@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 : gbs0321: (2015-11-30 )
MKVFASPSRYIQGKDALFQSIEHIKSLGQTPLILCDDVVYNIVGERFLSYLQDDLLPHRVSFNGEASDNEINRVVAVAKEKNSDLIIGLGGGKTIDSAKAIADKVNLPVVIAPTVASTDAPTSALSVIYTDEGAFEKYIFYSKNPDLVLVDTQVIAQAPKRLLASGIADGLATWVEARAVLQKNGIAMAGGRQTLAGVAIAQACERTLFNDSLQALAACDAKVVTKALENVIEANTLLSGLGFESAGLAAAHAIHNGFTALSGDIHHLTHGEKVAYGTLTQLFLENRPKEEIDRYINLYQAIGMPTTLAELHLGDATYEELLKVGQQATIEGETIHEMPFKISAEDVAAALLTVDRYVSNHQ
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--
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
--MKVFASPSRYIQ
G
K
D
A
L
F
Q
S
I
E
H
I
K
S
LG-QT
P
L
I
L
C
D
D
V
V
-
Y
N
--
I
--
V
G
E
R
F
L
S
Y
L
-
Q
-D-D-LLP
H
-
R
V
S-FNGEASDNEI
N
R
V
V
A
V
A
KEKNS
D
L
I
I
GLGGGKTI
D
S
A
K
A
I
A
DKV------------------NL
P
V
V
I
APTVASTDAPT
S
A
L
S
V
I
YTDEGA
F
E
-
K
Y
I
F
YSKNP
D
L
V
L
V
D
T
Q
V
I
A
Q
A
P
K
R
L
L
A
S
G
I
A
D
G
L
A
T
W
V
E
A
R
A
V
L
Q
-K---N
G
I
A
MAGG-R
Q
T
L
A
G
V
A
I
A
Q
A
C
E
R
T
L
F
N
D
S
L
Q
A
L
A
----A--------C
D
A
K
V
V
T
K
A
L
E
N
V
I
E
A
N
T
L
L
SG---LGFE
S
-
A
G
L
A
A
A
H
A
I
HN
G
F
T
ALSGDI-HHLTHGEK
V
A
Y
G
T
L
T
Q
L
F
L
ENR----------------
P
-----------------------
K
-----------
E
E
I
--------
D
R
Y
I
N
L
Y
Q
AIGMPT
T
L
A
E
L
HLG
D
A
T
Y
E
E
L
L
K
VGQQATIEGE-------
T
I
HEMPFKI
S
A
E
D
V
A
A
A
L
L
T
V
D
R
----
Y
VSNHQ--
51
Fugue
97.91
55%
-92
- C2 -
1JQ5
3
GLDA_GEOSE
A:
[2-367]
A
A
E
R
V
F
I
S
P
A
K
Y
V
Q
G
K
N
V
I
T
K
I
A
N
Y
L
E
G
I
G
-
N
K
T
V
V
I
A
D
E
I
V
-
W
K
---
I
-
A
G
H
T
I
V
N
E
L
-
K
-
K
G
N
-
I
A
A
E
-
E
V
V
-
F
S
G
E
A
S
R
N
E
V
E
R
I
A
N
I
A
R
K
A
E
A
A
I
V
I
G
V
G
G
G
K
T
L
D
T
A
K
A
V
A
D
E
L
------------------
D
A
Y
I
V
I
V
P
T
A
A
S
T
D
A
P
T
S
A
L
S
V
I
Y
S
D
D
G
V
F
E
-
S
Y
R
F
Y
K
K
N
P
D
L
V
L
V
D
T
K
I
I
A
N
A
P
P
R
L
L
A
S
G
I
A
D
A
L
A
T
W
V
E
A
R
S
V
I
K
-
S
---
G
G
K
T
M
A
G
G
-
I
P
T
I
A
A
E
A
I
A
E
K
C
E
Q
T
L
F
K
Y
G
K
L
A
Y
E
----
S
--------
V
K
A
K
V
V
T
P
A
L
E
A
V
V
E
A
N
T
L
L
S
G
---
L
G
F
E
S
-
G
G
L
A
A
A
H
A
I
H
N
G
F
T
A
L
E
G
E
I
-
H
H
L
T
H
G
E
K
V
A
F
G
T
L
V
Q
L
A
L
E
E
H
----------------
S
-----------------------
Q
-----------
Q
E
I
--------
E
R
Y
I
E
L
Y
L
C
L
D
L
P
V
T
L
E
D
I
K
L
K
D
A
S
R
E
D
I
L
K
V
A
K
A
A
T
A
E
G
E
-------
T
I
H
N
A
-
F
N
V
T
A
D
D
V
A
D
A
I
F
A
A
D
Q
----
Y
A
K
A
Y
K
E
K
49
Fugue
97.31
55%
-91
- C2 -
1JQ5
3
GLDA_GEOSE
A:
[2-367]
A
A
E
R
V
F
I
S
P
A
K
Y
V
Q
G
K
N
V
I
T
K
I
A
N
Y
L
E
G
I
G
-
N
K
T
V
V
I
A
D
E
I
V
-
W
K
--
I
--
A
G
H
T
I
V
N
E
L
-
K
-
K
-
G
N
I
A
A
E
-
E
V
V
-
F
S
G
E
A
S
R
N
E
V
E
R
I
A
N
I
A
R
K
A
E
A
A
I
V
I
G
V
G
G
G
K
T
L
D
T
A
K
A
V
A
D
E
L
------------------
D
A
Y
I
V
I
V
P
T
A
A
S
T
D
A
P
T
S
A
L
S
V
I
Y
S
D
D
G
V
F
E
-
S
Y
R
F
Y
K
K
N
P
D
L
V
