@TOME V2.3
(Nov 2016)
Ref.
-
-
Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : bsu15590: (2016-06-24 )
MSLAPHGGTLVNRVDESYDVSGIQKEIELDLISFADLELIGIGAYSPIEGFFNEKDYVSVVENMRLSSGVVWSLPITLPVDAQKAAELSLGETVKLTYEGETYGVIQIEDLYVPDKQKEAVNVYKTDEQEHPGVKKLFSRGNTYVGGPITLIKKASKQFPEFTFEPSETRRQFAEKGWETIVGFQTRNPVHRAHEYIQKTALETVDGLFLNPLVGETKSDDIPADVRMESYQVLLDHYYPKDRVFLGVFLAAMRYAGPREAIFHALVRKNYGCTHFIVGRDHAGVGDYYGTYEAQELFDTFKPEELGITPLKFEHSFFCKKCGNMGTAKTCPHGREHHVILSGTKVRGMLRDGVLPPAEFSRKEVVEVLIKGMKKKEEVGVS
Atome Classification :
(24 SA)
.........-10.-------..--..-...-20---------......--------...30.-------.......40........50........60........70........80........90-.......--.----.100.-.......110..---.....120.......130.......-140..----......150...-.-.-..160.......170.......180.......190..-.....200..--.-..-..210.......220.......230.......240.......250.......260.......270.......280....------.------..290.......300-.......310.......320.......330-..-.-....340.....-.-.350.......360.......370.......380-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MSLAPHG
G
T
-
L
V
N
-------RV--DE-SYD-V----------SG
I
Q
K
E
--------
I
E
L
D
L
I
-------
S
FA
D
L
E
L
I
G
I
GAY
S
P
I
E
G
FFNE
K
D
Y
V
S
V
V
E
NMRLSS
G
V
V
W
S
LP
I
T
LPV
D
A
Q
K
A
A
ELSL--G
E
T
V
K
L
T
--Y----EG
E
-
T
-
Y
G
V
I
Q
I
E
D
L
YVP---DKQKE
A
V
N
V
YKTDEQEHP
G
V
K
K
L
F
S-R-GNT----YVG
G
P
I
T
L
I
K
K
A
-
S
-
K
-QFPEFTFE
P
S
E
T
R
R
Q
F
A
E
KG
W
E
T
I
V
GFQTRN
P
V
H
R
A
H
-
E
Y
I
Q
K
T
A
L
E
T
--V-D
G
-
L
FLNPLVGETKSDDIPA
D
V
R
M
E
S
Y
Q
V
L
L
D
HYYPK
D
R
V
F
L
G
V
F
L
A
A
M
RYAG
P
R
E
A
I
F
H
A
L
V
R
KNYGC
T
H
F
I
VGRDHAGVG------D------YYGT
Y
E
A
Q
E
L
F
D
TFK-
P
E
ELGIT
P
L
KF
E
H
S
F
F
C
K
K
CGNMGTAKTCP-HG-R-E
H
H
V
I
L
SG
T
K
V
R
-
G
-
M
L
RDGVL
P
P
A
EF
S
R
K
E
V
V
E
V
L
I
K
GM
K
K
K
E
EVGVS-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
PsiBlast_CBE
95.89
35%
0
- C- -
1J70
1
MET3_YEAST
B:
[6-400]
---
A
P
H
G
G
I
-
L
Q
D
-------
L
I
AR
D
A
-
L
K
K
-
N
----------
E
L
L
S
E
A
--------
Q
S
S
D
I
L
VWNLTPR
Q
L
C
D
I
E
L
I
L
N
G
G
F
S
P
L
T
G
F
L
N
E
N
D
Y
S
S
V
V
T
D
S
R
L
A
D
G
T
L
W
T
I
P
I
T
L
D
V
D
E
A
F
A
N
Q
I
K
P
--
D
T
R
I
A
L
F
--
Q
----
D
D
E
-
I
P
I
A
I
L
T
V
Q
D
V
Y
K
P
---
N
K
T
I
E
A
E
K
V
F
R
G
D
P
-
E
H
P
A
I
S
Y
L
F
N
V
A
-
G
D
Y
----
Y
V
G
G
S
L
E
A
I
Q
L
P
-
Q
-
H
Y
D
Y
P
G
L
R
K
T
P
A
Q
L
R
L
E
F
Q
S
R
Q
W
D
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
E
A
--
N
-
A
K
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
H
T
R
V
R
V
Y
Q
E
I
I
K
R
Y
-
P
N
G
I
A
F
L
S
L
L
P
L
A
M
R
M
S
G
D
R
E
A
V
W
H
A
I
I
R
K
N
Y
G
A
S
H
F
I
V
G
R
D
H
A
G
P
G
KNSKGV
D
------
F
Y
G
P
Y
D
A
Q
E
L
V
E
S
Y
K
--
H
E
L
D
I
E
V
V
P
F
R
M
V
T
Y
L
P
D
E
D
R
Y
A
P
I
D
Q
I
D
-
T
T
-
K
-
T
R
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
V
G
G
E
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
R
E
S
N
P
P
R
P
K
Q
G
F
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
32
PsiBlast_CBE
95.89
35%
0
- C- -
1J70
2
MET3_YEAST
C:
[6-400]
---
A
P
H
G
G
I
-
L
Q
D
-------
L
I
AR
D
A
-
L
K
K
-
N
----------
E
L
L
S
E
A
--------
Q
S
S
D
I
L
VWNLTPR
Q
L
C
D
I
E
L
I
L
N
G
G
F
S
P
L
T
G
F
L
N
E
N
D
Y
S
S
V
V
T
D
S
R
L
A
D
G
T
L
W
T
I
P
I
T
L
D
V
D
E
A
F
A
N
Q
I
K
P
--
D
T
R
I
A
L
F
--
Q
----
D
D
E
-
I
P
I
A
I
L
T
V
Q
D
V
Y
K
P
---
N
K
T
I
E
A
E
K
V
F
R
G
D
P
-
