@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 : jhp_0037: (2015-12-12 )
MKIKNVLLSGGSGKRLWPLSRSLYPKQFLKLFDHKSLFELSFKRNASLVDETLIVCNEKHYFLALEEIKNEIKNKSVGFLLESLSKNTANAIALSALMSDKEDLLIVTPSDHLIKDFQAYENAIKKAINLAQKGFLVTFGISIEKPNTEFGYIESPNGLDVKRFIEKPSLEKAIEFQKSGGFYFNSGMFVFQAGVFLDELKKHAPTILKGCERAFESLENTHFFEQKIARLSEKSMQDLEDMSIDIALMQQSHKIKMVELNAKWSDLGNFNALFEEAANGTKENVSLNQTPIFAKESTNNLVFSHKVSALLGVEDLAIIDTKDALLVAHKDKAKDLKALVSEIETHNQELLQTHTKVYRPWGSYEVLHESGCYKVKILEVKPNARLSLQKHFHRSEHWVVISGMASVELDHQSFELQANESTYIPKNTLHRLANYGKIPLIIIEVQVGEYVGEDDIVRVDDDFNRQNQNA
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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MK
I
K
N
V
L
LSGGSG
K
R
L
W
PLSRSL
Y
P
K
Q
F
L
K
L
-F-DHK
S
-
L
F
E
L
SFKR--NAS-L--V--D-
E
T
--
L
I
V
CNE
K
H
Y
----
F
L
A
L
E
E
I
K
N
E
--I---------------KN------
K
--
S
V
G
F
----
L
---
L
--
E
S
-
L
SKNT
A
N
A
I
A
L
S
A
L
MS-D-K--E--
D
L
L
I
VTP
S
D
H
L
I
K
D
F
Q
A
Y
E
N
A
I
K
K
A
I
N
L
A
-QK-
G
F
-
L
V
T
F
G
I
S
IE--KPNTEFGYIE-SP----NG-----L-----
D
----
V
K
R
---
F
I
EKP
S
L
E
K
A
I
E
------
F
Q-------KSG
G
F
Y
FNS
G
M
F
V
F
Q
A
G
V
F
L
D
E
L
K
K
HA
P
T
I
L
K
G
C
E
R
--
A
F
E
S
L
EN
T
H
F
F
E
Q
K
I
A
R
L
S
E
K
S
M
Q
D
L
E
D
M
S
I
D
I
A
L
MQQSH
K
I
K
M
V
E
L--NAKWSDLG
N
F
N
A
L
--
F
E
E
AANGTKENVSLNQT
P
I
F
AKESTN
N
L
V
F
S
-
H
K
-
V
S
A
L
LGV
E
D
L
A
I
IDTK
D
A
L
L
V
AHK
D
K
A
K
D
L
K
A
L
V
S
E
I
E
T
H
N
Q
E
L
L
Q
T
H
T
K
V
YRPWGS
Y
E
V
L
HESG
C
Y
K
V
K
I
L
E
VKPNAR
L
S
L
Q
K
H
FHRSE
H
W
V
V
I
SG
M
A
S
V
E
L
DH
Q
S
F
E
L
QANESTYI
P
K
N
T
L
H
R
L
ANYGKI
P
L
I
I
I
E
V
QVGEYVGED
D
I
V
RVDDDFNRQNQNA
1
PsiBlast_PDB
94.96
95%
-110
- C2 -
2QH5
-
?
A:
[1-266]
L
K
I
K
N
I
L
L
S
G
-------------
Y
P
K
Q
F
L
K
L
-
F
-
D
H
K
S
-
L
F
E
L
S
F
K
R
--
N
A
S
-
L
--
V
--
D
-
E
T
--
L
I
V
C
N
E
K
H
Y
----
F
L
A
L
E
E
I
K
N
E
--
I
---------------
K
N
------
K
--
S
V
G
F
----
L
---
L
--
E
S
-
L
S
K
N
T
A
N
A
I
A
L
S
A
L
M
S
-
D
-
K
--
E
--
D
L
L
I
V
T
P
S
D
H
L
I
K
D
L
Q
A
Y
E
N
A
I
K
K
A
I
D
L
A
-
Q
K
-
G
F
-
L
V
T
F
G
V
S
I
D
--
K
P
N
T
E
F
G
Y
I
E
-
S
P
----
N
G
-----
L
-----
D
----
V
K
R
---
F
I
E
K
P
S
L
D
K
A
I
E
------
F
Q
-------
K
S
G
G
F
Y
F
N
S
G
M
F
V
F
Q
A
G
V
F
L
D
E
L
K
K
H
A
P
T
I
L
K
G
C
E
R
--
A
F
E
S
L
E
N
A
Y
F
F
E
K
K
I
A
R
L
S
E
K
S
M
Q
D
L
E
D
M
S
I
D
I
A
L
M
Q
Q
S
H
K
I
K
M
V
E
L
--
N
A
K
W
S
D
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
70
Fugue
93.45
93%
-109
- C2 -
2QH5
-
?
