@TOME V2.2
(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 : S47A2_HUMAN: (2015-12-11 )
MDSLQDTVALDHGGCCPALSRLVPRGFGTEMWTLFALSGPLFLFQVLTFMIYIVSTVFCGHLGKVELASVTLAVAFVNVCGVSVGVGLSSACDTLMSQSFGSPNKKHVGVILQRGALVLLLCCLPCWALFLNTQHILLLFRQDPDVSRLTQDYVMIFIPGLPVIFLYNLLAKYLQNQGWLKGQEEESPFQTPGLSILHPSHSHLSRASFHLFQKITWPQVLSGVVGNCVNGVANYALVSVLNLGVRGSAYANIISQFAQTVFLLLYIVLKKLHLETWAGWSSQCLQDWGPFFSLAVPSMLMICVEWWAYEIGSFLMGLLSVVDLSAQAVIYEVATVTYMIPLGLSIGVCVRVGMALGAADTVQAKRSAVSGVLSIVGISLVLGTLISILKNQLGHIFTNDEDVIALVSQVLPVYSVFHVFEAICCVYGGVLRGTGKQAFGAAVNAITYYIIGLPLGILLTFVVRMRIMGLWLGMLACVFLATAAFVAYTARLDWKLAAEEAKKHSGRQQQQRAESTATRPGPEKAVLSSVATGSSPGITLTTYSRSECHVDFFRTPEEAHALSAPTSRLSVKQLVIRRGAALGAASATLMVGLTVRILATRH
Atome Classification :
(20 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......----.450.......460-----.......470..-----.....480.......490.......500........510.......520.......530....---...540.....------..550.......560.......570.......580.......590.......600
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MDS
L
Q
D
T
V
ALDHGG
C
C
P
A
L
S
R
LVPRGFGT
E
M
W
T
L
F
ALS
G
P
L
F
L
F
Q
V
L
T
F
M
I
Y
I
V
S
T
V
F
CGHLGKV
E
L
A
S
V
T
L
A
V
A
F
V
N
V
CGVSVGV
G
L
S
S
A
C
D
T
L
M
S
Q
SFGSPNK
K
H
V
G
V
I
L
QR
G
---
A
L
V
L
-
L
L
C
C
L
P
C
W
A
L
-
F
LNT
Q
H
I
L
L
L
F
RQDP
D
V
S
R
L
TQ
D
Y
V
M
I
F
IP-G
L
P
V
I
F
L
Y
N
L
L
A
K
Y
L
QNQGWLKGQEEESPFQTPG
L
S
I
LHPSH
S
H
L
S
R
A
S
F
H
L
F
Q
KI
T
W
P
Q
V
L
S
G
V
V
G
N
C
V
N
G
V
A
N
Y
A
L
V
----
S
----
V
L
NLGVRG
S
A
Y
A
N
I
I
S
Q
F
A
Q
T
V
F
L
L
L
Y
I
V
-
L
K
K
--
L
H
--
L
E
T-WAG
W
S
S
Q
-------
C
L
Q
-
D
WG
P
F
---
F
S
L
A
V
P
S
M
L
M
I
C
V
E
W
W
A
Y
E
I
G
S
-
F
L
M
G
-
L
L
S
V
V
D
LS
A
Q
A
V
I
Y
E
V
A
T
V
T
Y
M
I
PLGL
S
I
G
V
C
V
R
V
G
M
ALGA
A
D
T
V
Q
A
K
R
S
A
V
S
G
V
L
S
I
V
G
I
--
S
L
V
L
G
T
L
I
S
--
I
L
K
N
-QLGHIFTN
D
E
D
V
I
---
A
L
V
S
Q
V
L
P
V
Y
S
V
F
H
V
F
E
A
I
C
C
VYG
G
V
LRGT
G
K
Q
A
F
G
A
A
V
N
A
I
T
Y
----
Y
I
I
GL
P
L
G
I
L
L
T
F
V
-----
V
R
M
R
I
M
G
L
W
L
G
M
-----
L
A
C
V
F
L
A
T
A
A
F
V
A
Y
T
A
RL
D
W
K
L
A
A
E
E
A
-
K
K
HS
G
R
Q
Q
Q
Q
R
A
E
STATRPG
P
E
K
A
V
L
S
S
VATGSSP---
G
I
T
L
T
T
YSRS
E
------
C
H
V
D
F
FRT
P
E
E
AHALSAP
T
S
R
L
S
V
K
Q
L
V
I
RRGAALGA
A
S
A
T
L
M
V
G
L
T
V
R
I
L
A
TRH
6
PsiBlast_PDB
88.17
23%
-117
- C1 -
4HUN
1
?
