@TOME V2.3
(Mar 2018)
Ref.
-
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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 : spr0372: (2017-12-20 )
MLDIKRIRTDFEAVAEKLATRGVDAAVLNEMKEIDAKRRNILVKVETLKAERNTVSAEIAQAKRNKENTDDKIAAMQNLSAEVKALDAELAEIDAKLTEFTTTLPNIPADSVPVGADEDDNVEVRRWGTPREFDFEPKAHWDLGEDLGILDWERGGKVTGARFLFYKGLGARLERAIYNFMLDEHGKEGYTEVITPYIVNHDSMFGTGQYPKFKEDTFELSDTNFVLIPTAEVPLTNYYRDEILDGKDLPIYFTAMSPSFRSEAGSAGRDTRGLIRLHQFHKVEMVKFAKPEESYEELEKMTANAENILQKLNLPYRVVALSTGDMGFSATKTYDLEVWIPAQNNYREISSCSNTEDFQARRAQIRYRDEADGKVKLLHTLNGSGLAVGRTVAAILENYQNEDGSVTIPEALRPYMGGAEVIKP
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.......390.......400.......410.......420..--------------
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
-----------------------------------------------------------------------------------------------ML
D
I
K
R
I
R
T
----
D
--
F
E
A
V
A
E
K
L
A
TRGV
D
--
A
--
A
V
--
L
N
-
E
M
---
K
E
I
D
A
KRR
N
I
L
V
K
V
--------
E
T
LKAERN
T
V
S
A
E
I
A
Q
A
KRNK--------E-----------------------------NT-------------------
D
D
----
K
-----------------------------
I
A
A
M
Q
-
N
L
S
A
E
V
K
A
L
D
A
E
L
A
E
I
D
A
K
L
T
E
F
T
TTLPNIPADSVPVGADED-D-N
V
E
V
R
RWGTPRE--------------------F--------------------DFEPKAHWDLGEDLGI
L
D
WE-RG-G-KVTG
A
R
F
L
F
Y
K
G
L
G
A
R
L
E
R
A
--
I
Y
N
F
M
L
D
EHGKEG
Y
T
E
V
I
T
P
Y
I
VNHDSMFGTGQYPKFKED
T
F
----ELSD--T--
N
F
V
L
I
PTAEVP
L
T
N
Y
Y
R
D
EILDGKDL
P
I
Y
F
T
AMSP
S
F
R
SEAGSAGRD
T
R
G
L
I
R
L
H
Q
F
H
K
V
E
--
M
V
KFAKP--
E
--
E
S
Y
E
E
L
E
K
MTA
N
A
E
N
I
L
Q
KLNL
P
Y
R
V
V
A
L
STGDMGFSA
T
K
T
Y
D
L
E
V
W
I
PAQNN
Y
R
E
I
SSCSN
T
E
D
F
Q
A
R
R
A
Q
I
R
Y
RDE-----AD-----
G
---
K
V
K
L
L
H
TLNGSGL
A
V
G
R
T
V
A
A
I
L
E
N
YQNEDG
S
V
T
I
P
E
A
L
R
P
YMGGAEVIKP--------------
45
HHSearch
72.56
56%
33
- C1 -
-
2DQ3
1
SYS_AQUAE
A:
[1-424]
-----------------------------------------------------------------------------------------------
M
I
D
I
N
L
I
R
E
----
K
--
P
D
Y
V
K
E
R
L
A
T
R
D
K
E
L-
V
--
S
L
--
V
D
-
K
V
---
L
E
L
D
K
R
R
R
E
I
I
K
R
L
--------
E
A
L
R
S
E
R
N
K
L
S
K
E
I
G
K
L
K
R
E
G
--------
K
-----------------------------
D
T
-------------------
T
E
----
I
-----------------------------
Q
N
R
V
K
-
E
L
K
E
E
I
D
R
L
E
E
E
L
R
K
V
E
E
E
L
K
N
T
L
L
W
I
P
N
L
P
H
P
S
V
P
V
G
E
D
E
K
-
D
-
N
V
E
V
R
R
W
G
E
P
R
K
--------------------
F
--------------------
D
F
E
P
K
P
H
W
E
I
G
E
R
L
G
I
L
D
F
K
-
R
G
-
A
-
K
L
S
G
S
R
F
T
V
I
A
G
W
G
A
R
L
E
R
A
--
L
I
N
F
M
L
D
L
H
T
K
K
G
Y
K
E
I
C
P
P
H
L
V
K
P
E
I
L
I
G
T
G
Q
L
P
K
F
E
E
D
L
Y
----
K
C
E
R
--
D
--
N
L
Y
L
I
P
T
A
E
V
P
L
T
N
L
Y
R
E
E
I
L
K
E
E
N
L
P
I
Y
L
T
A
Y
T
P
C
Y
R
R
E
A
G
A
Y
G
K
D
I
R
G
I
I
R
Q
H
Q
F
D
K
V
E
--
L
V
K
I
V
H
P
--
D
--
T
S
Y
D
E
L
E
K
L
V
K
D
A
E
E
V
L
Q
L
L
G
L
P
Y
R
V
V
E
L
C
T
G
D
L
G
F
S
A
A
K
T
Y
D
I
E
V
W
F
P
S
Q
N
K
Y
R
E
I
S
S
C
S
N
C
E
D
F
Q
A
R
R
M
N
T
R
F
K
D
S
-----
K
T
-----
G
---
K
N
R
F
V
H
T
L
N
G
S
G
L
A
V
G
R
T
L
A
A
I
L
E
N
Y
Q
Q
E
D
G
S
V
V
V
P
E
V
L
R
D
Y
V
G
T
-
D
V
I
R
P
--------------
1
PsiBlast_PDB
71.96
55%
34
- C1 -
-
2DQ3
1
SYS_AQUAE
A:
[2-424]
------------------------------------------------------------------------------------------------
I
D
I
N
L
I
R
E
----
K
--
P
D
Y
V
K
E
R
L
A
T
R
D
K
E
L-
V
--
S
L
--
V
D
-
K
V
---
L
E
L
D
K
R
R
R
E
I
I
K
R
L
--------
E
A
L
R
S
E
R
N
K
L
S
K
E
I
G
K
L
K
R
E
G
--------
K
-----------------------------
D
T
-------------------
T
E
----
I
-----------------------------
Q
N
R
V
K
-
E
L
K
E
E
I
D
R
L
E
E
E
L
R
K
V
E
E
E
L
K
N
T
L
L
W
I
P
N
L
P
H
P
S
V
P
V
G
E
D
E
K
-
D
-
N
V
E
V
R
R
W
G
E
P
R
K
--------------------
F
--------------------
D
F
E
P
K
P
H
W
E
I
G
E
R
L
G
I
L
D
F
K
-
R
G
-
A
-
K
L
S
G
S
R
F
T
V
I
A
G
W
G
A
R
L
E
R
A
--
L
I
N
F
M
L
D
L
H
T
K
K
G
Y
K
E
I
C
P
P
H
L
V
K
P
E
I
L
I
G
T
G
Q
L
P
K
F
E
E
D
L
Y
----
K
C
E
R
--
D
--
N
L
Y
L
I
P
T
A
E
V
P
L
T
N
L
Y
R
E
E
I
L
K
E
E
N
L
P
I
Y
L
T
A
Y
T
P
C
Y
R
R
E
A
G
A
Y
G
K
D
I
R
G
I
I
R
Q
H
Q
F
D
K
V
E
--
L
V
K
I
V
H
P
--
D
--
T
S
Y
D
E
L
E
K
L
V
K
D
A
E
E
V
L
Q
L
L
G
L
P
Y
R
V
V
E
L
C
T
G
D
L
G
F
S
A
A
K
T
Y
D
I
E
V
W
F
P
S
Q
N
K
Y
R
E
I
S
S
C
S
N
C
E
D
F
Q
A
R
R
M
N
T
R
F
