@TOME V2.3
(Mar 2018)
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 : B0VUQ9: (2017-12-19 )
MTTLKNDRFLRALLREPVDTTPIWMMRQAGRYLPEYRETRSKAGDFLSLCKNTEFACEVTLQPLRRYDLDAAILFSDILTIPDALGLGLYFETGEGPKFHKTVRTEQDVANLPKLNAKADLDYVMNAVSTIRSALGGQVPLIGFSGSPWTLATYMVEGGSSKEFRFTKQMMYAQPEVLHALLDHLADSVIDYLNAQIDAGAQAIQIFDSWGGALAHREYVEFSLNYMNKIIAGLQREKDGRRIPVIVFTKGGGQWLEPMITTGADALGLDWTTPLNTARNVVSGRVALQGNLDPAVLYGSAASIEKAVKAMLDDAYANGEKTGYVANLGHGITQWVDPAQPKIFVDTVHEYSAKYLG
Atome Classification :
(21 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.....
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MTTL
K
N
D
R
F
L
R
A
L
L
REPVDTT
P
I
W
M
M
R
Q
AGRY
L
P
E
Y
R
E
T
R
-SKA
G
---
D
F
L
S
L
CKNT
E
F
A
C
E
V
T
L
Q
P
L
R
RY-D-L
D
A
A
I
L
F
S
D
I
LTIPDALG
L
G
L
Y
F
ETGEGPK
F
H
K
T
VR
T
E
Q
D
V
ANL--PKLNA-KA
D
L
D
Y
V
M
N
A
V
S
T
I
R
S
AL----G-----GQ-V
P
L
I
GFSGSP
W
T
L
A
T
Y
M
V------E------G--G---S---SK
E
F
R
F
T
K
Q
-
M
MYA
Q
P
E
V
L
H
A
L
L
D
H
L
A
D
S
V
I
D
Y
L
N
A
QIDAG
A
Q
A
I
Q
I
FDSWG
G
A
L
A
H
R
E
Y
V
E
F
S
L
N
Y
M
N
K
I
I
A
G
L
Q---REK-D-G----
R
----
R
--
I
P
V
I
V
F
TKGGG
Q
W
L
E
P
M
ITTGA
D
A
LGLDWTTP
L
N
T
A
R
N
V-VS
G
R
V
A
L
QGNL
D
P
A
V
LYG
S
-
A
A
S
I
E
K
A
V
K
A
M
L
D
D
AYANGEKT
G
Y
V
ANLG
H
G
I
T
QWVDPAQ
P
K
I
F
V
D
T
V
H
E
Y
S
A
K
YLG
1
PsiBlast_PDB
98.44
98%
-116
- C1 -
-
4ZR8
4
?
A:
[11-365]
--
T
L
K
N
D
R
F
L
R
A
L
L
R
E
P
V
D
T
T
P
I
W
M
M
R
Q
A
G
R
Y
L
P
E
Y
R
E
T
R
-
S
K
A
G
-----
L
S
L
C
K
N
T
E
F
A
C
E
V
T
L
Q
P
L
R
R
Y
-
D
-
L
D
A
A
I
L
F
S
D
I
L
T
I
P
D
A
L
G
L
G
L
Y
F
E
T
G
E
G
P
K
F
H
K
T
V
R
T
E
Q
D
V
A
N
L
--
P
K
L
N
A
-
K
A
D
L
D
Y
V
M
N
A
V
S
T
I
R
S
A
L
----
G
-----
G
Q
-
V
P
L
I
G
F
S
G
S
P
W
T
L
A
T
Y
M
V
------
E
------
G
--
G
---
S
---
S
K
E
F
R
F
T
K
Q
-
M
M
Y
A
Q
P
E
V
L
H
A
L
L
D
H
L
A
D
S
V
I
D
Y
L
N
A
Q
I
D
A
G
A
Q
A
I
Q
I
F
D
S
W
G
G
A
L
A
H
R
E
Y
V
E
F
S
L
N
Y
M
K
K
I
I
A
G
L
Q
---
R
E
K
-
D
-
G
----
R
----
R
--
I
P
V
I
V
F
T
K
G
G
G
Q
W
L
E
P
M
I
T
T
G
A
D
A
L
G
L
D
W
T
T
P
L
N
T
A
R
T
T
-
V
A
G
R
V
A
L
Q
G
N
L
D
P
A
V
L
Y
G
S
-
A
A
S
I
E
K
A
V
K
A
M
L
D
D
A
Y
A
N
G
E
K
T
G
Y
V
A
N
L
G
H
G
I
T
Q
W
V
D
P
A
Q
P
K
I
F
V
D
T
V
H
E
Y
S
A
K
Y
L
G
21
PsiBlast_CBE
96.76
98%
-111
- C1 -
-
4ZR8
4
?
