 . 0 0 "[ . ]" 2
649 2 8 ARG H 2 8 ARG QB 0.000 . 3.300 2.276 2.035 2.653 . 0 0 "[ . ]" 2
650 2 8 ARG QB 2 9 LEU H 0.000 . 3.300 2.386 2.233 2.540 . 0 0 "[ . ]" 2
651 2 6 ILE QG 2 7 ALA H 0.000 . 6.000 3.902 1.826 4.515 . 0 0 "[ . ]" 2
652 2 8 ARG H 2 8 ARG HE 0.000 . 6.000 5.062 3.751 5.813 . 0 0 "[ . ]" 2
653 2 8 ARG H 2 8 ARG QD 0.000 . 6.000 3.786 2.511 4.703 . 0 0 "[ . ]" 2
654 2 9 LEU H 2 9 LEU QB 0.000 . 3.300 2.183 2.080 2.509 . 0 0 "[ . ]" 2
655 2 9 LEU QB 2 10 GLU H 0.000 . 4.200 2.690 2.382 3.030 . 0 0 "[ . ]" 2
656 2 10 GLU H 2 10 GLU QG 0.000 . 3.300 2.831 2.292 3.193 . 0 0 "[ . ]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 391
_Distance_constraint_stats_list.Viol_count 0
_Distance_constraint_stats_list.Viol_total 0.000
_Distance_constraint_stats_list.Viol_max 0.000
_Distance_constraint_stats_list.Viol_rms 0.0000
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0000
_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 2 CYS 0.000 0.000 . 0 "[ . ]"
1 3 GLY 0.000 0.000 . 0 "[ . ]"
1 4 GLY 0.000 0.000 . 0 "[ . ]"
1 5 ARG 0.000 0.000 . 0 "[ . ]"
1 6 ILE 0.000 0.000 . 0 "[ . ]"
1 7 ALA 0.000 0.000 . 0 "[ . ]"
1 8 ARG 0.000 0.000 . 0 "[ . ]"
1 9 LEU 0.000 0.000 . 0 "[ . ]"
1 10 GLU 0.000 0.000 . 0 "[ . ]"
1 11 GLU 0.000 0.000 . 0 "[ . ]"
1 12 LYS 0.000 0.000 . 0 "[ . ]"
1 13 VAL 0.000 0.000 . 0 "[ . ]"
1 14 LYS 0.000 0.000 . 0 "[ . ]"
1 15 THR 0.000 0.000 . 0 "[ . ]"
1 16 LEU 0.000 0.000 . 0 "[ . ]"
1 17 LYS 0.000 0.000 . 0 "[ . ]"
1 18 ALA 0.000 0.000 . 0 "[ . ]"
1 19 GLN 0.000 0.000 . 0 "[ . ]"
1 20 ASN 0.000 0.000 . 0 "[ . ]"
1 21 SER 0.000 0.000 . 0 "[ . ]"
1 22 GLU 0.000 0.000 . 0 "[ . ]"
1 23 LEU 0.000 0.000 . 0 "[ . ]"
1 24 ALA 0.000 0.000 . 0 "[ . ]"
1 25 SER 0.000 0.000 . 0 "[ . ]"
1 26 THR 0.000 0.000 . 0 "[ . ]"
1 27 ALA 0.000 0.000 . 0 "[ . ]"
1 28 ASN 0.000 0.000 . 0 "[ . ]"
1 29 MET 0.000 0.000 . 0 "[ . ]"
1 30 LEU 0.000 0.000 . 0 "[ . ]"
1 31 ARG 0.000 0.000 . 0 "[ . ]"
1 32 GLU 0.000 0.000 . 0 "[ . ]"
1 33 GLN 0.000 0.000 . 0 "[ . ]"
1 34 VAL 0.000 0.000 . 0 "[ . ]"
1 35 ALA 0.000 0.000 . 0 "[ . ]"
1 36 GLN 0.000 0.000 . 0 "[ . ]"
1 37 LEU 0.000 0.000 . 0 "[ . ]"
1 38 LYS 0.000 0.000 . 0 "[ . ]"
1 39 GLN 0.000 0.000 . 0 "[ . ]"
1 40 LYS 0.000 0.000 . 0 "[ . ]"
1 41 VAL 0.000 0.000 . 0 "[ . ]"
1 42 MET 0.000 0.000 . 0 "[ . ]"
1 43 ASN 0.000 0.000 . 0 "[ . ]"
1 44 TYR 0.000 0.000 . 0 "[ . ]"
2 2 CYS 0.000 0.000 . 0 "[ . ]"
2 3 GLY 0.000 0.000 . 0 "[ . ]"
2 4 GLY 0.000 0.000 . 0 "[ . ]"
2 5 ARG 0.000 0.000 . 0 "[ . ]"
2 6 ILE 0.000 0.000 . 0 "[ . ]"
2 7 ALA 0.000 0.000 . 0 "[ . ]"
2 8 ARG 0.000 0.000 . 0 "[ . ]"
2 9 LEU 0.000 0.000 . 0 "[ . ]"
2 10 GLU 0.000 0.000 . 0 "[ . ]"
2 11 GLU 0.000 0.000 . 0 "[ . ]"
2 12 LYS 0.000 0.000 . 0 "[ . ]"
2 13 VAL 0.000 0.000 . 0 "[ . ]"
2 14 LYS 0.000 0.000 . 0 "[ . ]"
2 15 THR 0.000 0.000 . 0 "[ . ]"
2 16 LEU 0.000 0.000 . 0 "[ . ]"
2 17 LYS 0.000 0.000 . 0 "[ . ]"
2 18 ALA 0.000 0.000 . 0 "[ . ]"
2 19 GLN 0.000 0.000 . 0 "[ . ]"
2 20 ASN 0.000 0.000 . 0 "[ . ]"
2 21 SER 0.000 0.000 . 0 "[ . ]"
2 22 GLU 0.000 0.000 . 0 "[ . ]"
2 23 LEU 0.000 0.000 . 0 "[ . ]"
2 24 ALA 0.000 0.000 . 0 "[ . ]"
2 25 SER 0.000 0.000 . 0 "[ . ]"
2 26 THR 0.000 0.000 . 0 "[ . ]"
2 27 ALA 0.000 0.000 . 0 "[ . ]"
2 28 ASN 0.000 0.000 . 0 "[ . ]"
2 29 MET 0.000 0.000 . 0 "[ . ]"
2 30 LEU 0.000 0.000 . 0 "[ . ]"
2 31 ARG 0.000 0.000 . 0 "[ . ]"
2 32 GLU 0.000 0.000 . 0 "[ . ]"
2 33 GLN 0.000 0.000 . 0 "[ . ]"
2 34 VAL 0.000 0.000 . 0 "[ . ]"
2 35 ALA 0.000 0.000 . 0 "[ . ]"
2 36 GLN 0.000 0.000 . 0 "[ . ]"
2 37 LEU 0.000 0.000 . 0 "[ . ]"
2 38 LYS 0.000 0.000 . 0 "[ . ]"
2 39 GLN 0.000 0.000 . 0 "[ . ]"
2 40 LYS 0.000 0.000 . 0 "[ . ]"
2 41 VAL 0.000 0.000 . 0 "[ . ]"
2 42 MET 0.000 0.000 . 0 "[ . ]"
2 43 ASN 0.000 0.000 . 0 "[ . ]"
2 44 TYR 0.000 0.000 . 0 "[ . ]"
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 7 ALA HA 1 9 LEU QB 0.000 . 5.000 3.728 3.570 3.827 . 0 0 "[ . ]" 3
2 1 11 GLU HA 1 14 LYS QG 0.000 . 5.000 3.646 3.199 4.012 . 0 0 "[ . ]" 3
3 1 11 GLU HA 1 15 THR H 0.000 . 3.300 2.904 2.767 2.964 . 0 0 "[ . ]" 3
4 1 11 GLU HA 1 15 THR MG 0.000 . 5.000 3.540 3.292 3.875 . 0 0 "[ . ]" 3
5 1 9 LEU QD 1 11 GLU H 0.000 . 5.000 2.828 2.636 2.950 . 0 0 "[ . ]" 3
6 1 10 GLU QG 1 11 GLU H 0.000 . 5.000 3.714 3.522 3.845 . 0 0 "[ . ]" 3
7 1 6 ILE H 1 6 ILE QG 0.000 . 3.300 2.128 1.606 2.543 . 0 0 "[ . ]" 3
8 1 5 ARG QG 1 6 ILE H 0.000 . 7.000 3.472 3.406 3.557 . 0 0 "[ . ]" 3
9 1 38 LYS HA 1 42 MET H 0.000 . 5.000 3.783 3.302 4.047 . 0 0 "[ . ]" 3
10 1 6 ILE H 1 10 GLU QG 0.000 . 5.000 3.736 3.504 3.912 . 0 0 "[ . ]" 3
11 1 13 VAL HB 1 16 LEU H 0.000 . 7.000 4.033 3.751 4.285 . 0 0 "[ . ]" 3
12 1 10 GLU QB 1 12 LYS QB 0.000 . 3.300 2.795 2.762 2.830 . 0 0 "[ . ]" 3
13 1 11 GLU QB 1 15 THR HB 0.000 . 7.000 5.209 4.342 5.943 . 0 0 "[ . ]" 3
14 1 11 GLU QG 1 12 LYS H 0.000 . 5.000 3.952 3.918 3.987 . 0 0 "[ . ]" 3
15 1 11 GLU QG 1 13 VAL H 0.000 . 7.000 5.308 5.042 5.569 . 0 0 "[ . ]" 3
16 1 11 GLU QG 1 15 THR MG 0.000 . 7.000 5.349 4.666 5.736 . 0 0 "[ . ]" 3
17 1 11 GLU QG 1 15 THR MG 0.000 . 7.000 5.511 4.709 5.962 . 0 0 "[ . ]" 3
18 1 12 LYS H 1 15 THR HB 0.000 . 7.000 4.256 4.097 4.484 . 0 0 "[ . ]" 3
19 1 10 GLU QG 1 12 LYS H 0.000 . 5.000 3.993 3.184 4.310 . 0 0 "[ . ]" 3
20 1 5 ARG H 1 6 ILE QG 0.000 . 3.300 2.820 2.628 2.952 . 0 0 "[ . ]" 3
21 1 10 GLU QG 1 12 LYS H 0.000 . 3.300 2.049 1.627 3.021 . 0 0 "[ . ]" 3
22 1 9 LEU QB 1 12 LYS H 0.000 . 7.000 3.694 3.578 3.872 . 0 0 "[ . ]" 3
23 1 12 LYS H 1 15 THR MG 0.000 . 7.000 4.380 4.106 4.847 . 0 0 "[ . ]" 3
24 1 5 ARG H 1 6 ILE QG 0.000 . 7.000 3.293 2.849 3.737 . 0 0 "[ . ]" 3
25 1 12 LYS H 1 13 VAL QG 0.000 . 5.000 3.507 3.363 3.657 . 0 0 "[ . ]" 3
26 1 9 LEU QB 1 12 LYS H 0.000 . 5.000 4.088 3.886 4.225 . 0 0 "[ . ]" 3
27 1 9 LEU QD 1 12 LYS QB 0.000 . 3.300 2.310 1.932 2.642 . 0 0 "[ . ]" 3
28 1 12 LYS QB 1 14 LYS QG 0.000 . 3.300 2.756 2.502 2.920 . 0 0 "[ . ]" 3
29 1 12 LYS QB 1 13 VAL HB 0.000 . 3.300 2.930 2.883 2.968 . 0 0 "[ . ]" 3
30 1 12 LYS QB 1 15 THR HB 0.000 . 5.000 2.665 2.419 2.795 . 0 0 "[ . ]" 3
31 1 8 ARG QD 1 12 LYS QB 0.000 . 5.000 3.281 3.055 3.676 . 0 0 "[ . ]" 3
32 1 12 LYS QB 1 16 LEU H 0.000 . 5.000 4.063 3.880 4.355 . 0 0 "[ . ]" 3
33 1 12 LYS QB 1 17 LYS H 0.000 . 7.000 4.597 4.364 5.178 . 0 0 "[ . ]" 3
34 1 10 GLU HA 1 12 LYS QB 0.000 . 3.300 2.500 2.043 2.838 . 0 0 "[ . ]" 3
35 1 5 ARG QG 1 9 LEU QB 0.000 . 7.000 2.926 2.732 3.103 . 0 0 "[ . ]" 3
36 1 5 ARG QG 1 16 LEU QD 0.000 . 3.300 1.763 1.584 1.941 . 0 0 "[ . ]" 3
37 1 12 LYS QD 1 13 VAL HA 0.000 . 7.000 3.503 3.368 3.688 . 0 0 "[ . ]" 3
38 1 12 LYS QD 1 15 THR HB 0.000 . 7.000 4.477 4.322 4.731 . 0 0 "[ . ]" 3
39 1 12 LYS QD 1 16 LEU H 0.000 . 7.000 3.926 3.813 4.055 . 0 0 "[ . ]" 3
40 1 12 LYS QD 1 16 LEU QD 0.000 . 5.000 1.763 1.584 1.941 . 0 0 "[ . ]" 3
41 1 12 LYS QD 1 13 VAL H 0.000 . 7.000 3.938 3.565 4.350 . 0 0 "[ . ]" 3
42 1 9 LEU QD 1 12 LYS QD 0.000 . 5.000 2.183 1.922 2.507 . 0 0 "[ . ]" 3
43 1 12 LYS QD 1 16 LEU HA 0.000 . 5.000 4.332 4.223 4.455 . 0 0 "[ . ]" 3
44 1 12 LYS QD 1 18 ALA H 0.000 . 7.000 4.237 3.969 4.532 . 0 0 "[ . ]" 3
45 1 8 ARG QG 1 10 GLU H 0.000 . 7.000 4.719 4.439 4.972 . 0 0 "[ . ]" 3
46 1 12 LYS QE 1 13 VAL QG 0.000 . 7.000 1.881 1.662 2.546 . 0 0 "[ . ]" 3
47 1 8 ARG QG 1 12 LYS QE 0.000 . 7.000 4.158 3.699 4.394 . 0 0 "[ . ]" 3
48 1 9 LEU HG 1 12 LYS QE 0.000 . 7.000 3.473 2.084 4.370 . 0 0 "[ . ]" 3
49 1 12 LYS QE 1 16 LEU QD 0.000 . 5.000 2.754 2.500 3.084 . 0 0 "[ . ]" 3
50 1 12 LYS QE 1 13 VAL QG 0.000 . 5.000 2.783 1.970 3.648 . 0 0 "[ . ]" 3
51 1 12 LYS QE 1 13 VAL QG 0.000 . 7.000 2.879 1.983 3.806 . 0 0 "[ . ]" 3
52 1 12 LYS QE 1 16 LEU QD 0.000 . 7.000 3.820 2.707 4.681 . 0 0 "[ . ]" 3
53 1 9 LEU H 1 12 LYS QE 0.000 . 7.000 4.800 3.880 5.882 . 0 0 "[ . ]" 3
54 1 10 GLU HA 1 12 LYS QE 0.000 . 7.000 5.509 4.625 6.014 . 0 0 "[ . ]" 3
55 1 12 LYS QG 1 13 VAL HA 0.000 . 7.000 3.333 3.108 3.578 . 0 0 "[ . ]" 3
56 1 12 LYS QG 1 13 VAL H 0.000 . 5.000 3.452 3.210 3.700 . 0 0 "[ . ]" 3
57 1 6 ILE QG 1 9 LEU QB 0.000 . 3.300 2.804 2.621 2.935 . 0 0 "[ . ]" 3
58 1 12 LYS QG 1 16 LEU QD 0.000 . 3.300 2.146 1.808 2.622 . 0 0 "[ . ]" 3
59 1 6 ILE QG 1 9 LEU QB 0.000 . 5.000 3.310 3.101 3.878 . 0 0 "[ . ]" 3
60 1 6 ILE QG 1 8 ARG H 0.000 . 5.000 3.824 3.239 4.374 . 0 0 "[ . ]" 3
61 1 6 ILE QG 1 9 LEU H 0.000 . 7.000 4.383 4.124 4.640 . 0 0 "[ . ]" 3
62 1 13 VAL HA 1 16 LEU HA 0.000 . 5.000 3.735 3.679 3.781 . 0 0 "[ . ]" 3
63 1 13 VAL HA 1 15 THR MG 0.000 . 3.300 2.237 2.064 2.366 . 0 0 "[ . ]" 3
64 1 9 LEU HG 1 13 VAL HA 0.000 . 5.000 3.556 3.130 3.861 . 0 0 "[ . ]" 3
65 1 13 VAL HA 1 16 LEU QD 0.000 . 3.300 1.855 1.630 2.177 . 0 0 "[ . ]" 3
66 1 13 VAL HA 1 16 LEU QD 0.000 . 3.300 1.857 1.631 2.180 . 0 0 "[ . ]" 3
67 1 34 VAL HA 1 38 LYS QG 0.000 . 5.000 3.944 3.427 4.487 . 0 0 "[ . ]" 3
68 1 9 LEU QB 1 13 VAL HA 0.000 . 3.300 2.236 2.064 2.366 . 0 0 "[ . ]" 3
69 1 10 GLU HA 1 13 VAL HA 0.000 . 7.000 4.724 4.560 4.956 . 0 0 "[ . ]" 3
70 1 13 VAL HB 1 16 LEU QD 0.000 . 3.300 2.394 2.072 2.646 . 0 0 "[ . ]" 3
71 1 13 VAL HB 1 17 LYS QD 0.000 . 7.000 3.129 2.977 3.299 . 0 0 "[ . ]" 3
72 1 13 VAL HB 1 16 LEU H 0.000 . 7.000 4.360 4.188 4.658 . 0 0 "[ . ]" 3
73 1 13 VAL HB 1 17 LYS H 0.000 . 7.000 4.390 4.253 4.765 . 0 0 "[ . ]" 3
74 1 10 GLU HA 1 13 VAL H 0.000 . 3.300 2.908 2.867 2.964 . 0 0 "[ . ]" 3
75 1 9 LEU QD 1 13 VAL H 0.000 . 3.300 1.900 1.791 2.076 . 0 0 "[ . ]" 3
76 1 13 VAL H 1 14 LYS QD 0.000 . 7.000 3.848 3.402 4.567 . 0 0 "[ . ]" 3
77 1 13 VAL H 1 16 LEU QD 0.000 . 3.300 2.688 2.466 2.906 . 0 0 "[ . ]" 3
78 1 13 VAL H 1 13 VAL QG 0.000 . 3.300 1.913 1.798 2.099 . 0 0 "[ . ]" 3
79 1 9 LEU QD 1 13 VAL H 0.000 . 3.300 1.915 1.799 2.095 . 0 0 "[ . ]" 3
