@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 : Rv3340: (2016-05-19 )
MSADSNSTDADPTAHWSFETKQIHAGQHPDPTTNARALPIYATTSYTFDDTAHAAALFGLEIPGNIYTRIGNPTTDVVEQRIAALEGGVAALFLSSGQAAETFAILNLAGAGDHIVSSPRLYGGTYNLFHYSLAKLGIEVSFVDDPDDLDTWQAAVRPNTKAFFAETISNPQIDLLDTPAVSEVAHRNGVPLIVDNTIATPYLIQPLAQGADIVVHSATKYLGGHGAAIAGVIVDGGNFDWTQGRFPGFTTPDPSYHGVVFAELGPPAFALKARVQLLRDYGSAASPFNAFLVAQGLETLSLRIERHVANAQRVAEFLAARDDVLSVNYAGLPSSPWHERAKRLAPKGTGAVLSFELAGGIEAGKAFVNALKLHSHVANIGDVRSLVIHPASTTHAQLSPAEQLATGVSPGLVRLAVGIEGIDDILADLELGFAAARRFSADPQSVAAF
Atome Classification :
(29 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.......390.......400.......410.......420.......430.......440.......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MSADSNSTDADPTA
H
W
S
F
E
T
K
Q
IHAGQHPDPTTN
A
R
A
L
P
I
Y
A
T
T
S
Y
TFDDTAH
A
A
A
L
F
GLEIPGN
I
Y
TRIGNP
T
T
D
V
V
E
Q
R
I
A
A
LEG
G
V
A
A
L
F
LSSGQA
A
E
T
F
A
I
L
N
LAGAGDHIVSSPRLYGG
T
Y
N
L
F
H
Y
S
L
A
KL
G
I
E
V
S
FVD--D--PDD
L
D
T
W
Q
A
AVRPN
T
K
A
F
F
A
E
TISNP
Q
I
D
LLDTP
A
V
S
E
V
A
H-R-N--GV
P
--
L
I
VDNTIA
T
-
P
Y
L
-
I
Q
P
L
AQGA
D
I
V
V
H
S
A
T
K
YLGGHG
A
A
I
A
G
V
I
V
DGGNFD---WTQG---RFPGFTTPDPSY
H
G
V
V
F
AE-L-GP
P
A
F
A
L
K
A
R
V
Q
L
L
R
D
Y-GSAAS
P
F
N
A
F
L
V
A
Q
G
L
E
T
L
S
L
R
I
E
R
H
VA
N
A
Q
R
V
A
E
F
L
AARD
D
V
L
S
V
NYAGLPSS
P
W
H
E
R
A
K
R
LAP-KG-T
G
A
V
L
S
F
E
LAGG
I
E
A
G
K
A
F
V
N
A
L
K
L
H
S
H
V
A
N
I
GD
V
R
S
L
V
IHPASTTHAQLS
P
A
E
Q
L
ATGVSPG
L
V
R
L
A
VGIE
G
I
D
D
I
L
A
D
L
E
L
G
F
A
A
A
R
RFSAD
P
Q
S
VAAF
22
PsiBlast_CBE
93.91
90%
-110
- C1 -
4KAM
2
?
C:
[16-444]
-----------
P
T
A
H
W
S
F
E
T
K
Q
I
H
A
G
Q
Q
P
D
S
A
T
----
L
P
I
Y
Q
T
T
S
-----------------------
R
L
G
N
P
T
T
D
V
V
E
Q
R
I
A
A
L
E
G
G
V
A
A
L
F
L
S
S
G
Q
A
A
E
T
F
A
I
L
N
L
A
G
A
G
D
H
I
V
S
S
P
R
L
Y
G
G
T
Y
N
L
F
H
Y
S
L
A
K
L
G
I
E
V
S
F
V
D
--
D
--
P
D
N
L
D
S
W
Q
A
A
V
R
P
N
T
K
A
F
F
G
E
T
I
S
N
P
Q
I
D
L
L
D
T
P
G
V
A
E
V
A
H
-
R
-
N
--
G
I
P
--
L
I
V
D
N
T
I
A
T
-
P
Y
L
-
I
R
P
F
T
Q
G
A
D
I
V
V
H
S
A
T
K
Y
L
G
G
H
G
A
A
I
A
G
V
I
V
D
G
G
T
F
D
---
W
T
Q
G
---
R
F
P
E
F
T
T
P
D
P
S
Y
H
G
V
V
F
A
E
-
L
-
G
A
P
A
Y
A
L
K
A
R
V
Q
L
L
R
D
L
-
G
S
A
A
S
P
F
N
A
F
L
V
A
Q
G
L
E
T
L
S
L
R
I
E
R
H
V
S
N
A
Q
R
V
A
E
F
L
A
D
R
E
D
V
V
T
V
N
Y
A
G
L
P
G
S
P
W
H
E
R
A
K
K
L
S
P
-
K
G
-
T
G
A
V
L
S
F
E
L
A
G
G
V
E
A
G
K
A
F
V
N
A
L
K
L
H
S
H
V
A
N
I
G
D
V
R
S
L
V
I
H
-------------------
S
P
G
L
V
R
L
A
V
G
I
E
G
I
E
D
I
L
A
D
L
E
L
G
F
A
A
A
R
K
F
S
---------
23
PsiBlast_CBE
92.67
90%
-108
- C1 -
4KAM
2
?
B:
[16-443]
-----------
P
T
A
H
W
S
F
E
T
K
Q
I
H
A
G
Q
------
N
A
R
A
L
P
I
Y
Q
T
T
S
----------------------
T
R
L
G
N
P
T
T
D
V
V
E
Q
R
I
A
A
L
E
G
G
V
A
A
L
F
L
S
S
G
Q
A
A
E
T
F
A
I
L
N
L
A
G
A
G
D
H
I
V
S
S
P
R
L
Y
G
G
T
Y
N
L
F
H
Y
S
L
A
K
L
G
I
E
V
S
F
V
D
--
D
--
P
D
N
L
D
S
W
Q
A
A
V
R
P
N
T
K
A
F
F
G
E
T
I
S
N
P
Q
I
D
L
L
D
T
P
G
V
A
E
V
A
H
-
R
-
N
--
G
I
P
--
L
I
V
D
N
T
I
A
T
-
P
Y
L
-
I
R
P
F
T
Q
G
A
D
I
V
V
H
S
A
T
K
Y
L
G
G
H
G
A
A
I
A
G
V
I
V
D
G
G
T
F
D
---
W
T
Q
G
---
R
F
P
E
F
T
T
P
D
P
S
Y
H
G
V
V
F
A
E
-
L
-
G
A
P
A
Y
A
L
K
A
R
V
Q
L
L
R
D
L
-
G
S
A
A
S
P
F
N
A
F
L
V
A
Q
G
L
E
T
L
S
L
R
I
E
R
H
V
S
N
A
Q
R
V
A
E
F
L
A
D
R
E
D
V
V
T
V
N
Y
A
G
L
P
G
S
P
W
H
E
R
A
K
K
L
S
P
-
K
G
-
T
G
A
V
L
S
F
E
L
A
G
G
V
E
A
G
K
A
F
V
N
A
L
K
L
H
S
H
V
A
N
I
G
D
V
R
S
L
V
I
H
-------------------
S
P
G
L
V
R
L
A
V
G
I
E
G
I
E
D
I
L
A
D
L
E
L
G
F
A
A
A
R
K
F
----------
101
HHSearch
91.08
91%
-109
- C1 -
4KAM
2
?