L
V
D
T
K
I
I
A
N
A
P
P
R
L
L
A
S
G
I
A
D
A
L
A
T
W
V
E
A
R
S
V
I
K
-
S
---
G
G
K
T
M
A
G
G
-
I
P
T
I
A
A
E
A
I
A
E
K
C
E
Q
T
L
F
K
Y
G
K
L
A
Y
E
----
S
--------
V
K
A
K
V
V
T
P
A
L
E
A
V
V
E
A
N
T
L
L
S
G
---
L
G
F
E
S
-
G
G
L
A
A
A
H
A
I
H
N
G
F
T
A
L
E
G
E
I
-
H
H
L
T
H
G
E
K
V
A
F
G
T
L
V
Q
L
A
L
E
E
H
----------------
S
-----------------------
Q
-----------
Q
E
I
--------
E
R
Y
I
E
L
Y
L
C
L
D
L
P
V
T
L
E
D
I
K
L
K
D
A
S
R
E
D
I
L
K
V
A
K
A
A
T
A
E
G
E
-------
T
I
H
N
-
A
F
N
V
T
A
D
D
V
A
D
A
I
F
A
A
D
Q
----
Y
A
K
A
Y
K
E
K
3
PsiBlast_PDB
96.55
54%
-92
- C2 -
1JQ5
3
GLDA_GEOSE
A:
[5-365]
---
R
V
F
I
S
P
A
K
Y
V
Q
G
K
N
V
I
T
K
I
A
N
Y
L
E
G
I
G
-
N
K
T
V
V
I
A
D
E
I
V
-
W
K
--
I
--
A
G
H
T
I
V
N
E
L
-
K
-
K
G
N
-
I
A
A
E
-
E
V
V
-
F
S
G
E
A
S
R
N
E
V
E
R
I
A
N
I
A
R
K
A
E
A
A
I
V
I
G
V
G
G
G
K
T
L
D
T
A
K
A
V
A
D
E
L
------------------
D
A
Y
I
V
I
V
P
T
A
A
S
T
D
A
P
T
S
A
L
S
V
I
Y
S
D
D
G
V
F
E
-
S
Y
R
F
Y
K
K
N
P
D
L
V
L
V
D
T
K
I
I
A
N
A
P
P
R
L
L
A
S
G
I
A
D
A
L
A
T
W
V
E
A
R
S
V
I
K
-
S
---
G
G
K
T
M
A
G
G
-
I
P
T
I
A
A
E
A
I
A
E
K
C
E
Q
T
L
F
K
Y
G
K
L
A
Y
E
----
S
--------
V
K
A
K
V
V
T
P
A
L
E
A
V
V
E
A
N
T
L
L
S
G
---
L
G
F
E
S
-
G
G
L
A
A
A
H
A
I
H
N
G
F
T
A
L
E
G
E
I
-
H
H
L
T
H
G
E
K
V
A
F
G
T
L
V
Q
L
A
L
E
E
H
----------------
S
-----------------------
Q
-----------
Q
E
I
--------
E
R
Y
I
E
L
Y
L
C
L
D
L
P
V
T
L
E
D
I
K
L
K
D
A
S
R
E
D
I
L
K
V
A
K
A
A
T
A
E
G
E
-------
T
I
H
N
-
A
F
N
V
T
A
D
D
V
A
D
A
I
F
A
A
D
Q
----
Y
A
K
A
Y
K
--
26
HHSearch
96.42
54%
-94
- C2 -
1JQ5
3
GLDA_GEOSE
A:
[5-362]
---
R
V
F
I
S
P
A
K
Y
V
Q
G
K
N
V
I
T
K
I
A
N
Y
L
E
G
I
G
-
N
K
T
V
V
I
A
D
E
I
V
-
W
K
--
I
--
A
G
H
T
I
V
N
E
L
-
K
K
G
-
N
-
I
A
A
E
-
E
V
V
-
F
S
G
E
A
S
R
N
E
V
E
R
I
A
N
I
A
R
K
A
E
A
A
I
V
I
G
V
G
G
G
K
T
L
D
T
A
K
A
V
A
D
E
L
------------------
D
A
Y
I
V
I
V
P
T
A
A
S
T
D
A
P
T
S
A
L
S
V
I
Y
S
D
D
G
V
F
E
-
S
Y
R
F
Y
K
K
N
P
D
L
V
L
V
D
T
K
I
I
A
N
A
P
P
R
L
L
A
S
G
I
A
D
A
L
A
T
W
V
E
A
R
S
V
I
K
-
S
---
G
G
K
T
M
A
G
G
-
I
P
T
I
A
A
E
A
I
A
E
K
C
E
Q
T
L
F
K
Y
G
K
L
A
Y
E
----
S
--------
V
K
A
K
V
V
T
P
A
L
E
A
V
V
E
A
N
T
L
L
S
G
---
L
G
F
E
S
-
G
G
L
A
A
A
H
A
I
H
N
G
F
T
A
L
E
G
E
I
-
H
H
L
T
H
G
E
K
V
A
F
G
T
L
V
Q
L
A
L
E
E
H
----------------
S
-----------------------
Q
-----------
Q
E
I
--------
E
R
Y
I
E
L
Y
L
C
L
D
L
P
V
T
L
E
D
I
K
L
K
D
A
S
R
E
D
I
L
K
V
A
K
A
A
T
A
E
-
G
-------
E
T
I
H
N
A
F
N
V
T
A
D
D
V
A
D
A
I
F
A
A
D
Q
----
Y
A
K
A
Y
K
--
2
PsiBlast_PDB
96.28
54%
-97
- C2 -
1JQA
3
GLDA_GEOSE
A:
[5-365]
---
R
V
F
I
S
P
A
K
Y
V
Q
G
K
N
V
I
T
K
I
A
N
Y
L
E
G
I
G
-
N
K
T
V
V
I
A
D
E
I
V
-
W
K
--
I
--
A
G
H
T
I
V
N
E
L
-
K
-
K
G
N
-
I
A
A
E
-
E
V
V
-
F
S
G
E
A