A:
[1-266]
-------------
L
K
I
K
N
I
L
L
S
G
Y
P
K
Q
F
L
K
L
-
F
-
D
H
K
S
-
L
F
E
L
S
F
K
R
--
N
A
S
-
L
--
V
--
D
-
E
T
--
L
I
V
C
N
E
K
H
Y
----
F
L
A
L
E
E
I
K
N
E
--
I
---------------
K
N
------
K
--
S
V
G
F
----
L
---
L
--
E
S
-
L
S
K
N
T
A
N
A
I
A
L
S
A
L
M
S
-
D
-
K
--
E
--
D
L
L
I
V
T
P
S
D
H
L
I
K
D
L
Q
A
Y
E
N
A
I
K
K
A
I
D
L
A
-
Q
K
-
G
F
-
L
V
T
F
G
V
S
I
D
--
K
P
N
T
E
F
G
Y
I
E
-
S
P
----
N
G
-----
L
-----
D
----
V
K
R
---
F
I
E
K
P
S
L
D
K
A
I
E
------
F
Q
-------
K
S
G
G
F
Y
F
N
S
G
M
F
V
F
Q
A
G
V
F
L
D
E
L
K
K
H
A
P
T
I
L
K
G
C
E
R
--
A
F
E
S
L
E
N
A
Y
F
F
E
K
K
I
A
R
L
S
E
K
S
M
Q
D
L
E
D
M
S
I
D
I
A
L
M
Q
Q
S
H
K
I
K
M
V
E
L
--
N
A
K
W
S
D
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
50
HHSearch
90.97
93%
-105
- C2 -
2QH5
-
?
A:
[1-266]
L
K
I
K
N
I
L
L
S
G
-------------
Y
P
K
Q
F
L
K
L
-
F
-
D
H
K
S
-
L
F
E
L
S
F
K
R
--
N
A
--
S
L-
V
--
D
-
E
T
--
L
I
V
C
N
E
K
H
Y
F
L
A
L
E
E
I
K
N
E
I
K
N
K
-----------------------------
S
V
G
F
----
L
---
L
--
E
S
-
L
S
K
N
T
A
N
A
I
A
L
S
A
L
M
S
-
D
-
K
--
E
--
D
L
L
I
V
T
P
S
D
H
L
I
K
D
L
Q
A
Y
E
N
A
I
K
K
A
I
D
L
A
-
Q
K
-
G
F
-
L
V
T
F
G
V
S
I
D
--
K
P
N
T
E
F
G
Y
I
E
-
S
P
----
N
G
-----
L
-----
D
----
V
K
R
---
F
I
E
K
P
S
L
D
K
A
I
E
------
F
Q
-------
K
S
G
G
F
Y
F
N
S
G
M
F
V
F
Q
A
G
V
F
L
D
E
L
K
K
H
A
P
T
I
L
K
G
C
E
R
--
A
F
E
S
L
E
N
A
Y
F
F
E
K
K
I
A
R
L
S
E
K
S
M
Q
D
L
E
D
M
S
I
D
I
A
L
M
Q
Q
S
H
K
I
K
M
V
E
L
--
N
A
K
W
S
D
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
49
HHSearch
80.02
31%
-81
- C2 -
2CU2
2
?
A:
[1-335]
M
K
T
Y
A
L
V
M
A
G
G
R
G
E
R
L
W
P
L
S
R
E
D
R
P
K
P
F
L
P
L
F
E
-
G
-
K
T
-
L
L
E
A
T
L
E
R
--
L
A
P
-
L
VP
P
--
E
-
R
T
--
L
L
A
V
R
R
D
Q
-----
E
A
V
A
R
P
Y
A
----------------------------
D
--
G
I
R
L
----
L
---
L
--
E
P
-
L
G
R
D
T
A
G
A
V
L
L
G
V
A
E
A
L
K
E
G
--
A
--
E
R
L
L
V
L
P
A
D
H
Y
V
G
D
D
E
A
Y
R
E
A
L
A
T
M
L
E
A
A
-
E
E
-
G
F
-
V
V
A
L
G
L
R
P
T
--
R
P
E
T
E
Y
G
Y
I
R
-
L
G
----
P
R
EGAW-
Y
-----
R
----
G
E
G
---
F
V
E
K
P
S
Y
A
E
A
L
E
------
Y
I
-------
R
K
-
G
Y
V
W
N
G
G
V
F
A
F
A
P
A
T
M
A
E
L
F
R
R
H
L
P
S
H
H
E
A
L
E
R
--
L
L
A
G
------------
A
S
L
E
E
V
Y
A
G
L
P
K
I
S
I
D
Y
G
V
M
E
K
A
E
R
V
R
V
V
L
G
--
R
F
P
W
D
D
V
G
N
W
R
A
L
--
E
R
V
F
S
Q
D
P
H
E
N
V
V
L
G
E
G
R
H
V
A
L
D
T
F
G
C
V
V
Y
A
D
R
G
-
V
V
A
T
L
G
V
S
G
L
V
V
A
K
V
G
D
E
V
L
V
V
P
K
D
W
A
R
E
V
R
E
V
V
K
R
L
E
A
-----------------------------------------------------------------------------------------------------------------------------
71
Fugue
78.84
31%
-76
- C2 -
2CU2
2
?