A:
[16-444]
-----------
P
T
A
H
W
S
F
E
T
K
Q
I
H
A
G
Q
Q
P
D
S
-----
A
L
P
I
Y
Q
T
T
S
--------------------------
N
P
T
T
D
V
V
E
Q
R
I
A
A
L
E
G
G
V
A
A
L
F
L
S
S
G
Q
A
A
E
T
F
A
I
L
N
L
A
G
A
G
D
H
I
V
S
S
P
R
L
Y
G
G
T
Y
N
L
F
H
Y
S
L
A
K
L
G
I
E
V
S
F
V
D
--
D
--
P
D
N
L
D
S
W
Q
A
A
V
R
P
N
T
K
A
F
F
G
E
T
I
S
N
P
Q
I
D
L
L
D
T
P
G
V
A
E
V
A
H
-
R
-
N
--
G
I
P
--
L
I
V
D
N
T
I
A
T
-
P
Y
L
-
I
R
P
F
T
Q
G
A
D
I
V
V
H
S
A
T
K
Y
L
G
G
H
G
A
A
I
A
G
V
I
V
D
G
G
T
F
D
---
W
T
Q
G
---
R
F
P
E
F
T
T
P
D
P
S
Y
H
G
V
V
F
A
E
-
L
-
G
A
P
A
Y
A
L
K
A
R
V
Q
L
L
R
D
L
-
G
S
A
A
S
P
F
N
A
F
L
V
A
Q
G
L
E
T
L
S
L
R
I
E
R
H
V
S
N
A
Q
R
V
A
E
F
L
A
D
R
E
D
V
V
T
V
N
Y
A
G
L
P
G
S
P
W
H
E
R
A
K
K
L
S
P
-
K
G
-
T
G
A
V
L
S
F
E
L
A
G
G
V
E
A
G
K
A
F
V
N
A
L
K
L
H
S
H
V
A
N
I
G
D
V
R
S
L
V
I
H
---------------------
G
L
V
R
L
A
V
G
I
E
G
I
E
D
I
L
A
D
L
E
L
G
F
A
A
A
R
K
F
S
---------
1
PsiBlast_PDB
90.84
90%
-109
- C1 -
4KAM
2
?
A:
[16-444]
-----------
P
T
A
H
W
S
F
E
T
K
Q
I
H
A
G
Q
Q
P
D
S
-----
A
L
P
I
Y
Q
T
T
S
--------------------------
N
P
T
T
D
V
V
E
Q
R
I
A
A
L
E
G
G
V
A
A
L
F
L
S
S
G
Q
A
A
E
T
F
A
I
L
N
L
A
G
A
G
D
H
I
V
S
S
P
R
L
Y
G
G
T
Y
N
L
F
H
Y
S
L
A
K
L
G
I
E
V
S
F
V
D
--
D
--
P
D
N
L
D
S
W
Q
A
A
V
R
P
N
T
K
A
F
F
G
E
T
I
S
N
P
Q
I
D
L
L
D
T
P
G
V
A
E
V
A
H
-
R
-
N
--
G
I
P
--
L
I
V
D
N
T
I
A
T
-
P
Y
L
-
I
R
P
F
T
Q
G
A
D
I
V
V
H
S
A
T
K
Y
L
G
G
H
G
A
A
I
A
G
V
I
V
D
G
G
T
F
D
---
W
T
Q
G
---
R
F
P
E
F
T
T
P
D
P
S
Y
H
G
V
V
F
A
E
-
L
-
G
A
P
A
Y
A
L
K
A
R
V
Q
L
L
R
D
L
-
G
S
A
A
S
P
F
N
A
F
L
V
A
Q
G
L
E
T
L
S
L
R
I
E
R
H
V
S
N
A
Q
R
V
A
E
F
L
A
D
R
E
D
V
V
T
V
N
Y
A
G
L
P
G
S
P
W
H
E
R
A
K
K
L
S
P
-
K
G
-
T
G
A
V
L
S
F
E
L
A
G
G
V
E
A
G
K
A
F
V
N
A
L
K
L
H
S
H
V
A
N
I
G
D
V
R
S
L
V
I
H
---------------------
G
L
V
R
L
A
V
G
I
E
G
I
E
D
I
L
A
D
L
E
L
G
F
A
A
A
R
K
F
S
---------
21
PsiBlast_CBE
89.85
90%
-112
- C1 -
4KAM
2
?
D:
[19-438]
--------------
H
W
S
F
E
T
K
Q
I
H
A
G
Q
------
N
A
R
A
L
P
I
Y
Q
T
T
S
Y
----------------------
R
L
G
N
P
T
T
D
V
V
E
Q
R
I
A
A
L
E
G
G
V
A
A
L
F
L
S
S
G
Q
A
A
E
T
F
A
I
L
N
L
A
G
A
G
D
H
I
V
S
S
P
R
L
Y
G
G
T
Y
N
L
F
H
Y
S
L
A
K
L
G
I
E
V
S
F
V
D
--
D
--
P
D
N
L
D
S
W
Q
A
A
V
R
P
N
T
K
A
F
F
G
E
T
I
S
N
P
Q
I
D
L
L
D
T
P
G
V
A
E
V
A
H
-
R
-
N
--
G
I
P
--
L
I
V
D
N
T
I
A
T
-
P
Y
L
-
I
R
P
F
T
Q
G
A
D
I
V
V
H
S
A
T
K
Y
L
G
G
H
G
A
A
I
A
G
V
I
V
D
G
G
T
F
D
---
W
T
Q
G
---
R
F
P
E
F
T
T
P
D
P
S
Y
H
G
V
V
F
A
E
-
L
-
G
A
P
A
Y
A
L
K
A
R
V
Q
L
L
R
D
L
-
G
S
A
A
S
P
F
N
A
F
L
V
A
Q
G
L
E
T
L
S
L
R
I
E
R
H
V
S
N
A
Q
R
V
A
E
F
L
A
D
R
E
D
V
V
T
V
N
Y
A
G
L
P
G
S
P
W
H
E
R
A
K
K
L
S
P
-
K
G
-
T
G
A
V
L
S
F
E
L
A
------
K
A
F
V
N
A
L
K
L
H
S
H
V
A
N
I
G
D
V
R
S
L
V
I
H
P
------------------
S
P
G
L
V
R
L
A
V
G
I
E
G
I
E
D
I
L
A
D
L
E
L
G
F
A
---------------
2
PsiBlast_PDB
82.53
53%
-96
- C1 -
2CTZ
1
?
A:
[3-421]
-----------------
F
E
T
L
Q
L
H
A
G
Y
E
P
E
P
T
T
L
S
R
Q
V
P
I
Y
P
T
T
S
Y
V
F
K
S
P
E
H
A
A
N
L
F
A
L
K
E
F
G
N
I
Y
S
R
I
M
N
P
T
V
D
V
L
E
K
R
L
A
A
L
E
G
G
K
A
A
L
A
T
A
S
G
H
A
A
Q
F
L
A
L
T
T
L
A
Q
A
G
D
N
I
V
S
T
P
N
L
Y
G
G
T
F
N
Q
F
K
V
T
L
K
R
L
G
I
E
V
R
F
T
S
--
R
--
E
E
R
P
E
E
F
L
A
L
T
D
E
K
T
R
A
W
W
V
E
S
I
G
N
P
A
L
N
I
P
D
L
E
A
L
A
Q
A
A
R
-
E
-
K
--
G
V
A
--
L
I
V
D
N
T
F
G
M
G
G
Y
L
-
L
R
P
L
A
W
G
A
A
L
V
T
H
S
L
T
K
W
V
G
G
H
G
A
V
I
A
G
A
I
V
D
G
G
N
F
P
---
W
E
G
G
---
R
Y
P
L
L
T
E
P
Q
P
G
Y
H
G
L
R
L
T
E
A
F
-
G
E
L
A
F
I
V
K
A
R
V
D
G
L
R
D
Q
-
G
Q
A
L
G
P
F
E
A
W
V
V
L
L
G
M
E
T
L
S
L
R
A
E
R
H
V
E
N
T
L
H
L
A
H
W
L
L
E
Q
P
Q
V
A
W
V
N
Y
P
G
L
P
H
H
P
H
H
D
R
A
Q
K
Y
F
K
-
G
K
-
P
G
A
V
L
T
F
G
L
K
G
G
Y
E
A
A
K
R
F
I
S
R
L
K
L
I
S
H
L
A
N
V
G
D
T
R
T
L
A
I
H
P
A
S
T
T
H
S
Q
L
S
P
E
E
Q
A
Q
A
G
V
S
P
E
M
V
R
L
S
V
G
L
E
H
V
E
D
L
K
A
E
L
K
E
A
L
A
---------------
102
HHSearch
82.08
53%
-95
- C1 -
2CTZ
1
?