S
R
N
E
V
E
R
I
A
N
I
A
R
K
A
E
A
A
I
V
I
G
V
G
G
G
K
T
L
D
T
A
K
A
V
A
D
E
L
------------------
D
A
Y
I
V
I
V
P
T
A
A
S
T
D
A
P
T
S
A
L
S
V
I
Y
----
V
F
E
-
S
Y
R
F
Y
K
K
N
P
D
L
V
L
V
D
T
K
I
I
A
N
A
P
P
R
L
L
A
S
G
I
A
D
A
L
A
T
W
V
E
A
R
S
V
I
K
-
S
---
G
G
K
T
M
A
G
G
-
I
P
T
I
A
A
E
A
I
A
E
K
C
E
Q
T
L
F
K
Y
G
K
L
A
Y
E
----
S
--------
V
K
A
K
V
V
T
P
A
L
E
A
V
V
E
A
N
T
L
L
S
G
---
L
G
F
E
S
-
G
G
L
A
A
A
H
A
I
H
N
G
F
T
A
L
E
G
E
I
-
H
H
L
T
H
G
E
K
V
A
F
G
T
L
V
Q
L
A
L
E
E
H
----------------
S
-----------------------
Q
-----------
Q
E
I
--------
E
R
Y
I
E
L
Y
L
C
L
D
L
P
V
T
L
E
D
I
K
L
K
D
A
S
R
E
D
I
L
K
V
A
K
A
A
T
A
E
G
E
-------
T
I
H
N
-
A
F
N
V
T
A
D
D
V
A
D
A
I
F
A
A
D
Q
----
Y
A
K
A
Y
K
--
1
PsiBlast_PDB
94.71
54%
-96
- C2 -
1JPU
2
GLDA_GEOSE
A:
[5-365]
---
R
V
F
I
S
P
A
K
Y
V
Q
G
K
N
V
I
T
K
I
A
N
Y
L
E
G
I
G
-
N
K
T
V
V
I
A
D
E
I
V
-
W
K
--
I
--
A
G
H
T
I
V
N
E
L
-
K
-
K
G
N
-
I
A
A
E
-
E
V
V
-
F
S
G
E
A
S
R
N
E
V
E
R
I
A
N
I
A
R
K
A
E
A
A
I
V
I
G
V
G
G
G
K
T
L
D
T
A
K
A
V
A
D
E
L
------------------
D
A
Y
I
V
I
V
P
T
A
A
S
T
D
A
P
T
S
A
L
S
V
-----
G
V
F
E
-
S
Y
R
F
Y
K
K
N
P
D
L
V
L
V
D
T
K
I
I
A
N
A
P
P
R
L
L
A
S
G
I
A
D
A
L
A
T
W
V
E
A
R
S
V
I
K
-
S
---
G
G
K
T
M
A
G
G
-
I
P
T
I
A
A
E
A
I
A
E
K
C
E
Q
T
L
F
K
Y
G
K
L
A
Y
E
----
S
--------
V
K
A
K
V
V
T
P
A
L
E
A
V
V
E
A
N
T
L
L
S
G
---
L
G
F
E
S
-
G
G
L
A
A
A
H
A
I
H
N
G
F
T
A
L
E
G
E
I
-
H
H
L
T
H
G
E
K
V
A
F
G
T
L
V
Q
L
A
L
E
E
H
----------------
S
-----------------------
Q
-----------
Q
E
I
--------
E
R
Y
I
E
L
Y
L
C
L
D
L
P
V
T
L
E
D
I
K
L
K
D
A
S
R
E
D
I
L
K
V
A
K
A
A
T
A
E
G
E
-------
T
I
H
N
-
A
F
N
V
T
A
D
D
V
A
D
A
I
F
A
A
D
Q
----
Y
A
K
A
Y
K
--
4
PsiBlast_PDB
92.94
47%
-94
- C2 -
4MCA
5
?
A:
[2-367]
--
L
R
I
I
Q
S
P
G
K
Y
I
Q
G
A
N
A
L
A
A
V
G
Q
Y
A
K
S
L
A
-
D
H
Y
L
V
I
A
D
D
F
V
-
M
K
--
L
--
A
G
D
T
L
M
G
S
L
-
Q
-
Q
-
H
-
G
V
K
H
-
H
A
A
L
F
N
G
E
C
C
H
K
E
I
D
R
L
G
R
E
L
K
A
H
G
C
R
G
V
I
G
V
G
G
G
K
T
L
D
T
A
K
A
I
A
H
Y
Q
------------------
Q
L
P
V
V
L
I
P
T
I
A
S
T
D
A
P
T
S
A
L
S
V
I
Y
T
E
Q
G
E
F
A
-
E
Y
L
I
Y
P
R
N
P
D
M
V
V
M
D
V
A
I
I
A
K
A
P
V
R
L
L
V
A
G
M
G
D
A
L
S
T
Y
F
E
A
Q
A
C
F
D
-
A
---
Q
A
T
S
M
A
G
G
-
K
S
T
L
A
A
L
S
L
A
R
L
C
Y
D
T
L
L
A
E
G
V
K
A
K
L
----
A
--------
V
E
A
G
V
V
T
E
A
V
E
R
I
I
E
A
N
T
Y
L
S
G
---
I
G
F
E
S
-
S
G
L
A
A
A
H
A
I
H
N
G
F
T
V
L
E
-
E
C
-
H
H
L
Y
H
G
E
K
V
A
F
G
T
L
A
Q
L
V
L
Q
N
S
----------------
P
-----------------------
M
-----------
A
Q
I
--------
E
T
V
L
A
F
C
H
R
I
G
L
P
I
T
L
A
E
M
G
V
S
G
D
A
V
E
K
I
M
A
V
A
Q
A
S
C
A
A
G
E
-------
T
I
H
N
M
P
F
K
V
T
P
A
G
V
Q
A
A
I
L
T
A
D
R
L
G
S
A
W
L
Q
Q
H
Q
--
21
PsiBlast_CBE
91.91
47%
-96
- C2 -
4MCA
5
?
