NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
483205 |
1wcr   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wcr
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 504
_Distance_constraint_stats_list.Viol_count 6
_Distance_constraint_stats_list.Viol_total 0.420
_Distance_constraint_stats_list.Viol_max 0.076
_Distance_constraint_stats_list.Viol_rms 0.0076
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0008
_Distance_constraint_stats_list.Viol_average_violations_only 0.0700
_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 5 GLU 0.000 0.000 . 0 "[ ]"
1 6 GLU 0.000 0.000 . 0 "[ ]"
1 7 VAL 0.000 0.000 . 0 "[ ]"
1 8 VAL 0.000 0.000 . 0 "[ ]"
1 9 MET 0.000 0.000 . 0 "[ ]"
1 10 GLY 0.000 0.000 . 0 "[ ]"
1 11 LEU 0.000 0.000 . 0 "[ ]"
1 12 ILE 0.000 0.000 . 0 "[ ]"
1 13 ILE 0.000 0.000 . 0 "[ ]"
1 14 ASN 0.000 0.000 . 0 "[ ]"
1 15 SER 0.000 0.000 . 0 "[ ]"
1 16 GLY 0.000 0.000 . 0 "[ ]"
1 17 GLN 0.000 0.000 . 0 "[ ]"
1 18 ALA 0.000 0.000 . 0 "[ ]"
1 19 ARG 0.000 0.000 . 0 "[ ]"
1 20 SER 0.000 0.000 . 0 "[ ]"
1 21 LEU 0.000 0.000 . 0 "[ ]"
1 22 ALA 0.000 0.000 . 0 "[ ]"
1 23 TYR 0.000 0.000 . 0 "[ ]"
1 24 ALA 0.000 0.000 . 0 "[ ]"
1 25 ALA 0.000 0.000 . 0 "[ ]"
1 26 LEU 0.000 0.000 . 0 "[ ]"
1 27 LYS 0.000 0.000 . 0 "[ ]"
1 28 GLN 0.000 0.000 . 0 "[ ]"
1 29 ALA 0.000 0.000 . 0 "[ ]"
1 30 LYS 0.000 0.000 . 0 "[ ]"
1 31 GLN 0.000 0.000 . 0 "[ ]"
1 32 GLY 0.000 0.000 . 0 "[ ]"
1 33 ASP 0.000 0.000 . 0 "[ ]"
1 34 PHE 0.000 0.000 . 0 "[ ]"
1 35 ALA 0.000 0.000 . 0 "[ ]"
1 36 ALA 0.000 0.000 . 0 "[ ]"
1 37 ALA 0.000 0.000 . 0 "[ ]"
1 38 LYS 0.000 0.000 . 0 "[ ]"
1 39 ALA 0.000 0.000 . 0 "[ ]"
1 40 MET 0.000 0.000 . 0 "[ ]"
1 41 MET 0.000 0.000 . 0 "[ ]"
1 42 ASP 0.000 0.000 . 0 "[ ]"
1 43 GLN 0.000 0.000 . 0 "[ ]"
1 44 SER 0.000 0.000 . 0 "[ ]"
1 45 ARG 0.000 0.000 . 0 "[ ]"
1 46 MET 0.000 0.000 . 0 "[ ]"
1 47 ALA 0.000 0.000 . 0 "[ ]"
1 48 LEU 0.000 0.000 . 0 "[ ]"
1 49 ASN 0.000 0.000 . 0 "[ ]"
1 50 GLU 0.000 0.000 . 0 "[ ]"
1 51 ALA 0.000 0.000 . 0 "[ ]"
1 52 HIS 0.000 0.000 . 0 "[ ]"
1 53 LEU 0.000 0.000 . 0 "[ ]"
1 54 VAL 0.000 0.000 . 0 "[ ]"
1 55 GLN 0.000 0.000 . 0 "[ ]"
1 56 THR 0.000 0.000 . 0 "[ ]"
1 57 LYS 0.000 0.000 . 0 "[ ]"
1 58 LEU 0.000 0.000 . 0 "[ ]"
1 59 ILE 0.000 0.000 . 0 "[ ]"
1 60 GLU 0.075 0.075 1 0 "[ ]"
1 61 GLY 0.140 0.075 1 0 "[ ]"
1 62 ASP 0.064 0.064 1 0 "[ ]"
1 63 ALA 0.000 0.000 . 0 "[ ]"
1 64 GLY 0.000 0.000 . 0 "[ ]"
1 65 GLU 0.000 0.000 . 0 "[ ]"
1 66 GLY 0.000 0.000 . 0 "[ ]"
1 67 LYS 0.000 0.000 . 0 "[ ]"
1 68 MET 0.000 0.000 . 0 "[ ]"
1 69 LYS 0.000 0.000 . 0 "[ ]"
1 70 VAL 0.000 0.000 . 0 "[ ]"
1 71 SER 0.000 0.000 . 0 "[ ]"
1 72 LEU 0.000 0.000 . 0 "[ ]"
1 73 VAL 0.000 0.000 . 0 "[ ]"
1 74 LEU 0.000 0.000 . 0 "[ ]"
1 75 VAL 0.000 0.000 . 0 "[ ]"
1 76 HIS 0.000 0.000 . 0 "[ ]"
1 77 ALA 0.000 0.000 . 0 "[ ]"
1 78 GLN 0.000 0.000 . 0 "[ ]"
1 79 LEU 0.000 0.000 . 0 "[ ]"
1 80 HIS 0.000 0.000 . 0 "[ ]"
1 81 LEU 0.000 0.000 . 0 "[ ]"
1 82 MET 0.000 0.000 . 0 "[ ]"
1 83 THR 0.000 0.000 . 0 "[ ]"
1 84 SER 0.000 0.000 . 0 "[ ]"
1 85 MET 0.000 0.000 . 0 "[ ]"
1 86 LEU 0.000 0.000 . 0 "[ ]"
1 87 ALA 0.000 0.000 . 0 "[ ]"
1 88 ARG 0.000 0.000 . 0 "[ ]"
1 89 GLU 0.000 0.000 . 0 "[ ]"
1 90 LEU 0.000 0.000 . 0 "[ ]"
1 91 ILE 0.000 0.000 . 0 "[ ]"
1 92 THR 0.000 0.000 . 0 "[ ]"
1 93 GLU 0.000 0.000 . 0 "[ ]"
1 94 LEU 0.000 0.000 . 0 "[ ]"
1 95 ILE 0.000 0.000 . 0 "[ ]"
1 96 GLU 0.000 0.000 . 0 "[ ]"
1 97 LEU 0.000 0.000 . 0 "[ ]"
1 98 HIS 0.000 0.000 . 0 "[ ]"
1 99 GLU 0.000 0.000 . 0 "[ ]"
1 100 LYS 0.000 0.000 . 0 "[ ]"
1 101 LEU 0.000 0.000 . 0 "[ ]"
2 5 GLU 0.000 0.000 . 0 "[ ]"
2 6 GLU 0.000 0.000 . 0 "[ ]"
2 7 VAL 0.000 0.000 . 0 "[ ]"
2 8 VAL 0.000 0.000 . 0 "[ ]"
2 9 MET 0.000 0.000 . 0 "[ ]"
2 10 GLY 0.000 0.000 . 0 "[ ]"
2 11 LEU 0.000 0.000 . 0 "[ ]"
2 12 ILE 0.000 0.000 . 0 "[ ]"
2 13 ILE 0.000 0.000 . 0 "[ ]"
2 14 ASN 0.000 0.000 . 0 "[ ]"
2 15 SER 0.000 0.000 . 0 "[ ]"
2 16 GLY 0.000 0.000 . 0 "[ ]"
2 17 GLN 0.000 0.000 . 0 "[ ]"
2 18 ALA 0.000 0.000 . 0 "[ ]"
2 19 ARG 0.000 0.000 . 0 "[ ]"
2 20 SER 0.000 0.000 . 0 "[ ]"
2 21 LEU 0.000 0.000 . 0 "[ ]"
2 22 ALA 0.000 0.000 . 0 "[ ]"
2 23 TYR 0.000 0.000 . 0 "[ ]"
2 24 ALA 0.000 0.000 . 0 "[ ]"
2 25 ALA 0.000 0.000 . 0 "[ ]"
2 26 LEU 0.000 0.000 . 0 "[ ]"
2 27 LYS 0.000 0.000 . 0 "[ ]"
2 28 GLN 0.000 0.000 . 0 "[ ]"
2 29 ALA 0.000 0.000 . 0 "[ ]"
2 30 LYS 0.000 0.000 . 0 "[ ]"
2 31 GLN 0.000 0.000 . 0 "[ ]"
2 32 GLY 0.000 0.000 . 0 "[ ]"
2 33 ASP 0.000 0.000 . 0 "[ ]"
2 34 PHE 0.000 0.000 . 0 "[ ]"
2 35 ALA 0.000 0.000 . 0 "[ ]"
2 36 ALA 0.000 0.000 . 0 "[ ]"
2 37 ALA 0.000 0.000 . 0 "[ ]"
2 38 LYS 0.000 0.000 . 0 "[ ]"
2 39 ALA 0.000 0.000 . 0 "[ ]"
2 40 MET 0.000 0.000 . 0 "[ ]"
2 41 MET 0.000 0.000 . 0 "[ ]"
2 42 ASP 0.000 0.000 . 0 "[ ]"
2 43 GLN 0.000 0.000 . 0 "[ ]"
2 44 SER 0.000 0.000 . 0 "[ ]"
2 45 ARG 0.000 0.000 . 0 "[ ]"
2 46 MET 0.000 0.000 . 0 "[ ]"
2 47 ALA 0.000 0.000 . 0 "[ ]"
2 48 LEU 0.000 0.000 . 0 "[ ]"
2 49 ASN 0.000 0.000 . 0 "[ ]"
2 50 GLU 0.000 0.000 . 0 "[ ]"
2 51 ALA 0.000 0.000 . 0 "[ ]"
2 52 HIS 0.000 0.000 . 0 "[ ]"
2 53 LEU 0.000 0.000 . 0 "[ ]"
2 54 VAL 0.000 0.000 . 0 "[ ]"
2 55 GLN 0.000 0.000 . 0 "[ ]"
2 56 THR 0.000 0.000 . 0 "[ ]"
2 57 LYS 0.000 0.000 . 0 "[ ]"
2 58 LEU 0.000 0.000 . 0 "[ ]"
2 59 ILE 0.000 0.000 . 0 "[ ]"
2 60 GLU 0.075 0.075 1 0 "[ ]"
2 61 GLY 0.139 0.075 1 0 "[ ]"
2 62 ASP 0.065 0.065 1 0 "[ ]"
2 63 ALA 0.000 0.000 . 0 "[ ]"
2 64 GLY 0.000 0.000 . 0 "[ ]"
2 65 GLU 0.000 0.000 . 0 "[ ]"
2 66 GLY 0.000 0.000 . 0 "[ ]"
2 67 LYS 0.000 0.000 . 0 "[ ]"
2 68 MET 0.000 0.000 . 0 "[ ]"
2 69 LYS 0.000 0.000 . 0 "[ ]"
2 70 VAL 0.000 0.000 . 0 "[ ]"
2 71 SER 0.000 0.000 . 0 "[ ]"
2 72 LEU 0.000 0.000 . 0 "[ ]"
2 73 VAL 0.000 0.000 . 0 "[ ]"
2 74 LEU 0.000 0.000 . 0 "[ ]"
2 75 VAL 0.000 0.000 . 0 "[ ]"
2 76 HIS 0.000 0.000 . 0 "[ ]"
2 77 ALA 0.000 0.000 . 0 "[ ]"
2 78 GLN 0.000 0.000 . 0 "[ ]"
2 79 LEU 0.000 0.000 . 0 "[ ]"
2 80 HIS 0.000 0.000 . 0 "[ ]"
2 81 LEU 0.000 0.000 . 0 "[ ]"
2 82 MET 0.000 0.000 . 0 "[ ]"
2 83 THR 0.000 0.000 . 0 "[ ]"
2 84 SER 0.000 0.000 . 0 "[ ]"
2 85 MET 0.000 0.000 . 0 "[ ]"
2 86 LEU 0.000 0.000 . 0 "[ ]"
2 87 ALA 0.000 0.000 . 0 "[ ]"
2 88 ARG 0.000 0.000 . 0 "[ ]"
2 89 GLU 0.000 0.000 . 0 "[ ]"
2 90 LEU 0.000 0.000 . 0 "[ ]"
2 91 ILE 0.000 0.000 . 0 "[ ]"
2 92 THR 0.000 0.000 . 0 "[ ]"
2 93 GLU 0.000 0.000 . 0 "[ ]"
2 94 LEU 0.000 0.000 . 0 "[ ]"
2 95 ILE 0.000 0.000 . 0 "[ ]"
2 96 GLU 0.000 0.000 . 0 "[ ]"
2 97 LEU 0.000 0.000 . 0 "[ ]"
2 98 HIS 0.000 0.000 . 0 "[ ]"
2 99 GLU 0.000 0.000 . 0 "[ ]"
2 100 LYS 0.000 0.000 . 0 "[ ]"
2 101 LEU 0.000 0.000 . 0 "[ ]"
3 5 GLU 0.000 0.000 . 0 "[ ]"
3 6 GLU 0.000 0.000 . 0 "[ ]"
3 7 VAL 0.000 0.000 . 0 "[ ]"
3 8 VAL 0.000 0.000 . 0 "[ ]"
3 9 MET 0.000 0.000 . 0 "[ ]"
3 10 GLY 0.000 0.000 . 0 "[ ]"
3 11 LEU 0.000 0.000 . 0 "[ ]"
3 12 ILE 0.000 0.000 . 0 "[ ]"
3 13 ILE 0.000 0.000 . 0 "[ ]"
3 14 ASN 0.000 0.000 . 0 "[ ]"
3 15 SER 0.000 0.000 . 0 "[ ]"
3 16 GLY 0.000 0.000 . 0 "[ ]"
3 17 GLN 0.000 0.000 . 0 "[ ]"
3 18 ALA 0.000 0.000 . 0 "[ ]"
3 19 ARG 0.000 0.000 . 0 "[ ]"
3 20 SER 0.000 0.000 . 0 "[ ]"
3 21 LEU 0.000 0.000 . 0 "[ ]"
3 22 ALA 0.000 0.000 . 0 "[ ]"
3 23 TYR 0.000 0.000 . 0 "[ ]"
3 24 ALA 0.000 0.000 . 0 "[ ]"
3 25 ALA 0.000 0.000 . 0 "[ ]"
3 26 LEU 0.000 0.000 . 0 "[ ]"
3 27 LYS 0.000 0.000 . 0 "[ ]"
3 28 GLN 0.000 0.000 . 0 "[ ]"
3 29 ALA 0.000 0.000 . 0 "[ ]"
3 30 LYS 0.000 0.000 . 0 "[ ]"
3 31 GLN 0.000 0.000 . 0 "[ ]"
3 32 GLY 0.000 0.000 . 0 "[ ]"
3 33 ASP 0.000 0.000 . 0 "[ ]"
3 34 PHE 0.000 0.000 . 0 "[ ]"
3 35 ALA 0.000 0.000 . 0 "[ ]"
3 36 ALA 0.000 0.000 . 0 "[ ]"
3 37 ALA 0.000 0.000 . 0 "[ ]"
3 38 LYS 0.000 0.000 . 0 "[ ]"
3 39 ALA 0.000 0.000 . 0 "[ ]"
3 40 MET 0.000 0.000 . 0 "[ ]"
3 41 MET 0.000 0.000 . 0 "[ ]"
3 42 ASP 0.000 0.000 . 0 "[ ]"
3 43 GLN 0.000 0.000 . 0 "[ ]"
3 44 SER 0.000 0.000 . 0 "[ ]"
3 45 ARG 0.000 0.000 . 0 "[ ]"
3 46 MET 0.000 0.000 . 0 "[ ]"
3 47 ALA 0.000 0.000 . 0 "[ ]"
3 48 LEU 0.000 0.000 . 0 "[ ]"
3 49 ASN 0.000 0.000 . 0 "[ ]"
3 50 GLU 0.000 0.000 . 0 "[ ]"
3 51 ALA 0.000 0.000 . 0 "[ ]"
3 52 HIS 0.000 0.000 . 0 "[ ]"
3 53 LEU 0.000 0.000 . 0 "[ ]"
3 54 VAL 0.000 0.000 . 0 "[ ]"
3 55 GLN 0.000 0.000 . 0 "[ ]"
3 56 THR 0.000 0.000 . 0 "[ ]"
3 57 LYS 0.000 0.000 . 0 "[ ]"
3 58 LEU 0.000 0.000 . 0 "[ ]"
3 59 ILE 0.000 0.000 . 0 "[ ]"
3 60 GLU 0.076 0.076 1 0 "[ ]"
3 61 GLY 0.141 0.076 1 0 "[ ]"
3 62 ASP 0.065 0.065 1 0 "[ ]"
3 63 ALA 0.000 0.000 . 0 "[ ]"
3 64 GLY 0.000 0.000 . 0 "[ ]"
3 65 GLU 0.000 0.000 . 0 "[ ]"
3 66 GLY 0.000 0.000 . 0 "[ ]"
3 67 LYS 0.000 0.000 . 0 "[ ]"
3 68 MET 0.000 0.000 . 0 "[ ]"
3 69 LYS 0.000 0.000 . 0 "[ ]"
3 70 VAL 0.000 0.000 . 0 "[ ]"
3 71 SER 0.000 0.000 . 0 "[ ]"
3 72 LEU 0.000 0.000 . 0 "[ ]"
3 73 VAL 0.000 0.000 . 0 "[ ]"
3 74 LEU 0.000 0.000 . 0 "[ ]"
3 75 VAL 0.000 0.000 . 0 "[ ]"
3 76 HIS 0.000 0.000 . 0 "[ ]"
3 77 ALA 0.000 0.000 . 0 "[ ]"
3 78 GLN 0.000 0.000 . 0 "[ ]"
3 79 LEU 0.000 0.000 . 0 "[ ]"
3 80 HIS 0.000 0.000 . 0 "[ ]"
3 81 LEU 0.000 0.000 . 0 "[ ]"
3 82 MET 0.000 0.000 . 0 "[ ]"
3 83 THR 0.000 0.000 . 0 "[ ]"
3 84 SER 0.000 0.000 . 0 "[ ]"
3 85 MET 0.000 0.000 . 0 "[ ]"
3 86 LEU 0.000 0.000 . 0 "[ ]"
3 87 ALA 0.000 0.000 . 0 "[ ]"
3 88 ARG 0.000 0.000 . 0 "[ ]"
3 89 GLU 0.000 0.000 . 0 "[ ]"
3 90 LEU 0.000 0.000 . 0 "[ ]"
3 91 ILE 0.000 0.000 . 0 "[ ]"
3 92 THR 0.000 0.000 . 0 "[ ]"
3 93 GLU 0.000 0.000 . 0 "[ ]"
3 94 LEU 0.000 0.000 . 0 "[ ]"
3 95 ILE 0.000 0.000 . 0 "[ ]"
3 96 GLU 0.000 0.000 . 0 "[ ]"
3 97 LEU 0.000 0.000 . 0 "[ ]"
3 98 HIS 0.000 0.000 . 0 "[ ]"
3 99 GLU 0.000 0.000 . 0 "[ ]"
3 100 LYS 0.000 0.000 . 0 "[ ]"
3 101 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 5 GLU H 1 6 GLU H 3.000 . 3.500 2.600 2.600 2.600 . 0 0 "[ ]" 1
2 1 5 GLU H 1 7 VAL H 4.000 . 5.000 3.804 3.804 3.804 . 0 0 "[ ]" 1
3 1 6 GLU H 1 8 VAL H 4.000 . 5.000 4.120 4.120 4.120 . 0 0 "[ ]" 1
4 1 6 GLU H 1 9 MET H 4.000 . 5.000 4.869 4.869 4.869 . 0 0 "[ ]" 1
5 1 7 VAL H 1 8 VAL H 3.000 . 3.500 2.622 2.622 2.622 . 0 0 "[ ]" 1
6 1 7 VAL H 1 9 MET H 4.000 . 5.000 4.146 4.146 4.146 . 0 0 "[ ]" 1
7 1 8 VAL H 1 9 MET H 3.000 . 3.500 2.689 2.689 2.689 . 0 0 "[ ]" 1
8 1 8 VAL H 1 10 GLY H 4.000 . 5.000 4.115 4.115 4.115 . 0 0 "[ ]" 1
9 1 9 MET H 1 10 GLY H 3.000 . 3.500 2.708 2.708 2.708 . 0 0 "[ ]" 1
10 1 9 MET H 1 11 LEU H 4.000 . 5.000 4.114 4.114 4.114 . 0 0 "[ ]" 1
11 1 10 GLY H 1 11 LEU H 3.000 . 3.500 2.652 2.652 2.652 . 0 0 "[ ]" 1
12 1 10 GLY H 1 12 ILE H 4.000 . 5.000 4.131 4.131 4.131 . 0 0 "[ ]" 1
13 1 10 GLY H 1 13 ILE H 4.000 . 6.000 4.689 4.689 4.689 . 0 0 "[ ]" 1
14 1 10 GLY H 1 14 ASN H 4.000 . 6.000 5.785 5.785 5.785 . 0 0 "[ ]" 1
15 1 11 LEU H 1 12 ILE H 3.000 . 3.500 2.685 2.685 2.685 . 0 0 "[ ]" 1
16 1 11 LEU H 1 13 ILE H 4.000 . 5.000 4.162 4.162 4.162 . 0 0 "[ ]" 1
17 1 12 ILE H 1 13 ILE H 3.000 . 3.500 2.664 2.664 2.664 . 0 0 "[ ]" 1
18 1 14 ASN H 1 15 SER H 3.000 . 3.500 2.728 2.728 2.728 . 0 0 "[ ]" 1
19 1 15 SER H 1 16 GLY H 3.000 . 3.500 2.723 2.723 2.723 . 0 0 "[ ]" 1
20 1 15 SER H 1 17 GLN H 4.000 . 5.000 4.175 4.175 4.175 . 0 0 "[ ]" 1
21 1 16 GLY H 1 19 ARG H 4.000 . 6.000 4.838 4.838 4.838 . 0 0 "[ ]" 1
22 1 17 GLN H 1 19 ARG H 4.000 . 5.000 4.314 4.314 4.314 . 0 0 "[ ]" 1
23 1 18 ALA H 1 19 ARG H 3.000 . 3.500 2.791 2.791 2.791 . 0 0 "[ ]" 1
24 1 19 ARG H 1 20 SER H 3.000 . 3.500 2.718 2.718 2.718 . 0 0 "[ ]" 1
25 1 19 ARG H 1 21 LEU H 4.000 . 5.000 4.281 4.281 4.281 . 0 0 "[ ]" 1
26 1 19 ARG H 1 22 ALA H 4.000 . 6.000 4.689 4.689 4.689 . 0 0 "[ ]" 1
27 1 20 SER H 1 22 ALA H 4.000 . 5.000 4.172 4.172 4.172 . 0 0 "[ ]" 1
28 1 20 SER H 1 23 TYR H 4.000 . 6.000 4.801 4.801 4.801 . 0 0 "[ ]" 1
29 1 21 LEU H 1 22 ALA H 3.000 . 3.500 2.667 2.667 2.667 . 0 0 "[ ]" 1
30 1 21 LEU H 1 23 TYR H 4.000 . 5.000 4.391 4.391 4.391 . 0 0 "[ ]" 1
31 1 21 LEU H 1 24 ALA H 4.000 . 5.000 4.719 4.719 4.719 . 0 0 "[ ]" 1
32 1 22 ALA H 1 23 TYR H 3.000 . 3.500 2.856 2.856 2.856 . 0 0 "[ ]" 1
33 1 22 ALA H 1 24 ALA H 4.000 . 5.000 4.081 4.081 4.081 . 0 0 "[ ]" 1
34 1 23 TYR H 1 24 ALA H 3.000 . 3.500 2.721 2.721 2.721 . 0 0 "[ ]" 1
35 1 23 TYR H 1 25 ALA H 4.000 . 5.000 4.103 4.103 4.103 . 0 0 "[ ]" 1
36 1 23 TYR H 1 26 LEU H 4.000 . 6.000 4.785 4.785 4.785 . 0 0 "[ ]" 1
37 1 24 ALA H 1 26 LEU H 4.000 . 5.000 4.154 4.154 4.154 . 0 0 "[ ]" 1
38 1 25 ALA H 1 26 LEU H 3.000 . 3.500 2.687 2.687 2.687 . 0 0 "[ ]" 1
39 1 25 ALA H 1 27 LYS H 4.000 . 6.000 4.143 4.143 4.143 . 0 0 "[ ]" 1
40 1 26 LEU H 1 27 LYS H 3.000 . 3.500 2.704 2.704 2.704 . 0 0 "[ ]" 1
41 1 26 LEU H 1 28 GLN H 4.000 . 6.000 4.162 4.162 4.162 . 0 0 "[ ]" 1
42 1 27 LYS H 1 29 ALA H 4.000 . 6.000 4.199 4.199 4.199 . 0 0 "[ ]" 1
43 1 28 GLN H 1 29 ALA H 3.000 . 3.500 2.670 2.670 2.670 . 0 0 "[ ]" 1
44 1 29 ALA H 1 31 GLN H 4.000 . 6.000 4.034 4.034 4.034 . 0 0 "[ ]" 1
45 1 29 ALA HA 1 32 GLY H 4.000 . 6.000 3.411 3.411 3.411 . 0 0 "[ ]" 1
46 1 29 ALA H 1 33 ASP H 4.000 . 6.000 4.699 4.699 4.699 . 0 0 "[ ]" 1
47 1 29 ALA HA 1 34 PHE H 4.000 . 5.000 4.559 4.559 4.559 . 0 0 "[ ]" 1
48 1 30 LYS H 1 31 GLN H 3.000 . 3.500 2.678 2.678 2.678 . 0 0 "[ ]" 1
49 1 30 LYS HA 1 31 GLN H 4.000 . 6.000 3.522 3.522 3.522 . 0 0 "[ ]" 1
50 1 30 LYS HA 1 32 GLY H 4.000 . 6.000 3.562 3.562 3.562 . 0 0 "[ ]" 1
51 1 30 LYS HA 1 33 ASP H 4.000 . 6.000 5.692 5.692 5.692 . 0 0 "[ ]" 1
52 1 31 GLN H 1 32 GLY H 2.500 . 2.900 2.464 2.464 2.464 . 0 0 "[ ]" 1
53 1 31 GLN H 1 33 ASP H 4.000 . 5.000 3.486 3.486 3.486 . 0 0 "[ ]" 1
54 1 32 GLY QA 1 33 ASP H 3.000 . 3.500 2.897 2.897 2.897 . 0 0 "[ ]" 1
55 1 32 GLY H 1 33 ASP H 2.500 . 2.900 2.416 2.416 2.416 . 0 0 "[ ]" 1
56 1 33 ASP HA 1 34 PHE H 2.500 . 2.900 2.375 2.375 2.375 . 0 0 "[ ]" 1
57 1 33 ASP HA 1 35 ALA H 4.000 . 5.000 3.480 3.480 3.480 . 0 0 "[ ]" 1
58 1 34 PHE H 1 35 ALA H 3.000 . 3.500 2.644 2.644 2.644 . 0 0 "[ ]" 1
59 1 34 PHE H 1 36 ALA H 4.000 . 6.000 4.505 4.505 4.505 . 0 0 "[ ]" 1
60 1 35 ALA H 1 36 ALA H 3.000 . 3.500 2.740 2.740 2.740 . 0 0 "[ ]" 1
61 1 35 ALA H 1 38 LYS H 4.000 . 5.000 4.759 4.759 4.759 . 0 0 "[ ]" 1
62 1 36 ALA H 1 37 ALA H 3.000 . 3.500 2.611 2.611 2.611 . 0 0 "[ ]" 1
63 1 37 ALA H 1 38 LYS H 3.000 . 3.500 2.734 2.734 2.734 . 0 0 "[ ]" 1
64 1 38 LYS H 1 39 ALA H 3.000 . 3.500 2.807 2.807 2.807 . 0 0 "[ ]" 1
65 1 38 LYS H 1 40 MET H 4.000 . 5.000 4.255 4.255 4.255 . 0 0 "[ ]" 1
66 1 39 ALA H 1 40 MET H 3.000 . 3.500 2.690 2.690 2.690 . 0 0 "[ ]" 1
67 1 39 ALA H 1 41 MET H 4.000 . 5.000 4.151 4.151 4.151 . 0 0 "[ ]" 1