A:
[1-421]
---------------
M
R
F
E
T
L
Q
L
H
A
G
Y
E
P
E
P
T
T
L
S
R
Q
V
P
I
Y
P
T
T
S
Y
V
F
K
S
P
E
H
A
A
N
L
F
A
L
K
E
F
G
N
I
Y
S
R
I
M
N
P
T
V
D
V
L
E
K
R
L
A
A
L
E
G
G
K
A
A
L
A
T
A
S
G
H
A
A
Q
F
L
A
L
T
T
L
A
Q
A
G
D
N
I
V
S
T
P
N
L
Y
G
G
T
F
N
Q
F
K
V
T
L
K
R
L
G
I
E
V
R
F
T
S
--
R
--
E
E
R
P
E
E
F
L
A
L
T
D
E
K
T
R
A
W
W
V
E
S
I
G
N
P
A
L
N
I
P
D
L
E
A
L
A
Q
A
A
R
-
E
-
K
--
G
V
A
--
L
I
V
D
N
T
F
G
M
-
G
G
Y
L
L
R
P
L
A
W
G
A
A
L
V
T
H
S
L
T
K
W
V
G
G
H
G
A
V
I
A
G
A
I
V
D
G
G
N
F
P
---
W
E
G
G
---
R
Y
P
L
L
T
E
P
Q
P
G
Y
H
G
L
R
L
T
E
-
A
F
G
E
L
A
F
I
V
K
A
R
V
D
G
L
R
D
Q
-
G
Q
A
L
G
P
F
E
A
W
V
V
L
L
G
M
E
T
L
S
L
R
A
E
R
H
V
E
N
T
L
H
L
A
H
W
L
L
E
Q
P
Q
V
A
W
V
N
Y
P
G
L
P
H
H
P
H
H
D
R
A
Q
K
Y
F
K
-
G
K
-
P
G
A
V
L
T
F
G
L
K
G
G
Y
E
A
A
K
R
F
I
S
R
L
K
L
I
S
H
L
A
N
V
G
D
T
R
T
L
A
I
H
P
A
S
T
T
H
S
Q
L
S
P
E
E
Q
A
Q
A
G
V
S
P
E
M
V
R
L
S
V
G
L
E
H
V
E
D
L
K
A
E
L
K
E
A
L
A
---------------
24
PsiBlast_CBE
82.07
53%
-95
- C1 -
2CTZ
1
?
B:
[3-421]
-----------------
F
E
T
L
Q
L
H
A
G
Y
E
P
E
P
T
T
L
S
R
Q
V
P
I
Y
P
T
T
S
Y
V
F
K
S
P
E
H
A
A
N
L
F
A
L
K
E
F
G
N
I
Y
S
R
I
M
N
P
T
V
D
V
L
E
K
R
L
A
A
L
E
G
G
K
A
A
L
A
T
A
S
G
H
A
A
Q
F
L
A
L
T
T
L
A
Q
A
G
D
N
I
V
S
T
P
N
L
Y
G
G
T
F
N
Q
F
K
V
T
L
K
R
L
G
I
E
V
R
F
T
S
--
R
--
E
E
R
P
E
E
F
L
A
L
T
D
E
K
T
R
A
W
W
V
E
S
I
G
N
P
A
L
N
I
P
D
L
E
A
L
A
Q
A
A
R
-
E
-
K
--
G
V
A
--
L
I
V
D
N
T
F
G
M
G
G
Y
L
-
L
R
P
L
A
W
G
A
A
L
V
T
H
S
L
T
K
W
V
G
G
H
G
A
V
I
A
G
A
I
V
D
G
G
N
F
P
---
W
E
G
G
---
R
Y
P
L
L
T
E
P
Q
P
G
Y
H
G
L
R
L
T
E
A
F
-
G
E
L
A
F
I
V
K
A
R
V
D
G
L
R
D
Q
-
G
Q
A
L
G
P
F
E
A
W
V
V
L
L
G
M
E
T
L
S
L
R
A
E
R
H
V
E
N
T
L
H
L
A
H
W
L
L
E
Q
P
Q
V
A
W
V
N
Y
P
G
L
P
H
H
P
H
H
D
R
A
Q
K
Y
F
K
-
G
K
-
P
G
A
V
L
T
F
G
L
K
G
G
Y
E
A
A
K
R
F
I
S
R
L
K
L
I
S
H
L
A
N
V
G
D
T
R
T
L
A
I
H
P
A
S
T
T
H
S
Q
L
S
P
E
E
Q
A
Q
A
G
V
S
P
E
M
V
R
L
S
V
G
L
E
H
V
E
D
L
K
A
E
L
K
E
A
L
A
---------------
4
PsiBlast_PDB
77.58
42%
-93
- C1 -
4OMA
6
?
A:
[7-390]
---------------
Y
G
F
N
T
Q
I
V
H
A
G
Q
Q
P
D
P
S
T
G
A
L
S
T
P
I
F
Q
T
S
T
F
V
F
D
S
A
E
Q
G
A
A
R
F
A
L
E
E
S
G
Y
I
Y
T
R
L
G
N
P
T
T
D
A
L
E
K
K
L
A
V
L
E
R
G
E
A
G
L
A
T
A
S
G
I
S
A
I
T
T
T
L
L
T
L
C
Q
Q
G
D
H
I
V
S
A
S
A
I
Y
G
C
T
H
A
F
L
S
H
S
M
P
K
F
G
I
N
V
S
F
V
D
AA
K
--
P
E
E
I
---
R
A
A
M
R
P
E
T
K
V
V
Y
I
E
T
P
A
N
P
T
L
S
L
V
D
I
E
T
V
A
G
I
A
H
-
Q
-
Q
--
G
A
L
--
L
V
V
D
N
T
F
M
S
-
P
Y
C
-
Q
Q
P
L
Q
L
G
A
D
I
V
V
H
S
V
T
K
Y
I
N
G
H
G
D
V
I
G
G
I
I
V
G
K
Q
E
F
----
I
D
Q
A
---
R
F
V
G
-------------------------------
L
K
D
I
T
G
G
C
M
S
P
F
N
A
W
L
T
L
R
G
V
K
T
L
G
I
R
M
E
R
H
C
E
N
A
L
K
I
A
R
F
L
E
G
H
P
S
I
T
R
V
Y
Y
P
G
L
S
S
H
P
Q
Y
E
L
G
Q
R
Q
M
S
-
L
--
P
G
G
I
I
S
F
E
I
A
G
G
L
E
A
G
R
R
M
I
N
S
V
E
L
C
L
L
A
V
S
L
G
D
T
E
T
L
I
Q
H
P
A
S
M
T
H
S
P
V
A
P
E
E
R
L
K
A
G
I
T
D
G
L
I
R
L
S
V
G
L
E
D
P
E
D
I
I
N
D
L
E
-------------------
104
HHSearch
76.68
41%
-98
- C1 -
4OC9
2
?
A:
[4-423]
---------------
F
N
K
E
T
L
A
L
H
G
A
Y
N
F
D
-
T
Q
R
S
I
S
V
P
I
Y
Q
N
T
A
Y
N
F
E
N
L
D
Q
A
A
A
R
F
N
L
Q
E
L
G
N
I
Y
S
R
L
S
N
P
T
S
D
V
L
G
Q
R
L
A
N
V
E
G
G
A
F
G
I
P
V
A
S
G
M
A
A
C
F
Y
A
L
I
N
L
A
S
S
G
D
N
V
A
Y
S
N
K
I
Y
G
G
T
Q
T
L
I
S
H
T
L
K
N
F
G
I
E
A
R
E
F
D
--
I
---
D
D
L
D
S
L
E
K
V
I
D
Q
N
T
K
A
I
F
F
E
S
L
S
N
P
Q
I
A
I
A
D
I
E
K
I
N
Q
I
A
K
-
K
-
H
--
K
I
V
--
S
I
C
D
N
T
V
A
T
-
P
F
L
-
L
Q
P
F
K
H
G
V
D
V
I
V
H
S
L
S
K
Y
V
S
G
Q
G
T
A
L
G
G
A
L
I
E
R
K
D
L
N
---
D
L
L
K
NND
R
Y
K
A
F
N
T
P
D
P
S
Y
H
G
L
N
L
N
T
-
L
-
D
L
P
I
F
S
I
R
V
I
I
T
W
L
R
D
L
-
G
A
S
L
A
P
Q
N
A
W
L
L
L
Q
G
L
E
T
L
A
V
R
I
E
K
H
S
Q
N
A
E
K
V
A
N
F
L
N
S
H
P
D
I
K
G
V
N
Y
P
T
L
A
S
N
A
Y
H
N
L
F
K
K
Y
F
D
K
N
F
-
A
S
G
L
L
S
F
E
A
K
D
-
Y
E
H
A
R
R
I
C
D
K
T
Q
L
F
L
L
A
A
N
L
G
D
S
K
S
L
I
I
H
P
A
S
T
T
H
S
Q
L
S
E
E
E
L
Q
K
A
G
I
T
K
A
T
I
R
L
S
I
G
L
E
N
S
D
D
L
I
A
D
L
K
Q
A
I
E
---------------
26
PsiBlast_CBE
76.61
40%
-98
- C1 -
4OC9
1
?