B:
[2-366]
--
L
R
I
I
Q
S
P
G
K
Y
I
Q
G
A
N
A
L
A
A
V
G
Q
Y
A
K
S
L
A
-
D
H
Y
L
V
I
A
D
D
F
V
-
M
K
--
L
--
A
G
D
T
L
M
G
S
L
-
Q
-
Q
-
H
-
G
V
K
H
-
H
A
A
L
F
N
G
--
C
H
K
E
I
D
R
L
G
R
E
L
K
A
H
G
C
R
G
V
I
G
V
G
G
G
K
T
L
D
T
A
K
A
I
A
H
Y
Q
------------------
Q
L
P
V
V
L
I
P
T
I
A
S
T
D
A
P
T
S
A
L
S
V
I
Y
T
E
Q
G
E
F
A
-
E
Y
L
I
Y
P
R
N
P
D
M
V
V
M
D
V
A
I
I
A
K
A
P
V
R
L
L
V
A
G
M
G
D
A
L
S
T
Y
F
E
A
Q
A
C
F
D
-
A
---
Q
A
T
S
M
A
G
G
-
K
S
T
L
A
A
L
S
L
A
R
L
C
Y
D
T
L
L
A
E
G
V
K
A
K
L
----
A
--------
V
E
A
G
V
V
T
E
A
V
E
R
I
I
E
A
N
T
Y
L
S
G
---
I
G
F
E
S
-
S
G
L
A
A
A
H
A
I
H
N
G
F
T
V
L
E
-
E
C
-
H
H
L
Y
H
G
E
K
V
A
F
G
T
L
A
Q
L
V
L
Q
N
S
----------------
P
-----------------------
M
-----------
A
Q
I
--------
E
T
V
L
A
F
C
H
R
I
G
L
P
I
T
L
A
E
M
G
V
S
G
D
A
V
E
K
I
M
A
V
A
Q
A
S
C
A
A
G
E
-------
T
I
H
N
M
P
F
K
V
T
P
A
G
V
Q
A
A
I
L
T
A
D
R
L
G
S
A
W
L
Q
Q
H
---
5
PsiBlast_PDB
91.42
45%
-92
- C2 -
1TA9
5
GLD1_SCHPO
A:
[64-425]
---
R
I
F
T
S
P
Q
K
Y
V
Q
G
R
H
A
F
T
R
S
Y
M
Y
V
K
K
W
A
T
K
S
A
V
V
L
A
D
Q
N
V
-
W
N
--
I
--
C
A
N
K
I
V
D
S
L
S
Q
-
N
-
G
-
M
T
V
T
-
K
L
V
-
F
G
G
E
A
S
L
V
E
L
D
K
L
R
K
Q
C
P
D
-
D
T
Q
V
I
I
G
V
G
G
G
K
T
M
D
S
A
K
Y
I
A
H
S
M
------------------
N
L
P
S
I
I
C
P
T
T
A
S
S
D
A
A
T
S
S
L
S
V
I
Y
----
Q
F
Q
-
K
Y
S
F
Y
P
L
N
P
N
L
I
F
I
D
T
D
V
I
V
R
A
P
V
R
F
L
I
S
G
I
G
D
A
L
S
T
W
V
E
T
E
S
V
I
R
-
S
---
N
S
T
S
F
A
G
G
-
V
A
S
I
A
G
R
Y
I
A
R
A
C
K
D
T
L
E
K
Y
A
L
S
A
I
L
----
S
--------
N
T
R
G
V
C
T
E
A
F
E
N
V
V
E
A
N
T
L
M
S
G
---
L
G
F
E
N
-
G
G
L
A
A
A
H
A
I
H
N
G
M
T
A
I
H
G
P
V
-
H
R
L
M
H
G
E
K
V
A
Y
G
T
L
V
Q
V
V
L
E
D
W
----------------
P
-----------------------
L
-----------
E
D
F
--------
N
N
L
A
S
F
M
A
K
C
H
L
P
I
T
L
E
E
L
G
I
P
N
V
T
D
E
E
L
L
M
V
G
R
A
T
L
R
P
D
E
-------
S
I
H
N
M
S
K
K
F
N
P
S
Q
I
A
D
A
I
K
A
V
D
S
----
Y
S
Q
K
W
Q
--
22
PsiBlast_CBE
90.85
45%
-92
- C2 -
1TA9
3
GLD1_SCHPO
B:
[64-425]
---
R
I
F
T
S
P
Q
K
Y
V
Q
G
R
H
A
F
T
R
S
Y
M
Y
V
K
K
W
A
T
K
S
A
V
V
L
A
D
Q
N
V
-
W
N
--
I
--
C
A
N
K
I
V
D
S
L
S
Q
-
N
-
G
-
M
T
V
T
-
K
L
V
-
F
G
G
E
A
S
L
V
E
L
D
K
L
R
K
Q
C
P
D
-
D
T
Q
V
I
I
G
V
G
G
G
K
T
M
D
S
A
K
Y
I
A
H
S
M
------------------
N
L
P
S
I
I
C
P
T
T
A
S
S
D
A
A
T
S
S
L
S
V
I
Y
T
P
D
G
Q
F
Q
-
K
Y
S
F
Y
P
L
N
P
N
L
I
F
I
D
T
D
V
I
V
R
A
P
V
R
F
L
I
S
G
I
G
D
A
L
S
T
W
V
E
T
E
S
V
I
R
-
S
---
N
S
T
S
F
A
G
G
-
V
A
S
I
A
G
R