68 1 40 MET H 1 41 MET H 3.000 . 3.500 2.688 2.688 2.688 . 0 0 "[ ]" 1
69 1 41 MET H 1 42 ASP H 3.000 . 3.500 2.683 2.683 2.683 . 0 0 "[ ]" 1
70 1 41 MET H 1 43 GLN H 4.000 . 5.000 4.273 4.273 4.273 . 0 0 "[ ]" 1
71 1 42 ASP H 1 43 GLN H 3.000 . 3.500 2.714 2.714 2.714 . 0 0 "[ ]" 1
72 1 43 GLN H 1 44 SER H 3.000 . 3.500 2.645 2.645 2.645 . 0 0 "[ ]" 1
73 1 43 GLN H 1 45 ARG H 4.000 . 5.000 4.275 4.275 4.275 . 0 0 "[ ]" 1
74 1 44 SER H 1 46 MET H 4.000 . 5.000 4.220 4.220 4.220 . 0 0 "[ ]" 1
75 1 45 ARG H 1 46 MET H 3.000 . 3.500 2.757 2.757 2.757 . 0 0 "[ ]" 1
76 1 45 ARG H 1 47 ALA H 4.000 . 5.000 4.222 4.222 4.222 . 0 0 "[ ]" 1
77 1 46 MET H 1 47 ALA H 3.000 . 3.500 2.659 2.659 2.659 . 0 0 "[ ]" 1
78 1 47 ALA H 1 48 LEU H 3.000 . 3.500 2.665 2.665 2.665 . 0 0 "[ ]" 1
79 1 47 ALA H 1 49 ASN H 4.000 . 5.000 4.067 4.067 4.067 . 0 0 "[ ]" 1
80 1 48 LEU H 1 49 ASN H 3.000 . 3.500 2.601 2.601 2.601 . 0 0 "[ ]" 1
81 1 50 GLU H 1 51 ALA H 3.000 . 3.500 2.589 2.589 2.589 . 0 0 "[ ]" 1
82 1 50 GLU H 1 52 HIS H 4.000 . 5.000 4.156 4.156 4.156 . 0 0 "[ ]" 1
83 1 51 ALA H 1 52 HIS H 3.000 . 3.500 2.666 2.666 2.666 . 0 0 "[ ]" 1
84 1 51 ALA H 1 53 LEU H 4.000 . 5.000 4.030 4.030 4.030 . 0 0 "[ ]" 1
85 1 52 HIS H 1 53 LEU H 3.000 . 3.500 2.700 2.700 2.700 . 0 0 "[ ]" 1
86 1 52 HIS H 1 54 VAL H 4.000 . 5.000 4.270 4.270 4.270 . 0 0 "[ ]" 1
87 1 52 HIS H 1 55 GLN H 4.000 . 6.000 4.796 4.796 4.796 . 0 0 "[ ]" 1
88 1 53 LEU H 1 54 VAL H 3.000 . 3.500 2.702 2.702 2.702 . 0 0 "[ ]" 1
89 1 54 VAL H 1 55 GLN H 3.000 . 3.500 2.669 2.669 2.669 . 0 0 "[ ]" 1
90 1 56 THR H 1 57 LYS H 3.000 . 3.500 2.820 2.820 2.820 . 0 0 "[ ]" 1
91 1 56 THR H 1 58 LEU H 4.000 . 5.000 4.061 4.061 4.061 . 0 0 "[ ]" 1
92 1 57 LYS H 1 58 LEU H 3.000 . 3.500 2.602 2.602 2.602 . 0 0 "[ ]" 1
93 1 57 LYS H 1 59 ILE H 4.000 . 5.000 4.484 4.484 4.484 . 0 0 "[ ]" 1
94 1 58 LEU H 1 59 ILE H 3.000 . 3.500 2.852 2.852 2.852 . 0 0 "[ ]" 1
95 1 59 ILE H 1 60 GLU H 3.000 . 3.500 2.938 2.938 2.938 . 0 0 "[ ]" 1
96 1 60 GLU HA 1 61 GLY H 3.000 . 3.500 3.575 3.575 3.575 0.075 1 0 "[ ]" 1
97 1 61 GLY QA 1 62 ASP H 2.500 . 2.900 2.964 2.964 2.964 0.064 1 0 "[ ]" 1
98 1 62 ASP HA 1 63 ALA H 3.000 . 3.500 3.474 3.474 3.474 . 0 0 "[ ]" 1
99 1 63 ALA HA 1 64 GLY H 3.000 . 3.500 2.150 2.150 2.150 . 0 0 "[ ]" 1
100 1 64 GLY QA 1 65 GLU H 2.500 . 2.900 2.591 2.591 2.591 . 0 0 "[ ]" 1
101 1 65 GLU HA 1 66 GLY H 3.000 . 3.500 2.161 2.161 2.161 . 0 0 "[ ]" 1
102 1 66 GLY QA 1 67 LYS H 3.000 . 3.500 2.075 2.075 2.075 . 0 0 "[ ]" 1
103 1 67 LYS HA 1 68 MET H 3.000 . 3.500 2.176 2.176 2.176 . 0 0 "[ ]" 1
104 1 68 MET HA 1 69 LYS H 3.000 . 3.500 3.448 3.448 3.448 . 0 0 "[ ]" 1
105 1 69 LYS HA 1 70 VAL H 3.000 . 3.500 3.252 3.252 3.252 . 0 0 "[ ]" 1
106 1 70 VAL HA 1 71 SER H 3.000 . 3.500 2.674 2.674 2.674 . 0 0 "[ ]" 1
107 1 72 LEU H 1 73 VAL H 3.000 . 3.500 2.806 2.806 2.806 . 0 0 "[ ]" 1
108 1 72 LEU H 1 74 LEU H 4.000 . 6.000 4.368 4.368 4.368 . 0 0 "[ ]" 1
109 1 73 VAL H 1 74 LEU H 3.000 . 3.500 2.853 2.853 2.853 . 0 0 "[ ]" 1
110 1 73 VAL H 1 75 VAL H 4.000 . 5.000 4.266 4.266 4.266 . 0 0 "[ ]" 1
111 1 74 LEU H 1 75 VAL H 3.000 . 3.500 2.665 2.665 2.665 . 0 0 "[ ]" 1
112 1 74 LEU H 1 76 HIS H 4.000 . 5.000 4.305 4.305 4.305 . 0 0 "[ ]" 1
113 1 74 LEU H 1 77 ALA H 4.000 . 6.000 4.866 4.866 4.866 . 0 0 "[ ]" 1
114 1 75 VAL H 1 78 GLN H 4.000 . 6.000 4.607 4.607 4.607 . 0 0 "[ ]" 1
115 1 76 HIS H 1 77 ALA H 3.000 . 3.500 2.814 2.814 2.814 . 0 0 "[ ]" 1
116 1 76 HIS H 1 78 GLN H 4.000 . 5.000 4.162 4.162 4.162 . 0 0 "[ ]" 1
117 1 77 ALA H 1 78 GLN H 3.000 . 3.500 2.643 2.643 2.643 . 0 0 "[ ]" 1
118 1 77 ALA H 1 79 LEU H 4.000 . 5.000 4.109 4.109 4.109 . 0 0 "[ ]" 1
119 1 77 ALA H 1 80 HIS H 4.000 . 6.000 5.005 5.005 5.005 . 0 0 "[ ]" 1
120 1 78 GLN H 1 79 LEU H 3.000 . 3.500 2.644 2.644 2.644 . 0 0 "[ ]" 1
121 1 78 GLN H 1 80 HIS H 4.000 . 5.000 4.361 4.361 4.361 . 0 0 "[ ]" 1
122 1 79 LEU H 1 80 HIS H 3.000 . 3.500 2.861 2.861 2.861 . 0 0 "[ ]" 1
123 1 79 LEU H 1 82 MET H 4.000 . 6.000 4.628 4.628 4.628 . 0 0 "[ ]" 1
124 1 80 HIS H 1 81 LEU H 3.000 . 3.500 2.689 2.689 2.689 . 0 0 "[ ]" 1
125 1 80 HIS H 1 82 MET H 4.000 . 5.000 4.241 4.241 4.241 . 0 0 "[ ]" 1
126 1 81 LEU H 1 82 MET H 3.000 . 3.500 2.774 2.774 2.774 . 0 0 "[ ]" 1
127 1 81 LEU H 1 83 THR H 4.000 . 5.000 4.228 4.228 4.228 . 0 0 "[ ]" 1
128 1 81 LEU H 1 84 SER H 4.000 . 6.000 4.683 4.683 4.683 . 0 0 "[ ]" 1
129 1 82 MET H 1 83 THR H 3.000 . 3.500 2.707 2.707 2.707 . 0 0 "[ ]" 1
130 1 82 MET H 1 84 SER H 4.000 . 5.000 4.211 4.211 4.211 . 0 0 "[ ]" 1
131 1 82 MET H 1 85 MET H 4.000 . 6.000 4.740 4.740 4.740 . 0 0 "[ ]" 1
132 1 83 THR H 1 84 SER H 3.000 . 3.500 2.699 2.699 2.699 . 0 0 "[ ]" 1
133 1 83 THR H 1 85 MET H 4.000 . 5.000 4.306 4.306 4.306 . 0 0 "[ ]" 1
134 1 84 SER H 1 85 MET H 3.000 . 3.500 2.815 2.815 2.815 . 0 0 "[ ]" 1
135 1 84 SER H 1 86 LEU H 4.000 . 5.000 4.277 4.277 4.277 . 0 0 "[ ]" 1
136 1 85 MET H 1 86 LEU H 3.000 . 3.500 2.783 2.783 2.783 . 0 0 "[ ]" 1
137 1 85 MET H 1 87 ALA H 4.000 . 5.000 4.230 4.230 4.230 . 0 0 "[ ]" 1
138 1 86 LEU H 1 87 ALA H 3.000 . 3.500 2.672 2.672 2.672 . 0 0 "[ ]" 1
139 1 86 LEU H 1 88 ARG H 4.000 . 5.000 4.189 4.189 4.189 . 0 0 "[ ]" 1
140 1 86 LEU H 1 89 GLU H 4.000 . 6.000 4.686 4.686 4.686 . 0 0 "[ ]" 1
141 1 87 ALA H 1 89 GLU H 4.000 . 5.000 4.231 4.231 4.231 . 0 0 "[ ]" 1
142 1 88 ARG H 1 89 GLU H 3.000 . 3.500 2.817 2.817 2.817 . 0 0 "[ ]" 1
143 1 88 ARG H 1 91 ILE H 4.000 . 5.000 4.638 4.638 4.638 . 0 0 "[ ]" 1
144 1 89 GLU H 1 91 ILE H 4.000 . 5.000 4.142 4.142 4.142 . 0 0 "[ ]" 1
145 1 90 LEU H 1 91 ILE H 3.000 . 3.500 2.627 2.627 2.627 . 0 0 "[ ]" 1
146 1 90 LEU H 1 92 THR H 4.000 . 5.000 4.037 4.037 4.037 . 0 0 "[ ]" 1
147 1 90 LEU H 1 93 GLU H 4.000 . 6.000 4.803 4.803 4.803 . 0 0 "[ ]" 1
148 1 91 ILE H 1 92 THR H 3.000 . 3.500 2.691 2.691 2.691 . 0 0 "[ ]" 1
149 1 91 ILE H 1 93 GLU H 4.000 . 5.000 4.199 4.199 4.199 . 0 0 "[ ]" 1
150 1 91 ILE H 1 94 LEU H 4.000 . 6.000 4.652 4.652 4.652 . 0 0 "[ ]" 1
151 1 92 THR H 1 93 GLU H 3.000 . 3.500 2.715 2.715 2.715 . 0 0 "[ ]" 1
152 1 93 GLU H 1 94 LEU H 3.000 . 3.500 2.673 2.673 2.673 . 0 0 "[ ]" 1
153 1 93 GLU H 1 95 ILE H 4.000 . 5.000 4.182 4.182 4.182 . 0 0 "[ ]" 1
154 1 93 GLU H 1 96 GLU H 4.000 . 6.000 4.802 4.802 4.802 . 0 0 "[ ]" 1
155 1 94 LEU H 1 95 ILE H 3.000 . 3.500 2.747 2.747 2.747 . 0 0 "[ ]" 1
156 1 94 LEU H 1 96 GLU H 4.000 . 5.000 4.229 4.229 4.229 . 0 0 "[ ]" 1
157 1 95 ILE H 1 96 GLU H 3.000 . 3.500 2.740 2.740 2.740 . 0 0 "[ ]" 1
158 1 95 ILE H 1 97 LEU H 4.000 . 5.000 4.140 4.140 4.140 . 0 0 "[ ]" 1
159 1 95 ILE H 1 98 HIS H 4.000 . 6.000 4.855 4.855 4.855 . 0 0 "[ ]" 1
160 1 96 GLU H 1 99 GLU H 4.000 . 6.000 4.885 4.885 4.885 . 0 0 "[ ]" 1
161 1 97 LEU H 1 98 HIS H 3.000 . 3.500 2.703 2.703 2.703 . 0 0 "[ ]" 1
162 1 97 LEU H 1 99 GLU H 4.000 . 5.000 4.112 4.112 4.112 . 0 0 "[ ]" 1
163 1 97 LEU H 1 100 LYS H 4.000 . 5.000 4.782 4.782 4.782 . 0 0 "[ ]" 1
164 1 98 HIS H 1 99 GLU H 3.000 . 3.500 2.675 2.675 2.675 . 0 0 "[ ]" 1
165 1 98 HIS H 1 101 LEU H 4.000 . 6.000 4.753 4.753 4.753 . 0 0 "[ ]" 1
166 1 99 GLU H 1 100 LYS H 3.000 . 3.500 2.674 2.674 2.674 . 0 0 "[ ]" 1
167 1 99 GLU H 1 101 LEU H 4.000 . 5.000 4.048 4.048 4.048 . 0 0 "[ ]" 1
168 1 100 LYS H 1 101 LEU H 3.000 . 3.500 2.627 2.627 2.627 . 0 0 "[ ]" 1
169 2 5 GLU H 2 6 GLU H 3.000 . 3.500 2.600 2.600 2.600 . 0 0 "[ ]" 1
170 2 5 GLU H 2 7 VAL H 4.000 . 5.000 3.803 3.803 3.803 . 0 0 "[ ]" 1
171 2 6 GLU H 2 8 VAL H 4.000 . 5.000 4.119 4.119 4.119 . 0 0 "[ ]" 1
172 2 6 GLU H 2 9 MET H 4.000 . 5.000 4.867 4.867 4.867 . 0 0 "[ ]" 1
173 2 7 VAL H 2 8 VAL H 3.000 . 3.500 2.622 2.622 2.622 . 0 0 "[ ]" 1
174 2 7 VAL H 2 9 MET H 4.000 . 5.000 4.145 4.145 4.145 . 0 0 "[ ]" 1
175 2 8 VAL H 2 9 MET H 3.000 . 3.500 2.688 2.688 2.688 . 0 0 "[ ]" 1
176 2 8 VAL H 2 10 GLY H 4.000 . 5.000 4.116 4.116 4.116 . 0 0 "[ ]" 1
177 2 9 MET H 2 10 GLY H 3.000 . 3.500 2.709 2.709 2.709 . 0 0 "[ ]" 1
178 2 9 MET H 2 11 LEU H 4.000 . 5.000 4.115 4.115 4.115 . 0 0 "[ ]" 1
179 2 10 GLY H 2 11 LEU H 3.000 . 3.500 2.653 2.653 2.653 . 0 0 "[ ]" 1
180 2 10 GLY H 2 12 ILE H 4.000 . 5.000 4.131 4.131 4.131 . 0 0 "[ ]" 1
181 2 10 GLY H 2 13 ILE H 4.000 . 6.000 4.688 4.688 4.688 . 0 0 "[ ]" 1
182 2 10 GLY H 2 14 ASN H 4.000 . 6.000 5.784 5.784 5.784 . 0 0 "[ ]" 1
183 2 11 LEU H 2 12 ILE H 3.000 . 3.500 2.684 2.684 2.684 . 0 0 "[ ]" 1
184 2 11 LEU H 2 13 ILE H 4.000 . 5.000 4.161 4.161 4.161 . 0 0 "[ ]" 1
185 2 12 ILE H 2 13 ILE H 3.000 . 3.500 2.663 2.663 2.663 . 0 0 "[ ]" 1
186 2 14 ASN H 2 15 SER H 3.000 . 3.500 2.729 2.729 2.729 . 0 0 "[ ]" 1
187 2 15 SER H 2 16 GLY H 3.000 . 3.500 2.723 2.723 2.723 . 0 0 "[ ]" 1
188 2 15 SER H 2 17 GLN H 4.000 . 5.000 4.177 4.177 4.177 . 0 0 "[ ]" 1
189 2 16 GLY H 2 19 ARG H 4.000 . 6.000 4.851 4.851 4.851 . 0 0 "[ ]" 1
190 2 17 GLN H 2 19 ARG H 4.000 . 5.000 4.325 4.325 4.325 . 0 0 "[ ]" 1
191 2 18 ALA H 2 19 ARG H 3.000 . 3.500 2.791 2.791 2.791 . 0 0 "[ ]" 1
192 2 19 ARG H 2 20 SER H 3.000 . 3.500 2.713 2.713 2.713 . 0 0 "[ ]" 1
193 2 19 ARG H 2 21 LEU H 4.000 . 5.000 4.285 4.285 4.285 . 0 0 "[ ]" 1
194 2 19 ARG H 2 22 ALA H 4.000 . 6.000 4.690 4.690 4.690 . 0 0 "[ ]" 1
195 2 20 SER H 2 22 ALA H 4.000 . 5.000 4.170 4.170 4.170 . 0 0 "[ ]" 1
196 2 20 SER H 2 23 TYR H 4.000 . 6.000 4.796 4.796 4.796 . 0 0 "[ ]" 1
197 2 21 LEU H 2 22 ALA H 3.000 . 3.500 2.666 2.666 2.666 . 0 0 "[ ]" 1
198 2 21 LEU H 2 23 TYR H 4.000 . 5.000 4.390 4.390 4.390 . 0 0 "[ ]" 1
199 2 21 LEU H 2 24 ALA H 4.000 . 5.000 4.719 4.719 4.719 . 0 0 "[ ]" 1
200 2 22 ALA H 2 23 TYR H 3.000 . 3.500 2.855 2.855 2.855 . 0 0 "[ ]" 1
201 2 22 ALA H 2 24 ALA H 4.000 . 5.000 4.081 4.081 4.081 . 0 0 "[ ]" 1
202 2 23 TYR H 2 24 ALA H 3.000 . 3.500 2.721 2.721 2.721 . 0 0 "[ ]" 1
203 2 23 TYR H 2 25 ALA H 4.000 . 5.000 4.102 4.102 4.102 . 0 0 "[ ]" 1
204 2 23 TYR H 2 26 LEU H 4.000 . 6.000 4.783 4.783 4.783 . 0 0 "[ ]" 1
205 2 24 ALA H 2 26 LEU H 4.000 . 5.000 4.154 4.154 4.154 . 0 0 "[ ]" 1
206 2 25 ALA H 2 26 LEU H 3.000 . 3.500 2.687 2.687 2.687 . 0 0 "[ ]" 1
207 2 25 ALA H 2 27 LYS H 4.000 . 6.000 4.143 4.143 4.143 . 0 0 "[ ]" 1
208 2 26 LEU H 2 27 LYS H 3.000 . 3.500 2.704 2.704 2.704 . 0 0 "[ ]" 1
209 2 26 LEU H 2 28 GLN H 4.000 . 6.000 4.163 4.163 4.163 . 0 0 "[ ]" 1
210 2 27 LYS H 2 29 ALA H 4.000 . 6.000 4.198 4.198 4.198 . 0 0 "[ ]" 1
211 2 28 GLN H 2 29 ALA H 3.000 . 3.500 2.671 2.671 2.671 . 0 0 "[ ]" 1
212 2 29 ALA H 2 31 GLN H 4.000 . 6.000 4.034 4.034 4.034 . 0 0 "[ ]" 1
213 2 29 ALA HA 2 32 GLY H 4.000 . 6.000 3.411 3.411 3.411 . 0 0 "[ ]" 1
214 2 29 ALA H 2 33 ASP H 4.000 . 6.000 4.701 4.701 4.701 . 0 0 "[ ]" 1
215 2 29 ALA HA 2 34 PHE H 4.000 . 5.000 4.561 4.561 4.561 . 0 0 "[ ]" 1
216 2 30 LYS H 2 31 GLN H 3.000 . 3.500 2.679 2.679 2.679 . 0 0 "[ ]" 1
217 2 30 LYS HA 2 31 GLN H 4.000 . 6.000 3.522 3.522 3.522 . 0 0 "[ ]" 1
218 2 30 LYS H 2 32 GLY H 4.000 . 6.000 3.899 3.899 3.899 . 0 0 "[ ]" 1
219 2 30 LYS HA 2 33 ASP H 4.000 . 6.000 5.692 5.692 5.692 . 0 0 "[ ]" 1
220 2 31 GLN H 2 32 GLY H 2.500 . 2.900 2.466 2.466 2.466 . 0 0 "[ ]" 1
221 2 31 GLN H 2 33 ASP H 4.000 . 5.000 3.485 3.485 3.485 . 0 0 "[ ]" 1
222 2 32 GLY QA 2 33 ASP H 3.000 . 3.500 2.897 2.897 2.897 . 0 0 "[ ]" 1
223 2 32 GLY H 2 33 ASP H 2.500 . 2.900 2.415 2.415 2.415 . 0 0 "[ ]" 1
224 2 33 ASP HA 2 34 PHE H 2.500 . 2.900 2.373 2.373 2.373 . 0 0 "[ ]" 1
225 2 33 ASP HA 2 35 ALA H 4.000 . 5.000 3.480 3.480 3.480 . 0 0 "[ ]" 1
226 2 34 PHE H 2 35 ALA H 3.000 . 3.500 2.644 2.644 2.644 . 0 0 "[ ]" 1
227 2 34 PHE H 2 36 ALA H 4.000 . 6.000 4.509 4.509 4.509 . 0 0 "[ ]" 1
228 2 35 ALA H 2 36 ALA H 3.000 . 3.500 2.742 2.742 2.742 . 0 0 "[ ]" 1
229 2 35 ALA H 2 38 LYS H 4.000 . 5.000 4.759 4.759 4.759 . 0 0 "[ ]" 1
230 2 36 ALA H 2 37 ALA H 3.000 . 3.500 2.613 2.613 2.613 . 0 0 "[ ]" 1
231 2 37 ALA H 2 38 LYS H 3.000 . 3.500 2.734 2.734 2.734 . 0 0 "[ ]" 1
232 2 38 LYS H 2 39 ALA H 3.000 . 3.500 2.808 2.808 2.808 . 0 0 "[ ]" 1
233 2 38 LYS H 2 40 MET H 4.000 . 5.000 4.258 4.258 4.258 . 0 0 "[ ]" 1
234 2 39 ALA H 2 40 MET H 3.000 . 3.500 2.692 2.692 2.692 . 0 0 "[ ]" 1
235 2 39 ALA H 2 41 MET H 4.000 . 5.000 4.152 4.152 4.152 . 0 0 "[ ]" 1
236 2 40 MET H 2 41 MET H 3.000 . 3.500 2.688 2.688 2.688 . 0 0 "[ ]" 1
237 2 41 MET H 2 42 ASP H 3.000 . 3.500 2.683 2.683 2.683 . 0 0 "[ ]" 1
238 2 41 MET H 2 43 GLN H 4.000 . 5.000 4.271 4.271 4.271 . 0 0 "[ ]" 1
239 2 42 ASP H 2 43 GLN H 3.000 . 3.500 2.714 2.714 2.714 . 0 0 "[ ]" 1
240 2 43 GLN H 2 44 SER H 3.000 . 3.500 2.645 2.645 2.645 . 0 0 "[ ]" 1
241 2 43 GLN H 2 45 ARG H 4.000 . 5.000 4.274 4.274 4.274 . 0 0 "[ ]" 1
242 2 44 SER H 2 46 MET H 4.000 . 5.000 4.219 4.219 4.219 . 0 0 "[ ]" 1
243 2 45 ARG H 2 46 MET H 3.000 . 3.500 2.757 2.757 2.757 . 0 0 "[ ]" 1
244 2 45 ARG H 2 47 ALA H 4.000 . 5.000 4.223 4.223 4.223 . 0 0 "[ ]" 1
245 2 46 MET H 2 47 ALA H 3.000 . 3.500 2.661 2.661 2.661 . 0 0 "[ ]" 1
246 2 47 ALA H 2 48 LEU H 3.000 . 3.500 2.665 2.665 2.665 . 0 0 "[ ]" 1
247 2 47 ALA H 2 49 ASN H 4.000 . 5.000 4.070 4.070 4.070 . 0 0 "[ ]" 1
248 2 48 LEU H 2 49 ASN H 3.000 . 3.500 2.604 2.604 2.604 . 0 0 "[ ]" 1
249 2 50 GLU H 2 51 ALA H 3.000 . 3.500 2.589 2.589 2.589 . 0 0 "[ ]" 1
250 2 50 GLU H 2 52 HIS H 4.000 . 5.000 4.153 4.153 4.153 . 0 0 "[ ]" 1
251 2 51 ALA H 2 52 HIS H 3.000 . 3.500 2.661 2.661 2.661 . 0 0 "[ ]" 1
252 2 51 ALA H 2 53 LEU H 4.000 . 5.000 4.031 4.031 4.031 . 0 0 "[ ]" 1
253 2 52 HIS H 2 53 LEU H 3.000 . 3.500 2.701 2.701 2.701 . 0 0 "[ ]" 1
254 2 52 HIS H 2 54 VAL H 4.000 . 5.000 4.273 4.273 4.273 . 0 0 "[ ]" 1
255 2 52 HIS H 2 55 GLN H 4.000 . 6.000 4.799 4.799 4.799 . 0 0 "[ ]" 1
256 2 53 LEU H 2 54 VAL H 3.000 . 3.500 2.703 2.703 2.703 . 0 0 "[ ]" 1
257 2 54 VAL H 2 55 GLN H 3.000 . 3.500 2.670 2.670 2.670 . 0 0 "[ ]" 1
258 2 56 THR H 2 57 LYS H 3.000 . 3.500 2.820 2.820 2.820 . 0 0 "[ ]" 1
259 2 56 THR H 2 58 LEU H 4.000 . 5.000 4.064 4.064 4.064 . 0 0 "[ ]" 1
260 2 57 LYS H 2 58 LEU H 3.000 . 3.500 2.601 2.601 2.601 . 0 0 "[ ]" 1
261 2 57 LYS H 2 59 ILE H 4.000 . 5.000 4.477 4.477 4.477 . 0 0 "[ ]" 1
262 2 58 LEU H 2 59 ILE H 3.000 . 3.500 2.849 2.849 2.849 . 0 0 "[ ]" 1
263 2 59 ILE H 2 60 GLU H 3.000 . 3.500 2.937 2.937 2.937 . 0 0 "[ ]" 1
264 2 60 GLU HA 2 61 GLY H 3.000 . 3.500 3.575 3.575 3.575 0.075 1 0 "[ ]" 1
265 2 61 GLY QA 2 62 ASP H 2.500 . 2.900 2.965 2.965 2.965 0.065 1 0 "[ ]" 1
266 2 62 ASP HA 2 63 ALA H 3.000 . 3.500 3.473 3.473 3.473 . 0 0 "[ ]" 1
267 2 63 ALA HA 2 64 GLY H 3.000 . 3.500 2.167 2.167 2.167 . 0 0 "[ ]" 1