A:
[1-458]
------------------
L
D
R
F
S
F
S
V
F
L
K
E
I
R
L
L
T
A
L
A
L
P
M
L
L
A
Q
V
A
Q
V
G
I
G
F
V
D
T
V
M
A
G
G
A
G
K
E
D
L
A
A
V
A
L
G
S
S
A
F
A
T
V
Y
I
T
F
-
M
G
I
M
A
A
L
N
P
M
I
A
Q
L
Y
G
A
G
K
T
G
E
A
G
E
T
G
R
Q
G
I
W
F
G
L
I
L
G
I
F
G
M
I
L
M
W
A
A
-
I
T
P
F
R
N
W
L
T
L
----
S
D
Y
V
E
G
T
M
A
Q
Y
M
L
F
T
S
L
A
M
P
A
A
M
V
H
R
A
L
H
A
Y
------------
A
S
S
L
N
R
P
R
L
I
M
L
------
V
S
F
A
A
F
--------------
V
L
N
V
P
L
N
Y
I
F
V
Y
G
K
F
----
G
----
M
P
A
L
G
G
A
G
C
G
V
A
T
M
A
V
F
W
F
S
A
L
A
L
W
I
Y
I
A
-
K
E
K
--
F
F
--
R
P
F
---
G
L
T
A
K
-------
F
G
K
P
D
W
A
V
F
KQI
W
K
I
G
A
P
I
G
L
S
Y
F
L
E
A
S
A
F
S
F
I
V
-
F
L
I
A
-
P
F
G
E
D
Y
V
A
A
Q
Q
V
G
I
S
L
S
G
I
L
Y
M
I
P
Q
S
V
G
S
A
G
T
V
R
I
G
F
S
L
G
R
R
E
F
S
R
A
R
Y
--
I
S
G
V
S
L
V
S
G
W
--
V
L
A
V
I
T
V
L
S
LV
L
F
R
S
-
P
L
A
S
M
Y
N
D
D
P
A
V
L
---
S
I
A
S
T
V
L
L
F
A
G
L
F
Q
P
A
D
F
T
Q
C
I
A
S
Y
A
L
R
G
Y
K
V
T
K
V
P
M
F
I
H
A
A
A
F
----
W
G
C
G
L
L
P
G
Y
L
L
A
Y
R
-----
F
D
M
G
I
Y
G
F
W
T
A
L
-----
I
A
S
L
T
I
A
A
V
A
L
V
W
C
L
E
K
Y
S
M
E
L
V
K
S
H
K
-
A
V
S
S
G
L
--------------------------------------------------------------------------------------------------------
30
Fugue
87.79
20%
-124
- C1 -
3MKT
-
?
A:
[2-461]
--------------------
E
N
S
V
H
R
Y
K
K
E
A
S
N
L
I
K
L
A
T
P
V
L
I
A
S
V
A
Q
T
G
M
G
F
V
D
T
I
M
A
G
G
V
S
A
I
D
M
A
A
V
S
I
A
A
S
I
W
L
P
S
I
L
F
G
V
G
L
L
M
A
L
V
P
V
V
-
A
Q
L
N
G
A
G
R
Q
H
K
I
P
F
E
V
H
Q
G
---
L
I
L
A
-
L
L
V
S
V
P
I
I
A
V
-
L
F
Q
T
Q
F
I
I
R
F
M
D
V
E
E
A
M
A
T
K
T
V
G
Y
M
H
A
V
I
F
-
A
V
P
A
Y
L
L
F
Q
A
L
R
S
F
T
D
G
M
S
L
------------------------------------
T
K
P
A
M
V
I
G
F
I
G
L
L
L
N
I
P
L
N
W
I
F
V
----
Y
GKFG
A
P
E
L
G
G
V
G
C
G
V
A
T
A
I
V
Y
W
I
M
L
L
L
L
L
F
Y
I
V
-
T
S
K
--
R
L
AH
V
K
V
-
F
E
T
F
H
K
P
-------
Q
P
K
-
E
L
I
R
L
---
F
R
L
G
F
P
V
A
A
A
L
F
F
E
V
T
L
F
A
V
V
A
-
L
L
V
A
-
P
L
G
S
T
V
V
A
A
H
Q
V
A
L
N
F
S
S
L
V
F
M
F
P
M
S
I
G
A
A
V
S
I
R
V
G
H
K
L
G
E
Q
D
T
K
G
A
A
I
A
A
N
V
G
L
M
T
G
L
A
T
--
A
C
I
T
A
L
L
T
V
--
L
F
R
E
-
Q
I
A
L
L
Y
T
E
N
Q
V
V
V
---
A
L
A
M
Q
L
L
L
F
A
A
I
Y
Q
C
M
D
A
V
Q
V
V
A
A
G
S
L
R
G
Y
K
D
M
T
A
I
F
H
R
T
F
I
S
Y
----
W
V
L
G
L
P
T
G
Y
I
L
G
M
T
NWLTE
Q
P
L
G
A
K
G
F
W
L
G
F
-----
I
I
G
L
S
A
A
A
L
M
L
G
Q
R
L
Y
W
L
Q
K
Q
S
D
D
V
Q
L
-
H
L
A
A
K
---------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
87.60
22%
-130
- C1 -
3MKU
-
?