B:
[12-365]
---
L
K
N
D
R
F
L
R
A
L
L
R
E
P
V
D
T
T
P
I
W
M
M
R
Q
A
G
R
Y
L
P
E
Y
R
E
T
R
-
S
K
A
G
---
D
F
L
S
L
C
K
N
T
E
F
A
C
E
V
T
L
Q
P
L
R
R
Y
-
D
-
L
D
A
A
I
L
F
S
D
I
L
T
I
P
D
A
L
G
L
G
L
Y
F
E
T
G
E
G
P
K
F
H
K
T
V
R
T
E
Q
D
V
A
N
L
--
P
K
L
N
A
-
K
A
D
L
D
Y
V
M
N
A
V
S
T
I
R
S
A
L
----
G
-----
G
Q
-
V
P
L
I
G
F
S
G
S
P
W
T
L
A
T
Y
M
V
------
E
------
G
--
G
---
S
---
S
K
E
F
R
F
T
K
Q
-
M
M
Y
A
Q
P
E
V
L
H
A
L
L
D
H
L
A
D
S
V
I
D
Y
L
N
A
Q
I
D
A
G
A
Q
A
I
Q
I
F
D
S
W
G
G
A
L
A
H
R
E
Y
V
E
F
S
L
N
Y
M
K
K
I
I
A
G
L
Q
---
R
E
K
-
D
-
G
----
R
----
R
--
I
P
V
I
V
F
T
K
G
G
G
Q
W
L
E
P
M
I
T
T
G
A
D
A
L
G
L
D
W
T
T
P
L
N
T
A
R
T
T
-
V
A
G
R
V
A
L
Q
G
N
L
D
P
A
V
L
Y
G
S
-
A
A
S
I
E
K
A
V
K
A
M
L
D
D
A
Y
A
N
G
E
K
T
G
Y
V
A
N
L
G
H
G
I
T
Q
W
V
D
P
A
Q
P
K
I
F
V
D
T
V
H
E
Y
S
A
K
Y
L
G
3
PsiBlast_PDB
86.57
66%
-113
- C1 -
-
3CYV
-
DCUP_SHIFL
A:
[3-352]
--
E
L
K
N
D
R
Y
L
R
A
L
L
R
Q
P
V
D
V
T
P
V
W
M
M
R
Q
A
G
R
Y
L
P
E
Y
K
A
T
R
-
A
Q
A
G
---
D
F
M
S
L
C
K
N
A
E
L
A
C
E
V
T
L
Q
P
L
R
R
Y
-
P
-
L
D
A
A
I
L
F
S
D
I
L
T
V
P
D
A
M
G
L
G
L
Y
F
E
A
G
E
G
P
R
F
T
S
P
V
T
C
K
A
D
V
D
K
L
--
P
I
P
D
P
-
E
D
E
L
G
Y
V
M
N
A
V
R
T
I
R
H
E
L
----
K
-----
G
E
-
V
P
L
I
G
F
S
G
S
P
W
T
L
A
T
Y
M
V
------
E
------
G
--
G
---
S
---
S
K
A
F
T
V
I
K
K
-
M
M
Y
A
D
P
Q
A
L
H
A
L
L
D
K
L
A
K
S
V
T
L
Y
L
N
A
Q
I
K
A
G
A
Q
A
V
M
I
F
D
T
W
G
G
V
L
T
G
R
D
Y
Q
Q
F
S
L
Y
Y
M
H
K
I
V
D
G
L
L
---
R
E
N
-
D
-
G
----
R
----
R
--
V
P
V
T
L
F
T
K
G
G
G
Q
W
L
E
A
M
A
E
T
G
C
D
A
L
G
L
D
W
T
T
D
I
A
D
A
R
R
R
-
V
G
N
K
V
A
L
Q
G
N
M
D
P
S
M
L
Y
A
P
-
P
A
R
I
E
E
E
V
A
T
I
L
-
A
G
F
G
H
G
E
--
G
H
V
F
N
L
G
H
G
I
H
Q
D
V
P
P
E
H
A
G
V
F
V
E
A
V
H
R
L
S
E
Q
Y
--
35
HHSearch
79.70
93%
-20
- C1 -
-
4ZR8
4
?
B:
[12-365]
---
L
K
N
D
R
F
L
R
A
L
L
R
E
P
V
D
T
T
P
I
W
M
M
R
Q
A
G
R
Y
L
P
E
Y
R
E
---
T
R
-
S
K
AG
D
F
L
S
L
C
K
N
T
E
F
A
C
E
V
T
L
Q
P
L
R
R
Y
-
D
-
L
D
A
A
I
L
F
S
D
I
L
T
I
P
D
A
L
G
L
G
L
Y
F
E
T
G
E
G
P
K
F
H
K
T
V
R
T
E
Q
D
V
A
N
L
--
P
K
L
N
A
-
K
A
D
L
D
Y
V
M
N
A
V
S
T
I
R
S
A
L
----
G
-----
G
Q
-
V
P
L
I
G
F
S
G
S
P
W
T
L
A
T
Y
M
V
------
E
------
G
GS
S
---
K
EF
R
F
------
T
K
Q
M
M
Y
A
Q
P
E
V
L
H
A
L
L
D
H
L
A
D
S
V
I
D
Y
L
N
A
Q
I
D
A
G
A
Q
A
I
Q
I
F
D
S
W
G
G
A
L
A
H
R
E
Y
V
E
F
S
L
N
Y
M
K
K
I
I
A
G
L
Q
---
R
-----
E
KDG
R
R
----
I
--
P
V
I
V
F
T
K
G
G
-
G
Q
W
L
E
P
M
I
T
T
G
A
D
A
L
G
L
D
W
T
T
P
L
N
T
A
R
T
T
V
A
G
-
R
V
A
L
Q
G
N
L
D
P
A
V
L
-
Y
G
S
A
A
S
I
E
K
A
V
K
A
M
L
D
D
A
Y
A
N
G