268 2 64 GLY QA 2 65 GLU H 2.500 . 2.900 2.569 2.569 2.569 . 0 0 "[ ]" 1
269 2 65 GLU HA 2 66 GLY H 3.000 . 3.500 2.170 2.170 2.170 . 0 0 "[ ]" 1
270 2 66 GLY QA 2 67 LYS H 3.000 . 3.500 2.086 2.086 2.086 . 0 0 "[ ]" 1
271 2 67 LYS HA 2 68 MET H 3.000 . 3.500 2.177 2.177 2.177 . 0 0 "[ ]" 1
272 2 68 MET HA 2 69 LYS H 3.000 . 3.500 3.460 3.460 3.460 . 0 0 "[ ]" 1
273 2 69 LYS HA 2 70 VAL H 3.000 . 3.500 3.252 3.252 3.252 . 0 0 "[ ]" 1
274 2 70 VAL HA 2 71 SER H 3.000 . 3.500 2.679 2.679 2.679 . 0 0 "[ ]" 1
275 2 72 LEU H 2 73 VAL H 3.000 . 3.500 2.810 2.810 2.810 . 0 0 "[ ]" 1
276 2 72 LEU H 2 74 LEU H 4.000 . 6.000 4.371 4.371 4.371 . 0 0 "[ ]" 1
277 2 73 VAL H 2 74 LEU H 3.000 . 3.500 2.856 2.856 2.856 . 0 0 "[ ]" 1
278 2 73 VAL H 2 75 VAL H 4.000 . 5.000 4.272 4.272 4.272 . 0 0 "[ ]" 1
279 2 74 LEU H 2 75 VAL H 3.000 . 3.500 2.666 2.666 2.666 . 0 0 "[ ]" 1
280 2 74 LEU H 2 76 HIS H 4.000 . 5.000 4.310 4.310 4.310 . 0 0 "[ ]" 1
281 2 74 LEU H 2 77 ALA H 4.000 . 6.000 4.870 4.870 4.870 . 0 0 "[ ]" 1
282 2 75 VAL H 2 78 GLN H 4.000 . 6.000 4.607 4.607 4.607 . 0 0 "[ ]" 1
283 2 76 HIS H 2 77 ALA H 3.000 . 3.500 2.817 2.817 2.817 . 0 0 "[ ]" 1
284 2 76 HIS H 2 78 GLN H 4.000 . 5.000 4.163 4.163 4.163 . 0 0 "[ ]" 1
285 2 77 ALA H 2 78 GLN H 3.000 . 3.500 2.644 2.644 2.644 . 0 0 "[ ]" 1
286 2 77 ALA H 2 79 LEU H 4.000 . 5.000 4.110 4.110 4.110 . 0 0 "[ ]" 1
287 2 77 ALA H 2 80 HIS H 4.000 . 6.000 5.005 5.005 5.005 . 0 0 "[ ]" 1
288 2 78 GLN H 2 79 LEU H 3.000 . 3.500 2.644 2.644 2.644 . 0 0 "[ ]" 1
289 2 78 GLN H 2 80 HIS H 4.000 . 5.000 4.362 4.362 4.362 . 0 0 "[ ]" 1
290 2 79 LEU H 2 80 HIS H 3.000 . 3.500 2.860 2.860 2.860 . 0 0 "[ ]" 1
291 2 79 LEU H 2 82 MET H 4.000 . 6.000 4.629 4.629 4.629 . 0 0 "[ ]" 1
292 2 80 HIS H 2 81 LEU H 3.000 . 3.500 2.690 2.690 2.690 . 0 0 "[ ]" 1
293 2 80 HIS H 2 82 MET H 4.000 . 5.000 4.242 4.242 4.242 . 0 0 "[ ]" 1
294 2 81 LEU H 2 82 MET H 3.000 . 3.500 2.774 2.774 2.774 . 0 0 "[ ]" 1
295 2 81 LEU H 2 83 THR H 4.000 . 5.000 4.228 4.228 4.228 . 0 0 "[ ]" 1
296 2 81 LEU H 2 84 SER H 4.000 . 6.000 4.684 4.684 4.684 . 0 0 "[ ]" 1
297 2 82 MET H 2 83 THR H 3.000 . 3.500 2.707 2.707 2.707 . 0 0 "[ ]" 1
298 2 82 MET H 2 84 SER H 4.000 . 5.000 4.211 4.211 4.211 . 0 0 "[ ]" 1
299 2 82 MET H 2 85 MET H 4.000 . 6.000 4.740 4.740 4.740 . 0 0 "[ ]" 1
300 2 83 THR H 2 84 SER H 3.000 . 3.500 2.698 2.698 2.698 . 0 0 "[ ]" 1
301 2 83 THR H 2 85 MET H 4.000 . 5.000 4.305 4.305 4.305 . 0 0 "[ ]" 1
302 2 84 SER H 2 85 MET H 3.000 . 3.500 2.815 2.815 2.815 . 0 0 "[ ]" 1
303 2 84 SER H 2 86 LEU H 4.000 . 5.000 4.277 4.277 4.277 . 0 0 "[ ]" 1
304 2 85 MET H 2 86 LEU H 3.000 . 3.500 2.782 2.782 2.782 . 0 0 "[ ]" 1
305 2 85 MET H 2 87 ALA H 4.000 . 5.000 4.232 4.232 4.232 . 0 0 "[ ]" 1
306 2 86 LEU H 2 87 ALA H 3.000 . 3.500 2.676 2.676 2.676 . 0 0 "[ ]" 1
307 2 86 LEU H 2 88 ARG H 4.000 . 5.000 4.189 4.189 4.189 . 0 0 "[ ]" 1
308 2 86 LEU H 2 89 GLU H 4.000 . 6.000 4.687 4.687 4.687 . 0 0 "[ ]" 1
309 2 87 ALA H 2 89 GLU H 4.000 . 5.000 4.234 4.234 4.234 . 0 0 "[ ]" 1
310 2 88 ARG H 2 89 GLU H 3.000 . 3.500 2.818 2.818 2.818 . 0 0 "[ ]" 1
311 2 88 ARG H 2 91 ILE H 4.000 . 5.000 4.639 4.639 4.639 . 0 0 "[ ]" 1
312 2 89 GLU H 2 91 ILE H 4.000 . 5.000 4.142 4.142 4.142 . 0 0 "[ ]" 1
313 2 90 LEU H 2 91 ILE H 3.000 . 3.500 2.626 2.626 2.626 . 0 0 "[ ]" 1
314 2 90 LEU H 2 92 THR H 4.000 . 5.000 4.036 4.036 4.036 . 0 0 "[ ]" 1
315 2 90 LEU H 2 93 GLU H 4.000 . 6.000 4.803 4.803 4.803 . 0 0 "[ ]" 1
316 2 91 ILE H 2 92 THR H 3.000 . 3.500 2.691 2.691 2.691 . 0 0 "[ ]" 1
317 2 91 ILE H 2 93 GLU H 4.000 . 5.000 4.198 4.198 4.198 . 0 0 "[ ]" 1
318 2 91 ILE H 2 94 LEU H 4.000 . 6.000 4.652 4.652 4.652 . 0 0 "[ ]" 1
319 2 92 THR H 2 93 GLU H 3.000 . 3.500 2.714 2.714 2.714 . 0 0 "[ ]" 1
320 2 93 GLU H 2 94 LEU H 3.000 . 3.500 2.673 2.673 2.673 . 0 0 "[ ]" 1
321 2 93 GLU H 2 95 ILE H 4.000 . 5.000 4.185 4.185 4.185 . 0 0 "[ ]" 1
322 2 93 GLU H 2 96 GLU H 4.000 . 6.000 4.808 4.808 4.808 . 0 0 "[ ]" 1
323 2 94 LEU H 2 95 ILE H 3.000 . 3.500 2.748 2.748 2.748 . 0 0 "[ ]" 1
324 2 94 LEU H 2 96 GLU H 4.000 . 5.000 4.232 4.232 4.232 . 0 0 "[ ]" 1
325 2 95 ILE H 2 96 GLU H 3.000 . 3.500 2.741 2.741 2.741 . 0 0 "[ ]" 1
326 2 95 ILE H 2 97 LEU H 4.000 . 5.000 4.142 4.142 4.142 . 0 0 "[ ]" 1
327 2 95 ILE H 2 98 HIS H 4.000 . 6.000 4.855 4.855 4.855 . 0 0 "[ ]" 1
328 2 96 GLU H 2 99 GLU H 4.000 . 6.000 4.886 4.886 4.886 . 0 0 "[ ]" 1
329 2 97 LEU H 2 98 HIS H 3.000 . 3.500 2.703 2.703 2.703 . 0 0 "[ ]" 1
330 2 97 LEU H 2 99 GLU H 4.000 . 5.000 4.113 4.113 4.113 . 0 0 "[ ]" 1
331 2 97 LEU H 2 100 LYS H 4.000 . 5.000 4.783 4.783 4.783 . 0 0 "[ ]" 1
332 2 98 HIS H 2 99 GLU H 3.000 . 3.500 2.676 2.676 2.676 . 0 0 "[ ]" 1
333 2 98 HIS H 2 101 LEU H 4.000 . 6.000 4.733 4.733 4.733 . 0 0 "[ ]" 1
334 2 99 GLU H 2 100 LYS H 3.000 . 3.500 2.679 2.679 2.679 . 0 0 "[ ]" 1
335 2 99 GLU H 2 101 LEU H 4.000 . 5.000 4.030 4.030 4.030 . 0 0 "[ ]" 1
336 2 100 LYS H 2 101 LEU H 3.000 . 3.500 2.611 2.611 2.611 . 0 0 "[ ]" 1
337 3 5 GLU H 3 6 GLU H 3.000 . 3.500 2.601 2.601 2.601 . 0 0 "[ ]" 1
338 3 5 GLU H 3 7 VAL H 4.000 . 5.000 3.802 3.802 3.802 . 0 0 "[ ]" 1
339 3 6 GLU H 3 8 VAL H 4.000 . 5.000 4.119 4.119 4.119 . 0 0 "[ ]" 1
340 3 6 GLU H 3 9 MET H 4.000 . 5.000 4.868 4.868 4.868 . 0 0 "[ ]" 1
341 3 7 VAL H 3 8 VAL H 3.000 . 3.500 2.621 2.621 2.621 . 0 0 "[ ]" 1
342 3 7 VAL H 3 9 MET H 4.000 . 5.000 4.144 4.144 4.144 . 0 0 "[ ]" 1
343 3 8 VAL H 3 9 MET H 3.000 . 3.500 2.688 2.688 2.688 . 0 0 "[ ]" 1
344 3 8 VAL H 3 10 GLY H 4.000 . 5.000 4.118 4.118 4.118 . 0 0 "[ ]" 1
345 3 9 MET H 3 10 GLY H 3.000 . 3.500 2.709 2.709 2.709 . 0 0 "[ ]" 1
346 3 9 MET H 3 11 LEU H 4.000 . 5.000 4.115 4.115 4.115 . 0 0 "[ ]" 1
347 3 10 GLY H 3 11 LEU H 3.000 . 3.500 2.651 2.651 2.651 . 0 0 "[ ]" 1
348 3 10 GLY H 3 12 ILE H 4.000 . 5.000 4.130 4.130 4.130 . 0 0 "[ ]" 1
349 3 10 GLY H 3 13 ILE H 4.000 . 6.000 4.688 4.688 4.688 . 0 0 "[ ]" 1
350 3 10 GLY H 3 14 ASN H 4.000 . 6.000 5.786 5.786 5.786 . 0 0 "[ ]" 1
351 3 11 LEU H 3 12 ILE H 3.000 . 3.500 2.685 2.685 2.685 . 0 0 "[ ]" 1
352 3 11 LEU H 3 13 ILE H 4.000 . 5.000 4.162 4.162 4.162 . 0 0 "[ ]" 1
353 3 12 ILE H 3 13 ILE H 3.000 . 3.500 2.664 2.664 2.664 . 0 0 "[ ]" 1
354 3 14 ASN H 3 15 SER H 3.000 . 3.500 2.728 2.728 2.728 . 0 0 "[ ]" 1
355 3 15 SER H 3 16 GLY H 3.000 . 3.500 2.722 2.722 2.722 . 0 0 "[ ]" 1
356 3 15 SER H 3 17 GLN H 4.000 . 5.000 4.178 4.178 4.178 . 0 0 "[ ]" 1
357 3 16 GLY H 3 19 ARG H 4.000 . 6.000 4.837 4.837 4.837 . 0 0 "[ ]" 1
358 3 17 GLN H 3 19 ARG H 4.000 . 5.000 4.314 4.314 4.314 . 0 0 "[ ]" 1
359 3 18 ALA H 3 19 ARG H 3.000 . 3.500 2.792 2.792 2.792 . 0 0 "[ ]" 1
360 3 19 ARG H 3 20 SER H 3.000 . 3.500 2.715 2.715 2.715 . 0 0 "[ ]" 1
361 3 19 ARG H 3 21 LEU H 4.000 . 5.000 4.282 4.282 4.282 . 0 0 "[ ]" 1
362 3 19 ARG H 3 22 ALA H 4.000 . 6.000 4.691 4.691 4.691 . 0 0 "[ ]" 1
363 3 20 SER H 3 22 ALA H 4.000 . 5.000 4.172 4.172 4.172 . 0 0 "[ ]" 1
364 3 20 SER H 3 23 TYR H 4.000 . 6.000 4.801 4.801 4.801 . 0 0 "[ ]" 1
365 3 21 LEU H 3 22 ALA H 3.000 . 3.500 2.666 2.666 2.666 . 0 0 "[ ]" 1
366 3 21 LEU H 3 23 TYR H 4.000 . 5.000 4.391 4.391 4.391 . 0 0 "[ ]" 1
367 3 21 LEU H 3 24 ALA H 4.000 . 5.000 4.722 4.722 4.722 . 0 0 "[ ]" 1
368 3 22 ALA H 3 23 TYR H 3.000 . 3.500 2.856 2.856 2.856 . 0 0 "[ ]" 1
369 3 22 ALA H 3 24 ALA H 4.000 . 5.000 4.083 4.083 4.083 . 0 0 "[ ]" 1
370 3 23 TYR H 3 24 ALA H 3.000 . 3.500 2.722 2.722 2.722 . 0 0 "[ ]" 1
371 3 23 TYR H 3 25 ALA H 4.000 . 5.000 4.103 4.103 4.103 . 0 0 "[ ]" 1
372 3 23 TYR H 3 26 LEU H 4.000 . 6.000 4.784 4.784 4.784 . 0 0 "[ ]" 1
373 3 24 ALA H 3 26 LEU H 4.000 . 5.000 4.152 4.152 4.152 . 0 0 "[ ]" 1
374 3 25 ALA H 3 26 LEU H 3.000 . 3.500 2.685 2.685 2.685 . 0 0 "[ ]" 1
375 3 25 ALA H 3 27 LYS H 4.000 . 6.000 4.142 4.142 4.142 . 0 0 "[ ]" 1
376 3 26 LEU H 3 27 LYS H 3.000 . 3.500 2.704 2.704 2.704 . 0 0 "[ ]" 1
377 3 26 LEU H 3 28 GLN H 4.000 . 6.000 4.162 4.162 4.162 . 0 0 "[ ]" 1
378 3 27 LYS H 3 29 ALA H 4.000 . 6.000 4.198 4.198 4.198 . 0 0 "[ ]" 1
379 3 28 GLN H 3 29 ALA H 3.000 . 3.500 2.670 2.670 2.670 . 0 0 "[ ]" 1
380 3 29 ALA H 3 31 GLN H 4.000 . 6.000 4.034 4.034 4.034 . 0 0 "[ ]" 1
381 3 29 ALA HA 3 32 GLY H 4.000 . 6.000 3.413 3.413 3.413 . 0 0 "[ ]" 1
382 3 29 ALA H 3 33 ASP H 4.000 . 6.000 4.700 4.700 4.700 . 0 0 "[ ]" 1
383 3 29 ALA HA 3 34 PHE H 4.000 . 5.000 4.551 4.551 4.551 . 0 0 "[ ]" 1
384 3 30 LYS H 3 31 GLN H 3.000 . 3.500 2.679 2.679 2.679 . 0 0 "[ ]" 1
385 3 30 LYS HA 3 31 GLN H 4.000 . 6.000 3.522 3.522 3.522 . 0 0 "[ ]" 1
386 3 30 LYS H 3 32 GLY H 4.000 . 6.000 3.903 3.903 3.903 . 0 0 "[ ]" 1
387 3 30 LYS HA 3 33 ASP H 4.000 . 6.000 5.687 5.687 5.687 . 0 0 "[ ]" 1
388 3 31 GLN H 3 32 GLY H 2.500 . 2.900 2.468 2.468 2.468 . 0 0 "[ ]" 1
389 3 31 GLN H 3 33 ASP H 4.000 . 5.000 3.481 3.481 3.481 . 0 0 "[ ]" 1
390 3 32 GLY QA 3 33 ASP H 3.000 . 3.500 2.897 2.897 2.897 . 0 0 "[ ]" 1
391 3 32 GLY H 3 33 ASP H 2.500 . 2.900 2.412 2.412 2.412 . 0 0 "[ ]" 1
392 3 33 ASP HA 3 34 PHE H 2.500 . 2.900 2.375 2.375 2.375 . 0 0 "[ ]" 1
393 3 33 ASP HA 3 35 ALA H 4.000 . 5.000 3.476 3.476 3.476 . 0 0 "[ ]" 1
394 3 34 PHE H 3 35 ALA H 3.000 . 3.500 2.642 2.642 2.642 . 0 0 "[ ]" 1
395 3 34 PHE H 3 36 ALA H 4.000 . 6.000 4.509 4.509 4.509 . 0 0 "[ ]" 1
396 3 35 ALA H 3 36 ALA H 3.000 . 3.500 2.743 2.743 2.743 . 0 0 "[ ]" 1
397 3 35 ALA H 3 38 LYS H 4.000 . 5.000 4.751 4.751 4.751 . 0 0 "[ ]" 1
398 3 36 ALA H 3 37 ALA H 3.000 . 3.500 2.611 2.611 2.611 . 0 0 "[ ]" 1
399 3 37 ALA H 3 38 LYS H 3.000 . 3.500 2.733 2.733 2.733 . 0 0 "[ ]" 1
400 3 38 LYS H 3 39 ALA H 3.000 . 3.500 2.805 2.805 2.805 . 0 0 "[ ]" 1
401 3 38 LYS H 3 40 MET H 4.000 . 5.000 4.256 4.256 4.256 . 0 0 "[ ]" 1
402 3 39 ALA H 3 40 MET H 3.000 . 3.500 2.691 2.691 2.691 . 0 0 "[ ]" 1
403 3 39 ALA H 3 41 MET H 4.000 . 5.000 4.154 4.154 4.154 . 0 0 "[ ]" 1
404 3 40 MET H 3 41 MET H 3.000 . 3.500 2.687 2.687 2.687 . 0 0 "[ ]" 1
405 3 41 MET H 3 42 ASP H 3.000 . 3.500 2.680 2.680 2.680 . 0 0 "[ ]" 1
406 3 41 MET H 3 43 GLN H 4.000 . 5.000 4.267 4.267 4.267 . 0 0 "[ ]" 1
407 3 42 ASP H 3 43 GLN H 3.000 . 3.500 2.711 2.711 2.711 . 0 0 "[ ]" 1
408 3 43 GLN H 3 44 SER H 3.000 . 3.500 2.646 2.646 2.646 . 0 0 "[ ]" 1
409 3 43 GLN H 3 45 ARG H 4.000 . 5.000 4.278 4.278 4.278 . 0 0 "[ ]" 1
410 3 44 SER H 3 46 MET H 4.000 . 5.000 4.219 4.219 4.219 . 0 0 "[ ]" 1
411 3 45 ARG H 3 46 MET H 3.000 . 3.500 2.757 2.757 2.757 . 0 0 "[ ]" 1
412 3 45 ARG H 3 47 ALA H 4.000 . 5.000 4.222 4.222 4.222 . 0 0 "[ ]" 1
413 3 46 MET H 3 47 ALA H 3.000 . 3.500 2.661 2.661 2.661 . 0 0 "[ ]" 1
414 3 47 ALA H 3 48 LEU H 3.000 . 3.500 2.664 2.664 2.664 . 0 0 "[ ]" 1
415 3 47 ALA H 3 49 ASN H 4.000 . 5.000 4.069 4.069 4.069 . 0 0 "[ ]" 1
416 3 48 LEU H 3 49 ASN H 3.000 . 3.500 2.603 2.603 2.603 . 0 0 "[ ]" 1
417 3 50 GLU H 3 51 ALA H 3.000 . 3.500 2.590 2.590 2.590 . 0 0 "[ ]" 1
418 3 50 GLU H 3 52 HIS H 4.000 . 5.000 4.157 4.157 4.157 . 0 0 "[ ]" 1
419 3 51 ALA H 3 52 HIS H 3.000 . 3.500 2.665 2.665 2.665 . 0 0 "[ ]" 1
420 3 51 ALA H 3 53 LEU H 4.000 . 5.000 4.031 4.031 4.031 . 0 0 "[ ]" 1
421 3 52 HIS H 3 53 LEU H 3.000 . 3.500 2.701 2.701 2.701 . 0 0 "[ ]" 1
422 3 52 HIS H 3 54 VAL H 4.000 . 5.000 4.272 4.272 4.272 . 0 0 "[ ]" 1
423 3 52 HIS H 3 55 GLN H 4.000 . 6.000 4.798 4.798 4.798 . 0 0 "[ ]" 1
424 3 53 LEU H 3 54 VAL H 3.000 . 3.500 2.702 2.702 2.702 . 0 0 "[ ]" 1
425 3 54 VAL H 3 55 GLN H 3.000 . 3.500 2.669 2.669 2.669 . 0 0 "[ ]" 1
426 3 56 THR H 3 57 LYS H 3.000 . 3.500 2.820 2.820 2.820 . 0 0 "[ ]" 1
427 3 56 THR H 3 58 LEU H 4.000 . 5.000 4.065 4.065 4.065 . 0 0 "[ ]" 1
428 3 57 LYS H 3 58 LEU H 3.000 . 3.500 2.602 2.602 2.602 . 0 0 "[ ]" 1
429 3 57 LYS H 3 59 ILE H 4.000 . 5.000 4.479 4.479 4.479 . 0 0 "[ ]" 1
430 3 58 LEU H 3 59 ILE H 3.000 . 3.500 2.850 2.850 2.850 . 0 0 "[ ]" 1
431 3 59 ILE H 3 60 GLU H 3.000 . 3.500 2.937 2.937 2.937 . 0 0 "[ ]" 1
432 3 60 GLU HA 3 61 GLY H 3.000 . 3.500 3.576 3.576 3.576 0.076 1 0 "[ ]" 1
433 3 61 GLY QA 3 62 ASP H 2.500 . 2.900 2.965 2.965 2.965 0.065 1 0 "[ ]" 1
434 3 62 ASP HA 3 63 ALA H 3.000 . 3.500 3.472 3.472 3.472 . 0 0 "[ ]" 1
435 3 63 ALA HA 3 64 GLY H 3.000 . 3.500 2.166 2.166 2.166 . 0 0 "[ ]" 1
436 3 64 GLY QA 3 65 GLU H 2.500 . 2.900 2.587 2.587 2.587 . 0 0 "[ ]" 1
437 3 65 GLU HA 3 66 GLY H 3.000 . 3.500 2.165 2.165 2.165 . 0 0 "[ ]" 1
438 3 66 GLY QA 3 67 LYS H 3.000 . 3.500 2.086 2.086 2.086 . 0 0 "[ ]" 1
439 3 67 LYS HA 3 68 MET H 3.000 . 3.500 2.176 2.176 2.176 . 0 0 "[ ]" 1
440 3 68 MET HA 3 69 LYS H 3.000 . 3.500 3.456 3.456 3.456 . 0 0 "[ ]" 1
441 3 69 LYS HA 3 70 VAL H 3.000 . 3.500 3.248 3.248 3.248 . 0 0 "[ ]" 1
442 3 70 VAL HA 3 71 SER H 3.000 . 3.500 2.677 2.677 2.677 . 0 0 "[ ]" 1
443 3 72 LEU H 3 73 VAL H 3.000 . 3.500 2.808 2.808 2.808 . 0 0 "[ ]" 1
444 3 72 LEU H 3 74 LEU H 4.000 . 6.000 4.372 4.372 4.372 . 0 0 "[ ]" 1
445 3 73 VAL H 3 74 LEU H 3.000 . 3.500 2.857 2.857 2.857 . 0 0 "[ ]" 1
446 3 73 VAL H 3 75 VAL H 4.000 . 5.000 4.272 4.272 4.272 . 0 0 "[ ]" 1
447 3 74 LEU H 3 75 VAL H 3.000 . 3.500 2.666 2.666 2.666 . 0 0 "[ ]" 1
448 3 74 LEU H 3 76 HIS H 4.000 . 5.000 4.310 4.310 4.310 . 0 0 "[ ]" 1
449 3 74 LEU H 3 77 ALA H 4.000 . 6.000 4.873 4.873 4.873 . 0 0 "[ ]" 1
450 3 75 VAL H 3 78 GLN H 4.000 . 6.000 4.608 4.608 4.608 . 0 0 "[ ]" 1
451 3 76 HIS H 3 77 ALA H 3.000 . 3.500 2.820 2.820 2.820 . 0 0 "[ ]" 1
452 3 76 HIS H 3 78 GLN H 4.000 . 5.000 4.163 4.163 4.163 . 0 0 "[ ]" 1
453 3 77 ALA H 3 78 GLN H 3.000 . 3.500 2.643 2.643 2.643 . 0 0 "[ ]" 1
454 3 77 ALA H 3 79 LEU H 4.000 . 5.000 4.111 4.111 4.111 . 0 0 "[ ]" 1
455 3 77 ALA H 3 80 HIS H 4.000 . 6.000 5.007 5.007 5.007 . 0 0 "[ ]" 1
456 3 78 GLN H 3 79 LEU H 3.000 . 3.500 2.645 2.645 2.645 . 0 0 "[ ]" 1
457 3 78 GLN H 3 80 HIS H 4.000 . 5.000 4.362 4.362 4.362 . 0 0 "[ ]" 1
458 3 79 LEU H 3 80 HIS H 3.000 . 3.500 2.860 2.860 2.860 . 0 0 "[ ]" 1
459 3 79 LEU H 3 82 MET H 4.000 . 6.000 4.630 4.630 4.630 . 0 0 "[ ]" 1
460 3 80 HIS H 3 81 LEU H 3.000 . 3.500 2.691 2.691 2.691 . 0 0 "[ ]" 1
461 3 80 HIS H 3 82 MET H 4.000 . 5.000 4.243 4.243 4.243 . 0 0 "[ ]" 1
462 3 81 LEU H 3 82 MET H 3.000 . 3.500 2.773 2.773 2.773 . 0 0 "[ ]" 1
463 3 81 LEU H 3 83 THR H 4.000 . 5.000 4.227 4.227 4.227 . 0 0 "[ ]" 1
464 3 81 LEU H 3 84 SER H 4.000 . 6.000 4.684 4.684 4.684 . 0 0 "[ ]" 1
465 3 82 MET H 3 83 THR H 3.000 . 3.500 2.707 2.707 2.707 . 0 0 "[ ]" 1
466 3 82 MET H 3 84 SER H 4.000 . 5.000 4.213 4.213 4.213 . 0 0 "[ ]" 1