A:
[1-335]
M
K
T
Y
A
L
V
M
A
G
G
R
G
E
R
L
W
P
L
S
R
E
D
R
P
K
P
F
L
P
L
-
F
-
E
G
K
T
-
L
L
E
A
T
L
E
R
L
A
P
L
V
-
P
--
P
--
E
-
R
T
--
L
L
A
V
R
R
D
Q
E
----
A
V
A
R
P
Y
A
D
G
I
-------------------------------
R
L
----
L
---
L
--
E
P
-
L
G
R
D
T
A
G
A
V
L
L
G
V
A
E
A
-
L
-
K
--
E
GA
E
R
L
L
V
L
P
A
D
H
Y
V
G
D
D
E
A
Y
R
E
A
L
A
T
M
L
E
A
A
-
E
E
-
G
F
-
V
V
A
L
G
L
R
P
T
--
R
P
E
T
E
Y
G
Y
I
R
-
L
G
----
P
R
-----
E
-----
G
AWYR
G
E
G
---
F
V
E
K
P
S
Y
A
E
A
L
E
------
Y
I
-------
R
K
G
-
Y
V
W
N
G
G
V
F
A
F
A
P
A
T
M
A
E
L
F
R
R
H
L
P
S
H
H
E
A
L
E
R
--
L
L
A
G
------------
A
S
L
E
E
V
Y
A
G
L
P
K
I
S
I
D
Y
G
V
M
E
K
A
E
R
V
R
V
V
L
G
--
R
F
P
W
D
D
V
G
N
W
R
A
L
--
E
R
V
F
S
Q
D
P
H
E
N
V
V
L
G
E
G
R
H
V
A
L
D
T
F
G
C
V
V
Y
A
D
R
G
-
V
V
A
T
L
G
V
S
G
L
V
V
A
K
V
G
D
E
V
L
V
V
P
K
D
W
A
R
E
V
R
E
V
V
K
R
L
E
A
-----------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
78.12
31%
-70
- C2 -
2CU2
2
?
A:
[1-335]
M
K
T
Y
A
L
V
M
A
G
G
R
G
E
R
L
W
P
L
S
R
E
D
R
P
K
P
F
L
P
L
-
F
-
E
G
K
T
-
L
L
E
A
T
L
E
R
--
L
A
P
-
L
--
V
PP
E
-
R
T
--
L
L
A
V
R
R
D
----------
Q
E
A
V
A
R
--
P
---------------
Y
A
------
D
--
G
I
R
L
----
L
---
L
--
E
P
-
L
G
R
D
T
A
G
A
V
L
L
G
V
A
E
A
-
L
-
K
--
E
GA
E
R
L
L
V
L
P
A
D
H
Y
V
G
D
D
E
A
Y
R
E
A
L
A
T
M
L
E
A
A
-
E
E
-
G
F
-
V
V
A
L
G
L
R
P
T
--
R
P
E
T
E
Y
G
Y
I
R
L
G
P
----
R
E
-----
G
-----
A
----
W
Y
R
GE
G
F
V
E
K
P
S
Y
A
E
A
L
E
------
Y
I
-------
R
K
-
G
Y
V
W
N
G
G
V
F
A
F
A
P
A
T
M
A
E
L
F
R
R
H
L
P
S
H
H
E
A
L
E
R
L
L
A
G
A
S
L
E
E
V
Y
--------------
A
G
L
P
K
I
S
I
D
Y
G
V
M
E
K
A
E
R
V
R
V
V
L
G
--
R
F
P
W
D
D
V
G
N
W
R
A
L
--
E
R
V
F
S
Q
D
P
H
E
N
V
V
L
G
E
G
R
H
V
A
L
D
T
F
G
C
V
V
Y
A
-
D
R
G
V
V
A
T
L
G
V
S
G
L
V
V
A
K
V
G
D
E
V
L
V
V
P
K
D
W
A
R
E
V
R
E
V
V
K
R
L
E
A
-----------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
76.75
33%
-84
- C2 -
2X65
6
?
A:
[2-332]
--
M
K
A
L
I
L
A
G
G
S
G
E
R
F
W
P
L
S
T
P
E
T
P
K
Q
F
L
K
L
-
F
-
G
N
K
S
-
L
M
R
W
T
F
E
R
--
V
L
E
-
E
--
M
--
D
P
K
D
--
V
I
V
V
T
H
K
D
Y
-------
V
E
R
T
K
K
E
--
L
---------------
P
E
L-----
P
--
D
E
N
I
----
I
---
A
--
E
P
-
M
K
K
N
T
A
P
A
C
F
I
G
T
K
L
A
-
D
-
D
--
D
--
E
P
V
L
V
L
P
A
D
H
R
I
P
D
T
K
K
F
W
K
T
V
K
K
A
L
D
A
L
-
E
K
Y
D
G
-
L
F
T
F
G
I
V
P
T
--
R
P
E
T
G
Y
G
Y
I
E
-
I
G
----
E
E
-----
L
EEG
V
H
K
----
V
A
Q
---
F
R
E
K
P
D
L
E
T
A
K
K
------
F
V
-------
E
S
G
R
F
L
W
N
S
G
M
F
L
W
K
A
R
E
F
I
E
E
V
K
V
C
E
P
S
I
Y
E
N
------
L
K
D
V
D
P
R
N
F
E
E
L
K
------
K
A
Y
E
K
V
P
S
I
S
V
D
Y
A
V
M
E
K
S
K
K
V
R
V
V
K
A
--
D
F
E
W
S
D
L
G
N
W
S
S
V
R
E
I
E
G
Y
T
E
E
S
D
E
V
I
L
V
D
S
D
R
V
F
V
K
--
T
H
N
------
K
-
P
I
A
V
V
G
L
S
D
V
I
V
I
D
T
P
N
G
I
L
I
C
K
E
E
Y
A
Q
K
V
R
E
V
V
K
K
L
F
R
-----------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
76.09
33%
-79
- C2 -
2X5S
-
?