Y
I
A
R
A
C
K
D
T
L
E
K
Y
A
L
S
A
I
L
----
S
--------
N
T
R
G
V
C
T
E
A
F
E
N
V
V
E
A
N
T
L
M
S
G
---
L
G
F
E
N
-
G
G
L
A
A
A
H
A
I
H
N
G
M
T
A
I
H
G
P
V
-
H
R
L
M
H
G
E
K
V
A
Y
G
T
L
V
Q
V
V
L
E
D
W
----------------
P
-----------------------
L
-----------
E
D
F
--------
N
N
L
A
S
F
M
A
K
C
H
L
P
I
T
L
E
E
L
G
I
P
N
V
T
D
E
E
L
L
M
V
G
R
A
T
L
R
P
D
E
-------
S
I
H
N
M
S
K
K
F
N
P
S
Q
I
A
D
A
I
K
A
V
D
S
----
Y
S
Q
K
W
Q
--
33
HHSearch
88.25
44%
-92
- C2 -
1TA9
5
GLD1_SCHPO
A:
[64-423]
---
R
I
F
T
S
P
Q
K
Y
V
Q
G
R
H
A
F
T
R
S
Y
M
Y
V
K
K
W
A
T
K
S
A
V
V
L
A
D
Q
N
V
-
W
N
--
I
--
C
A
N
K
I
V
D
S
L
-
S
Q
N
-
G
-
M
T
V
T
-
K
L
V
-
F
G
G
E
A
S
L
V
E
L
D
K
L
R
K
Q
C
P
-
D
D
T
Q
V
I
I
G
V
G
G
G
K
T
M
D
S
A
K
Y
I
A
H
S
M
------------------
N
L
P
S
I
I
C
P
T
T
A
S
S
D
A
A
T
S
S
L
S
V
I
Y
----
Q
F
Q
-
K
Y
S
F
Y
P
L
N
P
N
L
I
F
I
D
T
D
V
I
V
R
A
P
V
R
F
L
I
S
G
I
G
D
A
L
S
T
W
V
E
T
E
S
V
I
R
-
S
---
N
S
---------
T
S
F
A
G
G
V
A
S
I
A
G
R
Y
I
A
R
A
C
K
D
T
L
E
----
K
Y
A
L
S
A
I
L
S
N
T
R
G
V
C
T
E
A
F
E
N
V
V
E
A
N
T
L
M
S
G
---
L
G
F
E
N
-
G
G
L
A
A
A
H
A
I
H
N
G
M
T
A
I
H
-
G
P
V
H
R
L
M
H
G
E
K
V
A
Y
G
T
L
V
Q
V
V
L
E
D
W
----------------
P
-----------------------
L
-----------
E
D
F
--------
N
N
L
A
S
F
M
A
K
C
H
L
P
I
T
L
E
E
L
G
I
P
N
V
T
D
E
E
L
L
M
V
G
R
A
T
L
R
P
D
E
-------
S
I
H
N
M
S
K
K
F
N
P
S
Q
I
A
D
A
I
K
A
V
D
S
----
Y
S
Q
K
W
Q
--
6
PsiBlast_PDB
87.44
46%
-87
- C2 -
1KQ3
3
GLDA_THEMA
A:
[20-368]
--------
P
G
R
Y
V
Q
G
A
G
A
I
N
I
L
E
E
E
L
S
R
F
G
-
E
R
A
F
V
V
I
D
D
F
V
D
K
N
--
V
--
L
G
E
N
F
F
S
S
F
-
T
-
K
-
V
-
R
V
N
K
-
Q
I
--
F
G
G
E
C
S
D
E
E
I
E
R
L
S
G
L
V
E
E
E
-
T
D
V
V
V
G
I
G
G
G
K
T
L
D
T
A
K
A
V
A
Y
K
L
------------------
K
K
P
V
V
I
V
P
T
I
A
S
T
D
A
P
C
S
A
L
S
V
I
Y
T
P
N
G
E
F
K
-
R
Y
L
F
L
P
R
N
P
D
V
V
L
V
D
T
E
I
V
A
K
A
P
A
R
F
L
V
A
G
M
G
D
A
L
A
T
W
F
E
A
E
S
C
K
Q
-
K
---
Y
A
P
N
M
T
G
R
-
L
G
S
M
T
A
Y
A
L
A
R
L
C
Y
E
T
L
L
E
Y
G
V
L
A
K
R
----
S
--------
V
E
E
K
S
V
T
P
A
L
E
K
I
V
E
A
N
T
L
L
S
G
---
L
G
F
E
S
-
G
G
L
A
A
A
H
A
I
H
N
G
L
T
V
L
E
-
N
T
-
H
K
Y
L
H
G
E
K
V
A
I
G
V
L
A
S
L
F
L
T
D
K
----------------
P
-----------------------
R
-----------
K
M
I
--------
E
E
V
Y
S
F
C
E
E
V
G
L
P
T
T
L
A
E
I
G
L
D
G
V
S
D
E
D
L
M
K
V
A
E
K
A
C
D
K
N
E
-------
T
I
H
N
E
P
Q
P
V
T
S
K
D
V
F
F
A
L
K
A
A
D
R
----
Y
G
R
M
R
K
--
7
PsiBlast_PDB
86.62
42%
-84
- C2 -
3UHJ
2
?