467 3 82 MET H 3 85 MET H 4.000 . 6.000 4.740 4.740 4.740 . 0 0 "[ ]" 1
468 3 83 THR H 3 84 SER H 3.000 . 3.500 2.700 2.700 2.700 . 0 0 "[ ]" 1
469 3 83 THR H 3 85 MET H 4.000 . 5.000 4.305 4.305 4.305 . 0 0 "[ ]" 1
470 3 84 SER H 3 85 MET H 3.000 . 3.500 2.814 2.814 2.814 . 0 0 "[ ]" 1
471 3 84 SER H 3 86 LEU H 4.000 . 5.000 4.276 4.276 4.276 . 0 0 "[ ]" 1
472 3 85 MET H 3 86 LEU H 3.000 . 3.500 2.781 2.781 2.781 . 0 0 "[ ]" 1
473 3 85 MET H 3 87 ALA H 4.000 . 5.000 4.231 4.231 4.231 . 0 0 "[ ]" 1
474 3 86 LEU H 3 87 ALA H 3.000 . 3.500 2.675 2.675 2.675 . 0 0 "[ ]" 1
475 3 86 LEU H 3 88 ARG H 4.000 . 5.000 4.188 4.188 4.188 . 0 0 "[ ]" 1
476 3 86 LEU H 3 89 GLU H 4.000 . 6.000 4.685 4.685 4.685 . 0 0 "[ ]" 1
477 3 87 ALA H 3 89 GLU H 4.000 . 5.000 4.232 4.232 4.232 . 0 0 "[ ]" 1
478 3 88 ARG H 3 89 GLU H 3.000 . 3.500 2.817 2.817 2.817 . 0 0 "[ ]" 1
479 3 88 ARG H 3 91 ILE H 4.000 . 5.000 4.637 4.637 4.637 . 0 0 "[ ]" 1
480 3 89 GLU H 3 91 ILE H 4.000 . 5.000 4.142 4.142 4.142 . 0 0 "[ ]" 1
481 3 90 LEU H 3 91 ILE H 3.000 . 3.500 2.627 2.627 2.627 . 0 0 "[ ]" 1
482 3 90 LEU H 3 92 THR H 4.000 . 5.000 4.034 4.034 4.034 . 0 0 "[ ]" 1
483 3 90 LEU H 3 93 GLU H 4.000 . 6.000 4.802 4.802 4.802 . 0 0 "[ ]" 1
484 3 91 ILE H 3 92 THR H 3.000 . 3.500 2.690 2.690 2.690 . 0 0 "[ ]" 1
485 3 91 ILE H 3 93 GLU H 4.000 . 5.000 4.199 4.199 4.199 . 0 0 "[ ]" 1
486 3 91 ILE H 3 94 LEU H 4.000 . 6.000 4.652 4.652 4.652 . 0 0 "[ ]" 1
487 3 92 THR H 3 93 GLU H 3.000 . 3.500 2.713 2.713 2.713 . 0 0 "[ ]" 1
488 3 93 GLU H 3 94 LEU H 3.000 . 3.500 2.672 2.672 2.672 . 0 0 "[ ]" 1
489 3 93 GLU H 3 95 ILE H 4.000 . 5.000 4.182 4.182 4.182 . 0 0 "[ ]" 1
490 3 93 GLU H 3 96 GLU H 4.000 . 6.000 4.801 4.801 4.801 . 0 0 "[ ]" 1
491 3 94 LEU H 3 95 ILE H 3.000 . 3.500 2.747 2.747 2.747 . 0 0 "[ ]" 1
492 3 94 LEU H 3 96 GLU H 4.000 . 5.000 4.228 4.228 4.228 . 0 0 "[ ]" 1
493 3 95 ILE H 3 96 GLU H 3.000 . 3.500 2.740 2.740 2.740 . 0 0 "[ ]" 1
494 3 95 ILE H 3 97 LEU H 4.000 . 5.000 4.134 4.134 4.134 . 0 0 "[ ]" 1
495 3 95 ILE H 3 98 HIS H 4.000 . 6.000 4.830 4.830 4.830 . 0 0 "[ ]" 1
496 3 96 GLU H 3 99 GLU H 4.000 . 6.000 4.876 4.876 4.876 . 0 0 "[ ]" 1
497 3 97 LEU H 3 98 HIS H 3.000 . 3.500 2.698 2.698 2.698 . 0 0 "[ ]" 1
498 3 97 LEU H 3 99 GLU H 4.000 . 5.000 4.117 4.117 4.117 . 0 0 "[ ]" 1
499 3 97 LEU H 3 100 LYS H 4.000 . 5.000 4.768 4.768 4.768 . 0 0 "[ ]" 1
500 3 98 HIS H 3 99 GLU H 3.000 . 3.500 2.680 2.680 2.680 . 0 0 "[ ]" 1
501 3 98 HIS H 3 101 LEU H 4.000 . 6.000 4.636 4.636 4.636 . 0 0 "[ ]" 1
502 3 99 GLU H 3 100 LYS H 3.000 . 3.500 2.680 2.680 2.680 . 0 0 "[ ]" 1
503 3 99 GLU H 3 101 LEU H 4.000 . 5.000 3.904 3.904 3.904 . 0 0 "[ ]" 1
504 3 100 LYS H 3 101 LEU H 3.000 . 3.500 2.543 2.543 2.543 . 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 307
_Distance_constraint_stats_list.Viol_count 10
_Distance_constraint_stats_list.Viol_total 0.668
_Distance_constraint_stats_list.Viol_max 0.161
_Distance_constraint_stats_list.Viol_rms 0.0164
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0022
_Distance_constraint_stats_list.Viol_average_violations_only 0.0668
_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 7 VAL 0.000 0.000 . 0 "[ ]"
1 8 VAL 0.159 0.159 1 0 "[ ]"
1 11 LEU 0.000 0.000 . 0 "[ ]"
1 21 LEU 0.000 0.000 . 0 "[ ]"
1 23 TYR 0.000 0.000 . 0 "[ ]"
1 26 LEU 0.000 0.000 . 0 "[ ]"
1 44 SER 0.000 0.000 . 0 "[ ]"
1 48 LEU 0.000 0.000 . 0 "[ ]"
1 52 HIS 0.000 0.000 . 0 "[ ]"
1 54 VAL 0.000 0.000 . 0 "[ ]"
1 55 GLN 0.028 0.015 1 0 "[ ]"
1 58 LEU 0.159 0.159 1 0 "[ ]"
1 59 ILE 0.000 0.000 . 0 "[ ]"
1 70 VAL 0.000 0.000 . 0 "[ ]"
1 72 LEU 0.000 0.000 . 0 "[ ]"
1 73 VAL 0.000 0.000 . 0 "[ ]"
1 75 VAL 0.000 0.000 . 0 "[ ]"
1 76 HIS 0.000 0.000 . 0 "[ ]"
1 77 ALA 0.000 0.000 . 0 "[ ]"
1 79 LEU 0.014 0.014 1 0 "[ ]"
1 81 LEU 0.000 0.000 . 0 "[ ]"
1 83 THR 0.000 0.000 . 0 "[ ]"
1 84 SER 0.000 0.000 . 0 "[ ]"
1 85 MET 0.000 0.000 . 0 "[ ]"
1 86 LEU 0.000 0.000 . 0 "[ ]"
1 87 ALA 0.000 0.000 . 0 "[ ]"
1 90 LEU 0.000 0.000 . 0 "[ ]"
1 91 ILE 0.000 0.000 . 0 "[ ]"
1 94 LEU 0.000 0.000 . 0 "[ ]"
1 95 ILE 0.000 0.000 . 0 "[ ]"
1 97 LEU 0.000 0.000 . 0 "[ ]"
1 98 HIS 0.000 0.000 . 0 "[ ]"
1 100 LYS 0.086 0.060 1 0 "[ ]"
1 101 LEU 0.061 0.045 1 0 "[ ]"
2 7 VAL 0.000 0.000 . 0 "[ ]"
2 8 VAL 0.159 0.159 1 0 "[ ]"
2 11 LEU 0.000 0.000 . 0 "[ ]"
2 21 LEU 0.000 0.000 . 0 "[ ]"
2 23 TYR 0.000 0.000 . 0 "[ ]"
2 26 LEU 0.000 0.000 . 0 "[ ]"
2 44 SER 0.000 0.000 . 0 "[ ]"
2 48 LEU 0.000 0.000 . 0 "[ ]"
2 52 HIS 0.000 0.000 . 0 "[ ]"
2 54 VAL 0.000 0.000 . 0 "[ ]"
2 55 GLN 0.029 0.015 1 0 "[ ]"
2 58 LEU 0.159 0.159 1 0 "[ ]"
2 59 ILE 0.000 0.000 . 0 "[ ]"
2 70 VAL 0.000 0.000 . 0 "[ ]"
2 72 LEU 0.000 0.000 . 0 "[ ]"
2 73 VAL 0.000 0.000 . 0 "[ ]"
2 75 VAL 0.000 0.000 . 0 "[ ]"
2 76 HIS 0.000 0.000 . 0 "[ ]"
2 77 ALA 0.000 0.000 . 0 "[ ]"
2 79 LEU 0.013 0.013 1 0 "[ ]"
2 81 LEU 0.000 0.000 . 0 "[ ]"
2 83 THR 0.000 0.000 . 0 "[ ]"
2 84 SER 0.000 0.000 . 0 "[ ]"
2 85 MET 0.000 0.000 . 0 "[ ]"
2 86 LEU 0.000 0.000 . 0 "[ ]"
2 87 ALA 0.000 0.000 . 0 "[ ]"
2 90 LEU 0.000 0.000 . 0 "[ ]"
2 91 ILE 0.000 0.000 . 0 "[ ]"
2 94 LEU 0.000 0.000 . 0 "[ ]"
2 95 ILE 0.000 0.000 . 0 "[ ]"
2 97 LEU 0.000 0.000 . 0 "[ ]"
2 98 HIS 0.000 0.000 . 0 "[ ]"
2 100 LYS 0.076 0.060 1 0 "[ ]"
2 101 LEU 0.071 0.045 1 0 "[ ]"
3 7 VAL 0.000 0.000 . 0 "[ ]"
3 8 VAL 0.161 0.161 1 0 "[ ]"
3 11 LEU 0.000 0.000 . 0 "[ ]"
3 21 LEU 0.000 0.000 . 0 "[ ]"
3 23 TYR 0.000 0.000 . 0 "[ ]"
3 26 LEU 0.000 0.000 . 0 "[ ]"
3 44 SER 0.000 0.000 . 0 "[ ]"
3 48 LEU 0.000 0.000 . 0 "[ ]"
3 52 HIS 0.000 0.000 . 0 "[ ]"
3 54 VAL 0.000 0.000 . 0 "[ ]"
3 55 GLN 0.027 0.014 1 0 "[ ]"
3 58 LEU 0.161 0.161 1 0 "[ ]"
3 59 ILE 0.000 0.000 . 0 "[ ]"
3 70 VAL 0.000 0.000 . 0 "[ ]"
3 72 LEU 0.000 0.000 . 0 "[ ]"
3 73 VAL 0.000 0.000 . 0 "[ ]"
3 75 VAL 0.000 0.000 . 0 "[ ]"
3 76 HIS 0.000 0.000 . 0 "[ ]"
3 77 ALA 0.000 0.000 . 0 "[ ]"
3 79 LEU 0.015 0.015 1 0 "[ ]"
3 81 LEU 0.000 0.000 . 0 "[ ]"
3 83 THR 0.000 0.000 . 0 "[ ]"
3 84 SER 0.000 0.000 . 0 "[ ]"
3 85 MET 0.000 0.000 . 0 "[ ]"
3 86 LEU 0.000 0.000 . 0 "[ ]"
3 87 ALA 0.000 0.000 . 0 "[ ]"
3 90 LEU 0.000 0.000 . 0 "[ ]"
3 91 ILE 0.000 0.000 . 0 "[ ]"
3 94 LEU 0.000 0.000 . 0 "[ ]"
3 95 ILE 0.000 0.000 . 0 "[ ]"
3 97 LEU 0.000 0.000 . 0 "[ ]"
3 98 HIS 0.000 0.000 . 0 "[ ]"
3 100 LYS 0.043 0.026 1 0 "[ ]"
3 101 LEU 0.104 0.060 1 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 VAL MG1 1 58 LEU MD1 3.000 . 4.300 2.283 2.283 2.283 . 0 0 "[ ]" 2
2 1 7 VAL MG1 1 58 LEU MD2 2.500 . 3.700 2.968 2.968 2.968 . 0 0 "[ ]" 2
3 1 7 VAL MG2 1 58 LEU MD1 4.000 . 6.000 4.081 4.081 4.081 . 0 0 "[ ]" 2
4 1 7 VAL MG2 1 58 LEU MD2 4.000 . 6.000 3.704 3.704 3.704 . 0 0 "[ ]" 2
5 2 7 VAL MG1 2 58 LEU MD1 3.000 . 4.300 2.281 2.281 2.281 . 0 0 "[ ]" 2
6 2 7 VAL MG1 2 58 LEU MD2 2.500 . 3.700 2.964 2.964 2.964 . 0 0 "[ ]" 2
7 2 7 VAL MG2 2 58 LEU MD1 4.000 . 6.000 4.074 4.074 4.074 . 0 0 "[ ]" 2
8 2 7 VAL MG2 2 58 LEU MD2 4.000 . 6.000 3.700 3.700 3.700 . 0 0 "[ ]" 2
9 3 7 VAL MG1 3 58 LEU MD1 3.000 . 4.300 2.281 2.281 2.281 . 0 0 "[ ]" 2
10 3 7 VAL MG1 3 58 LEU MD2 2.500 . 3.700 2.961 2.961 2.961 . 0 0 "[ ]" 2
11 3 7 VAL MG2 3 58 LEU MD1 4.000 . 6.000 4.071 4.071 4.071 . 0 0 "[ ]" 2
12 3 7 VAL MG2 3 58 LEU MD2 4.000 . 6.000 3.697 3.697 3.697 . 0 0 "[ ]" 2
13 1 8 VAL MG2 1 58 LEU MD1 3.000 . 4.300 3.562 3.562 3.562 . 0 0 "[ ]" 2
14 1 8 VAL MG2 1 58 LEU MD2 3.000 . 4.300 4.459 4.459 4.459 0.159 1 0 "[ ]" 2
15 1 8 VAL MG2 1 73 VAL MG2 3.000 . 4.300 3.542 3.542 3.542 . 0 0 "[ ]" 2
16 1 8 VAL MG2 1 77 ALA H 4.000 . 5.500 4.018 4.018 4.018 . 0 0 "[ ]" 2
17 1 8 VAL MG1 1 77 ALA H 3.000 . 4.000 3.485 3.485 3.485 . 0 0 "[ ]" 2
18 2 8 VAL MG2 2 58 LEU MD1 3.000 . 4.300 3.565 3.565 3.565 . 0 0 "[ ]" 2
19 2 8 VAL MG2 2 58 LEU MD2 3.000 . 4.300 4.459 4.459 4.459 0.159 1 0 "[ ]" 2
20 2 8 VAL MG2 2 73 VAL MG2 3.000 . 4.300 3.540 3.540 3.540 . 0 0 "[ ]" 2
21 2 8 VAL MG2 2 77 ALA H 4.000 . 5.500 4.019 4.019 4.019 . 0 0 "[ ]" 2
22 2 8 VAL MG1 2 77 ALA H 3.000 . 4.000 3.481 3.481 3.481 . 0 0 "[ ]" 2
23 3 8 VAL MG2 3 58 LEU MD1 3.000 . 4.300 3.566 3.566 3.566 . 0 0 "[ ]" 2
24 3 8 VAL MG2 3 58 LEU MD2 3.000 . 4.300 4.461 4.461 4.461 0.161 1 0 "[ ]" 2
25 3 8 VAL MG2 3 73 VAL MG2 3.000 . 4.300 3.541 3.541 3.541 . 0 0 "[ ]" 2
26 3 8 VAL MG2 3 77 ALA H 4.000 . 5.500 4.012 4.012 4.012 . 0 0 "[ ]" 2
27 3 8 VAL MG1 3 77 ALA H 3.000 . 4.000 3.483 3.483 3.483 . 0 0 "[ ]" 2
28 1 11 LEU MD1 1 54 VAL MG1 3.000 . 4.300 2.290 2.290 2.290 . 0 0 "[ ]" 2
29 1 11 LEU MD1 1 54 VAL MG2 4.000 . 6.000 4.403 4.403 4.403 . 0 0 "[ ]" 2
30 1 11 LEU MD1 1 55 GLN H 4.000 . 5.500 3.940 3.940 3.940 . 0 0 "[ ]" 2
31 1 11 LEU MD1 1 58 LEU MD1 3.000 . 4.300 2.200 2.200 2.200 . 0 0 "[ ]" 2
32 1 11 LEU MD1 1 58 LEU MD2 4.000 . 6.000 4.131 4.131 4.131 . 0 0 "[ ]" 2
33 2 11 LEU MD1 2 54 VAL MG1 3.000 . 4.300 2.276 2.276 2.276 . 0 0 "[ ]" 2
34 2 11 LEU MD1 2 54 VAL MG2 4.000 . 6.000 4.394 4.394 4.394 . 0 0 "[ ]" 2
35 2 11 LEU MD1 2 55 GLN H 4.000 . 5.500 3.939 3.939 3.939 . 0 0 "[ ]" 2
36 2 11 LEU MD1 2 58 LEU MD1 3.000 . 4.300 2.199 2.199 2.199 . 0 0 "[ ]" 2
37 2 11 LEU MD1 2 58 LEU MD2 4.000 . 6.000 4.130 4.130 4.130 . 0 0 "[ ]" 2
38 3 11 LEU MD1 3 54 VAL MG1 3.000 . 4.300 2.270 2.270 2.270 . 0 0 "[ ]" 2
39 3 11 LEU MD1 3 54 VAL MG2 4.000 . 6.000 4.391 4.391 4.391 . 0 0 "[ ]" 2
40 3 11 LEU MD1 3 55 GLN H 4.000 . 5.500 3.943 3.943 3.943 . 0 0 "[ ]" 2
41 3 11 LEU MD1 3 58 LEU MD1 3.000 . 4.300 2.199 2.199 2.199 . 0 0 "[ ]" 2
42 3 11 LEU MD1 3 58 LEU MD2 4.000 . 6.000 4.129 4.129 4.129 . 0 0 "[ ]" 2
43 1 21 LEU MD1 1 44 SER H 4.000 . 5.500 4.102 4.102 4.102 . 0 0 "[ ]" 2
44 1 21 LEU MD2 1 44 SER H 4.000 . 5.500 5.056 5.056 5.056 . 0 0 "[ ]" 2
45 2 21 LEU MD1 2 44 SER H 4.000 . 5.500 4.102 4.102 4.102 . 0 0 "[ ]" 2
46 2 21 LEU MD2 2 44 SER H 4.000 . 5.500 5.055 5.055 5.055 . 0 0 "[ ]" 2
47 3 21 LEU MD1 3 44 SER H 4.000 . 5.500 4.099 4.099 4.099 . 0 0 "[ ]" 2
48 3 21 LEU MD2 3 44 SER H 4.000 . 5.500 5.056 5.056 5.056 . 0 0 "[ ]" 2
49 1 26 LEU MD2 3 90 LEU MD2 4.000 . 6.000 4.192 4.192 4.192 . 0 0 "[ ]" 2
50 1 26 LEU MD2 3 90 LEU HA 4.000 . 6.500 5.140 5.140 5.140 . 0 0 "[ ]" 2
51 1 26 LEU MD1 1 91 ILE MD 4.000 . 6.000 5.111 5.111 5.111 . 0 0 "[ ]" 2
52 1 26 LEU MD2 1 91 ILE MD 3.000 . 4.300 3.934 3.934 3.934 . 0 0 "[ ]" 2
53 1 26 LEU H 1 95 ILE MD 3.000 . 4.000 3.157 3.157 3.157 . 0 0 "[ ]" 2
54 1 26 LEU MD1 1 95 ILE MD 4.000 . 6.000 3.425 3.425 3.425 . 0 0 "[ ]" 2
55 1 26 LEU MD2 1 95 ILE MD 4.000 . 7.000 4.646 4.646 4.646 . 0 0 "[ ]" 2
56 1 26 LEU MD1 1 95 ILE H 3.000 . 4.000 3.560 3.560 3.560 . 0 0 "[ ]" 2
57 1 90 LEU MD2 2 26 LEU MD2 4.000 . 6.000 4.195 4.195 4.195 . 0 0 "[ ]" 2
58 1 90 LEU HA 2 26 LEU MD2 4.000 . 6.500 5.142 5.142 5.142 . 0 0 "[ ]" 2
59 2 26 LEU MD1 2 91 ILE MD 4.000 . 6.000 5.113 5.113 5.113 . 0 0 "[ ]" 2
60 2 26 LEU MD2 2 91 ILE MD 3.000 . 4.300 3.937 3.937 3.937 . 0 0 "[ ]" 2
61 2 26 LEU H 2 95 ILE MD 3.000 . 4.000 3.160 3.160 3.160 . 0 0 "[ ]" 2
62 2 26 LEU MD1 2 95 ILE MD 4.000 . 6.000 3.422 3.422 3.422 . 0 0 "[ ]" 2
63 2 26 LEU MD2 2 95 ILE MD 4.000 . 7.000 4.645 4.645 4.645 . 0 0 "[ ]" 2
64 2 26 LEU MD1 2 95 ILE H 3.000 . 4.000 3.557 3.557 3.557 . 0 0 "[ ]" 2
65 2 90 LEU MD2 3 26 LEU MD2 4.000 . 6.000 4.193 4.193 4.193 . 0 0 "[ ]" 2
66 2 90 LEU HA 3 26 LEU MD2 4.000 . 6.500 5.138 5.138 5.138 . 0 0 "[ ]" 2
67 3 26 LEU MD1 3 91 ILE MD 4.000 . 6.000 5.112 5.112 5.112 . 0 0 "[ ]" 2
68 3 26 LEU MD2 3 91 ILE MD 3.000 . 4.300 3.936 3.936 3.936 . 0 0 "[ ]" 2
69 3 26 LEU H 3 95 ILE MD 3.000 . 4.000 3.162 3.162 3.162 . 0 0 "[ ]" 2
70 3 26 LEU MD1 3 95 ILE MD 4.000 . 6.000 3.427 3.427 3.427 . 0 0 "[ ]" 2
71 3 26 LEU MD2 3 95 ILE MD 4.000 . 7.000 4.647 4.647 4.647 . 0 0 "[ ]" 2
72 3 26 LEU MD1 3 95 ILE H 3.000 . 4.000 3.563 3.563 3.563 . 0 0 "[ ]" 2
73 1 48 LEU QD 1 85 MET H 3.000 . 4.500 3.299 3.299 3.299 . 0 0 "[ ]" 2
74 2 48 LEU QD 2 85 MET H 3.000 . 4.500 3.304 3.304 3.304 . 0 0 "[ ]" 2
75 3 48 LEU QD 3 85 MET H 3.000 . 4.500 3.300 3.300 3.300 . 0 0 "[ ]" 2
76 1 58 LEU MD1 1 73 VAL MG1 4.000 . 6.000 4.278 4.278 4.278 . 0 0 "[ ]" 2
77 1 58 LEU MD1 1 73 VAL MG2 4.000 . 7.000 6.416 6.416 6.416 . 0 0 "[ ]" 2
78 1 58 LEU MD2 1 73 VAL MG1 4.000 . 6.000 4.707 4.707 4.707 . 0 0 "[ ]" 2
79 1 58 LEU MD2 1 73 VAL MG2 4.000 . 7.000 6.445 6.445 6.445 . 0 0 "[ ]" 2
80 2 58 LEU MD1 2 73 VAL MG1 4.000 . 6.000 4.281 4.281 4.281 . 0 0 "[ ]" 2
81 2 58 LEU MD1 2 73 VAL MG2 4.000 . 7.000 6.419 6.419 6.419 . 0 0 "[ ]" 2
82 2 58 LEU MD2 2 73 VAL MG1 4.000 . 6.000 4.709 4.709 4.709 . 0 0 "[ ]" 2
83 2 58 LEU MD2 2 73 VAL MG2 4.000 . 7.000 6.446 6.446 6.446 . 0 0 "[ ]" 2
84 3 58 LEU MD1 3 73 VAL MG1 4.000 . 6.000 4.284 4.284 4.284 . 0 0 "[ ]" 2
85 3 58 LEU MD1 3 73 VAL MG2 4.000 . 7.000 6.423 6.423 6.423 . 0 0 "[ ]" 2
86 3 58 LEU MD2 3 73 VAL MG1 4.000 . 6.000 4.715 4.715 4.715 . 0 0 "[ ]" 2
87 3 58 LEU MD2 3 73 VAL MG2 4.000 . 7.000 6.453 6.453 6.453 . 0 0 "[ ]" 2
88 1 59 ILE MD 1 70 VAL QG 4.000 . 7.000 3.176 3.176 3.176 . 0 0 "[ ]" 2
89 2 59 ILE MD 2 70 VAL QG 4.000 . 7.000 3.172 3.172 3.172 . 0 0 "[ ]" 2
90 3 59 ILE MD 3 70 VAL QG 4.000 . 7.000 3.175 3.175 3.175 . 0 0 "[ ]" 2
91 1 70 VAL QG 2 72 LEU QD 4.000 . 6.000 2.148 2.148 2.148 . 0 0 "[ ]" 2
92 1 70 VAL QG 2 73 VAL MG1 4.000 . 7.000 4.912 4.912 4.912 . 0 0 "[ ]" 2
93 1 70 VAL QG 2 73 VAL MG2 4.000 . 7.000 4.273 4.273 4.273 . 0 0 "[ ]" 2
94 1 70 VAL QG 2 75 VAL MG2 4.000 . 7.000 5.248 5.248 5.248 . 0 0 "[ ]" 2
95 1 70 VAL QG 2 75 VAL HB 4.000 . 6.500 4.843 4.843 4.843 . 0 0 "[ ]" 2
96 1 70 VAL QG 2 76 HIS HE1 4.000 . 6.500 3.981 3.981 3.981 . 0 0 "[ ]" 2
97 1 70 VAL QG 2 76 HIS HD2 4.000 . 6.500 2.304 2.304 2.304 . 0 0 "[ ]" 2
98 1 70 VAL QG 2 76 HIS QB 4.000 . 6.500 2.397 2.397 2.397 . 0 0 "[ ]" 2
99 1 72 LEU QD 2 70 VAL QG 4.000 . 6.000 2.146 2.146 2.146 . 0 0 "[ ]" 2
100 1 73 VAL MG1 2 70 VAL QG 4.000 . 7.000 4.907 4.907 4.907 . 0 0 "[ ]" 2
101 1 73 VAL MG2 2 70 VAL QG 4.000 . 7.000 4.272 4.272 4.272 . 0 0 "[ ]" 2
102 1 75 VAL MG2 2 70 VAL QG 4.000 . 7.000 5.251 5.251 5.251 . 0 0 "[ ]" 2
103 1 75 VAL HB 2 70 VAL QG 4.000 . 6.500 4.845 4.845 4.845 . 0 0 "[ ]" 2
104 1 76 HIS HE1 2 70 VAL QG 4.000 . 6.500 3.980 3.980 3.980 . 0 0 "[ ]" 2
105 1 76 HIS HD2 2 70 VAL QG 4.000 . 6.500 2.302 2.302 2.302 . 0 0 "[ ]" 2
106 1 76 HIS QB 2 70 VAL QG 4.000 . 6.500 2.398 2.398 2.398 . 0 0 "[ ]" 2
107 1 72 LEU QD 3 70 VAL QG 4.000 . 6.000 2.149 2.149 2.149 . 0 0 "[ ]" 2
108 1 73 VAL MG1 3 70 VAL QG 4.000 . 7.000 4.918 4.918 4.918 . 0 0 "[ ]" 2