80 1 13 VAL H 1 13 VAL QG 0.000 . 3.300 1.922 1.801 2.107 . 0 0 "[ . ]" 3
81 1 13 VAL QG 1 17 LYS QG 0.000 . 3.300 1.903 1.657 2.141 . 0 0 "[ . ]" 3
82 1 13 VAL QG 1 15 THR HB 0.000 . 7.000 2.690 2.515 2.857 . 0 0 "[ . ]" 3
83 1 13 VAL QG 1 15 THR H 0.000 . 5.000 3.384 3.315 3.469 . 0 0 "[ . ]" 3
84 1 13 VAL QG 1 14 LYS H 0.000 . 3.300 2.655 2.539 2.736 . 0 0 "[ . ]" 3
85 1 13 VAL QG 1 14 LYS HA 0.000 . 3.300 2.940 2.887 2.958 . 0 0 "[ . ]" 3
86 1 13 VAL QG 1 14 LYS HA 0.000 . 5.000 2.993 2.930 3.056 . 0 0 "[ . ]" 3
87 1 13 VAL QG 1 15 THR HB 0.000 . 7.000 3.385 3.264 3.555 . 0 0 "[ . ]" 3
88 1 13 VAL QG 1 17 LYS QE 0.000 . 5.000 1.908 1.658 2.513 . 0 0 "[ . ]" 3
89 1 13 VAL QG 1 17 LYS H 0.000 . 5.000 2.612 2.435 2.905 . 0 0 "[ . ]" 3
90 1 9 LEU QD 1 10 GLU HA 0.000 . 3.300 1.954 1.730 2.204 . 0 0 "[ . ]" 3
91 1 9 LEU QD 1 10 GLU H 0.000 . 7.000 3.057 2.727 3.303 . 0 0 "[ . ]" 3
92 1 6 ILE QG 1 9 LEU HA 0.000 . 3.300 2.040 1.571 2.391 . 0 0 "[ . ]" 3
93 1 4 GLY QA 1 6 ILE QG 0.000 . 5.000 3.318 3.009 3.715 . 0 0 "[ . ]" 3
94 1 6 ILE QG 1 10 GLU QG 0.000 . 7.000 2.490 2.103 2.802 . 0 0 "[ . ]" 3
95 1 4 GLY QA 1 6 ILE QG 0.000 . 3.300 2.365 2.001 2.645 . 0 0 "[ . ]" 3
96 1 6 ILE QG 1 9 LEU H 0.000 . 3.300 2.648 2.095 2.835 . 0 0 "[ . ]" 3
97 1 6 ILE QG 1 10 GLU QG 0.000 . 3.300 2.492 2.103 2.805 . 0 0 "[ . ]" 3
98 1 6 ILE QG 1 10 GLU H 0.000 . 5.000 3.028 2.710 3.267 . 0 0 "[ . ]" 3
99 1 3 GLY H 1 6 ILE QG 0.000 . 7.000 2.964 2.674 3.208 . 0 0 "[ . ]" 3
100 1 13 VAL QG 1 14 LYS H 0.000 . 5.000 2.923 2.700 3.044 . 0 0 "[ . ]" 3
101 1 13 VAL QG 1 14 LYS QG 0.000 . 5.000 3.462 3.329 3.711 . 0 0 "[ . ]" 3
102 1 13 VAL QG 1 15 THR H 0.000 . 5.000 4.183 3.990 4.315 . 0 0 "[ . ]" 3
103 1 13 VAL QG 1 16 LEU H 0.000 . 7.000 3.709 3.634 3.774 . 0 0 "[ . ]" 3
104 1 10 GLU HA 1 13 VAL QG 0.000 . 5.000 2.531 2.014 2.852 . 0 0 "[ . ]" 3
105 1 13 VAL QG 1 17 LYS H 0.000 . 7.000 3.310 3.178 3.383 . 0 0 "[ . ]" 3
106 1 14 LYS HA 1 16 LEU QD 0.000 . 3.300 2.277 1.686 2.508 . 0 0 "[ . ]" 3
107 1 14 LYS HA 1 15 THR MG 0.000 . 5.000 4.076 3.991 4.157 . 0 0 "[ . ]" 3
108 1 14 LYS HA 1 17 LYS QG 0.000 . 5.000 4.044 3.601 4.458 . 0 0 "[ . ]" 3
109 1 3 GLY QA 1 5 ARG QG 0.000 . 3.300 2.574 2.163 2.913 . 0 0 "[ . ]" 3
110 1 14 LYS QD 1 16 LEU QD 0.000 . 5.000 2.278 1.860 2.780 . 0 0 "[ . ]" 3
111 1 14 LYS H 1 16 LEU QD 0.000 . 7.000 3.281 3.109 3.465 . 0 0 "[ . ]" 3
112 1 14 LYS H 1 15 THR MG 0.000 . 7.000 3.629 3.484 3.755 . 0 0 "[ . ]" 3
113 1 14 LYS H 1 15 THR MG 0.000 . 7.000 3.930 3.690 4.134 . 0 0 "[ . ]" 3
114 1 10 GLU HA 1 14 LYS H 0.000 . 5.000 3.801 3.583 4.020 . 0 0 "[ . ]" 3
115 1 14 LYS QG 1 15 THR HA 0.000 . 5.000 3.272 3.078 3.422 . 0 0 "[ . ]" 3
116 1 14 LYS QG 1 16 LEU H 0.000 . 7.000 4.614 4.413 4.786 . 0 0 "[ . ]" 3
117 1 14 LYS QG 1 18 ALA HA 0.000 . 7.000 5.592 4.995 6.132 . 0 0 "[ . ]" 3
118 1 15 THR HA 1 16 LEU QD 0.000 . 3.300 2.253 2.146 2.381 . 0 0 "[ . ]" 3
119 1 15 THR HB 1 16 LEU HG 0.000 . 7.000 3.362 2.874 3.708 . 0 0 "[ . ]" 3
120 1 15 THR HB 1 16 LEU QD 0.000 . 3.300 2.706 2.527 2.881 . 0 0 "[ . ]" 3
121 1 15 THR HB 1 17 LYS HA 0.000 . 7.000 3.880 3.830 3.922 . 0 0 "[ . ]" 3
122 1 15 THR H 1 15 THR HB 0.000 . 3.300 2.511 2.195 2.919 . 0 0 "[ . ]" 3
123 1 9 LEU QB 1 15 THR HB 0.000 . 7.000 3.960 3.777 4.140 . 0 0 "[ . ]" 3
124 1 15 THR HB 1 17 LYS QD 0.000 . 7.000 3.917 3.639 4.073 . 0 0 "[ . ]" 3
125 1 15 THR HB 1 17 LYS QG 0.000 . 7.000 4.247 3.961 4.359 . 0 0 "[ . ]" 3
126 1 15 THR H 1 16 LEU HG 0.000 . 7.000 4.306 3.736 4.481 . 0 0 "[ . ]" 3
127 1 15 THR H 1 16 LEU QD 0.000 . 7.000 3.600 3.484 3.705 . 0 0 "[ . ]" 3
128 1 17 LYS HA 1 19 GLN H 0.000 . 7.000 4.426 4.256 4.597 . 0 0 "[ . ]" 3
129 1 15 THR H 1 17 LYS QB 0.000 . 5.000 4.009 3.852 4.179 . 0 0 "[ . ]" 3
130 1 15 THR MG 1 19 GLN QE 0.000 . 5.000 3.482 3.119 3.845 . 0 0 "[ . ]" 3
131 1 15 THR MG 1 19 GLN QE 0.000 . 5.000 3.668 3.132 4.081 . 0 0 "[ . ]" 3
132 1 15 THR MG 1 19 GLN QG 0.000 . 5.000 3.100 2.717 3.525 . 0 0 "[ . ]" 3
133 1 15 THR MG 1 19 GLN QE 0.000 . 5.000 3.749 3.138 4.273 . 0 0 "[ . ]" 3
134 1 15 THR MG 1 19 GLN QG 0.000 . 7.000 3.186 2.727 3.726 . 0 0 "[ . ]" 3
135 1 15 THR MG 1 20 ASN QD 0.000 . 7.000 3.271 2.917 3.564 . 0 0 "[ . ]" 3
136 1 15 THR MG 1 17 LYS QD 0.000 . 5.000 2.596 2.468 2.699 . 0 0 "[ . ]" 3
137 1 15 THR MG 1 17 LYS H 0.000 . 5.000 2.169 2.047 2.297 . 0 0 "[ . ]" 3
138 1 15 THR MG 1 18 ALA H 0.000 . 7.000 3.550 3.345 3.844 . 0 0 "[ . ]" 3
139 1 15 THR MG 1 19 GLN QG 0.000 . 5.000 3.243 2.737 3.859 . 0 0 "[ . ]" 3
140 1 16 LEU HA 1 17 LYS QG 0.000 . 5.000 2.443 2.239 2.577 . 0 0 "[ . ]" 3
141 1 16 LEU HA 1 17 LYS QG 0.000 . 3.300 2.451 2.245 2.587 . 0 0 "[ . ]" 3
142 1 16 LEU HA 1 20 ASN QD 0.000 . 5.000 3.290 2.996 3.595 . 0 0 "[ . ]" 3
143 1 16 LEU HA 1 20 ASN QB 0.000 . 7.000 3.579 3.142 3.780 . 0 0 "[ . ]" 3
144 1 16 LEU HA 1 16 LEU QD 0.000 . 3.300 2.002 1.757 2.353 . 0 0 "[ . ]" 3
145 1 16 LEU HA 1 17 LYS QD 0.000 . 3.300 3.005 2.998 3.013 . 0 0 "[ . ]" 3
146 1 16 LEU HA 1 20 ASN QD 0.000 . 5.000 3.326 3.006 3.692 . 0 0 "[ . ]" 3
147 1 16 LEU QB 1 20 ASN QD 0.000 . 5.000 3.299 2.926 3.587 . 0 0 "[ . ]" 3
148 1 16 LEU QB 1 20 ASN H 0.000 . 7.000 3.853 3.649 4.058 . 0 0 "[ . ]" 3
149 1 16 LEU QB 1 17 LYS QD 0.000 . 5.000 3.063 2.828 3.296 . 0 0 "[ . ]" 3
150 1 16 LEU HG 1 20 ASN QD 0.000 . 7.000 3.925 3.499 4.366 . 0 0 "[ . ]" 3
151 1 5 ARG QB 1 10 GLU QG 0.000 . 5.000 3.760 3.103 4.079 . 0 0 "[ . ]" 3
152 1 8 ARG QG 1 10 GLU QG 0.000 . 7.000 3.822 3.129 4.180 . 0 0 "[ . ]" 3
153 1 16 LEU HG 1 20 ASN H 0.000 . 7.000 5.069 4.719 5.484 . 0 0 "[ . ]" 3
154 1 16 LEU H 1 16 LEU HG 0.000 . 3.300 2.585 2.015 2.936 . 0 0 "[ . ]" 3
155 1 16 LEU HG 1 17 LYS QE 0.000 . 7.000 4.962 4.681 5.319 . 0 0 "[ . ]" 3
156 1 16 LEU HG 1 17 LYS H 0.000 . 7.000 4.033 3.769 4.255 . 0 0 "[ . ]" 3
157 1 16 LEU QD 1 19 GLN QE 0.000 . 7.000 2.616 2.117 3.032 . 0 0 "[ . ]" 3
158 1 8 ARG QD 1 9 LEU QD 0.000 . 5.000 2.393 1.641 2.698 . 0 0 "[ . ]" 3
159 1 16 LEU QD 1 19 GLN QE 0.000 . 7.000 2.180 1.584 2.798 . 0 0 "[ . ]" 3
160 1 16 LEU QD 1 20 ASN QB 0.000 . 5.000 2.620 2.246 3.033 . 0 0 "[ . ]" 3
161 1 16 LEU QD 1 20 ASN QD 0.000 . 3.300 2.197 1.973 2.556 . 0 0 "[ . ]" 3
162 1 16 LEU QD 1 20 ASN QD 0.000 . 3.300 2.200 1.976 2.561 . 0 0 "[ . ]" 3
163 1 16 LEU QD 1 20 ASN H 0.000 . 7.000 3.491 3.321 3.900 . 0 0 "[ . ]" 3
164 1 8 ARG HE 1 9 LEU QD 0.000 . 7.000 2.794 2.132 3.321 . 0 0 "[ . ]" 3
165 1 16 LEU QD 1 20 ASN QD 0.000 . 3.300 2.449 2.001 2.922 . 0 0 "[ . ]" 3
166 1 6 ILE HA 1 9 LEU QD 0.000 . 7.000 2.540 1.977 3.346 . 0 0 "[ . ]" 3
167 1 16 LEU QD 1 18 ALA H 0.000 . 7.000 4.085 3.744 4.327 . 0 0 "[ . ]" 3
168 1 16 LEU QD 1 19 GLN QG 0.000 . 5.000 2.690 2.257 3.200 . 0 0 "[ . ]" 3
169 1 16 LEU QD 1 20 ASN QB 0.000 . 5.000 2.417 1.643 2.725 . 0 0 "[ . ]" 3
170 1 16 LEU QD 1 18 ALA HA 0.000 . 7.000 3.751 3.464 3.924 . 0 0 "[ . ]" 3
171 1 16 LEU QD 1 20 ASN QD 0.000 . 3.300 2.181 1.905 2.540 . 0 0 "[ . ]" 3
172 1 16 LEU QD 1 20 ASN QD 0.000 . 3.300 2.198 1.971 2.559 . 0 0 "[ . ]" 3
173 1 16 LEU QD 1 20 ASN QB 0.000 . 5.000 2.764 2.374 3.150 . 0 0 "[ . ]" 3
174 1 16 LEU QD 1 20 ASN QD 0.000 . 5.000 2.443 1.995 2.915 . 0 0 "[ . ]" 3
175 1 16 LEU QD 1 17 LYS H 0.000 . 5.000 2.754 2.501 3.167 . 0 0 "[ . ]" 3
176 1 17 LYS HA 1 19 GLN QB 0.000 . 3.300 2.509 2.045 2.850 . 0 0 "[ . ]" 3
177 1 17 LYS HA 1 20 ASN QD 0.000 . 5.000 3.382 2.832 4.030 . 0 0 "[ . ]" 3
178 1 17 LYS HA 1 20 ASN QD 0.000 . 7.000 3.436 3.148 4.053 . 0 0 "[ . ]" 3
179 1 17 LYS QD 1 19 GLN QG 0.000 . 7.000 2.931 2.722 3.150 . 0 0 "[ . ]" 3
180 1 17 LYS QD 1 20 ASN QB 0.000 . 7.000 4.043 3.711 4.417 . 0 0 "[ . ]" 3
181 1 17 LYS QD 1 20 ASN H 0.000 . 7.000 5.215 4.853 5.560 . 0 0 "[ . ]" 3
182 1 17 LYS H 1 20 ASN QD 0.000 . 7.000 4.890 4.341 5.448 . 0 0 "[ . ]" 3
183 1 17 LYS QG 1 19 GLN QB 0.000 . 5.000 2.763 2.505 2.931 . 0 0 "[ . ]" 3
184 1 17 LYS QG 1 19 GLN QE 0.000 . 7.000 4.339 3.748 4.957 . 0 0 "[ . ]" 3
185 1 17 LYS QG 1 20 ASN QD 0.000 . 7.000 3.788 3.233 4.378 . 0 0 "[ . ]" 3
186 1 18 ALA H 1 22 GLU QG 0.000 . 7.000 5.759 4.954 6.214 . 0 0 "[ . ]" 3
187 1 19 GLN HA 1 23 LEU QD 0.000 . 3.300 1.784 1.578 2.549 . 0 0 "[ . ]" 3
188 1 19 GLN HA 1 23 LEU H 0.000 . 7.000 3.216 2.976 3.490 . 0 0 "[ . ]" 3
189 1 19 GLN HA 1 23 LEU H 0.000 . 5.000 3.272 3.010 3.555 . 0 0 "[ . ]" 3
190 1 19 GLN QB 1 20 ASN QD 0.000 . 3.300 2.207 1.832 2.640 . 0 0 "[ . ]" 3
191 1 19 GLN QB 1 21 SER H 0.000 . 7.000 4.077 3.904 4.271 . 0 0 "[ . ]" 3
192 1 19 GLN QB 1 22 GLU H 0.000 . 7.000 3.612 3.496 3.751 . 0 0 "[ . ]" 3
193 1 19 GLN QB 1 20 ASN QD 0.000 . 5.000 2.229 1.838 2.657 . 0 0 "[ . ]" 3
194 1 19 GLN QE 1 20 ASN QB 0.000 . 7.000 3.250 1.782 4.383 . 0 0 "[ . ]" 3
195 1 19 GLN QE 1 23 LEU QD 0.000 . 7.000 3.181 2.865 3.681 . 0 0 "[ . ]" 3
196 1 19 GLN QE 1 20 ASN QD 0.000 . 3.300 2.366 1.810 2.857 . 0 0 "[ . ]" 3
197 1 19 GLN QG 1 23 LEU QD 0.000 . 3.300 2.780 2.356 2.941 . 0 0 "[ . ]" 3
198 1 19 GLN QG 1 23 LEU H 0.000 . 7.000 4.545 4.092 4.969 . 0 0 "[ . ]" 3
199 1 19 GLN H 1 20 ASN QD 0.000 . 7.000 4.304 3.970 4.648 . 0 0 "[ . ]" 3
200 1 20 ASN HA 1 24 ALA H 0.000 . 7.000 3.448 3.156 3.697 . 0 0 "[ . ]" 3
201 1 20 ASN H 1 20 ASN QD 0.000 . 5.000 3.255 2.666 3.554 . 0 0 "[ . ]" 3
202 1 20 ASN QD 1 21 SER H 0.000 . 7.000 3.808 2.891 4.213 . 0 0 "[ . ]" 3
203 1 2 CYS HA 1 6 ILE QG 0.000 . 7.000 3.490 3.155 4.303 . 0 0 "[ . ]" 3
204 1 2 CYS HA 1 5 ARG QB 0.000 . 7.000 4.906 3.151 5.907 . 0 0 "[ . ]" 3
205 1 2 CYS HA 1 6 ILE MD 0.000 . 7.000 3.530 2.064 4.533 . 0 0 "[ . ]" 3
206 1 2 CYS H 1 6 ILE QG 0.000 . 7.000 5.002 3.091 6.153 . 0 0 "[ . ]" 3
207 1 2 CYS H 1 6 ILE MD 0.000 . 7.000 3.851 2.701 4.746 . 0 0 "[ . ]" 3
208 1 2 CYS QB 1 6 ILE HA 0.000 . 7.000 5.187 4.331 6.206 . 0 0 "[ . ]" 3