A:
[26-382]
---
R
A
F
G
G
P
N
K
Y
I
Q
R
A
G
E
I
D
K
L
A
A
Y
L
A
P
L
G
-
K
R
A
L
V
L
I
D
R
V
L
-
F
D
--
A
--
L
S
E
R
I
---------
S
-
L
D
I
R
-
F
E
R
-
F
G
G
E
C
C
T
S
E
I
E
R
V
R
K
V
A
I
E
H
G
S
D
I
L
V
G
V
G
G
G
K
T
A
D
T
A
K
I
V
A
I
D
T
------------------
G
A
R
I
V
I
A
P
T
I
A
S
T
D
A
P
C
S
A
I
A
V
R
Y
T
E
H
G
V
Y
E
-
E
A
L
R
L
P
R
N
P
D
A
V
V
V
D
S
A
L
V
A
A
A
P
A
R
F
L
V
A
G
I
G
D
A
L
S
T
W
F
E
A
R
S
N
I
E
S
R
---
T
D
N
Y
V
A
G
G
F
P
A
T
E
A
G
M
A
I
A
R
H
C
Q
D
V
L
T
R
D
A
V
K
A
K
I
----
A
--------
V
E
A
G
L
L
T
P
A
V
E
N
I
I
E
A
N
T
L
L
S
G
---
L
G
F
E
N
-
C
G
C
S
A
A
H
G
I
H
D
G
L
T
V
L
E
-
E
V
-
H
G
Y
F
H
G
E
K
V
A
F
G
T
L
C
L
L
M
L
E
N
R
----------------
D
-----------------------
R
-----------
A
E
I
--------
E
A
M
I
R
F
C
R
S
V
G
L
P
T
K
L
A
D
L
G
I
V
D
D
V
P
A
K
I
G
R
V
A
E
A
A
C
R
P
G
N
-------
I
I
Y
A
T
P
V
T
I
T
V
P
A
V
R
D
A
I
L
A
L
D
A
----
F
S
R
S
I
---
27
HHSearch
85.94
42%
-84
- C2 -
3UHJ
2
?
A:
[27-383]
----
A
F
G
G
P
N
K
Y
I
Q
R
A
G
E
I
D
K
L
A
A
Y
L
A
P
L
G
-
K
R
A
L
V
L
I
D
R
V
L
-
F
D
--
A
--
L
S
E
R
I
-------
S
---
L
D
I
R
-
F
E
R
-
F
G
G
E
C
C
T
S
E
I
E
R
V
R
K
V
A
I
E
H
G
S
D
I
L
V
G
V
G
G
G
K
T
A
D
T
A
K
I
V
A
I
D
T
------------------
G
A
R
I
V
I
A
P
T
I
A
S
T
D
A
P
C
S
A
I
A
V
R
Y
T
E
H
G
V
Y
E
-
E
A
L
R
L
P
R
N
P
D
A
V
V
V
D
S
A
L
V
A
A
A
P
A
R
F
L
V
A
G
I
G
D
A
L
S
T
W
F
E
A
R
S
N
I
E
-
S
R
T
D
N
Y
V
A
-
G
G
F
-
P
A
T
E
A
G
M
A
I
A
R
H
C
Q
D
V
L
T
R
D
A
V
K
A
K
I
----
A
--------
V
E
A
G
L
L
T
P
A
V
E
N
I
I
E
A
N
T
L
L
S
G
---
L
G
F
E
N
-
C
G
C
S
A
A
H
G
I
H
D
G
L
T
V
L
E
-
E
V
-
H
G
Y
F
H
G
E
K
V
A
F
G
T
L
C
L
L
M
L
E
N
R
----------------
D
-----------------------
R
-----------
A
E
I
--------
E
A
M
I
R
F
C
R
S
V
G
L
P
T
K
L
A
D
L
G
I
V
D
D
V
P
A
K
I
G
R
V
A
E
A
A
C
R
P
G
N
-------
I
I
Y
A
T
P
V
T
I
T
V
P
A
V
R
D
A
I
L
A
L
D
A
----
F
S
R
S
I
---
30
HHSearch
84.31
46%
-83
- C2 -
1KQ3
3
GLDA_THEMA
A:
[16-371]
----
T
T
I
F
P
G
R
Y
V
Q
G
A
G
A
I
N
I
L
E
E
E
L
S
R
F
G
-
E
R
A
F
V
V
I
D
D
F
V
-
D
K
N-
V
--
L
G
E
N
F
F
S
S
F
-
T
K
V
-
R
-
V
N
K
---
Q
I
-
F
G
G
E
C
S
D
E
E
I
E
R
L
S
G
L
-
V
E
E
E
T
D
V
V
V
G
I
G
G
G
K
T
L
D
T
A
K
A
V
A
Y
K
L
------------------
K
K
P
V
V
I
V
P
T
I
A
S
T
D
A
P
C
S
A
L
S
V
I
Y
T
P
N
G
E
F
K
-
R
Y
L
F
L
P
R
N
P
D
V
V
L
V
D
T
E
I
V
A
K
A
P
A
R
F
L
V
A
G
M
G
D
A
L
A
T
W
F
E
A
E
S
C
K
Q
-
K
---
Y
A
----
P
N
-
M
T
G
R
L
G
S
M
T
A
Y
A
L
A
R
L
C
Y
E
T
L
L
E
Y
G
V
L
A
K
R
S
--------
V
E
E
K
S
V
T
P
A
L
E
K
I
V
E
A
N
T
L
L
S
G
---
L
G
F
E
S
-
G
G
L
A
A
A
H
A
I
H
N
G
L
T
V
L
E
-
N
T
-
H
K
Y
L
H
G
E
K
V
A
I
G
V
L
A
S
L
F
L
T
D
K
----------------
P
-----------------------
R
-----------
K
M
I
--------
E
E
V
Y
S
F
C
E
E
V
G
L
P
T
T
L
A
E
I
G
L
D
G
V
S
D
E
D
L
M
K
V
A
E
K
A
C
D
K
N
E
-------
T
I
H
N
E
P
Q
P
V
T
S
K
D
V
F
F
A
L
K
A
A
D
R
----
Y
G
R
M
R
K
--
35
HHSearch
59.02
21%
-71
- C2 -
1VLJ
2
?