K
D
S
-----
K
T
-----
G
---
K
N
R
F
V
H
T
L
N
G
S
G
L
A
V
G
R
T
L
A
A
I
L
E
N
Y
Q
Q
E
D
G
S
V
V
V
P
E
V
L
R
D
Y
V
-
G
T
D
V
I
R
P
--------------
49
HHSearch
68.37
38%
-17
- C1 -
-
1SRY
-
SYS_THET2
B:
[1-419]
-----------------------------------------------------------------------------------------------
M
V
D
L
K
R
L
R
Q
----
E
--
P
E
V
F
H
R
A
I
R
E
K
G
V
A
--
L
---
D
--
L
E
-
A
L
---
L
A
L
D
R
E
V
Q
E
L
K
K
R
L
--------
Q
E
V
Q
T
E
R
N
Q
V
A
K
R
V
P
K
A
P
P
----------
E
-----------------------------
E
K
-------------------
E
A
----
L
-----------------------------
I
A
R
G
K
-
A
L
G
E
E
A
K
R
L
E
E
A
L
R
E
K
E
A
R
L
E
A
L
L
L
Q
V
P
L
P
P
W
P
G
A
P
V
G
G
E
E
--
A
-
N
R
E
I
K
R
V
G
G
P
P
E
--------------------
F
--------------------
S
F
P
P
L
D
H
V
A
L
M
E
K
N
G
W
W
E
P
--
R
I
-
S
-
Q
V
S
G
S
R
S
Y
A
L
K
G
D
L
A
L
Y
E
L
A
--
L
L
R
F
A
M
D
F
M
A
R
R
G
F
L
P
M
T
L
P
S
Y
A
R
E
K
A
F
L
G
T
G
H
F
P
A
Y
R
D
Q
V
W
----
A
I
A
E
--
T
--
D
L
Y
L
T
G
T
A
E
V
V
L
N
A
L
H
S
G
E
I
L
P
Y
E
A
L
P
L
R
Y
A
G
Y
A
P
A
F
R
S
E
A
G
S
F
G
K
D
V
R
G
L
M
R
V
H
Q
F
H
K
V
E
--
Q
Y
V
L
T
E
A
--
S
LE
A
S
D
R
A
F
Q
E
L
L
E
N
A
E
E
I
L
R
L
L
E
L
P
Y
R
L
V
E
V
A
T
G
D
M
G
P
G
K
W
R
Q
V
D
I
E
V
Y
L
P
S
E
G
R
Y
R
E
T
H
S
C
S
A
L
L
D
W
Q
A
R
R
A
N
L
R
Y
R
D
P
------
E
-----
G
---
R
V
R
Y
A
Y
T
L
N
N
T
A
L
A
T
P
R
I
L
A
M
L
L
E
N
H
Q
L
Q
D
G
R
V
R
V
P
Q
A
L
I
P
Y
M
G
K
-
E
V
L
E
P
--------------
48
HHSearch
68.23
38%
-19
- C1 -
-
1SER
-
B:
[501-919]
-----------------------------------------------------------------------------------------------
M
V
D
L
K
R
L
R
Q
----
E
--
P
E
V
F
H
R
A
I
R
E
K
G
V
A
--
L
---
D
--
L
E
-
A
L
---
L
A
L
D
R
E
V
Q
E
L
K
K
R
L
--------
Q
E
V
Q
T
E
R
N
Q
V
A
K
R
V
P
K
A
P
P
----------
E
-----------------------------
E
K
-------------------
E
A
----
L
-----------------------------
I
A
R
G
K
-
A
L
G
E
E
A
K
R
L
E
E
A
L
R
E
K
E
A
R
L
E
A
L
L
L
Q
V
P
L
P
P
W
P
G
A
P
V
G
G
E
E
--
A
-
N
R
E
I
K
R
V
G
G
P
P
E
--------------------
F
--------------------
S
F
P
P
L
D
H
V
A
L
M
E
K
N
G
W
W
E
P
--
R
I
-
S
-
Q
V
S
G
S
R
S
Y
A
L
K
G
D
L
A
L
Y
E
L
A
--
L
L
R
F
A
M
D
F
M
A
R
R
G
F
L
P
M
T
L
P
S
Y
A
R
E
K
A
F
L
G
T
G
H
F
P
A
Y
R
D
Q
V
W
----
A
I
A
E
--
T
--
D
L
Y
L
T
G
T
A
E
V
V
L
N
A
L
H
S
G
E
I
L
P
Y
E
A
L
P
L
R
Y
A
G
Y
A
P
A
F
R
S
E
A
G
S
F
G
K
D
V
R
G
L
M
R
V
H
Q
F
H
K
V
E
--
Q
Y
V
L
T
E
A
--
S
L
E
A
S
D
R
A
F
Q
E
L
L
E
N
A
E
E
I
L
R
L
L
E
L
P
Y
R
L
V
E
V
A
T
G
D
M
G
P
G
K
W
R
Q
V
D
I
E
V
Y
L
P
S
E
G
R
Y
R
E
T
H
S
C
S
A
L
L
D
W
Q
A
R
R
A
N
L
R
Y
R
D
P
------
E
-----
G
---
R
V
R
Y
A
Y
T
L
N
N
T
A
L
A
T
P
R
I
L
A
M
L
L
E
N
H
Q
L
Q
D
G
R
V
R
V
P
Q
A
L
I
P
Y
M
G
K
-
E
V
L
E
P
--------------
50
HHSearch
62.89
43%
57
- C1 -
-
2DQ0
1
SYS_PYRHO
A:
[1-445]
-----------------------------------------------------------------------------------------------
M
L
D
I
K
L
I
R
E
----
N
--
P
E
L
V
K
N
D
L
I
K
R
G
E
L
--
E
K
V
K
W
--
V
D
-
E
I
---
L
K
L
D
T
E
W
R
T
K
L
K
E
I
--------
N
R
L
R
H
E
R
N
K
I
A
V
E
I
G
K
R
R
K
K
G
--------
E
-----------------------------
P
V
-------------------
D
E
----
L
-----------------------------
L
A
K
S
R
-
E
I
V
K
R
I
G
E
L
E
N
E
V
E
E
L
K
K
K
I
D
Y
Y
L
W
R
L
P
N
I
T
H
P
S
V
P
V
G
K
D
E
N
-
D
-
N
V
P
I
R
F
W
G
K
A
R
V
WKGH
L
E
R
F
L
E
Q
S
QGK
M
E
Y
E
I
L
--------------------
E
W
K
P
K
L
H
V
D
L
L
E
I
L
G
G
A
D
F
A
-
R
A
-
A
-
K
V
S
G
S
R
F
Y
Y
L
L
N
E
I
V
I
L
D
L
A
--
L
I
R
F
A
L
D
R
L
I
E
K
G
F
T
P
V
I
P
P
Y
M
V
R
R
F
V
E
E
G
S
T
S
F
E
D
F
E
D
V
I
Y
----
K
V
E
D
--
E
--
D
L
Y
L
I
P
T
A
E
H
P
L
A
G
M
H
A
N
E
I
L
D
G
K
D
L
P
L
L
Y
V
G
V
S
P
C
F
R
K
E
A
G
T
A
G
K
D
T
K
G
I
F
R
V
H
Q
F
H
K
V
E
--
Q
F
V
Y
S
R
P
--
E
--
E
S
W
E
W
H
E
K
I
I
R
N
A
E
E
L
F
Q
E
L
E
I
P
Y
R
V
V
N
I
C
T
G
D
L
G
Y
V
A
A
K
K
Y
D
I
E
A
W
M
P
G
Q
G
K
F
R
E
V
V
S
A
S
N
C
T
D
W
Q
A
R
R
L
N
I
R
F
R
D
R
-----
T
D
-----
E
---
K
P
R
Y
V
H
T
L
N
S
T
A
I
A
T
S
R
A
I
V
A
I
L
E
N
H
Q
E
E
D
G
T
V
R
I
P
K
V
L
W
K
Y
T
G
F
-
K
E
I
V
P
--------------
51
HHSearch
62.50
43%
59
- C1 -
-
2ZR3
-
SYS_PYRHO
B:
[1-445]
-----------------------------------------------------------------------------------------------
M
L
D
I
K
L
I
R
E
----
N
--
P
E
L
V
K
N
D
L
I
K
R
G
E
L
--
E