G:
[3-419]
--------------
N
F
N
K
E
T
L
A
L
H
G
A
Y
N
F
D
-
T
Q
R
S
I
S
V
P
I
Y
Q
N
T
A
Y
N
F
E
N
L
D
Q
A
A
A
R
F
N
L
Q
E
L
G
N
I
Y
S
R
L
S
N
P
T
S
D
V
L
G
Q
R
L
A
N
V
E
G
G
A
F
G
I
P
V
A
S
G
M
A
A
C
F
Y
A
L
I
N
L
A
S
S
G
D
N
V
A
Y
S
N
K
I
Y
G
G
T
Q
T
L
I
S
H
T
L
K
N
F
G
I
E
A
R
E
F
D
-----
I
D
D
L
D
S
L
E
K
V
I
D
Q
N
T
K
A
I
F
F
E
S
L
S
N
P
Q
I
A
I
A
D
I
E
K
I
N
Q
I
A
K
-
K
-
H
--
K
I
V
--
S
I
C
D
N
T
V
A
T
-
P
F
L
-
L
Q
P
F
K
H
G
V
D
V
I
V
H
S
L
S
K
Y
V
S
G
Q
G
T
A
L
G
G
A
L
I
E
R
K
D
L
N
DLL
K
N
N
D
---
R
Y
K
A
F
N
T
P
D
P
S
Y
H
G
L
N
L
N
T
-
L
-
D
L
P
I
F
S
I
R
V
I
I
T
W
L
R
D
L
-
G
A
S
L
A
P
Q
N
A
W
L
L
L
Q
G
L
E
T
L
A
V
R
I
E
K
H
S
Q
N
A
E
K
V
A
N
F
L
N
S
H
P
D
I
K
G
V
N
Y
P
T
L
A
S
N
A
Y
H
N
L
F
K
K
Y
F
D
-
K
N
F
A
S
G
L
L
S
F
E
-
A
K
D
Y
E
H
A
R
R
I
C
D
K
T
Q
L
F
L
L
A
A
N
L
G
D
S
K
S
L
I
I
H
P
A
S
T
T
H
S
Q
L
S
E
E
E
L
Q
K
A
G
I
T
K
A
T
I
R
L
S
I
G
L
E
N
S
D
D
L
I
A
D
L
K
-------------------
27
PsiBlast_CBE
76.46
40%
-98
- C1 -
4OC9
2
?
D:
[3-419]
--------------
N
F
N
K
E
T
L
A
L
H
G
A
Y
N
F
D
-
T
Q
R
S
I
S
V
P
I
Y
Q
N
T
A
Y
N
F
E
N
L
D
Q
A
A
A
R
F
N
L
Q
E
L
G
N
I
Y
S
R
L
S
N
P
T
S
D
V
L
G
Q
R
L
A
N
V
E
G
G
A
F
G
I
P
V
A
S
G
M
A
A
C
F
Y
A
L
I
N
L
A
S
S
G
D
N
V
A
Y
S
N
K
I
Y
G
G
T
Q
T
L
I
S
H
T
L
K
N
F
G
I
E
A
R
E
F
D
-----
I
D
D
L
D
S
L
E
K
V
I
D
Q
N
T
K
A
I
F
F
E
S
L
S
N
P
Q
I
A
I
A
D
I
E
K
I
N
Q
I
A
K
-
K
-
H
--
K
I
V
--
S
I
C
D
N
T
V
A
T
-
P
F
L
-
L
Q
P
F
K
H
G
V
D
V
I
V
H
S
L
S
K
Y
V
S
G
Q
G
T
A
L
G
G
A
L
I
E
R
K
D
L
N
DLL
K
N
N
D
---
R
Y
K
A
F
N
T
P
D
P
S
Y
H
G
L
N
L
N
T
-
L
-
D
L
P
I
F
S
I
R
V
I
I
T
W
L
R
D
L
-
G
A
S
L
A
P
Q
N
A
W
L
L
L
Q
G
L
E
T
L
A
V
R
I
E
K
H
S
Q
N
A
E
K
V
A
N
F
L
N
S
H
P
D
I
K
G
V
N
Y
P
T
L
A
S
N
A
Y
H
N
L
F
K
K
Y
F
D
-
K
N
F
A
S
G
L
L
S
F
E
-
A
K
D
Y
E
H
A
R
R
I
C
D
K
T
Q
L
F
L
L
A
A
N
L
G
D
S
K
S
L
I
I
H
P
A
S
T
T
H
S
Q
L
S
E
E
E
L
Q
K
A
G
I
T
K
A
T
I
R
L
S
I
G
L
E
N
S
D
D
L
I
A
D
L
K
-------------------
3
PsiBlast_PDB
76.27
40%
-98
- C1 -
4OC9
2
?
A:
[4-419]
---------------
F
N
K
E
T
L
A
L
H
G
A
Y
N
F
D
-
T
Q
R
S
I
S
V
P
I
Y
Q
N
T
A
Y
N
F
E
N
L
D
Q
A
A
A
R
F
N
L
Q
E
L
G
N
I
Y
S
R
L
S
N
P
T
S
D
V
L
G
Q
R
L
A
N
V
E
G
G
A
F
G
I
P
V
A
S
G
M
A
A
C
F
Y
A
L
I
N
L
A
S
S
G
D
N
V
A
Y
S
N
K
I
Y
G
G
T
Q
T
L
I
S
H
T
L
K
N
F
G
I
E
A
R
E
F
D
-----
I
D
D
L
D
S
L
E
K
V
I
D
Q
N
T
K
A
I
F
F
E
S
L
S
N
P
Q
I
A
I
A
D
I
E
K
I
N
Q
I
A
K
-
K
-
H
--
K
I
V
--
S
I
C
D
N
T
V
A
T
-
P
F
L
-
L
Q
P
F
K
H
G
V
D
V
I
V
H
S
L
S
K
Y
V
S
G
Q
G
T
A
L
G
G
A
L
I
E
R
K
D
L
N
D
L
L
K
N
N
D
---
R
Y
K
A
F
N
T
P
D
P
S
Y
H
G
L
N
L
N
T
-
L
-
D
L
P
I
F
S
I
R
V
I
I
T
W
L
R
D
L
-
G
A
S
L
A
P
Q
N
A
W
L
L
L
Q
G
L
E
T
L
A
V
R
I
E
K
H
S
Q
N
A
E
K
V
A
N
F
L
N
S
H
P
D
I
K
G
V
N
Y
P
T
L
A
S
N
A
Y
H
N
L
F
K
K
Y
F
D
-
K
N
F
A
S
G
L
L
S
F
E
-
A
K
D
Y
E
H
A
R
R
I
C
D
K
T
Q
L
F
L
L
A
A
N
L
G
D
S
K
S
L
I
I
H
P
A
S
T
T
H
S
Q
L
S
E
E
E
L
Q
K
A
G
I
T
K
A
T
I
R
L
S
I
G
L
E
N
S
D
D
L
I
A
D
L
K
-------------------
29
PsiBlast_CBE
76.26
40%
-99
- C1 -
4OC9
1
?
B:
[3-419]
--------------
N
F
N
K
E
T
L
A
L
H
G
A
Y
N
F
D
-
T
Q
R
S
I
S
V
P
I
Y
Q
N
T
A
Y
N
F
E
N
L
D
Q
A
A
A
R
F
N
L
Q
E
L
G
N
I
Y
S
R
L
S
N
P
T
S
D
V
L
G
Q
R
L
A
N
V
E
G
G
A
F
G
I
P
V
A
S
G
M
A
A
C
F
Y
A
L
I
N
L
A
S
S
G
D
N
V
A
Y
S
N
K
I
Y
G
G
T
Q
T
L
I
S
H
T
L
K
N
F
G
I
E
A
R
E
F
D
-----
I
D
D
L
D
S
L
E
K
V
I
D
Q
N
T
K
A
I
F
F
E
S
L
S
N
P
Q
I
A
I
A
D
I
E
K
I
N
Q
I
A
K
-
K
-
H
--
K
I
V
--
S
I
C
D
N
T
V
A
T
-
P
F
L
-
L
Q
P
F
K
H
G
V
D
V
I
V
H
S
L
S
K
Y
V
S
G
Q
G
T
A
L
G
G
A
L
I
E
R
K
D
L
N
D
L
L
K
N
N
D
---
R
Y
K
A
F
N
T
P
D
P
S
Y
H
G
L
N
L
N
T
-
L
-
D
L
P
I
F
S
I
R
V
I
I
T
W
L
R
D
L
-
G
A
S
L
A
P
Q
N
A
W
L
L
L
Q
G
L
E
T
L
A
V
R
I
E
K
H
S
Q
N
A
E
K
V
A
N
F
L
N
S
H
P
D
I
K
G
V
N
Y
P
T
L
A
S
N
A
Y
H
N
L
F
K
K
Y
F
D
-
K
N
F
A
S
G
L
L
S
F
E
-
A
K
D
Y
E
H
A
R
R
I
C
D
K
T
Q
L
F
L
L
A
A
N
L
G
D
S
K
S
L
I
I
H
P
A
S
T
T
H
-
Q
L
S
E
E
E
L
Q
K
A
G
I
T
K
A
T
I
R
L
S
I
G
L
E
N
S
D
D
L
I
A
D
L
K
-------------------
114
HHSearch
76.20
44%
-92
- C1 -
2RFV
1
?