E
H
P
A
I
S
Y
L
F
N
V
A
-
G
D
Y
----
Y
V
G
G
S
L
E
A
I
Q
L
P
-
Q
-
H
Y
D
Y
P
G
L
R
K
T
P
A
Q
L
R
L
E
F
Q
S
R
Q
W
D
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
E
A
--
N
-
A
K
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
H
T
R
V
R
V
Y
Q
E
I
I
K
R
Y
-
P
N
G
I
A
F
L
S
L
L
P
L
A
M
R
M
S
G
D
R
E
A
V
W
H
A
I
I
R
K
N
Y
G
A
S
H
F
I
V
G
R
D
H
A
G
P
G
KNSKGV
D
------
F
Y
G
P
Y
D
A
Q
E
L
V
E
S
Y
K
--
H
E
L
D
I
E
V
V
P
F
R
M
V
T
Y
L
P
D
E
D
R
Y
A
P
I
D
Q
I
D
-
T
T
-
K
-
T
R
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
V
G
G
E
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
R
E
S
N
P
P
R
P
K
Q
G
F
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
95.89
35%
0
- C- -
1J70
3
MET3_YEAST
A:
[6-400]
---
A
P
H
G
G
I
-
L
Q
D
-------
L
I
A
R
D
A
-
L
K
K
-
N
----------
E
L
L
S
E
A
--------
Q
S
S
D
I
L
V
W
N
L
T
P
R
Q
L
C
D
I
E
L
I
L
N
G
G
F
S
P
L
T
G
F
L
N
E
N
D
Y
S
S
V
V
T
D
S
R
L
A
D
G
T
L
W
T
I
P
I
T
L
D
V
D
E
A
F
A
N
Q
I
K
P
--
D
T
R
I
A
L
F
--
Q
----
D
D
E
-
I
P
I
A
I
L
T
V
Q
D
V
Y
K
P
---
N
K
T
I
E
A
E
K
V
F
R
G
D
P
-
E
H
P
A
I
S
Y
L
F
N
V
A
-
G
D
Y
----
Y
V
G
G
S
L
E
A
I
Q
L
P
-
Q
-
H
Y
D
Y
P
G
L
R
K
T
P
A
Q
L
R
L
E
F
Q
S
R
Q
W
D
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
E
A
--
N
-
A
K
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
H
T
R
V
R
V
Y
Q
E
I
I
K
R
Y
-
P
N
G
I
A
F
L
S
L
L
P
L
A
M
R
M
S
G
D
R
E
A
V
W
H
A
I
I
R
K
N
Y
G
A
S
H
F
I
V
G
R
D
H
A
G
P
G
KNSKGV
D
------
F
Y
G
P
Y
D
A
Q
E
L
V
E
S
Y
K
--
H
E
L
D
I
E
V
V
P
F
R
M
V
T
Y
L
P
D
E
D
R
Y
A
P
I
D
Q
I
D
-
T
T
-
K
-
T
R
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
V
G
G
E
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
R
E
S
N
P
P
R
P
K
Q
G
F
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
28
PsiBlast_CBE
95.20
38%
-101
- C4 -
1I2D
1
MET3_PENCH
C:
[2-385]
-
A
N
A
P
H
G
G
V
-
L
K
D
LLARDAP
R
Q
--
A
E
-
L
A
A
-
E
----------
A
E
S
L
P
A
--------
V
T
L
T
E
R
-------
Q
L
C
D
L
E
L
I
M
N
G
G
F
S
P
L
E
G
F
M
N
Q
A
D
Y
D
R
V
C
E
D
N
R
L
A
D
G
N
V
F
S
M
P
I
T
L
D
A
S
Q
E
V
I
D
E
K
K
L
--
Q
A
G
S
R
I
T
--
L
RDFR
D
D
R
-
N
-
L
A
I
L
T
I
D
D
I
Y
R
P
---
D
K
T
K
E
A
K
L
V
F
G
G
D
P
-
E
H
P
A
I
V
Y
L
-----
N
N
T
VKEF
Y
I
G
G
K
I
E
A
V
N
K
L
-
N
-
H
Y
D
Y
V
A
L
R
Y
T
P
A
E
L
R
V
H
F
D
K
L
G
W
S
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
S
R
--
Q
-
A
N
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
F
T
R
V
R
A
Y
Q
A
L
L
P
R
Y
-
P
N
G
M
A
V
L
G
L
L
G
L
A
M
R
M
G
G
P
R
E
A
I
W
H
A
I
I
R
K
N
H
G
A
T
H
F
I
V
G
R
D
H
A
G
P
G
SNSKGE
D
------
F
Y
G
P
Y
D
A
Q
H
A
V
E
K
Y
K
--
D
E
L
G
I
E
V
V
E
F
Q
M
V
T
Y
L
P
D
T
D
E
Y
R
P
V
D
Q
V
P
-
A
G
-
V
-
K
-
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
S
G
A
H
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
55
Fugue
94.56
38%
-91
- C4 -
1I2D
2
MET3_PENCH
A:
[2-573]
-
A
N
A
P
H
G
G
V
-
L
K
D
-------
L
L
--
A
R
D
A
P
R
-
Q
----------
A
E
L
A
A
E
A
E
S
L
P
A
--
V
T
L
T
E
R
-------
Q
L
C
D
L
E
L
I
M
N
G
G
F
S
P
L
E
G
F
M
N
Q
A
D
Y
D
R
V
C
E
D
N
R
L
A
D
G
N
V
F
S
M
P
I
T
L
D
A
S
Q
E
V
I
D
E
K
K
L
QA
G
S
R
I
T
L
R
D
F
R
----
D
D
R
-
N
-
L
A
I
L
T
I
D
D
I
Y
R
P
---
D
K
T
K
E
A
K
L
V
F
G
G
D
P
-
E
H
P
A
I
V
Y
L
N
N
-
T
V
K
E
F
----
Y
I
G
G
K
I
E
A
V
N
K
L
-
N
H
Y
-
D
Y
V
A
L
R
Y
T
P
A
E
L
R
V
H
F
D
K
L
G
W
S
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