A:
[2-332]
--
M
K
A
L
I
L
A
G
G
S
G
E
R
F
W
P
L
S
T
P
E
T
P
K
Q
F
L
K
L
-
F
-
G
N
K
S
-
L
M
R
W
T
F
E
R
--
V
L
E
-
E
--
M
--
D
P
K
D
--
V
I
V
V
T
H
K
D
Y
-------
V
E
R
T
K
K
E
--
L
---------------
P
E
L-----
P
--
D
E
N
I
----
I
---
A
--
E
P
-
M
K
K
N
T
A
P
A
C
F
I
G
T
K
L
A
-
D
-
D
--
D
--
E
P
V
L
V
L
P
A
D
H
R
I
P
D
T
K
K
F
W
K
T
V
K
K
A
L
D
A
L
-
E
K
Y
D
G
-
L
F
T
F
G
I
V
P
T
--
R
P
E
T
G
Y
G
Y
I
E
-
I
G
----
E
E
-----
L
EEG
V
H
K
----
V
A
Q
---
F
R
E
K
P
D
L
E
T
A
K
K
------
F
V
-------
E
S
G
R
F
L
W
N
S
G
M
F
L
W
K
A
R
E
F
I
E
E
V
K
V
C
E
P
S
I
Y
E
N
------
L
K
D
V
D
P
R
N
F
E
E
L
K
------
K
A
Y
E
K
V
P
S
I
S
V
D
Y
A
V
M
E
K
S
K
K
V
R
V
V
K
A
--
D
F
E
W
S
D
L
G
N
W
S
S
V
R
E
I
E
G
Y
T
E
E
S
D
E
V
I
L
V
D
S
D
R
V
F
V
K
--
T
H
N
------
K
-
P
I
A
V
V
G
L
S
D
V
I
V
I
D
T
P
N
G
I
L
I
C
K
E
E
Y
A
Q
K
V
R
E
V
V
K
K
L
F
------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
75.94
33%
-82
- C2 -
2X5Z
1
?
B:
[2-332]
--
M
K
A
L
I
L
A
G
G
S
G
E
R
F
W
P
L
S
T
P
E
T
P
K
Q
F
L
K
L
-
F
-
G
N
K
S
-
L
M
R
W
T
F
E
R
--
V
L
E
-
E
--
M
--
D
P
K
D
--
V
I
V
V
T
H
K
D
Y
-------
V
E
R
T
K
K
E
--
L
---------------
P
E
L-----
P
--
D
E
N
I
----
I
---
A
--
E
P
-
M
K
K
N
T
A
P
A
C
F
I
G
T
K
L
A
-
D
-
D
--
D
--
E
P
V
L
V
L
P
A
D
H
R
I
P
D
T
K
K
F
W
K
T
V
K
K
A
L
D
A
L
-
E
K
Y
D
G
-
L
F
T
F
G
I
V
P
T
--
R
P
E
T
G
Y
G
Y
I
E
-
I
G
----
E
E
-----
L
EEGVH
K
----
V
A
Q
---
F
R
E
K
P
D
L
E
T
A
K
K
------
F
V
-------
E
S
G
R
F
L
W
N
S
G
M
F
L
W
K
A
R
E
F
I
E
E
V
K
V
C
E
P
S
I
Y
E
N
------
L
K
D
V
D
P
R
N
F
E
E
L
K
------
K
A
Y
E
K
V
P
S
I
S
V
D
Y
A
V
M
E
K
S
K
K
V
R
V
V
K
A
--
D
F
E
W
S
D
L
G
N
W
S
S
V
RE
I
E
G
Y
T
E
E
S
D
E
V
I
L
V
D
S
D
R
V
F
V
K
--
T
H
N
------
K
-
P
I
A
V
V
G
L
S
D
V
I
V
I
D
T
P
N
G
I
L
I
C
K
E
E
Y
A
Q
K
V
R
E
V
V
K
K
L
F
------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
75.86
33%
-84
- C2 -
2X5Z
2
?
A:
[2-332]
--
M
K
A
L
I
L
A
G
G
S
G
E
R
F
W
P
L
S
T
P
E
T
P
K
Q
F
L
K
L
-
F
-
G
N
K
S
-
L
M
R
W
T
F
E
R
--
V
L
E
-
E
--
M
--
D
P
K
D
--
V
I
V
V
T
H
K
D
Y
-------
V
E
R
T
K
K
E
--
L
---------------
P
E
L-----
P
--
D
E
N
I
----
I
---
A
--
E
P
-
M
K
K
N
T
A
P
A
C
F
I
G
T
K
L
A
-
D
-
D
--
D
--
E
P
V
L
V
L
P
A
D
H
R
I
P
D
T
K
K
F
W
K
T
V
K
K
A
L
D
A
L
-
E
K
Y
D
G
-
L
F
T
F
G
I
V
P
T
--
R
P
E
T
G
Y
G
Y
I
E
-
I
G
----
E
E
-----
L
EEG
V
H
K
----
V
A
Q
---
F
R
E
K
P
D
L
E
T
A
K
K
------
F
V
-------
E
S
G
R
F
L
W
N
S
G
M
F
L
W
K
A
R
E
F
I
E
E
V
K
V
C
E
P
S
I
Y
E
N
------
L
K
D
V
D
P
R
N
F
E
E
L
K
------
K
A
Y
E
K
V
P
S
I
S
V
D
Y
A
V
M
E
K
S
K
K
V
R
V
V
K
A
--
D
F
E
W
S
D
L
G
N
W
S
S
V
R
E
I
E
G
Y
T
E
E
S
D
E
V
I
L
V
D
S
D
R
V
F
V
K
--
T
H
N
------
K
-
P
I
A
V
V
G
L
S
D
V
I
V
I
D
T
P
N
G
I
L
I
C
K
E
E
Y
A
Q
K
V
R
E
V
V
K
K
L
F
------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
75.65
33%
-81
- C2 -
2X65
3
?