E
K
T
G
Y
V
A
N
L
G
H
G
I
T
Q
W
V
D
P
A
Q
P
K
I
F
V
D
T
V
H
E
Y
S
A
K
Y
L
G
2
PsiBlast_PDB
77.60
67%
-36
- C1 -
-
4WSH
-
DCUP_PSEAE
A:
[9-363]
M
T
A
L
K
N
D
R
F
L
R
A
L
L
K
Q
P
V
D
V
T
P
V
W
M
M
R
Q
A
G
R
Y
L
P
E
Y
R
A
T
R
-
A
K
A
G
---
D
F
M
S
L
C
M
N
P
E
L
A
C
E
V
T
L
Q
P
L
D
R
Y
P
Q
-
L
D
A
A
I
L
F
S
D
I
L
T
I
P
D
A
M
G
Q
G
L
Y
F
E
T
G
E
G
P
R
F
R
K
V
V
S
S
L
A
D
I
E
A
L
--
P
V
P
D
P
-
E
Q
D
L
G
Y
V
M
D
A
V
R
T
I
R
R
E
L
----
N
-----
G
R
-
V
P
L
I
G
F
S
G
S
P
W
T
L
A
T
Y
M
V
------
E
------
G
--
G
---
S
---
S
K
D
F
R
K
S
K
A
-
M
L
Y
D
N
P
K
A
M
H
A
L
L
D
K
L
A
Q
S
V
T
S
Y
L
N
G
Q
I
H
A
G
A
Q
A
V
Q
I
F
D
S
W
G
G
S
L
S
A
A
A
Y
Q
E
F
S
L
A
Y
M
R
K
I
V
D
G
L
I
---
R
E
H
-
D
-
G
----
R
----
R
--
V
P
V
I
L
F
T
K
G
G
G
L
W
L
E
S
M
A
E
V
G
A
E
A
L
G
L
D
W
T
C
D
I
G
S
A
R
A
R
-
V
G
E
R
V
A
L
Q
G
N
M
D
P
S
V
L
Y
A
N
-
P
A
A
I
R
A
E
V
A
R
I
L
---
A
A
Y
G
K
G
T
G
H
V
F
N
L
G
H
G
I
T
P
E
V
D
P
A
H
A
G
A
F
F
E
A
V
H
E
L
S
A
Q
Y
H
G
38
HHSearch
76.66
57%
-52
- C1 -
-
4EXQ
-
DCUP_BURTA
A:
[7-362]
-
Q
T
L
I
N
D
T
F
L
R
A
L
L
R
E
P
T
D
Y
T
P
I
W
L
M
R
Q
A
G
R
Y
L
P
E
Y
N
A
T
R
-
A
R
A
G
---
S
F
L
G
L
A
K
H
P
D
Y
A
T
E
V
T
L
Q
P
L
E
R
F
-
P
-
L
D
A
A
I
L
F
S
D
I
L
T
I
P
D
A
M
G
L
G
L
D
F
----
G
P
K
F
A
H
P
V
R
T
E
A
D
V
A
K
L
--
A
V
P
D
I
-
G
A
T
L
G
Y
V
T
D
A
V
R
E
I
R
R
A
L
----
T
DGEGR
Q
R
-
V
P
L
I
G
F
S
G
S
P
W
T
L
A
C
Y
M
V
------
E
GGG---
S
--
D
DF
R
T
---
V
------
K
S
-
M
A
Y
A
R
P
D
L
M
H
R
I
L
D
V
N
A
Q
A
V
A
A
Y
L
N
A
Q
I
E
A
G
A
Q
A
V
M
I
F
D
T
W
G
G
A
L
A
D
G
A
Y
Q
R
F
S
L
D
Y
I
R
R
V
V
A
Q
L
K
---
R
-----
E
----
H
DG
A
R
V
--
P
A
I
A
F
T
K
G
G
-
G
L
W
L
E
D
L
A
A
T
G
V
D
A
V
G
L
D
W
T
V
N
L
G
R
A
R
E
R
V
A
G
-
R
V
A
L
Q
G
N
L
D
P
T
I
L
-
F
A
P
P
E
A
I
R
A
E
A
R
A
V
L
D
S
Y
G
---
N
H
P
G
H
V
F
N
L
G
H
G
I
S
Q
F
T
P
P
E
H
V
A
E
L
V
D
E
V
H
R
H
S
R
A
I
--
4
PsiBlast_PDB
75.94
60%
-41
- C1 -
-
4EXQ
-
DCUP_BURTA
A:
[8-359]
--
T
L
I
N
D
T
F
L
R
A
L
L
R
E
P
T
D
Y
T
P
I
W
L
M
R
Q
A
G
R
Y
L
P
E
Y
N
A
T
R
-
A
R
A
G
---
S
F
L
G
L
A
K
H
P
D
Y
A
T
E
V
T
L
Q
P
L
E
R
F
-
P
-
L
D
A
A
I
L
F
S
D
I
L
T
I
P
D
A
M
G
L
G
L
D
F
----
G
P
K
F
A
H
P
V
R
T
E
A
D
V
A
K
L
--
A
V
P
D
I
-
G
A
T
L
G
Y
V
T
D
A
V
R
E
I
R
R
A
L
TDGE
G
-----
R
Q
R
V
P
L
I
G
F
S
G
S
P
W
T
L
A
C
Y
M
V
------
E
------
G
--
G
---
G
---
S
D
D
F
R
T
V
K
S
-
M
A
Y
A
R
P
D
L
M
H
R
I
L
D
V
N
A
Q
A
V
A
A
Y
L
N
A
Q
I
E
A
G
A
Q
A
V
M
I
F
D
T
W
G
G
A
L
A
D
G
A
Y
Q
R
F
S
L
D
Y
I
R
R
V
V
A
Q
L
K
---
R
E
H
-
D
-
G
----
A
----
R
--
V
P
A
I
A
F
T
K
G
G
G
L