KV
K
W
--
V
D
-
E
I
---
L
K
L
D
T
E
W
R
T
K
L
K
E
I
--------
N
R
L
R
H
E
R
N
K
I
A
V
E
I
G
K
R
R
K
K
G
--------
E
-----------------------------
P
V
-------------------
D
E
----
L
-----------------------------
L
A
K
S
R
-
E
I
V
K
R
I
G
E
L
E
N
E
V
E
E
L
K
K
K
I
D
Y
Y
L
W
R
L
P
N
I
T
H
P
S
V
P
V
G
K
D
E
N
-
D
-
N
V
P
I
R
F
W
G
K
A
R
V
WKGHLERFLEQSQGKMEYEI
L
--------------------
E
W
K
P
K
L
H
V
D
L
L
E
I
L
G
G
A
D
F
A
-
R
A
-
A
-
K
V
S
G
S
R
F
Y
Y
L
L
N
E
I
V
I
L
D
L
A
--
L
I
R
F
A
L
D
R
L
I
E
K
G
F
T
P
V
I
P
P
Y
M
V
R
R
F
V
E
E
G
S
T
S
F
E
D
F
E
D
V
I
Y
----
K
V
E
D
--
E
--
D
L
Y
L
I
P
T
A
E
H
P
L
A
G
M
H
A
N
E
I
L
D
G
K
D
L
P
L
L
Y
V
G
V
S
P
C
F
R
K
E
A
G
T
A
G
K
D
T
K
G
I
F
R
V
H
Q
F
H
K
V
E
--
Q
F
V
Y
S
R
P
--
E
--
E
S
W
E
W
H
E
K
I
I
R
N
A
E
E
L
F
Q
E
L
E
I
P
Y
R
V
V
N
I
C
T
G
D
L
G
Y
V
A
A
K
K
Y
D
I
E
A
W
M
P
G
Q
G
K
F
R
E
V
V
S
A
S
N
C
T
D
W
Q
A
R
R
L
N
I
R
F
R
D
R
-----
T
D
-----
E
---
K
P
R
Y
V
H
T
L
N
S
T
A
I
A
T
S
R
A
I
V
A
I
L
E
N
H
Q
E
E
D
G
T
V
R
I
P
K
V
L
W
K
Y
T
G
F
-
K
E
I
V
P
--------------
22
PsiBlast_CBE
61.95
40%
55
- C1 -
-
2DQ0
1
SYS_PYRHO
B:
[1-444]
-----------------------------------------------------------------------------------------------
M
L
D
I
K
L
I
R
E
----
N
--
P
E
L
V
K
N
D
L
I
K
R
G
E
L
--
E
--
K
V
KW
V
D
-
E
I
---
L
K
L
D
T
E
W
R
T
K
L
K
E
I
--------
N
R
L
R
H
E
R
N
K
I
A
V
E
I
G
K
R
R
K
K
G
--------
E
-----------------------------
P
V
-------------------
D
E
----
L
-----------------------------
L
A
K
S
R
-
E
I
V
K
R
I
G
E
L
E
N
E
V
E
E
L
K
K
K
I
D
Y
Y
L
W
R
L
P
N
I
T
H
P
S
V
P
V
G
K
D
E
N
-
D
-
N
V
P
I
R
F
W
G
K
A
R
V
--------------------
W
KGHLERFLEQSQGKMEYEIL
E
W
K
P
K
L
H
V
D
L
L
E
I
L
G
G
A
D
F
A
-
R
A
-
A
-
K
V
S
G
S
R
F
Y
Y
L
L
N
E
I
V
I
L
D
L
A
--
L
I
R
F
A
L
D
R
L
I
E
K
G
F
T
P
V
I
P
P
Y
M
V
R
R
F
V
E
E
G
S
T
S
F
E
D
F
E
D
V
I
Y
----
K
V
E
D
--
E
--
D
L
Y
L
I
P
T
A
E
H
P
L
A
G
M
H
A
N
E
I
L
D
G
K
D
L
P
L
L
Y
V
G
V
S
P
C
F
R
K
E
A
G
T
A
G
K
D
T
K
G
I
F
R
V
H
Q
F
H
K
V
E
--
Q
F
V
Y
S
R
P
--
E
--
E
S
W
E
W
H
E
K
I
I
R
N
A
E
E
L
F
Q
E
L
E
I
P
Y
R
V
V
N
I
C
T
G
D
L
G
Y
V
A
A
K
K
Y
D
I
E
A
W
M
P
G
Q
G
K
F
R
E
V
V
S
A
S
N
C
T
D
W
Q
A
R
R
L
N
I
R
F
R
D
R
-----
T
D
-----
E
---
K
P
R
Y
V
H
T
L
N
S
T
A
I
A
T
S
R
A
I
V
A
I
L
E
N
H
Q
E
E
D
G
T
V
R
I
P
K
V
L
W
K
Y
T
G
F
K
E
I
V
----------------
21
PsiBlast_CBE
61.89
40%
56
- C1 -
-
2ZR2
1
SYS_PYRHO
B:
[1-444]
-----------------------------------------------------------------------------------------------
M
L
D
I
K
L
I
R
E
----
N
--
P
E
L
V
K
N
D
L
I
K
R
G
E
L
--
E
--
K
V
KW
V
D
-
E
I
---
L
K
L
D
T
E
W
R
T
K
L
K
E
I
--------
N
R
L
R
H
E
R
N
K
I
A
V
E
I
G
K
R
R
K
K
G
--------
E
-----------------------------
P
V
-------------------
D
E
----
L
-----------------------------
L
A
K
S
R
-
E
I
V
K
R
I
G
E
L
E
N
E
V
E
E
L
K
K
K
I
D
Y
Y
L
W
R
L
P
N
I
T
H
P
S
V
P
V
G
K
D
E
N
-
D
-
N
V
P
I
R
F
W
G
K
A
R
V
--------------------
W
KGHLERFLEQSQGKMEYEIL
E
W
K
P
K
L
H
V
D
L
L
E
I
L
G
G
A
D
F
A
-
R
A
-
A
-
K
V
S
G
S
R
F
Y
Y
L
L
N
E
I
V
I
L
D
L
A
--
L
I
R
F
A
L
D
R
L
I
E
K
G
F
T
P
V
I
P
P
Y
M
V
R
R
F
V
E
E
G
S
T
S
F
E
D
F
E
D
V
I
Y
----
K
V
E
D
--
E
--
D
L
Y
L
I
P
T
A
E
H
P
L
A
G
M
H
A
N
E
I
L
D
G
K
D
L
P
L
L
Y
V
G
V
S
P
C
F
R
K
E
A
G
T
A
G
K
D
T
K
G
I
F
R
V
H
Q
F
H
K
V
E
--
Q
F
V
Y
S
R
P
--
E
--
E
S
W
E
W
H
E
K
I
I
R
N
A
E
E
L
F
Q
E
L
E
I
P
Y
R
V
V
N
I
C
T
G
D
L
G
Y
V
A
A
K
K
Y
D
I
E
A
W
M
P
G
Q
G
K
F
R
E
V
V
S
A
S
N
C
T
D
W
Q
A
R
R
L
N
I
R
F
R
D
R
-----
T
D
-----
E
---
K
P
R
Y
V
H
T
L
N
S
T
A
I
A
T
S
R
A
I
V
A
I
L
E
N
H
Q
E
E
D
G
T
V
R
I
P
K
V
L
W
K
Y
T
G
F
K
E
I
V
----------------
3
PsiBlast_PDB
61.87
40%
53
- C1 -
-
2ZR2
1
SYS_PYRHO
A:
[1-444]
-----------------------------------------------------------------------------------------------
M
L
D
I
K
L
I
R
E
----
N
--
P
E
L
V
K
N
D
L
I
K
R
G
E
L
--
E
--
K
V
K
W
V
D
-
E
I
---
L
K
L
D
T
E
W
R
T
K
L
K
E
I
--------
N
R
L
R
H
E
R
N
K
I
A
V
E
I
G
K
R
R
K
K
G
--------
E
-----------------------------
P
V
-------------------
D
E
----
L
-----------------------------
L
A
K
S
R
-
E
I
V
K
R
I
G
E
L
E
N
E
V
E
E
L
K
K
K
I
D
Y
Y
L
W
R
L
P
N
I
T
H
P
S
V
P
V
G
K
D
E
N
-
D
-
N
V
P
I
R
F
W
G
K
A
R
V
--------------------