109 1 73 VAL MG2 3 70 VAL QG 4.000 . 7.000 4.280 4.280 4.280 . 0 0 "[ ]" 2
110 1 75 VAL MG2 3 70 VAL QG 4.000 . 7.000 5.252 5.252 5.252 . 0 0 "[ ]" 2
111 1 75 VAL HB 3 70 VAL QG 4.000 . 6.500 4.849 4.849 4.849 . 0 0 "[ ]" 2
112 1 76 HIS HE1 3 70 VAL QG 4.000 . 6.500 3.983 3.983 3.983 . 0 0 "[ ]" 2
113 1 76 HIS HD2 3 70 VAL QG 4.000 . 6.500 2.309 2.309 2.309 . 0 0 "[ ]" 2
114 1 76 HIS QB 3 70 VAL QG 4.000 . 6.500 2.401 2.401 2.401 . 0 0 "[ ]" 2
115 1 72 LEU QD 2 59 ILE MG 4.000 . 7.000 6.440 6.440 6.440 . 0 0 "[ ]" 2
116 1 72 LEU QD 2 75 VAL MG2 4.000 . 6.000 2.768 2.768 2.768 . 0 0 "[ ]" 2
117 1 59 ILE MG 2 72 LEU QD 4.000 . 7.000 6.437 6.437 6.437 . 0 0 "[ ]" 2
118 1 75 VAL MG2 2 72 LEU QD 4.000 . 6.000 2.754 2.754 2.754 . 0 0 "[ ]" 2
119 1 59 ILE MG 3 72 LEU QD 4.000 . 7.000 6.442 6.442 6.442 . 0 0 "[ ]" 2
120 1 75 VAL MG2 3 72 LEU QD 4.000 . 6.000 2.762 2.762 2.762 . 0 0 "[ ]" 2
121 1 75 VAL MG1 2 75 VAL HA 4.000 . 6.500 4.341 4.341 4.341 . 0 0 "[ ]" 2
122 1 75 VAL MG1 2 76 HIS HD2 4.000 . 6.500 3.781 3.781 3.781 . 0 0 "[ ]" 2
123 1 75 VAL MG1 2 76 HIS HA 4.000 . 6.500 3.256 3.256 3.256 . 0 0 "[ ]" 2
124 1 75 VAL MG1 2 79 LEU MD2 3.000 . 4.300 2.998 2.998 2.998 . 0 0 "[ ]" 2
125 1 75 VAL MG2 2 75 VAL HB 4.000 . 6.000 3.613 3.613 3.613 . 0 0 "[ ]" 2
126 1 75 VAL MG2 2 75 VAL MG2 4.000 . 6.000 4.033 4.033 4.033 . 0 0 "[ ]" 2
127 1 75 VAL MG2 2 76 HIS QB 4.000 . 5.500 3.107 3.107 3.107 . 0 0 "[ ]" 2
128 1 75 VAL MG2 2 76 HIS HD2 4.000 . 5.500 2.922 2.922 2.922 . 0 0 "[ ]" 2
129 1 75 VAL MG2 2 76 HIS HA 4.000 . 5.500 3.654 3.654 3.654 . 0 0 "[ ]" 2
130 1 75 VAL MG2 2 79 LEU MD2 4.000 . 7.000 4.267 4.267 4.267 . 0 0 "[ ]" 2
131 1 75 VAL HA 2 75 VAL MG1 4.000 . 6.500 4.341 4.341 4.341 . 0 0 "[ ]" 2
132 1 76 HIS HD2 2 75 VAL MG1 4.000 . 6.500 3.793 3.793 3.793 . 0 0 "[ ]" 2
133 1 76 HIS HA 2 75 VAL MG1 4.000 . 6.500 3.266 3.266 3.266 . 0 0 "[ ]" 2
134 1 79 LEU MD2 2 75 VAL MG1 3.000 . 4.300 3.019 3.019 3.019 . 0 0 "[ ]" 2
135 1 75 VAL HB 2 75 VAL MG2 4.000 . 6.000 3.609 3.609 3.609 . 0 0 "[ ]" 2
136 1 76 HIS QB 2 75 VAL MG2 4.000 . 5.500 3.107 3.107 3.107 . 0 0 "[ ]" 2
137 1 76 HIS HD2 2 75 VAL MG2 4.000 . 5.500 2.924 2.924 2.924 . 0 0 "[ ]" 2
138 1 76 HIS HA 2 75 VAL MG2 4.000 . 5.500 3.654 3.654 3.654 . 0 0 "[ ]" 2
139 1 79 LEU MD2 2 75 VAL MG2 4.000 . 7.000 4.269 4.269 4.269 . 0 0 "[ ]" 2
140 1 75 VAL HA 3 75 VAL MG1 4.000 . 6.500 4.341 4.341 4.341 . 0 0 "[ ]" 2
141 1 76 HIS HD2 3 75 VAL MG1 4.000 . 6.500 3.790 3.790 3.790 . 0 0 "[ ]" 2
142 1 76 HIS HA 3 75 VAL MG1 4.000 . 6.500 3.264 3.264 3.264 . 0 0 "[ ]" 2
143 1 79 LEU MD2 3 75 VAL MG1 3.000 . 4.300 3.014 3.014 3.014 . 0 0 "[ ]" 2
144 1 75 VAL HB 3 75 VAL MG2 4.000 . 6.000 3.604 3.604 3.604 . 0 0 "[ ]" 2
145 1 76 HIS QB 3 75 VAL MG2 4.000 . 5.500 3.109 3.109 3.109 . 0 0 "[ ]" 2
146 1 76 HIS HD2 3 75 VAL MG2 4.000 . 5.500 2.923 2.923 2.923 . 0 0 "[ ]" 2
147 1 76 HIS HA 3 75 VAL MG2 4.000 . 5.500 3.655 3.655 3.655 . 0 0 "[ ]" 2
148 1 79 LEU MD2 3 75 VAL MG2 4.000 . 7.000 4.263 4.263 4.263 . 0 0 "[ ]" 2
149 1 79 LEU MD1 2 79 LEU HA 2.500 . 3.200 2.257 2.257 2.257 . 0 0 "[ ]" 2
150 1 79 LEU MD1 2 79 LEU HG 4.000 . 6.500 3.948 3.948 3.948 . 0 0 "[ ]" 2
151 1 79 LEU MD1 2 79 LEU QB 4.000 . 6.500 3.179 3.179 3.179 . 0 0 "[ ]" 2
152 1 79 LEU MD1 2 79 LEU MD1 3.000 . 4.300 1.817 1.817 1.817 . 0 0 "[ ]" 2
153 1 79 LEU MD2 2 55 GLN QG 4.000 . 6.500 6.514 6.514 6.514 0.014 1 0 "[ ]" 2
154 1 79 LEU MD2 2 79 LEU HA 3.000 . 3.800 2.297 2.297 2.297 . 0 0 "[ ]" 2
155 1 79 LEU MD2 2 79 LEU MD1 4.000 . 6.000 3.058 3.058 3.058 . 0 0 "[ ]" 2
156 1 79 LEU HA 2 79 LEU MD1 2.500 . 3.200 2.257 2.257 2.257 . 0 0 "[ ]" 2
157 1 79 LEU HG 2 79 LEU MD1 4.000 . 6.500 3.948 3.948 3.948 . 0 0 "[ ]" 2
158 1 79 LEU QB 2 79 LEU MD1 4.000 . 6.500 3.181 3.181 3.181 . 0 0 "[ ]" 2
159 1 55 GLN QG 2 79 LEU MD2 4.000 . 6.500 6.513 6.513 6.513 0.013 1 0 "[ ]" 2
160 1 79 LEU HA 2 79 LEU MD2 3.000 . 3.800 2.296 2.296 2.296 . 0 0 "[ ]" 2
161 1 79 LEU MD1 2 79 LEU MD2 4.000 . 6.000 3.057 3.057 3.057 . 0 0 "[ ]" 2
162 1 79 LEU HA 3 79 LEU MD1 2.500 . 3.200 2.257 2.257 2.257 . 0 0 "[ ]" 2
163 1 79 LEU HG 3 79 LEU MD1 4.000 . 6.500 3.948 3.948 3.948 . 0 0 "[ ]" 2
164 1 79 LEU QB 3 79 LEU MD1 4.000 . 6.500 3.180 3.180 3.180 . 0 0 "[ ]" 2
165 1 55 GLN QG 3 79 LEU MD2 4.000 . 6.500 6.515 6.515 6.515 0.015 1 0 "[ ]" 2
166 1 79 LEU HA 3 79 LEU MD2 3.000 . 3.800 2.296 2.296 2.296 . 0 0 "[ ]" 2
167 1 79 LEU MD1 3 79 LEU MD2 4.000 . 6.000 3.058 3.058 3.058 . 0 0 "[ ]" 2
168 1 52 HIS H 1 81 LEU MD1 4.000 . 6.500 4.438 4.438 4.438 . 0 0 "[ ]" 2
169 2 52 HIS H 2 81 LEU MD1 4.000 . 6.500 4.438 4.438 4.438 . 0 0 "[ ]" 2
170 3 52 HIS H 3 81 LEU MD1 4.000 . 6.500 4.438 4.438 4.438 . 0 0 "[ ]" 2
171 1 86 LEU MD1 2 23 TYR QE 4.000 . 6.500 3.332 3.332 3.332 . 0 0 "[ ]" 2
172 1 86 LEU MD1 2 84 SER HA 4.000 . 6.500 4.032 4.032 4.032 . 0 0 "[ ]" 2
173 1 86 LEU MD1 2 86 LEU MD2 3.000 . 5.000 4.229 4.229 4.229 . 0 0 "[ ]" 2
174 1 86 LEU MD1 2 86 LEU MD1 4.000 . 7.000 5.773 5.773 5.773 . 0 0 "[ ]" 2
175 1 86 LEU MD1 2 90 LEU MD1 4.000 . 6.000 4.480 4.480 4.480 . 0 0 "[ ]" 2
176 1 86 LEU MD1 2 87 ALA HA 3.000 . 3.800 3.522 3.522 3.522 . 0 0 "[ ]" 2
177 1 86 LEU MD2 2 83 THR MG 4.000 . 6.000 3.071 3.071 3.071 . 0 0 "[ ]" 2
178 1 86 LEU MD2 2 84 SER HA 4.000 . 5.500 4.565 4.565 4.565 . 0 0 "[ ]" 2
179 1 86 LEU MD2 2 86 LEU MD2 3.000 . 4.300 2.358 2.358 2.358 . 0 0 "[ ]" 2
180 1 86 LEU MD2 2 86 LEU MD1 4.000 . 6.000 4.230 4.230 4.230 . 0 0 "[ ]" 2
181 1 86 LEU MD2 2 87 ALA HA 3.000 . 3.800 2.835 2.835 2.835 . 0 0 "[ ]" 2
182 1 86 LEU MD2 2 90 LEU MD1 4.000 . 7.000 3.155 3.155 3.155 . 0 0 "[ ]" 2
183 1 23 TYR QE 2 86 LEU MD1 4.000 . 6.500 3.335 3.335 3.335 . 0 0 "[ ]" 2
184 1 84 SER HA 2 86 LEU MD1 4.000 . 6.500 4.036 4.036 4.036 . 0 0 "[ ]" 2
185 1 86 LEU MD2 2 86 LEU MD1 3.000 . 5.000 4.228 4.228 4.228 . 0 0 "[ ]" 2
186 1 90 LEU MD1 2 86 LEU MD1 4.000 . 6.000 4.480 4.480 4.480 . 0 0 "[ ]" 2
187 1 87 ALA HA 2 86 LEU MD1 3.000 . 3.800 3.521 3.521 3.521 . 0 0 "[ ]" 2
188 1 83 THR MG 2 86 LEU MD2 4.000 . 6.000 3.074 3.074 3.074 . 0 0 "[ ]" 2
189 1 84 SER HA 2 86 LEU MD2 4.000 . 5.500 4.567 4.567 4.567 . 0 0 "[ ]" 2
190 1 86 LEU MD1 2 86 LEU MD2 4.000 . 6.000 4.229 4.229 4.229 . 0 0 "[ ]" 2
191 1 87 ALA HA 2 86 LEU MD2 3.000 . 3.800 2.835 2.835 2.835 . 0 0 "[ ]" 2
192 1 90 LEU MD1 2 86 LEU MD2 4.000 . 7.000 3.152 3.152 3.152 . 0 0 "[ ]" 2
193 1 23 TYR QE 3 86 LEU MD1 4.000 . 6.500 3.331 3.331 3.331 . 0 0 "[ ]" 2
194 1 84 SER HA 3 86 LEU MD1 4.000 . 6.500 4.045 4.045 4.045 . 0 0 "[ ]" 2
195 1 86 LEU MD2 3 86 LEU MD1 3.000 . 5.000 4.231 4.231 4.231 . 0 0 "[ ]" 2
196 1 90 LEU MD1 3 86 LEU MD1 4.000 . 6.000 4.482 4.482 4.482 . 0 0 "[ ]" 2
197 1 87 ALA HA 3 86 LEU MD1 3.000 . 3.800 3.520 3.520 3.520 . 0 0 "[ ]" 2
198 1 83 THR MG 3 86 LEU MD2 4.000 . 6.000 3.078 3.078 3.078 . 0 0 "[ ]" 2
199 1 84 SER HA 3 86 LEU MD2 4.000 . 5.500 4.571 4.571 4.571 . 0 0 "[ ]" 2
200 1 86 LEU MD1 3 86 LEU MD2 4.000 . 6.000 4.230 4.230 4.230 . 0 0 "[ ]" 2
201 1 87 ALA HA 3 86 LEU MD2 3.000 . 3.800 2.829 2.829 2.829 . 0 0 "[ ]" 2
202 1 90 LEU MD1 3 86 LEU MD2 4.000 . 7.000 3.151 3.151 3.151 . 0 0 "[ ]" 2
203 1 90 LEU MD1 2 87 ALA HA 4.000 . 5.500 2.549 2.549 2.549 . 0 0 "[ ]" 2
204 1 90 LEU MD1 2 90 LEU MD1 2.500 . 3.700 1.826 1.826 1.826 . 0 0 "[ ]" 2
205 1 90 LEU MD1 2 90 LEU MD2 4.000 . 6.000 3.155 3.155 3.155 . 0 0 "[ ]" 2
206 1 90 LEU MD2 2 23 TYR QE 4.000 . 5.500 4.035 4.035 4.035 . 0 0 "[ ]" 2
207 1 90 LEU MD2 2 23 TYR QD 4.000 . 6.500 5.217 5.217 5.217 . 0 0 "[ ]" 2
208 1 90 LEU MD2 2 87 ALA HA 4.000 . 5.500 3.166 3.166 3.166 . 0 0 "[ ]" 2
209 1 90 LEU MD2 2 90 LEU MD1 4.000 . 6.000 3.152 3.152 3.152 . 0 0 "[ ]" 2
210 1 90 LEU MD2 2 90 LEU MD2 4.000 . 7.000 3.853 3.853 3.853 . 0 0 "[ ]" 2
211 1 90 LEU MD2 2 91 ILE MD 4.000 . 6.000 3.214 3.214 3.214 . 0 0 "[ ]" 2
212 1 90 LEU MD2 2 91 ILE HA 4.000 . 6.500 3.626 3.626 3.626 . 0 0 "[ ]" 2
213 1 90 LEU MD2 2 94 LEU HG 4.000 . 5.500 4.201 4.201 4.201 . 0 0 "[ ]" 2
214 1 90 LEU MD2 2 94 LEU MD2 3.000 . 4.300 3.904 3.904 3.904 . 0 0 "[ ]" 2
215 1 90 LEU HA 2 94 LEU MD2 4.000 . 5.500 4.807 4.807 4.807 . 0 0 "[ ]" 2
216 1 87 ALA HA 2 90 LEU MD1 4.000 . 5.500 2.553 2.553 2.553 . 0 0 "[ ]" 2
217 1 90 LEU MD2 2 90 LEU MD1 4.000 . 6.000 3.153 3.153 3.153 . 0 0 "[ ]" 2
218 1 23 TYR QE 2 90 LEU MD2 4.000 . 5.500 4.040 4.040 4.040 . 0 0 "[ ]" 2
219 1 23 TYR QD 2 90 LEU MD2 4.000 . 6.500 5.219 5.219 5.219 . 0 0 "[ ]" 2
220 1 87 ALA HA 2 90 LEU MD2 4.000 . 5.500 3.166 3.166 3.166 . 0 0 "[ ]" 2
221 1 90 LEU MD1 2 90 LEU MD2 4.000 . 6.000 3.153 3.153 3.153 . 0 0 "[ ]" 2
222 1 91 ILE MD 2 90 LEU MD2 4.000 . 6.000 3.215 3.215 3.215 . 0 0 "[ ]" 2
223 1 91 ILE HA 2 90 LEU MD2 4.000 . 6.500 3.624 3.624 3.624 . 0 0 "[ ]" 2
224 1 94 LEU HG 2 90 LEU MD2 4.000 . 5.500 4.196 4.196 4.196 . 0 0 "[ ]" 2
225 1 94 LEU MD2 2 90 LEU MD2 3.000 . 4.300 3.903 3.903 3.903 . 0 0 "[ ]" 2
226 1 94 LEU MD2 2 90 LEU HA 4.000 . 5.500 4.804 4.804 4.804 . 0 0 "[ ]" 2
227 1 87 ALA HA 3 90 LEU MD1 4.000 . 5.500 2.554 2.554 2.554 . 0 0 "[ ]" 2
228 1 90 LEU MD2 3 90 LEU MD1 4.000 . 6.000 3.153 3.153 3.153 . 0 0 "[ ]" 2
229 1 23 TYR QE 3 90 LEU MD2 4.000 . 5.500 4.043 4.043 4.043 . 0 0 "[ ]" 2
230 1 23 TYR QD 3 90 LEU MD2 4.000 . 6.500 5.221 5.221 5.221 . 0 0 "[ ]" 2
231 1 87 ALA HA 3 90 LEU MD2 4.000 . 5.500 3.174 3.174 3.174 . 0 0 "[ ]" 2
232 1 90 LEU MD1 3 90 LEU MD2 4.000 . 6.000 3.155 3.155 3.155 . 0 0 "[ ]" 2
233 1 91 ILE MD 3 90 LEU MD2 4.000 . 6.000 3.217 3.217 3.217 . 0 0 "[ ]" 2
234 1 91 ILE HA 3 90 LEU MD2 4.000 . 6.500 3.623 3.623 3.623 . 0 0 "[ ]" 2
235 1 94 LEU HG 3 90 LEU MD2 4.000 . 5.500 4.195 4.195 4.195 . 0 0 "[ ]" 2
236 1 94 LEU MD2 3 90 LEU MD2 3.000 . 4.300 3.901 3.901 3.901 . 0 0 "[ ]" 2
237 1 94 LEU MD2 3 90 LEU HA 4.000 . 5.500 4.803 4.803 4.803 . 0 0 "[ ]" 2
238 1 23 TYR H 1 91 ILE MD 3.000 . 4.000 3.258 3.258 3.258 . 0 0 "[ ]" 2
239 2 23 TYR H 2 91 ILE MD 3.000 . 4.000 3.265 3.265 3.265 . 0 0 "[ ]" 2
240 3 23 TYR H 3 91 ILE MD 3.000 . 4.000 3.260 3.260 3.260 . 0 0 "[ ]" 2
241 1 94 LEU MD1 2 97 LEU MD1 3.000 . 4.300 3.766 3.766 3.766 . 0 0 "[ ]" 2
242 1 94 LEU MD2 2 97 LEU MD1 4.000 . 6.000 1.921 1.921 1.921 . 0 0 "[ ]" 2
243 1 94 LEU MD2 2 94 LEU MD1 3.000 . 4.300 3.302 3.302 3.302 . 0 0 "[ ]" 2
244 1 97 LEU MD1 2 94 LEU MD1 3.000 . 4.300 3.765 3.765 3.765 . 0 0 "[ ]" 2
245 1 97 LEU MD1 2 94 LEU MD2 4.000 . 6.000 1.921 1.921 1.921 . 0 0 "[ ]" 2
246 1 94 LEU MD1 2 94 LEU MD2 3.000 . 4.300 3.303 3.303 3.303 . 0 0 "[ ]" 2
247 1 97 LEU MD1 3 94 LEU MD1 3.000 . 4.300 3.767 3.767 3.767 . 0 0 "[ ]" 2
248 1 97 LEU MD1 3 94 LEU MD2 4.000 . 6.000 1.924 1.924 1.924 . 0 0 "[ ]" 2
249 1 94 LEU MD1 3 94 LEU MD2 3.000 . 4.300 3.302 3.302 3.302 . 0 0 "[ ]" 2
250 1 97 LEU MD1 2 97 LEU MD1 3.000 . 4.300 2.301 2.301 2.301 . 0 0 "[ ]" 2
251 1 97 LEU MD1 2 97 LEU MD2 4.000 . 6.000 3.536 3.536 3.536 . 0 0 "[ ]" 2
252 1 97 LEU MD1 2 97 LEU HA 4.000 . 6.500 5.169 5.169 5.169 . 0 0 "[ ]" 2
253 1 97 LEU MD1 2 97 LEU HG 4.000 . 6.500 4.465 4.465 4.465 . 0 0 "[ ]" 2
254 1 97 LEU MD1 2 98 HIS HD2 4.000 . 6.500 5.095 5.095 5.095 . 0 0 "[ ]" 2
255 1 97 LEU MD2 2 97 LEU HA 4.000 . 5.500 5.154 5.154 5.154 . 0 0 "[ ]" 2
256 1 97 LEU MD2 2 97 LEU HG 4.000 . 5.500 5.345 5.345 5.345 . 0 0 "[ ]" 2
257 1 97 LEU MD2 2 97 LEU MD2 4.000 . 7.000 3.998 3.998 3.998 . 0 0 "[ ]" 2
258 1 97 LEU MD2 2 98 HIS HE1 4.000 . 5.500 2.850 2.850 2.850 . 0 0 "[ ]" 2
259 1 97 LEU MD2 2 98 HIS HD2 4.000 . 5.500 3.141 3.141 3.141 . 0 0 "[ ]" 2
260 1 97 LEU MD2 2 101 LEU HG 4.000 . 5.500 4.226 4.226 4.226 . 0 0 "[ ]" 2
261 1 97 LEU MD2 2 101 LEU MD1 3.000 . 4.300 2.089 2.089 2.089 . 0 0 "[ ]" 2
262 1 97 LEU MD2 2 101 LEU MD2 4.000 . 6.000 3.756 3.756 3.756 . 0 0 "[ ]" 2
263 1 97 LEU HA 2 101 LEU MD1 4.000 . 5.500 3.799 3.799 3.799 . 0 0 "[ ]" 2
264 1 97 LEU MD2 2 97 LEU MD1 4.000 . 6.000 3.535 3.535 3.535 . 0 0 "[ ]" 2
265 1 97 LEU HA 2 97 LEU MD1 4.000 . 6.500 5.163 5.163 5.163 . 0 0 "[ ]" 2
266 1 97 LEU HG 2 97 LEU MD1 4.000 . 6.500 4.465 4.465 4.465 . 0 0 "[ ]" 2
267 1 98 HIS HD2 2 97 LEU MD1 4.000 . 6.500 5.096 5.096 5.096 . 0 0 "[ ]" 2
268 1 97 LEU HA 2 97 LEU MD2 4.000 . 5.500 5.150 5.150 5.150 . 0 0 "[ ]" 2
269 1 97 LEU HG 2 97 LEU MD2 4.000 . 5.500 5.350 5.350 5.350 . 0 0 "[ ]" 2
270 1 98 HIS HE1 2 97 LEU MD2 4.000 . 5.500 2.853 2.853 2.853 . 0 0 "[ ]" 2
271 1 98 HIS HD2 2 97 LEU MD2 4.000 . 5.500 3.159 3.159 3.159 . 0 0 "[ ]" 2
272 1 101 LEU HG 2 97 LEU MD2 4.000 . 5.500 4.187 4.187 4.187 . 0 0 "[ ]" 2
273 1 101 LEU MD1 2 97 LEU MD2 3.000 . 4.300 2.000 2.000 2.000 . 0 0 "[ ]" 2
274 1 101 LEU MD2 2 97 LEU MD2 4.000 . 6.000 3.743 3.743 3.743 . 0 0 "[ ]" 2
275 1 101 LEU MD1 2 97 LEU HA 4.000 . 5.500 3.703 3.703 3.703 . 0 0 "[ ]" 2
276 1 97 LEU MD2 3 97 LEU MD1 4.000 . 6.000 3.538 3.538 3.538 . 0 0 "[ ]" 2
277 1 97 LEU HA 3 97 LEU MD1 4.000 . 6.500 5.168 5.168 5.168 . 0 0 "[ ]" 2
278 1 97 LEU HG 3 97 LEU MD1 4.000 . 6.500 4.465 4.465 4.465 . 0 0 "[ ]" 2
279 1 98 HIS HD2 3 97 LEU MD1 4.000 . 6.500 5.099 5.099 5.099 . 0 0 "[ ]" 2
280 1 97 LEU HA 3 97 LEU MD2 4.000 . 5.500 5.159 5.159 5.159 . 0 0 "[ ]" 2
281 1 97 LEU HG 3 97 LEU MD2 4.000 . 5.500 5.349 5.349 5.349 . 0 0 "[ ]" 2
282 1 98 HIS HE1 3 97 LEU MD2 4.000 . 5.500 2.852 2.852 2.852 . 0 0 "[ ]" 2
283 1 98 HIS HD2 3 97 LEU MD2 4.000 . 5.500 3.157 3.157 3.157 . 0 0 "[ ]" 2
284 1 101 LEU HG 3 97 LEU MD2 4.000 . 5.500 4.276 4.276 4.276 . 0 0 "[ ]" 2
285 1 101 LEU MD1 3 97 LEU MD2 3.000 . 4.300 2.122 2.122 2.122 . 0 0 "[ ]" 2
286 1 101 LEU MD2 3 97 LEU MD2 4.000 . 6.000 3.789 3.789 3.789 . 0 0 "[ ]" 2
287 1 101 LEU MD1 3 97 LEU HA 4.000 . 5.500 3.840 3.840 3.840 . 0 0 "[ ]" 2
288 1 101 LEU MD1 2 100 LYS HA 4.000 . 5.500 5.517 5.517 5.517 0.017 1 0 "[ ]" 2
289 1 101 LEU MD1 2 101 LEU HA 4.000 . 6.500 4.430 4.430 4.430 . 0 0 "[ ]" 2
290 1 101 LEU MD1 2 101 LEU MD1 4.000 . 6.000 3.001 3.001 3.001 . 0 0 "[ ]" 2
291 1 101 LEU MD1 2 101 LEU MD2 3.000 . 4.300 2.925 2.925 2.925 . 0 0 "[ ]" 2
292 1 101 LEU MD2 2 100 LYS HA 4.000 . 5.500 5.312 5.312 5.312 . 0 0 "[ ]" 2
293 1 101 LEU MD2 2 101 LEU HA 3.000 . 3.800 3.049 3.049 3.049 . 0 0 "[ ]" 2
294 1 101 LEU MD2 2 101 LEU MD1 3.000 . 4.300 2.927 2.927 2.927 . 0 0 "[ ]" 2
295 1 101 LEU MD2 2 101 LEU MD2 2.500 . 3.700 1.755 1.755 1.755 0.045 1 0 "[ ]" 2
296 1 100 LYS HA 2 101 LEU MD1 4.000 . 5.500 5.526 5.526 5.526 0.026 1 0 "[ ]" 2
297 1 101 LEU HA 2 101 LEU MD1 4.000 . 6.500 4.378 4.378 4.378 . 0 0 "[ ]" 2
298 1 101 LEU MD2 2 101 LEU MD1 3.000 . 4.300 2.934 2.934 2.934 . 0 0 "[ ]" 2