B:
[2-332]
--
M
K
A
L
I
L
A
G
G
S
G
E
R
F
W
P
L
S
T
P
E
T
P
K
Q
F
L
K
L
-
F
-
G
N
K
S
-
L
M
R
W
T
F
E
R
--
V
L
E
-
E
--
M
--
D
P
K
D
--
V
I
V
V
T
H
K
D
Y
-------
V
E
R
T
K
K
E
--
L
---------------
P
E
L-----
P
--
D
E
N
I
----
I
---
A
--
E
P
-
M
K
K
N
T
A
P
A
C
F
I
G
T
K
L
A
-
D
-
D
--
D
--
E
P
V
L
V
L
P
A
D
H
R
I
P
D
T
K
K
F
W
K
T
V
K
K
A
L
D
A
L
-
E
K
Y
D
G
-
L
F
T
F
G
I
V
P
T
--
R
P
E
T
G
Y
G
Y
I
E
-
I
G
----
E
E
-----
L
EEGVH
K
----
V
A
Q
---
F
R
E
K
P
D
L
E
T
A
K
K
------
F
V
-------
E
S
G
R
F
L
W
N
S
G
M
F
L
W
K
A
R
E
F
I
E
E
V
K
V
C
E
P
S
I
Y
E
N
------
L
K
D
V
D
P
R
N
F
E
E
L
K
------
K
A
Y
E
K
V
P
S
I
S
V
D
Y
A
V
M
E
K
S
K
K
V
R
V
V
K
A
--
D
F
E
W
S
D
L
G
N
W
S
S
V
RE
I
E
G
Y
T
E
E
S
D
E
V
I
L
V
D
S
D
R
V
F
V
K
--
T
H
N
------
K
-
P
I
A
V
V
G
L
S
D
V
I
V
I
D
T
P
N
G
I
L
I
C
K
E
E
Y
A
Q
K
V
R
E
V
V
K
K
L
F
R
-----------------------------------------------------------------------------------------------------------------------------
72
Fugue
75.38
32%
-83
- C2 -
2X65
6
?
A:
[1-334]
-
V
M
K
A
L
I
L
A
G
G
S
G
E
R
F
W
P
L
S
T
P
E
T
P
K
Q
F
L
K
L
-
F
-
G
N
K
S
-
L
M
R
W
T
F
E
R
--
V
L
E
-
E
--
M
--
D
-
P
K
D
V
I
V
V
T
H
K
D
Y
V
----
E
R
T
K
K
E
L
P
E
L
--
P
---------------
D
E
------
N
-----
I
----
I
---
A
--
E
P
-
M
K
K
N
T
A
P
A
C
F
I
G
T
K
L
A
-
D
-
D
--
D
--
E
P
V
L
V
L
P
A
D
H
R
I
P
D
T
K
K
F
W
K
T
V
K
K
A
L
D
A
L
-
E
K
Y
D
G
-
L
F
T
F
G
I
V
P
T
--
R
P
E
T
G
Y
G
Y
I
E
-
I
G
----
E
E
-----
L
EEG
V
H
K
----
V
A
Q
---
F
R
E
K
P
D
L
E
T
A
K
K
------
F
V
-------
E
S
G
R
F
L
W
N
S
G
M
F
L
W
K
A
R
E
F
I
E
E
V
K
V
C
E
P
S
I
Y
E
N
L
K
D
--
V
----------
D
P
R
N
F
E
E
L
K
K
A
Y
E
K
V
P
S
I
S
V
D
Y
A
V
M
E
K
S
K
K
V
R
V
V
K
A
--
D
F
E
W
S
D
L
G
N
W
S
S
V
--
R
E
I
E
G
Y
T
E
------
E
S
D
E
V
I
L
V
D
S
D
R
V
F
V
K
T
H
N
K
-
P
I
A
V
V
G
L
S
D
V
I
V
I
D
T
P
N
G
I
L
I
C
K
E
E
Y
A
Q
K
V
R
E
V
V
K
K
L
F
R
-----------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
75.10
33%
-79
- C2 -
2X60
1
?