A:
[4-397]
------------
C
R
T
Y
G
F
N
T
Q
I
V
H
A
G
Q
Q
P
D
P
S
T
G
A
L
S
T
P
I
F
Q
T
S
T
F
V
F
D
S
A
E
Q
G
A
A
R
F
-----
G
Y
I
Y
T
R
L
G
N
P
T
T
D
A
L
E
K
K
L
A
V
L
E
R
G
E
A
G
L
A
T
A
S
G
I
S
A
I
T
T
T
L
L
T
L
C
Q
Q
G
D
H
I
V
S
A
S
A
I
Y
G
C
T
H
A
F
L
S
H
S
M
P
K
F
G
I
N
V
R
F
V
D
--
A
---
A
K
P
E
E
I
R
A
A
M
R
P
E
T
K
V
V
Y
I
E
T
P
A
N
P
T
L
S
L
V
D
I
E
T
V
A
G
I
A
H
-
Q
-
Q
--
G
A
L
--
L
V
V
D
N
T
F
M
S
-
P
Y
C
-
Q
Q
P
L
Q
L
G
A
D
I
V
V
H
S
V
T
K
Y
I
N
G
H
G
D
V
I
G
G
I
I
V
G
K
Q
E
F
I
---
D
Q
------
A
R
---
F
V
-------------------------
G
L
K
D
I
T
-
G
G
C
M
S
P
F
N
A
W
L
T
L
R
G
V
K
T
L
G
I
R
M
E
R
H
C
E
N
A
L
K
I
A
R
F
L
E
G
H
P
S
I
T
R
V
Y
Y
P
G
L
S
S
H
P
Q
Y
E
L
G
Q
R
Q
M
--
S
L
-
P
G
G
I
I
S
F
E
I
A
G
G
L
E
A
G
R
R
M
I
N
S
V
E
L
C
L
L
A
V
S
L
G
D
T
E
T
L
I
Q
H
P
A
S
M
T
H
S
P
V
A
P
E
E
R
L
K
A
G
I
T
D
G
L
I
R
L
S
V
G
L
E
D
P
E
D
I
I
N
D
L
E
H
A
I
R
K
A
T
------------
7
PsiBlast_PDB
75.69
42%
-93
- C1 -
3JWA
6
?
A:
[7-390]
---------------
Y
G
F
N
T
Q
I
V
H
A
G
Q
Q
P
D
P
S
T
G
A
L
S
T
P
I
F
Q
T
S
T
F
V
F
D
S
A
E
Q
G
A
A
R
F
A
L
E
E
S
G
Y
I
Y
T
R
L
G
N
P
T
T
D
A
L
E
K
K
L
A
V
L
E
R
G
E
A
G
L
A
T
A
S
G
I
S
A
I
T
T
T
L
L
T
L
C
Q
Q
G
D
H
I
V
S
A
S
A
I
Y
G
C
T
H
A
F
L
S
H
S
M
P
K
F
G
I
N
V
S
F
V
D
AA
K
--
P
E
E
I
---
R
A
A
M
R
P
E
T
K
V
V
Y
I
E
T
P
A
N
P
T
L
S
L
V
D
I
E
T
V
A
G
I
A
H
-
Q
-
Q
--
G
A
L
--
L
V
V
D
N
T
F
M
S
-
P
Y
C
-
Q
Q
P
L
Q
L
G
A
D
I
V
V
H
S
V
T
K
Y
I
N
G
H
G
D
V
I
G
G
I
I
V
G
K
Q
E
F
----
I
D
Q
A
---
R
F
V
G
-------------------------------
L
K
D
I
T
G
G
C
M
S
P
F
N
A
W
L
T
L
R
G
V
K
T
L
G
I
R
M
E
R
H
C
E
N
A
L
K
I
A
R
F
L
E
G
H
P
S
I
T
R
V
Y
Y
P
G
L
S
S
H
P
Q
Y
E
L
G
Q
R
Q
M
S
-
L
--
P
G
G
I
I
S
F
E
I
A
G
G
L
E
A
G
R
R
M
I
N
S
V
E
L
C
L
L
A
V
S
L
G
D
T
E
T
L
I
Q
H
P
A
S
M
T
H
S
P
V
A
P
E
E
R
L
K
A
G
I
T
D
G
L
I
R
L
S
V
G
L
E
D
P
E
D
I
I
N
D
L
E
-------------------
9
PsiBlast_PDB
75.65
42%
-94
- C1 -
3JW9
2
?
A:
[7-390]
---------------
Y
G
F
N
T
Q
I
V
H
A
G
Q
Q
P
D
P
S
T
G
A
L
S
T
P
I
F
Q
T
S
T
F
V
F
D
S
A
E
Q
G
A
A
R
F
A
L
E
E
S
G
Y
I
Y
T
R
L
G
N
P
T
T
D
A
L
E
K
K
L
A
V
L
E
R
G
E
A
G
L
A
T
A
S
G
I
S
A
I
T
T
T
L
L
T
L
C
Q
Q
G
D
H
I
V
S
A
S
A
I
Y
G
C
T
H
A
F
L
S
H
S
M
P
K
F
G
I
N
V
S
F
V
D
AA
K
--
P
E
E
I
---
R
A
A
M
R
P
E
T
K
V
V
Y
I
E
T
P
A
N
P
T
L
S
L
V
D
I
E
T
V
A
G
I
A
H
-
Q
-
Q
--
G
A
L
--
L
V
V
D
N
T
F
M
S
-
P
Y
C
-
Q
Q
P
L
Q
L
G
A
D
I
V
V
H
S
V
T
K
Y
I
N
G
H
G
D
V
I
G
G
I
I
V
G
K
Q
E
F
----
I
D
Q
A
---
R
F
V
G
-------------------------------
L
K
D
I
T
G
G
C
M
S
P
F
N
A
W
L
T
L
R
G
V
K
T
L
G
I
R
M
E
R
H
C
E
N
A
L
K
I
A
R
F
L
E
G
H
P
S
I
T
R
V
Y
Y
P
G
L
S
S
H
P
Q
Y
E
L
G
Q
R
Q
M
S
-
L
--
P
G
G
I
I
S
F
E
I
A
G
G
L
E
A
G
R
R
M
I
N
S
V
E
L
C
L
L
A
V
S
L
G
D
T
E
T
L
I
Q
H
P
A
S
M
T
H
S
P
V
A
P
E
E
R
L
K
A
G
I
T
D
G
L
I
R
L
S
V
G
L
E
D
P
E
D
I
I
N
D
L
E
-------------------
28
PsiBlast_CBE
75.48
40%
-97
- C1 -
4OC9
1
?