299 1 100 LYS HA 2 101 LEU MD2 4.000 . 5.500 5.325 5.325 5.325 . 0 0 "[ ]" 2
300 1 101 LEU HA 2 101 LEU MD2 3.000 . 3.800 2.938 2.938 2.938 . 0 0 "[ ]" 2
301 1 101 LEU MD1 2 101 LEU MD2 3.000 . 4.300 2.914 2.914 2.914 . 0 0 "[ ]" 2
302 1 100 LYS HA 3 101 LEU MD1 4.000 . 5.500 5.560 5.560 5.560 0.060 1 0 "[ ]" 2
303 1 101 LEU HA 3 101 LEU MD1 4.000 . 6.500 4.330 4.330 4.330 . 0 0 "[ ]" 2
304 1 101 LEU MD2 3 101 LEU MD1 3.000 . 4.300 2.896 2.896 2.896 . 0 0 "[ ]" 2
305 1 100 LYS HA 3 101 LEU MD2 4.000 . 5.500 5.333 5.333 5.333 . 0 0 "[ ]" 2
306 1 101 LEU HA 3 101 LEU MD2 3.000 . 3.800 2.934 2.934 2.934 . 0 0 "[ ]" 2
307 1 101 LEU MD1 3 101 LEU MD2 3.000 . 4.300 2.912 2.912 2.912 . 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 462
_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 3 GLU 0.000 0.000 . 0 "[ ]"
1 4 LEU 0.000 0.000 . 0 "[ ]"
1 5 GLU 0.000 0.000 . 0 "[ ]"
1 6 GLU 0.000 0.000 . 0 "[ ]"
1 7 VAL 0.000 0.000 . 0 "[ ]"
1 8 VAL 0.000 0.000 . 0 "[ ]"
1 9 MET 0.000 0.000 . 0 "[ ]"
1 10 GLY 0.000 0.000 . 0 "[ ]"
1 11 LEU 0.000 0.000 . 0 "[ ]"
1 12 ILE 0.000 0.000 . 0 "[ ]"
1 13 ILE 0.000 0.000 . 0 "[ ]"
1 14 ASN 0.000 0.000 . 0 "[ ]"
1 15 SER 0.000 0.000 . 0 "[ ]"
1 16 GLY 0.000 0.000 . 0 "[ ]"
1 17 GLN 0.000 0.000 . 0 "[ ]"
1 18 ALA 0.000 0.000 . 0 "[ ]"
1 19 ARG 0.000 0.000 . 0 "[ ]"
1 20 SER 0.000 0.000 . 0 "[ ]"
1 21 LEU 0.000 0.000 . 0 "[ ]"
1 22 ALA 0.000 0.000 . 0 "[ ]"
1 23 TYR 0.000 0.000 . 0 "[ ]"
1 24 ALA 0.000 0.000 . 0 "[ ]"
1 25 ALA 0.000 0.000 . 0 "[ ]"
1 26 LEU 0.000 0.000 . 0 "[ ]"
1 27 LYS 0.000 0.000 . 0 "[ ]"
1 28 GLN 0.000 0.000 . 0 "[ ]"
1 29 ALA 0.000 0.000 . 0 "[ ]"
1 30 LYS 0.000 0.000 . 0 "[ ]"
1 31 GLN 0.000 0.000 . 0 "[ ]"
1 33 ASP 0.000 0.000 . 0 "[ ]"
1 34 PHE 0.000 0.000 . 0 "[ ]"
1 35 ALA 0.000 0.000 . 0 "[ ]"
1 36 ALA 0.000 0.000 . 0 "[ ]"
1 37 ALA 0.000 0.000 . 0 "[ ]"
1 38 LYS 0.000 0.000 . 0 "[ ]"
1 39 ALA 0.000 0.000 . 0 "[ ]"
1 40 MET 0.000 0.000 . 0 "[ ]"
1 41 MET 0.000 0.000 . 0 "[ ]"
1 42 ASP 0.000 0.000 . 0 "[ ]"
1 43 GLN 0.000 0.000 . 0 "[ ]"
1 44 SER 0.000 0.000 . 0 "[ ]"
1 45 ARG 0.000 0.000 . 0 "[ ]"
1 46 MET 0.000 0.000 . 0 "[ ]"
1 47 ALA 0.000 0.000 . 0 "[ ]"
1 48 LEU 0.000 0.000 . 0 "[ ]"
1 49 ASN 0.000 0.000 . 0 "[ ]"
1 50 GLU 0.000 0.000 . 0 "[ ]"
1 51 ALA 0.000 0.000 . 0 "[ ]"
1 52 HIS 0.000 0.000 . 0 "[ ]"
1 53 LEU 0.000 0.000 . 0 "[ ]"
1 54 VAL 0.000 0.000 . 0 "[ ]"
1 55 GLN 0.000 0.000 . 0 "[ ]"
1 56 THR 0.000 0.000 . 0 "[ ]"
1 57 LYS 0.000 0.000 . 0 "[ ]"
1 58 LEU 0.000 0.000 . 0 "[ ]"
1 59 ILE 0.000 0.000 . 0 "[ ]"
1 60 GLU 0.000 0.000 . 0 "[ ]"
1 71 SER 0.000 0.000 . 0 "[ ]"
1 72 LEU 0.000 0.000 . 0 "[ ]"
1 73 VAL 0.000 0.000 . 0 "[ ]"
1 74 LEU 0.000 0.000 . 0 "[ ]"
1 75 VAL 0.000 0.000 . 0 "[ ]"
1 76 HIS 0.000 0.000 . 0 "[ ]"
1 77 ALA 0.000 0.000 . 0 "[ ]"
1 78 GLN 0.000 0.000 . 0 "[ ]"
1 79 LEU 0.000 0.000 . 0 "[ ]"
1 80 HIS 0.000 0.000 . 0 "[ ]"
1 81 LEU 0.000 0.000 . 0 "[ ]"
1 82 MET 0.000 0.000 . 0 "[ ]"
1 83 THR 0.000 0.000 . 0 "[ ]"
1 84 SER 0.000 0.000 . 0 "[ ]"
1 85 MET 0.000 0.000 . 0 "[ ]"
1 86 LEU 0.000 0.000 . 0 "[ ]"
1 87 ALA 0.000 0.000 . 0 "[ ]"
1 88 ARG 0.000 0.000 . 0 "[ ]"
1 89 GLU 0.000 0.000 . 0 "[ ]"
1 90 LEU 0.000 0.000 . 0 "[ ]"
1 91 ILE 0.000 0.000 . 0 "[ ]"
1 92 THR 0.000 0.000 . 0 "[ ]"
1 93 GLU 0.000 0.000 . 0 "[ ]"
1 94 LEU 0.000 0.000 . 0 "[ ]"
1 95 ILE 0.000 0.000 . 0 "[ ]"
1 96 GLU 0.000 0.000 . 0 "[ ]"
1 97 LEU 0.000 0.000 . 0 "[ ]"
1 98 HIS 0.000 0.000 . 0 "[ ]"
1 99 GLU 0.000 0.000 . 0 "[ ]"
1 100 LYS 0.000 0.000 . 0 "[ ]"
1 101 LEU 0.000 0.000 . 0 "[ ]"
2 3 GLU 0.000 0.000 . 0 "[ ]"
2 4 LEU 0.000 0.000 . 0 "[ ]"
2 5 GLU 0.000 0.000 . 0 "[ ]"
2 6 GLU 0.000 0.000 . 0 "[ ]"
2 7 VAL 0.000 0.000 . 0 "[ ]"
2 8 VAL 0.000 0.000 . 0 "[ ]"
2 9 MET 0.000 0.000 . 0 "[ ]"
2 10 GLY 0.000 0.000 . 0 "[ ]"
2 11 LEU 0.000 0.000 . 0 "[ ]"
2 12 ILE 0.000 0.000 . 0 "[ ]"
2 13 ILE 0.000 0.000 . 0 "[ ]"
2 14 ASN 0.000 0.000 . 0 "[ ]"
2 15 SER 0.000 0.000 . 0 "[ ]"
2 16 GLY 0.000 0.000 . 0 "[ ]"
2 17 GLN 0.000 0.000 . 0 "[ ]"
2 18 ALA 0.000 0.000 . 0 "[ ]"
2 19 ARG 0.000 0.000 . 0 "[ ]"
2 20 SER 0.000 0.000 . 0 "[ ]"
2 21 LEU 0.000 0.000 . 0 "[ ]"
2 22 ALA 0.000 0.000 . 0 "[ ]"
2 23 TYR 0.000 0.000 . 0 "[ ]"
2 24 ALA 0.000 0.000 . 0 "[ ]"
2 25 ALA 0.000 0.000 . 0 "[ ]"
2 26 LEU 0.000 0.000 . 0 "[ ]"
2 27 LYS 0.000 0.000 . 0 "[ ]"
2 28 GLN 0.000 0.000 . 0 "[ ]"
2 29 ALA 0.000 0.000 . 0 "[ ]"
2 30 LYS 0.000 0.000 . 0 "[ ]"
2 31 GLN 0.000 0.000 . 0 "[ ]"
2 33 ASP 0.000 0.000 . 0 "[ ]"
2 34 PHE 0.000 0.000 . 0 "[ ]"
2 35 ALA 0.000 0.000 . 0 "[ ]"
2 36 ALA 0.000 0.000 . 0 "[ ]"
2 37 ALA 0.000 0.000 . 0 "[ ]"
2 38 LYS 0.000 0.000 . 0 "[ ]"
2 39 ALA 0.000 0.000 . 0 "[ ]"
2 40 MET 0.000 0.000 . 0 "[ ]"
2 41 MET 0.000 0.000 . 0 "[ ]"
2 42 ASP 0.000 0.000 . 0 "[ ]"
2 43 GLN 0.000 0.000 . 0 "[ ]"
2 44 SER 0.000 0.000 . 0 "[ ]"
2 45 ARG 0.000 0.000 . 0 "[ ]"
2 46 MET 0.000 0.000 . 0 "[ ]"
2 47 ALA 0.000 0.000 . 0 "[ ]"
2 48 LEU 0.000 0.000 . 0 "[ ]"
2 49 ASN 0.000 0.000 . 0 "[ ]"
2 50 GLU 0.000 0.000 . 0 "[ ]"
2 51 ALA 0.000 0.000 . 0 "[ ]"
2 52 HIS 0.000 0.000 . 0 "[ ]"
2 53 LEU 0.000 0.000 . 0 "[ ]"
2 54 VAL 0.000 0.000 . 0 "[ ]"
2 55 GLN 0.000 0.000 . 0 "[ ]"
2 56 THR 0.000 0.000 . 0 "[ ]"
2 57 LYS 0.000 0.000 . 0 "[ ]"
2 58 LEU 0.000 0.000 . 0 "[ ]"
2 59 ILE 0.000 0.000 . 0 "[ ]"
2 60 GLU 0.000 0.000 . 0 "[ ]"
2 71 SER 0.000 0.000 . 0 "[ ]"
2 72 LEU 0.000 0.000 . 0 "[ ]"
2 73 VAL 0.000 0.000 . 0 "[ ]"
2 74 LEU 0.000 0.000 . 0 "[ ]"
2 75 VAL 0.000 0.000 . 0 "[ ]"
2 76 HIS 0.000 0.000 . 0 "[ ]"
2 77 ALA 0.000 0.000 . 0 "[ ]"
2 78 GLN 0.000 0.000 . 0 "[ ]"
2 79 LEU 0.000 0.000 . 0 "[ ]"
2 80 HIS 0.000 0.000 . 0 "[ ]"
2 81 LEU 0.000 0.000 . 0 "[ ]"
2 82 MET 0.000 0.000 . 0 "[ ]"
2 83 THR 0.000 0.000 . 0 "[ ]"
2 84 SER 0.000 0.000 . 0 "[ ]"
2 85 MET 0.000 0.000 . 0 "[ ]"
2 86 LEU 0.000 0.000 . 0 "[ ]"
2 87 ALA 0.000 0.000 . 0 "[ ]"
2 88 ARG 0.000 0.000 . 0 "[ ]"
2 89 GLU 0.000 0.000 . 0 "[ ]"
2 90 LEU 0.000 0.000 . 0 "[ ]"
2 91 ILE 0.000 0.000 . 0 "[ ]"
2 92 THR 0.000 0.000 . 0 "[ ]"
2 93 GLU 0.000 0.000 . 0 "[ ]"
2 94 LEU 0.000 0.000 . 0 "[ ]"
2 95 ILE 0.000 0.000 . 0 "[ ]"
2 96 GLU 0.000 0.000 . 0 "[ ]"
2 97 LEU 0.000 0.000 . 0 "[ ]"
2 98 HIS 0.000 0.000 . 0 "[ ]"
2 99 GLU 0.000 0.000 . 0 "[ ]"
2 100 LYS 0.000 0.000 . 0 "[ ]"
2 101 LEU 0.000 0.000 . 0 "[ ]"
3 3 GLU 0.000 0.000 . 0 "[ ]"
3 4 LEU 0.000 0.000 . 0 "[ ]"
3 5 GLU 0.000 0.000 . 0 "[ ]"
3 6 GLU 0.000 0.000 . 0 "[ ]"
3 7 VAL 0.000 0.000 . 0 "[ ]"
3 8 VAL 0.000 0.000 . 0 "[ ]"
3 9 MET 0.000 0.000 . 0 "[ ]"
3 10 GLY 0.000 0.000 . 0 "[ ]"
3 11 LEU 0.000 0.000 . 0 "[ ]"
3 12 ILE 0.000 0.000 . 0 "[ ]"
3 13 ILE 0.000 0.000 . 0 "[ ]"
3 14 ASN 0.000 0.000 . 0 "[ ]"
3 15 SER 0.000 0.000 . 0 "[ ]"
3 16 GLY 0.000 0.000 . 0 "[ ]"
3 17 GLN 0.000 0.000 . 0 "[ ]"
3 18 ALA 0.000 0.000 . 0 "[ ]"
3 19 ARG 0.000 0.000 . 0 "[ ]"
3 20 SER 0.000 0.000 . 0 "[ ]"
3 21 LEU 0.000 0.000 . 0 "[ ]"
3 22 ALA 0.000 0.000 . 0 "[ ]"
3 23 TYR 0.000 0.000 . 0 "[ ]"
3 24 ALA 0.000 0.000 . 0 "[ ]"
3 25 ALA 0.000 0.000 . 0 "[ ]"
3 26 LEU 0.000 0.000 . 0 "[ ]"
3 27 LYS 0.000 0.000 . 0 "[ ]"
3 28 GLN 0.000 0.000 . 0 "[ ]"
3 29 ALA 0.000 0.000 . 0 "[ ]"
3 30 LYS 0.000 0.000 . 0 "[ ]"
3 31 GLN 0.000 0.000 . 0 "[ ]"
3 33 ASP 0.000 0.000 . 0 "[ ]"
3 34 PHE 0.000 0.000 . 0 "[ ]"
3 35 ALA 0.000 0.000 . 0 "[ ]"
3 36 ALA 0.000 0.000 . 0 "[ ]"
3 37 ALA 0.000 0.000 . 0 "[ ]"
3 38 LYS 0.000 0.000 . 0 "[ ]"
3 39 ALA 0.000 0.000 . 0 "[ ]"
3 40 MET 0.000 0.000 . 0 "[ ]"
3 41 MET 0.000 0.000 . 0 "[ ]"
3 42 ASP 0.000 0.000 . 0 "[ ]"
3 43 GLN 0.000 0.000 . 0 "[ ]"
3 44 SER 0.000 0.000 . 0 "[ ]"
3 45 ARG 0.000 0.000 . 0 "[ ]"
3 46 MET 0.000 0.000 . 0 "[ ]"
3 47 ALA 0.000 0.000 . 0 "[ ]"
3 48 LEU 0.000 0.000 . 0 "[ ]"
3 49 ASN 0.000 0.000 . 0 "[ ]"
3 50 GLU 0.000 0.000 . 0 "[ ]"
3 51 ALA 0.000 0.000 . 0 "[ ]"
3 52 HIS 0.000 0.000 . 0 "[ ]"
3 53 LEU 0.000 0.000 . 0 "[ ]"
3 54 VAL 0.000 0.000 . 0 "[ ]"
3 55 GLN 0.000 0.000 . 0 "[ ]"
3 56 THR 0.000 0.000 . 0 "[ ]"
3 57 LYS 0.000 0.000 . 0 "[ ]"
3 58 LEU 0.000 0.000 . 0 "[ ]"
3 59 ILE 0.000 0.000 . 0 "[ ]"
3 60 GLU 0.000 0.000 . 0 "[ ]"
3 71 SER 0.000 0.000 . 0 "[ ]"
3 72 LEU 0.000 0.000 . 0 "[ ]"
3 73 VAL 0.000 0.000 . 0 "[ ]"
3 74 LEU 0.000 0.000 . 0 "[ ]"
3 75 VAL 0.000 0.000 . 0 "[ ]"
3 76 HIS 0.000 0.000 . 0 "[ ]"
3 77 ALA 0.000 0.000 . 0 "[ ]"
3 78 GLN 0.000 0.000 . 0 "[ ]"
3 79 LEU 0.000 0.000 . 0 "[ ]"
3 80 HIS 0.000 0.000 . 0 "[ ]"
3 81 LEU 0.000 0.000 . 0 "[ ]"
3 82 MET 0.000 0.000 . 0 "[ ]"
3 83 THR 0.000 0.000 . 0 "[ ]"
3 84 SER 0.000 0.000 . 0 "[ ]"
3 85 MET 0.000 0.000 . 0 "[ ]"
3 86 LEU 0.000 0.000 . 0 "[ ]"
3 87 ALA 0.000 0.000 . 0 "[ ]"
3 88 ARG 0.000 0.000 . 0 "[ ]"
3 89 GLU 0.000 0.000 . 0 "[ ]"
3 90 LEU 0.000 0.000 . 0 "[ ]"
3 91 ILE 0.000 0.000 . 0 "[ ]"
3 92 THR 0.000 0.000 . 0 "[ ]"
3 93 GLU 0.000 0.000 . 0 "[ ]"
3 94 LEU 0.000 0.000 . 0 "[ ]"
3 95 ILE 0.000 0.000 . 0 "[ ]"
3 96 GLU 0.000 0.000 . 0 "[ ]"
3 97 LEU 0.000 0.000 . 0 "[ ]"
3 98 HIS 0.000 0.000 . 0 "[ ]"
3 99 GLU 0.000 0.000 . 0 "[ ]"
3 100 LYS 0.000 0.000 . 0 "[ ]"
3 101 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 3 GLU O 1 7 VAL H 2.300 . 2.500 1.462 1.462 1.462 . 0 0 "[ ]" 3
2 1 3 GLU O 1 7 VAL N 3.300 2.300 3.500 2.404 2.404 2.404 . 0 0 "[ ]" 3
3 1 4 LEU O 1 8 VAL H 2.300 . 2.500 2.070 2.070 2.070 . 0 0 "[ ]" 3
4 1 4 LEU O 1 8 VAL N 3.300 2.300 3.500 2.950 2.950 2.950 . 0 0 "[ ]" 3
5 1 5 GLU O 1 9 MET H 2.300 . 2.500 2.298 2.298 2.298 . 0 0 "[ ]" 3
6 1 5 GLU O 1 9 MET N 3.300 2.300 3.500 3.230 3.230 3.230 . 0 0 "[ ]" 3
7 1 6 GLU O 1 10 GLY H 2.300 . 2.500 2.196 2.196 2.196 . 0 0 "[ ]" 3
8 1 6 GLU O 1 10 GLY N 3.300 2.300 3.500 3.116 3.116 3.116 . 0 0 "[ ]" 3
9 1 7 VAL O 1 11 LEU H 2.300 . 2.500 1.904 1.904 1.904 . 0 0 "[ ]" 3
10 1 7 VAL O 1 11 LEU N 3.300 2.300 3.500 2.829 2.829 2.829 . 0 0 "[ ]" 3
11 1 8 VAL O 1 12 ILE H 2.300 . 2.500 1.722 1.722 1.722 . 0 0 "[ ]" 3
12 1 8 VAL O 1 12 ILE N 3.300 2.300 3.500 2.673 2.673 2.673 . 0 0 "[ ]" 3
13 1 9 MET O 1 13 ILE H 2.300 . 2.500 1.896 1.896 1.896 . 0 0 "[ ]" 3
14 1 9 MET O 1 13 ILE N 3.300 2.300 3.500 2.844 2.844 2.844 . 0 0 "[ ]" 3
15 1 10 GLY O 1 14 ASN H 2.300 . 2.500 1.770 1.770 1.770 . 0 0 "[ ]" 3
16 1 10 GLY O 1 14 ASN N 3.300 2.300 3.500 2.699 2.699 2.699 . 0 0 "[ ]" 3
17 1 11 LEU O 1 15 SER H 2.300 . 2.500 1.743 1.743 1.743 . 0 0 "[ ]" 3
18 1 11 LEU O 1 15 SER N 3.300 2.300 3.500 2.699 2.699 2.699 . 0 0 "[ ]" 3
19 1 12 ILE O 1 16 GLY H 2.300 . 2.500 1.911 1.911 1.911 . 0 0 "[ ]" 3
20 1 12 ILE O 1 16 GLY N 3.300 2.300 3.500 2.843 2.843 2.843 . 0 0 "[ ]" 3
21 1 13 ILE O 1 17 GLN H 2.300 . 2.500 1.821 1.821 1.821 . 0 0 "[ ]" 3
22 1 13 ILE O 1 17 GLN N 3.300 2.300 3.500 2.753 2.753 2.753 . 0 0 "[ ]" 3
23 1 14 ASN O 1 18 ALA H 2.300 . 2.500 1.873 1.873 1.873 . 0 0 "[ ]" 3
24 1 14 ASN O 1 18 ALA N 3.300 2.300 3.500 2.792 2.792 2.792 . 0 0 "[ ]" 3
25 1 15 SER O 1 19 ARG H 2.300 . 2.500 2.060 2.060 2.060 . 0 0 "[ ]" 3
26 1 15 SER O 1 19 ARG N 3.300 2.300 3.500 3.022 3.022 3.022 . 0 0 "[ ]" 3
27 1 16 GLY O 1 20 SER H 2.300 . 2.500 1.906 1.906 1.906 . 0 0 "[ ]" 3
28 1 16 GLY O 1 20 SER N 3.300 2.300 3.500 2.870 2.870 2.870 . 0 0 "[ ]" 3
29 1 17 GLN O 1 21 LEU H 2.300 . 2.500 1.835 1.835 1.835 . 0 0 "[ ]" 3
30 1 17 GLN O 1 21 LEU N 3.300 2.300 3.500 2.792 2.792 2.792 . 0 0 "[ ]" 3
31 1 18 ALA O 1 22 ALA H 2.300 . 2.500 1.957 1.957 1.957 . 0 0 "[ ]" 3
32 1 18 ALA O 1 22 ALA N 3.300 2.300 3.500 2.893 2.893 2.893 . 0 0 "[ ]" 3
33 1 19 ARG O 1 23 TYR H 2.300 . 2.500 1.825 1.825 1.825 . 0 0 "[ ]" 3
34 1 19 ARG O 1 23 TYR N 3.300 2.300 3.500 2.798 2.798 2.798 . 0 0 "[ ]" 3
35 1 20 SER O 1 24 ALA H 2.300 . 2.500 2.013 2.013 2.013 . 0 0 "[ ]" 3
36 1 20 SER O 1 24 ALA N 3.300 2.300 3.500 2.943 2.943 2.943 . 0 0 "[ ]" 3
37 1 21 LEU O 1 25 ALA H 2.300 . 2.500 1.839 1.839 1.839 . 0 0 "[ ]" 3
38 1 21 LEU O 1 25 ALA N 3.300 2.300 3.500 2.726 2.726 2.726 . 0 0 "[ ]" 3
39 1 22 ALA O 1 26 LEU H 2.300 . 2.500 2.031 2.031 2.031 . 0 0 "[ ]" 3
40 1 22 ALA O 1 26 LEU N 3.300 2.300 3.500 2.965 2.965 2.965 . 0 0 "[ ]" 3
41 1 23 TYR O 1 27 LYS H 2.300 . 2.500 1.975 1.975 1.975 . 0 0 "[ ]" 3
42 1 23 TYR O 1 27 LYS N 3.300 2.300 3.500 2.926 2.926 2.926 . 0 0 "[ ]" 3
43 1 24 ALA O 1 28 GLN H 2.300 . 2.500 2.075 2.075 2.075 . 0 0 "[ ]" 3
44 1 24 ALA O 1 28 GLN N 3.300 2.300 3.500 2.983 2.983 2.983 . 0 0 "[ ]" 3
45 1 25 ALA O 1 29 ALA H 2.300 . 2.500 2.278 2.278 2.278 . 0 0 "[ ]" 3
46 1 25 ALA O 1 29 ALA N 3.300 2.300 3.500 3.184 3.184 3.184 . 0 0 "[ ]" 3
47 1 26 LEU O 1 30 LYS H 2.300 . 2.500 2.129 2.129 2.129 . 0 0 "[ ]" 3
48 1 26 LEU O 1 30 LYS N 3.300 2.300 3.500 3.046 3.046 3.046 . 0 0 "[ ]" 3
49 1 27 LYS O 1 31 GLN H 2.300 . 2.500 2.330 2.330 2.330 . 0 0 "[ ]" 3
50 1 27 LYS O 1 31 GLN N 3.300 2.300 3.500 3.144 3.144 3.144 . 0 0 "[ ]" 3
51 1 33 ASP O 1 37 ALA H 2.300 . 2.500 2.190 2.190 2.190 . 0 0 "[ ]" 3
52 1 33 ASP O 1 37 ALA N 3.300 2.300 3.500 3.088 3.088 3.088 . 0 0 "[ ]" 3
53 1 34 PHE O 1 38 LYS H 2.300 . 2.500 1.931 1.931 1.931 . 0 0 "[ ]" 3
54 1 34 PHE O 1 38 LYS N 3.300 2.300 3.500 2.897 2.897 2.897 . 0 0 "[ ]" 3
55 1 35 ALA O 1 39 ALA H 2.300 . 2.500 2.098 2.098 2.098 . 0 0 "[ ]" 3
56 1 35 ALA O 1 39 ALA N 3.300 2.300 3.500 3.046 3.046 3.046 . 0 0 "[ ]" 3
57 1 36 ALA O 1 40 MET H 2.300 . 2.500 1.920 1.920 1.920 . 0 0 "[ ]" 3
58 1 36 ALA O 1 40 MET N 3.300 2.300 3.500 2.862 2.862 2.862 . 0 0 "[ ]" 3
59 1 37 ALA O 1 41 MET H 2.300 . 2.500 1.870 1.870 1.870 . 0 0 "[ ]" 3
60 1 37 ALA O 1 41 MET N 3.300 2.300 3.500 2.806 2.806 2.806 . 0 0 "[ ]" 3
61 1 38 LYS O 1 42 ASP H 2.300 . 2.500 2.002 2.002 2.002 . 0 0 "[ ]" 3
62 1 38 LYS O 1 42 ASP N 3.300 2.300 3.500 2.946 2.946 2.946 . 0 0 "[ ]" 3
63 1 39 ALA O 1 43 GLN H 2.300 . 2.500 2.169 2.169 2.169 . 0 0 "[ ]" 3
64 1 39 ALA O 1 43 GLN N 3.300 2.300 3.500 3.124 3.124 3.124 . 0 0 "[ ]" 3
65 1 40 MET O 1 44 SER H 2.300 . 2.500 1.934 1.934 1.934 . 0 0 "[ ]" 3
66 1 40 MET O 1 44 SER N 3.300 2.300 3.500 2.851 2.851 2.851 . 0 0 "[ ]" 3
67 1 41 MET O 1 45 ARG H 2.300 . 2.500 1.995 1.995 1.995 . 0 0 "[ ]" 3
68 1 41 MET O 1 45 ARG N 3.300 2.300 3.500 2.955 2.955 2.955 . 0 0 "[ ]" 3
69 1 42 ASP O 1 46 MET H 2.300 . 2.500 2.199 2.199 2.199 . 0 0 "[ ]" 3
70 1 42 ASP O 1 46 MET N 3.300 2.300 3.500 3.128 3.128 3.128 . 0 0 "[ ]" 3
71 1 43 GLN O 1 47 ALA H 2.300 . 2.500 2.080 2.080 2.080 . 0 0 "[ ]" 3
72 1 43 GLN O 1 47 ALA N 3.300 2.300 3.500 3.015 3.015 3.015 . 0 0 "[ ]" 3
73 1 44 SER O 1 48 LEU H 2.300 . 2.500 2.146 2.146 2.146 . 0 0 "[ ]" 3
74 1 44 SER O 1 48 LEU N 3.300 2.300 3.500 3.068 3.068 3.068 . 0 0 "[ ]" 3