W
L
E
D
L
A
A
T
G
V
D
A
V
G
L
D
W
T
V
N
L
G
R
A
R
E
R
-
V
A
G
R
V
A
L
Q
G
N
L
D
P
T
I
L
F
A
P
-
P
E
A
I
R
A
E
A
R
A
V
L
D
---
S
Y
G
N
H
P
G
H
V
F
N
L
G
H
G
I
S
Q
F
T
P
P
E
H
V
A
E
L
V
D
E
V
H
R
H
S
-----
24
Fugue
75.76
35%
-116
- C1 -
-
1J93
-
DCUP_TOBAC
A:
[11-353]
----
T
Q
P
L
L
L
D
A
V
R
G
K
E
V
E
R
P
P
V
W
L
M
R
Q
A
G
R
Y
M
K
S
Y
Q
L
L
C
-
E
K
Y
P
---
L
F
R
D
R
S
E
N
V
D
L
V
V
E
I
S
L
Q
P
W
K
V
F
-
R
-
P
D
G
V
I
L
F
S
D
I
L
T
P
L
S
G
M
N
I
P
F
D
I
I
K
G
K
G
P
V
I
F
D
P
L
R
T
A
A
D
V
E
K
V
--
R
E
F
I
P
-
E
K
S
V
P
Y
V
G
E
A
L
T
I
L
R
K
E
V
----
N
-----
N
Q
-
A
A
V
L
G
F
V
G
A
P
F
T
L
A
S
Y
V
V
------
E
------
G
--
G
---
S
---
S
K
N
F
T
K
I
K
R
-
L
A
F
A
E
P
K
V
L
H
A
L
L
Q
K
F
A
T
S
M
A
K
Y
I
R
Y
Q
A
D
S
G
A
Q
A
V
Q
I
F
D
S
W
A
T
E
L
S
P
V
D
F
E
E
F
S
L
P
Y
L
K
Q
I
V
D
S
V
K
---
L
T
H
-
P
-----------
N
--
L
P
L
I
L
Y
A
S
G
S
G
G
L
L
E
R
L
P
L
T
G
V
D
V
V
S
L
D
W
T
V
D
M
A
D
G
R
R
R
-
L
G
P
N
V
A
I
Q
G
N
V
D
P
G
V
L
F
G
S
-
K
E
F
I
T
N
R
I
N
D
T
V
K
K
A
----
G
K
G
K
H
I
L
N
L
G
H
G
I
K
V
G
T
P
E
E
N
F
A
H
F
F
E
I
A
K
G
L
R
Y
----
34
HHSearch
75.08
64%
-24
- C1 -
-
4WSH
-
DCUP_PSEAE
A:
[9-363]
M
T
A
L
K
N
D
R
F
L
R
A
L
L
K
Q
P
V
D
V
T
P
V
W
M
M
R
Q
A
G
R
Y
L
P
E
Y
R
A
T
R
-
A
K
A
G
---
D
F
M
S
L
C
M
N
P
E
L
A
C
E
V
T
L
Q
P
L
D
R
Y
-
P
Q
L
D
A
A
I
L
F
S
D
I
L
T
I
P
D
A
M
G
Q
G
L
Y
F
E
T
G
E
G
P
R
F
R
K
V
V
S
S
L
A
D
I
E
A
L
--
P
V
P
D
P
-
E
Q
D
L
G
Y
V
M
D
A
V
R
T
I
R
R
E
L
----
N
-----
G
R
-
V
P
L
I
G
F
S
G
S
P
W
T
L
A
T
Y
M
V
------
E
GGSSKD
F
--
R
---
K
---
S
------
K
A
-
M
L
Y
D
N
P
K
A
M
H
A
L
L
D
K
L
A
Q
S
V
T
S
Y
L
N
G
Q
I
H
A
G
A
Q
A
V
Q
I
F
D
S
W
G
G
S
L
S
A
A
A
Y
Q
E
F
S
L
A
Y
M
R
K
I
V
D
G
L
I
---
R
E
H
-
D
G
R
----
R
----
V
--
P
V
I
L
F
T
K
G
G
G
-
L
W
L
E
S
M
A
E
V
G
A
E
A
L
G
L
D
W
T
C
D
I
G
S
A
R
A
R
V
G
E
-
R
V
A
L
Q
G
N
M
D
P
S
V
L
-
Y
A
N
P
A
A
I
R
A
E
V
A
R
I
L
A
A
Y
G
---
K
G
T
G
H
V
F
N
L
G
H
G
I
T
P
E
V
D
P
A
H
A
G
A
F
F
E
A
V
H
E
L
S
A
Q
Y
H
G
13
PsiBlast_PDB
69.93
47%
-39
- C1 -
-
1R3V
2
DCUP_HUMAN
A:
[14-361]
---
L
K
N
D
T
F
L
R
A
A
W
G
E
E
T
D
Y
T
P
V
W
C
M
R
Q
A
G
R
Y
L
P
E
F
R
E
T
R
-
A
-
A
Q
---
D
F
F
S
T
C
R
S
P
E
A
C
C
E
L
T
L
Q
P
L
R
R
F
-
P
-
L
D
A
A
I
I
F
S
E
I
L
V
V
P
Q
A
L
G
M
E
V
T
M
V
P
G
K
G
P
S
F
P
E
P
L
R
E
E
Q
D
L
E
R
L
RD
P
E
V
V
A
--
S
E
L
G
Y
V
F
Q
A
I
T
L
T
R
Q
R
L
----
A
-----
G
R
-
V
P
L
I
G
F
A
G
A
P
W
T
L
M
T
Y
M
V
------
E
------
G
--
G
---
G
---
S
S
T
M
A
Q
A
K
R
-
W
L
Y
Q
R
P
Q
A
S
H
Q
L
L
R
I
L
T
D
A
L
V
P
Y
L
V
G
Q
V
V
A
G
A
Q
A
L