A:
[7-445]
--------------------------
Y
K
K
E
A
S
N
L
I
K
L
A
T
P
V
L
I
A
S
V
A
Q
T
G
M
G
F
V
D
T
I
M
A
G
G
V
S
A
I
D
M
A
A
V
S
I
A
-
A
S
I
W
L
P
S
I
L
F
G
V
G
L
L
M
A
L
V
P
V
V
A
Q
L
N
G
A
G
R
Q
H
K
I
P
F
E
V
H
Q
G
---
L
I
L
A
-
L
L
V
S
V
P
I
I
A
V
-
L
F
Q
T
Q
F
I
I
R
F
M
D
V
E
E
A
M
A
T
K
T
V
G
Y
M
H
A
V
I
F
-
A
V
P
A
Y
L
L
F
Q
A
L
R
S
F
-----------------
T
D
G
M
S
L
-------------------
T
K
P
A
M
V
I
G
F
I
G
L
L
L
N
I
P
L
N
W
I
F
V
YGKF
G
----
A
P
E
L
G
G
V
G
C
G
V
A
T
A
I
V
Y
W
I
M
L
L
L
L
L
F
Y
I
V
-
T
S
K
RL
A
H
--
V
K
V
-
F
E
T
F
H
K
P
-------
Q
P
K
-
E
L
I
R
L
---
F
R
L
G
F
P
V
A
A
A
L
F
F
E
V
T
L
F
A
V
V
A
-
L
L
V
A
-
P
L
G
S
T
V
V
A
A
H
Q
V
A
L
N
F
S
S
L
V
F
M
F
P
M
S
I
G
A
A
V
S
I
R
V
G
H
K
L
G
E
Q
D
T
K
G
A
A
I
A
A
N
V
G
L
M
T
G
L
A
T
--
A
C
I
T
A
L
L
T
V
--
L
F
R
E
-
Q
I
A
L
L
Y
T
E
N
Q
V
V
V
---
A
L
A
M
Q
L
L
L
F
A
A
I
Y
Q
C
M
D
A
V
Q
V
V
A
A
G
S
L
R
G
Y
K
D
M
T
A
I
F
H
R
T
F
I
S
Y
----
W
V
L
G
L
P
T
G
Y
I
L
G
M
T
NWLTE
Q
P
L
G
A
K
G
F
W
L
G
F
-----
I
I
G
L
---
S
A
A
A
L
M
L
G
Q
R
L
Y
W
L
Q
K
Q
S
D
D
-
V
Q
L
H
L
A
A
K
------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
87.50
23%
-113
- C1 -
4HUK
1
?
A:
[1-458]
------------------
L
D
R
F
S
F
S
V
F
L
K
E
I
R
L
L
T
A
L
A
L
P
M
L
L
A
Q
V
A
Q
V
G
I
G
F
V
D
T
V
M
A
G
G
A
G
K
E
D
L
A
A
V
A
L
G
S
S
A
F
A
T
V
Y
I
T
F
-
M
G
I
M
A
A
L
N
P
M
I
A
Q
L
Y
G
A
G
K
T
G
E
A
G
E
T
G
R
Q
G
I
W
F
G
L
I
L
G
I
F
G
M
I
L
M
W
A
A
-
I
T
P
F
R
N
W
L
T
L
----
S
D
Y
V
E
G
T
M
A
Q
Y
M
L
F
T
S
L
A
M
P
A
A
M
V
H
R
A
L
H
A
Y
------------
A
S
S
L
N
R
P
R
L
I
M
L
------
V
S
F
A
A
F
--------------
V
L
N
V
P
L
N
Y
I
F
V
Y
G
K
F
----
G
----
M
P
A
L
G
G
A
G
C
G
V
A
T
M
A
V
F
W
F
S
A
L
A
L
W
I
Y
I
A
-
K
E
K
--
F
F
--
R
P
F
---
G
L
T
A
K
-------
F
G
K
P
D
W
A
V
F
KQI
W
K
I
G
A
P
I
G
L
S
Y
F
L
E
A
S
A
F
S
F
I
V
-
F
L
I
A
-
P
F
G
E
D
Y
V
A
A
Q
Q
V
G
I
S
L
S
G
I
L
Y
M
I
P
Q
S
V
G
S
A
G
T
V
R
I
G
F
S
L
G
R
R
E
F
S
R
A
R
Y
--
I
S
G
V
S
L
V
S
G
W
--
V
L
A
V
I
T
V
L
S
LV
L
F
R
S
-
P
L
A
S
M
Y
N
D
D
P
A
V
L
---
S
I
A
S
T
V
L
L
F
A
G
L
F
Q
P
A
D
F
T
Q
C
I
A
S
Y
A
L
R
G
Y
K
V
T
K
V
P
M
F
I
H
A
A
A
F
----
W
G
C
G
L
L
P
G
Y
L
L
A
Y
R
-----
F
D
M
G
I
Y
G
F
W
T
A
L
-----
I
A
S
L
T
I
A
A
V
A
L
V
W
C
L
E
K
Y
S
M
E
L
V
K
S
H
K
-
A
V
S
S
G
L
--------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
87.44
22%
-131
- C1 -
3MKT
-
?