209 1 2 CYS QB 1 6 ILE HB 0.000 . 7.000 4.292 3.218 5.188 . 0 0 "[ . ]" 3
210 1 2 CYS QB 1 6 ILE QG 0.000 . 5.000 3.037 1.972 4.137 . 0 0 "[ . ]" 3
211 1 2 CYS QB 1 6 ILE MD 0.000 . 3.300 2.136 1.685 2.726 . 0 0 "[ . ]" 3
212 1 5 ARG QB 1 7 ALA H 0.000 . 7.000 3.793 3.457 4.011 . 0 0 "[ . ]" 3
213 1 7 ALA H 1 9 LEU QD 0.000 . 7.000 3.965 3.815 4.125 . 0 0 "[ . ]" 3
214 1 21 SER H 1 23 LEU QD 0.000 . 7.000 4.454 4.340 4.607 . 0 0 "[ . ]" 3
215 1 21 SER QB 1 23 LEU QD 0.000 . 3.300 1.929 1.762 2.141 . 0 0 "[ . ]" 3
216 1 5 ARG HA 1 6 ILE MD 0.000 . 3.300 2.275 2.153 2.417 . 0 0 "[ . ]" 3
217 1 22 GLU HA 1 26 THR MG 0.000 . 7.000 4.908 4.645 5.142 . 0 0 "[ . ]" 3
218 1 22 GLU QG 1 26 THR MG 0.000 . 7.000 4.225 3.810 4.563 . 0 0 "[ . ]" 3
219 1 22 GLU H 1 23 LEU HG 0.000 . 7.000 4.951 4.185 5.267 . 0 0 "[ . ]" 3
220 1 22 GLU H 1 23 LEU QD 0.000 . 7.000 4.164 4.024 4.350 . 0 0 "[ . ]" 3
221 1 23 LEU HA 1 23 LEU QD 0.000 . 3.300 2.063 1.812 2.341 . 0 0 "[ . ]" 3
222 1 23 LEU HA 1 23 LEU QD 0.000 . 3.300 2.065 1.814 2.345 . 0 0 "[ . ]" 3
223 1 23 LEU HA 1 23 LEU QD 0.000 . 3.300 2.108 1.826 2.376 . 0 0 "[ . ]" 3
224 1 27 ALA HA 1 30 LEU QB 0.000 . 5.000 2.556 2.053 2.964 . 0 0 "[ . ]" 3
225 1 23 LEU QB 1 27 ALA H 0.000 . 7.000 3.624 3.406 3.802 . 0 0 "[ . ]" 3
226 1 23 LEU QB 1 24 ALA H 0.000 . 5.000 2.407 2.154 2.667 . 0 0 "[ . ]" 3
227 1 23 LEU QB 1 26 THR MG 0.000 . 5.000 3.434 3.335 3.658 . 0 0 "[ . ]" 3
228 1 23 LEU QB 1 24 ALA MB 0.000 . 7.000 3.031 2.605 3.215 . 0 0 "[ . ]" 3
229 1 23 LEU H 1 23 LEU HG 0.000 . 3.300 2.496 1.866 2.888 . 0 0 "[ . ]" 3
230 1 23 LEU HG 1 24 ALA H 0.000 . 7.000 4.061 3.855 4.234 . 0 0 "[ . ]" 3
231 1 23 LEU HG 1 26 THR MG 0.000 . 7.000 4.648 3.940 5.176 . 0 0 "[ . ]" 3
232 1 23 LEU H 1 26 THR MG 0.000 . 7.000 5.464 5.211 5.744 . 0 0 "[ . ]" 3
233 1 23 LEU QD 1 27 ALA H 0.000 . 5.000 3.048 2.737 3.351 . 0 0 "[ . ]" 3
234 1 23 LEU QD 1 24 ALA MB 0.000 . 7.000 2.041 1.692 2.653 . 0 0 "[ . ]" 3
235 1 7 ALA MB 1 9 LEU QD 0.000 . 3.300 2.042 1.692 2.656 . 0 0 "[ . ]" 3
236 1 23 LEU QD 1 24 ALA H 0.000 . 5.000 2.710 2.296 2.997 . 0 0 "[ . ]" 3
237 1 23 LEU QD 1 26 THR H 0.000 . 7.000 3.992 3.800 4.248 . 0 0 "[ . ]" 3
238 1 23 LEU QD 1 27 ALA MB 0.000 . 3.300 2.023 1.741 2.438 . 0 0 "[ . ]" 3
239 1 23 LEU QD 1 25 SER H 0.000 . 7.000 3.324 3.106 3.513 . 0 0 "[ . ]" 3
240 1 23 LEU QD 1 24 ALA MB 0.000 . 3.300 2.067 1.696 2.750 . 0 0 "[ . ]" 3
241 1 24 ALA HA 1 27 ALA H 0.000 . 5.000 3.134 3.000 3.236 . 0 0 "[ . ]" 3
242 1 24 ALA HA 1 27 ALA H 0.000 . 5.000 3.180 3.093 3.293 . 0 0 "[ . ]" 3
243 1 24 ALA MB 1 28 ASN QD 0.000 . 5.000 3.788 2.696 4.355 . 0 0 "[ . ]" 3
244 1 26 THR HB 1 27 ALA HA 0.000 . 7.000 3.603 3.459 3.794 . 0 0 "[ . ]" 3
245 1 25 SER H 1 26 THR HA 0.000 . 5.000 3.973 3.561 4.433 . 0 0 "[ . ]" 3
246 1 25 SER H 1 28 ASN QB 0.000 . 5.000 3.678 2.900 3.927 . 0 0 "[ . ]" 3
247 1 25 SER H 1 26 THR MG 0.000 . 7.000 5.227 5.145 5.355 . 0 0 "[ . ]" 3
248 1 25 SER QB 1 28 ASN QD 0.000 . 3.300 2.905 2.801 2.974 . 0 0 "[ . ]" 3
249 1 26 THR HA 1 30 LEU H 0.000 . 5.000 2.949 2.860 3.048 . 0 0 "[ . ]" 3
250 1 26 THR HB 1 27 ALA MB 0.000 . 7.000 2.836 2.419 3.112 . 0 0 "[ . ]" 3
251 1 26 THR H 1 30 LEU HG 0.000 . 7.000 5.784 5.372 6.204 . 0 0 "[ . ]" 3
252 1 26 THR MG 1 27 ALA HA 0.000 . 5.000 3.119 2.738 3.339 . 0 0 "[ . ]" 3
253 1 26 THR MG 1 27 ALA H 0.000 . 5.000 3.093 2.700 3.375 . 0 0 "[ . ]" 3
254 1 26 THR MG 1 27 ALA MB 0.000 . 3.300 2.604 2.288 2.901 . 0 0 "[ . ]" 3
255 1 26 THR MG 1 28 ASN H 0.000 . 7.000 3.679 3.594 3.943 . 0 0 "[ . ]" 3
256 1 26 THR MG 1 28 ASN H 0.000 . 7.000 4.341 4.166 4.542 . 0 0 "[ . ]" 3
257 1 26 THR MG 1 29 MET H 0.000 . 7.000 3.991 3.816 4.383 . 0 0 "[ . ]" 3
258 1 26 THR MG 1 30 LEU H 0.000 . 5.000 3.452 3.295 3.634 . 0 0 "[ . ]" 3
259 1 26 THR MG 1 31 ARG HE 0.000 . 7.000 4.850 3.578 6.077 . 0 0 "[ . ]" 3
260 1 26 THR MG 1 31 ARG H 0.000 . 7.000 4.790 4.428 5.043 . 0 0 "[ . ]" 3
261 1 27 ALA HA 1 30 LEU QD 0.000 . 3.300 2.136 1.772 2.546 . 0 0 "[ . ]" 3
262 1 28 ASN QD 1 30 LEU QD 0.000 . 5.000 3.349 2.933 3.674 . 0 0 "[ . ]" 3
263 1 28 ASN QD 1 30 LEU QD 0.000 . 5.000 3.494 2.986 3.874 . 0 0 "[ . ]" 3
264 1 28 ASN H 1 30 LEU QB 0.000 . 7.000 3.298 3.150 3.420 . 0 0 "[ . ]" 3
265 1 28 ASN H 1 30 LEU HG 0.000 . 7.000 3.280 3.128 3.626 . 0 0 "[ . ]" 3
266 1 28 ASN H 1 30 LEU QD 0.000 . 7.000 3.482 3.264 3.751 . 0 0 "[ . ]" 3
267 1 28 ASN H 1 30 LEU HG 0.000 . 7.000 3.902 3.602 4.159 . 0 0 "[ . ]" 3
268 1 29 MET QG 1 33 GLN QE 0.000 . 5.000 3.188 1.773 4.210 . 0 0 "[ . ]" 3
269 1 29 MET QG 1 33 GLN H 0.000 . 3.300 2.035 1.645 2.938 . 0 0 "[ . ]" 3
270 1 29 MET QG 1 33 GLN QB 0.000 . 3.300 2.641 2.430 2.963 . 0 0 "[ . ]" 3
271 1 29 MET QG 1 33 GLN QE 0.000 . 7.000 3.958 1.786 6.031 . 0 0 "[ . ]" 3
272 1 29 MET QB 1 30 LEU QB 0.000 . 7.000 3.027 2.815 3.338 . 0 0 "[ . ]" 3
273 1 29 MET QB 1 30 LEU QD 0.000 . 7.000 2.589 2.387 2.721 . 0 0 "[ . ]" 3
274 1 31 ARG HA 1 32 GLU QB 0.000 . 7.000 3.716 3.469 4.186 . 0 0 "[ . ]" 3
275 1 29 MET QB 1 34 VAL QG 0.000 . 3.300 2.128 1.744 2.905 . 0 0 "[ . ]" 3
276 1 29 MET QB 1 34 VAL QG 0.000 . 5.000 2.136 1.744 2.924 . 0 0 "[ . ]" 3
277 1 30 LEU HA 1 34 VAL QG 0.000 . 7.000 2.766 2.575 2.953 . 0 0 "[ . ]" 3
278 1 30 LEU HA 1 34 VAL QG 0.000 . 7.000 2.824 2.605 3.023 . 0 0 "[ . ]" 3
279 1 30 LEU QB 1 31 ARG HA 0.000 . 7.000 3.199 2.963 3.416 . 0 0 "[ . ]" 3
280 1 30 LEU QB 1 31 ARG H 0.000 . 5.000 2.471 1.953 2.669 . 0 0 "[ . ]" 3
281 1 30 LEU QB 1 34 VAL QG 0.000 . 5.000 2.234 2.123 2.399 . 0 0 "[ . ]" 3
282 1 30 LEU H 1 30 LEU QB 0.000 . 3.300 2.185 2.025 2.253 . 0 0 "[ . ]" 3
283 1 30 LEU HG 1 34 VAL HA 0.000 . 5.000 3.738 3.537 4.009 . 0 0 "[ . ]" 3
284 1 30 LEU HG 1 34 VAL H 0.000 . 5.000 4.124 4.052 4.323 . 0 0 "[ . ]" 3
285 1 30 LEU HG 1 34 VAL QG 0.000 . 5.000 3.315 3.218 3.399 . 0 0 "[ . ]" 3
286 1 30 LEU HG 1 33 GLN QB 0.000 . 5.000 3.828 3.685 3.988 . 0 0 "[ . ]" 3
287 1 30 LEU H 1 34 VAL QG 0.000 . 7.000 4.284 4.123 4.447 . 0 0 "[ . ]" 3
288 1 30 LEU QD 1 34 VAL H 0.000 . 3.300 2.000 1.668 2.134 . 0 0 "[ . ]" 3
289 1 5 ARG HE 1 9 LEU QD 0.000 . 7.000 2.571 1.589 3.662 . 0 0 "[ . ]" 3
290 1 30 LEU QD 1 31 ARG HA 0.000 . 3.300 2.214 1.886 2.413 . 0 0 "[ . ]" 3
291 1 30 LEU QD 1 31 ARG H 0.000 . 5.000 2.646 2.156 2.892 . 0 0 "[ . ]" 3
292 1 30 LEU QD 1 33 GLN QE 0.000 . 5.000 2.589 1.589 3.712 . 0 0 "[ . ]" 3
293 1 30 LEU QD 1 31 ARG H 0.000 . 3.300 2.707 2.173 2.974 . 0 0 "[ . ]" 3
294 1 30 LEU QD 1 34 VAL H 0.000 . 5.000 3.202 2.969 3.437 . 0 0 "[ . ]" 3
295 1 30 LEU QD 1 34 VAL QG 0.000 . 3.300 1.905 1.704 2.121 . 0 0 "[ . ]" 3
296 1 3 GLY QA 1 7 ALA MB 0.000 . 3.300 2.765 2.279 2.936 . 0 0 "[ . ]" 3
297 1 3 GLY QA 1 6 ILE QG 0.000 . 5.000 2.774 2.106 3.209 . 0 0 "[ . ]" 3
298 1 3 GLY QA 1 6 ILE H 0.000 . 3.300 2.924 2.890 2.950 . 0 0 "[ . ]" 3
299 1 31 ARG HA 1 34 VAL QG 0.000 . 5.000 2.674 2.279 3.009 . 0 0 "[ . ]" 3
300 1 34 VAL HA 1 37 LEU HG 0.000 . 7.000 4.096 3.789 4.441 . 0 0 "[ . ]" 3
301 1 31 ARG QB 1 34 VAL QG 0.000 . 5.000 3.594 3.369 3.810 . 0 0 "[ . ]" 3
302 1 31 ARG QD 1 35 ALA H 0.000 . 7.000 5.285 3.998 6.183 . 0 0 "[ . ]" 3
303 1 31 ARG H 1 31 ARG HE 0.000 . 7.000 5.489 4.989 6.261 . 0 0 "[ . ]" 3
304 1 31 ARG H 1 34 VAL QG 0.000 . 7.000 3.788 3.611 3.974 . 0 0 "[ . ]" 3
305 1 31 ARG QG 1 34 VAL H 0.000 . 7.000 4.181 3.982 4.514 . 0 0 "[ . ]" 3
306 1 31 ARG QG 1 35 ALA HA 0.000 . 7.000 5.143 4.191 5.829 . 0 0 "[ . ]" 3
307 1 32 GLU QG 1 36 GLN QE 0.000 . 7.000 3.722 2.299 4.965 . 0 0 "[ . ]" 3
308 1 32 GLU QG 1 33 GLN QE 0.000 . 5.000 3.613 2.895 4.297 . 0 0 "[ . ]" 3
309 1 32 GLU QG 1 34 VAL QG 0.000 . 7.000 3.954 3.753 4.199 . 0 0 "[ . ]" 3
310 1 8 ARG H 1 10 GLU QG 0.000 . 5.000 3.551 3.312 3.837 . 0 0 "[ . ]" 3
311 1 33 GLN QG 1 34 VAL HA 0.000 . 7.000 3.305 2.611 4.719 . 0 0 "[ . ]" 3
312 1 32 GLU QB 1 34 VAL H 0.000 . 3.300 2.121 1.720 2.990 . 0 0 "[ . ]" 3
313 1 33 GLN QG 1 37 LEU H 0.000 . 7.000 4.705 4.248 5.621 . 0 0 "[ . ]" 3
314 1 32 GLU QB 1 34 VAL QG 0.000 . 7.000 4.915 4.533 5.120 . 0 0 "[ . ]" 3
315 1 33 GLN QE 1 34 VAL HB 0.000 . 7.000 4.934 3.566 6.155 . 0 0 "[ . ]" 3
316 1 33 GLN QE 1 34 VAL QG 0.000 . 7.000 3.019 1.595 4.258 . 0 0 "[ . ]" 3
317 1 5 ARG HE 1 9 LEU QB 0.000 . 7.000 4.733 3.558 5.742 . 0 0 "[ . ]" 3
318 1 5 ARG HE 1 6 ILE MD 0.000 . 7.000 3.406 1.854 4.246 . 0 0 "[ . ]" 3
319 1 33 GLN QE 1 36 GLN QE 0.000 . 5.000 4.132 3.592 4.474 . 0 0 "[ . ]" 3
320 1 33 GLN H 1 34 VAL QG 0.000 . 5.000 3.322 3.216 3.417 . 0 0 "[ . ]" 3
321 1 33 GLN QB 1 37 LEU H 0.000 . 5.000 3.950 3.719 4.108 . 0 0 "[ . ]" 3
322 1 33 GLN QB 1 37 LEU QD 0.000 . 3.300 2.518 2.162 2.811 . 0 0 "[ . ]" 3
323 1 34 VAL HB 1 35 ALA MB 0.000 . 5.000 3.642 3.448 3.830 . 0 0 "[ . ]" 3
324 1 33 GLN QB 1 37 LEU QD 0.000 . 3.300 2.547 2.164 2.871 . 0 0 "[ . ]" 3
325 1 34 VAL HB 1 38 LYS H 0.000 . 5.000 3.709 3.604 3.828 . 0 0 "[ . ]" 3
326 1 34 VAL H 1 34 VAL QG 0.000 . 3.300 2.024 1.677 2.172 . 0 0 "[ . ]" 3
327 1 34 VAL H 1 37 LEU QD 0.000 . 7.000 3.489 3.104 3.887 . 0 0 "[ . ]" 3
328 1 8 ARG H 1 9 LEU QD 0.000 . 3.300 2.773 2.605 2.920 . 0 0 "[ . ]" 3
329 1 34 VAL QG 1 37 LEU H 0.000 . 3.300 2.717 2.495 2.859 . 0 0 "[ . ]" 3
330 1 34 VAL QG 1 38 LYS H 0.000 . 5.000 2.916 2.812 3.053 . 0 0 "[ . ]" 3
331 1 5 ARG H 1 9 LEU QD 0.000 . 5.000 2.795 2.607 2.922 . 0 0 "[ . ]" 3
332 1 34 VAL QG 1 38 LYS H 0.000 . 5.000 3.266 3.000 3.449 . 0 0 "[ . ]" 3
333 1 34 VAL QG 1 35 ALA H 0.000 . 5.000 2.869 2.646 3.060 . 0 0 "[ . ]" 3
334 1 34 VAL QG 1 37 LEU QB 0.000 . 3.300 2.860 2.741 2.966 . 0 0 "[ . ]" 3
335 1 34 VAL QG 1 37 LEU H 0.000 . 5.000 3.689 3.583 3.840 . 0 0 "[ . ]" 3
336 1 8 ARG H 1 9 LEU QB 0.000 . 7.000 3.451 3.259 3.649 . 0 0 "[ . ]" 3
337 1 5 ARG QB 1 8 ARG H 0.000 . 3.300 2.327 1.677 2.957 . 0 0 "[ . ]" 3