A:
[17-406]
----
V
F
H
N
P
T
K
I
V
F
G
R
G
T
I
P
K
I
G
E
E
I
K
N
A
G
I
R
K
V
L
F
L
Y
G
G
G
S
-
I
K
--
K
N
G
V
Y
D
Q
V
V
D
S
L
-
K
K
H
-
G
-
I
E
W
V
E
V
S
G
-
V
K
P
N
P
V
L
S
K
V
H
E
A
V
E
V
A
K
K
E
K
V
E
A
V
L
G
V
G
G
G
S
V
V
D
S
A
K
A
V
A
A
G
A
L
YEGDIWDAFIGKYQIEK
A
L
P
I
F
D
V
L
T
I
S
A
T
G
T
E
M
N
G
N
A
V
I
T
N
E
K
T
K
E
K
Y
G
V
S
S
K
A
L
Y
P
K
V
S
I
I
D
P
S
V
Q
F
T
L
P
K
E
Q
T
V
Y
G
A
V
D
A
I
S
H
I
L
E
Y
Y
F
D
G
S
-
S
---
P
-----------
E
I
S
N
E
I
A
E
G
T
I
R
T
I
M
K
M
T
E
R
L
I
E
----
K
--------
P
D
---
D
Y
E
A
R
A
N
L
A
W
S
A
-
T
I
A
L
NGT
M
A
V
G
R
R
G
G
E
W
A
C
H
R
I
E
H
S
L
S
A
L
Y
-----
D
I
A
H
G
A
G
L
A
I
V
F
P
A
W
M
K
Y
V
Y
R
----------------
K
N
P
A
Q
F
E
R
F
A
K
K
IFG
F
E
G
E
G
E
E
L
I
L
-----------
K
G
I
--------
E
A
F
K
N
W
L
K
K
V
G
A
P
V
S
L
K
D
A
G
I
P
E
---
E
D
I
D
K
I
V
D
N
V
M
L
L
V
E
K
NLKPKG
A
S
L
G
R
I
M
V
L
E
R
E
D
V
R
E
I
L
K
L
A
A
K
------------
31
HHSearch
58.17
22%
-69
- C2 -
3BFJ
1
DHAT_KLEPN
A:
[7-386]
----
D
Y
L
V
P
N
V
N
F
F
G
P
N
A
I
S
V
V
G
E
R
C
Q
L
L
G
G
K
K
A
L
L
V
T
D
K
G
L
-
R
-KD
G
--
A
V
D
K
T
L
H
Y
L
-
R
E
A
-
G
-
I
E
V
A
I
F
D
G
-
V
E
P
N
P
K
D
T
N
V
R
D
G
L
A
V
F
R
R
E
Q
C
D
I
I
V
T
V
G
G
G
S
P
H
D
C
G
K
G
I
G
I
A
A
T
HEGDLYQYAGIETLTNP
L
P
P
I
V
A
V
N
T
T
A
G
T
A
S
E
V
T
R
H
C
V
L
T
N
T
E
T
K
V
K
F
V
I
V
S
W
R
N
L
P
S
V
S
I
N
D
P
L
L
M
I
G
K
P
A
A
L
T
A
A
T
G
M
D
A
L
T
H
A
V
E
A
Y
I
S
K
D
-
A
---
N
-----------
P
V
T
D
A
A
A
M
Q
A
I
R
L
I
A
R
N
L
R
Q
A
V
A
----
L
--------
G
S
---
N
L
Q
A
R
E
Y
M
A
Y
A
S
-
L
L
A
G
---
M
A
F
N
N
-
A
N
L
G
Y
V
H
A
M
A
H
Q
L
G
G
L
Y
-----
D
M
P
H
G
V
A
N
A
V
L
L
P
H
V
A
R
Y
N
L
I
AN
P
E
K
F
A
D
I
A
E
L
M
GEN
I
TGLS
T
L
D
A
A
--------------
E
-----------
K
A
I
--------
A
A
I
T
R
L
S
M
D
I
G
I
P
Q
H
L
R
D
L
G
V
K
E
---
T
D
F
P
Y
M
A
E
M
A
L
K
D
-
G
-------
N
A
F
S
N
P
R
K
G
N
E
Q
E
I
A
A
I
F
R
Q
A
F
-------------
37
HHSearch
58.03
20%
-71
* C2 *
3JZD
6
?