-
R
E
L
T
V
R
A
A
R
S
--
R
Q
A
N
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
F
T
R
V
R
A
Y
Q
A
L
L
P
R
Y
-
P
N
G
M
A
V
L
G
L
L
G
L
A
M
R
M
G
G
P
R
E
A
I
W
H
A
I
I
R
K
N
H
G
A
T
H
F
I
V
G
R
D
H
A
G
P
G
SNSKGE
D
------
F
Y
G
P
Y
D
A
Q
H
A
V
E
K
Y
--
K
D
E
L
G
I
E
V
V
E
F
Q
M
V
T
Y
L
P
D
T
D
E
Y
R
P
V
D
Q
V
P
-
A
G
---
V
K
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
S
G
A
H
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
R
E
S
N
P
P
R
A
T
Q
G
F
T
I
F
L
T
G
Y
MNSG
K
D
A
I
A
R
A
L
Q
V
T
L
N
Q
Q
GG
R
S
V
S
L
L
L
G
D
T
V
R
H
E
LSSELGFT
R
E
D
R
H
T
N
I
Q
R
I
A
F
V
A
T
E
L
T
R
A
G
A
A
V
I
A
A
P
IAPY
E
E
S
R
K
F
A
R
D
A
V
S
Q
A
G
S
F
F
L
V
H
VATP
L
E
H
C
E
Q
S
DKRG
I
Y
A
A
A
R
R
GEIKGFTGVDDPYETPEKAD
L
V
V
D
FSKQS
V
R
S
I
V
H
E
I
I
L
V
L
E
S
Q
GFLERQ
29
PsiBlast_CBE
94.54
38%
-101
- C4 -
1I2D
1
MET3_PENCH
B:
[2-385]
-
A
N
A
P
H
G
G
V
-
L
K
D
LLARDAP
R
Q
--
A
E
-
L
A
A
-
E
----------
A
E
S
L
P
A
--------
V
T
L
T
E
R
-------
Q
L
C
D
L
E
L
I
M
N
G
G
F
S
P
L
E
G
F
M
N
Q
A
D
Y
D
R
V
C
E
D
N
R
L
A
D
G
N
V
F
S
M
P
I
T
L
D
A
S
Q
E
V
I
D
E
K
K
L
--
Q
A
G
S
R
I
T
--
L
RDFR
D
D
R
-
N
-
L
A
I
L
T
I
D
D
I
Y
R
P
---
D
K
T
K
E
A
K
L
V
F
G
G
D
P
-
E
H
P
A
I
V
Y
L
-----
N
N
T
VKEF
Y
I
G
G
K
I
E
A
V
N
K
L
-
N
-
H
Y
D
Y
V
A
L
R
Y
T
P
A
E
L
R
V
H
F
D
K
L
G
W
S
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
S
R
--
Q
-
A
N
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
F
T
R
V
R
A
Y
Q
A
L
L
P
R
Y
-
P
N
G
M
A
V
L
G
L
L
G
L
A
M
R
M
G
G
P
R
E
A
I
W
H
A
I
I
R
K
N
H
G
A
T
H
F
I
V
G
R
D
H
A
G
P
G
SNSKGE
D
------
F
Y
G
P
Y
D
A
Q
H
A
V
E
K
Y
K
--
D
E
L
G
I
E
V
V
E
F
Q
M
V
T
Y
L
P
D
T
D
E
Y
R
P
V
D
Q
V
P
-
A
G
-
V
-
K
-
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
S
G
A
H
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
94.25
38%
-97
- C4 -
1I2D
1
MET3_PENCH
A:
[2-385]
-
A
N
A
P
H
G
G
V
-
L
K
D
L
L
A
R
D
A
P
R
Q
--
A
E
-
L
A
A
-
E
----------
A
E
S
L
P
A
--------
V
T
L
T
E
R
-------
Q
L
C
D
L
E
L
I
M
N
G
G
F
S
P
L
E
G
F
M
N
Q
A
D
Y
D
R
V
C
E
D
N
R
L
A
D
G
N
V
F
S
M
P
I
T
L
D
A
S
Q
E
V
I
D
E
K
K
L
--
Q
A
G
S
R
I
T
--
L
R
D
FR
D
D
R
-
N
-
L
A
I
L
T
I
D
D
I
Y
R
P
---
D
K
T
K
E
A
K
L
V
F
G
G
D
P
-
E
H
P
A
I
V
Y
L
-----
N
N
T
VKE
F
Y
I
G
G
K
I
E
A
V
N
K
L
-
N
-
H
Y
D
Y
V
A
L
R
Y
T
P
A
E
L
R
V
H
F
D
K
L
G
W
S
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
S
R
--
Q
-
A
N
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
F
T
R
V
R
A
Y
Q
A
L
L
P
R
Y
-
P
N
G
M
A
V
L
G
L
L
G
L
A
M
R
M
G
G
P
R
E
A
I
W
H
A
I
I
R
K
N
H
G
A
T
H
F
I
V
G
R
D
H
A
G
P
G
SNSKGE
D
------
F
Y
G
P
Y
D
A
Q
H
A
V
E
K
Y
K
--
D
E
L
G
I
E
V
V
E
F
Q
M
V
T
Y
L
P
D
T
D
E
Y
R
P
V
D
Q
V
P
-
A
G
-
V
-
K
-
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
S
G
A
H
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
54
Fugue
94.03
36%
-91
- C4 -
1G8F
24
MET3_YEAST
A:
[2-511]
--
P
A
P
H
G
G
I
-
L
Q
D
-------
L
I
--
A
R
D
A
L
K
-
K
----------
N
E
L
L
S
E
A
Q
SSD
I
L
V
W
N
L
T
P
R
-------
Q
L
C
D
I
E
L
I
L
N
G
G
F
S
P
L
T
G
F
L
N
E
N
D
Y
S
S
V
V
T
D
S
R
L
A
D
G
T
L
W
T
I
P
I
T
L
D
V
D
E
A
F
A
N
Q
I
K
P
--
D
T
R
I
A
L
F
--
Q
D---
D
E
I
-
P
-
I
A
I
L
T
V
Q
D
V
Y
K
P
---
N
K
T
I
E
A
E
R
V
F
R
G
D
P
-
E
H
P
A
I
S
Y
L
F
N
-
V
A
G
D
Y
----
Y
V
G
G
S
L
E
A
I
Q
L
P
-
Q
H
Y
-
D
Y
P
G
L
R
K
T
P
A
Q
L
R
L
E
F
Q