C:
[4-419]
---------------
F
N
K
E
T
L
A
L
H
G
A
Y
N
F
D
-
T
Q
R
S
I
S
V
P
I
Y
Q
N
T
A
Y
N
F
E
N
L
D
Q
A
A
A
R
F
N
L
Q
E
L
G
N
I
Y
S
R
L
S
N
P
T
S
D
V
L
G
Q
R
L
A
N
V
E
G
G
A
F
G
I
P
V
A
S
G
M
A
A
C
F
Y
A
L
I
N
L
A
S
S
G
D
N
V
A
Y
S
N
K
I
Y
G
G
T
Q
T
L
I
S
H
T
L
K
N
F
G
I
E
A
R
E
F
D
-----
I
D
D
L
D
S
L
E
K
V
I
D
Q
N
T
K
A
I
F
F
E
S
L
S
N
P
Q
I
A
I
A
D
I
E
K
I
N
Q
I
A
K
-
K
-
H
--
K
I
V
--
S
I
C
D
N
T
V
A
T
-
P
F
L
-
L
Q
P
F
K
H
G
V
D
V
I
V
H
S
L
S
K
Y
V
S
G
Q
G
T
A
L
G
G
A
L
I
E
R
K
D
L
N
DLL
K
N
N
D
---
R
Y
K
A
F
N
T
P
D
P
S
Y
H
G
L
N
L
N
T
-
L
-
D
L
P
I
F
S
I
R
V
I
I
T
W
L
R
D
L
-
G
A
S
L
A
P
Q
N
A
W
L
L
L
Q
G
L
E
T
L
A
V
R
I
E
K
H
S
Q
N
A
E
K
V
A
N
F
L
N
S
H
P
D
I
K
G
V
N
Y
P
T
L
A
S
N
A
Y
H
N
L
F
K
K
Y
F
D
-
K
N
F
A
S
G
L
L
S
F
E
-
A
K
D
Y
E
H
A
R
R
I
C
D
K
T
Q
L
F
L
L
A
A
N
L
G
D
S
K
S
L
I
I
H
P
A
S
T
T
H
S
Q
L
S
E
E
E
L
Q
K
A
G
I
T
K
A
T
I
R
L
S
I
G
L
E
N
S
D
D
L
I
A
D
L
K
-------------------
33
PsiBlast_CBE
75.46
39%
-92
- C1 -
5DX5
4
?
B:
[9-392]
-----------------
F
A
T
K
A
I
H
G
G
H
I
G
D
K
Q
F
G
S
L
A
T
P
I
Y
Q
T
S
T
F
I
F
D
S
A
E
Q
G
G
R
R
F
A
G
E
E
S
G
Y
I
Y
S
R
L
G
N
P
T
S
T
E
V
E
N
K
L
A
L
L
E
G
G
E
A
A
V
V
A
A
S
G
M
G
A
I
A
A
S
L
W
S
A
L
K
S
G
D
H
V
V
A
S
D
T
L
Y
G
C
T
F
A
L
L
N
H
G
L
T
R
Y
G
V
E
V
T
F
V
---
D
--
V
S
N
L
D
E
V
K
N
A
L
K
P
N
T
K
V
V
Y
L
E
T
P
A
N
P
T
L
K
V
T
D
I
R
K
I
S
N
M
V
H
-
E
-
S
--
N
K
E
CF
V
F
V
D
N
T
F
C
T
-
P
Y
I
-
Q
R
P
L
E
L
G
A
D
V
V
V
H
S
A
T
K
Y
L
N
G
H
G
D
V
I
A
G
F
A
V
--------------------------------------
G
K
E
E
F
I
N
Q
V
K
L
F
G
I
K
D
M
T
G
S
V
T
G
P
F
E
S
F
L
I
I
R
G
M
K
T
L
Q
L
R
M
E
K
H
C
K
N
A
M
E
V
A
K
F
L
E
S
H
P
A
V
E
K
V
Y
Y
P
G
L
E
S
F
K
Y
Y
Q
L
A
-
R
E
Q
M
-
K
L
-
P
G
A
M
I
S
F
E
L
K
G
G
V
E
E
G
K
I
V
M
N
N
V
K
L
A
T
L
A
V
S
L
G
D
S
E
T
L
I
Q
H
P
A
S
M
T
H
S
P
Y
T
A
E
E
R
K
A
A
G
I
S
D
G
L
V
R
L
S
V
G
L
E
D
A
E
D
I
I
D
D
L
K
-------------------
8
PsiBlast_PDB
75.24
42%
-93
- C1 -
3JWB
4
?
A:
[7-390]
---------------
Y
G
F
N
T
Q
I
V
H
A
G
Q
Q
P
D
P
S
T
G
A
L
S
T
P
I
F
Q
T
S
T
F
V
F
D
S
A
E
Q
G
A
A
R
F
A
L
E
E
S
G
Y
I
Y
T
R
L
G
N
P
T
T
D
A
L
E
K
K
L
A
V
L
E
R
G
E
A
G
L
A
T
A
S
G
I
S
A
I
T
T
T
L
L
T
L
C
Q
Q
G
D
H
I
V
S
A
S
A
I
Y
G
C
T
H
A
F
L
S
H
S
M
P
K
F
G
I
N
V
S
F
V
D
AA
K
--
P
E
E
I
---
R
A
A
M
R
P
E
T
K
V
V
Y
I
E
T
P
A
N
P
T
L
S
L
V
D
I
E
T
V
A
G
I
A
H
-
Q
-
Q
--
G
A
L
--
L
V
V
D
N
T
F
M
S
-
P
Y
C
-
Q
Q
P
L
Q
L
G
A
D
I
V
V
H
S
V
T
K
Y
I
N
G
H
G
D
V
I
G
G
I
I
V
G
K
Q
E
F
----
I
D
Q
A
---
R
F
V
G
-------------------------------
L
K
D
I
T
G
G
C
M
S
P
F
N
A
W
L
T
L
R
G
V
K
T
L
G
I
R
M
E
R
H
C
E
N
A
L
K
I
A
R
F
L
E
G
H
P
S
I
T
R
V
Y
Y
P
G
L
S
S
H
P
Q
Y
E
L
G
Q
R
Q
M
S
-
L
--
P
G
G
I
I
S
F
E
I
A
G
G
L
E
A
G
R
R
M
I
N
S
V
E
L
C
L
L
A
V
S
L
G
D
T
E
T
L
I
Q
H
P
A
S
M
T
H
S
P
V
A
P
E
E
R
L
K
A
G
I
T
D
G
L
I
R
L
S
V
G
L
E
D
P
E
D
I
I
N
D
L
E
-------------------
108
HHSearch
75.13
41%
-88
- C1 -
5DX5
3
?
A:
[3-399]
-----------
N
I
K
K
M
G
F
A
T
K
A
I
H
G
G
H
I
G
D
K
Q
F
G
S
L
A
T
P
I
Y
Q
T
S
T
F
I
F
D
S
A
E
Q
G
G
R
R
F
A
G
E
E
S
G
Y
I
Y
S
R
L
G
N
P
T
S
T
E
V
E
N
K
L
A
L
L
E
G
G
E
A
A
V
V
A
A
S
G
M
G
A
I
A
A
S
L
W
S
A
L
K
S
G
D
H
V
V
A
S
D
T
L
Y
G
C
T
F
A
L
L
N
H
G
L
T
R
Y
G
V
E
V
T
F
V
D
--
V
---
S
N
L
D
E
V
K
N
A
L
K
P
N
T
K
V
V
Y
L
E
T
P
A
N
P
T
L
K
V
T
D
I
R
K
I
S
N
M
V
H
-
E
-
S
NK
E
C
F
--
V
F
V
D
N
T
F
C
T
-
P
Y
I
-
Q
R
P
L
E
L
G
A
D
V
V
V
H
S
A
T
K
Y
L
N
G
H
G
D
V
I
A
G
F
A
V
G
K
E
E
F
I
---
N
------
Q
V
K
---
L
F
-------------------------
G
I
K
D
M
T
-
G
S
V
T
G
P
F
E
S
F
L
I
I
R
G
M
K
T
L
Q
L
R
M
E
K
H
C
K
N
A
M
E
V
A
K
F
L
E
S
H
P
A
V
E
K
V
Y
Y
P
G
L
E
S
F
K
Y
Y
Q
L
A
R
E
Q
M
--
K
L
-
P
G
A
M
I
S
F
E
L
K
G
G
V
E
E
G
K
I
V
M
N
N
V
K
L
A
T
L
A
V
S
L
G
D
S
E
T
L
I
Q
H
P
A
S
M
T
H
S
P
Y
T
A
E
E
R
K
A
A
G
I
S
D
G
L
V
R
L
S
V
G
L
E
D
A
E
D
I
I
D
D
L
K
Q
A
L
D
L
I
V
------------
20
PsiBlast_PDB
73.80
39%
-94
- C1 -
5DX5
3
?