A:
[8-446]
--------------------------
Y
K
K
E
A
S
N
L
I
K
L
A
T
P
V
L
I
A
S
V
A
Q
T
G
M
G
F
V
D
T
I
M
A
G
G
V
S
A
I
D
M
A
A
V
S
I
A
-
A
S
I
W
L
P
S
I
L
F
G
V
G
L
L
M
A
L
V
P
V
V
A
Q
L
N
G
A
G
R
Q
H
K
I
P
F
E
V
H
Q
G
---
L
I
L
A
-
L
L
V
S
V
P
I
I
A
V
-
L
F
Q
T
Q
F
I
I
R
F
M
D
V
E
E
A
M
A
T
K
T
V
G
Y
M
H
A
V
I
F
-
A
V
P
A
Y
L
L
F
Q
A
L
R
S
F
-----------------
T
D
G
M
S
L
-------------------
T
K
P
A
M
V
I
G
F
I
G
L
L
L
N
I
P
L
N
W
I
F
V
YGKF
G
----
A
P
E
L
G
G
V
G
C
G
V
A
T
A
I
V
Y
W
I
M
L
L
L
L
L
F
Y
I
V
-
T
S
K
RL
A
H
--
V
K
V
-
F
E
T
F
H
K
P
-------
Q
P
K
-
E
L
I
R
L
---
F
R
L
G
F
P
V
A
A
A
L
F
F
E
V
T
L
F
A
V
V
A
-
L
L
V
A
-
P
L
G
S
T
V
V
A
A
H
Q
V
A
L
N
F
S
S
L
V
F
M
F
P
M
S
I
G
A
A
V
S
I
R
V
G
H
K
L
G
E
Q
D
T
K
G
A
A
I
A
A
N
V
G
L
M
T
G
L
A
T
--
A
C
I
T
A
L
L
T
V
--
L
F
R
E
-
Q
I
A
L
L
Y
T
E
N
Q
V
V
V
---
A
L
A
M
Q
L
L
L
F
A
A
I
Y
Q
C
M
D
A
V
Q
V
V
A
A
G
S
L
R
G
Y
K
D
M
T
A
I
F
H
R
T
F
I
S
Y
----
W
V
L
G
L
P
T
G
Y
I
L
G
M
T
NWLTE
Q
P
L
G
A
K
G
F
W
L
G
F
-----
I
I
G
L
---
S
A
A
A
L
M
L
G
Q
R
L
Y
W
L
Q
K
Q
S
D
D
-
V
Q
L
H
L
A
A
K
------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
86.78
23%
-112
- C1 -
4HUM
1
?
A:
[1-458]
------------------
L
D
R
F
S
F
S
V
F
L
K
E
I
R
L
L
T
A
L
A
L
P
M
L
L
A
Q
V
A
Q
V
G
I
G
F
V
D
T
V
M
A
G
G
A
G
K
E
D
L
A
A
V
A
L
G
S
S
A
F
A
T
V
Y
I
T
F
-
M
G
I
M
A
A
L
N
P
M
I
A
Q
L
Y
G
A
G
K
T
G
E
A
G
E
T
G
R
Q
G
I
W
F
G
L
I
L
G
I
F
G
M
I
L
M
W
A
A
-
I
T
P
F
R
N
W
L
T
L
----
S
D
Y
V
E
G
T
M
A
Q
Y
M
L
F
T
S
L
A
M
P
A
A
M
V
H
R
A
L
H
A
Y
------------
A
S
S
L
N
R
P
R
L
I
M
L
------
V
S
F
A
A
F
--------------
V
L
N
V
P
L
N
Y
I
F
V
Y
G
K
F
----
G
----
M
P
A
L
G
G
A
G
C
G
V
A
T
M
A
V
F
W
F
S
A
L
A
L
W
I
Y
I
A
-
K
E
K
--
F
F
--
R
P
F
---
G
L
T
A
K
-------
F
G
K
P
D
W
A
V
F
KQI
W
K
I
G
A
P
I
G
L
S
Y
F
L
E
A
S
A
F
S
F
I
V
-
F
L
I
A
-
P
F
G
E
D
Y
V
A
A
Q
Q
V
G
I
S
L
S
G
I
L
Y
M
I
P
Q
S
V
G
S
A
G
T
V
R
I
G
F
S
L
G
R
R
E
F
S
R
A
R
Y
--
I
S
G
V
S
L
V
S
G
W
--
V
L
A
V
I
T
V
L
S
LV
L
F
R
S
-
P
L
A
S
M
Y
N
D
D
P
A
V
L
---
S
I
A
S
T
V
L
L
F
A
G
L
F
Q
P
A
D
F
T
Q
C
I
A
S
Y
A
L
R
G
Y
K
V
T
K
V
P
M
F
I
H
A
A
A
F
----
W
G
C
G
L
L
P
G
Y
L
L
A
Y
R
-----
F
D
M
G
I
Y
G
F
W
T
A
L
-----
I
A
S
L
T
I
A
A
V
A
L
V
W
C
L
E
K
Y
S
M
E
L
V
K
S
H
K
-
A
V
S
S
G
L
--------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
86.18
23%
-110
- C1 -
4HUL
-
?