S
R
Q
W
D
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
-
R
E
L
T
V
R
A
A
R
E
--
A
N
A
K
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
H
T
R
V
R
V
Y
Q
E
I
I
K
R
Y
-
P
N
G
I
A
F
L
S
L
L
P
L
A
M
R
M
S
G
D
R
E
A
V
W
H
A
I
I
R
K
N
Y
G
A
S
H
F
I
V
G
R
D
H
A
G
P
G
KNSKGV
D
------
F
Y
G
P
Y
D
A
Q
E
L
V
E
S
Y
--
K
H
E
L
D
I
E
V
V
P
F
R
M
V
T
Y
L
P
D
E
D
R
Y
A
P
I
D
Q
I
D
-
T
T
-
K
-
T
R
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
V
G
G
E
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
R
E
S
N
P
P
R
P
K
Q
G
F
S
I
V
LGNSLTVS
R
E
Q
L
S
I
A
L
L
S
T
F
L
Q
FGGG
R
Y
Y
K
IFEHNNK
T
E
L
L
S
L
I
Q
D
F
I
G
S
G
S
G
L
I
I
PDQWEDDKDSVVGKQN
V
Y
L
L
D
TSSSADIQLESADEP
I
S
H
I
V
Q
K
V
V
L
F
L
E
D
N
GFFVF-------------------------------------------------------------
34
HHSearch
92.67
37%
-88
* C4 *
1R6X
4
MET3_YEAST
A:
[1-386]
--
P
A
P
H
G
G
I
-
L
Q
D
-------
L
I
--
A
R
-
D
A
L
-
K
K
N
E
L
L
S
E
A
Q
S
S
D
I
-
L
V
--------
W
N
L
T
P
R
-------
Q
L
C
D
I
E
L
I
L
N
G
G
F
S
P
L
T
G
F
L
N
E
N
D
Y
S
S
V
V
T
D
S
R
L
A
D
G
T
L
W
T
I
P
I
T
L
D
V
D
E
A
F
A
N
Q
I
K
P
--
D
T
R
I
A
L
F
--
Q
D---
D
E
I
-
P
-
I
A
I
L
T
V
Q
D
V
Y
K
P
---
N
K
T
I
E
A
E
K
V
F
R
G
D
-
P
E
H
P
A
I
S
Y
L
F
N
V
A
-
G
D
Y
----
Y
V
G
G
S
L
E
A
I
Q
L
P
-
Q
H
Y
-
D
Y
P
G
L
R
K
T
P
A
Q
L
R
L
E
F
Q
S
R
Q
W
D
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
-
R
E
L
T
V
R
A
A
R
E
A
-
N
-
A
K
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
H
T
R
V
R
V
Y
Q
E
I
I
K
R
Y
-
P
N
G
I
A
F
L
S
L
L
P
L
A
M
R
M
S
G
D
R
E
A
V
W
H
A
I
I
R
K
N
Y
G
A
S
H
F
I
V
G
R
D
H
A
G
P
G
KNSKGV
D
------
F
Y
G
P
Y
D
A
Q
E
L
V
E
S
Y
K
--
H
E
L
D
I
E
V
V
P
F
R
M
V
T
Y
L
P
D
E
D
R
Y
A
P
I
D
Q
I
D
-
T
T
-
K
-
T
R
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
V
G
G
E
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
R
E
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
36
HHSearch
92.63
37%
-90
- C4 -
1G8F
22
MET3_YEAST
A:
[2-396]
--
P
A
P
H
G
G
I
-
L
Q
D
-------
L
I
--
A
R
-
D
A
L
-
K
K
N
E
L
L
S
E
A
Q
S
S
D
I
-
L
V
--------
W
N
L
T
P
R
-------
Q
L
C
D
I
E
L
I
L
N
G
G
F
S
P
L
T
G
F
L
N
E
N
D
Y
S
S
V
V
T
D
S
R
L
A
D
G
T
L
W
T
I
P
I
T
L
D
V
D
E
A
F
A
N
Q
I
K
P
--
D
T
R
I
A
L
F
--
Q
D---
D
E
I
-
P
-
I
A
I
L
T
V
Q
D
V
Y
K
P
---
N
K
T
I
E
A
E
R
V
F
R
G
D
-
P
E
H
P
A
I
S
Y
L
F
N
V
A
-
G
D
Y
----
Y
V
G
G
S
L
E
A
I
Q
L
P
-
Q
H
Y
-
D
Y
P
G
L
R
K
T
P
A
Q
L
R
L
E
F
Q
S
R
Q
W
D
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
-
R
E
L
T
V
R
A
A
R
E
A
-
N
-
A
K
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
H
T
R
V
R
V
Y
Q
E
I
I
K
R
Y
-
P
N
G
I
A
F
L
S
L
L
P
L
A
M
R
M
S
G
D
R
E
A
V
W
H
A
I
I
R
K
N
Y
G
A
S
H
F
I
V
G
R
D
H
A
G
P
G
KNSKGV
D
------
F
Y
G
P
Y
D
A
Q
E
L
V
E
S
Y
K
--
H
E
L
D
I
E
V
V
P
F
R
M
V
T
Y
L
P
D
E
D
R
Y
A
P
I
D
Q
I
D
-
T
T
-
K
-
T
R
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
V
G
G
E
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
R
E
S
N
P
P
R
P
K
Q
G
F
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
91.74
38%
-100
- C4 -
1M8P
-
MET3_PENCH
A:
[1-385]
M
A
N
A
P
H
G
G
V
-
L
K
D
L
L
A
R
D
AP
R
Q
--
A
E
-
L
A
A
-
E
----------
A
E
S
L
P
A
--------
V
T
L
T
E
R
-------
Q
L
C
D
L
E
L
I
M
N
G
G
F
S
P
L
E
G
F
M
N
Q
A
D
Y
D
R
V
C
E
D
N
R
L
A
D
G
N
V
F
S
M
P
I
T
L
D
A
S
Q
E
V
I
D
E
K
K
L
--
Q
A
A
S
R
I
T
--
L
R
D
FR
D
D