A:
[9-392]
-----------------
F
A
T
K
A
I
H
G
G
H
I
G
D
K
Q
F
G
S
L
A
T
P
I
Y
Q
T
S
T
F
I
F
D
S
A
E
Q
G
G
R
R
F
A
G
E
E
S
G
Y
I
Y
S
R
L
G
N
P
T
S
T
E
V
E
N
K
L
A
L
L
E
G
G
E
A
A
V
V
A
A
S
G
M
G
A
I
A
A
S
L
W
S
A
L
K
S
G
D
H
V
V
A
S
D
T
L
Y
G
C
T
F
A
L
L
N
H
G
L
T
R
Y
G
V
E
V
T
F
V
---
D
--
V
S
N
L
D
E
V
K
N
A
L
K
P
N
T
K
V
V
Y
L
E
T
P
A
N
P
T
L
K
V
T
D
I
R
K
I
S
N
M
V
H
-
E
-
S
--
N
K
E
C
F
V
F
V
D
N
T
F
C
T
-
P
Y
I
-
Q
R
P
L
E
L
G
A
D
V
V
V
H
S
A
T
K
Y
L
N
G
H
G
D
V
I
A
G
F
A
V
--------------------------------------
G
K
E
E
F
I
N
Q
V
K
L
F
G
I
K
D
M
T
G
S
V
T
G
P
F
E
S
F
L
I
I
R
G
M
K
T
L
Q
L
R
M
E
K
H
C
K
N
A
M
E
V
A
K
F
L
E
S
H
P
A
V
E
K
V
Y
Y
P
G
L
E
S
F
K
Y
Y
Q
L
A
-
R
E
Q
M
-
K
L
-
P
G
A
M
I
S
F
E
L
K
G
G
V
E
E
G
K
I
V
M
N
N
V
K
L
A
T
L
A
V
S
L
G
D
S
E
T
L
I
Q
H
P
A
S
M
T
H
S
P
Y
T
A
E
E
R
K
A
A
G
I
S
D
G
L
V
R
L
S
V
G
L
E
D
A
E
D
I
I
D
D
L
K
-------------------
6
PsiBlast_PDB
72.29
42%
-94
- C1 -
3MKJ
1
?
A:
[7-390]
---------------
Y
G
F
N
T
Q
I
V
H
A
G
Q
Q
P
D
P
S
T
G
A
L
S
T
P
I
F
Q
T
S
T
F
V
F
D
S
A
E
Q
G
A
A
R
F
-----------
L
G
N
P
T
T
D
A
L
E
K
K
L
A
V
L
E
R
G
E
A
G
L
A
T
A
S
G
I
S
A
I
T
T
T
L
L
T
L
C
Q
Q
G
D
H
I
V
S
A
S
A
I
Y
G
C
T
H
A
F
L
S
H
S
M
P
K
F
G
I
N
V
S
F
V
D
AA
K
--
P
E
E
I
---
R
A
A
M
R
P
E
T
K
V
V
Y
I
E
T
P
A
N
P
T
L
S
L
V
D
I
E
T
V
A
G
I
A
H
-
Q
-
Q
--
G
A
L
--
L
V
V
D
N
T
F
M
S
-
P
Y
C
-
Q
Q
P
L
Q
L
G
A
D
I
V
V
H
S
V
T
K
Y
I
N
G
H
G
D
V
I
G
G
I
I
V
G
K
Q
E
F
----
I
D
Q
A
---
R
F
V
G
-------------------------------
L
K
D
I
T
G
G
C
M
S
P
F
N
A
W
L
T
L
R
G
V
K
T
L
G
I
R
M
E
R
H
C
E
N
A
L
K
I
A
R
F
L
E
G
H
P
S
I
T
R
V
Y
Y
P
G
L
S
S
H
P
Q
Y
E
L
G
Q
R
Q
M
S
-
L
--
P
G
G
I
I
S
F
E
I
A
G
G
L
E
A
G
R
R
M
I
N
S
V
E
L
C
L
L
A
V
S
L
G
D
T
E
T
L
I
Q
H
P
A
S
M
T
H
S
P
V
A
P
E
E
R
L
K
A
G
I
T
D
G
L
I
R
L
S
V
G
L
E
D
P
E
D
I
I
N
D
L
E
-------------------
82
PsiBlast_CBE
68.97
35%
-86
- C1 -
1E5F
5
?
B:
[10-396]
-------------------
T
A
C
I
H
A
N
P
Q
K
D
-
Q
F
G
A
A
I
P
P
I
Y
Q
T
S
T
F
V
F
D
N
C
Q
Q
G
G
N
R
F
A
G
Q
E
S
G
Y
I
Y
T
R
L
G
N
P
T
V
S
N
L
E
G
K
I
A
F
L
E
K
T
E
A
C
V
A
T
S
S
G
M
G
A
I
A
A
T
V
L
T
I
L
K
A
G
D
H
L
I
S
D
E
C
L
Y
G
C
T
H
A
L
F
E
H
A
L
T
K
F
G
I
Q
V
D
F
I
N
--
T
AI
P
G
E
V
---
K
K
H
M
K
P
N
T
K
I
V
Y
F
E
T
P
A
N
P
T
L
K
I
I
D
M
E
R
V
C
K
D
A
H
S
Q
-
E
--
G
V
L
--
V
I
A
D
N
T
F
C
S
-
P
M
I
-
T
N
P
V
D
F
G
V
D
V
V
V
H
S
A
T
K
Y
I
N
G
H
T
D
V
V
A
G
L
I
C
--
G
K
A
D
---
L
L
Q
---------------------------------
Q
I
R
M
V
G
I
K
D
I
T
G
S
V
I
S
P
H
D
A
W
L
I
T
R
G
L
S
T
L
N
I
R
M
K
A
E
S
E
N
A
M
K
V
A
E
Y
L
K
S
H
P
A
V
E
K
V
Y
Y
P
G
F
E
D
H
E
G
H
D
I
A
K
K
-
Q
M
-
R
M
-
Y
G
S
M
I
T
F
I
L
K
S
G
F
E
G
A
K
K
L
L
D
N
L
K
L
I
T
L
A
V
S
L
G
G
C
E
S
L
I
Q
H
P
A
S
M
T
H
A
V
V
P
K
E
E
R
E
A
A
G
I
T
D
G
M
I
R
L
S
V
G
I
E
D
A
D
E
L
I
A
D
F
K
Q
G
L
D
A
L
L
------------
84
PsiBlast_CBE
68.66
35%
-87
- C1 -
1E5E
6
?
B:
[10-396]
-------------------
T
A
C
I
H
A
N
P
Q
K
D
-
Q
F
G
A
A
I
P
P
I
Y
Q
T
S
T
F
V
F
D
N
C
Q
Q
G
G
N
R
F
A
G
Q
E
S
G
Y
I
Y
T
R
L
G
N
P
T
V
S
N
L
E
G
K
I
A
F
L
E
K
T
E
A
C
V
A
T
S
S
G
M
G
A
I
A
A
T
V
L
T
I
L
K
A
G
D
H
L
I
S
D
E
C
L
Y
G
C
T
H
A
L
F
E
H
A
L
T
K
F
G
I
Q
V
D
F
I
N
--
T
AI
P
G
E
V
---
K
K
H
M
K
P
N
T
K
I
V
Y
F
E
T
P
A
N
P
T
L
K
I
I
D
M
E
R
V
C
K
D
A
H
S
Q
-
E
--
G
V
L
--
V
I
A
D
N
T
F
C
S
-
P
M
I
-
T
N
P
V
D
F
G
V
D
V
V
V
H
S
A
T
K
Y
I
N
G
H
T
D
V
V
A
G
L
I
C
--
G
K
A
D
---
L
L
Q
---------------------------------
Q
I
R
M
V
G
I
K
D
I
T
G
S
V
I
S
P
H
D
A
W
L
I
T
R
G
L
S
T
L
N
I
R
M
K
A
E
S
E
N
A
M
K
V
A
E
Y
L
K
S
H
P
A
V
E
K
V
Y
Y
P
G
F
E
D
H
E
G
H
D
I
A
K
K
-
Q
M
-
R
M
-
Y
G
S
M
I
T
F
I
L
K
S
G
F
E
G
A
K
K
L
L
D
N
L
K
L
I
T
L
A
V
S
L
G
G
C
E
S
L
I
Q
H
P
A
S
M
T
H
A
V
V
P
K
E
E
R
E
A
A
G
I
T
D
G
M
I
R
L
S
V
G
I
E
D
A
D
E
L
I
A
D
F
K
Q
G
L
D
A
L
L
------------
83
PsiBlast_CBE
68.33
35%
-87
- C1 -
1E5F
6
?