W
KGH
L
E
R
F
L
E
Q
S
QGK
M
E
Y
E
I
L
E
W
K
P
K
L
H
V
D
L
L
E
I
L
G
G
A
D
F
A
-
R
A
-
A
-
K
V
S
G
S
R
F
Y
Y
L
L
N
E
I
V
I
L
D
L
A
--
L
I
R
F
A
L
D
R
L
I
E
K
G
F
T
P
V
I
P
P
Y
M
V
R
R
F
V
E
E
G
S
T
S
F
E
D
F
E
D
V
I
Y
----
K
V
E
D
--
E
--
D
L
Y
L
I
P
T
A
E
H
P
L
A
G
M
H
A
N
E
I
L
D
G
K
D
L
P
L
L
Y
V
G
V
S
P
C
F
R
K
E
A
G
T
A
G
K
D
T
K
G
I
F
R
V
H
Q
F
H
K
V
E
--
Q
F
V
Y
S
R
P
--
E
--
E
S
W
E
W
H
E
K
I
I
R
N
A
E
E
L
F
Q
E
L
E
I
P
Y
R
V
V
N
I
C
T
G
D
L
G
Y
V
A
A
K
K
Y
D
I
E
A
W
M
P
G
Q
G
K
F
R
E
V
V
S
A
S
N
C
T
D
W
Q
A
R
R
L
N
I
R
F
R
D
R
-----
T
D
-----
E
---
K
P
R
Y
V
H
T
L
N
S
T
A
I
A
T
S
R
A
I
V
A
I
L
E
N
H
Q
E
E
D
G
T
V
R
I
P
K
V
L
W
K
Y
T
G
F
K
E
I
V
----------------
24
PsiBlast_CBE
61.56
37%
29
- C1 -
-
1SES
1
SYS_THET2
B:
[1-419]
-----------------------------------------------------------------------------------------------
M
V
D
L
K
R
L
R
Q
----
E
--
P
E
V
F
H
R
A
I
R
E
K
G
V
A
--
L
--
D
L
--
E
A
-
L
L
ALD
R
E
V
Q
E
L
K
K
----
R
L
--------
Q
E
V
Q
T
E
R
N
Q
V
A
K
R
V
P
K
A
P
--
P
--------
E
-----------------------------
E
K
-------------------
E
A
----
L
-----------------------------
I
A
R
G
K
-
A
L
G
E
E
A
K
R
L
E
E
A
L
R
E
K
E
A
R
L
E
A
L
L
L
Q
V
P
L
P
P
W
P
G
A
P
V
G
G
E
E
A
---
N
R
E
I
K
R
V
G
G
P
P
E
--------------------
F
--------------------
S
F
P
P
L
D
H
V
A
L
M
E
K
N
G
W
--
W
E
P
R
I
-
S
-
Q
V
S
G
S
R
S
Y
A
L
K
G
D
L
A
L
Y
E
L
A
--
L
L
R
F
A
M
D
F
M
A
R
R
G
F
L
P
M
T
L
P
S
Y
A
R
E
K
A
F
L
G
T
G
H
F
P
A
Y
R
D
Q
V
W
----
A
I
A
E
--
T
--
D
L
Y
L
T
G
T
A
E
V
V
L
N
A
L
H
S
G
E
I
L
P
Y
E
A
L
P
L
R
Y
A
G
Y
A
P
A
F
R
S
E
A
G
S
F
G
K
D
V
R
G
L
M
R
V
H
Q
F
H
K
V
E
QY
V
L
T
E
A
S
L
--
E
--
A
S
D
R
A
F
Q
E
L
L
E
N
A
E
E
I
L
R
L
L
E
L
P
Y
R
L
V
E
V
A
T
G
D
M
G
P
G
K
W
R
Q
V
D
I
E
V
Y
L
P
S
E
G
R
Y
R
E
T
H
S
C
S
A
L
L
D
W
Q
A
R
R
A
N
L
R
Y
R
D
------
P
E
-----
G
---
R
V
R
Y
A
Y
T
L
N
N
T
A
L
A
T
P
R
I
L
A
M
L
L
E
N
H
Q
L
Q
D
G
R
V
R
V
P
Q
A
L
I
P
Y
M
-
G
K
E
V
L
E
P
--------------
2
PsiBlast_PDB
61.53
40%
55
- C1 -
-
2DQ0
1
SYS_PYRHO
A:
[1-444]
-----------------------------------------------------------------------------------------------
M
L
D
I
K
L
I
R
E
----
N
--
P
E
L
V
K
N
D
L
I
K
R
G
E
L
--
E
--
K
V
K
W
V
D
-
E
I
---
L
K
L
D
T
E
W
R
T
K
L
K
E
I
--------
N
R
L
R
H
E
R
N
K
I
A
V
E
I
G
K
R
R
K
K
G
--------
E
-----------------------------
P
V
-------------------
D
E
----
L
-----------------------------
L
A
K
S
R
-
E
I
V
K
R
I
G
E
L
E
N
E
V
E
E
L
K
K
K
I
D
Y
Y
L
W
R
L
P
N
I
T
H
P
S
V
P
V
G
K
D
E
N
-
D
-
N
V
P
I
R
F
W
G
K
A
R
V
--------------------
W
KGH
L
E
R
F
L
E
Q
S
QGK
M
E
Y
E
I
L
E
W
K
P
K
L
H
V
D
L
L
E
I
L
G
G
A
D
F
A
-
R
A
-
A
-
K
V
S
G
S
R
F
Y
Y
L
L
N
E
I
V
I
L
D
L
A
--
L
I
R
F
A
L
D
R
L
I
E
K
G
F
T
P
V
I
P
P
Y
M
V
R
R
F
V
E
E
G
S
T
S
F
E
D
F
E
D
V
I
Y
----
K
V
E
D
--
E
--
D
L
Y
L
I
P
T
A
E
H
P
L
A
G
M
H
A
N
E
I
L
D
G
K
D
L
P
L
L
Y
V
G
V
S
P
C
F
R
K
E
A
G
T
A
G
K
D
T
K
G
I
F
R
V
H
Q
F
H
K
V
E
--
Q
F
V
Y
S
R
P
--
E
--
E
S
W
E
W
H
E
K
I
I
R
N
A
E
E
L
F
Q
E
L
E
I
P
Y
R
V
V
N
I
C
T
G
D
L
G
Y
V
A
A
K
K
Y
D
I
E
A
W
M
P
G
Q
G
K
F
R
E
V
V
S
A
S
N
C
T
D
W
Q
A
R
R
L
N
I
R
F
R
D
R
-----
T
D
-----
E
---
K
P
R
Y
V
H
T
L
N
S
T
A
I
A
T
S
R
A
I
V
A
I
L
E
N
H
Q
E
E
D
G
T
V
R
I
P
K
V
L
W
K
Y
T
G
F
K
E
I
V
----------------
8
PsiBlast_PDB
61.28
37%
34
- C1 -
-
1SET
1
SYS_THET2
A:
[1-419]
-----------------------------------------------------------------------------------------------
M
V
D
L
K
R
L
R
Q
----
E
--
P
E
V
F
H
R
A
I
R
E
K
G
V
A
--
L
--
D
L
--
E
A
-
L
L
A
L
D
R
E
V
Q
E
L
K
K
----
R
L
--------
Q
E
V
Q
T
E
R
N
Q
V
A
K
R
V
P
K
A
P
--
P
--------
E
-----------------------------
E
K
-------------------
E
A
----
L
-----------------------------
I
A
R
G
K
-
A
L
G
E
E
A
K
R
L
E
E
A
L
R
E
K
E
A
R
L
E
A
L
L
L
Q
V
P
L
P
P
W
P
G
A
P
V
G
G
E
E
A
---
N
R
E
I
K
R
V
G
G
P
P
E
--------------------
F
--------------------
S
F
P
P
L
D
H
V
A
L
M
E
K
N
G
W
--
W
E
P
R
I
-
S
-
Q
V
S
G
S
R
S
Y
A
L
K
G
D
L
A
L
Y
E
L
A
--
L
L
R
F
A
M
D
F
M
A
R
R
G
F
L
P
M
T
L
P
S
Y
A
R
E
K
A
F
L
G
T
G
H
F
P
A
Y
R
D
Q
V
W
----
A
I
A
E
--
T
--
D
L
Y
L
T
G
T
A
E
V
V
L
N
A
L
H
S
G
E
I
L
P
Y
E
A
L
P
L
R
Y
A
G
Y
A
P
A
F
R
S
E
A
G
S
F
G
K
D
V
R
G
L
M
R
V
H
Q