338 1 35 ALA H 1 37 LEU QD 0.000 . 5.000 4.197 3.869 4.459 . 0 0 "[ . ]" 3
339 1 6 ILE MD 1 7 ALA MB 0.000 . 5.000 3.048 1.942 3.331 . 0 0 "[ . ]" 3
340 1 35 ALA MB 1 39 GLN QE 0.000 . 7.000 4.396 3.331 6.142 . 0 0 "[ . ]" 3
341 1 36 GLN HA 1 37 LEU QD 0.000 . 3.300 2.290 2.170 2.433 . 0 0 "[ . ]" 3
342 1 36 GLN QE 1 39 GLN QG 0.000 . 7.000 6.048 5.647 6.252 . 0 0 "[ . ]" 3
343 1 36 GLN QG 1 38 LYS QD 0.000 . 7.000 5.335 4.174 5.810 . 0 0 "[ . ]" 3
344 1 37 LEU HA 1 41 VAL QG 0.000 . 5.000 3.706 3.229 4.413 . 0 0 "[ . ]" 3
345 1 37 LEU QB 1 40 LYS H 0.000 . 7.000 4.144 4.024 4.302 . 0 0 "[ . ]" 3
346 1 37 LEU HG 1 40 LYS H 0.000 . 5.000 3.986 3.888 4.135 . 0 0 "[ . ]" 3
347 1 5 ARG H 1 6 ILE MD 0.000 . 5.000 3.124 2.632 3.745 . 0 0 "[ . ]" 3
348 1 37 LEU QD 1 38 LYS HA 0.000 . 5.000 3.543 3.153 3.909 . 0 0 "[ . ]" 3
349 1 37 LEU QD 1 38 LYS H 0.000 . 7.000 3.309 3.082 3.496 . 0 0 "[ . ]" 3
350 1 37 LEU QD 1 39 GLN H 0.000 . 7.000 4.576 4.226 4.873 . 0 0 "[ . ]" 3
351 1 37 LEU QD 1 40 LYS H 0.000 . 7.000 4.366 4.093 4.706 . 0 0 "[ . ]" 3
352 1 37 LEU QD 1 40 LYS QE 0.000 . 7.000 4.592 3.050 5.268 . 0 0 "[ . ]" 3
353 1 37 LEU QD 1 38 LYS H 0.000 . 5.000 3.127 2.798 3.341 . 0 0 "[ . ]" 3
354 1 37 LEU QD 1 39 GLN H 0.000 . 7.000 3.917 3.411 4.137 . 0 0 "[ . ]" 3
355 1 37 LEU QD 1 40 LYS H 0.000 . 5.000 3.391 2.947 3.737 . 0 0 "[ . ]" 3
356 1 38 LYS HA 1 38 LYS QD 0.000 . 3.300 2.220 1.718 2.983 . 0 0 "[ . ]" 3
357 1 38 LYS H 1 39 GLN QG 0.000 . 7.000 4.296 3.687 5.499 . 0 0 "[ . ]" 3
358 1 38 LYS QD 1 41 VAL QG 0.000 . 3.300 2.622 2.337 2.929 . 0 0 "[ . ]" 3
359 1 38 LYS QE 1 41 VAL QG 0.000 . 7.000 4.261 3.701 4.749 . 0 0 "[ . ]" 3
360 1 39 GLN H 1 40 LYS QG 0.000 . 7.000 5.352 3.900 5.763 . 0 0 "[ . ]" 3
361 1 40 LYS HA 1 41 VAL QG 0.000 . 7.000 4.099 3.968 4.242 . 0 0 "[ . ]" 3
362 1 40 LYS HA 1 43 ASN QB 0.000 . 7.000 4.094 2.553 5.826 . 0 0 "[ . ]" 3
363 1 40 LYS QG 1 41 VAL QG 0.000 . 7.000 3.716 3.255 4.085 . 0 0 "[ . ]" 3
364 1 40 LYS QG 1 41 VAL H 0.000 . 5.000 3.761 3.572 3.958 . 0 0 "[ . ]" 3
365 1 40 LYS H 1 41 VAL QG 0.000 . 5.000 3.551 3.001 3.963 . 0 0 "[ . ]" 3
366 1 4 GLY QA 1 6 ILE H 0.000 . 3.300 2.893 2.822 2.960 . 0 0 "[ . ]" 3
367 1 4 GLY QA 1 6 ILE QG 0.000 . 7.000 4.777 3.539 5.259 . 0 0 "[ . ]" 3
368 1 6 ILE H 1 9 LEU QD 0.000 . 5.000 2.837 2.530 3.018 . 0 0 "[ . ]" 3
369 1 42 MET QB 1 43 ASN QD 0.000 . 7.000 5.158 3.965 5.706 . 0 0 "[ . ]" 3
370 1 5 ARG HA 1 6 ILE QG 0.000 . 7.000 3.533 3.087 3.978 . 0 0 "[ . ]" 3
371 1 5 ARG HE 1 6 ILE QG 0.000 . 7.000 4.791 3.791 5.502 . 0 0 "[ . ]" 3
372 1 5 ARG QB 1 6 ILE HA 0.000 . 5.000 3.145 2.634 3.384 . 0 0 "[ . ]" 3
373 1 5 ARG QB 1 6 ILE HA 0.000 . 7.000 3.431 3.342 3.505 . 0 0 "[ . ]" 3
374 1 5 ARG QD 1 6 ILE QG 0.000 . 7.000 3.478 2.676 4.101 . 0 0 "[ . ]" 3
375 1 5 ARG QD 1 6 ILE H 0.000 . 7.000 4.293 3.584 4.857 . 0 0 "[ . ]" 3
376 1 5 ARG QD 1 6 ILE MD 0.000 . 5.000 3.652 1.914 4.449 . 0 0 "[ . ]" 3
377 1 6 ILE HA 1 6 ILE QG 0.000 . 3.300 2.035 1.777 2.777 . 0 0 "[ . ]" 3
378 1 6 ILE HA 1 6 ILE QG 0.000 . 3.300 2.168 1.949 2.965 . 0 0 "[ . ]" 3
379 1 6 ILE HA 1 8 ARG QG 0.000 . 7.000 3.816 2.757 4.720 . 0 0 "[ . ]" 3
380 1 6 ILE HA 1 9 LEU QD 0.000 . 5.000 2.540 1.977 3.349 . 0 0 "[ . ]" 3
381 1 6 ILE H 1 6 ILE HB 0.000 . 3.300 2.258 2.073 3.056 . 0 0 "[ . ]" 3
382 1 6 ILE HB 1 7 ALA H 0.000 . 3.300 2.361 1.896 2.947 . 0 0 "[ . ]" 3
383 1 6 ILE QG 1 8 ARG H 0.000 . 7.000 3.891 3.418 4.177 . 0 0 "[ . ]" 3
384 1 6 ILE QG 1 10 GLU QG 0.000 . 3.300 2.583 2.125 2.915 . 0 0 "[ . ]" 3
385 1 6 ILE MD 1 7 ALA HA 0.000 . 3.300 2.820 2.445 2.914 . 0 0 "[ . ]" 3
386 1 6 ILE MD 1 9 LEU H 0.000 . 5.000 3.981 3.811 4.181 . 0 0 "[ . ]" 3
387 1 6 ILE MD 1 10 GLU H 0.000 . 5.000 3.416 3.017 4.127 . 0 0 "[ . ]" 3
388 1 8 ARG QG 1 9 LEU H 0.000 . 3.300 2.573 1.778 2.910 . 0 0 "[ . ]" 3
389 1 8 ARG QG 1 10 GLU H 0.000 . 7.000 3.926 3.680 4.081 . 0 0 "[ . ]" 3
390 1 8 ARG H 1 9 LEU QD 0.000 . 5.000 4.203 3.691 4.463 . 0 0 "[ . ]" 3
391 1 9 LEU H 1 10 GLU QG 0.000 . 7.000 4.479 3.961 5.006 . 0 0 "[ . ]" 3
stop_
save_
save_distance_constraint_statistics_4
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 4
_Distance_constraint_stats_list.Constraint_count 384
_Distance_constraint_stats_list.Viol_count 0
_Distance_constraint_stats_list.Viol_total 0.000
_Distance_constraint_stats_list.Viol_max 0.000
_Distance_constraint_stats_list.Viol_rms 0.0000
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0000
_Distance_constraint_stats_list.Viol_average_violations_only 0.0000
_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 2 CYS 0.000 0.000 . 0 "[ . ]"
1 3 GLY 0.000 0.000 . 0 "[ . ]"
1 4 GLY 0.000 0.000 . 0 "[ . ]"
1 5 ARG 0.000 0.000 . 0 "[ . ]"
1 6 ILE 0.000 0.000 . 0 "[ . ]"
1 7 ALA 0.000 0.000 . 0 "[ . ]"
1 8 ARG 0.000 0.000 . 0 "[ . ]"
1 9 LEU 0.000 0.000 . 0 "[ . ]"
1 10 GLU 0.000 0.000 . 0 "[ . ]"
1 11 GLU 0.000 0.000 . 0 "[ . ]"
1 12 LYS 0.000 0.000 . 0 "[ . ]"
1 13 VAL 0.000 0.000 . 0 "[ . ]"
1 14 LYS 0.000 0.000 . 0 "[ . ]"
1 15 THR 0.000 0.000 . 0 "[ . ]"
1 16 LEU 0.000 0.000 . 0 "[ . ]"
1 17 LYS 0.000 0.000 . 0 "[ . ]"
1 18 ALA 0.000 0.000 . 0 "[ . ]"
1 19 GLN 0.000 0.000 . 0 "[ . ]"
1 20 ASN 0.000 0.000 . 0 "[ . ]"
1 21 SER 0.000 0.000 . 0 "[ . ]"
1 22 GLU 0.000 0.000 . 0 "[ . ]"
1 23 LEU 0.000 0.000 . 0 "[ . ]"
1 24 ALA 0.000 0.000 . 0 "[ . ]"
1 25 SER 0.000 0.000 . 0 "[ . ]"
1 26 THR 0.000 0.000 . 0 "[ . ]"
1 27 ALA 0.000 0.000 . 0 "[ . ]"
1 28 ASN 0.000 0.000 . 0 "[ . ]"
1 29 MET 0.000 0.000 . 0 "[ . ]"
1 30 LEU 0.000 0.000 . 0 "[ . ]"
1 31 ARG 0.000 0.000 . 0 "[ . ]"
1 32 GLU 0.000 0.000 . 0 "[ . ]"
1 33 GLN 0.000 0.000 . 0 "[ . ]"
1 34 VAL 0.000 0.000 . 0 "[ . ]"
1 35 ALA 0.000 0.000 . 0 "[ . ]"
1 36 GLN 0.000 0.000 . 0 "[ . ]"
1 37 LEU 0.000 0.000 . 0 "[ . ]"
1 38 LYS 0.000 0.000 . 0 "[ . ]"
1 39 GLN 0.000 0.000 . 0 "[ . ]"
1 40 LYS 0.000 0.000 . 0 "[ . ]"
1 41 VAL 0.000 0.000 . 0 "[ . ]"
1 42 MET 0.000 0.000 . 0 "[ . ]"
1 43 ASN 0.000 0.000 . 0 "[ . ]"
1 44 TYR 0.000 0.000 . 0 "[ . ]"
2 2 CYS 0.000 0.000 . 0 "[ . ]"
2 3 GLY 0.000 0.000 . 0 "[ . ]"
2 4 GLY 0.000 0.000 . 0 "[ . ]"
2 5 ARG 0.000 0.000 . 0 "[ . ]"
2 6 ILE 0.000 0.000 . 0 "[ . ]"
2 7 ALA 0.000 0.000 . 0 "[ . ]"
2 8 ARG 0.000 0.000 . 0 "[ . ]"
2 9 LEU 0.000 0.000 . 0 "[ . ]"
2 10 GLU 0.000 0.000 . 0 "[ . ]"
2 11 GLU 0.000 0.000 . 0 "[ . ]"
2 12 LYS 0.000 0.000 . 0 "[ . ]"
2 13 VAL 0.000 0.000 . 0 "[ . ]"
2 14 LYS 0.000 0.000 . 0 "[ . ]"
2 15 THR 0.000 0.000 . 0 "[ . ]"
2 16 LEU 0.000 0.000 . 0 "[ . ]"
2 17 LYS 0.000 0.000 . 0 "[ . ]"
2 18 ALA 0.000 0.000 . 0 "[ . ]"
2 19 GLN 0.000 0.000 . 0 "[ . ]"
2 20 ASN 0.000 0.000 . 0 "[ . ]"
2 21 SER 0.000 0.000 . 0 "[ . ]"
2 22 GLU 0.000 0.000 . 0 "[ . ]"
2 23 LEU 0.000 0.000 . 0 "[ . ]"
2 24 ALA 0.000 0.000 . 0 "[ . ]"
2 25 SER 0.000 0.000 . 0 "[ . ]"
2 26 THR 0.000 0.000 . 0 "[ . ]"
2 27 ALA 0.000 0.000 . 0 "[ . ]"
2 28 ASN 0.000 0.000 . 0 "[ . ]"
2 29 MET 0.000 0.000 . 0 "[ . ]"
2 30 LEU 0.000 0.000 . 0 "[ . ]"
2 31 ARG 0.000 0.000 . 0 "[ . ]"
2 32 GLU 0.000 0.000 . 0 "[ . ]"
2 33 GLN 0.000 0.000 . 0 "[ . ]"
2 34 VAL 0.000 0.000 . 0 "[ . ]"
2 35 ALA 0.000 0.000 . 0 "[ . ]"
2 36 GLN 0.000 0.000 . 0 "[ . ]"
2 37 LEU 0.000 0.000 . 0 "[ . ]"
2 38 LYS 0.000 0.000 . 0 "[ . ]"
2 39 GLN 0.000 0.000 . 0 "[ . ]"
2 40 LYS 0.000 0.000 . 0 "[ . ]"
2 41 VAL 0.000 0.000 . 0 "[ . ]"
2 42 MET 0.000 0.000 . 0 "[ . ]"
2 43 ASN 0.000 0.000 . 0 "[ . ]"
2 44 TYR 0.000 0.000 . 0 "[ . ]"
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 11 GLU HA 1 14 LYS H 0.000 . 3.300 3.022 2.915 3.158 . 0 0 "[ . ]" 4
2 1 9 LEU HA 1 13 VAL H 0.000 . 4.200 3.294 3.240 3.358 . 0 0 "[ . ]" 4
3 1 7 ALA HA 1 10 GLU H 0.000 . 4.200 3.093 2.959 3.240 . 0 0 "[ . ]" 4
4 1 11 GLU HA 1 14 LYS HA 0.000 . 6.000 5.111 4.955 5.367 . 0 0 "[ . ]" 4
5 1 8 ARG HA 1 12 LYS QD 0.000 . 4.200 3.443 2.667 3.915 . 0 0 "[ . ]" 4
6 1 8 ARG HA 1 12 LYS QE 0.000 . 6.000 3.900 3.098 4.381 . 0 0 "[ . ]" 4
7 1 13 VAL HA 1 14 LYS H 0.000 . 4.200 3.348 3.310 3.387 . 0 0 "[ . ]" 4
8 1 11 GLU H 1 12 LYS H 0.000 . 3.300 2.349 2.312 2.408 . 0 0 "[ . ]" 4
9 1 11 GLU H 1 11 GLU QG 0.000 . 4.200 2.992 2.658 3.155 . 0 0 "[ . ]" 4
10 1 11 GLU H 1 13 VAL H 0.000 . 3.300 2.320 2.248 2.373 . 0 0 "[ . ]" 4
11 1 10 GLU HA 1 11 GLU H 0.000 . 4.200 3.395 3.338 3.455 . 0 0 "[ . ]" 4
12 1 6 ILE H 1 7 ALA MB 0.000 . 3.300 2.497 2.280 2.684 . 0 0 "[ . ]" 4
13 1 8 ARG H 1 11 GLU H 0.000 . 3.300 2.562 2.456 2.692 . 0 0 "[ . ]" 4
14 1 5 ARG H 1 6 ILE H 0.000 . 3.300 2.063 1.933 2.180 . 0 0 "[ . ]" 4
15 1 6 ILE H 1 6 ILE HB 0.000 . 3.300 2.054 1.961 2.172 . 0 0 "[ . ]" 4
16 1 3 GLY QA 1 6 ILE H 0.000 . 3.300 3.032 2.998 3.054 . 0 0 "[ . ]" 4
17 1 6 ILE H 1 7 ALA MB 0.000 . 4.200 3.836 3.803 3.932 . 0 0 "[ . ]" 4
18 1 6 ILE H 1 9 LEU QB 0.000 . 3.300 2.705 2.022 3.018 . 0 0 "[ . ]" 4
19 1 6 ILE H 1 10 GLU QG 0.000 . 6.000 3.862 3.700 4.147 . 0 0 "[ . ]" 4
20 1 10 GLU QB 1 11 GLU H 0.000 . 3.300 2.012 1.968 2.076 . 0 0 "[ . ]" 4
21 1 11 GLU QB 1 15 THR H 0.000 . 3.300 2.350 2.175 2.527 . 0 0 "[ . ]" 4
22 1 7 ALA H 1 10 GLU QB 0.000 . 6.000 4.108 3.940 4.285 . 0 0 "[ . ]" 4
23 1 10 GLU QB 1 13 VAL H 0.000 . 3.300 2.310 2.090 2.439 . 0 0 "[ . ]" 4
24 1 11 GLU QB 1 14 LYS H 0.000 . 3.300 2.301 1.962 2.437 . 0 0 "[ . ]" 4
25 1 11 GLU QB 1 12 LYS H 0.000 . 3.300 2.803 2.707 3.002 . 0 0 "[ . ]" 4
26 1 8 ARG H 1 10 GLU QB 0.000 . 4.200 3.932 3.817 4.091 . 0 0 "[ . ]" 4
27 1 11 GLU QG 1 15 THR H 0.000 . 6.000 4.465 3.919 4.836 . 0 0 "[ . ]" 4
28 1 8 ARG H 1 11 GLU QG 0.000 . 6.000 4.755 4.539 4.925 . 0 0 "[ . ]" 4
29 1 7 ALA MB 1 11 GLU QG 0.000 . 6.000 4.071 3.664 4.461 . 0 0 "[ . ]" 4
30 1 8 ARG QG 1 11 GLU QG 0.000 . 6.000 4.595 4.196 4.951 . 0 0 "[ . ]" 4
31 1 8 ARG QB 1 11 GLU QG 0.000 . 4.200 3.662 3.481 3.919 . 0 0 "[ . ]" 4