Q
L
F
E
S
H
A
G
H
L
G
P
Q
L
F
N
K
F
A
L
P
Y
I
R
D
V
A
K
Q
V
K
A
R
L
R
E
A
-
G
-
L
----
A
----
P
--
V
P
M
I
I
F
A
K
D
G
H
F
A
L
E
E
L
A
Q
A
G
Y
E
V
V
G
L
D
W
T
V
A
P
K
K
A
R
E
C
-
V
G
K
T
V
T
L
Q
G
N
L
D
P
C
A
L
Y
A
S
-
E
E
E
I
G
Q
L
V
K
Q
M
L
D
D
F
G
P
H
----
R
Y
I
A
N
L
G
H
G
L
Y
P
D
M
D
P
E
H
V
G
A
F
V
D
A
V
H
K
H
S
-----
5
PsiBlast_PDB
69.74
47%
-39
- C1 -
-
3GW0
-
DCUP_HUMAN
A:
[14-361]
---
L
K
N
D
T
F
L
R
A
A
W
G
E
E
T
D
Y
T
P
V
W
C
M
R
Q
A
G
R
Y
L
P
E
F
R
E
T
R
-
A
-
A
Q
---
D
F
F
S
T
C
R
S
P
E
A
C
C
E
L
T
L
Q
P
L
R
R
F
-
P
-
L
D
A
A
I
I
F
S
D
I
L
V
V
P
Q
A
L
G
M
E
V
T
M
V
P
G
K
G
P
S
F
P
E
P
L
R
E
E
Q
D
L
E
R
L
RD
P
E
V
V
A
--
S
E
L
G
Y
V
F
Q
A
I
T
L
T
R
Q
R
L
----
A
-----
G
R
-
V
P
L
I
G
F
A
G
A
P
W
T
L
M
T
Y
M
V
------
E
------
G
--
G
---
G
---
S
S
T
M
A
Q
A
K
R
-
W
L
Y
Q
R
P
Q
A
S
H
Q
L
L
R
I
L
T
D
A
L
V
P
Y
L
V
G
Q
V
V
A
G
A
Q
A
L
Q
L
F
E
S
H
A
G
H
L
G
P
Q
L
F
N
K
F
A
L
P
Y
I
R
D
V
A
K
Q
V
K
A
R
L
R
E
A
-
G
-
L
----
A
----
P
--
V
P
M
I
I
F
A
K
D
G
H
F
A
L
E
E
L
A
Q
A
G
Y
E
V
V
G
L
D
W
T
V
A
P
K
K
A
R
E
C
-
V
G
K
T
V
T
L
Q
G
N
L
D
P
C
A
L
Y
A
S
-
E
E
E
I
R
Q
L
V
K
Q
M
L
D
D
F
G
P
H
----
R
Y
I
A
N
L
G
H
G
L
Y
P
D
M
D
P
E
H
V
G
A
F
V
D
A
V
H
K
H
S
-----
8
PsiBlast_PDB
69.69
47%
-39
- C1 -
-
1R3Q
2
DCUP_HUMAN
A:
[14-361]
---
L
K
N
D
T
F
L
R
A
A
W
G
E
E
T
D
Y
T
P
V
W
C
M
R
Q
A
G
R
Y
L
P
E
F
R
E
T
R
-
A
-
A
Q
---
D
F
F
S
T
C
R
S
P
E
A
C
C
E
L
T
L
Q
P
L
R
R
F
-
P
-
L
D
A
A
I
I
F
S
D
I
L
V
V
P
Q
A
L
G
M
E
V
T
M
V
P
G
K
G
P
S
F
P
E
P
L
R
E
E
Q
D
L
E
R
L
RD
P
E
V
V
A
--
S
E
L
G
Y
V
F
Q
A
I
T
L
T
R
Q
R
L
----
A
-----
G
R
-
V
P
L
I
G
F
A
G
A
P
W
T
L
M
T
Y
M
V
------
E
------
G
--
G
---
G
---
S
S
T
M
A
Q
A
K
R
-
W
L
Y
Q
R
P
Q
A
S
H
Q
L
L
R
I
L
T
D
A
L
V
P
Y
L
V
G
Q
V
V
A
G
A
Q
A
L
Q
L
F
E
S
H
A
G
H
L
G
P
Q
L
F
N
K
F
A
L
P
Y
I
R
D
V
A
K
Q
V
K
A
R
L
R
E
A
-
G
-
L
----
A
----
P
--
V
P
M
I
I
F
A
K
D
G
H
F
A
L
E
E
L
A
Q
A
G
Y
E
V
V
G
L
D
W
T
V
A
P
K
K
A
R
E
C
-
V
G
K
T
V
T
L
Q
G
N
L
D
P
C
A
L
Y
A
S
-
E
E
E
I
G
Q
L
V
K
Q
M
L
D
D
F
G
P
H
----
R
Y
I
A
N
L
G
H
G
L
Y
P
D
M
D
P
E
H
V
G
A
F
V
D
A
V
H
K
H
S
-----
36
HHSearch
69.66
63%
-15
- C1 -
-
3CYV
-
DCUP_SHIFL
A:
[3-352]
--
E
L
K
N
D
R
Y
L
R
A
L
L
R
Q
P
V
D
V
T
P
V
W
M
M
R
Q
A
G
R
Y
L
P
E
Y
K
A
T
R
A
Q
A
-
G
---
D
F
M
S
L
C
K
N
A
E
L
A
C
E
V
T
L
Q
P
L
R
R
Y
-
P
-
L
D
A
A
I
L
F
S
D
I
L
T
V
P
D
A
M
G
L
G
L
Y
F
E
A
G
E
G
P
R
F
T
S
P
V
T
C
K
A
D
V
D
K
L
--
P
I
P
D
P
-
E
D
E
L
G
Y
V
M
N
A
V
R
T
I
R
H
E
L
----
K
-----
G
E
-
V
P
L
I
G
F
S
G
S
P
W
T
L
A