A:
[2-332]
--
M
K
A
L
I
L
A
G
G
S
G
E
R
F
W
P
L
S
T
P
E
T
P
K
Q
F
L
K
L
-
F
-
G
N
K
S
-
L
M
R
W
T
F
E
R
--
V
L
E
-
E
--
M
--
D
P
K
D
--
V
I
V
V
T
H
K
D
Y
-------
V
E
R
T
K
K
E
--
L
---------------
P
E
L-----
P
--
D
E
N
I
----
I
---
A
--
E
P
-
M
K
K
N
T
A
P
A
C
F
I
G
T
K
L
A
-
D
-
D
--
D
--
E
P
V
L
V
L
P
A
D
H
R
I
P
D
T
K
K
F
W
K
T
V
K
K
A
L
D
A
L
-
E
K
Y
D
G
-
L
F
T
F
G
I
V
P
T
--
R
P
E
T
G
Y
G
Y
I
E
-
I
G
----
E
E
-----
L
EEGVH
K
----
V
A
Q
---
F
R
E
K
P
D
L
E
T
A
K
K
------
F
V
-------
E
S
G
R
F
L
W
N
S
G
M
F
L
W
K
A
R
E
F
I
E
E
V
K
V
C
E
P
S
I
Y
E
N
------
L
K
D
V
D
P
R
N
F
E
E
L
K
------
K
A
Y
E
K
V
P
S
I
S
V
D
Y
A
V
M
E
K
S
K
K
V
R
V
V
K
A
--
D
F
E
W
S
D
L
G
N
W
S
S
V
R
E
I
E
G
Y
T
E
E
S
D
E
V
I
L
V
D
S
D
R
V
F
V
K
--
T
H
N
------
K
-
P
I
A
V
V
G
L
S
D
V
I
V
I
D
T
P
N
G
I
L
I
C
K
E
E
Y
A
Q
K
V
R
E
V
V
K
K
L
F
------------------------------------------------------------------------------------------------------------------------------
48
HHSearch
74.62
31%
-78
* C2 *
2X65
6
?
A:
[1-334]
-
V
M
K
A
L
I
L
A
G
G
S
G
E
R
F
W
P
L
S
T
P
E
T
P
K
Q
F
L
K
L
F
G
-
N
-
K
S
-
L
M
R
W
T
F
E
R
--
V
L
E
E
M
D-
P
--
K
-
D
V
--
I
V
V
T
H
K
D
Y
V
----
E
R
T
K
K
E
L
P
E
L
--------------------------
P
--
D
E
N
I
----
I
---
A
--
E
P
-
M
K
K
N
T
A
P
A
C
F
I
G
T
K
L
A
-
D
-
D
--
D
--
E
P
V
L
V
L
P
A
D
H
R
I
P
D
T
K
K
F
W
K
T
V
K
K
A
L
D
A
L
E
K
Y
-
D
G
-
L
F
T
F
G
I
V
P
T
--
R
P
E
T
G
Y
G
Y
I
E
-
I
G
----
E
E
LEEG
V
H
-----
K
----
V
A
Q
---
F
R
E
K
P
D
L
E
T
A
K
K
------
F
V
-------
E
S
G
R
F
L
W
N
S
G
M
F
L
W
K
A
R
E
F
I
E
E
V
K
V
C
E
P
S
I
Y
E
N
L
K
D
--
V
D
P
R
---------
N
F
E
E
-
L
K
K
A
Y
E
K
V
P
S
I
S
V
D
Y
A
V
M
E
K
S
K
K
V
R
V
V
K
A
--
D
F
E
W
S
D
L
G
N
W
S
S
V
--
R
E
I
E
G
Y
T
E
E
S
D
E
------
V
I
L
V
D
S
D
R
V
F
V
K
T
H
N
K
-
P
I
A
V
V
G
L
S
D
V
I
V
I
D
T
P
N
G
I
L
I
C
K
E
E
Y
A
Q
K
V
R
E
V
V
K
K
L
F
R
-----------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
73.48
33%
-79
- C2 -
2X60
1
?
B:
[2-332]
--
M
K
A
L
I
L
A
G
G
S
G
E
R
F
W
P
L
S
T
P
E
T
P
K
Q
F
L
K
L
-
F
-
G
N
K
S
-
L
M
R
W
T
F
E
R
--
V
L
E
-
E
--
M
--
D
P
K
D
--
V
I
V
V
T
H
K
D
Y
-------
V
E
R
T
K
K
E
--
L
---------------
P
E
L-----
P
--
D
E
N
I
----
I
---
A
--
E
P
-
M
K
K
N
T
A
P
A
C
F
I
G
T
K
L
A
-
D
-
D
--
D
--
E
P
V
L
V
L
P
A
D
H
R
I
P
D
T
K
K
F
W
K
T
V
K
K
A
L
D
A
L
-
E
K
Y
D
G
-
L
F
T
F
G
I
V
P
T
--
R
P
E
T
G
Y
G
Y
I
E
-
I
G
----
E
E
-----
L
EEGVH
K
----
V
A
Q
---
F
R
E
K
P
D
L
E
T
A
K
K
------
F
V
-------
E
S
G
R
F
L
W
N
S
G
M
F
L
W
K
A
R
E
F
I
E
E
V
K
V
C
E
P
S
I
Y
E
N