R
-
N
-
L
A
I
L
T
I
D
D
I
Y
R
P
---
D
K
T
K
E
A
K
L
V
F
G
G
D
P
-
E
H
P
A
I
V
Y
L
-----
N
N
T
VKE
F
Y
I
G
G
K
I
E
A
V
N
K
L
-
N
-
H
Y
D
Y
V
A
L
R
Y
T
P
A
E
L
R
V
H
F
D
K
L
G
W
S
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
S
R
--
Q
-
A
N
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
F
T
R
V
R
A
Y
Q
A
L
L
P
R
Y
-
P
N
G
M
A
V
L
G
L
L
G
L
A
M
R
M
G
G
P
R
E
A
I
W
H
A
I
I
R
K
N
H
G
A
T
H
F
I
V
G
R
D
H
A
G
P
G
SNSKGE
D
------
F
Y
G
P
Y
D
A
Q
H
A
V
E
K
Y
K
--
D
E
L
G
I
E
V
V
E
F
Q
M
V
T
Y
L
P
D
T
D
E
Y
R
P
V
D
Q
V
P
-
A
G
-
V
-
K
-
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
S
G
A
H
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
91.61
36%
-88
- C4 -
1R6X
4
MET3_YEAST
A:
[2-383]
---
A
P
H
G
G
I
-
L
Q
D
-------
L
I
A
R
D
A
-
L
K
K
-
N
----------
E
L
L
S
E
A
--------
Q
S
S
D
I
L
V
W
N
L
T
P
R
Q
L
C
D
I
E
L
I
L
N
G
G
F
S
P
L
T
G
F
L
N
E
N
D
Y
S
S
V
V
T
D
S
R
L
A
D
G
T
L
W
T
I
P
I
T
L
D
V
D
E
A
F
A
N
Q
I
K
P
--
D
T
R
I
A
L
F
--
Q
----
D
D
E
-
I
P
I
A
I
L
T
V
Q
D
V
Y
K
P
---
N
K
T
I
E
A
E
K
V
F
R
G
D
P
-
E
H
P
A
I
S
Y
L
F
N
V
A
-
G
D
Y
----
Y
V
G
G
S
L
E
A
I
Q
L
P
-
Q
-
H
Y
D
Y
P
G
L
R
K
T
P
A
Q
L
R
L
E
F
Q
S
R
Q
W
D
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
E
A
--
N
-
A
K
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
H
T
R
V
R
V
Y
Q
E
I
I
K
R
Y
-
P
N
G
I
A
F
L
S
L
L
P
L
A
M
R
M
S
G
D
R
E
A
V
W
H
A
I
I
R
K
N
Y
G
A
S
H
F
I
V
G
R
D
H
A
G
P
G
KNSKGV
D
------
F
Y
G
P
Y
D
A
Q
E
L
V
E
S
Y
K
--
H
E
L
D
I
E
V
V
P
F
R
M
V
T
Y
L
P
D
E
D
R
Y
A
P
I
D
Q
I
D
-
T
T
-
K
-
T
R
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
V
G
G
E
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
91.47
35%
-87
- C4 -
1G8F
22
MET3_YEAST
A:
[3-397]
---
A
P
H
G
G
I
-
L
Q
D
-------
L
I
A
R
D
A
-
L
K
K
-
N
----------
E
L
L
S
E
A
--------
Q
S
S
D
I
L
V
W
N
L
T
P
R
Q
L
C
D
I
E
L
I
L
N
G
G
F
S
P
L
T
G
F
L
N
E
N
D
Y
S
S
V
V
T
D
S
R
L
A
D
G
T
L
W
T
I
P
I
T
L
D
V
D
E
A
F
A
N
Q
I
K
P
--
D
T
R
I
A
L
F
--
Q
----
D
D
E
-
I
P
I
A
I
L
T
V
Q
D
V
Y
K
P
---
N
K
T
I
E
A
E
R
V
F
R
G
D
P
-
E
H
P
A
I
S
Y
L
F
N
V
A
-
G
D
Y
----
Y
V
G
G
S
L
E
A
I
Q
L
P
-
Q
-
H
Y
D
Y
P
G
L
R
K
T
P
A
Q
L
R
L
E
F
Q
S
R
Q
W
D
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
E
A
--
N
-
A
K
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
H
T
R
V
R
V
Y
Q
E
I
I
K
R
Y
-
P
N
G
I
A
F
L
S
L
L
P
L
A
M
R
M
S
G
D
R
E
A
V
W
H
A
I
I
R
K
N
Y
G
A
S
H
F
I
V
G
R
D
H
A
G
P
G
KNSKGV
D
------
F
Y
G
P
Y
D
A
Q
E
L
V
E
S
Y
K
--
H
E
L
D
I
E
V
V
P
F
R
M
V
T
Y
L
P
D
E
D
R
Y
A
P
I
D
Q
I
D
-
T
T
-
K
-
T
R
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
V
G
G
E
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
R
E
S
N
P
P
R
P
K
Q
G
F
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
41
HHSearch
91.38
40%
-108
- C4 -
1V47
9
?
A:
[4-348]
-------------------------------------------
T
L
-
P
A
--------
L
E
I
G
E
D
-------
E
R
L
D
L
E
N
L
A
T
G
A
F
F
P
V
K
G
F
M
T
R
E
E
A
L
S
V
A
H
E
M
R
L
P
T
G
E
V
W
T
I
P
I
L
L
Q
F
R
E
K
--
P
R
V
G
P
--
G
N
T
V
A
L
L
--
H
----
G
G
E
-
R
-
V
A
L
L
H
V
A
E
A
Y
E
L
---
D
L
E
A
L
A
R
A
V
F
G
T
D
S
E
T
H
P
G
V
A
R
L
Y
G
-
K
-
G
P
Y
----
A
L
A
G
R
V
E
V
L
K
P
R
-----
P
R
T
P
L
E
K
T
P
E
E
V
R
A
F
F
R
Q
R
G
W
R
K
V
V
A
F
Q
T
R
N
A
P
H
R
A
H
-
E
Y
L
I
R
L
G
L
E
L
--
A
-
D
G
-
V
L
V
H
P
I
L
G
A
K
K
P
D
D
F