T
Y
M
V
------
E
GGSSKA
F
--
T
---
V
---
I
------
K
K
-
M
M
Y
A
D
P
Q
A
L
H
A
L
L
D
K
L
A
K
S
V
T
L
Y
L
N
A
Q
I
K
A
G
A
Q
A
V
M
I
F
D
T
W
G
G
V
L
T
G
R
D
Y
Q
Q
F
S
L
Y
Y
M
H
K
I
V
D
G
L
L
---
R
-----
E
NDG
R
R
----
V
--
P
V
T
L
F
T
K
G
G
-
G
Q
W
L
E
A
M
A
E
T
G
C
D
A
L
G
L
D
W
T
T
D
I
A
D
A
R
R
R
V
G
N
-
K
V
A
L
Q
G
N
M
D
P
S
M
L
-
Y
A
P
P
A
R
I
E
E
E
V
A
T
I
L
A
G
F
G
---
H
G
E
G
H
V
F
N
L
G
H
G
I
H
Q
D
V
P
P
E
H
A
G
V
F
V
E
A
V
H
R
L
S
E
Q
Y
--
6
PsiBlast_PDB
69.66
47%
-39
- C1 -
-
3GW3
-
DCUP_HUMAN
A:
[14-361]
---
L
K
N
D
T
F
L
R
A
A
W
G
E
E
T
D
Y
T
P
V
W
C
M
R
Q
A
G
R
Y
L
P
E
F
R
E
T
R
-
A
-
A
Q
---
D
F
F
S
T
C
R
S
P
E
A
C
C
E
L
T
L
Q
P
L
R
R
F
-
P
-
L
D
A
A
I
I
F
S
D
I
L
V
V
P
Q
A
L
G
M
E
V
T
M
V
P
G
K
G
P
S
F
P
E
P
L
R
E
E
Q
D
L
E
R
L
RD
P
E
V
V
A
--
S
E
L
G
Y
V
F
Q
A
I
T
L
T
R
Q
R
L
----
A
-----
G
R
-
V
P
L
I
G
F
A
G
A
P
W
T
L
M
T
Y
M
V
------
E
------
G
--
G
---
G
---
S
S
T
M
A
Q
A
K
R
-
W
L
Y
Q
R
P
Q
A
S
H
Q
L
L
R
I
L
T
D
A
L
V
P
Y
L
V
G
Q
V
V
A
G
A
Q
A
L
Q
L
F
E
S
H
A
G
H
L
G
P
Q
L
F
N
K
F
A
L
P
Y
I
R
D
V
A
K
Q
V
K
A
R
L
R
E
A
-
G
-
L
----
A
----
P
--
V
P
M
I
I
F
A
K
D
G
H
F
A
L
E
E
L
A
Q
A
G
Y
E
V
V
G
L
D
W
T
V
A
P
K
K
A
R
E
C
-
V
G
N
T
V
T
L
Q
G
N
L
D
P
C
A
L
Y
A
S
-
E
E
E
I
G
Q
L
V
K
Q
M
L
D
D
F
G
P
H
----
R
Y
I
A
N
L
G
H
G
L
Y
P
D
M
D
P
E
H
V
G
A
F
V
D
A
V
H
K
H
S
-----
23
PsiBlast_CBE
69.63
47%
-39
- C1 -
-
2Q71
1
DCUP_HUMAN
A:
[4-351]
---
L
K
N
D
T
F
L
R
A
A
W
G
E
E
T
D
Y
T
P
V
W
C
M
R
Q
A
G
R
Y
L
P
E
F
R
E
T
R
-
A
-
A
Q
---
D
F
F
S
T
C
R
S
P
E
A
C
C
E
L
T
L
Q
P
L
R
R
F
-
P
-
L
D
A
A
I
I
F
S
D
I
L
V
V
P
Q
A
L
G
M
E
V
T
M
V
P
G
K
G
P
S
F
P
E
P
L
R
E
E
Q
D
L
E
R
L
RD
P
E
V
V
A
--
S
E
L
G
Y
V
F
Q
A
I
T
L
T
R
Q
R
L
----
A
-----
G
R
-
V
P
L
I
G
F
A
G
A
P
W
T
L
M
T
Y
M
V
------
E
------
R
--
G
---
G
---
S
S
T
M
A
Q
A
K
R
-
W
L
Y
Q
R
P
Q
A
S
H
Q
L
L
R
I
L
T
D
A
L
V
P
Y
L
V
G
Q
V
V
A
G
A
Q
A
L
Q
L
F
E
S
H
A
G
H
L
G
P
Q
L
F
N
K
F
A
L
P
Y
I
R
D
V
A
K
Q
V
K
A
R
L
R
E
A
-
G
-
L
----
A
----
P
--
V
P
M
I
I
F
A
K
D
G
H
F
A
L
E
E
L
A
Q
A
G
Y
E
V
V
G
L
D
W
T
V
A
P
K
K
A
R
E
C
-
V
G
K
T
V
T
L
Q
G
N
L
D
P
C
A
L
Y
A
S
-
E
E
E
I
G
Q
L
V
K
Q
M
L
D
D
F
G
P
H
----
R
Y
I
A
N
L
G
H
G
L
Y
P
D
M
D
P
E
H
V
G
A
F
V
D
A
V
H
K
H
S
-----
9
PsiBlast_PDB
69.29
47%
-39
- C1 -
-
1R3Y
1
DCUP_HUMAN
A:
[14-361]
---
L
K
N
D
T
F
L
R
A
A
W
G
E
E
T
D
Y
T
P
V
W
C
M
R
Q
A
G
R
Y
L
P
E
F
R
E
T
R
-
A
-
A
Q
---
D
F
F
S
T
C
R
S
P
E
A
C
C
E
L
T
L
Q
P
L
R
R
F
-
P
-
L
D
A
A
I
I
F
S
D
I
L
V
V
P
Q
A
L
G
M
E
V
T
M
V
P
G
K
G