A:
[1-458]
------------------
L
D
R
F
S
F
S
V
F
L
K
E
I
R
L
L
T
A
L
A
L
P
M
L
L
A
Q
V
A
Q
V
G
I
G
F
V
D
T
V
M
A
G
G
A
G
K
E
D
L
A
A
V
A
L
G
S
S
A
F
A
T
V
Y
I
T
F
-
M
G
I
M
A
A
L
N
P
M
I
A
Q
L
Y
G
A
G
K
T
G
E
A
G
E
T
G
R
Q
G
I
W
F
G
L
I
L
G
I
F
G
M
I
L
M
W
A
A
-
I
T
P
F
R
N
W
L
T
L
----
S
D
Y
V
E
G
T
M
A
Q
Y
M
L
F
T
S
L
A
M
P
A
A
M
V
H
R
A
L
H
A
Y
------------
A
S
S
L
N
R
P
R
L
I
M
L
------
V
S
F
A
A
F
--------------
V
L
N
V
P
L
N
Y
I
F
V
Y
G
K
F
----
G
----
M
P
A
L
G
G
A
G
C
G
V
A
T
M
A
V
F
W
F
S
A
L
A
L
W
I
Y
I
A
-
K
E
K
--
F
F
--
R
P
F
---
G
L
T
A
K
-------
F
G
K
P
D
W
A
V
F
KQI
W
K
I
G
A
P
I
G
L
S
Y
F
L
E
A
S
A
F
S
F
I
V
-
F
L
I
A
-
P
F
G
E
D
Y
V
A
A
Q
Q
V
G
I
S
L
S
G
I
L
Y
M
I
P
Q
S
V
G
S
A
G
T
V
R
I
G
F
S
L
G
R
R
E
F
S
R
A
R
Y
--
I
S
G
V
S
L
V
S
G
W
--
V
L
A
V
I
T
V
L
S
LV
L
F
R
S
-
P
L
A
S
M
Y
N
D
D
P
A
V
L
---
S
I
A
S
T
V
L
L
F
A
G
L
F
Q
P
A
D
F
T
Q
C
I
A
S
Y
A
L
R
G
Y
K
V
T
K
V
P
M
F
I
H
A
A
A
F
----
W
G
C
G
L
L
P
G
Y
L
L
A
Y
R
-----
F
D
M
G
I
Y
G
F
W
T
A
L
-----
I
A
S
L
T
I
A
A
V
A
L
V
W
C
L
E
K
Y
S
M
E
L
V
K
S
H
K
-
A
V
S
S
G
L
--------------------------------------------------------------------------------------------------------
21
HHSearch
72.83
15%
-139
- C1 -
3W4T
9
?
A:
[13-445]
--------------------------
R
G
D
P
K
K
A
I
V
R
L
S
I
A
M
M
I
G
M
S
V
Q
T
L
Y
N
L
A
D
G
I
W
V
S
G
L
G
P
E
S
L
A
A
V
G
L
F
F
P
V
F
M
G
I
-
I
A
L
A
A
G
L
G
V
G
T
S
S
A
I
A
R
R
I
G
A
R
D
K
E
G
A
D
N
V
A
V
H
S
---
L
I
L
S
-
L
I
L
G
V
T
I
T
I
T
M
L
P
A
I
D
S
L
F
R
S
M
G
A
K
G
E
A
V
E
L
A
I
E
Y
A
R
V
L
L
A
-
G
A
F
I
I
V
F
N
N
V
G
N
G
I
L
R
G
E
G
------------------------------------
D
A
N
R
A
M
L
A
M
V
L
G
S
G
L
N
I
V
L
D
P
I
F
I
----
Y
----
T
L
G
F
G
V
V
G
A
A
Y
A
T
L
L
S
M
V
V
T
S
L
F
I
A
Y
W
L
F
V
K
R
D
--
T
Y
V
-
D
I
T
-
L
R
D
F
-
S
P
-------
S
R
E
-
I
L
K
D
I
---
L
R
V
G
L
P
S
S
L
S
Q
L
S
M
S
I
A
M
F
F
L
N
-
S
V
A
I
T
A
G
G
E
N
G
V
A
V
F
T
S
A
W
R
I
T
M
L
G
I
V
P
I
L
G
M
A
A
A
T
T
S
V
T
G
A
A
Y
G
E
R
N
V
E
K
L
E
T
A
Y
L
Y
A
I
K
I
A
F
M
I
--
E
L
A
V
V
A
F
I
M
--
L
F
A
P
-
Q
V
A
Y
L
F
T
Y
-----VI
K
G
D
L
I
S
A
L
R
T
L
P
V
F
L
V
L
T
P
F
G
M
M
T
S
A
M
F
Q
G
I
G
E
G
E
K
S
L
I
L
T
I
F
R
T
----
L
V
M
Q
V
G
F
A
Y
I
F
V
H
Y
-----
T
T
L
G
L
R
G
V
W
I
G
I
-----
V
I
G
N
M
V
A
A
I
V
G
F
L
W
G
R
M
R
I
S
A
L
K
K
T
-----------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
61.50
22%
-148
- C- -
4LZ9
-
?