P
T
E
V
I
V
E
A
Y
Q
A
L
I
R
D
F
L
P
Q
E
R
V
A
F
F
G
L
A
T
P
M
R
Y
A
G
P
K
E
A
V
F
H
A
L
V
R
K
N
F
G
A
T
H
F
L
V
G
R
D
H
A
G
V
G
------
D
------
F
Y
D
P
Y
A
A
H
R
I
F
D
R
L
P
---
P
L
G
I
E
I
V
K
V
G
A
V
F
H
C
P
L
C
G
G
I
A
S
E
R
T
C
P
-
E
G
-
H
R
E
K
R
T
A
I
S
M
T
K
V
R
-
A
-
L
L
R
E
G
K
A
P
P
S
E
L
V
R
P
E
L
L
P
I
L
R
R
G
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
40
HHSearch
91.37
35%
-113
- C4 -
4DNX
1
SAT_ALLVD
A:
[1-395]
-
M
I
K
P
V
G
S
D
E
L
R
P
-------
R
F
--
V
Y
-
D
P
E
Q
H
H
R
L
S
S
E
A
---
E
S
L
-
P
S
--------
V
I
V
S
S
Q
-------
A
A
G
N
A
V
M
L
G
A
G
Y
F
S
P
L
D
G
F
M
N
L
A
D
A
L
S
S
A
Q
S
M
T
L
T
D
G
R
F
F
P
V
P
L
L
C
L
L
E
S
A
--
D
A
I
A
G
--
A
T
R
I
A
L
R
--
D
PNV-
E
G
N
P
V
-
L
A
V
M
D
V
T
A
V
E
Q
V
S
D
A
Q
M
A
L
M
T
E
Q
V
Y
G
T
S
D
P
K
H
P
G
V
E
T
F
N
S
-
Q
-
G
R
T
----
A
I
S
G
P
I
Q
V
L
N
F
S
Y
F
Q
T
-
D
F
P
D
T
F
R
T
A
V
E
I
R
H
E
I
Q
E
R
G
W
Q
K
I
V
A
F
Q
T
R
N
P
M
H
R
A
H
-
E
E
L
C
K
M
A
M
E
A
V
E
A
-
D
G
-
V
V
I
H
M
L
L
G
Q
L
K
P
G
D
I
P
A
P
V
R
D
A
A
I
R
T
M
A
E
L
Y
F
P
P
N
T
V
M
V
T
G
Y
G
F
D
M
L
Y
A
G
P
R
E
A
V
L
H
A
Y
F
R
Q
N
M
G
A
T
H
F
I
I
G
R
D
H
A
G
V
G
------
D
------
Y
Y
G
P
F
D
A
Q
T
I
F
D
D
A
V
P
T
D
V
L
A
I
E
I
F
R
A
D
N
T
A
Y
S
K
K
L
G
R
V
V
M
M
R
D
A
P
D
H
T
-
P
-
D
D
F
I
Q
L
S
G
T
R
V
R
-
E
-
M
L
G
Q
G
E
A
P
P
P
E
F
S
R
P
E
V
A
Q
I
L
M
D
Y
Y
R
S
L
P
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
31
PsiBlast_CBE
91.33
35%
-80
- C4 -
1G8G
16
MET3_YEAST
B:
[3-397]
---
A
P
H
G
G
I
-
L
Q
D
-------
L
I
AR
D
A
-
L
K
K
-
N
----------
E
L
L
S
E
A
--------
Q
S
S
D
I
L
VWNLTPR
Q
L
C
D
I
E
L
I
L
N
G
G
F
S
P
L
T
G
F
L
N
E
N
D
Y
S
S
V
V
T
D
S
R
L
A
D
G
T
L
W
T
I
P
I
T
L
D
V
D
E
A
F
A
N
Q
I
K
P
--
D
T
R
I
A
L
F
--
Q
----
D
D
E
-
I
P
I
A
I
L
T
V
Q
D
V
Y
K
P
---
N
K
T
I
E
A
E
R
V
F
R
G
D
P
-
E
H
P
A
I
S
Y
L
F
N
V
A
-
G
D
Y
----
Y
V
G
G
S
L
E
A
I
Q
L
P
-
Q
-
H
Y
D
Y
P
G
L
R
K
T
P
A
Q
L
R
L
E
F
Q
S
R
Q
W
D
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
E
A
--
N
-
A
K
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
H
T
R
V
R
V
Y
Q
E
I
I
K
R
Y
-
P
N
G
I
A
F
L
S
L
L
P
L
A
M
R
M
S
G
D
R
E
A
V
W
H
A
I
I
R
K
N
Y
G
A
S
H
F
I
V
G
R
D
H
A
G
P
G
KNSKGV
D
------
F
Y
G
P
Y
D
A
Q
E
L
V
E
S
Y
K
--
H
E
L
D
I
E
V
V
P
F
R
M
V
T
Y
L
P
D
E
D
R
Y
A
P
I
D
Q
I
D
-
T
T
-
K
-
T
R
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
V
G
G
E
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
R
E
S
N
P
P
R
P
K
Q
G
F
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
91.17
35%
-82
- C4 -
1G8H
13
MET3_YEAST
A:
[3-397]
---
A
P
H
G
G
I
-
L
Q
D
-------
L
I
A
R
D
A
-
L
K
K
-
N
----------
E
L
L
S
E
A
--------
Q
S
S
D
I
L
V
W
N
L
T
P
R
Q
L
C
D
I
E
L
I
L
N
G
G
F
S
P
L
T
G
F
L
N
E
N
D
Y
S
S
V
V
T
D
S
R
L
A
D
G
T
L
W
T
I
P
I
T
L
D
V
D
E
A
F
A
N
Q
I
K
P
--
D
T
R
I
A
L
F
--
Q
----
D
D
E
-
I
P
I
A
I
L
T
V
Q
D
V
Y
K
P
---
N
K
T
I
E
A
E
R
V
F
R
G
D
P
-
E
H
P
A
I
S
Y
L
F
N
V
A
-
G
D
Y
----
Y
V
G
G
S
L
E
A
I
Q
L
P
-
Q
-
H
Y
D
Y
P
G
L
R
K
T
P
A
Q
L
R
L
E
F
Q
S
R
Q
W
D
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
E
A
--
N
-
A
K
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
H
T
R
V
R
V
Y
Q
E
I
I
K
R
Y
-
P
N
G
I
A
F
L
S
L
L
P
L
A
M
R
M
S
G
D
R
E
A
V
W
H
A
I
I
R
K
N
Y
G
A
S
H
F
I
V
G
R
D
H
A
G
P
G
KNSKGV
D
------
F
Y
G
P
Y
D
A
Q
E
L
V
E
S
Y
K
--
H
E
L
D
I
E
V
V
P
F
R
M
V
T