P
S
F
P
E
P
L
R
E
E
Q
D
L
E
R
L
RD
P
E
V
V
A
--
S
E
L
G
Y
V
F
Q
A
I
T
L
T
R
Q
R
L
----
A
-----
G
R
-
V
P
L
I
G
F
A
G
A
P
W
T
L
M
T
Y
M
V
------
E
------
G
--
G
---
G
---
S
S
T
M
A
Q
A
K
R
-
W
L
Y
Q
R
P
Q
A
S
H
Q
L
L
R
I
L
T
D
A
L
V
P
Y
L
V
G
Q
V
V
A
G
A
Q
A
L
Q
L
F
E
S
H
A
G
H
L
G
P
Q
L
F
N
K
F
A
L
P
Y
I
R
D
V
A
K
Q
V
K
A
R
L
R
E
A
-
G
-
L
----
A
----
P
--
V
P
M
I
I
F
A
K
D
G
H
F
A
L
E
E
L
A
Q
A
G
Y
E
V
V
G
L
D
W
T
V
A
P
K
K
A
R
E
C
-
V
G
K
T
V
T
L
Q
G
N
L
D
P
C
A
L
Y
A
S
-
E
E
E
I
G
Q
L
V
K
Q
M
L
D
D
F
G
P
H
----
R
Y
I
A
N
L
G
H
G
L
Y
P
D
M
D
P
E
H
V
G
A
F
V
D
A
V
H
K
H
S
-----
16
PsiBlast_PDB
69.24
47%
-37
- C1 -
-
1R3W
1
DCUP_HUMAN
A:
[14-361]
---
L
K
N
D
T
F
L
R
A
A
W
G
E
E
T
D
Y
T
P
V
W
C
M
R
Q
A
G
R
Y
L
P
E
F
R
E
T
R
-
A
-
A
Q
---
D
F
F
S
T
C
R
S
P
E
A
C
C
E
L
T
L
Q
P
L
R
R
F
-
P
-
L
D
A
A
I
I
F
S
D
I
L
V
V
P
Q
A
L
G
M
E
V
T
M
V
P
G
K
G
P
S
F
P
E
P
L
R
E
E
Q
D
L
E
R
L
RD
P
E
V
V
A
--
S
E
L
G
Y
V
F
Q
A
I
T
L
T
R
Q
R
L
----
A
-----
G
R
-
V
P
L
I
G
F
A
G
A
P
W
T
L
M
T
F
M
V
------
E
------
G
--
G
---
G
---
S
S
T
M
A
Q
A
K
R
-
W
L
Y
Q
R
P
Q
A
S
H
Q
L
L
R
I
L
T
D
A
L
V
P
Y
L
V
G
Q
V
V
A
G
A
Q
A
L
Q
L
F
E
S
H
A
G
H
L
G
P
Q
L
F
N
K
F
A
L
P
Y
I
R
D
V
A
K
Q
V
K
A
R
L
R
E
A
-
G
-
L
----
A
----
P
--
V
P
M
I
I
F
A
K
D
G
H
F
A
L
E
E
L
A
Q
A
G
Y
E
V
V
G
L
D
W
T
V
A
P
K
K
A
R
E
C
-
V
G
K
T
V
T
L
Q
G
N
L
D
P
C
A
L
Y
A
S
-
E
E
E
I
G
Q
L
V
K
Q
M
L
D
D
F
G
P
H
----
R
Y
I
A
N
L
G
H
G
L
Y
P
D
M
D
P
E
H
V
G
A
F
V
D
A
V
H
K
H
S
-----
20
PsiBlast_PDB
69.07
47%
-39
- C1 -
-
1R3T
1
DCUP_HUMAN
A:
[14-361]
---
L
K
N
D
T
F
L
R
A
A
W
G
E
E
T
D
Y
T
P
V
W
C
M
R
Q
A
G
R
Y
L
P
E
F
R
E
T
R
-
A
-
A
Q
---
D
F
F
S
T
C
R
S
P
E
A
C
C
E
L
T
L
Q
P
L
R
R
F
-
P
-
L
D
A
A
I
I
F
S
G
I
L
V
V
P
Q
A
L
G
M
E
V
T
M
V
P
G
K
G
P
S
F
P
E
P
L
R
E
E
Q
D
L
E
R
L
RD
P
E
V
V
A
--
S
E
L
G
Y
V
F
Q
A
I
T
L
T
R
Q
R
L
----
A
-----
G
R
-
V
P
L
I
G
F
A
G
A
P
W
T
L
M
T
Y
M
V
------
E
------
G
--
G
---
G
---
S
S
T
M
A
Q
A
K
R
-
W
L
Y
Q
R
P
Q
A
S
H
Q
L
L
R
I
L
T
D
A
L
V
P
Y
L
V
G
Q
V
V
A
G
A
Q
A
L
Q
L
F
E
S
H
A
G
H
L
G
P
Q
L
F
N
K
F
A
L
P
Y
I
R
D
V
A
K
Q
V
K
A
R
L
R
E
A
-
G
-
L
----
A
----
P
--
V
P
M
I
I
F
A
K
D
G
H
F
A
L
E
E
L
A
Q
A
G
Y
E
V
V
G
L
D
W
T
V
A
P
K
K
A
R
E
C
-
V
G
K
T
V
T
L
Q
G
N
L
D
P
C
A
L
Y
A
S
-
E
E
E
I
G
Q
L
V
K
Q
M
L
D
D
F
G
P
H
----
R
Y
I
A
N
L
G
H
G
L
Y
P
D
M
D
P
E
H
V
G
A
F
V
D
A
V
H
K
H
S
-----
19
PsiBlast_PDB
69.01
47%
-38
- C1 -
-
1R3S
1
DCUP_HUMAN
A:
[14-361]
---
L
K
N
D
T
F
L
R
A
A
W
G
E
E
T
D
Y
T
P
V
W
C
M
R
Q
A
G
R
Y
L