A:
[168-418]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
V
T
M
I
V
P
A
V
L
N
I
L
L
D
V
L
F
I
----
F
----
G
L
N
M
G
V
L
G
A
S
I
A
T
V
I
A
Q
A
S
V
T
G
L
V
L
R
Y
F
L
-
T
G
K
--
S
T
--
L
S
L
H
W
S
D
L
R
M
K
GSV
I
K
E
V
C
L
V
-
G
L
P
A
F
---
V
Q
Q
S
S
A
S
L
M
M
I
A
I
N
S
M
L
L
R
F
G
S
D
F
Y
V
G
-
V
F
G
L
V
Q
--------
R
I
M
M
F
V
M
M
P
M
M
G
I
M
Q
A
M
Q
P
I
V
G
Y
N
Y
G
A
K
Q
Y
S
R
L
R
E
T
V
M
L
G
F
K
V
A
T
I
F
--
S
I
G
I
F
A
L
L
M
--
L
F
P
E
-
A
L
L
R
V
F
T
A
D
R
E
V
I
Q
--
A
G
V
S
A
M
H
I
L
F
C
V
T
F
L
I
G
A
Q
-
I
V
A
G
G
L
Y
Q
S
L
G
K
P
K
Q
A
L
I
L
S
L
S
R
Q
----
I
I
F
L
I
P
L
V
L
I
L
P
H
I
-----
F
G
L
S
--
G
V
W
W
A
F
-----
P
I
A
D
V
L
S
F
I
L
T
V
V
L
L
Y
R
D
R
N
V
F
F
L
K
-----------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
52.44
22%
-108
- C1 -
4LZ6
-
?
A:
[168-418]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
V
T
M
I
V
P
A
V
L
N
I
L
L
D
V
L
F
I
----
F
----
G
L
N
M
G
V
L
G
A
S
I
A
T
V
I
A
Q
A
S
V
T
G
L
V
L
R
Y
F
L
-
T
G
K
--
S
T
--
L
S
L
H
W
S
D
L
R
M
K
GSV
I
K
E
V
C
L
V
-
G
L
P
A
F
---
V
Q
Q
S
S
A
S
L
M
M
I
A
I
N
S
M
L
L
R
F
G
S
D
F
Y
V
G
-
V
F
G
L
V
Q
--------
R
I
M
M
F
V
M
M
P
M
M
G
I
M
Q
A
M
Q
P
I
V
G
Y
N
Y
G
A
K
Q
Y
S
R
L
R
E
T
V
M
L
G
F
K
V
A
T
I
F
--
S
I
G
I
F
A
L
L
M
--
L
F
P
E
-
A
L
L
R
V
F
T
A
D
R
E
V
I
Q
--
A
G
V
S
A
M
H
I
L
F
C
V
T
F
L
I
G
A
Q
-
I
V
A
G
G
L
Y
Q
S
L
G
K
P
K
Q
A
L
I
L
S
L
S
R
Q
----
I
I
F
L
I
P
L
V
L
I
L
P
H
I
-----
F
G
L
S
--
G
V
W
W
A
F
-----
P
I
A
D
V
L
S
F
I
L
T
V
V
L
L
Y
R
D
R
N
V
F
F
L
K
-----------------------------------------------------------------------------------------------------------------
22
HHSearch
49.93
14%
-132
- C1 -
3W4T
8
?
A:
[14-212]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
D
-
P
K
K
A
I
---
V
R
L
S
I
A
M
M
I
G
M
S
V
Q
T
L
Y
N
L
A
D
G
-
I
W
V
S
-
G
L
G
P
E
S
L
A
A
V
G
L
F
F
P
V
F
M
G
I
I
A
L
A
A
G
L
G
V
G
T
S
S
A
I
A
R
R
I
G
A
R
D
K
E
G
A
D
N
V
A
V
H
S
L
I
L
S
L
I
L
--
G
V
T
I
T
I
T
M
L
--
P
A
I
D
-
S
L
F
R
S
M
G
A
K
G
E
A
V
---
E
L
A
I
E
Y
A
R
V
L
L
A
G
A
F
I
I
V
F
N
N
V
G
N
G
I
L
R
G
E
G
D
A
N
R
A
M
L
A
M
V
L
G
S
-----
G
L
N
I
V
L
D
P
I
F
I
Y
T
-----
L
G
F
G
V
V
G
A
A
Y
A
T
-----
L
L
S
M
V
V
T
S
L
F
I
A
Y
W
L
F
V
K
R
D
T
Y
V
D
I
T
L
-
R
D
F
S
P
S
R
E
I
L
K
D
I
L
R
V
G
L
P
S
S
L
S
Q
L
S
M
S
I
A
M
F
F
L
N
---
S
V
A
I
T
A
G
G
E
N
G
------
V
A
V
F
T
S
A
W
R
I
T
M
L
G
I
V
P
I
L
G
M
A
A
A
T
T
S
V
T
G
A
A
Y
G
E
R
N
V
E
K
L
E
T
A
Y
L
Y
A
I
K
I
A
F
M
I
36
Fugue
42.78
17%
-69
- C1 -
2XQH
-
?