32 1 8 ARG QG 1 11 GLU QG 0.000 . 6.000 4.799 4.231 5.318 . 0 0 "[ . ]" 4
33 1 8 ARG QB 1 11 GLU QG 0.000 . 6.000 3.768 3.563 4.025 . 0 0 "[ . ]" 4
34 1 12 LYS H 1 12 LYS QB 0.000 . 3.300 2.000 1.956 2.071 . 0 0 "[ . ]" 4
35 1 12 LYS H 1 12 LYS QE 0.000 . 6.000 4.036 3.673 4.426 . 0 0 "[ . ]" 4
36 1 12 LYS H 1 14 LYS QB 0.000 . 3.300 2.734 2.402 2.970 . 0 0 "[ . ]" 4
37 1 12 LYS H 1 12 LYS QE 0.000 . 6.000 4.476 3.908 5.530 . 0 0 "[ . ]" 4
38 1 12 LYS QB 1 13 VAL HA 0.000 . 3.300 2.321 2.034 2.658 . 0 0 "[ . ]" 4
39 1 12 LYS QB 1 13 VAL H 0.000 . 3.300 2.011 1.918 2.091 . 0 0 "[ . ]" 4
40 1 14 LYS H 1 14 LYS QD 0.000 . 4.200 3.229 2.511 4.034 . 0 0 "[ . ]" 4
41 1 14 LYS QD 1 17 LYS H 0.000 . 3.300 2.736 2.339 3.129 . 0 0 "[ . ]" 4
42 1 14 LYS HA 1 14 LYS QD 0.000 . 3.300 2.016 1.882 2.111 . 0 0 "[ . ]" 4
43 1 12 LYS QD 1 15 THR H 0.000 . 6.000 4.257 3.786 4.450 . 0 0 "[ . ]" 4
44 1 5 ARG QG 1 9 LEU H 0.000 . 6.000 3.873 3.386 4.137 . 0 0 "[ . ]" 4
45 1 12 LYS QE 1 14 LYS H 0.000 . 4.200 3.653 3.092 3.994 . 0 0 "[ . ]" 4
46 1 14 LYS HA 1 14 LYS QE 0.000 . 6.000 2.893 2.615 3.279 . 0 0 "[ . ]" 4
47 1 8 ARG QB 1 12 LYS QE 0.000 . 4.200 3.083 2.024 3.507 . 0 0 "[ . ]" 4
48 1 12 LYS QG 1 14 LYS H 0.000 . 4.200 3.157 2.506 3.858 . 0 0 "[ . ]" 4
49 1 34 VAL HA 1 37 LEU QB 0.000 . 3.300 2.334 2.035 2.682 . 0 0 "[ . ]" 4
50 1 13 VAL HB 1 14 LYS H 0.000 . 3.300 2.306 1.963 2.445 . 0 0 "[ . ]" 4
51 1 13 VAL H 1 14 LYS HA 0.000 . 6.000 4.694 4.615 4.795 . 0 0 "[ . ]" 4
52 1 26 THR HA 1 30 LEU MD1 0.000 . 3.300 2.083 2.025 2.136 . 0 0 "[ . ]" 4
53 1 14 LYS HA 1 14 LYS QG 0.000 . 3.300 2.421 2.310 2.716 . 0 0 "[ . ]" 4
54 1 14 LYS QD 1 17 LYS H 0.000 . 4.200 2.702 2.330 3.049 . 0 0 "[ . ]" 4
55 1 14 LYS QD 1 18 ALA H 0.000 . 6.000 4.380 3.602 4.938 . 0 0 "[ . ]" 4
56 1 14 LYS H 1 16 LEU H 0.000 . 3.300 2.555 2.433 2.770 . 0 0 "[ . ]" 4
57 1 14 LYS H 1 14 LYS QG 0.000 . 4.200 3.868 3.705 4.047 . 0 0 "[ . ]" 4
58 1 5 ARG HA 1 8 ARG QB 0.000 . 3.300 2.505 2.242 2.689 . 0 0 "[ . ]" 4
59 1 14 LYS QE 1 17 LYS HA 0.000 . 6.000 4.203 4.060 4.340 . 0 0 "[ . ]" 4
60 1 14 LYS QE 1 17 LYS QB 0.000 . 4.200 2.472 2.110 3.112 . 0 0 "[ . ]" 4
61 1 14 LYS QG 1 15 THR H 0.000 . 6.000 4.049 3.588 4.294 . 0 0 "[ . ]" 4
62 1 15 THR HA 1 18 ALA H 0.000 . 4.200 3.398 3.224 3.544 . 0 0 "[ . ]" 4
63 1 15 THR HA 1 18 ALA MB 0.000 . 3.300 2.409 2.170 2.692 . 0 0 "[ . ]" 4
64 1 3 GLY H 1 4 GLY QA 0.000 . 6.000 3.900 3.663 4.106 . 0 0 "[ . ]" 4
65 1 15 THR H 1 15 THR MG 0.000 . 3.300 3.193 3.069 3.263 . 0 0 "[ . ]" 4
66 1 15 THR H 1 17 LYS H 0.000 . 6.000 4.098 3.960 4.234 . 0 0 "[ . ]" 4
67 1 15 THR MG 1 16 LEU H 0.000 . 3.300 2.171 2.066 2.359 . 0 0 "[ . ]" 4
68 1 19 GLN HA 1 22 GLU H 0.000 . 3.300 2.768 2.651 2.999 . 0 0 "[ . ]" 4
69 1 16 LEU HA 1 20 ASN H 0.000 . 4.200 3.364 3.291 3.416 . 0 0 "[ . ]" 4
70 1 16 LEU HA 1 19 GLN QG 0.000 . 3.300 2.184 1.977 2.294 . 0 0 "[ . ]" 4
71 1 16 LEU HA 1 19 GLN QG 0.000 . 3.300 2.230 1.992 2.347 . 0 0 "[ . ]" 4
72 1 16 LEU HA 1 18 ALA MB 0.000 . 6.000 3.434 3.422 3.457 . 0 0 "[ . ]" 4
73 1 16 LEU QD 1 19 GLN QE 0.000 . 6.000 2.733 2.082 3.460 . 0 0 "[ . ]" 4
74 1 16 LEU QD 1 19 GLN QE 0.000 . 6.000 3.122 2.387 3.601 . 0 0 "[ . ]" 4
75 1 17 LYS HA 1 20 ASN QB 0.000 . 3.300 2.399 2.175 2.542 . 0 0 "[ . ]" 4
76 1 4 GLY QA 1 7 ALA H 0.000 . 4.200 3.505 3.007 3.914 . 0 0 "[ . ]" 4
77 1 17 LYS HA 1 18 ALA HA 0.000 . 6.000 4.242 4.222 4.281 . 0 0 "[ . ]" 4
78 1 17 LYS H 1 17 LYS QD 0.000 . 6.000 2.720 2.334 3.076 . 0 0 "[ . ]" 4
79 1 17 LYS QD 1 20 ASN H 0.000 . 6.000 4.075 3.853 4.188 . 0 0 "[ . ]" 4
80 1 17 LYS QD 1 21 SER H 0.000 . 6.000 4.575 4.374 4.718 . 0 0 "[ . ]" 4
81 1 5 ARG QG 1 7 ALA H 0.000 . 6.000 4.513 3.949 5.000 . 0 0 "[ . ]" 4
82 1 3 GLY H 1 6 ILE HB 0.000 . 3.300 2.049 1.983 2.090 . 0 0 "[ . ]" 4
83 1 17 LYS QB 1 18 ALA HA 0.000 . 4.200 3.576 3.541 3.651 . 0 0 "[ . ]" 4
84 1 18 ALA HA 1 20 ASN H 0.000 . 6.000 4.041 3.799 4.217 . 0 0 "[ . ]" 4
85 1 18 ALA HA 1 20 ASN QB 0.000 . 6.000 3.345 2.762 3.727 . 0 0 "[ . ]" 4
86 1 18 ALA HA 1 22 GLU H 0.000 . 4.200 3.359 3.325 3.386 . 0 0 "[ . ]" 4
87 1 18 ALA HA 1 19 GLN QB 0.000 . 4.200 3.846 3.744 4.079 . 0 0 "[ . ]" 4
88 1 19 GLN HA 1 22 GLU QG 0.000 . 4.200 2.777 2.364 3.177 . 0 0 "[ . ]" 4
89 1 19 GLN HA 1 22 GLU HA 0.000 . 3.300 3.064 2.911 3.191 . 0 0 "[ . ]" 4
90 1 19 GLN HA 1 22 GLU H 0.000 . 4.200 3.259 3.123 3.516 . 0 0 "[ . ]" 4
91 1 19 GLN QB 1 20 ASN H 0.000 . 4.200 2.820 2.541 3.639 . 0 0 "[ . ]" 4
92 1 19 GLN QB 1 23 LEU H 0.000 . 3.300 2.210 2.091 2.424 . 0 0 "[ . ]" 4
93 1 29 MET HA 1 29 MET QG 0.000 . 3.300 2.043 1.757 2.425 . 0 0 "[ . ]" 4
94 1 20 ASN QD 1 24 ALA MB 0.000 . 3.300 2.103 2.002 2.168 . 0 0 "[ . ]" 4
95 1 5 ARG H 1 7 ALA H 0.000 . 3.300 2.694 2.507 2.869 . 0 0 "[ . ]" 4
96 1 33 GLN QB 1 35 ALA H 0.000 . 3.300 2.309 2.176 2.423 . 0 0 "[ . ]" 4
97 1 33 GLN H 1 33 GLN QB 0.000 . 3.300 2.532 2.384 2.692 . 0 0 "[ . ]" 4
98 1 2 CYS HA 1 5 ARG H 0.000 . 6.000 3.932 3.494 4.518 . 0 0 "[ . ]" 4
99 1 2 CYS HA 1 5 ARG QB 0.000 . 3.300 2.525 2.197 3.084 . 0 0 "[ . ]" 4
100 1 2 CYS HA 1 5 ARG QD 0.000 . 4.200 3.594 2.930 4.108 . 0 0 "[ . ]" 4
101 1 21 SER HA 1 25 SER H 0.000 . 4.200 3.779 3.326 4.041 . 0 0 "[ . ]" 4
102 1 4 GLY QA 1 7 ALA H 0.000 . 3.300 2.321 2.038 2.837 . 0 0 "[ . ]" 4
103 1 22 GLU HA 1 23 LEU HA 0.000 . 4.200 4.042 3.961 4.130 . 0 0 "[ . ]" 4
104 1 22 GLU HA 1 25 SER H 0.000 . 4.200 3.567 3.145 3.961 . 0 0 "[ . ]" 4
105 1 22 GLU QG 1 25 SER H 0.000 . 6.000 3.697 3.112 4.276 . 0 0 "[ . ]" 4
106 1 23 LEU HA 1 27 ALA H 0.000 . 4.200 3.045 2.987 3.107 . 0 0 "[ . ]" 4
107 1 23 LEU HA 1 23 LEU HG 0.000 . 3.300 2.249 2.028 2.696 . 0 0 "[ . ]" 4
108 1 23 LEU QB 1 27 ALA H 0.000 . 3.300 2.539 2.363 2.746 . 0 0 "[ . ]" 4
109 1 23 LEU MD2 1 26 THR MG 0.000 . 3.300 2.186 1.852 2.595 . 0 0 "[ . ]" 4
110 1 24 ALA HA 1 28 ASN QD 0.000 . 6.000 4.647 3.363 5.449 . 0 0 "[ . ]" 4
111 1 24 ALA HA 1 28 ASN H 0.000 . 6.000 3.714 3.550 3.835 . 0 0 "[ . ]" 4
112 1 24 ALA HA 1 28 ASN QD 0.000 . 4.200 3.480 3.232 3.555 . 0 0 "[ . ]" 4
113 1 24 ALA HA 1 28 ASN H 0.000 . 4.200 3.994 3.870 4.110 . 0 0 "[ . ]" 4
114 1 24 ALA HA 1 25 SER H 0.000 . 4.200 3.536 3.392 3.569 . 0 0 "[ . ]" 4
115 1 25 SER HA 1 26 THR H 0.000 . 4.200 2.576 2.395 2.740 . 0 0 "[ . ]" 4
116 1 25 SER HA 1 27 ALA H 0.000 . 4.200 2.459 2.267 2.875 . 0 0 "[ . ]" 4
117 1 25 SER HA 1 28 ASN H 0.000 . 4.200 3.236 3.038 3.399 . 0 0 "[ . ]" 4
118 1 25 SER HA 1 28 ASN H 0.000 . 6.000 3.397 3.158 3.621 . 0 0 "[ . ]" 4
119 1 25 SER HA 1 29 MET H 0.000 . 6.000 4.098 3.953 4.225 . 0 0 "[ . ]" 4
120 1 25 SER QB 1 29 MET QB 0.000 . 3.300 3.133 2.605 3.260 . 0 0 "[ . ]" 4
121 1 25 SER QB 1 27 ALA H 0.000 . 4.200 3.365 3.264 3.435 . 0 0 "[ . ]" 4
122 1 26 THR HA 1 28 ASN QD 0.000 . 6.000 5.085 4.620 5.316 . 0 0 "[ . ]" 4
123 1 27 ALA MB 1 28 ASN H 0.000 . 3.300 2.528 2.136 2.892 . 0 0 "[ . ]" 4
124 1 28 ASN H 1 28 ASN QB 0.000 . 3.300 2.174 1.990 2.429 . 0 0 "[ . ]" 4
125 1 28 ASN H 1 29 MET QG 0.000 . 4.200 3.641 2.609 3.981 . 0 0 "[ . ]" 4
126 1 28 ASN H 1 29 MET QB 0.000 . 3.300 2.195 2.037 2.303 . 0 0 "[ . ]" 4
127 1 28 ASN H 1 30 LEU H 0.000 . 3.300 2.685 2.479 2.803 . 0 0 "[ . ]" 4
128 1 28 ASN QB 1 29 MET QB 0.000 . 6.000 3.793 3.684 3.955 . 0 0 "[ . ]" 4
129 1 29 MET HA 1 31 ARG H 0.000 . 6.000 3.950 3.749 4.435 . 0 0 "[ . ]" 4
130 1 29 MET QG 1 31 ARG H 0.000 . 6.000 3.817 3.380 4.618 . 0 0 "[ . ]" 4
131 1 32 GLU QG 1 33 GLN H 0.000 . 3.300 1.858 1.712 2.117 . 0 0 "[ . ]" 4
132 1 29 MET QG 1 30 LEU H 0.000 . 6.000 3.560 3.083 3.907 . 0 0 "[ . ]" 4
133 1 29 MET H 1 30 LEU HG 0.000 . 6.000 3.976 3.823 4.492 . 0 0 "[ . ]" 4
134 1 29 MET QB 1 30 LEU HA 0.000 . 3.300 2.010 1.856 2.276 . 0 0 "[ . ]" 4
135 1 29 MET QB 1 30 LEU H 0.000 . 3.300 2.378 2.092 2.644 . 0 0 "[ . ]" 4
136 1 29 MET QB 1 31 ARG H 0.000 . 6.000 3.597 3.479 3.959 . 0 0 "[ . ]" 4
137 1 32 GLU H 1 32 GLU QB 0.000 . 3.300 2.408 2.180 2.605 . 0 0 "[ . ]" 4
138 1 30 LEU HA 1 30 LEU HG 0.000 . 3.300 2.856 2.683 3.098 . 0 0 "[ . ]" 4
139 1 30 LEU QB 1 31 ARG H 0.000 . 3.300 2.065 1.926 2.175 . 0 0 "[ . ]" 4
140 1 5 ARG QB 1 5 ARG HE 0.000 . 4.200 3.601 2.633 4.075 . 0 0 "[ . ]" 4
141 1 31 ARG QG 1 34 VAL QG 0.000 . 4.200 2.777 1.740 3.543 . 0 0 "[ . ]" 4
142 1 8 ARG H 1 10 GLU QG 0.000 . 6.000 3.827 3.535 4.570 . 0 0 "[ . ]" 4
143 1 32 GLU QG 1 34 VAL H 0.000 . 6.000 4.033 3.747 4.280 . 0 0 "[ . ]" 4
144 1 32 GLU QG 1 35 ALA MB 0.000 . 6.000 3.396 2.936 3.663 . 0 0 "[ . ]" 4
145 1 36 GLN HA 1 36 GLN QG 0.000 . 3.300 2.636 2.117 3.183 . 0 0 "[ . ]" 4
146 1 32 GLU QB 1 33 GLN H 0.000 . 3.300 2.017 1.795 2.247 . 0 0 "[ . ]" 4
147 1 33 GLN HA 1 36 GLN QG 0.000 . 3.300 2.002 1.866 2.323 . 0 0 "[ . ]" 4
148 1 33 GLN H 1 33 GLN QB 0.000 . 3.300 2.525 2.378 2.692 . 0 0 "[ . ]" 4
149 1 33 GLN H 1 34 VAL H 0.000 . 3.300 2.590 2.452 2.826 . 0 0 "[ . ]" 4
150 1 33 GLN H 1 35 ALA H 0.000 . 3.300 2.574 2.463 2.714 . 0 0 "[ . ]" 4
151 1 33 GLN H 1 35 ALA MB 0.000 . 3.300 2.527 2.294 2.728 . 0 0 "[ . ]" 4
152 1 33 GLN QB 1 34 VAL H 0.000 . 3.300 2.240 1.955 2.374 . 0 0 "[ . ]" 4
153 1 33 GLN QB 1 35 ALA H 0.000 . 3.300 2.776 2.439 3.148 . 0 0 "[ . ]" 4
154 1 35 ALA HA 1 39 GLN H 0.000 . 6.000 3.983 3.514 4.374 . 0 0 "[ . ]" 4
155 1 7 ALA MB 1 8 ARG H 0.000 . 3.300 2.016 1.835 2.114 . 0 0 "[ . ]" 4
156 1 5 ARG H 1 5 ARG QG 0.000 . 4.200 2.371 1.878 2.855 . 0 0 "[ . ]" 4
157 1 35 ALA H 1 36 GLN QG 0.000 . 6.000 4.009 3.574 4.864 . 0 0 "[ . ]" 4
158 1 35 ALA MB 1 36 GLN QE 0.000 . 6.000 4.099 3.656 4.475 . 0 0 "[ . ]" 4
159 1 35 ALA MB 1 37 LEU H 0.000 . 6.000 4.282 4.087 4.673 . 0 0 "[ . ]" 4
160 1 35 ALA MB 1 38 LYS H 0.000 . 6.000 4.637 4.503 4.781 . 0 0 "[ . ]" 4
161 1 35 ALA MB 1 39 GLN H 0.000 . 6.000 4.427 4.046 4.721 . 0 0 "[ . ]" 4