P
E
F
R
E
T
R
-
A
-
A
Q
---
D
F
F
S
T
C
R
S
P
E
A
C
C
E
L
T
L
Q
P
L
R
R
F
-
P
-
L
D
A
A
I
I
F
S
G
I
L
V
V
P
Q
A
L
G
M
E
V
T
M
V
P
G
K
G
P
S
F
P
E
P
L
R
E
E
Q
D
L
E
R
L
RD
P
E
V
V
A
--
S
E
L
G
Y
V
F
Q
A
I
T
L
T
R
Q
R
L
----
A
-----
G
R
-
V
P
L
I
G
F
A
G
A
P
W
T
L
M
T
Y
M
V
------
E
------
G
--
G
---
G
---
S
S
T
M
A
Q
A
K
R
-
W
L
Y
Q
R
P
Q
A
S
H
Q
L
L
R
I
L
T
D
A
L
V
P
Y
L
V
G
Q
V
V
A
G
A
Q
A
L
Q
L
F
E
S
H
A
G
H
L
G
P
Q
L
F
N
K
F
A
L
P
Y
I
R
D
V
A
K
Q
V
K
A
R
L
R
E
A
-
G
-
L
----
A
----
P
--
V
P
M
I
I
F
A
K
D
G
H
F
A
L
E
E
L
A
Q
A
G
Y
E
V
V
G
L
D
W
T
V
A
P
K
K
A
R
E
C
-
V
G
K
T
V
T
L
Q
G
N
L
D
P
C
A
L
Y
A
S
-
E
E
E
I
G
Q
L
V
K
Q
M
L
D
D
F
G
P
H
----
R
Y
I
A
N
L
G
H
G
L
Y
P
D
M
D
P
E
H
V
G
A
F
V
D
A
V
H
K
H
S
-----
7
PsiBlast_PDB
68.56
47%
-37
- C1 -
-
1URO
1
DCUP_HUMAN
A:
[14-361]
---
L
K
N
D
T
F
L
R
A
A
W
G
E
E
T
D
Y
T
P
V
W
C
M
R
Q
A
G
R
Y
L
P
E
F
R
E
T
R
-
A
-
A
Q
---
D
F
F
S
T
C
R
S
P
E
A
C
C
E
L
T
L
Q
P
L
R
R
F
-
P
-
L
D
A
A
I
I
F
S
D
I
L
V
V
P
Q
A
L
G
M
E
V
T
M
V
P
G
K
G
P
S
F
P
E
P
L
R
E
E
Q
D
L
E
R
L
RD
P
E
V
V
A
--
S
E
L
G
Y
V
F
Q
A
I
T
L
T
R
Q
R
L
----
A
-----
G
R
-
V
P
L
I
G
F
A
G
A
P
W
T
L
M
T
Y
M
V
------
E
------
G
--
G
---
G
---
S
S
T
M
A
Q
A
K
R
-
W
L
Y
Q
R
P
Q
A
S
H
Q
L
L
R
I
L
T
D
A
L
V
P
Y
L
V
G
Q
V
V
A
G
A
Q
A
L
Q
L
F
E
S
H
A
G
H
L
G
P
Q
L
F
N
K
F
A
L
P
Y
I
R
D
V
A
K
Q
V
K
A
R
L
R
E
A
-
G
-
L
----
A
----
P
--
V
P
M
I
I
F
A
K
D
G
H
F
A
L
E
E
L
A
Q
A
G
Y
E
V
V
G
L
D
W
T
V
A
P
K
K
A
R
E
C
-
V
G
K
T
V
T
L
Q
G
N
L
D
P
C
A
L
Y
A
S
-
E
E
E
I
G
Q
L
V
K
Q
M
L
D
D
F
G
P
H
----
R
Y
I
A
N
L
G
H
G
L
Y
P
D
M
D
P
E
H
V
G
A
F
V
D
A
V
H
K
H
S
-----
40
HHSearch
67.83
45%
-28
* C1 *
-
1R3S
1
DCUP_HUMAN
A:
[11-365]
F
P
E
L
K
N
D
T
F
L
R
A
A
W
G
E
E
T
D
Y
T
P
V
W
C
M
R
Q
A
G
R
Y
L
P
E
F
R
E
T
R
-
A
A
-
Q
---
D
F
F
S
T
C
R
S
P
E
A
C
C
E
L
T
L
Q
P
L
R
R
F
-
P
-
L
D
A
A
I
I
F
S
G
I
L
V
V
P
Q
A
L
G
M
E
V
T
M
V
P
G
K
G
P
S
F
P
E
P
L
R
E
E
Q
D
L
E
R
L
--
R
D
P
E
V
V
A
S
E
L
G
Y
V
F
Q
A
I
T
L
T
R
Q
R
L
----
A
-----
G
R
-
V
P
L
I
G
F
A
G
A
P
W
T
L
M
T
Y
M
V
E
GGGSS
T
------
M
--
A
---
Q
---
A
------
K
R
-
W
L
Y
Q
R
P
Q
A
S
H
Q
L
L
R
I
L
T
D
A
L
V
P
Y
L
V
G
Q
V
V
A
G
A
Q
A
L
Q
L
F
E
S
H
A
G
H
L
G
P
Q
L
F
N
K
F
A
L
P
Y
I
R
D
V
A
K
Q
V
K
---
A
R
L
R
E
-
A
----
G
----
L
A
P
V
P
M
I
I
F
A
K
D
G
H
F
A
L
E
E
L
A
Q
A
G
Y
E
V
V
G
L
D
W
T
V
A
P
K
K
A
R
E
C
V
G
K
-
T
V
T
L
Q
G
N
L
D
P
C
A
L
-
Y
A
S
E
E
E
I
G
Q
L
V
K
Q
M
L
D
D
F
G
----
P
H
R
Y
I
A
N
L
G
H
G
L
Y
P
D
M
D
P
E
H
V
G
A
F
V
D
A
V
H
K
H
S
R
L
L
R
-