A:
[23-280]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
D
A
K
A
S
G
E
F
S
V
A
V
G
N
G
A
R
A
T
E
K
A
S
T
A
V
G
S
W
A
A
A
D
G
K
Q
S
T
A
L
G
V
G
T
Y
A
Y
A
NA
S
T
A
L
G
S
V
A
F
--
V
D
N
T
A
T
Y
G
T
A
A
G
N
R
A
K
V
D
---
K
D
A
T
------------
E
G
T
A
L
G
A
K
A
T
V
T
N
K
N
S
V
A
L
G
A
--
N
S
V
T
T
R
DNE
V
Y
I
G
Y
K
T
G
T
E
S
D
K
T
-----
Y
G
T
R
V
L
G
G
L
S
D
G
TRNSD
A
A
T
V
G
Q
L
N
R
K
V
G
G
V
Y
D
D
V
K
A
R
I
T
V
E
S
E
-
K
Q
K
K
Y
T
D
Q
K
T
S
E
V
N
E
K
V
E
A
R
T
T
V
G
V
D
S
D
G
K
L
T
R
A
E
---
G
A
T
K
T
I
A
V
N
D
G
------
L
V
A
L
S
G
R
T
D
R
I
D
Y
A
V
G
A
I
D
G
R
V
T
R
N
T
Q
S
I
E
K
N
S
K
A
I
A
A
N
T
R
T
-------------
16
PsiBlast_PDB
39.75
29%
72
- C2 -
1TYE
1
ITA2B_HUMAN
A:
[248-361]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
N
T
T
E
Y
V
V
G
A
P
T
W
S
W
T
L
G
A
V
E
I
L
D
S
Y
Y
Q
R
L
H
R
L
R
A
E
Q
M
A
S
Y
F
G
H
S
V
A
V
T
D
V
N
G
D
G
R
H
D
L
L
V
G
A
P
L
Y
M
E
S
R
A
D
R
K
L
A
E
V
G
R
V
Y
L
F
L
Q
P
R
G
P
H
A
L
G
A
P
S
L
L
L
T
G
T
Q
L
Y
G
R
F
G
S
A
I
A
P
L
G
D
L
D
R
D
G
Y
N
D
I
A
V
A
A
P
Y
18
PsiBlast_PDB
39.56
28%
76
- C2 -
2VDK
2
ITA2B_HUMAN
A:
[248-361]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
N
T
T
E
Y
V
V
G
A
P
T
W
S
W
T
L
G
A
V
E
I
L
D
S
Y
Y
Q
R
L
H
R
L
R
G
E
Q
M
A
S
Y
F
G
H
S
V
A
V
T
D
V
N
G
D
G
R
H
D
L
L
V
G
A
P
L
Y
M
E
S
R
A
D
R
K
L
A
E
V
G
R
V
Y
L
F
L
Q
P
R
G
P
H
A
L
G
A
P
S
L
L
L
T
G
T
Q
L
Y
G
R
F
G
S
A
I
A
P
L
G
D
L
D
R
D
G
Y
N
D
I
A
V
A
A
P
Y
17
PsiBlast_PDB
39.55
28%
73
- C2 -
2VC2
2
ITA2B_HUMAN
A:
[248-361]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
N
T
T
E
Y
V
V
G
A
P
T
W
S
W
T
L
G
A
V
E
I
L
D
S
Y
Y
Q
R
L
H
R
L
R
G
E
Q
M
A
S
Y
F
G
H
S
V
A
V
T
D
V
N
G
D
G
R
H
D
L
L
V
G
A
P
L
Y
M
E
S
R
A
D
R
K
L
A
E
V
G
R
V
Y
L
F
L
Q
P
R
G
P
H
A
L
G
A
P
S
L
L
L
T
G
T
Q
L
Y
G
R
F
G
S
A
I
A
P
L
G
D
L
D
R
D
G
Y
N
D
I
A
V
A
A
P
Y
19
PsiBlast_PDB
39.27
28%
74
* C2 *
2VDL
2
ITA2B_HUMAN
A:
[248-361]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
N
T
T
E
Y
V
V
G
A
P
T
W
S
W
T
L
G
A
V
E
I
L
D
S
Y
Y
Q
R
L
H
R
L
R
G
E
Q
M
A
S
Y
F
G
H
S
V
A
V
T
D
V
N
G
D
G
R
H
D
L
L
V
G
A
P
L
Y
M
E
S
R
A
D
R
K
L
A
E
V
G
R
V
Y
L
F
L
Q
P
R
G
P
H
A
L
G
A
P
S
L
L
L
T
G
T
Q
L
Y
G
R
F
G
S
A
I
A
P
L
G
D
L
D
R
D
G
Y
N
D
I
A
V
A
A
P
Y
20
PsiBlast_PDB
39.09
28%
76
- C2 -
2VDM
2
ITA2B_HUMAN
A:
[248-361]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
N
T
T
E
Y
V
V
G
A
P
T
W
S
W
T
L
G
A
V
E
I
L
D
S
Y
Y
Q
R
L
H
R
L
R
G
E
Q
M
A
S
Y
F
G
H
S
V
A
V
T
D
V
N
G
D
G
R
H
D
L
L
V
G
A
P
L
Y
M
E
S
R
A
D
R
K
L
A
E
V
G
R
V
Y
L
F
L
Q
P
R
G
P
H
A
L
G
A
P
S
L
L
L
T
G
T
Q
L
Y
G
R
F
G
S
A
I
A
P
L
G
D
L
D
R
D
G
Y
N
D
I
A
V
A
A
P
Y
11
PsiBlast_PDB
36.59
26%
-36
- C1 -
3WBN
4
?