F
H
K
V
E
Q
Y
V
L
T
E
A
S
L
--
E
--
A
S
D
R
A
F
Q
E
L
L
E
N
A
E
E
I
L
R
L
L
E
L
P
Y
R
L
V
E
V
A
T
G
D
M
G
P
G
K
W
R
Q
V
D
I
E
V
Y
L
P
S
E
G
R
Y
R
E
T
H
S
C
S
A
L
L
D
W
Q
A
R
R
A
N
L
R
Y
R
D
------
P
E
-----
G
---
R
V
R
Y
A
Y
T
L
N
N
T
A
L
A
T
P
R
I
L
A
M
L
L
E
N
H
Q
L
Q
D
G
R
V
R
V
P
Q
A
L
I
P
Y
M
-
G
K
E
V
L
E
P
--------------
23
PsiBlast_CBE
61.25
37%
32
- C1 -
-
1SET
1
SYS_THET2
B:
[1-419]
-----------------------------------------------------------------------------------------------
M
V
D
L
K
R
L
R
Q
----
E
--
P
E
V
F
H
R
A
I
R
E
K
G
V
A
--
L
--
D
L
--
E
A
-
L
L
ALD
R
E
V
Q
E
L
K
K
----
R
L
--------
Q
E
V
Q
T
E
R
N
Q
V
A
K
R
V
P
K
A
P
--
P
--------
E
-----------------------------
E
K
-------------------
E
A
----
L
-----------------------------
I
A
R
G
K
-
A
L
G
E
E
A
K
R
L
E
E
A
L
R
E
K
E
A
R
L
E
A
L
L
L
Q
V
P
L
P
P
W
P
G
A
P
V
G
G
E
E
A
---
N
R
E
I
K
R
V
G
G
P
P
E
--------------------
F
--------------------
S
F
P
P
L
D
H
V
A
L
M
E
K
N
G
W
--
W
E
P
R
I
-
S
-
Q
V
S
G
S
R
S
Y
A
L
K
G
D
L
A
L
Y
E
L
A
--
L
L
R
F
A
M
D
F
M
A
R
R
G
F
L
P
M
T
L
P
S
Y
A
R
E
K
A
F
L
G
T
G
H
F
P
A
Y
R
D
Q
V
W
----
A
I
A
E
--
T
--
D
L
Y
L
T
G
T
A
E
V
V
L
N
A
L
H
S
G
E
I
L
P
Y
E
A
L
P
L
R
Y
A
G
Y
A
P
A
F
R
S
E
A
G
S
F
G
K
D
V
R
G
L
M
R
V
H
Q
F
H
K
V
E
QY
V
L
T
E
A
S
L
--
E
--
A
S
D
R
A
F
Q
E
L
L
E
N
A
E
E
I
L
R
L
L
E
L
P
Y
R
L
V
E
V
A
T
G
D
M
G
P
G
K
W
R
Q
V
D
I
E
V
Y
L
P
S
E
G
R
Y
R
E
T
H
S
C
S
A
L
L
D
W
Q
A
R
R
A
N
L
R
Y
R
D
------
P
E
-----
G
---
R
V
R
Y
A
Y
T
L
N
N
T
A
L
A
T
P
R
I
L
A
M
L
L
E
N
H
Q
L
Q
D
G
R
V
R
V
P
Q
A
L
I
P
Y
M
-
G
K
E
V
L
E
P
--------------
7
PsiBlast_PDB
61.13
37%
29
- C1 -
-
1SES
1
SYS_THET2
A:
[1-419]
-----------------------------------------------------------------------------------------------
M
V
D
L
K
R
L
R
Q
----
E
--
P
E
V
F
H
R
A
I
R
E
K
G
V
A
--
L
--
D
L
--
E
A
-
L
L
A
L
D
R
E
V
Q
E
L
K
K
----
R
L
--------
Q
E
V
Q
T
E
R
N
Q
V
A
K
R
V
P
K
A
P
--
P
--------
E
-----------------------------
E
K
-------------------
E
A
----
L
-----------------------------
I
A
R
G
K
-
A
L
G
E
E
A
K
R
L
E
E
A
L
R
E
K
E
A
R
L
E
A
L
L
L
Q
V
P
L
P
P
W
P
G
A
P
V
G
G
E
E
A
---
N
R
E
I
K
R
V
G
G
P
P
E
--------------------
F
--------------------
S
F
P
P
L
D
H
V
A
L
M
E
K
N
G
W
--
W
E
P
R
I
-
S
-
Q
V
S
G
S
R
S
Y
A
L
K
G
D
L
A
L
Y
E
L
A
--
L
L
R
F
A
M
D
F
M
A
R
R
G
F
L
P
M
T
L
P
S
Y
A
R
E
K
A
F
L
G
T
G
H
F
P
A
Y
R
D
Q
V
W
----
A
I
A
E
--
T
--
D
L
Y
L
T
G
T
A
E
V
V
L
N
A
L
H
S
G
E
I
L
P
Y
E
A
L
P
L
R
Y
A
G
Y
A
P
A
F
R
S
E
A
G
S
F
G
K
D
V
R
G
L
M
R
V
H
Q
F
H
K
V
E
Q
Y
V
L
T
E
A
S
L
--
E
--
A
S
D
R
A
F
Q
E
L
L
E
N
A
E
E
I
L
R
L
L
E
L
P
Y
R
L
V
E
V
A
T
G
D
M
G
P
G
K
W
R
Q
V
D
I
E
V
Y
L
P
S
E
G
R
Y
R
E
T
H
S
C
S
A
L
L
D
W
Q
A
R
R
A
N
L
R
Y
R
D
------
P
E
-----
G
---
R
V
R
Y
A
Y
T
L
N
N
T
A
L
A
T
P
R
I
L
A
M
L
L
E
N
H
Q
L
Q
D
G
R
V
R
V
P
Q
A
L
I
P
Y
M
-
G
K
E
V
L
E
P
--------------
5
PsiBlast_PDB
60.58
37%
32
- C1 -
-
1SRY
-
SYS_THET2
A:
[1-419]
-----------------------------------------------------------------------------------------------
M
V
D
L
K
R
L
R
Q
----
E
--
P
E
V
F
H
R
A
I
R
E
K
G
V
A
--
L
--
D
L
--
E
A
-
L
L
A
L
D
R
E
V
Q
E
L
K
K
----
R
L
--------
Q
E
V
Q
T
E
R
N
Q
V
A
K
R
V
P
K
A
P
--
P
--------
E
-----------------------------
E
K
-------------------
E
A
----
L
-----------------------------
I
A
R
G
K
-
A
L
G
E
E
A
K
R
L
E
E
A
L
R
E
K
E
A
R
L
E
A
L
L
L
Q
V
P
L
P
P
W
P
G
A
P
V
G
G
E
E
A
---
N
R
E
I
K
R
V
G
G
P
P
E
--------------------
F
--------------------
S
F
P
P
L
D
H
V
A
L
M
E
K
N
G
W
--
W
E
P
R
I
-
S
-
Q
V
S
G
S
R
S
Y
A
L
K
G
D
L
A
L
Y
E
L
A
--
L
L
R
F
A
M
D
F
M
A
R
R
G
F
L
P
M
T
L
P
S
Y
A
R
E
K
A
F
L
G
T
G
H
F
P
A
Y
R
D
Q
V
W
----
A
I
A
E
--
T
--
D
L
Y
L
T
G
T
A
E
V
V
L
N
A
L
H
S
G
E
I
L
P
Y
E
A
L
P
L
R
Y
A
G
Y
A
P
A
F
R
S
E
A
G
S
F
G
K
D
V
R
G
L
M
R
V
H
Q
F
H
K
V
E
Q
Y
V
L
T
E
A
S
L
--
E
--
A
S
D
R
A
F
Q
E
L
L
E
N
A
E
E
I
L
R
L
L
E
L
P
Y
R
L
V
E
V
A
T
G
D
M
G
P
G
K
W
R
Q
V
D
I
E
V
Y
L
P
S
E
G
R
Y
R
E
T
H
S
C
S
A
L
L
D
W
Q
A
R
R
A
N
L
R
Y
R
D
------
P
E
-----
G
---
R
V
R
Y
A
Y
T
L
N
N
T
A
L
A
T
P
R
I
L
A
M
L
L
E
N
H
Q
L
Q
D
G
R
V
R
V
P
Q
A
L
I
P
Y
M
-
G
K
E
V
L
E
P
--------------
37
Fugue
60.54
34%
41
- C1 -
-
3LSS
1
?