162 1 35 ALA MB 1 36 GLN QE 0.000 . 6.000 3.902 3.510 4.552 . 0 0 "[ . ]" 4
163 1 36 GLN HA 1 38 LYS H 0.000 . 6.000 3.448 3.315 3.518 . 0 0 "[ . ]" 4
164 1 36 GLN HA 1 39 GLN H 0.000 . 4.200 3.417 3.119 3.681 . 0 0 "[ . ]" 4
165 1 36 GLN HA 1 40 LYS H 0.000 . 4.200 3.383 3.192 3.697 . 0 0 "[ . ]" 4
166 1 36 GLN HA 1 39 GLN H 0.000 . 4.200 3.460 3.008 3.732 . 0 0 "[ . ]" 4
167 1 36 GLN QG 1 40 LYS H 0.000 . 6.000 3.915 3.386 4.257 . 0 0 "[ . ]" 4
168 1 5 ARG QB 1 6 ILE H 0.000 . 3.300 2.882 2.766 3.064 . 0 0 "[ . ]" 4
169 1 36 GLN H 1 39 GLN H 0.000 . 6.000 4.260 4.121 4.484 . 0 0 "[ . ]" 4
170 1 37 LEU QB 1 38 LYS HA 0.000 . 3.300 2.419 1.959 2.783 . 0 0 "[ . ]" 4
171 1 37 LEU QB 1 38 LYS H 0.000 . 3.300 2.235 1.817 2.675 . 0 0 "[ . ]" 4
172 1 37 LEU QB 1 39 GLN H 0.000 . 6.000 3.891 3.655 4.073 . 0 0 "[ . ]" 4
173 1 37 LEU H 1 37 LEU HG 0.000 . 3.300 3.130 2.451 3.292 . 0 0 "[ . ]" 4
174 1 5 ARG H 1 5 ARG QG 0.000 . 3.300 2.870 2.532 3.233 . 0 0 "[ . ]" 4
175 1 38 LYS QD 1 39 GLN H 0.000 . 6.000 4.470 4.149 4.787 . 0 0 "[ . ]" 4
176 1 38 LYS QD 1 40 LYS H 0.000 . 6.000 4.101 3.745 4.336 . 0 0 "[ . ]" 4
177 1 39 GLN H 1 40 LYS QB 0.000 . 6.000 4.473 4.357 4.642 . 0 0 "[ . ]" 4
178 1 39 GLN QG 1 40 LYS H 0.000 . 6.000 3.937 3.410 4.310 . 0 0 "[ . ]" 4
179 1 5 ARG H 1 6 ILE HB 0.000 . 3.300 2.736 2.399 2.992 . 0 0 "[ . ]" 4
180 1 4 GLY QA 1 5 ARG QD 0.000 . 4.200 3.314 1.944 3.943 . 0 0 "[ . ]" 4
181 1 4 GLY QA 1 7 ALA MB 0.000 . 6.000 3.227 2.596 3.802 . 0 0 "[ . ]" 4
182 1 4 GLY H 1 6 ILE MD 0.000 . 6.000 3.344 2.171 3.965 . 0 0 "[ . ]" 4
183 1 41 VAL HB 1 42 MET HA 0.000 . 6.000 3.732 3.217 3.978 . 0 0 "[ . ]" 4
184 1 41 VAL HB 1 43 ASN H 0.000 . 6.000 4.840 4.309 5.318 . 0 0 "[ . ]" 4
185 1 5 ARG H 1 6 ILE H 0.000 . 3.300 2.161 1.990 2.310 . 0 0 "[ . ]" 4
186 1 5 ARG QG 1 9 LEU H 0.000 . 6.000 3.938 3.408 4.178 . 0 0 "[ . ]" 4
187 1 6 ILE H 1 6 ILE QG 0.000 . 4.200 2.514 1.811 3.132 . 0 0 "[ . ]" 4
188 1 6 ILE H 1 6 ILE MD 0.000 . 3.300 2.476 1.833 3.250 . 0 0 "[ . ]" 4
189 1 6 ILE MD 1 7 ALA H 0.000 . 4.200 2.909 1.878 3.277 . 0 0 "[ . ]" 4
190 1 6 ILE MD 1 7 ALA MB 0.000 . 6.000 3.617 2.175 3.922 . 0 0 "[ . ]" 4
191 1 6 ILE MD 1 10 GLU QG 0.000 . 3.300 2.772 2.098 3.264 . 0 0 "[ . ]" 4
192 1 6 ILE MD 1 10 GLU QB 0.000 . 4.200 3.619 2.898 4.042 . 0 0 "[ . ]" 4
193 2 11 GLU HA 2 14 LYS H 0.000 . 3.300 3.022 2.913 3.159 . 0 0 "[ . ]" 4
194 2 9 LEU HA 2 13 VAL H 0.000 . 4.200 3.294 3.237 3.358 . 0 0 "[ . ]" 4
195 2 7 ALA HA 2 10 GLU H 0.000 . 4.200 3.093 2.960 3.241 . 0 0 "[ . ]" 4
196 2 11 GLU HA 2 14 LYS HA 0.000 . 6.000 5.113 4.957 5.367 . 0 0 "[ . ]" 4
197 2 8 ARG HA 2 12 LYS QD 0.000 . 4.200 3.441 2.663 3.915 . 0 0 "[ . ]" 4
198 2 8 ARG HA 2 12 LYS QE 0.000 . 6.000 3.899 3.094 4.379 . 0 0 "[ . ]" 4
199 2 13 VAL HA 2 14 LYS H 0.000 . 4.200 3.348 3.313 3.388 . 0 0 "[ . ]" 4
200 2 11 GLU H 2 12 LYS H 0.000 . 3.300 2.349 2.311 2.406 . 0 0 "[ . ]" 4
201 2 11 GLU H 2 11 GLU QG 0.000 . 4.200 2.993 2.665 3.149 . 0 0 "[ . ]" 4
202 2 11 GLU H 2 13 VAL H 0.000 . 3.300 2.321 2.255 2.370 . 0 0 "[ . ]" 4
203 2 10 GLU HA 2 11 GLU H 0.000 . 4.200 3.394 3.339 3.455 . 0 0 "[ . ]" 4
204 2 6 ILE H 2 7 ALA MB 0.000 . 3.300 2.496 2.277 2.694 . 0 0 "[ . ]" 4
205 2 8 ARG H 2 11 GLU H 0.000 . 3.300 2.563 2.457 2.695 . 0 0 "[ . ]" 4
206 2 5 ARG H 2 6 ILE H 0.000 . 3.300 2.063 1.927 2.184 . 0 0 "[ . ]" 4
207 2 6 ILE H 2 6 ILE HB 0.000 . 3.300 2.053 1.959 2.171 . 0 0 "[ . ]" 4
208 2 3 GLY QA 2 6 ILE H 0.000 . 3.300 3.032 2.998 3.055 . 0 0 "[ . ]" 4
209 2 6 ILE H 2 7 ALA MB 0.000 . 4.200 3.836 3.799 3.933 . 0 0 "[ . ]" 4
210 2 6 ILE H 2 9 LEU QB 0.000 . 3.300 2.701 2.024 3.020 . 0 0 "[ . ]" 4
211 2 6 ILE H 2 10 GLU QG 0.000 . 6.000 3.863 3.706 4.149 . 0 0 "[ . ]" 4
212 2 10 GLU QB 2 11 GLU H 0.000 . 3.300 2.012 1.971 2.077 . 0 0 "[ . ]" 4
213 2 11 GLU QB 2 15 THR H 0.000 . 3.300 2.348 2.182 2.522 . 0 0 "[ . ]" 4
214 2 7 ALA H 2 10 GLU QB 0.000 . 6.000 4.112 3.925 4.270 . 0 0 "[ . ]" 4
215 2 10 GLU QB 2 13 VAL H 0.000 . 3.300 2.310 2.094 2.437 . 0 0 "[ . ]" 4
216 2 11 GLU QB 2 14 LYS H 0.000 . 3.300 2.301 1.962 2.437 . 0 0 "[ . ]" 4
217 2 11 GLU QB 2 12 LYS H 0.000 . 3.300 2.803 2.702 3.005 . 0 0 "[ . ]" 4
218 2 8 ARG H 2 10 GLU QB 0.000 . 4.200 3.932 3.817 4.095 . 0 0 "[ . ]" 4
219 2 11 GLU QG 2 15 THR H 0.000 . 6.000 4.466 3.915 4.832 . 0 0 "[ . ]" 4
220 2 8 ARG H 2 11 GLU QG 0.000 . 6.000 4.755 4.538 4.922 . 0 0 "[ . ]" 4
221 2 7 ALA MB 2 11 GLU QG 0.000 . 6.000 4.074 3.674 4.458 . 0 0 "[ . ]" 4
222 2 8 ARG QG 2 11 GLU QG 0.000 . 6.000 4.595 4.189 4.965 . 0 0 "[ . ]" 4
223 2 8 ARG QB 2 11 GLU QG 0.000 . 4.200 3.665 3.487 3.920 . 0 0 "[ . ]" 4
224 2 8 ARG QG 2 11 GLU QG 0.000 . 6.000 4.799 4.223 5.320 . 0 0 "[ . ]" 4
225 2 8 ARG QB 2 11 GLU QG 0.000 . 6.000 3.772 3.570 4.025 . 0 0 "[ . ]" 4
226 2 12 LYS H 2 12 LYS QB 0.000 . 3.300 2.000 1.958 2.072 . 0 0 "[ . ]" 4
227 2 12 LYS H 2 12 LYS QE 0.000 . 6.000 4.035 3.678 4.427 . 0 0 "[ . ]" 4
228 2 12 LYS H 2 14 LYS QB 0.000 . 3.300 2.736 2.405 2.971 . 0 0 "[ . ]" 4
229 2 12 LYS H 2 12 LYS QE 0.000 . 6.000 4.475 3.915 5.524 . 0 0 "[ . ]" 4
230 2 12 LYS QB 2 13 VAL HA 0.000 . 3.300 2.325 2.043 2.661 . 0 0 "[ . ]" 4
231 2 12 LYS QB 2 13 VAL H 0.000 . 3.300 2.011 1.919 2.087 . 0 0 "[ . ]" 4
232 2 14 LYS H 2 14 LYS QD 0.000 . 4.200 3.229 2.512 4.032 . 0 0 "[ . ]" 4
233 2 14 LYS QD 2 17 LYS H 0.000 . 3.300 2.736 2.341 3.133 . 0 0 "[ . ]" 4
234 2 14 LYS HA 2 14 LYS QD 0.000 . 3.300 2.019 1.886 2.118 . 0 0 "[ . ]" 4
235 2 12 LYS QD 2 15 THR H 0.000 . 6.000 4.258 3.786 4.452 . 0 0 "[ . ]" 4
236 2 5 ARG QG 2 9 LEU H 0.000 . 6.000 3.872 3.388 4.136 . 0 0 "[ . ]" 4
237 2 12 LYS QE 2 14 LYS H 0.000 . 4.200 3.652 3.089 3.991 . 0 0 "[ . ]" 4
238 2 14 LYS HA 2 14 LYS QE 0.000 . 6.000 2.888 2.610 3.274 . 0 0 "[ . ]" 4
239 2 8 ARG QB 2 12 LYS QE 0.000 . 4.200 3.081 2.021 3.505 . 0 0 "[ . ]" 4
240 2 12 LYS QG 2 14 LYS H 0.000 . 4.200 3.157 2.507 3.858 . 0 0 "[ . ]" 4
241 2 34 VAL HA 2 37 LEU QB 0.000 . 3.300 2.338 2.045 2.686 . 0 0 "[ . ]" 4
242 2 13 VAL HB 2 14 LYS H 0.000 . 3.300 2.306 1.963 2.446 . 0 0 "[ . ]" 4
243 2 13 VAL H 2 14 LYS HA 0.000 . 6.000 4.694 4.613 4.797 . 0 0 "[ . ]" 4
244 2 26 THR HA 2 30 LEU MD1 0.000 . 3.300 2.083 2.026 2.135 . 0 0 "[ . ]" 4
245 2 14 LYS HA 2 14 LYS QG 0.000 . 3.300 2.419 2.306 2.713 . 0 0 "[ . ]" 4
246 2 14 LYS QD 2 17 LYS H 0.000 . 4.200 2.701 2.332 3.051 . 0 0 "[ . ]" 4
247 2 14 LYS QD 2 18 ALA H 0.000 . 6.000 4.383 3.616 4.940 . 0 0 "[ . ]" 4
248 2 14 LYS H 2 16 LEU H 0.000 . 3.300 2.553 2.429 2.772 . 0 0 "[ . ]" 4
249 2 14 LYS H 2 14 LYS QG 0.000 . 4.200 3.867 3.699 4.047 . 0 0 "[ . ]" 4
250 2 5 ARG HA 2 8 ARG QB 0.000 . 3.300 2.504 2.243 2.686 . 0 0 "[ . ]" 4
251 2 14 LYS QE 2 17 LYS HA 0.000 . 6.000 4.202 4.055 4.342 . 0 0 "[ . ]" 4
252 2 14 LYS QE 2 17 LYS QB 0.000 . 4.200 2.468 2.108 3.100 . 0 0 "[ . ]" 4
253 2 14 LYS QG 2 15 THR H 0.000 . 6.000 4.046 3.581 4.290 . 0 0 "[ . ]" 4
254 2 15 THR HA 2 18 ALA H 0.000 . 4.200 3.393 3.220 3.548 . 0 0 "[ . ]" 4
255 2 15 THR HA 2 18 ALA MB 0.000 . 3.300 2.404 2.161 2.696 . 0 0 "[ . ]" 4
256 2 3 GLY H 2 4 GLY QA 0.000 . 6.000 3.900 3.665 4.110 . 0 0 "[ . ]" 4
257 2 15 THR H 2 15 THR MG 0.000 . 3.300 3.191 3.067 3.263 . 0 0 "[ . ]" 4
258 2 15 THR H 2 17 LYS H 0.000 . 6.000 4.098 3.961 4.239 . 0 0 "[ . ]" 4
259 2 15 THR MG 2 16 LEU H 0.000 . 3.300 2.172 2.067 2.361 . 0 0 "[ . ]" 4
260 2 19 GLN HA 2 22 GLU H 0.000 . 3.300 2.770 2.647 3.002 . 0 0 "[ . ]" 4
261 2 16 LEU HA 2 20 ASN H 0.000 . 4.200 3.359 3.277 3.409 . 0 0 "[ . ]" 4
262 2 16 LEU HA 2 19 GLN QG 0.000 . 3.300 2.186 1.979 2.290 . 0 0 "[ . ]" 4
263 2 16 LEU HA 2 19 GLN QG 0.000 . 3.300 2.232 1.995 2.337 . 0 0 "[ . ]" 4
264 2 16 LEU HA 2 18 ALA MB 0.000 . 6.000 3.434 3.418 3.454 . 0 0 "[ . ]" 4
265 2 16 LEU QD 2 19 GLN QE 0.000 . 6.000 2.735 2.077 3.466 . 0 0 "[ . ]" 4
266 2 16 LEU QD 2 19 GLN QE 0.000 . 6.000 3.127 2.394 3.608 . 0 0 "[ . ]" 4
267 2 17 LYS HA 2 20 ASN QB 0.000 . 3.300 2.323 2.097 2.492 . 0 0 "[ . ]" 4
268 2 4 GLY QA 2 7 ALA H 0.000 . 4.200 3.502 2.996 3.924 . 0 0 "[ . ]" 4
269 2 17 LYS HA 2 18 ALA HA 0.000 . 6.000 4.241 4.219 4.282 . 0 0 "[ . ]" 4
270 2 17 LYS H 2 17 LYS QD 0.000 . 6.000 2.720 2.336 3.078 . 0 0 "[ . ]" 4
271 2 17 LYS QD 2 20 ASN H 0.000 . 6.000 4.065 3.817 4.238 . 0 0 "[ . ]" 4
272 2 17 LYS QD 2 21 SER H 0.000 . 6.000 4.578 4.394 4.771 . 0 0 "[ . ]" 4
273 2 5 ARG QG 2 7 ALA H 0.000 . 6.000 4.509 3.943 4.992 . 0 0 "[ . ]" 4
274 2 3 GLY H 2 6 ILE HB 0.000 . 3.300 2.049 1.983 2.090 . 0 0 "[ . ]" 4
275 2 17 LYS QB 2 18 ALA HA 0.000 . 4.200 3.578 3.543 3.655 . 0 0 "[ . ]" 4
276 2 18 ALA HA 2 20 ASN H 0.000 . 6.000 4.034 3.779 4.275 . 0 0 "[ . ]" 4
277 2 18 ALA HA 2 20 ASN QB 0.000 . 6.000 3.313 2.775 3.729 . 0 0 "[ . ]" 4
278 2 18 ALA HA 2 22 GLU H 0.000 . 4.200 3.360 3.324 3.386 . 0 0 "[ . ]" 4
279 2 18 ALA HA 2 19 GLN QB 0.000 . 4.200 3.846 3.745 4.080 . 0 0 "[ . ]" 4
280 2 19 GLN HA 2 22 GLU QG 0.000 . 4.200 2.779 2.362 3.179 . 0 0 "[ . ]" 4
281 2 19 GLN HA 2 22 GLU HA 0.000 . 3.300 3.064 2.910 3.196 . 0 0 "[ . ]" 4
282 2 19 GLN HA 2 22 GLU H 0.000 . 4.200 3.262 3.124 3.514 . 0 0 "[ . ]" 4
283 2 19 GLN QB 2 20 ASN H 0.000 . 4.200 2.819 2.512 3.623 . 0 0 "[ . ]" 4
284 2 19 GLN QB 2 23 LEU H 0.000 . 3.300 2.208 2.088 2.419 . 0 0 "[ . ]" 4
285 2 29 MET HA 2 29 MET QG 0.000 . 3.300 2.045 1.756 2.423 . 0 0 "[ . ]" 4
286 2 20 ASN QD 2 24 ALA MB 0.000 . 3.300 2.116 2.029 2.186 . 0 0 "[ . ]" 4
287 2 5 ARG H 2 7 ALA H 0.000 . 3.300 2.737 2.533 2.855 . 0 0 "[ . ]" 4
288 2 33 GLN QB 2 35 ALA H 0.000 . 3.300 2.308 2.174 2.418 . 0 0 "[ . ]" 4
289 2 33 GLN H 2 33 GLN QB 0.000 . 3.300 2.533 2.381 2.695 . 0 0 "[ . ]" 4
290 2 2 CYS HA 2 5 ARG H 0.000 . 6.000 3.934 3.494 4.521 . 0 0 "[ . ]" 4