A:
[170-234]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
L
A
M
V
L
G
S
G
L
N
I
V
L
D
P
I
F
I
----
Y
----
T
L
G
F
G
V
V
G
A
A
Y
A
T
L
L
S
M
V
V
T
S
L
F
I
A
Y
W
L
F
-
V
K
R
-------
D
T
-
Y
V
---
D
I
-------
T
L
R
-
D
F
S
P
S
---
R
E
I
L
K
D
I
L
R
V
G
L
P
S
S
L
S
Q
L
S
M
S
-
I
A
M
F
-
F
L
N
S
V
A
I
T
A
G
G
E
N
G
V
A
V
F
T
S
A
W
R
I
T
M
L
G
I
V
P
I
L
G
M
A
A
A
T
T
S
V
T
G
A
A
Y
G
E
R
N
V
E
K
L
E
T
A
Y
L
Y
--
A
I
K
I
A
F
M
I
E
--
L
A
V
V
-
A
F
I
M
L
F
A
P
Q
V
A
Y
L
---
F
T
Y
S
E
S
A
Q
V
I
K
G
D
L
I
S
A
L
R
T
L
P
V
F
L
V
L
T
P
F
G
M
M
T
S
A
M
F
Q
G
I
G
E
G
----
E
K
S
L
I
L
T
I
F
R
T
L
V
M
-----
Q
V
G
F
A
Y
I
F
V
H
Y
T
-----
T
L
G
L
R
G
V
W
I
G
I
V
I
G
N
M
V
A
A
I
V
G
F
L
W
G
R
-
M
R
I
S
A
L
K
K
T
-----------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
36.35
26%
-39
- C1 -
3VVR
4
?
A:
[170-234]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
L
A
M
V
L
G
S
G
L
N
I
V
L
D
P
I
F
I
----
Y
----
T
L
G
F
G
V
V
G
A
A
Y
A
T
L
L
S
M
V
V
T
S
L
F
I
A
Y
W
L
F
-
V
K
R
-------
D
T
-
Y
V
---
D
I
-------
T
L
R
-
D
F
S
P
S
---
R
E
I
L
K
D
I
L
R
V
G
L
P
S
S
L
S
Q
L
S
M
S
-
I
A
M
F
-
F
L
N
S
V
A
I
T
A
G
E
N
G
V
A
V
F
T
S
A
W
R
I
T
M
L
G
I
V
P
I
L
G
M
A
A
A
T
T
S
V
T
G
A
A
Y
G
E
R
N
V
E
K
L
E
T
A
Y
L
Y
A
--
I
K
I
A
F
M
I
E
L
--
A
V
V
A
-
F
I
M
L
F
A
P
Q
V
A
Y
L
F
---
T
Y
I
K
G
D
L
I
S
A
L
R
T
L
P
V
F
L
V
L
T
P
F
G
M
M
T
S
A
M
F
Q
G
I
G
E
G
E
K
S
L
I
L
T
----
I
F
R
T
L
V
M
Q
V
G
F
A
Y
I
-----
F
V
H
G
L
R
G
V
W
I
G
I
-----
V
I
G
N
M
V
A
A
I
V
G
F
L
W
G
R
M
R
I
S
A
L
K
K
T
-----------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
36.00
26%
-39
- C1 -
3VVN
6
?
A:
[170-234]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
L
A
M
V
L
G
S
G
L
N
I
V
L
D
P
I
F
I
----
Y
----
T
L
G
F
G
V
V
G
A
A
Y
A
T
L
L
S
M
V
V
T
S
L
F
I
A
Y
W
L
F
-
V
K
R
-------
D
T
-
Y
V
---
D
I
-------
T
L
R
-
D
F
S
P
S
---
R
E
I
L
K
D
I
L
R
V
G
L
P
S
S
L
S
Q
L
S
M
S
-
I
A
M
F
-
F
L
N
S
V
A
I
T
A
G
G
E
N
G
V
A
V
F
T
S
A
W
R
I
T
M
L
G
I
V
P
I
L
G
M
A
A
A
T
T
S
V
T
G
A
A
Y
G
E
R
N
V
E
K
L
E
T
A
Y
L
Y
--
A
I
K
I
A
F
M
I
E
--
L
A
V
V
-
A
F
I
M
L
F
A
P
Q
V
A
Y
L
---
F
T
A
Q
V
I
K
G
D
L
I
S
A
L
R
T
L
P
V
F
L
V
L
T
P
F
G
M
M
T
S
A
M
F
Q
G
I
G
E
G
E
K
S
L
----
I
L
T
I
F
R
T
L
V
M
Q
V
G
F
-----
A
Y
I
F
V
H
Y
T
T
L
G
L
-----
R
G
V
W
I
G
I
V
I
G
N
M
V
A
A
I
V
G
F
L
W
G
R
M
R
I
S
-
A
L
K
K
T
---------------------------------------------------------------------------------------------------------