B:
[3-470]
-------------------------------------------------------------------------------------------G
S
M
M
V
L
D
I
Q
L
F
R
D
----
E
T
G
A
N
I
I
R
E
S
Q
R
R
R
F
A
D
--
P
--
D
I
--
V
D
-
A
I
---
I
E
A
D
K
K
W
R
R
T
Q
F
L
T
--------
E
A
S
K
K
L
I
N
I
C
S
K
A
V
G
A
K
K
K
A
K
--------
E
-----------------------------
A
D
-------------------
G
D
----
T
SEIP
P
Q
V
K
E
A
Y
E
N
GTLK
G
E
Q
V
E
Q
LC
V
L
Q
L
K
Q
L
S
K
-
D
L
S
D
Q
V
A
G
L
A
K
E
A
Q
Q
L
E
E
E
R
D
K
L
M
L
N
V
G
N
I
L
H
E
S
V
P
I
A
Q
D
E
E
-
T
G
N
T
V
V
R
T
F
G
N
T
T
K
--------------------
R
----------------------
A
K
L
N
H
V
S
I
M
E
R
L
G
M
M
D
T
S
-
K
A
V
T
-
S
M
A
G
G
R
S
Y
V
L
K
G
G
L
V
Q
L
Q
V
A
--
L
V
S
Y
S
L
D
F
L
V
K
R
G
Y
T
P
F
Y
P
P
F
F
L
N
R
D
V
M
G
E
V
A
Q
L
S
Q
F
D
E
E
L
Y
----
Q
V
S
G
--
D
G
D
K
K
Y
L
I
A
T
S
E
M
P
I
A
A
Y
H
R
G
R
W
F
T
E
L
K
E
P
L
K
Y
A
G
M
S
T
C
F
R
K
E
A
G
A
H
G
R
D
T
L
G
I
F
R
V
H
Q
F
D
K
I
E
--
Q
F
V
V
C
S
P
RQ
E
--
E
S
W
R
H
L
E
D
M
I
T
T
S
E
E
F
N
K
S
L
G
L
P
Y
R
V
V
N
I
C
S
G
A
L
N
N
A
A
A
K
K
Y
D
L
E
A
W
F
P
A
S
G
A
F
R
E
L
V
S
C
S
N
C
T
D
Y
Q
S
Q
S
V
N
C
R
Y
G
P
N
L
R
GTA
A
Q
-----
N
---
V
K
E
Y
C
H
M
L
N
G
T
L
C
A
I
T
R
T
M
C
C
I
C
E
N
Y
Q
T
E
E
G
-
V
V
I
P
D
V
L
R
P
Y
M
M
G
I
E
M
I
R
F
E-------------
4
PsiBlast_PDB
60.37
40%
60
- C1 -
-
2ZR3
-
SYS_PYRHO
A:
[1-444]
-----------------------------------------------------------------------------------------------
M
L
D
I
K
L
I
R
E
----
N
--
P
E
L
V
K
N
D
L
I
K
R
G
E
L
--
E
--
K
V
K
W
V
D
-
E
I
---
L
K
L
D
T
E
W
R
T
K
L
K
E
I
--------
N
R
L
R
H
E
R
N
K
I
A
V
E
I
G
K
R
R
K
K
G
--------
E
-----------------------------
P
V
-------------------
D
E
----
L
-----------------------------
L
A
K
S
R
-
E
I
V
K
R
I
G
E
L
E
N
E
V
E
E
L
K
K
K
I
D
Y
Y
L
W
R
L
P
N
I
T
H
P
S
V
P
V
G
K
D
E
N
-
D
-
N
V
P
I
R
F
W
G
K
A
R
V
--------------------
W
KGH
L
E
R
F
L
E
Q
S
QGK
M
E
Y
E
I
L
E
W
K
P
K
L
H
V
D
L
L
E
I
L
G
G
A
D
F
A
-
R
A
-
A
-
K
V
S
G
S
R
F
Y
Y
L
L
N
E
I
V
I
L
D
L
A
--
L
I
R
F
A
L
D
R
L
I
E
K
G
F
T
P
V
I
P
P
Y
M
V
R
R
F
V
E
E
G
S
T
S
F
E
D
F
E
D
V
I
Y
----
K
V
E
D
--
E
--
D
L
Y
L
I
P
T
A
E
H
P
L
A
G
M
H
A
N
E
I
L
D
G
K
D
L
P
L
L
Y
V
G
V
S
P
C
F
R
K
E
A
G
T
A
G
K
D
T
K
G
I
F
R
V
H
Q
F
H
K
V
E
--
Q
F
V
Y
S
R
P
--
E
--
E
S
W
E
W
H
E
K
I
I
R
N
A
E
E
L
F
Q
E
L
E
I
P
Y
R
V
V
N
I
C
T
G
D
L
G
Y
V
A
A
K
K
Y
D
I
E
A
W
M
P
G
Q
G
K
F
R
E
V
V
S
A
S
N
C
T
D
W
Q
A
R
R
L
N
I
R
F
R
D
R
-----
T
D
-----
E
---
K
P
R
Y
V
H
T
L
N
S
T
A
I
A
T
S
R
A
I
V
A
I
L
E
N
H
Q
E
E
D
G
T
V
R
I
P
K
V
L
W
K
Y
T
G
F
K
E
I
V
----------------
53
HHSearch
58.80
35%
29
- C1 -
-
3VBB
-
SYSC_HUMAN
B:
[2-462]
-----------------------------------------------------------------------------------------------
V
L
D
L
D
L
F
R
V
DKGG
D
--
P
A
L
I
R
E
T
Q
E
K
R
F
K
D
--
P
---
G
L
-
V
D
-
Q
L
---
V
K
A
D
S
E
W
R
R
C
R
F
R
A
--------
D
N
L
N
K
L
K
N
L
C
S
K
T
I
G
E
K
M
K
K
-----------------------------------------DESVPENVLSFDDLT
A
D
A
L
A
N
LK
V
S
Q
-----------------------------
I
K
K
V
R
L
L
I
D
E
A
I
L
K
C
D
A
E
R
I
K
L
E
A
E
R
F
E
N
L
R
E
I
G
N
L
L
H
P
S
V
P
I
S
N
D
E
D
V
D
-
N
K
V
E
R
I
W
G
D
C
T
V
------------------------------------------
R
K
K
Y
S
H
V
D
L
V
V
M
V
D
G
F
E
G
E
-
K
G
-
A
-
V
V
A
G
S
R
G
Y
F
L
K
G
V
L
V
F
L
E
Q
A
--
L
I
Q
Y
A
L
R
T
L
G
S
R
G
Y
I
P
I
Y
T
P
F
F
M
R
K
E
V
M
Q
E
V
A
Q
L
S
Q
F
D
E
E
L
Y
----
K
V
I
---
D
--
E
K
Y
L
I
A
T
S
E
Q
P
I
A
A
L
H
R
D
E
W
L
R
P
E
D
L
P
I
K
Y
A
G
L
S
T
C
F
R
Q
E
V
G
S
H
G
--
T
R
G
I
F
R
V
H
Q
F
E
K
I
E
--
Q
F
V
Y
S
S
P
--
H
DN
K
S
W
E
M
F
E
E
M
I
T
T
A
E
E
F
Y
Q
S
L
G
I
P
Y
H
I
V
N
I
V
S
G
S
L
N
H
A
A
S
K
K
L
D
L
E
A
W
F
P
G
S
G
A
F
R
E
L
V
S
C
S
N
C
T
D
Y
Q
A
R
R
L
R
I
R
Y
G
Q
T
------
K
-----
K
MMD
K
V
E
F
V
H
M
L
N
A
T
M
C
A
T
T
R
T
I
C
A
I
L
E
N
Y
Q
T
E
K
G
-
I
T
V
P
E
K
L
K
E
F
M
P
P
--------------------
52
HHSearch
58.20
34%
45
- C1 -
-
3LSS
1
?
