@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 : Q3XXS0: (2018-01-05 )
MVQENIVIEMQNITKEFGTFKANDNINLQVKAGEIHALLGENGAGKSTLMNVLSGLLEPTSGKILMRGKEVKITSPTKANQLGIGMVHQHFMLVDAFTVTENIVLGSEPSRAGMLDHKKARKEIQKVSEQYGLSVNPDAYVRDISVGMEQRVEILKTLYRGADVLIFDEPTAVLTPQEIDELIVIMKELVKEGKSIILITHKLDEIKAVADRCTVIRRGKGIGTVNVKDVTSQQLADMMVGRTVSFKTMKKEAKPQEVVLSIENLVVKENRGLEAVKNLNLEVRAGEVLGIAGIDGNGQSELIQALTGLRKAESGHIKLKGEDITNKKPRKITEHGVGHVPEDRHKYGLVLDMTLSENIALQTYHQKPYSKNGMLNYSVMNEHARELIEEYDVRTTNELVPAKALSGGNQQKAIIAREVDRDPDLLIVANPTRGLDVGAIEFIHKRLIEQRDKYKAVLLISFELEEILNVSDRIAVIHEGEIVGIVDPKETSENELGLLMAGYTLEEARKELEKGAGAHE
Atome Classification :
(22 SA)
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------.........10......-.----.---20........30........40........50........60........70.....---...80.--.----......90....----....100......-.110----------------...----..-..---120----------.........130-.--.......140.......150.......160.......170.......180.......190.-..-.....200.......210.......220...-....230.-----------------------.------------------------.---------.--------------------------------------.--------------------------------------..----------------------------------------------------------------240-----.-------------------------------------------------.---------------.---------------...--------------------------------------------------.----------------.---------------------------------------------------------------------------------------250--------------------------------------------------------------------------------------------------.--.----------------------------------------------------------.-----------......260.......270-........280.......290.........300......-.310.......320.......330.......340.......350.......360.......370.......380.......390--.-.-.....400.......410.......420.......430.......440.......450.......460.......470.......480.......490.......500.......510.......520-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MVQE
N
I
V
I
E
M
Q
N
I
T
K
E
F-G----T---FKAND
N
I
N
L
Q
V
KA
G
E
I
H
A
L
LGENGA
G
K
S
T
L
M
N
V
L
S
G
L
LEPTS
G
K
I
L
M
RG
K
E
V
K
ITSP---TKAN
Q
L
--
G
----
I
G
M
V
H
Q
H
F
M
L
V
D
----
A
F
T
V
TE
N
I
VLGSE-PSRA----------------GML----
D
H
-
K
K
---
A
------------
R
K
E
I
Q
K
V
S
E
Q
Y--G--LSVNP
D
A
Y
V
R
D
I
S
V
G
M
E
Q
R
V
E
I
L
K
T
L
YRGA
D
V
L
I
FDEPTAVL
T
P
Q
E
I
D
E
L
I
V
I
M
K
E
L
V
K-E-G
K
-
S
I
I
L
I
TH
K
L
D
E
I
K
A
V
A
D
R
C
T
V
IRRGKG
I
G
T
V
-
N
V
K
D
V
T
S
Q
-----------------------
Q
------------------------
L
---------
A
--------------------------------------
D
--------------------------------------
M
M
----------------------------------------------------------------VG------R-------------------------------------------------T---------------V---------------S
F
K
--------------------------------------------------
T
----------------
M
---------------------------------------------------------------------------------------K----------------------------------------------------------------------------------------------------K--E----------------------------------------------------------A-----------
K
P
Q
E
V
V
L
S
I
E
N
L
V
VKENR--G
L
E
A
V
K
NL
N
L
E
V
R
A
G
E
V
L
G
--
I
AGIDGN
G
Q
S
E
L
I
Q
A
L
T
G-LRKAES
G
H
I
K
L
KGEDITNKKPR
K
I
T
EHGVGHVPEDRHKY
G
L
V
L
D
M
TLSEN
I
A
L
Q
T
YHQKPYSKNG
M
L
N
Y
S
V
M
N
E
H
A
R
E
L
I
E
EYD--V-R-TTNELVPAKALSGGNQ
Q
K
A
I
I
A
REVDRDP
D
L
L
I
V
ANPTRGL
D
V
G
A
I
E
F
I
H
K
R
L
I
E
Q
RDK
Y
K
A
V
L
L
I
S
F
E
L
E
E
I
LNVS
D
R
I
A
V
I
HEG
E
I
V
G
I
VDPKETSENE
L
G
L
L
MAGY
T
L
E
E
A
R
K
E
L
E
KGAGAHE-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
73
HHSearch
63.71
34%
-107
* C4 *
-
4YER
2
?