75 1 45 ARG O 1 49 ASN H 2.300 . 2.500 1.787 1.787 1.787 . 0 0 "[ ]" 3
76 1 45 ARG O 1 49 ASN N 3.300 2.300 3.500 2.720 2.720 2.720 . 0 0 "[ ]" 3
77 1 46 MET O 1 50 GLU H 2.300 . 2.500 2.068 2.068 2.068 . 0 0 "[ ]" 3
78 1 46 MET O 1 50 GLU N 3.300 2.300 3.500 3.021 3.021 3.021 . 0 0 "[ ]" 3
79 1 47 ALA O 1 51 ALA H 2.300 . 2.500 2.137 2.137 2.137 . 0 0 "[ ]" 3
80 1 47 ALA O 1 51 ALA N 3.300 2.300 3.500 3.030 3.030 3.030 . 0 0 "[ ]" 3
81 1 48 LEU O 1 52 HIS H 2.300 . 2.500 1.659 1.659 1.659 . 0 0 "[ ]" 3
82 1 48 LEU O 1 52 HIS N 3.300 2.300 3.500 2.617 2.617 2.617 . 0 0 "[ ]" 3
83 1 49 ASN O 1 53 LEU H 2.300 . 2.500 1.981 1.981 1.981 . 0 0 "[ ]" 3
84 1 49 ASN O 1 53 LEU N 3.300 2.300 3.500 2.884 2.884 2.884 . 0 0 "[ ]" 3
85 1 50 GLU O 1 54 VAL H 2.300 . 2.500 2.209 2.209 2.209 . 0 0 "[ ]" 3
86 1 50 GLU O 1 54 VAL N 3.300 2.300 3.500 3.128 3.128 3.128 . 0 0 "[ ]" 3
87 1 51 ALA O 1 55 GLN H 2.300 . 2.500 2.073 2.073 2.073 . 0 0 "[ ]" 3
88 1 51 ALA O 1 55 GLN N 3.300 2.300 3.500 3.018 3.018 3.018 . 0 0 "[ ]" 3
89 1 52 HIS O 1 56 THR H 2.300 . 2.500 1.881 1.881 1.881 . 0 0 "[ ]" 3
90 1 52 HIS O 1 56 THR N 3.300 2.300 3.500 2.816 2.816 2.816 . 0 0 "[ ]" 3
91 1 53 LEU O 1 57 LYS H 2.300 . 2.500 2.208 2.208 2.208 . 0 0 "[ ]" 3
92 1 53 LEU O 1 57 LYS N 3.300 2.300 3.500 3.147 3.147 3.147 . 0 0 "[ ]" 3
93 1 54 VAL O 1 58 LEU H 2.300 . 2.500 2.161 2.161 2.161 . 0 0 "[ ]" 3
94 1 54 VAL O 1 58 LEU N 3.300 2.300 3.500 3.067 3.067 3.067 . 0 0 "[ ]" 3
95 1 55 GLN O 1 59 ILE H 2.300 . 2.500 1.749 1.749 1.749 . 0 0 "[ ]" 3
96 1 55 GLN O 1 59 ILE N 3.300 2.300 3.500 2.715 2.715 2.715 . 0 0 "[ ]" 3
97 1 56 THR O 1 60 GLU H 2.300 . 2.500 1.796 1.796 1.796 . 0 0 "[ ]" 3
98 1 56 THR O 1 60 GLU N 3.300 2.300 3.500 2.719 2.719 2.719 . 0 0 "[ ]" 3
99 1 71 SER OG 1 74 LEU H 2.300 . 2.500 2.170 2.170 2.170 . 0 0 "[ ]" 3
100 1 71 SER OG 1 74 LEU N 3.300 2.300 3.500 3.134 3.134 3.134 . 0 0 "[ ]" 3
101 1 71 SER O 1 75 VAL H 2.300 . 2.500 1.884 1.884 1.884 . 0 0 "[ ]" 3
102 1 71 SER O 1 75 VAL N 3.300 2.300 3.500 2.854 2.854 2.854 . 0 0 "[ ]" 3
103 1 72 LEU O 1 76 HIS H 2.300 . 2.500 2.338 2.338 2.338 . 0 0 "[ ]" 3
104 1 72 LEU O 1 76 HIS N 3.300 2.300 3.500 3.297 3.297 3.297 . 0 0 "[ ]" 3
105 1 73 VAL O 1 77 ALA H 2.300 . 2.500 2.273 2.273 2.273 . 0 0 "[ ]" 3
106 1 73 VAL O 1 77 ALA N 3.300 2.300 3.500 3.215 3.215 3.215 . 0 0 "[ ]" 3
107 1 74 LEU O 1 78 GLN H 2.300 . 2.500 1.760 1.760 1.760 . 0 0 "[ ]" 3
108 1 74 LEU O 1 78 GLN N 3.300 2.300 3.500 2.701 2.701 2.701 . 0 0 "[ ]" 3
109 1 75 VAL O 1 79 LEU H 2.300 . 2.500 1.862 1.862 1.862 . 0 0 "[ ]" 3
110 1 75 VAL O 1 79 LEU N 3.300 2.300 3.500 2.796 2.796 2.796 . 0 0 "[ ]" 3
111 1 76 HIS O 1 80 HIS H 2.300 . 2.500 2.306 2.306 2.306 . 0 0 "[ ]" 3
112 1 76 HIS O 1 80 HIS N 3.300 2.300 3.500 3.254 3.254 3.254 . 0 0 "[ ]" 3
113 1 77 ALA O 1 81 LEU H 2.300 . 2.500 1.979 1.979 1.979 . 0 0 "[ ]" 3
114 1 77 ALA O 1 81 LEU N 3.300 2.300 3.500 2.950 2.950 2.950 . 0 0 "[ ]" 3
115 1 78 GLN O 1 82 MET H 2.300 . 2.500 1.650 1.650 1.650 . 0 0 "[ ]" 3
116 1 78 GLN O 1 82 MET N 3.300 2.300 3.500 2.603 2.603 2.603 . 0 0 "[ ]" 3
117 1 79 LEU O 1 83 THR H 2.300 . 2.500 2.069 2.069 2.069 . 0 0 "[ ]" 3
118 1 79 LEU O 1 83 THR N 3.300 2.300 3.500 2.994 2.994 2.994 . 0 0 "[ ]" 3
119 1 80 HIS O 1 84 SER H 2.300 . 2.500 1.885 1.885 1.885 . 0 0 "[ ]" 3
120 1 80 HIS O 1 84 SER N 3.300 2.300 3.500 2.830 2.830 2.830 . 0 0 "[ ]" 3
121 1 81 LEU O 1 85 MET H 2.300 . 2.500 1.824 1.824 1.824 . 0 0 "[ ]" 3
122 1 81 LEU O 1 85 MET N 3.300 2.300 3.500 2.794 2.794 2.794 . 0 0 "[ ]" 3
123 1 82 MET O 1 86 LEU H 2.300 . 2.500 2.029 2.029 2.029 . 0 0 "[ ]" 3
124 1 82 MET O 1 86 LEU N 3.300 2.300 3.500 2.977 2.977 2.977 . 0 0 "[ ]" 3
125 1 83 THR O 1 87 ALA H 2.300 . 2.500 1.889 1.889 1.889 . 0 0 "[ ]" 3
126 1 83 THR O 1 87 ALA N 3.300 2.300 3.500 2.828 2.828 2.828 . 0 0 "[ ]" 3
127 1 84 SER O 1 88 ARG H 2.300 . 2.500 1.847 1.847 1.847 . 0 0 "[ ]" 3
128 1 84 SER O 1 88 ARG N 3.300 2.300 3.500 2.805 2.805 2.805 . 0 0 "[ ]" 3
129 1 85 MET O 1 89 GLU H 2.300 . 2.500 1.903 1.903 1.903 . 0 0 "[ ]" 3
130 1 85 MET O 1 89 GLU N 3.300 2.300 3.500 2.852 2.852 2.852 . 0 0 "[ ]" 3
131 1 86 LEU O 1 90 LEU H 2.300 . 2.500 1.923 1.923 1.923 . 0 0 "[ ]" 3
132 1 86 LEU O 1 90 LEU N 3.300 2.300 3.500 2.890 2.890 2.890 . 0 0 "[ ]" 3
133 1 87 ALA O 1 91 ILE H 2.300 . 2.500 1.819 1.819 1.819 . 0 0 "[ ]" 3
134 1 87 ALA O 1 91 ILE N 3.300 2.300 3.500 2.754 2.754 2.754 . 0 0 "[ ]" 3
135 1 88 ARG O 1 92 THR H 2.300 . 2.500 1.964 1.964 1.964 . 0 0 "[ ]" 3
136 1 88 ARG O 1 92 THR N 3.300 2.300 3.500 2.854 2.854 2.854 . 0 0 "[ ]" 3
137 1 89 GLU O 1 93 GLU H 2.300 . 2.500 2.231 2.231 2.231 . 0 0 "[ ]" 3
138 1 89 GLU O 1 93 GLU N 3.300 2.300 3.500 3.152 3.152 3.152 . 0 0 "[ ]" 3
139 1 90 LEU O 1 94 LEU H 2.300 . 2.500 1.915 1.915 1.915 . 0 0 "[ ]" 3
140 1 90 LEU O 1 94 LEU N 3.300 2.300 3.500 2.859 2.859 2.859 . 0 0 "[ ]" 3
141 1 91 ILE O 1 95 ILE H 2.300 . 2.500 1.873 1.873 1.873 . 0 0 "[ ]" 3
142 1 91 ILE O 1 95 ILE N 3.300 2.300 3.500 2.816 2.816 2.816 . 0 0 "[ ]" 3
143 1 92 THR O 1 96 GLU H 2.300 . 2.500 2.074 2.074 2.074 . 0 0 "[ ]" 3
144 1 92 THR O 1 96 GLU N 3.300 2.300 3.500 3.013 3.013 3.013 . 0 0 "[ ]" 3
145 1 93 GLU O 1 97 LEU H 2.300 . 2.500 2.170 2.170 2.170 . 0 0 "[ ]" 3
146 1 93 GLU O 1 97 LEU N 3.300 2.300 3.500 3.075 3.075 3.075 . 0 0 "[ ]" 3
147 1 94 LEU O 1 98 HIS H 2.300 . 2.500 2.258 2.258 2.258 . 0 0 "[ ]" 3
148 1 94 LEU O 1 98 HIS N 3.300 2.300 3.500 3.158 3.158 3.158 . 0 0 "[ ]" 3
149 1 95 ILE O 1 99 GLU H 2.300 . 2.500 2.230 2.230 2.230 . 0 0 "[ ]" 3
150 1 95 ILE O 1 99 GLU N 3.300 2.300 3.500 3.135 3.135 3.135 . 0 0 "[ ]" 3
151 1 96 GLU O 1 100 LYS H 2.300 . 2.500 2.134 2.134 2.134 . 0 0 "[ ]" 3
152 1 96 GLU O 1 100 LYS N 3.300 2.300 3.500 3.044 3.044 3.044 . 0 0 "[ ]" 3
153 1 97 LEU O 1 101 LEU H 2.300 . 2.500 1.997 1.997 1.997 . 0 0 "[ ]" 3
154 1 97 LEU O 1 101 LEU N 3.300 2.300 3.500 2.897 2.897 2.897 . 0 0 "[ ]" 3
155 2 3 GLU O 2 7 VAL H 2.300 . 2.500 1.460 1.460 1.460 . 0 0 "[ ]" 3
156 2 3 GLU O 2 7 VAL N 3.300 2.300 3.500 2.403 2.403 2.403 . 0 0 "[ ]" 3
157 2 4 LEU O 2 8 VAL H 2.300 . 2.500 2.070 2.070 2.070 . 0 0 "[ ]" 3
158 2 4 LEU O 2 8 VAL N 3.300 2.300 3.500 2.949 2.949 2.949 . 0 0 "[ ]" 3
159 2 5 GLU O 2 9 MET H 2.300 . 2.500 2.296 2.296 2.296 . 0 0 "[ ]" 3
160 2 5 GLU O 2 9 MET N 3.300 2.300 3.500 3.228 3.228 3.228 . 0 0 "[ ]" 3
161 2 6 GLU O 2 10 GLY H 2.300 . 2.500 2.196 2.196 2.196 . 0 0 "[ ]" 3
162 2 6 GLU O 2 10 GLY N 3.300 2.300 3.500 3.115 3.115 3.115 . 0 0 "[ ]" 3
163 2 7 VAL O 2 11 LEU H 2.300 . 2.500 1.904 1.904 1.904 . 0 0 "[ ]" 3
164 2 7 VAL O 2 11 LEU N 3.300 2.300 3.500 2.828 2.828 2.828 . 0 0 "[ ]" 3
165 2 8 VAL O 2 12 ILE H 2.300 . 2.500 1.719 1.719 1.719 . 0 0 "[ ]" 3
166 2 8 VAL O 2 12 ILE N 3.300 2.300 3.500 2.670 2.670 2.670 . 0 0 "[ ]" 3
167 2 9 MET O 2 13 ILE H 2.300 . 2.500 1.893 1.893 1.893 . 0 0 "[ ]" 3
168 2 9 MET O 2 13 ILE N 3.300 2.300 3.500 2.841 2.841 2.841 . 0 0 "[ ]" 3
169 2 10 GLY O 2 14 ASN H 2.300 . 2.500 1.769 1.769 1.769 . 0 0 "[ ]" 3
170 2 10 GLY O 2 14 ASN N 3.300 2.300 3.500 2.700 2.700 2.700 . 0 0 "[ ]" 3
171 2 11 LEU O 2 15 SER H 2.300 . 2.500 1.741 1.741 1.741 . 0 0 "[ ]" 3
172 2 11 LEU O 2 15 SER N 3.300 2.300 3.500 2.698 2.698 2.698 . 0 0 "[ ]" 3
173 2 12 ILE O 2 16 GLY H 2.300 . 2.500 1.910 1.910 1.910 . 0 0 "[ ]" 3
174 2 12 ILE O 2 16 GLY N 3.300 2.300 3.500 2.842 2.842 2.842 . 0 0 "[ ]" 3
175 2 13 ILE O 2 17 GLN H 2.300 . 2.500 1.824 1.824 1.824 . 0 0 "[ ]" 3
176 2 13 ILE O 2 17 GLN N 3.300 2.300 3.500 2.758 2.758 2.758 . 0 0 "[ ]" 3
177 2 14 ASN O 2 18 ALA H 2.300 . 2.500 1.879 1.879 1.879 . 0 0 "[ ]" 3
178 2 14 ASN O 2 18 ALA N 3.300 2.300 3.500 2.793 2.793 2.793 . 0 0 "[ ]" 3
179 2 15 SER O 2 19 ARG H 2.300 . 2.500 2.071 2.071 2.071 . 0 0 "[ ]" 3
180 2 15 SER O 2 19 ARG N 3.300 2.300 3.500 3.033 3.033 3.033 . 0 0 "[ ]" 3
181 2 16 GLY O 2 20 SER H 2.300 . 2.500 1.916 1.916 1.916 . 0 0 "[ ]" 3
182 2 16 GLY O 2 20 SER N 3.300 2.300 3.500 2.879 2.879 2.879 . 0 0 "[ ]" 3
183 2 17 GLN O 2 21 LEU H 2.300 . 2.500 1.837 1.837 1.837 . 0 0 "[ ]" 3
184 2 17 GLN O 2 21 LEU N 3.300 2.300 3.500 2.795 2.795 2.795 . 0 0 "[ ]" 3
185 2 18 ALA O 2 22 ALA H 2.300 . 2.500 1.964 1.964 1.964 . 0 0 "[ ]" 3
186 2 18 ALA O 2 22 ALA N 3.300 2.300 3.500 2.899 2.899 2.899 . 0 0 "[ ]" 3
187 2 19 ARG O 2 23 TYR H 2.300 . 2.500 1.816 1.816 1.816 . 0 0 "[ ]" 3
188 2 19 ARG O 2 23 TYR N 3.300 2.300 3.500 2.789 2.789 2.789 . 0 0 "[ ]" 3
189 2 20 SER O 2 24 ALA H 2.300 . 2.500 2.012 2.012 2.012 . 0 0 "[ ]" 3
190 2 20 SER O 2 24 ALA N 3.300 2.300 3.500 2.942 2.942 2.942 . 0 0 "[ ]" 3
191 2 21 LEU O 2 25 ALA H 2.300 . 2.500 1.840 1.840 1.840 . 0 0 "[ ]" 3
192 2 21 LEU O 2 25 ALA N 3.300 2.300 3.500 2.726 2.726 2.726 . 0 0 "[ ]" 3
193 2 22 ALA O 2 26 LEU H 2.300 . 2.500 2.029 2.029 2.029 . 0 0 "[ ]" 3
194 2 22 ALA O 2 26 LEU N 3.300 2.300 3.500 2.963 2.963 2.963 . 0 0 "[ ]" 3
195 2 23 TYR O 2 27 LYS H 2.300 . 2.500 1.976 1.976 1.976 . 0 0 "[ ]" 3
196 2 23 TYR O 2 27 LYS N 3.300 2.300 3.500 2.926 2.926 2.926 . 0 0 "[ ]" 3
197 2 24 ALA O 2 28 GLN H 2.300 . 2.500 2.074 2.074 2.074 . 0 0 "[ ]" 3
198 2 24 ALA O 2 28 GLN N 3.300 2.300 3.500 2.983 2.983 2.983 . 0 0 "[ ]" 3
199 2 25 ALA O 2 29 ALA H 2.300 . 2.500 2.278 2.278 2.278 . 0 0 "[ ]" 3
200 2 25 ALA O 2 29 ALA N 3.300 2.300 3.500 3.184 3.184 3.184 . 0 0 "[ ]" 3
201 2 26 LEU O 2 30 LYS H 2.300 . 2.500 2.128 2.128 2.128 . 0 0 "[ ]" 3
202 2 26 LEU O 2 30 LYS N 3.300 2.300 3.500 3.045 3.045 3.045 . 0 0 "[ ]" 3
203 2 27 LYS O 2 31 GLN H 2.300 . 2.500 2.332 2.332 2.332 . 0 0 "[ ]" 3
204 2 27 LYS O 2 31 GLN N 3.300 2.300 3.500 3.146 3.146 3.146 . 0 0 "[ ]" 3
205 2 33 ASP O 2 37 ALA H 2.300 . 2.500 2.195 2.195 2.195 . 0 0 "[ ]" 3
206 2 33 ASP O 2 37 ALA N 3.300 2.300 3.500 3.094 3.094 3.094 . 0 0 "[ ]" 3
207 2 34 PHE O 2 38 LYS H 2.300 . 2.500 1.932 1.932 1.932 . 0 0 "[ ]" 3
208 2 34 PHE O 2 38 LYS N 3.300 2.300 3.500 2.899 2.899 2.899 . 0 0 "[ ]" 3
209 2 35 ALA O 2 39 ALA H 2.300 . 2.500 2.095 2.095 2.095 . 0 0 "[ ]" 3
210 2 35 ALA O 2 39 ALA N 3.300 2.300 3.500 3.044 3.044 3.044 . 0 0 "[ ]" 3
211 2 36 ALA O 2 40 MET H 2.300 . 2.500 1.916 1.916 1.916 . 0 0 "[ ]" 3
212 2 36 ALA O 2 40 MET N 3.300 2.300 3.500 2.859 2.859 2.859 . 0 0 "[ ]" 3
213 2 37 ALA O 2 41 MET H 2.300 . 2.500 1.872 1.872 1.872 . 0 0 "[ ]" 3
214 2 37 ALA O 2 41 MET N 3.300 2.300 3.500 2.807 2.807 2.807 . 0 0 "[ ]" 3
215 2 38 LYS O 2 42 ASP H 2.300 . 2.500 2.002 2.002 2.002 . 0 0 "[ ]" 3
216 2 38 LYS O 2 42 ASP N 3.300 2.300 3.500 2.945 2.945 2.945 . 0 0 "[ ]" 3
217 2 39 ALA O 2 43 GLN H 2.300 . 2.500 2.168 2.168 2.168 . 0 0 "[ ]" 3
218 2 39 ALA O 2 43 GLN N 3.300 2.300 3.500 3.123 3.123 3.123 . 0 0 "[ ]" 3
219 2 40 MET O 2 44 SER H 2.300 . 2.500 1.932 1.932 1.932 . 0 0 "[ ]" 3
220 2 40 MET O 2 44 SER N 3.300 2.300 3.500 2.849 2.849 2.849 . 0 0 "[ ]" 3
221 2 41 MET O 2 45 ARG H 2.300 . 2.500 1.993 1.993 1.993 . 0 0 "[ ]" 3
222 2 41 MET O 2 45 ARG N 3.300 2.300 3.500 2.952 2.952 2.952 . 0 0 "[ ]" 3
223 2 42 ASP O 2 46 MET H 2.300 . 2.500 2.196 2.196 2.196 . 0 0 "[ ]" 3
224 2 42 ASP O 2 46 MET N 3.300 2.300 3.500 3.125 3.125 3.125 . 0 0 "[ ]" 3
225 2 43 GLN O 2 47 ALA H 2.300 . 2.500 2.077 2.077 2.077 . 0 0 "[ ]" 3
226 2 43 GLN O 2 47 ALA N 3.300 2.300 3.500 3.013 3.013 3.013 . 0 0 "[ ]" 3
227 2 44 SER O 2 48 LEU H 2.300 . 2.500 2.141 2.141 2.141 . 0 0 "[ ]" 3
228 2 44 SER O 2 48 LEU N 3.300 2.300 3.500 3.062 3.062 3.062 . 0 0 "[ ]" 3
229 2 45 ARG O 2 49 ASN H 2.300 . 2.500 1.783 1.783 1.783 . 0 0 "[ ]" 3
230 2 45 ARG O 2 49 ASN N 3.300 2.300 3.500 2.717 2.717 2.717 . 0 0 "[ ]" 3
231 2 46 MET O 2 50 GLU H 2.300 . 2.500 2.062 2.062 2.062 . 0 0 "[ ]" 3
232 2 46 MET O 2 50 GLU N 3.300 2.300 3.500 3.016 3.016 3.016 . 0 0 "[ ]" 3
233 2 47 ALA O 2 51 ALA H 2.300 . 2.500 2.137 2.137 2.137 . 0 0 "[ ]" 3
234 2 47 ALA O 2 51 ALA N 3.300 2.300 3.500 3.027 3.027 3.027 . 0 0 "[ ]" 3
235 2 48 LEU O 2 52 HIS H 2.300 . 2.500 1.664 1.664 1.664 . 0 0 "[ ]" 3
236 2 48 LEU O 2 52 HIS N 3.300 2.300 3.500 2.623 2.623 2.623 . 0 0 "[ ]" 3
237 2 49 ASN O 2 53 LEU H 2.300 . 2.500 1.986 1.986 1.986 . 0 0 "[ ]" 3
238 2 49 ASN O 2 53 LEU N 3.300 2.300 3.500 2.889 2.889 2.889 . 0 0 "[ ]" 3
239 2 50 GLU O 2 54 VAL H 2.300 . 2.500 2.220 2.220 2.220 . 0 0 "[ ]" 3
240 2 50 GLU O 2 54 VAL N 3.300 2.300 3.500 3.140 3.140 3.140 . 0 0 "[ ]" 3
241 2 51 ALA O 2 55 GLN H 2.300 . 2.500 2.077 2.077 2.077 . 0 0 "[ ]" 3
242 2 51 ALA O 2 55 GLN N 3.300 2.300 3.500 3.022 3.022 3.022 . 0 0 "[ ]" 3
243 2 52 HIS O 2 56 THR H 2.300 . 2.500 1.884 1.884 1.884 . 0 0 "[ ]" 3
244 2 52 HIS O 2 56 THR N 3.300 2.300 3.500 2.820 2.820 2.820 . 0 0 "[ ]" 3
245 2 53 LEU O 2 57 LYS H 2.300 . 2.500 2.211 2.211 2.211 . 0 0 "[ ]" 3
246 2 53 LEU O 2 57 LYS N 3.300 2.300 3.500 3.149 3.149 3.149 . 0 0 "[ ]" 3
247 2 54 VAL O 2 58 LEU H 2.300 . 2.500 2.162 2.162 2.162 . 0 0 "[ ]" 3
248 2 54 VAL O 2 58 LEU N 3.300 2.300 3.500 3.070 3.070 3.070 . 0 0 "[ ]" 3
249 2 55 GLN O 2 59 ILE H 2.300 . 2.500 1.749 1.749 1.749 . 0 0 "[ ]" 3
250 2 55 GLN O 2 59 ILE N 3.300 2.300 3.500 2.716 2.716 2.716 . 0 0 "[ ]" 3
251 2 56 THR O 2 60 GLU H 2.300 . 2.500 1.793 1.793 1.793 . 0 0 "[ ]" 3
252 2 56 THR O 2 60 GLU N 3.300 2.300 3.500 2.716 2.716 2.716 . 0 0 "[ ]" 3
253 2 71 SER OG 2 74 LEU H 2.300 . 2.500 2.171 2.171 2.171 . 0 0 "[ ]" 3
254 2 71 SER OG 2 74 LEU N 3.300 2.300 3.500 3.136 3.136 3.136 . 0 0 "[ ]" 3
255 2 71 SER O 2 75 VAL H 2.300 . 2.500 1.894 1.894 1.894 . 0 0 "[ ]" 3
256 2 71 SER O 2 75 VAL N 3.300 2.300 3.500 2.862 2.862 2.862 . 0 0 "[ ]" 3
257 2 72 LEU O 2 76 HIS H 2.300 . 2.500 2.350 2.350 2.350 . 0 0 "[ ]" 3
258 2 72 LEU O 2 76 HIS N 3.300 2.300 3.500 3.310 3.310 3.310 . 0 0 "[ ]" 3
259 2 73 VAL O 2 77 ALA H 2.300 . 2.500 2.274 2.274 2.274 . 0 0 "[ ]" 3
260 2 73 VAL O 2 77 ALA N 3.300 2.300 3.500 3.216 3.216 3.216 . 0 0 "[ ]" 3
261 2 74 LEU O 2 78 GLN H 2.300 . 2.500 1.762 1.762 1.762 . 0 0 "[ ]" 3
262 2 74 LEU O 2 78 GLN N 3.300 2.300 3.500 2.703 2.703 2.703 . 0 0 "[ ]" 3
263 2 75 VAL O 2 79 LEU H 2.300 . 2.500 1.864 1.864 1.864 . 0 0 "[ ]" 3
264 2 75 VAL O 2 79 LEU N 3.300 2.300 3.500 2.797 2.797 2.797 . 0 0 "[ ]" 3
265 2 76 HIS O 2 80 HIS H 2.300 . 2.500 2.307 2.307 2.307 . 0 0 "[ ]" 3
266 2 76 HIS O 2 80 HIS N 3.300 2.300 3.500 3.256 3.256 3.256 . 0 0 "[ ]" 3
267 2 77 ALA O 2 81 LEU H 2.300 . 2.500 1.978 1.978 1.978 . 0 0 "[ ]" 3
268 2 77 ALA O 2 81 LEU N 3.300 2.300 3.500 2.949 2.949 2.949 . 0 0 "[ ]" 3
269 2 78 GLN O 2 82 MET H 2.300 . 2.500 1.650 1.650 1.650 . 0 0 "[ ]" 3