291 2 2 CYS HA 2 5 ARG QB 0.000 . 3.300 2.522 2.193 3.080 . 0 0 "[ . ]" 4
292 2 2 CYS HA 2 5 ARG QD 0.000 . 4.200 3.593 2.924 4.110 . 0 0 "[ . ]" 4
293 2 21 SER HA 2 25 SER H 0.000 . 4.200 3.783 3.330 4.044 . 0 0 "[ . ]" 4
294 2 4 GLY QA 2 7 ALA H 0.000 . 3.300 2.324 2.046 2.838 . 0 0 "[ . ]" 4
295 2 22 GLU HA 2 23 LEU HA 0.000 . 4.200 4.041 3.960 4.129 . 0 0 "[ . ]" 4
296 2 22 GLU HA 2 25 SER H 0.000 . 4.200 3.565 3.150 3.967 . 0 0 "[ . ]" 4
297 2 22 GLU QG 2 25 SER H 0.000 . 6.000 3.699 3.118 4.277 . 0 0 "[ . ]" 4
298 2 23 LEU HA 2 27 ALA H 0.000 . 4.200 3.044 2.986 3.105 . 0 0 "[ . ]" 4
299 2 23 LEU HA 2 23 LEU HG 0.000 . 3.300 2.247 2.026 2.692 . 0 0 "[ . ]" 4
300 2 23 LEU QB 2 27 ALA H 0.000 . 3.300 2.538 2.364 2.749 . 0 0 "[ . ]" 4
301 2 23 LEU MD2 2 26 THR MG 0.000 . 3.300 2.187 1.846 2.584 . 0 0 "[ . ]" 4
302 2 24 ALA HA 2 28 ASN QD 0.000 . 6.000 4.646 3.354 5.439 . 0 0 "[ . ]" 4
303 2 24 ALA HA 2 28 ASN H 0.000 . 6.000 3.714 3.549 3.836 . 0 0 "[ . ]" 4
304 2 24 ALA HA 2 28 ASN QD 0.000 . 4.200 3.480 3.231 3.555 . 0 0 "[ . ]" 4
305 2 24 ALA HA 2 28 ASN H 0.000 . 4.200 3.994 3.866 4.114 . 0 0 "[ . ]" 4
306 2 24 ALA HA 2 25 SER H 0.000 . 4.200 3.536 3.394 3.570 . 0 0 "[ . ]" 4
307 2 25 SER HA 2 26 THR H 0.000 . 4.200 2.577 2.388 2.743 . 0 0 "[ . ]" 4
308 2 25 SER HA 2 27 ALA H 0.000 . 4.200 2.457 2.266 2.866 . 0 0 "[ . ]" 4
309 2 25 SER HA 2 28 ASN H 0.000 . 4.200 3.237 3.033 3.400 . 0 0 "[ . ]" 4
310 2 25 SER HA 2 28 ASN H 0.000 . 6.000 3.400 3.152 3.625 . 0 0 "[ . ]" 4
311 2 25 SER HA 2 29 MET H 0.000 . 6.000 4.095 3.945 4.228 . 0 0 "[ . ]" 4
312 2 25 SER QB 2 29 MET QB 0.000 . 3.300 3.134 2.609 3.259 . 0 0 "[ . ]" 4
313 2 25 SER QB 2 27 ALA H 0.000 . 4.200 3.365 3.262 3.436 . 0 0 "[ . ]" 4
314 2 26 THR HA 2 28 ASN QD 0.000 . 6.000 5.085 4.621 5.313 . 0 0 "[ . ]" 4
315 2 27 ALA MB 2 28 ASN H 0.000 . 3.300 2.526 2.130 2.889 . 0 0 "[ . ]" 4
316 2 28 ASN H 2 28 ASN QB 0.000 . 3.300 2.174 1.985 2.432 . 0 0 "[ . ]" 4
317 2 28 ASN H 2 29 MET QG 0.000 . 4.200 3.641 2.606 3.981 . 0 0 "[ . ]" 4
318 2 28 ASN H 2 29 MET QB 0.000 . 3.300 2.196 2.038 2.306 . 0 0 "[ . ]" 4
319 2 28 ASN H 2 30 LEU H 0.000 . 3.300 2.686 2.479 2.806 . 0 0 "[ . ]" 4
320 2 28 ASN QB 2 29 MET QB 0.000 . 6.000 3.792 3.683 3.962 . 0 0 "[ . ]" 4
321 2 29 MET HA 2 31 ARG H 0.000 . 6.000 3.952 3.760 4.438 . 0 0 "[ . ]" 4
322 2 29 MET QG 2 31 ARG H 0.000 . 6.000 3.818 3.387 4.620 . 0 0 "[ . ]" 4
323 2 32 GLU QG 2 33 GLN H 0.000 . 3.300 1.859 1.713 2.111 . 0 0 "[ . ]" 4
324 2 29 MET QG 2 30 LEU H 0.000 . 6.000 3.563 3.099 3.908 . 0 0 "[ . ]" 4
325 2 29 MET H 2 30 LEU HG 0.000 . 6.000 3.978 3.821 4.498 . 0 0 "[ . ]" 4
326 2 29 MET QB 2 30 LEU HA 0.000 . 3.300 2.012 1.856 2.277 . 0 0 "[ . ]" 4
327 2 29 MET QB 2 30 LEU H 0.000 . 3.300 2.380 2.091 2.642 . 0 0 "[ . ]" 4
328 2 29 MET QB 2 31 ARG H 0.000 . 6.000 3.599 3.481 3.961 . 0 0 "[ . ]" 4
329 2 32 GLU H 2 32 GLU QB 0.000 . 3.300 2.408 2.182 2.602 . 0 0 "[ . ]" 4
330 2 30 LEU HA 2 30 LEU HG 0.000 . 3.300 2.855 2.682 3.098 . 0 0 "[ . ]" 4
331 2 30 LEU QB 2 31 ARG H 0.000 . 3.300 2.065 1.926 2.174 . 0 0 "[ . ]" 4
332 2 5 ARG QB 2 5 ARG HE 0.000 . 4.200 3.599 2.630 4.074 . 0 0 "[ . ]" 4
333 2 31 ARG QG 2 34 VAL QG 0.000 . 4.200 2.780 1.747 3.550 . 0 0 "[ . ]" 4
334 2 8 ARG H 2 10 GLU QG 0.000 . 6.000 3.827 3.538 4.570 . 0 0 "[ . ]" 4
335 2 32 GLU QG 2 34 VAL H 0.000 . 6.000 4.030 3.744 4.275 . 0 0 "[ . ]" 4
336 2 32 GLU QG 2 35 ALA MB 0.000 . 6.000 3.396 2.941 3.662 . 0 0 "[ . ]" 4
337 2 36 GLN HA 2 36 GLN QG 0.000 . 3.300 2.636 2.118 3.183 . 0 0 "[ . ]" 4
338 2 32 GLU QB 2 33 GLN H 0.000 . 3.300 2.016 1.794 2.248 . 0 0 "[ . ]" 4
339 2 33 GLN HA 2 36 GLN QG 0.000 . 3.300 2.002 1.862 2.325 . 0 0 "[ . ]" 4
340 2 33 GLN H 2 33 GLN QB 0.000 . 3.300 2.526 2.375 2.695 . 0 0 "[ . ]" 4
341 2 33 GLN H 2 34 VAL H 0.000 . 3.300 2.587 2.447 2.819 . 0 0 "[ . ]" 4
342 2 33 GLN H 2 35 ALA H 0.000 . 3.300 2.574 2.464 2.716 . 0 0 "[ . ]" 4
343 2 33 GLN H 2 35 ALA MB 0.000 . 3.300 2.527 2.292 2.738 . 0 0 "[ . ]" 4
344 2 33 GLN QB 2 34 VAL H 0.000 . 3.300 2.243 1.964 2.378 . 0 0 "[ . ]" 4
345 2 33 GLN QB 2 35 ALA H 0.000 . 3.300 2.775 2.435 3.142 . 0 0 "[ . ]" 4
346 2 35 ALA HA 2 39 GLN H 0.000 . 6.000 3.980 3.502 4.372 . 0 0 "[ . ]" 4
347 2 7 ALA MB 2 8 ARG H 0.000 . 3.300 2.016 1.836 2.117 . 0 0 "[ . ]" 4
348 2 5 ARG H 2 5 ARG QG 0.000 . 4.200 2.370 1.873 2.858 . 0 0 "[ . ]" 4
349 2 35 ALA H 2 36 GLN QG 0.000 . 6.000 4.008 3.581 4.857 . 0 0 "[ . ]" 4
350 2 35 ALA MB 2 36 GLN QE 0.000 . 6.000 4.098 3.653 4.475 . 0 0 "[ . ]" 4
351 2 35 ALA MB 2 37 LEU H 0.000 . 6.000 4.283 4.091 4.679 . 0 0 "[ . ]" 4
352 2 35 ALA MB 2 38 LYS H 0.000 . 6.000 4.636 4.503 4.778 . 0 0 "[ . ]" 4
353 2 35 ALA MB 2 39 GLN H 0.000 . 6.000 4.424 4.043 4.719 . 0 0 "[ . ]" 4
354 2 35 ALA MB 2 36 GLN QE 0.000 . 6.000 3.900 3.506 4.548 . 0 0 "[ . ]" 4
355 2 36 GLN HA 2 38 LYS H 0.000 . 6.000 3.448 3.312 3.519 . 0 0 "[ . ]" 4
356 2 36 GLN HA 2 39 GLN H 0.000 . 4.200 3.419 3.118 3.693 . 0 0 "[ . ]" 4
357 2 36 GLN HA 2 40 LYS H 0.000 . 4.200 3.383 3.196 3.694 . 0 0 "[ . ]" 4
358 2 36 GLN HA 2 39 GLN H 0.000 . 4.200 3.462 3.015 3.741 . 0 0 "[ . ]" 4
359 2 36 GLN QG 2 40 LYS H 0.000 . 6.000 3.914 3.376 4.255 . 0 0 "[ . ]" 4
360 2 5 ARG QB 2 6 ILE H 0.000 . 3.300 2.882 2.758 3.064 . 0 0 "[ . ]" 4
361 2 36 GLN H 2 39 GLN H 0.000 . 6.000 4.260 4.117 4.484 . 0 0 "[ . ]" 4
362 2 37 LEU QB 2 38 LYS HA 0.000 . 3.300 2.418 1.956 2.781 . 0 0 "[ . ]" 4
363 2 37 LEU QB 2 38 LYS H 0.000 . 3.300 2.235 1.815 2.679 . 0 0 "[ . ]" 4
364 2 37 LEU QB 2 39 GLN H 0.000 . 6.000 3.891 3.654 4.070 . 0 0 "[ . ]" 4
365 2 37 LEU H 2 37 LEU HG 0.000 . 3.300 3.128 2.460 3.287 . 0 0 "[ . ]" 4
366 2 5 ARG H 2 5 ARG QG 0.000 . 3.300 2.869 2.550 3.231 . 0 0 "[ . ]" 4
367 2 38 LYS QD 2 39 GLN H 0.000 . 6.000 4.470 4.145 4.789 . 0 0 "[ . ]" 4
368 2 38 LYS QD 2 40 LYS H 0.000 . 6.000 4.101 3.744 4.332 . 0 0 "[ . ]" 4
369 2 39 GLN H 2 40 LYS QB 0.000 . 6.000 4.473 4.358 4.632 . 0 0 "[ . ]" 4
370 2 39 GLN QG 2 40 LYS H 0.000 . 6.000 3.936 3.400 4.309 . 0 0 "[ . ]" 4
371 2 5 ARG H 2 6 ILE HB 0.000 . 3.300 2.738 2.402 2.992 . 0 0 "[ . ]" 4
372 2 4 GLY QA 2 5 ARG QD 0.000 . 4.200 3.315 1.943 3.940 . 0 0 "[ . ]" 4
373 2 4 GLY QA 2 7 ALA MB 0.000 . 6.000 3.222 2.580 3.803 . 0 0 "[ . ]" 4
374 2 4 GLY H 2 6 ILE MD 0.000 . 6.000 3.351 2.177 3.973 . 0 0 "[ . ]" 4
375 2 41 VAL HB 2 42 MET HA 0.000 . 6.000 3.730 3.213 3.975 . 0 0 "[ . ]" 4
376 2 41 VAL HB 2 43 ASN H 0.000 . 6.000 4.839 4.319 5.321 . 0 0 "[ . ]" 4
377 2 5 ARG H 2 6 ILE H 0.000 . 3.300 2.162 1.982 2.315 . 0 0 "[ . ]" 4
378 2 5 ARG QG 2 9 LEU H 0.000 . 6.000 3.937 3.410 4.176 . 0 0 "[ . ]" 4
379 2 6 ILE H 2 6 ILE QG 0.000 . 4.200 2.516 1.811 3.138 . 0 0 "[ . ]" 4
380 2 6 ILE H 2 6 ILE MD 0.000 . 3.300 2.479 1.844 3.249 . 0 0 "[ . ]" 4
381 2 6 ILE MD 2 7 ALA H 0.000 . 4.200 2.910 1.882 3.277 . 0 0 "[ . ]" 4
382 2 6 ILE MD 2 7 ALA MB 0.000 . 6.000 3.619 2.193 3.922 . 0 0 "[ . ]" 4
383 2 6 ILE MD 2 10 GLU QG 0.000 . 3.300 2.774 2.108 3.263 . 0 0 "[ . ]" 4
384 2 6 ILE MD 2 10 GLU QB 0.000 . 4.200 3.620 2.899 4.038 . 0 0 "[ . ]" 4
stop_
save_
save_distance_constraint_statistics_5
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 5
_Distance_constraint_stats_list.Constraint_count 124
_Distance_constraint_stats_list.Viol_count 75
_Distance_constraint_stats_list.Viol_total 4.099
_Distance_constraint_stats_list.Viol_max 0.027
_Distance_constraint_stats_list.Viol_rms 0.0028
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0007
_Distance_constraint_stats_list.Viol_average_violations_only 0.0078
_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 5 ARG 0.000 0.000 . 0 "[ . ]"
1 6 ILE 0.015 0.009 6 0 "[ . ]"
1 7 ALA 0.000 0.000 6 0 "[ . ]"
1 8 ARG 0.019 0.015 7 0 "[ . ]"
1 9 LEU 0.000 0.000 . 0 "[ . ]"
1 10 GLU 0.023 0.009 6 0 "[ . ]"
1 11 GLU 0.016 0.013 1 0 "[ . ]"
1 12 LYS 0.019 0.015 7 0 "[ . ]"
1 13 VAL 0.000 0.000 . 0 "[ . ]"
1 14 LYS 0.008 0.008 7 0 "[ . ]"
1 15 THR 0.083 0.026 5 0 "[ . ]"
1 16 LEU 0.001 0.001 6 0 "[ . ]"
1 17 LYS 0.014 0.009 1 0 "[ . ]"
1 18 ALA 0.000 0.000 . 0 "[ . ]"
1 19 GLN 0.071 0.026 5 0 "[ . ]"
1 20 ASN 0.001 0.001 6 0 "[ . ]"
1 21 SER 0.015 0.009 1 0 "[ . ]"
1 22 GLU 0.013 0.013 7 0 "[ . ]"
1 23 LEU 0.004 0.004 4 0 "[ . ]"
1 24 ALA 0.009 0.009 7 0 "[ . ]"
1 25 SER 0.001 0.001 3 0 "[ . ]"
1 26 THR 0.013 0.013 7 0 "[ . ]"
1 27 ALA 0.004 0.003 4 0 "[ . ]"
1 28 ASN 0.009 0.009 7 0 "[ . ]"
1 29 MET 0.042 0.020 5 0 "[ . ]"
1 30 LEU 0.005 0.005 5 0 "[ . ]"
1 31 ARG 0.004 0.003 4 0 "[ . ]"
1 32 GLU 0.043 0.012 7 0 "[ . ]"
1 33 GLN 0.050 0.020 5 0 "[ . ]"
1 34 VAL 0.015 0.009 5 0 "[ . ]"
1 35 ALA 0.016 0.008 7 0 "[ . ]"
1 36 GLN 0.043 0.012 7 0 "[ . ]"
1 37 LEU 0.009 0.009 4 0 "[ . ]"
1 38 LYS 0.009 0.009 5 0 "[ . ]"
1 39 GLN 0.016 0.008 7 0 "[ . ]"
2 5 ARG 0.000 0.000 . 0 "[ . ]"
2 6 ILE 0.014 0.010 6 0 "[ . ]"
2 7 ALA 0.000 0.000 6 0 "[ . ]"
2 8 ARG 0.014 0.011 7 0 "[ . ]"
2 9 LEU 0.000 0.000 . 0 "[ . ]"
2 10 GLU 0.023 0.010 6 0 "[ . ]"
2 11 GLU 0.018 0.014 1 0 "[ . ]"
2 12 LYS 0.014 0.011 7 0 "[ . ]"
2 13 VAL 0.000 0.000 . 0 "[ . ]"
2 14 LYS 0.011 0.009 7 0 "[ . ]"
2 15 THR 0.084 0.027 5 0 "[ . ]"
2 16 LEU 0.007 0.005 6 0 "[ . ]"
2 17 LYS 0.010 0.009 1 0 "[ . ]"
2 18 ALA 0.002 0.002 5 0 "[ . ]"
2 19 GLN 0.076 0.027 5 0 "[ . ]"
2 20 ASN 0.007 0.005 6 0 "[ . ]"
2 21 SER 0.012 0.009 1 0 "[ . ]"
2 22 GLU 0.012 0.012 7 0 "[ . ]"
2 23 LEU 0.010 0.010 4 0 "[ . ]"
2 24 ALA 0.009 0.009 7 0 "[ . ]"
2 25 SER 0.001 0.001 3 0 "[ . ]"
2 26 THR 0.012 0.012 7 0 "[ . ]"
2 27 ALA 0.002 0.002 2 0 "[ . ]"
2 28 ASN 0.009 0.009 7 0 "[ . ]"
2 29 MET 0.039 0.019 5 0 "[ . ]"
2 30 LEU 0.005 0.005 5 0 "[ . ]"
2 31 ARG 0.002 0.002 2 0 "[ . ]"
2 32 GLU 0.043 0.013 7 0 "[ . ]"
2 33 GLN 0.046 0.019 5 0 "[ . ]"
2 34 VAL 0.014 0.009 5 0 "[ . ]"
2 35 ALA 0.012 0.007 7 0 "[ . ]"