------
L
K
D
V
D
P
R
N
F
E
E
L
K
------
K
A
Y
E
K
V
P
S
I
S
V
D
Y
A
V
M
E
K
S
K
K
V
R
V
V
K
A
--
D
F
E
W
S
D
L
G
N
W
S
S
V
RE
I
E
G
Y
T
E
E
S
D
E
V
I
L
V
D
S
D
R
V
F
V
K
--
T
H
N
------
K
-
P
I
A
V
V
G
L
S
D
V
I
V
I
D
T
P
N
G
I
L
I
C
K
E
E
Y
A
Q
K
V
R
E
V
V
K
K
L
F
------------------------------------------------------------------------------------------------------------------------------
59
HHSearch
55.53
19%
-80
- C2 -
1YP2
4
GLGS_SOLTU
A:
[20-295]
-
S
V
L
G
I
I
L
------
R
L
Y
P
L
T
K
-
K
R
A
K
P
A
V
P
L
-
G
A
N
-
Y
R
-
L
I
D
I
P
V
S
N
--
C
L
N
-
S
N-
I
--
S
-
K
I
--
Y
V
L
T
Q
F
N
-
S
----
A
S
L
N
R
H
L
S
R
A
--
Y
---------------
A
--------E
G
F
V
E
V
L
A
--
A
QQS
P
EN
P
D
-
W
F
Q
G
T
A
D
A
V
R
Q
Y
L
W
L
F
-
E
-
E
HT
V
--
L
E
Y
L
I
L
A
G
D
H
L
Y
R
M
D
--
Y
E
K
F
I
Q
A
H
R
E
----
T
-
D
A
-
D
I
T
V
A
A
L
P
M
D
E
K
R
A
T
A
F
G
L
M
K
-
I
D
----
E
E
-----
G
-----
R
----
I
I
E
---
F
A
E
K
P
Q
G
E
Q
L
Q
A
M
KVDTT
I
L
GLD
D
K
R
A
K
E
M
P
F
I
A
S
M
G
I
Y
V
I
S
K
D
V
M
L
N
L
L
R
D
K
F
P
G
A
N
-----------------------
D
F
G
S
E
V
I
P
G
---------
A
T
S
L
G
M
R
V
Q
A
Y
L
Y
--
D
G
Y
W
E
D
I
G
T
I
E
A
F
--
Y
N
A
N
L
G
I
T
K
K
P
V
P
D
F
S
F
Y
D
R
S
A
P
I
Y
T
Q
P
R
Y
L
-
P
P
-
S
K
M
L
D
A
D
V
T
D
S
V
I
G
E
G
C
V
I
K
N
C
K
I
H
H
S
V
V
G
L
R
S
C
I
S
E
G
A
I
I
E
D
S
L
L
M
G
A
D
Y
Y
E
T
D
A
D
R
K
L
L
A
A
K
G
S
V
P
I
G
I
G
K
N
C
H
I
K
R
A
I
I
D
K
N
A
R
I
G
D
N
V
K
I
I
N
K
D
N
V
Q
E
A
A
R
E
T
D
G
Y
F
I
K
S
G
I
V
T
V
I
K
D
A
L
I
P
S
G
I
I
I
---------------------------------
52
HHSearch
49.99
17%
-69
- C2 -
1LVW
8
?
A:
[2-241]
A
H
M
K
G
I
V
L
A
G
G
S
G
T
R
L
Y
P
I
T
R
-
A
V
S
K
Q
L
L
P
I
-
Y
-
D
-
K
P
-
M
I
Y
Y
P
L
S
V
--
L
M
L
-
A
G-
I
--
R
-
D
I
--
L
I
I
S
T
P
R
D
L
----
P
L
Y
R
D
L
L
G
D
G
SQ
F
---------------
G
V
---------
R
F
S
Y
----
R
---
V
--
Q
E
-
E
P
R
G
I
A
D
A
F
I
V
G
K
D
F
I
-
G
----
D
--
S
K
V
A
L
V
L
G
D
N
V
F
Y
G
H
R
-
F
S
E
I
L
R
R
A
A
S
----
L
-
E
D
-
G
A
V
I
F
G
Y
Y
V
--
R
D
P
R
P
F
G
V
V
E
-
F
D
----
S
E
-----
G
-----
R
----
V
I
S
---
I
E
E
K
P
S
R
P
---------------------
K
S
N
Y
V
V
P
G
L
Y
F
Y
D
N
Q
V
V
-
E
I
A
R
R
I
E
P
S
D
--------------------
R
G
E
L
E
-----
I
T
S
V
----
N
E
E
-
Y
L
R
M
G
-
K
L
R
V
E
L
M
GR
G
M
A
W
L
D
T
G
T
H
D
G
L
--
L
E
A
S
S
F
I
E
T
I
Q
K
R
Q
G
F
Y
I
A
C
L
E
E
I
A
Y
N
N
G
W
I
-
T
R
-
E
D
V
L
E
M
A
E
K
L
E
K
T
D
Y
G
K
Y
L
R
D
L
A
E
G
N
F
H
G
---------------------------------------------------------------------------------------------------------------------------------------
63
HHSearch
47.75
20%
-78
- C2 -
2GGO
-
?