270 2 78 GLN O 2 82 MET N 3.300 2.300 3.500 2.603 2.603 2.603 . 0 0 "[ ]" 3
271 2 79 LEU O 2 83 THR H 2.300 . 2.500 2.067 2.067 2.067 . 0 0 "[ ]" 3
272 2 79 LEU O 2 83 THR N 3.300 2.300 3.500 2.993 2.993 2.993 . 0 0 "[ ]" 3
273 2 80 HIS O 2 84 SER H 2.300 . 2.500 1.886 1.886 1.886 . 0 0 "[ ]" 3
274 2 80 HIS O 2 84 SER N 3.300 2.300 3.500 2.831 2.831 2.831 . 0 0 "[ ]" 3
275 2 81 LEU O 2 85 MET H 2.300 . 2.500 1.825 1.825 1.825 . 0 0 "[ ]" 3
276 2 81 LEU O 2 85 MET N 3.300 2.300 3.500 2.794 2.794 2.794 . 0 0 "[ ]" 3
277 2 82 MET O 2 86 LEU H 2.300 . 2.500 2.031 2.031 2.031 . 0 0 "[ ]" 3
278 2 82 MET O 2 86 LEU N 3.300 2.300 3.500 2.978 2.978 2.978 . 0 0 "[ ]" 3
279 2 83 THR O 2 87 ALA H 2.300 . 2.500 1.890 1.890 1.890 . 0 0 "[ ]" 3
280 2 83 THR O 2 87 ALA N 3.300 2.300 3.500 2.829 2.829 2.829 . 0 0 "[ ]" 3
281 2 84 SER O 2 88 ARG H 2.300 . 2.500 1.849 1.849 1.849 . 0 0 "[ ]" 3
282 2 84 SER O 2 88 ARG N 3.300 2.300 3.500 2.808 2.808 2.808 . 0 0 "[ ]" 3
283 2 85 MET O 2 89 GLU H 2.300 . 2.500 1.906 1.906 1.906 . 0 0 "[ ]" 3
284 2 85 MET O 2 89 GLU N 3.300 2.300 3.500 2.855 2.855 2.855 . 0 0 "[ ]" 3
285 2 86 LEU O 2 90 LEU H 2.300 . 2.500 1.926 1.926 1.926 . 0 0 "[ ]" 3
286 2 86 LEU O 2 90 LEU N 3.300 2.300 3.500 2.893 2.893 2.893 . 0 0 "[ ]" 3
287 2 87 ALA O 2 91 ILE H 2.300 . 2.500 1.818 1.818 1.818 . 0 0 "[ ]" 3
288 2 87 ALA O 2 91 ILE N 3.300 2.300 3.500 2.752 2.752 2.752 . 0 0 "[ ]" 3
289 2 88 ARG O 2 92 THR H 2.300 . 2.500 1.967 1.967 1.967 . 0 0 "[ ]" 3
290 2 88 ARG O 2 92 THR N 3.300 2.300 3.500 2.855 2.855 2.855 . 0 0 "[ ]" 3
291 2 89 GLU O 2 93 GLU H 2.300 . 2.500 2.232 2.232 2.232 . 0 0 "[ ]" 3
292 2 89 GLU O 2 93 GLU N 3.300 2.300 3.500 3.154 3.154 3.154 . 0 0 "[ ]" 3
293 2 90 LEU O 2 94 LEU H 2.300 . 2.500 1.915 1.915 1.915 . 0 0 "[ ]" 3
294 2 90 LEU O 2 94 LEU N 3.300 2.300 3.500 2.860 2.860 2.860 . 0 0 "[ ]" 3
295 2 91 ILE O 2 95 ILE H 2.300 . 2.500 1.876 1.876 1.876 . 0 0 "[ ]" 3
296 2 91 ILE O 2 95 ILE N 3.300 2.300 3.500 2.819 2.819 2.819 . 0 0 "[ ]" 3
297 2 92 THR O 2 96 GLU H 2.300 . 2.500 2.080 2.080 2.080 . 0 0 "[ ]" 3
298 2 92 THR O 2 96 GLU N 3.300 2.300 3.500 3.019 3.019 3.019 . 0 0 "[ ]" 3
299 2 93 GLU O 2 97 LEU H 2.300 . 2.500 2.176 2.176 2.176 . 0 0 "[ ]" 3
300 2 93 GLU O 2 97 LEU N 3.300 2.300 3.500 3.080 3.080 3.080 . 0 0 "[ ]" 3
301 2 94 LEU O 2 98 HIS H 2.300 . 2.500 2.258 2.258 2.258 . 0 0 "[ ]" 3
302 2 94 LEU O 2 98 HIS N 3.300 2.300 3.500 3.159 3.159 3.159 . 0 0 "[ ]" 3
303 2 95 ILE O 2 99 GLU H 2.300 . 2.500 2.229 2.229 2.229 . 0 0 "[ ]" 3
304 2 95 ILE O 2 99 GLU N 3.300 2.300 3.500 3.136 3.136 3.136 . 0 0 "[ ]" 3
305 2 96 GLU O 2 100 LYS H 2.300 . 2.500 2.135 2.135 2.135 . 0 0 "[ ]" 3
306 2 96 GLU O 2 100 LYS N 3.300 2.300 3.500 3.045 3.045 3.045 . 0 0 "[ ]" 3
307 2 97 LEU O 2 101 LEU H 2.300 . 2.500 1.979 1.979 1.979 . 0 0 "[ ]" 3
308 2 97 LEU O 2 101 LEU N 3.300 2.300 3.500 2.876 2.876 2.876 . 0 0 "[ ]" 3
309 3 3 GLU O 3 7 VAL H 2.300 . 2.500 1.461 1.461 1.461 . 0 0 "[ ]" 3
310 3 3 GLU O 3 7 VAL N 3.300 2.300 3.500 2.402 2.402 2.402 . 0 0 "[ ]" 3
311 3 4 LEU O 3 8 VAL H 2.300 . 2.500 2.066 2.066 2.066 . 0 0 "[ ]" 3
312 3 4 LEU O 3 8 VAL N 3.300 2.300 3.500 2.946 2.946 2.946 . 0 0 "[ ]" 3
313 3 5 GLU O 3 9 MET H 2.300 . 2.500 2.298 2.298 2.298 . 0 0 "[ ]" 3
314 3 5 GLU O 3 9 MET N 3.300 2.300 3.500 3.229 3.229 3.229 . 0 0 "[ ]" 3
315 3 6 GLU O 3 10 GLY H 2.300 . 2.500 2.195 2.195 2.195 . 0 0 "[ ]" 3
316 3 6 GLU O 3 10 GLY N 3.300 2.300 3.500 3.114 3.114 3.114 . 0 0 "[ ]" 3
317 3 7 VAL O 3 11 LEU H 2.300 . 2.500 1.902 1.902 1.902 . 0 0 "[ ]" 3
318 3 7 VAL O 3 11 LEU N 3.300 2.300 3.500 2.828 2.828 2.828 . 0 0 "[ ]" 3
319 3 8 VAL O 3 12 ILE H 2.300 . 2.500 1.720 1.720 1.720 . 0 0 "[ ]" 3
320 3 8 VAL O 3 12 ILE N 3.300 2.300 3.500 2.671 2.671 2.671 . 0 0 "[ ]" 3
321 3 9 MET O 3 13 ILE H 2.300 . 2.500 1.894 1.894 1.894 . 0 0 "[ ]" 3
322 3 9 MET O 3 13 ILE N 3.300 2.300 3.500 2.843 2.843 2.843 . 0 0 "[ ]" 3
323 3 10 GLY O 3 14 ASN H 2.300 . 2.500 1.770 1.770 1.770 . 0 0 "[ ]" 3
324 3 10 GLY O 3 14 ASN N 3.300 2.300 3.500 2.700 2.700 2.700 . 0 0 "[ ]" 3
325 3 11 LEU O 3 15 SER H 2.300 . 2.500 1.746 1.746 1.746 . 0 0 "[ ]" 3
326 3 11 LEU O 3 15 SER N 3.300 2.300 3.500 2.701 2.701 2.701 . 0 0 "[ ]" 3
327 3 12 ILE O 3 16 GLY H 2.300 . 2.500 1.911 1.911 1.911 . 0 0 "[ ]" 3
328 3 12 ILE O 3 16 GLY N 3.300 2.300 3.500 2.844 2.844 2.844 . 0 0 "[ ]" 3
329 3 13 ILE O 3 17 GLN H 2.300 . 2.500 1.819 1.819 1.819 . 0 0 "[ ]" 3
330 3 13 ILE O 3 17 GLN N 3.300 2.300 3.500 2.753 2.753 2.753 . 0 0 "[ ]" 3
331 3 14 ASN O 3 18 ALA H 2.300 . 2.500 1.873 1.873 1.873 . 0 0 "[ ]" 3
332 3 14 ASN O 3 18 ALA N 3.300 2.300 3.500 2.791 2.791 2.791 . 0 0 "[ ]" 3
333 3 15 SER O 3 19 ARG H 2.300 . 2.500 2.061 2.061 2.061 . 0 0 "[ ]" 3
334 3 15 SER O 3 19 ARG N 3.300 2.300 3.500 3.022 3.022 3.022 . 0 0 "[ ]" 3
335 3 16 GLY O 3 20 SER H 2.300 . 2.500 1.908 1.908 1.908 . 0 0 "[ ]" 3
336 3 16 GLY O 3 20 SER N 3.300 2.300 3.500 2.872 2.872 2.872 . 0 0 "[ ]" 3
337 3 17 GLN O 3 21 LEU H 2.300 . 2.500 1.838 1.838 1.838 . 0 0 "[ ]" 3
338 3 17 GLN O 3 21 LEU N 3.300 2.300 3.500 2.794 2.794 2.794 . 0 0 "[ ]" 3
339 3 18 ALA O 3 22 ALA H 2.300 . 2.500 1.961 1.961 1.961 . 0 0 "[ ]" 3
340 3 18 ALA O 3 22 ALA N 3.300 2.300 3.500 2.897 2.897 2.897 . 0 0 "[ ]" 3
341 3 19 ARG O 3 23 TYR H 2.300 . 2.500 1.823 1.823 1.823 . 0 0 "[ ]" 3
342 3 19 ARG O 3 23 TYR N 3.300 2.300 3.500 2.798 2.798 2.798 . 0 0 "[ ]" 3
343 3 20 SER O 3 24 ALA H 2.300 . 2.500 2.014 2.014 2.014 . 0 0 "[ ]" 3
344 3 20 SER O 3 24 ALA N 3.300 2.300 3.500 2.943 2.943 2.943 . 0 0 "[ ]" 3
345 3 21 LEU O 3 25 ALA H 2.300 . 2.500 1.840 1.840 1.840 . 0 0 "[ ]" 3
346 3 21 LEU O 3 25 ALA N 3.300 2.300 3.500 2.727 2.727 2.727 . 0 0 "[ ]" 3
347 3 22 ALA O 3 26 LEU H 2.300 . 2.500 2.031 2.031 2.031 . 0 0 "[ ]" 3
348 3 22 ALA O 3 26 LEU N 3.300 2.300 3.500 2.966 2.966 2.966 . 0 0 "[ ]" 3
349 3 23 TYR O 3 27 LYS H 2.300 . 2.500 1.976 1.976 1.976 . 0 0 "[ ]" 3
350 3 23 TYR O 3 27 LYS N 3.300 2.300 3.500 2.926 2.926 2.926 . 0 0 "[ ]" 3
351 3 24 ALA O 3 28 GLN H 2.300 . 2.500 2.073 2.073 2.073 . 0 0 "[ ]" 3
352 3 24 ALA O 3 28 GLN N 3.300 2.300 3.500 2.982 2.982 2.982 . 0 0 "[ ]" 3
353 3 25 ALA O 3 29 ALA H 2.300 . 2.500 2.277 2.277 2.277 . 0 0 "[ ]" 3
354 3 25 ALA O 3 29 ALA N 3.300 2.300 3.500 3.184 3.184 3.184 . 0 0 "[ ]" 3
355 3 26 LEU O 3 30 LYS H 2.300 . 2.500 2.127 2.127 2.127 . 0 0 "[ ]" 3
356 3 26 LEU O 3 30 LYS N 3.300 2.300 3.500 3.045 3.045 3.045 . 0 0 "[ ]" 3
357 3 27 LYS O 3 31 GLN H 2.300 . 2.500 2.334 2.334 2.334 . 0 0 "[ ]" 3
358 3 27 LYS O 3 31 GLN N 3.300 2.300 3.500 3.148 3.148 3.148 . 0 0 "[ ]" 3
359 3 33 ASP O 3 37 ALA H 2.300 . 2.500 2.190 2.190 2.190 . 0 0 "[ ]" 3
360 3 33 ASP O 3 37 ALA N 3.300 2.300 3.500 3.089 3.089 3.089 . 0 0 "[ ]" 3
361 3 34 PHE O 3 38 LYS H 2.300 . 2.500 1.928 1.928 1.928 . 0 0 "[ ]" 3
362 3 34 PHE O 3 38 LYS N 3.300 2.300 3.500 2.893 2.893 2.893 . 0 0 "[ ]" 3
363 3 35 ALA O 3 39 ALA H 2.300 . 2.500 2.092 2.092 2.092 . 0 0 "[ ]" 3
364 3 35 ALA O 3 39 ALA N 3.300 2.300 3.500 3.040 3.040 3.040 . 0 0 "[ ]" 3
365 3 36 ALA O 3 40 MET H 2.300 . 2.500 1.919 1.919 1.919 . 0 0 "[ ]" 3
366 3 36 ALA O 3 40 MET N 3.300 2.300 3.500 2.861 2.861 2.861 . 0 0 "[ ]" 3
367 3 37 ALA O 3 41 MET H 2.300 . 2.500 1.884 1.884 1.884 . 0 0 "[ ]" 3
368 3 37 ALA O 3 41 MET N 3.300 2.300 3.500 2.819 2.819 2.819 . 0 0 "[ ]" 3
369 3 38 LYS O 3 42 ASP H 2.300 . 2.500 2.004 2.004 2.004 . 0 0 "[ ]" 3
370 3 38 LYS O 3 42 ASP N 3.300 2.300 3.500 2.947 2.947 2.947 . 0 0 "[ ]" 3
371 3 39 ALA O 3 43 GLN H 2.300 . 2.500 2.174 2.174 2.174 . 0 0 "[ ]" 3
372 3 39 ALA O 3 43 GLN N 3.300 2.300 3.500 3.129 3.129 3.129 . 0 0 "[ ]" 3
373 3 40 MET O 3 44 SER H 2.300 . 2.500 1.932 1.932 1.932 . 0 0 "[ ]" 3
374 3 40 MET O 3 44 SER N 3.300 2.300 3.500 2.847 2.847 2.847 . 0 0 "[ ]" 3
375 3 41 MET O 3 45 ARG H 2.300 . 2.500 1.989 1.989 1.989 . 0 0 "[ ]" 3
376 3 41 MET O 3 45 ARG N 3.300 2.300 3.500 2.949 2.949 2.949 . 0 0 "[ ]" 3
377 3 42 ASP O 3 46 MET H 2.300 . 2.500 2.199 2.199 2.199 . 0 0 "[ ]" 3
378 3 42 ASP O 3 46 MET N 3.300 2.300 3.500 3.129 3.129 3.129 . 0 0 "[ ]" 3
379 3 43 GLN O 3 47 ALA H 2.300 . 2.500 2.079 2.079 2.079 . 0 0 "[ ]" 3
380 3 43 GLN O 3 47 ALA N 3.300 2.300 3.500 3.013 3.013 3.013 . 0 0 "[ ]" 3
381 3 44 SER O 3 48 LEU H 2.300 . 2.500 2.145 2.145 2.145 . 0 0 "[ ]" 3
382 3 44 SER O 3 48 LEU N 3.300 2.300 3.500 3.067 3.067 3.067 . 0 0 "[ ]" 3
383 3 45 ARG O 3 49 ASN H 2.300 . 2.500 1.784 1.784 1.784 . 0 0 "[ ]" 3
384 3 45 ARG O 3 49 ASN N 3.300 2.300 3.500 2.718 2.718 2.718 . 0 0 "[ ]" 3
385 3 46 MET O 3 50 GLU H 2.300 . 2.500 2.067 2.067 2.067 . 0 0 "[ ]" 3
386 3 46 MET O 3 50 GLU N 3.300 2.300 3.500 3.020 3.020 3.020 . 0 0 "[ ]" 3
387 3 47 ALA O 3 51 ALA H 2.300 . 2.500 2.138 2.138 2.138 . 0 0 "[ ]" 3
388 3 47 ALA O 3 51 ALA N 3.300 2.300 3.500 3.030 3.030 3.030 . 0 0 "[ ]" 3
389 3 48 LEU O 3 52 HIS H 2.300 . 2.500 1.660 1.660 1.660 . 0 0 "[ ]" 3
390 3 48 LEU O 3 52 HIS N 3.300 2.300 3.500 2.619 2.619 2.619 . 0 0 "[ ]" 3
391 3 49 ASN O 3 53 LEU H 2.300 . 2.500 1.984 1.984 1.984 . 0 0 "[ ]" 3
392 3 49 ASN O 3 53 LEU N 3.300 2.300 3.500 2.888 2.888 2.888 . 0 0 "[ ]" 3
393 3 50 GLU O 3 54 VAL H 2.300 . 2.500 2.212 2.212 2.212 . 0 0 "[ ]" 3
394 3 50 GLU O 3 54 VAL N 3.300 2.300 3.500 3.133 3.133 3.133 . 0 0 "[ ]" 3
395 3 51 ALA O 3 55 GLN H 2.300 . 2.500 2.075 2.075 2.075 . 0 0 "[ ]" 3
396 3 51 ALA O 3 55 GLN N 3.300 2.300 3.500 3.020 3.020 3.020 . 0 0 "[ ]" 3
397 3 52 HIS O 3 56 THR H 2.300 . 2.500 1.883 1.883 1.883 . 0 0 "[ ]" 3
398 3 52 HIS O 3 56 THR N 3.300 2.300 3.500 2.819 2.819 2.819 . 0 0 "[ ]" 3
399 3 53 LEU O 3 57 LYS H 2.300 . 2.500 2.212 2.212 2.212 . 0 0 "[ ]" 3
400 3 53 LEU O 3 57 LYS N 3.300 2.300 3.500 3.150 3.150 3.150 . 0 0 "[ ]" 3
401 3 54 VAL O 3 58 LEU H 2.300 . 2.500 2.162 2.162 2.162 . 0 0 "[ ]" 3
402 3 54 VAL O 3 58 LEU N 3.300 2.300 3.500 3.069 3.069 3.069 . 0 0 "[ ]" 3
403 3 55 GLN O 3 59 ILE H 2.300 . 2.500 1.749 1.749 1.749 . 0 0 "[ ]" 3
404 3 55 GLN O 3 59 ILE N 3.300 2.300 3.500 2.716 2.716 2.716 . 0 0 "[ ]" 3
405 3 56 THR O 3 60 GLU H 2.300 . 2.500 1.794 1.794 1.794 . 0 0 "[ ]" 3
406 3 56 THR O 3 60 GLU N 3.300 2.300 3.500 2.716 2.716 2.716 . 0 0 "[ ]" 3
407 3 71 SER OG 3 74 LEU H 2.300 . 2.500 2.170 2.170 2.170 . 0 0 "[ ]" 3
408 3 71 SER OG 3 74 LEU N 3.300 2.300 3.500 3.135 3.135 3.135 . 0 0 "[ ]" 3
409 3 71 SER O 3 75 VAL H 2.300 . 2.500 1.903 1.903 1.903 . 0 0 "[ ]" 3
410 3 71 SER O 3 75 VAL N 3.300 2.300 3.500 2.871 2.871 2.871 . 0 0 "[ ]" 3
411 3 72 LEU O 3 76 HIS H 2.300 . 2.500 2.355 2.355 2.355 . 0 0 "[ ]" 3
412 3 72 LEU O 3 76 HIS N 3.300 2.300 3.500 3.314 3.314 3.314 . 0 0 "[ ]" 3
413 3 73 VAL O 3 77 ALA H 2.300 . 2.500 2.274 2.274 2.274 . 0 0 "[ ]" 3
414 3 73 VAL O 3 77 ALA N 3.300 2.300 3.500 3.217 3.217 3.217 . 0 0 "[ ]" 3
415 3 74 LEU O 3 78 GLN H 2.300 . 2.500 1.763 1.763 1.763 . 0 0 "[ ]" 3
416 3 74 LEU O 3 78 GLN N 3.300 2.300 3.500 2.704 2.704 2.704 . 0 0 "[ ]" 3
417 3 75 VAL O 3 79 LEU H 2.300 . 2.500 1.863 1.863 1.863 . 0 0 "[ ]" 3
418 3 75 VAL O 3 79 LEU N 3.300 2.300 3.500 2.796 2.796 2.796 . 0 0 "[ ]" 3
419 3 76 HIS O 3 80 HIS H 2.300 . 2.500 2.307 2.307 2.307 . 0 0 "[ ]" 3
420 3 76 HIS O 3 80 HIS N 3.300 2.300 3.500 3.257 3.257 3.257 . 0 0 "[ ]" 3
421 3 77 ALA O 3 81 LEU H 2.300 . 2.500 1.980 1.980 1.980 . 0 0 "[ ]" 3
422 3 77 ALA O 3 81 LEU N 3.300 2.300 3.500 2.950 2.950 2.950 . 0 0 "[ ]" 3
423 3 78 GLN O 3 82 MET H 2.300 . 2.500 1.651 1.651 1.651 . 0 0 "[ ]" 3
424 3 78 GLN O 3 82 MET N 3.300 2.300 3.500 2.604 2.604 2.604 . 0 0 "[ ]" 3
425 3 79 LEU O 3 83 THR H 2.300 . 2.500 2.067 2.067 2.067 . 0 0 "[ ]" 3
426 3 79 LEU O 3 83 THR N 3.300 2.300 3.500 2.994 2.994 2.994 . 0 0 "[ ]" 3
427 3 80 HIS O 3 84 SER H 2.300 . 2.500 1.885 1.885 1.885 . 0 0 "[ ]" 3
428 3 80 HIS O 3 84 SER N 3.300 2.300 3.500 2.831 2.831 2.831 . 0 0 "[ ]" 3
429 3 81 LEU O 3 85 MET H 2.300 . 2.500 1.823 1.823 1.823 . 0 0 "[ ]" 3
430 3 81 LEU O 3 85 MET N 3.300 2.300 3.500 2.793 2.793 2.793 . 0 0 "[ ]" 3
431 3 82 MET O 3 86 LEU H 2.300 . 2.500 2.032 2.032 2.032 . 0 0 "[ ]" 3
432 3 82 MET O 3 86 LEU N 3.300 2.300 3.500 2.980 2.980 2.980 . 0 0 "[ ]" 3
433 3 83 THR O 3 87 ALA H 2.300 . 2.500 1.889 1.889 1.889 . 0 0 "[ ]" 3
434 3 83 THR O 3 87 ALA N 3.300 2.300 3.500 2.828 2.828 2.828 . 0 0 "[ ]" 3
435 3 84 SER O 3 88 ARG H 2.300 . 2.500 1.849 1.849 1.849 . 0 0 "[ ]" 3
436 3 84 SER O 3 88 ARG N 3.300 2.300 3.500 2.806 2.806 2.806 . 0 0 "[ ]" 3
437 3 85 MET O 3 89 GLU H 2.300 . 2.500 1.904 1.904 1.904 . 0 0 "[ ]" 3
438 3 85 MET O 3 89 GLU N 3.300 2.300 3.500 2.853 2.853 2.853 . 0 0 "[ ]" 3
439 3 86 LEU O 3 90 LEU H 2.300 . 2.500 1.922 1.922 1.922 . 0 0 "[ ]" 3
440 3 86 LEU O 3 90 LEU N 3.300 2.300 3.500 2.890 2.890 2.890 . 0 0 "[ ]" 3
441 3 87 ALA O 3 91 ILE H 2.300 . 2.500 1.817 1.817 1.817 . 0 0 "[ ]" 3
442 3 87 ALA O 3 91 ILE N 3.300 2.300 3.500 2.751 2.751 2.751 . 0 0 "[ ]" 3
443 3 88 ARG O 3 92 THR H 2.300 . 2.500 1.965 1.965 1.965 . 0 0 "[ ]" 3
444 3 88 ARG O 3 92 THR N 3.300 2.300 3.500 2.855 2.855 2.855 . 0 0 "[ ]" 3
445 3 89 GLU O 3 93 GLU H 2.300 . 2.500 2.231 2.231 2.231 . 0 0 "[ ]" 3
446 3 89 GLU O 3 93 GLU N 3.300 2.300 3.500 3.151 3.151 3.151 . 0 0 "[ ]" 3
447 3 90 LEU O 3 94 LEU H 2.300 . 2.500 1.913 1.913 1.913 . 0 0 "[ ]" 3
448 3 90 LEU O 3 94 LEU N 3.300 2.300 3.500 2.858 2.858 2.858 . 0 0 "[ ]" 3
449 3 91 ILE O 3 95 ILE H 2.300 . 2.500 1.871 1.871 1.871 . 0 0 "[ ]" 3
450 3 91 ILE O 3 95 ILE N 3.300 2.300 3.500 2.813 2.813 2.813 . 0 0 "[ ]" 3
451 3 92 THR O 3 96 GLU H 2.300 . 2.500 2.071 2.071 2.071 . 0 0 "[ ]" 3
452 3 92 THR O 3 96 GLU N 3.300 2.300 3.500 3.009 3.009 3.009 . 0 0 "[ ]" 3
453 3 93 GLU O 3 97 LEU H 2.300 . 2.500 2.164 2.164 2.164 . 0 0 "[ ]" 3
454 3 93 GLU O 3 97 LEU N 3.300 2.300 3.500 3.068 3.068 3.068 . 0 0 "[ ]" 3
455 3 94 LEU O 3 98 HIS H 2.300 . 2.500 2.235 2.235 2.235 . 0 0 "[ ]" 3
456 3 94 LEU O 3 98 HIS N 3.300 2.300 3.500 3.132 3.132 3.132 . 0 0 "[ ]" 3
457 3 95 ILE O 3 99 GLU H 2.300 . 2.500 2.209 2.209 2.209 . 0 0 "[ ]" 3
458 3 95 ILE O 3 99 GLU N 3.300 2.300 3.500 3.118 3.118 3.118 . 0 0 "[ ]" 3
459 3 96 GLU O 3 100 LYS H 2.300 . 2.500 2.123 2.123 2.123 . 0 0 "[ ]" 3
460 3 96 GLU O 3 100 LYS N 3.300 2.300 3.500 3.034 3.034 3.034 . 0 0 "[ ]" 3
461 3 97 LEU O 3 101 LEU H 2.300 . 2.500 1.938 1.938 1.938 . 0 0 "[ ]" 3
462 3 97 LEU O 3 101 LEU N 3.300 2.300 3.500 2.797 2.797 2.797 . 0 0 "[ ]" 3
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