2 36 GLN 0.043 0.013 7 0 "[ . ]"
2 37 LEU 0.007 0.007 4 0 "[ . ]"
2 38 LYS 0.009 0.009 5 0 "[ . ]"
2 39 GLN 0.012 0.007 7 0 "[ . ]"
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 5 ARG O 1 9 LEU H 1.800 . 2.200 2.058 1.869 2.177 . 0 0 "[ . ]" 5
2 1 5 ARG O 1 9 LEU N 2.700 2.700 3.300 3.016 2.844 3.150 . 0 0 "[ . ]" 5
3 1 6 ILE O 1 10 GLU H 1.800 . 2.200 1.972 1.791 2.205 0.009 6 0 "[ . ]" 5
4 1 6 ILE O 1 10 GLU N 2.700 2.700 3.300 2.878 2.740 3.029 . 0 0 "[ . ]" 5
5 1 7 ALA O 1 11 GLU H 1.800 . 2.200 2.114 1.964 2.200 0.000 6 0 "[ . ]" 5
6 1 7 ALA O 1 11 GLU N 2.700 2.700 3.300 3.038 2.883 3.143 . 0 0 "[ . ]" 5
7 1 8 ARG O 1 12 LYS H 1.800 . 2.200 2.046 1.796 2.215 0.015 7 0 "[ . ]" 5
8 1 8 ARG O 1 12 LYS N 2.700 2.700 3.300 2.925 2.727 3.151 . 0 0 "[ . ]" 5
9 1 9 LEU O 1 13 VAL H 1.800 . 2.200 2.035 1.855 2.151 . 0 0 "[ . ]" 5
10 1 9 LEU O 1 13 VAL N 2.700 2.700 3.300 2.967 2.812 3.129 . 0 0 "[ . ]" 5
11 1 10 GLU O 1 14 LYS H 1.800 . 2.200 2.125 2.011 2.208 0.008 7 0 "[ . ]" 5
12 1 10 GLU O 1 14 LYS N 2.700 2.700 3.300 2.988 2.847 3.150 . 0 0 "[ . ]" 5
13 1 11 GLU O 1 15 THR H 1.800 . 2.200 2.148 2.051 2.213 0.013 1 0 "[ . ]" 5
14 1 11 GLU O 1 15 THR N 2.700 2.700 3.300 3.102 3.004 3.164 . 0 0 "[ . ]" 5
15 1 12 LYS O 1 16 LEU H 1.800 . 2.200 2.044 1.916 2.123 . 0 0 "[ . ]" 5
16 1 12 LYS O 1 16 LEU N 2.700 2.700 3.300 2.989 2.872 3.098 . 0 0 "[ . ]" 5
17 1 13 VAL O 1 17 LYS H 1.800 . 2.200 2.130 1.958 2.187 . 0 0 "[ . ]" 5
18 1 13 VAL O 1 17 LYS N 2.700 2.700 3.300 3.084 2.926 3.166 . 0 0 "[ . ]" 5
19 1 14 LYS O 1 18 ALA H 1.800 . 2.200 2.119 2.002 2.198 . 0 0 "[ . ]" 5
20 1 14 LYS O 1 18 ALA N 2.700 2.700 3.300 3.013 2.947 3.088 . 0 0 "[ . ]" 5
21 1 15 THR O 1 19 GLN H 1.800 . 2.200 2.206 2.187 2.226 0.026 5 0 "[ . ]" 5
22 1 15 THR O 1 19 GLN N 2.700 2.700 3.300 3.146 3.128 3.168 . 0 0 "[ . ]" 5
23 1 16 LEU O 1 20 ASN H 1.800 . 2.200 2.044 1.799 2.195 0.001 6 0 "[ . ]" 5
24 1 16 LEU O 1 20 ASN N 2.700 2.700 3.300 2.956 2.705 3.105 . 0 0 "[ . ]" 5
25 1 17 LYS O 1 21 SER H 1.800 . 2.200 2.117 1.955 2.209 0.009 1 0 "[ . ]" 5
26 1 17 LYS O 1 21 SER N 2.700 2.700 3.300 3.062 2.880 3.173 . 0 0 "[ . ]" 5
27 1 18 ALA O 1 22 GLU H 1.800 . 2.200 2.026 1.856 2.167 . 0 0 "[ . ]" 5
28 1 18 ALA O 1 22 GLU N 2.700 2.700 3.300 2.922 2.774 3.057 . 0 0 "[ . ]" 5
29 1 19 GLN O 1 23 LEU H 1.800 . 2.200 1.993 1.796 2.149 0.004 4 0 "[ . ]" 5
30 1 19 GLN O 1 23 LEU N 2.700 2.700 3.300 2.915 2.770 3.121 . 0 0 "[ . ]" 5
31 1 20 ASN O 1 24 ALA H 1.800 . 2.200 2.023 1.874 2.197 . 0 0 "[ . ]" 5
32 1 20 ASN O 1 24 ALA N 2.700 2.700 3.300 2.902 2.760 3.104 . 0 0 "[ . ]" 5
33 1 21 SER O 1 25 SER H 1.800 . 2.200 2.110 1.928 2.201 0.001 3 0 "[ . ]" 5
34 1 21 SER O 1 25 SER N 2.700 2.700 3.300 3.040 2.804 3.165 . 0 0 "[ . ]" 5
35 1 22 GLU O 1 26 THR H 1.800 . 2.200 2.111 1.872 2.213 0.013 7 0 "[ . ]" 5
36 1 22 GLU O 1 26 THR N 2.700 2.700 3.300 3.068 2.841 3.182 . 0 0 "[ . ]" 5
37 1 23 LEU O 1 27 ALA H 1.800 . 2.200 1.993 1.819 2.141 . 0 0 "[ . ]" 5
38 1 23 LEU O 1 27 ALA N 2.700 2.700 3.300 2.927 2.791 3.097 . 0 0 "[ . ]" 5
39 1 24 ALA O 1 28 ASN H 1.800 . 2.200 2.072 1.903 2.209 0.009 7 0 "[ . ]" 5
40 1 24 ALA O 1 28 ASN N 2.700 2.700 3.300 2.983 2.757 3.189 . 0 0 "[ . ]" 5
41 1 25 SER O 1 29 MET H 1.800 . 2.200 2.083 2.007 2.148 . 0 0 "[ . ]" 5
42 1 25 SER O 1 29 MET N 2.700 2.700 3.300 2.939 2.872 2.983 . 0 0 "[ . ]" 5
43 1 26 THR O 1 30 LEU H 1.800 . 2.200 2.092 1.975 2.194 . 0 0 "[ . ]" 5
44 1 26 THR O 1 30 LEU N 2.700 2.700 3.300 3.035 2.927 3.115 . 0 0 "[ . ]" 5
45 1 27 ALA O 1 31 ARG H 1.800 . 2.200 2.127 1.922 2.203 0.003 4 0 "[ . ]" 5
46 1 27 ALA O 1 31 ARG N 2.700 2.700 3.300 2.966 2.724 3.143 . 0 0 "[ . ]" 5
47 1 28 ASN O 1 32 GLU H 1.800 . 2.200 2.121 1.870 2.199 . 0 0 "[ . ]" 5
48 1 28 ASN O 1 32 GLU N 2.700 2.700 3.300 3.022 2.847 3.130 . 0 0 "[ . ]" 5
49 1 29 MET O 1 33 GLN H 1.800 . 2.200 2.136 1.981 2.220 0.020 5 0 "[ . ]" 5
50 1 29 MET O 1 33 GLN N 2.700 2.700 3.300 3.062 2.897 3.172 . 0 0 "[ . ]" 5
51 1 30 LEU O 1 34 VAL H 1.800 . 2.200 2.146 2.075 2.205 0.005 5 0 "[ . ]" 5
52 1 30 LEU O 1 34 VAL N 2.700 2.700 3.300 3.024 2.966 3.102 . 0 0 "[ . ]" 5
53 1 31 ARG O 1 35 ALA H 1.800 . 2.200 2.078 1.936 2.171 . 0 0 "[ . ]" 5
54 1 31 ARG O 1 35 ALA N 2.700 2.700 3.300 2.924 2.759 3.055 . 0 0 "[ . ]" 5
55 1 32 GLU O 1 36 GLN H 1.800 . 2.200 2.173 1.970 2.212 0.012 7 0 "[ . ]" 5
56 1 32 GLU O 1 36 GLN N 2.700 2.700 3.300 3.089 2.896 3.185 . 0 0 "[ . ]" 5
57 1 33 GLN O 1 37 LEU H 1.800 . 2.200 2.031 1.872 2.184 . 0 0 "[ . ]" 5
58 1 33 GLN O 1 37 LEU N 2.700 2.700 3.300 2.872 2.691 3.046 0.009 4 0 "[ . ]" 5
59 1 34 VAL O 1 38 LYS H 1.800 . 2.200 2.046 1.815 2.209 0.009 5 0 "[ . ]" 5
60 1 34 VAL O 1 38 LYS N 2.700 2.700 3.300 2.973 2.774 3.180 . 0 0 "[ . ]" 5
61 1 35 ALA O 1 39 GLN H 1.800 . 2.200 2.096 1.841 2.208 0.008 7 0 "[ . ]" 5
62 1 35 ALA O 1 39 GLN N 2.700 2.700 3.300 2.975 2.762 3.182 . 0 0 "[ . ]" 5
63 2 5 ARG O 2 9 LEU H 1.800 . 2.200 2.058 1.868 2.178 . 0 0 "[ . ]" 5
64 2 5 ARG O 2 9 LEU N 2.700 2.700 3.300 3.017 2.843 3.152 . 0 0 "[ . ]" 5
65 2 6 ILE O 2 10 GLU H 1.800 . 2.200 1.974 1.790 2.203 0.010 6 0 "[ . ]" 5
66 2 6 ILE O 2 10 GLU N 2.700 2.700 3.300 2.880 2.743 3.028 . 0 0 "[ . ]" 5
67 2 7 ALA O 2 11 GLU H 1.800 . 2.200 2.115 1.961 2.200 0.000 6 0 "[ . ]" 5
68 2 7 ALA O 2 11 GLU N 2.700 2.700 3.300 3.039 2.882 3.138 . 0 0 "[ . ]" 5
69 2 8 ARG O 2 12 LYS H 1.800 . 2.200 2.047 1.797 2.211 0.011 7 0 "[ . ]" 5
70 2 8 ARG O 2 12 LYS N 2.700 2.700 3.300 2.926 2.730 3.148 . 0 0 "[ . ]" 5
71 2 9 LEU O 2 13 VAL H 1.800 . 2.200 2.034 1.858 2.147 . 0 0 "[ . ]" 5
72 2 9 LEU O 2 13 VAL N 2.700 2.700 3.300 2.967 2.815 3.127 . 0 0 "[ . ]" 5
73 2 10 GLU O 2 14 LYS H 1.800 . 2.200 2.125 2.013 2.209 0.009 7 0 "[ . ]" 5
74 2 10 GLU O 2 14 LYS N 2.700 2.700 3.300 2.989 2.850 3.152 . 0 0 "[ . ]" 5
75 2 11 GLU O 2 15 THR H 1.800 . 2.200 2.150 2.046 2.214 0.014 1 0 "[ . ]" 5
76 2 11 GLU O 2 15 THR N 2.700 2.700 3.300 3.106 3.001 3.167 . 0 0 "[ . ]" 5
77 2 12 LYS O 2 16 LEU H 1.800 . 2.200 2.047 1.912 2.124 . 0 0 "[ . ]" 5
78 2 12 LYS O 2 16 LEU N 2.700 2.700 3.300 2.992 2.867 3.101 . 0 0 "[ . ]" 5
79 2 13 VAL O 2 17 LYS H 1.800 . 2.200 2.130 1.965 2.184 . 0 0 "[ . ]" 5
80 2 13 VAL O 2 17 LYS N 2.700 2.700 3.300 3.083 2.932 3.163 . 0 0 "[ . ]" 5
81 2 14 LYS O 2 18 ALA H 1.800 . 2.200 2.117 2.003 2.202 0.002 5 0 "[ . ]" 5
82 2 14 LYS O 2 18 ALA N 2.700 2.700 3.300 3.009 2.943 3.075 . 0 0 "[ . ]" 5
83 2 15 THR O 2 19 GLN H 1.800 . 2.200 2.205 2.173 2.227 0.027 5 0 "[ . ]" 5
84 2 15 THR O 2 19 GLN N 2.700 2.700 3.300 3.144 3.117 3.163 . 0 0 "[ . ]" 5
85 2 16 LEU O 2 20 ASN H 1.800 . 2.200 2.047 1.795 2.192 0.005 6 0 "[ . ]" 5
86 2 16 LEU O 2 20 ASN N 2.700 2.700 3.300 2.953 2.698 3.082 0.002 6 0 "[ . ]" 5
87 2 17 LYS O 2 21 SER H 1.800 . 2.200 2.115 1.928 2.209 0.009 1 0 "[ . ]" 5
88 2 17 LYS O 2 21 SER N 2.700 2.700 3.300 3.060 2.862 3.165 . 0 0 "[ . ]" 5
89 2 18 ALA O 2 22 GLU H 1.800 . 2.200 2.028 1.855 2.180 . 0 0 "[ . ]" 5
90 2 18 ALA O 2 22 GLU N 2.700 2.700 3.300 2.925 2.777 3.054 . 0 0 "[ . ]" 5
91 2 19 GLN O 2 23 LEU H 1.800 . 2.200 1.993 1.790 2.151 0.010 4 0 "[ . ]" 5
92 2 19 GLN O 2 23 LEU N 2.700 2.700 3.300 2.917 2.753 3.122 . 0 0 "[ . ]" 5
93 2 20 ASN O 2 24 ALA H 1.800 . 2.200 2.028 1.854 2.200 . 0 0 "[ . ]" 5
94 2 20 ASN O 2 24 ALA N 2.700 2.700 3.300 2.908 2.765 3.137 . 0 0 "[ . ]" 5
95 2 21 SER O 2 25 SER H 1.800 . 2.200 2.112 1.937 2.201 0.001 3 0 "[ . ]" 5
96 2 21 SER O 2 25 SER N 2.700 2.700 3.300 3.042 2.813 3.160 . 0 0 "[ . ]" 5
97 2 22 GLU O 2 26 THR H 1.800 . 2.200 2.112 1.878 2.212 0.012 7 0 "[ . ]" 5
98 2 22 GLU O 2 26 THR N 2.700 2.700 3.300 3.069 2.849 3.182 . 0 0 "[ . ]" 5
99 2 23 LEU O 2 27 ALA H 1.800 . 2.200 1.995 1.814 2.143 . 0 0 "[ . ]" 5
100 2 23 LEU O 2 27 ALA N 2.700 2.700 3.300 2.929 2.786 3.107 . 0 0 "[ . ]" 5
101 2 24 ALA O 2 28 ASN H 1.800 . 2.200 2.076 1.909 2.209 0.009 7 0 "[ . ]" 5
102 2 24 ALA O 2 28 ASN N 2.700 2.700 3.300 2.987 2.759 3.186 . 0 0 "[ . ]" 5
103 2 25 SER O 2 29 MET H 1.800 . 2.200 2.081 2.007 2.150 . 0 0 "[ . ]" 5
104 2 25 SER O 2 29 MET N 2.700 2.700 3.300 2.937 2.863 2.985 . 0 0 "[ . ]" 5
105 2 26 THR O 2 30 LEU H 1.800 . 2.200 2.089 1.970 2.183 . 0 0 "[ . ]" 5
106 2 26 THR O 2 30 LEU N 2.700 2.700 3.300 3.033 2.924 3.118 . 0 0 "[ . ]" 5
107 2 27 ALA O 2 31 ARG H 1.800 . 2.200 2.125 1.914 2.202 0.002 2 0 "[ . ]" 5
108 2 27 ALA O 2 31 ARG N 2.700 2.700 3.300 2.965 2.723 3.146 . 0 0 "[ . ]" 5
109 2 28 ASN O 2 32 GLU H 1.800 . 2.200 2.121 1.862 2.197 . 0 0 "[ . ]" 5
110 2 28 ASN O 2 32 GLU N 2.700 2.700 3.300 3.021 2.839 3.134 . 0 0 "[ . ]" 5
111 2 29 MET O 2 33 GLN H 1.800 . 2.200 2.137 1.991 2.219 0.019 5 0 "[ . ]" 5
112 2 29 MET O 2 33 GLN N 2.700 2.700 3.300 3.063 2.907 3.172 . 0 0 "[ . ]" 5
113 2 30 LEU O 2 34 VAL H 1.800 . 2.200 2.143 2.077 2.205 0.005 5 0 "[ . ]" 5
114 2 30 LEU O 2 34 VAL N 2.700 2.700 3.300 3.022 2.964 3.085 . 0 0 "[ . ]" 5
115 2 31 ARG O 2 35 ALA H 1.800 . 2.200 2.079 1.940 2.168 . 0 0 "[ . ]" 5
116 2 31 ARG O 2 35 ALA N 2.700 2.700 3.300 2.925 2.763 3.051 . 0 0 "[ . ]" 5
117 2 32 GLU O 2 36 GLN H 1.800 . 2.200 2.173 1.968 2.213 0.013 7 0 "[ . ]" 5
118 2 32 GLU O 2 36 GLN N 2.700 2.700 3.300 3.089 2.899 3.186 . 0 0 "[ . ]" 5
119 2 33 GLN O 2 37 LEU H 1.800 . 2.200 2.030 1.879 2.179 . 0 0 "[ . ]" 5
120 2 33 GLN O 2 37 LEU N 2.700 2.700 3.300 2.872 2.693 3.050 0.007 4 0 "[ . ]" 5
121 2 34 VAL O 2 38 LYS H 1.800 . 2.200 2.048 1.816 2.209 0.009 5 0 "[ . ]" 5
122 2 34 VAL O 2 38 LYS N 2.700 2.700 3.300 2.974 2.775 3.182 . 0 0 "[ . ]" 5
123 2 35 ALA O 2 39 GLN H 1.800 . 2.200 2.095 1.853 2.207 0.007 7 0 "[ . ]" 5
124 2 35 ALA O 2 39 GLN N 2.700 2.700 3.300 2.973 2.774 3.179 . 0 0 "[ . ]" 5
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