Y
L
P
D
E
D
R
Y
A
P
I
D
Q
I
D
-
T
T
-
K
-
T
R
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
V
G
G
E
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
R
E
S
N
P
P
R
P
K
Q
G
F
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
91.15
35%
-88
- C4 -
1JEC
22
MET3_YEAST
A:
[2-396]
---
A
P
H
G
G
I
-
L
Q
D
-------
L
I
A
R
D
A
-
L
K
K
-
N
----------
E
L
L
S
E
A
--------
Q
S
S
D
I
L
V
W
N
L
T
P
R
Q
L
C
D
I
E
L
I
L
N
G
G
F
S
P
L
T
G
F
L
N
E
N
D
Y
S
S
V
V
T
D
S
R
L
A
D
G
T
L
W
T
I
P
I
T
L
D
V
D
E
A
F
A
N
Q
I
K
P
--
D
T
R
I
A
L
F
--
Q
----
D
D
E
-
I
P
I
A
I
L
T
V
Q
D
V
Y
K
P
---
N
K
T
I
E
A
E
K
V
F
R
G
D
P
-
E
H
P
A
I
S
Y
L
F
N
V
A
-
G
D
Y
----
Y
V
G
G
S
L
E
A
I
Q
L
P
-
Q
-
H
Y
D
Y
P
G
L
R
K
T
P
A
Q
L
R
L
E
F
Q
S
R
Q
W
D
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
E
A
--
N
-
A
K
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
H
T
R
V
R
V
Y
Q
E
I
I
K
R
Y
-
P
N
G
I
A
F
L
S
L
L
P
L
A
M
R
M
S
G
D
R
E
A
V
W
H
A
I
I
R
K
N
Y
G
A
S
H
F
I
V
G
R
D
H
A
G
P
G
KNSKGV
D
------
F
Y
G
P
Y
D
A
Q
E
L
V
E
S
Y
K
--
H
E
L
D
I
E
V
V
P
F
R
M
V
T
Y
L
P
D
E
D
R
Y
A
P
I
D
Q
I
D
-
T
T
-
K
-
T
R
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
V
G
G
E
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
R
E
S
N
P
P
R
P
K
Q
G
F
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
39
HHSearch
90.85
39%
-95
- C4 -
2GKS
1
SATC_AQUAE
A:
[5-378]
------------------------------------------
K
Y
L
-
K
S
--------
I
Q
I
S
Q
R
-------
S
V
L
D
L
E
L
L
A
V
G
A
F
T
P
L
D
R
F
M
G
E
E
D
Y
R
N
V
V
E
S
M
R
L
K
S
G
T
L
F
P
I
P
I
T
L
P
M
E
K
E
I
A
K
D
L
K
E
--
G
E
W
I
V
L
R
--
D
P---
K
N
V
-
P
-
L
A
I
M
R
V
E
E
V
Y
K
W
---
N
L
E
Y
E
A
K
N
V
L
G
T
T
D
P
R
H
P
L
V
A
E
M
H
T
-
W
-
G
E
Y
----
Y
I
S
G
E
L
K
V
I
Q
L
P
-
K
Y
Y
-
D
F
P
E
Y
R
K
T
P
K
Q
V
R
E
E
I
K
S
L
G
L
D
K
I
V
A
F
Q
T
R
N
P
M
H
R
V
H
-
E
E
L
T
K
R
A
M
E
K
V
-
G
-
G
G
-
L
L
L
H
P
V
V
G
L
T
K
P
G
D
V
D
V
Y
T
R
M
R
I
Y
K
V
L
Y
E
K
Y
Y
D
K
K
K
T
I
L
A
F
L
P
L
A
M
R
M
A
G
P
R
E
A
L
W
H
G
I
I
R
R
N
Y
G
A
T
H
F
I
V
G
R
D
H
A
S
P
G
KDSKGK
P
------
F
Y
D
P
Y
E
A
Q
E
L
F
K
K
Y
E
--
D
E
I
G
I
K
M
V
P
F
E
E
L
V
Y
V
P
E
L
D
Q
Y
V
E
I
N
------------------
E
I
R
-
E
N
F
L
K
Q
G
R
K
L
P
E
W
F
T
R
P
E
V
A
E
I
L
A
E
T
Y
V
P
K
H
K
Q
G
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
90.78
35%
-79
- C4 -
1JEE
19
MET3_YEAST
B:
[2-396]
---
A
P
H
G
G
I
-
L
Q
D
-------
L
I
AR
D
A
-
L
K
K
-
N
----------
E
L
L
S
E
A
--------
Q
S
S
D
I
L
VWNLTPR
Q
L
C
D
I
E
L
I
L
N
G
G
F
S
P
L
T
G
F
L
N
E
N
D
Y
S
S
V
V
T
D
S
R
L
A
D
G
T
L
W
T
I
P
I
T
L
D
V
D
E
A
F
A
N
Q
I
K
P
--
D
T
R
I
A
L
F
--
Q
----
D
D
E
-
I
P
I
A
I
L
T
V
Q
D
V
Y
K
P
---
N
K
T
I
E
A
E
K
V
F
R
G
D
P
-
E
H
P
A
I
S
Y
L
F
N
V
A
-
G
D
Y
----
Y
V
G
G
S
L
E
A
I
Q
L
P
-
Q
-
H
Y
D
Y
P
G
L
R
K
T
P
A
Q
L
R
L
E
F
Q
S
R
Q
W
D
R
V
V
A
F
Q
T
R
N
P
M
H
R
A
H
R
E
L
T
V
R
A
A
R
E
A
--
N
-
A
K
-
V
L
I
H
P
V
V
G
L
T
K
P
G
D
I
D
H
H
T
R
V
R
V
Y
Q
E
I
I
K
R
Y
-
P
N
G
I
A
F
L
S
L
L
P
L
A
M
R
M
S
G
D
R
E
A
V
W
H
A
I
I
R
K
N
Y
G
A
S
H
F
I
V
G
R
D
H
A
G
P
G
KNSKGV
D
------
F
Y
G
P
Y
D
A
Q
E
L
V
E
S
Y
K
--
H
E
L
D
I
E
V
V
P
F
R
M
V
T
Y
L
P
D
E
D
R
Y
A
P
I
D
Q
I
D
-
T
T
-
K
-
T
R
T
L
N
I
S
G
T
E
L
R
-
R
-
R
L
R
V
G
G
E
I
P
E
W
F
S
Y
P
E
V
V
K
I
L
R
E
S
N
P
P
R
P
K
Q
G
F
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
88.59
41%
-104
- C4 -
1V47
9
?