A:
[10-396]
-------------------
T
A
C
I
H
A
N
P
Q
K
D
-
Q
F
G
A
A
I
P
P
I
Y
Q
T
S
T
F
V
F
D
N
C
Q
Q
G
G
N
R
F
A
G
Q
E
S
G
Y
I
Y
T
R
L
G
N
P
T
V
S
N
L
E
G
K
I
A
F
L
E
K
T
E
A
C
V
A
T
S
S
G
M
G
A
I
A
A
T
V
L
T
I
L
K
A
G
D
H
L
I
S
D
E
C
L
Y
G
C
T
H
A
L
F
E
H
A
L
T
K
F
G
I
Q
V
D
F
I
N
--
T
AI
P
G
E
V
---
K
K
H
M
K
P
N
T
K
I
V
Y
F
E
T
P
A
N
P
T
L
K
I
I
D
M
E
R
V
C
K
D
A
H
S
Q
-
E
--
G
V
L
--
V
I
A
D
N
T
F
C
S
-
P
M
I
-
T
N
P
V
D
F
G
V
D
V
V
V
H
S
A
T
K
Y
I
N
G
H
T
D
V
V
A
G
L
I
C
--
G
K
A
D
---
L
L
Q
---------------------------------
Q
I
R
M
V
G
I
K
D
I
T
G
S
V
I
S
P
H
D
A
W
L
I
T
R
G
L
S
T
L
N
I
R
M
K
A
E
S
E
N
A
M
K
V
A
E
Y
L
K
S
H
P
A
V
E
K
V
Y
Y
P
G
F
E
D
H
E
G
H
D
I
A
K
K
-
Q
M
-
R
M
-
Y
G
S
M
I
T
F
I
L
K
S
G
F
E
G
A
K
K
L
L
D
N
L
K
L
I
T
L
A
V
S
L
G
G
C
E
S
L
I
Q
H
P
A
S
M
T
H
A
V
V
P
K
E
E
R
E
A
A
G
I
T
D
G
M
I
R
L
S
V
G
I
E
D
A
D
E
L
I
A
D
F
K
Q
G
L
D
A
L
L
------------
85
PsiBlast_CBE
68.32
35%
-85
- C1 -
1E5E
5
?
A:
[10-397]
-------------------
T
A
C
I
H
A
N
P
Q
K
D
-
Q
F
G
A
A
I
P
P
I
Y
Q
T
S
T
F
V
F
D
N
C
Q
Q
G
G
N
R
F
A
G
Q
E
S
G
Y
I
Y
T
R
L
G
N
P
T
V
S
N
L
E
G
K
I
A
F
L
E
K
T
E
A
C
V
A
T
S
S
G
M
G
A
I
A
A
T
V
L
T
I
L
K
A
G
D
H
L
I
S
D
E
C
L
Y
G
C
T
H
A
L
F
E
H
A
L
T
K
F
G
I
Q
V
D
F
I
N
--
T
AI
P
G
E
V
---
K
K
H
M
K
P
N
T
K
I
V
Y
F
E
T
P
A
N
P
T
L
K
I
I
D
M
E
R
V
C
K
D
A
H
S
Q
-
E
--
G
V
L
--
V
I
A
D
N
T
F
C
S
-
P
M
I
-
T
N
P
V
D
F
G
V
D
V
V
V
H
S
A
T
K
Y
I
N
G
H
T
D
V
V
A
G
L
I
C
--
G
K
A
D
---
L
L
Q
---------------------------------
Q
I
R
M
V
G
I
K
D
I
T
G
S
V
I
S
P
H
D
A
W
L
I
T
R
G
L
S
T
L
N
I
R
M
K
A
E
S
E
N
A
M
K
V
A
E
Y
L
K
S
H
P
A
V
E
K
V
Y
Y
P
G
F
E
D
H
E
G
H
D
I
A
K
K
-
Q
M
-
R
M
-
Y
G
S
M
I
T
F
I
L
K
S
G
F
E
G
A
K
K
L
L
D
N
L
K
L
I
T
L
A
V
S
L
G
G
C
E
S
L
I
Q
H
P
A
S
M
T
H
A
V
V
P
K
E
E
R
E
A
A
G
I
T
D
G
M
I
R
L
S
V
G
I
E
D
A
D
E
L
I
A
D
F
K
Q
G
L
D
A
L
L
R
-----------
111
HHSearch
65.79
37%
-84
- C1 -
1E5E
5
?
A:
[5-397]
--------------
R
M
T
P
A
T
A
C
I
H
A
N
P
Q
K
D
-
Q
F
G
A
A
I
P
P
I
Y
Q
T
S
T
F
V
F
D
N
C
Q
Q
G
G
N
R
F
A
G
Q
E
S
G
Y
I
Y
T
R
L
G
N
P
T
V
S
N
L
E
G
K
I
A
F
L
E
K
T
E
A
C
V
A
T
S
S
G
M
G
A
I
A
A
T
V
L
T
I
L
K
A
G
D
H
L
I
S
D
E
C
L
Y
G
C
T
H
A
L
F
E
H
A
L
T
K
F
G
I
Q
V
D
F
I
N
--
T
---
A
I
P
G
E
V
K
K
H
M
K
P
N
T
K
I
V
Y
F
E
T
P
A
N
P
T
L
K
I
I
D
M
E
R
V
C
K
D
A
H
-
S
Q
E
--
G
V
L
--
V
I
A
D
N
T
F
C
S
-
P
M
I
-
T
N
P
V
D
F
G
V
D
V
V
V
H
S
A
T
K
Y
I
N
G
H
T
D
V
V
A
G
L
I
C
G
K
A
D
L
L
---
Q
------
Q
I
R
M
V
----------------------------
G
I
K
D
I
T
-
G
S
V
I
S
P
H
D
A
W
L
I
T
R
G
L
S
T
L
N
I
R
M
K
A
E
S
E
N
A
M
K
V
A
E
Y
L
K
S
H
P
A
V
E
K
V
Y
Y
P
G
F
E
D
H
E
G
H
D
I
A
K
K
Q
M
--
R
M
-
Y
G
S
M
I
T
F
I
L
K
S
G
F
E
G
A
K
K
L
L
D
N
L
K
L
I
T
L
A
V
S
L
G
G
C
E
S
L
I
Q
H
P
A
S
M
T
H
A
V
V
P
K
E
E
R
E
A
A
G
I
T
D
G
M
I
R
L
S
V
G
I
E
D
A
D
E
L
I
A
D
F
K
Q
G
L
D
A
L
L
R
-----------
112
HHSearch
64.73
35%
-85
- C1 -
1IBJ
4
METC_ARATH
A:
[85-463]
---------------
A
S
V
S
T
L
L
V
N
L
D
N
K
F
D
P
-
F
D
A
M
S
T
P
L
Y
Q
T
A
T
F
K
Q
P
S
A
I
--------
E
N
G
P
Y
D
Y
T
R
S
G
N
P
T
R
D
A
L
E
S
L
L
A
K
L
D
K
A
D
R
A
F
C
F
T
S
G
M
A
A
L
S
A
V
T
H
-
L
I
K
N
G
E
E
I
V
A
G
D
D
V
Y
G
G
S
D
R
L
L
S
Q
V
V
P
R
S
G
V
V
V
K
R
V
N
--
T
---
T
K
L
D
E
V
A
A
A
I
G
P
Q
T
K
L
V
W
L
E
S
P
T
N
P
R
Q
Q
I
S
D
I
R
K
I
S
E
M
A
H
-
A
-
Q
--
G
A
L
--
V
L
V
D
N
S
I
M
S
-
P
V
L
-
S
R
P
L
E
L
G
A
D
I
V
M
H
S
A
T
K
F
I
A
G
H
S
D
V
M
A
G
V
L
A
V
K
G
E
K
L
---
A
K
-----
E
V
Y
------------------------------
F
L
Q
N
S
E
-
G
S
G
L
A
P
F
D
C
W
L
C
L
R
G
I
K
T
M
A
L
R
I
E
K
Q
Q
E
N
A
R
K
I
A
M
Y
L
S
S
H
P
R
V
K
K
V
Y
Y
A
G
L
P
D
H
P
G
H
H
L
H
F
S
Q
A
--
K
G
-
A
G
S
V
F
S
F
I
T
G
S
V
-
A
L
S
K
H
L
V
E
T
T
K
Y
F
S
I
A
V
S
F
G
S
V
K
S
L
I
S
M
P
C
F
M
S
H
A
S
I
P
A
E
V
R
E
A
R
G
L
T
E
D
L
V
R
I
S
A
G
I
E
D
V
D
D
L
I
S
D
L
D
I
A
F
K
T
F
P
------------