A:
[1-224]
--
M
K
A
F
I
L
A
A
G
S
G
E
R
L
E
P
I
T
H
-
T
R
P
K
A
F
V
P
I
-
L
-
S
-
K
P
-
L
I
E
Y
Q
I
E
Y
--
L
R
K
-
C
G-
I
--
R
-
D
I
--
T
V
I
V
S
S
K
N
K
----
E
Y
F
E
K
K
L
K
-------------------------------
E
I
S
I
----
V
---
T
--
Q
K
D
D
I
K
G
T
G
A
A
I
L
S
A
K
F
--------
N
--
D
E
A
L
I
I
Y
G
D
L
F
F
S
N
E
K
E
I
C
N
I
I
T
L
K
------
E
-
N
---
A
I
I
G
V
K
-
V
--
S
N
P
K
D
Y
G
V
L
V
-
L
D
----
N
Q
-----
N
-----
N
----
L
S
K
---
I
I
E
K
P
E
I
P
---------------------
P
S
N
L
I
N
A
G
I
Y
K
L
N
S
D
I
F
-
T
Y
L
D
K
I
S
I
S
E
--------------------
R
G
E
L
-----
E
L
T
D
A
----
I
N
L
-
M
A
-
K
D
H
R
V
K
V
I
E
Y
--
E
G
Y
W
M
D
I
G
K
P
W
N
I
--
I
D
V
N
K
W
A
L
D
N
L
V
F
S
Q
N
L
G
N
V
E
D
N
V
K
I
K
G
K
V
I
-
I
E
-
E
D
A
E
I
K
S
G
T
Y
I
E
G
P
V
Y
I
G
K
G
S
E
I
G
P
N
S
Y
L
R
P
Y
T
I
L
V
E
K
N
K
I
G
A
S
V
E
V
K
E
S
V
I
M
E
G
S
K
I
P
H
L
S
Y
V
G
D
S
V
I
A
E
D
V
N
F
G
A
G
T
L
I
A
N
L
R
F
D
E
K
E
V
K
V
N
V
K
G
K
R
I
S
S
G
R
R
K
L
G
A
F
I
G
G
H
V
R
T
G
I
N
V
T
I
L
P
G
V
K
I
G
A
Y
A
R
I
Y
P
G
A
V
V
N
R
D
V
G
Y
G
E
F
F
K
V
-----------
60
HHSearch
47.33
19%
-72
- C2 -
3BRK
1
GLGC_RHIRD
X:
[12-222]
-
D
A
M
A
Y
V
L
A
G
G
R
G
S
R
L
K
E
L
T
D
-
R
R
A
K
P
A
V
Y
F
-
G
-
G
-
K
A
R
I
I
D
F
A
L
S
N
--
A
L
N
-
S
G-
I
--
R
-
R
I
--
G
V
A
T
Q
Y
K
-
A
----
H
S
L
I
R
H
L
Q
R
G
--
W
---------------
D
F
FRPERN
E
--
S
F
D
I
LPAS----------
W
Y
E
G
T
A
D
A
V
Y
Q
N
I
D
I
I
-
E
-
P
YA
P
--
E
Y
M
V
I
L
A
G
D
H
I
Y
K
M
D
--
Y
E
Y
M
L
Q
Q
H
V
D
----
S
-
G
A
-
D
V
T
I
G
C
L
E
V
PR
M
E
A
T
G
F
G
V
M
H
-
V
N
----
E
K
-----
D
-----
E
----
I
I
D
---
F
I
E
K
P
A
D
P
P
G
I
P
------
G
N
--------
E
G
F
A
L
A
S
M
G
I
Y
V
F
H
T
K
F
L
M
E
A
V
R
R
D
A
A
D
I
I
P
Y
I
V
E
--
H
G
K
A
V
A
H
R
F
A
D
S
C
V
R
S
D
F
E
H
E
P
Y
W
R
D
V
G
T
I
D
A
Y
W
Q
A
N
I
D
L
T
D
V
V
P
D
L
--
D
I
Y
D
K
S
W
P
I
W
T
Y
A
--
E
I
T
P
P
A
K
F
V
H
D
D
E
D
R
R
G
S
A
V
S
S
V
V
S
G
D
C
I
I
S
-
G
A
-
A
L
N
R
S
L
L
F
T
G
V
R
A
N
S
Y
S
R
L
E
N
A
V
V
L
P
S
V
K
I
G
R
H
A
Q
L
S
N
V
V
I
D
H
G
V
V
I
P
E
G
L
I
V
G
E
D
P
E
L
D
A
K
R
F
R
R
T
E
S
G
I
C
L
I
T
Q
S
M
I
D
K
L
----------------------------------------------------------------------------------
54
HHSearch
46.13
17%
-49
- C2 -
3JUK
5
?
A:
[1-272]
M
I
K
K
C
L
F
P
A
A
G
Y
G
T
R
F
L
P
I
T
K
-
T
I
P
K
E
M
L
P
I
-
V
-
D
-
K
P
-
L
I
Q
Y
A
V
E
E
--
A
M
E
-
A
G-
C
--
E
-
V
M
--
A
I
V
T
G
R
N
-
K
----
R
S
L
E
D
Y
F
D
T
S
--
Y
TNKENAL
K
S
I
R
N
I
I
E
K
C
---------
C
F
S
Y
----
V
---
R
--
Q
K
-
Q
M
K
G
L
G
H
A
I
L
T
G
E
A
L
I
-
G
----
N
--
E
P
F
A
V
I
L
A
D
D
L
C
I
S
H
D
-
H
P
S
V
L
K
Q
M
T
S
L
Y
Q
K
Y
-
Q
C
S
I
V
A
I
E
E
V
A
L
--
E
E
V
S
K
Y
G
V
I
R
-
G
E
WLEE
G
V
-----
Y
-----
E
----
I
K
D
---
M
V
E
K
P
N
Q
E
D
A
-------------------
P
S
N
L
A
V
I
G
R
Y
I
L
T
P
D
I
F
-
E
I
L
S
E
T
K
P
G
K
--------------------
N
N
E
I
Q
I
-
T
D
A
--------
L
R
T
-
Q
A
K
R
-
K
R
I
I
A
Y
Q
F
--
K
G
K
R
Y
D
C
G
S
V
E
G
Y
--
I
E
A
S
N
A
Y
Y
K
K
R
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------