A:
[12-354]
------
A
H
A
A
R
V
V
F
G
A
G
S
S
S
Q
V
A
A
E
V
E
R
L
G
A
K
R
A
L
V
L
C
T
P
N
Q
-
Q
A
-----
E
A
E
R
I
A
D
L
L
-
G
P
L
-
S
-
A
G
-
V
-
Y
A
G
-
A
V
M
H
V
P
I
E
S
A
R
D
A
T
A
R
A
R
E
A
G
A
D
C
A
V
A
V
G
G
G
S
T
T
G
L
G
K
A
I
A
L
E
T
------------------
G
M
P
I
V
A
I
P
T
T
Y
-
A
G
S
E
V
T
P
V
Y
G
L
T
E
A
-
G
T
K
R
-
T
G
R
D
P
R
V
L
P
R
T
V
I
Y
D
P
A
L
T
V
G
L
P
R
G
L
S
V
T
S
A
L
N
A
I
A
H
A
A
E
G
L
Y
A
R
D
-
A
---
N
-----------
P
V
M
S
L
M
A
E
E
G
I
R
A
L
A
A
G
I
P
A
V
F
N
----
D
--------
P
---
A
D
L
D
A
R
S
Q
C
L
Y
G
A
-
W
L
C
G
---
T
V
L
G
G
-
V
G
M
A
L
H
H
K
L
C
H
T
L
G
G
S
F
-----
N
L
P
H
A
E
T
H
T
I
V
L
P
H
A
L
A
Y
N
A
A
AV--------------
P
E
A
M
A
R
I
R
R
A
T
GAGE---------
Q
-----------
S
A
A
--------
A
T
L
F
D
L
A
Q
R
H
G
A
P
V
A
L
R
D
I
G
M
R
E
---
E
D
L
D
R
A
A
D
I
A
L
A
S
----------
P
Y
W
N
P
R
P
I
E
R
E
P
I
R
A
L
L
Q
A
A
Y
E
----
G
V
R
P
D
---
36
HHSearch
57.46
19%
-69
- C2 -
3W5S
7
?
A:
[29-367]
-------
A
P
A
R
I
V
F
G
T
G
S
S
V
G
V
A
E
E
I
R
R
L
G
L
S
R
A
L
V
L
S
T
P
H
Q
-
K
---
G
--
D
A
E
A
L
A
A
R
L
-
G
---
P
-
L
A
A
G
V
F
S
D
-
A
A
M
H
T
P
V
E
V
T
K
R
A
V
E
A
Y
R
A
A
G
A
D
C
V
V
S
L
G
G
G
S
T
T
G
L
G
K
A
I
A
L
R
T
------------------
D
A
P
Q
I
V
I
P
T
T
Y
-
A
G
S
E
V
T
P
I
L
G
Q
T
E
-
N
G
V
K
T
-
T
L
R
G
P
E
I
L
P
E
V
V
I
Y
D
A
E
L
T
L
G
L
P
V
G
I
S
M
T
S
G
L
N
A
M
A
H
A
A
E
A
L
Y
A
R
D
-
R
---
N
-----------
P
I
A
S
M
M
A
V
E
G
L
R
A
M
I
E
A
L
P
G
V
R
M
----
E
--------
P
---
Q
D
T
K
A
R
E
T
A
L
Y
G
A
-
W
L
C
G
---
T
V
L
G
A
-
V
G
M
S
L
H
H
K
L
C
H
T
L
G
G
S
L
-----
D
L
P
H
A
E
T
H
A
V
L
L
P
Y
T
I
A
Y
V
E
Q
----------------
A
VP---------------------
D
QL
A
P
L
A
A
L
V
GG
R
A
G
--------
T
G
L
Y
D
F
A
A
R
L
G
A
P
A
S
L
A
A
L
G
V
G
G
---
E
D
L
D
A
M
A
E
L
A
T
A
N
----------
P
Y
W
C
P
R
P
V
E
K
T
A
I
R
A
L
L
Q
R
A
F
E
----
G
A
R
P
----
34
HHSearch
55.61
19%
-65
- C2 -
1O2D
3
?
A:
[15-369]
----
E
F
Y
M
P
T
D
V
F
F
G
E
K
I
L
E
K
R
G
N
I
I
D
L
L
G
-
K
R
A
L
V
V
T
G
K
S
S
-
S
K
--
K
N
G
S
L
D
D
L
K
K
L
L
-
D
E
T
-
E
-
I
S
Y
E
I
F
D
E
-
V
E
E
N
P
S
F
D
N
V
M
K
A
V
E
R
Y
R
N
D
S
F
D
F
V
V
G
L
G
G
G
S
P
M
D
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A
K
A
V
A
V
L
L
K
E
KDLS
V
E
D
L
Y
DREKVKH
W
L
P
V
V
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T
A
G
T
G
S
E
V
T
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Y
S
I
L
T
D
P
E
G
N
K
R
-
G
--
C
T
L
M
F
P
V
Y
A
F
L
D
P
R
Y
T
Y
S
M
S
D
E
L
T
L
S
T
G
V
D
A
L
S
H
A
V
E
G
Y
L
S
R
K
-
S
---
T
-----------
P
P
S
D
A
L
A
I
E
A
M
K
I
I
H
R
N
L
P
K
A
I
E
----
G
-------------
N
R
E
A
R
K
K
M
F
V
A
S
-
C
L
A
G
---
M
V
I
A
Q
-
T
G
T
T
L
A
H
A
L
G
Y
P
L
T
T
E
K
-----
G
I
K
H
G
K
A
T
G
M
V
L
P
F
V
M
E
V
M
K
E
----------------
E
I----------------------
P
-----------
E
K
V
D
T
V
N
H
I
F
G
G
S
L
L
K
F
L
K
E
L
G
L
Y
E
K
V
---
A
V
S
S
---
E
E
L
E
K
W
V
E
K
G
S
R
A
-
K
-------
H
L
K
N
T
P
G
T
F
T
P
E
K
I
R
N
I
Y
R
E
A
L
G
----
V
-------