B:
[7-468]
-----------------------------------------------------------------------------------------------
V
L
D
I
Q
L
F
R
D
E
T
--
G
--
A
N
I
I
R
E
S
Q
R
R
R
F
A
D
--
P
--
D
I
--
V
D
-
A
I
---
I
E
A
D
K
K
W
R
R
T
Q
F
L
T
--------
E
A
S
K
K
L
I
N
I
C
S
K
A
V
G
A
K
K
K
A
K
--------
E
ADGDTSEIP
P
Q
V
K
E
A
Y
E
N
GTLK
G
E
Q
V
E
Q
L
C
V
-------------------
L
Q
----
L
-----------------------------
K
Q
L
S
K
-
D
L
S
D
Q
V
A
G
L
A
K
E
A
Q
Q
L
E
E
E
R
D
K
L
M
L
N
V
G
N
I
L
H
E
S
V
P
I
A
Q
D
E
E
T
G
-
N
T
V
V
R
T
F
G
N
T
T
K
------------------------------------------
R
A
K
L
N
H
V
S
I
M
E
R
L
G
M
M
D
T
S
-
K
A
-
V
T
S
M
A
G
G
R
S
Y
V
L
K
G
G
L
V
Q
L
Q
V
A
--
L
V
S
Y
S
L
D
F
L
V
K
R
G
Y
T
P
F
Y
P
P
F
F
L
N
R
D
V
M
G
E
V
A
Q
L
S
Q
F
D
E
E
L
Y
----
Q
V
S
G
DG
D
--
K
K
Y
L
I
A
T
S
E
M
P
I
A
A
Y
H
R
G
R
W
F
T
E
L
K
E
P
L
K
Y
A
G
M
S
T
C
F
R
K
E
A
G
A
H
G
R
D
T
L
G
I
F
R
V
H
Q
F
D
K
I
E
--
Q
F
V
V
C
S
P
--
R
QE
E
S
W
R
H
L
E
D
M
I
T
T
S
E
E
F
N
K
S
L
G
L
P
Y
R
V
V
N
I
C
S
G
A
L
N
N
A
A
A
K
K
Y
D
L
E
A
W
F
P
A
S
G
A
F
R
E
L
V
S
C
S
N
C
T
D
Y
Q
S
Q
S
V
N
C
R
Y
G
P
N
-----
L
R
GTAAQ
N
---
V
K
E
Y
C
H
M
L
N
G
T
L
C
A
I
T
R
T
M
C
C
I
C
E
N
Y
Q
T
E
E
G
-
V
V
I
P
D
V
L
R
P
Y
M
M
G
-
I
E
M
I
R
--------------
35
Fugue
58.20
30%
28
- C1 -
-
1WLE
1
SYSM_BOVIN
A:
[24-490]
-------------------------------------------------------------------------------RN
L
L
Y
E
H
A
R
E
GYSALP
L
L
D
M
E
S
L
C
A
----
Y
--
P
E
D
A
A
R
A
L
D
L
R
K
G
E
LR
S
--
K
D
--
L
P
-
G
I
---
I
S
T
W
Q
E
L
R
Q
L
R
E
Q
I
--------
R
S
L
E
E
E
K
E
A
V
T
E
A
V
R
A
L
V
V
N
Q
DNSQVQQD
P
-----------------------------
Q
Y
-------------------
Q
S
----
L
-----------------------------
R
A
R
G
R
-
E
I
R
K
Q
L
T
L
L
Y
P
K
E
A
Q
L
E
E
Q
F
Y
L
R
A
L
R
L
P
N
Q
T
H
P
D
V
P
V
G
-
D
E
S
-
Q
-
A
R
V
L
H
V
V
G
D
K
P
A
--------------------
F
--------------------
S
F
Q
P
R
G
H
L
E
I
A
E
K
L
D
I
I
R
Q
K
-
R
L
-
S
-
H
V
S
G
H
R
S
Y
Y
L
R
G
A
G
A
L
L
Q
H
G
--
L
V
N
F
T
L
N
K
L
I
H
R
G
F
T
P
M
T
V
P
D
L
L
R
G
V
V
F
E
G
C
G
M
T
P
N
A
K
P
S
Q
I
Y
N
I
D
P
S
R
F
--
E
--
D
L
N
L
A
G
T
A
E
V
G
L
A
G
Y
F
M
D
H
S
V
A
F
R
D
L
P
I
R
M
V
C
S
S
T
C
Y
R
A
E
T
D
T
---
G
P
W
G
L
Y
R
V
H
H
F
T
K
V
E
--
M
F
G
V
T
G
P
G
L
E
--
Q
S
S
E
L
L
E
E
F
L
S
L
Q
M
E
I
L
T
E
L
G
L
H
F
R
V
L
D
M
P
T
Q
E
L
G
L
P
A
Y
R
K
F
D
I
E
A
W
M
P
G
R
G
R
F
G
E
V
T
S
A
S
N
C
T
D
F
Q
S
R
R
L
H
I
M
F
Q
T
E
------
A
-----
G
---
E
L
Q
F
A
H
T
V
N
A
T
G
C
A
V
P
R
L
L
I
A
L
L
E
S
Y
Q
Q
K
D
G
S
V
L
V
P
P
A
L
Q
P
Y
L
G
T
D
R
I
T
T
P
THVPLQYIGPNQPQ
9
PsiBlast_PDB
54.00
39%
11
- C1 -
-
3ERR
1
DYHC1_MOUSE (first)
A:
[174-528]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
Y
-------------------
A
D
----
M
-----------------------------
L
K
R
V
E
-
P
L
R
N
E
L
Q
K
L
E
D
D
A
K
D
N
Q
Q
K
L
E
A
L
L
L
Q
V
P
L
P
P
W
P
G
A
P
V
G
G
E
E
A
---
N
R
E
I
K
R
V
G
G
P
P
E
--------------------
F
--------------------
S
F
P
P
L
D
H
V
A
L
M
E
K
N
G
W
--
W
E
P
R
I
-
S
-
Q
V
S
G
S
R
S
Y
A
L
K
G
D
L
A
L
Y
E
L
A
--
L
L
R
F
A
M
D
F
M
A
R
R
G
F
L
P
M
T
L
P
S
Y
A
R
E
K
A
F
L
G
T
G
H
F
P
A
Y
R
D
Q
V
W
----
A
I
A
E
--
T
--
D
L
Y
L
T
G
T
A
E
V
V
L
N
A
L
H
S
G
E
I
L
P
Y
E
A
L
P
L
R
Y
A
G
Y
A
P
A
F
R
S
E
A
G
S
F
G
K
D
V
R
G
L
M
R
V
H
Q
F
H
K
V
E
Q
Y
V
L
T
E
A
S
L
--
E
--
A
S
D
R
A
F
Q
E
L
L
E
N
A
E
E
I
L
R
L
L
E
L
P
Y
R
L
V
E
V
A
T
G
D
M
G
P
G
K
W
R
Q
V
D
I
E
V
Y
L
P
S
E
G
R
Y
R
E
T
H
S
C
S
A
L
L
D
W
Q
A
R
R
A
N
L
R
Y
R
D
------
P
E
-----
G
---
R
V
R