A:
[17-349]
------------------------------------------------------------------------
D
L
E
N
L
A
T
G
A
F
F
P
V
K
G
F
M
T
R
E
E
A
L
S
V
A
H
E
M
R
L
P
T
G
E
V
W
T
I
P
I
L
L
--
Q
F
R
E
K
P
R
V
G
P
--
G
N
T
V
A
L
L
--
H
----
G
G
E
-
R
-
V
A
L
L
H
V
A
E
A
Y
E
L
---
D
L
E
A
L
A
R
A
V
F
G
T
D
S
E
T
H
P
G
V
A
R
L
Y
G
-
K
-
G
P
Y
----
A
L
A
G
R
V
E
V
L
K
P
R
-
P
-
R
-
T
P
L
E
K
T
--
P
E
E
V
R
A
F
F
R
Q
R
G
W
R
K
V
V
A
F
Q
T
R
N
A
P
H
R
A
H
-
E
Y
L
I
R
L
G
L
E
L
--
A
-
D
G
-
V
L
V
H
P
I
L
G
A
K
K
P
D
D
F
P
T
E
V
I
V
E
A
Y
Q
A
L
I
R
D
F
L
P
Q
E
R
V
A
F
F
G
L
A
T
P
M
R
Y
A
G
P
K
E
A
V
F
H
A
L
V
R
K
N
F
G
A
T
H
F
L
V
G
R
D
H
A
G
V
G
------
D
------
F
Y
D
P
Y
A
A
H
R
I
F
D
R
L
P
-
P
--
L
G
I
E
I
V
K
V
G
A
V
F
H
C
P
L
C
G
G
I
A
S
E
R
T
C
P
-
E
G
H
R
-
E
K
R
T
A
I
S
M
T
K
V
R
-
A
-
L
L
R
E
G
K
A
P
P
S
E
L
V
R
P
E
L
L
P
I
L
R
R
G
V
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
88.42
38%
-105
- C4 -
2GKS
1
SATC_AQUAE
A:
[8-367]
----------------------------------------------
K
S
--------
I
Q
I
S
Q
R
-------
S
V
L
D
L
E
L
L
A
V
G
A
F
T
P
L
D
R
F
M
G
E
E
D
Y
R
N
V
V
E
S
M
R
L
K
S
G
T
L
F
P
I
P
I
T
L
P
M
E
K
E
I
A
K
D
L
K
E
--
G
E
W
I
V
L
R
--
D
----
P
K
N
-
V
P
L
A
I
M
R
V
E
E
V
Y
K
W
---
N
L
E
Y
E
A
K
N
V
L
G
T
T
D
P
R
H
P
L
V
A
E
M
H
T
-
W
-
G
E
Y
----
Y
I
S
G
E
L
K
V
I
Q
L
P
-
K
-
Y
Y
D
F
P
E
Y
R
K
T
P
K
Q
V
R
E
E
I
K
S
L
G
L
D
K
I
V
A
F
Q
T
R
N
P
M
H
R
V
H
-
E
E
L
T
K
R
A
M
E
K
--
V
-
G
G
G
L
L
L
H
P
V
V
G
L
T
K
P
G
D
V
D
V
Y
T
R
M
R
I
Y
K
V
L
Y
E
K
Y
Y
D
K
K
K
T
I
L
A
F
L
P
L
A
M
R
M
A
G
P
R
E
A
L
W
H
G
I
I
R
R
N
Y
G
A
T
H
F
I
V
G
R
D
H
A
S
P
G
------
K
DSKGKP
F
Y
D
P
Y
E
A
Q
E
L
F
K
K
Y
E
--
D
E
I
G
I
K
M
V
P
F
E
E
L
V
Y
V
P
E
L
D
Q
Y
V
E
I
N
------------------
E
I
R
E
N
-
F
L
K
Q
G
R
K
L
P
E
W
F
T
R
P
E
V
A
E
I
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
88.05
38%
-106
- C4 -
2GKS
1
SATC_AQUAE
B:
[8-361]
----------------------------------------------
K
S
--------
I
Q
I
S
Q
R
-------
S
V
L
D
L
E
L
L
A
V
G
A
F
T
P
L
D
R
F
M
G
E
E
D
Y
R
N
V
V
E
S
M
R
L
K
S
G
T
L
F
P
I
P
I
T
L
P
M
E
K
E
I
A
K
D
L
K
E
--
G
E
W
I
V
L
R
--
D
----
P
K
N
-
V
P
L
A
I
M
R
V
E
E
V
Y
K
W
---
N
L
E
Y
E
A
K
N
V
L
G
T
T
D
P
R
H
P
L
V
A
E
M
H
T
-
W
-
G
E
Y
----
Y
I
S
G
E
L
K
V
I
Q
L
P
-
K
-
Y
Y
D
F
P
E
Y
R
K
T
P
K
Q
V
R
E
E
I
K
S
L
G
L
D
K
I
V
A
F
Q
T
R
N
P
M
H
R
V
H
-
E
E
L
T
K
R
A
M
E
K
--
V
-
G
G
G
L
L
L
H
P
V
V
G
L
T
K
P
G
D
V
D
V
Y
T
R
M
R
I
Y
K
V
L
Y
E
K
Y
Y
D
K
K
K
T
I
L
A
F
L
P
L
A
M
R
M
A
G
P
R
E
A
L
W
H
G
I
I
R
R
N
Y
G
A
T
H
F
I
V
G
R
D
H
A
S
P
G
------
K
DSKGKP
F
Y
D
P
Y
E
A
Q
E
L
F
K
K
Y
E
--
D
E
I
G
I
K
M
V
P
F
E
E
L
V
Y
V
P
E
L
D
Q
Y
V
E
I
N
------------------
E
I
R
E
N
-
F
L
K
Q
G
R
K
L
P
E
W
F
T
R
P
E
V
A
E
I
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
87.17
41%
-101
- C4 -
1V47
3
?
B:
[17-347]
------------------------------------------------------------------------
D
L
E
N
L
A
T
G
A
F
F
P
V
K
G
F
M
T
R
E
E
A
L
S
V
A
H
E
M
R
L
P
T
G
E
V
W
T
I
P
I
L
L
--
Q
F
R
E
K
P
R
V
G
P
--
G
N
T
V
A
L
L
--
H
----
G
G
E
-
R
-
V
A
L
L
H
V
A
E
A
Y
E
L
---
D
L
E
A
L
A
R
A
V
F
G
T
D
S
E
T
H
P
G
V
A
R
L
Y
G
-
K
-
G
P
Y
----
A
L
A
G
R
V
E
V
L
K
P
R
-
P
-
R
-
T
P
L
E
K
T
--
P
E
E
V
R
A
F
F
R
Q
R
G
W
R
K
V
V
A
F
Q
T
R
N
A
P
H
R
A
H
-
E
Y
L
I
R
L
G
L
E
L
--
A
-
D
G
-
V
L
V
H
P
I
L
G
A
K
K
P
D
D
F
P
T
E
V
I
V
E
A
Y
Q
A
L
I
R
D
F
L
P
Q
E
R
V
A
F
F
G
L
A
T
P
M
R
Y
A
G
P
K
E
A
V
F
H
A
L
V
R
K
N
F
G
A
T
H
F
L
V
G
R
D
H
A
G
V
G
------
D
------
F
Y
D
P
Y
A
A
H
R
I
F
D
R
L
P
-
P
--
L
G
I
E
I
V
K
V
G
A
V
F
H
C
P
L
C
G
G
I
A
S
E
R
T
C
P
-
E
G
H
R
-
E
K
R
T
A
I
S
M
T
K
V
R
-
A
-
L
L
-
E
G
K
A
P
P
S
E
L
V
R
P
E
L
L
P
I
L
R
R
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------