Y
A
Y
T
L
N
N
T
A
L
A
T
P
R
I
L
A
M
L
L
E
N
H
Q
L
Q
D
G
R
V
R
V
P
Q
A
L
I
P
Y
M
-
G
K
E
V
L
E
P
--------------
25
PsiBlast_CBE
53.88
39%
10
- C1 -
-
3ERR
1
SYS_THET2
B:
[174-528]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
Y
-------------------
A
D
----
M
-----------------------------
L
K
R
V
E
-
P
L
R
N
E
L
Q
K
L
E
D
D
A
K
D
N
Q
Q
K
L
E
A
L
L
L
Q
V
P
L
P
P
W
P
G
A
P
V
G
G
E
E
A
---
N
R
E
I
K
R
V
G
G
P
P
E
--------------------
F
--------------------
S
F
P
P
L
D
H
V
A
L
M
E
K
N
G
W
--
W
E
P
R
I
-
S
-
Q
V
S
G
S
R
S
Y
A
L
K
G
D
L
A
L
Y
E
L
A
--
L
L
R
F
A
M
D
F
M
A
R
R
G
F
L
P
M
T
L
P
S
Y
A
R
E
K
A
F
L
G
T
G
H
F
P
A
Y
R
D
Q
V
W
----
A
I
A
E
--
T
--
D
L
Y
L
T
G
T
A
E
V
V
L
N
A
L
H
S
G
E
I
L
P
Y
E
A
L
P
L
R
Y
A
G
Y
A
P
A
F
R
S
E
A
G
S
F
G
K
D
V
R
G
L
M
R
V
H
Q
F
H
K
V
E
QY
V
L
T
E
A
S
L
--
E
--
A
S
D
R
A
F
Q
E
L
L
E
N
A
E
E
I
L
R
L
L
E
L
P
Y
R
L
V
E
V
A
T
G
D
M
G
P
G
K
W
R
Q
V
D
I
E
V
Y
L
P
S
E
G
R
Y
R
E
T
H
S
C
S
A
L
L
D
W
Q
A
R
R
A
N
L
R
Y
R
D
------
P
E
-----
G
---
R
V
R
Y
A
Y
T
L
N
N
T
A
L
A
T
P
R
I
L
A
M
L
L
E
N
H
Q
L
Q
D
G
R
V
R
V
P
Q
A
L
I
P
Y
M
-
G
K
E
V
L
E
P
--------------
36
Fugue
51.24
35%
44
- C1 -
-
3ERR
1
DYHC1_MOUSE (first)
A:
[3-529]
D
L
K
R
L
R
Q
E
P
E
V
F
H
R
A
I
R
E
K
GVALD
L
E
A
L
L
A
V
D
E
Q
L
H
K
Q
Q
E
V
I
A
D
K
Q
M
S
V
K
E
D
L
D
K
V
E
P
A
V
I
E
A
Q
N
A
V
K
S
IK
K
Q
H
L
V
E
V
R
S
MANPP
A
A
V
K
L
A
L
E
S
I
A
L
L
L
G
E
S
T
T
----
D
--
W
K
Q
I
R
S
I
I
M
R
E
N
F
I
--
P
--
T
I
--
V
N
F
S
A
---
E
E
I
S
D
A
I
R
E
K
M
K
K
N
YMSNPSYN
Y
E
I
V
N
R
A
S
L
A
A
G
P
M
V
K
W
A
I
A
Q
--------
L
-----------------------------
N
Y
-------------------
A
D
----
M
-----------------------------
L
K
R
V
E
-
P
L
R
N
E
L
Q
K
L
E
D
D
A
K
D
N
Q
Q
K
L
E
A
L
L
L
Q
V
P
L
P
P
W
P
G
A
P
V
G
G
E
E
A
---
N
R
E
I
K
R
V
G
G
P
P
E
--------------------
F
--------------------
S
F
P
P
L
D
H
V
A
L
M
E
K
N
G
-
W
W
E
P
-
R
I
-
S
-
Q
V
S
G
S
R
S
Y
A
L
K
G
D
L
A
L
Y
E
L
A
--
L
L
R
F
A
M
D
F
M
A
R
R
G
F
L
P
M
T
L
P
S
Y
A
R
E
K
A
F
L
G
T
G
H
F
P
A
Y
R
D
Q
V
W
----
A
I
A
E
--
T
--
D
L
Y
L
T
G
T
A
E
V
V
L
N
A
L
H
S
G
E
I
L
P
Y
E
A
L
P
L
R
Y
A
G
Y
A
P
A
F
R
S
E
A
G
S
F
G
K
D
V
R
G
L
M
R
V
H
Q
F
H
K
V
E
--
Q
Y
V
L
T
E
A
S
L
E
--
A
S
D
R
A
F
Q
E
L
L
E
N
A
E
E
I
L
R
L
L
E
L
P
Y
R
L
V
E
V
A
T
G
D
M
G
P
G
K
W
R
Q
V
D
I
E
V
Y
L
P
S
E
G
R
Y
R
E
T
H
S
C
S
A
L
L
D
W
Q
A
R
R
A
N
L
R
Y
R
D
P
------
E
-----
G
---
R
V
R
Y
A
Y
T
L
N
N
T
A
L
A
T
P
R
I
L
A
M
L
L
E
N
H
Q
L
Q
D
G
R
V
R
V
P
Q
A
L
I
P
Y
M
G
K
-
E
V
L
E
P
G-------------
58
HHSearch
48.34
37%
15
* C1 *
-
3ERR
1
SYS_THET2
B:
[179-523]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
K
R
V
E
-
P
L
R
N
E
L
Q
K
L
E
D
D
A
K
D
N
Q
Q
K
L
E
A
L
L
L
Q
V
P
L
P
P
W
P
G
A
P
V
G
G
E
E
--
A
-
N
R
E
I
K
R
V
G
G
P
P
E
--------------------
F
--------------------
S
F
P
P
L
D
H
V
A
L
M
E
K
N
G
W
W
E
P
R
-
I
S
-----
Q
V
S
G
S
R
S
Y
A
L
K
G
D
L
A
L
Y
E
LA
L
L
R
F
A
M
D
F
M
A
R
R
G
F
L
P
M
T
L
P
S
Y
A
R
E
K
A
F
L
G
T
G
H
F
P
A
Y
R
D
Q
V
W
----
A
I
A
E
--
T
--
D
L
Y
L
T
G
T
A
E
V
V
L
N
A
L
H
S
G
E
I
L
P
Y
E
A
L
P
L
R
Y
A
G
Y
A
P
A
F
R
S
E
A
G
S
F
G
K
D
V
R
G
L
M
R
V
H
Q
F
H
K
V
E
--
Q
Y
V
L
T
E
A
--
S
LE
A
S
D
R
A
F
Q
E
L
L
E
N
A
E
E
I
L
R
L
L
E
L
P
Y
R
L
V
E
V
A
T
G
D
M
G
P
G
K
W
R
Q
V
D
I
E
V
Y
L
P
S
E
G
R
Y
R
E
T
H
S
C
S
A
L
L
D
W
Q
A
R
R
A
N
L
R
Y
R
D
P
------
E
-----
G
---
R
V
R
Y
A
Y
T
L
N
N
T
A
L
A
T
P
R
I
L
A
M
L
L
E
N
H
Q
L
Q
D
G
R
V
R
V
P
Q
A
L
I
P
Y
M
G
K
--------------------