A:
[3-253]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
D
I
I
V
V
E
N
L
V
K
K
F
-
G
----
D
---
F
E
A
V
K
G
V
S
F
S
V
K
K
G
E
I
F
A
F
L
G
P
N
G
A
G
K
T
T
T
I
H
M
L
T
T
L
L
K
P
T
S
G
K
A
W
V
A
G
H
D
V
L
K
E
P
-----
R
E
V
R
R
--
K
----
I
G
I
V
F
Q
D
Q
S
L
D
R
----
E
L
T
A
Y
E
N
M
Y
I
H
G
K
-
I
Y
-------------------
G
Y
----
G
G
-
E
K
---
L
------------
K
K
R
I
L
E
L
L
E
F
V
--
E
--
L
L
E
F
K
D
K
P
V
K
T
F
S
G
G
M
A
R
R
L
E
I
A
R
S
L
I
H
E
P
E
V
L
F
L
D
E
P
T
I
G
L
D
P
H
T
R
A
H
M
W
E
Y
I
S
K
M
K
K
E
H
-
N
M
-
T
I
F
L
T
T
H
Y
M
D
E
A
E
Q
L
A
D
R
V
A
I
I
D
H
G
K
I
I
A
L
G
-
T
P
T
E
L
K
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
61.28
37%
-110
- C4 -
-
2IT1
-
?
A:
[4-210]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
K
L
E
N
I
V
K
K
F
-
G
----
N
---
F
T
A
L
N
N
I
N
L
K
I
K
D
G
E
F
M
A
L
L
G
P
S
G
S
G
K
S
T
L
L
Y
T
I
A
G
I
Y
K
P
T
S
G
K
I
Y
F
D
E
K
D
V
T
E
L
P
P
---
K
D
R
N
---------
V
G
L
V
F
Q
N
W
A
L
Y
P
----
H
M
T
V
Y
K
N
I
A
F
P
L
E
-
L
R
K
A
-----------------------
P
R
-
E
E
---
I
------------
D
K
K
V
R
E
V
A
K
M
L
--
H
--
I
D
K
L
L
N
R
Y
P
W
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
V
K
E
P
E
V
L
L
L
D
E
P
L
S
N
L
D
A
L
L
R
L
E
V
R
A
E
L
K
R
L
Q
K
-
E
L
G
I
-
T
T
V
Y
V
T
H
D
Q
A
E
A
L
A
M
A
D
R
I
A
V
I
R
E
G
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
51
HHSearch
59.52
22%
51
- C4 -
-
5KO2
-
MDR1A_MOUSE
A:
[385-1225]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
G
N
L
E
F
K
N
I
H
F
S
Y
-
P
----
S
RKE
V
Q
I
L
K
G
L
N
L
K
V
K
S
G
Q
T
V
A
L
V
G
N
S
G
C
G
K
S
T
T
V
Q
L
M
Q
R
L
Y
D
P
L
D
G
M
V
S
I
D
G
Q
D
I
R
T
I
N
V
----
R
Y
L
R
E
--
I
----
I
G
V
V
S
Q
E
P
V
L
F
A
----
T
-
T
I
A
E
N
I
R
Y
G
R
E
-
D
V
T
M
----------------
D
E
I
----
E
K
-
A
V
---
K
------------
E
A
N
A
Y
D
F
I
M
K
L
--
P
HQ
F
D
T
L
V
G
E
R
G
A
Q
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
V
R
N
P
K
I
L
L
L
D
Q
A
T
S
A
L
D
T
E
S
E
A
V
V
Q
A
A
L
D
K
A
R
--
E
-
G
R
-
T
T
I
V
I
A
H
R
L
S
T
V
R
N
-
A
D
V
I
A
G
F
D
G
G
V
I
V
E
Q
G
-
N
H
D
E
L
M
R
E
KG
I
Y
F
K
L
V
M
T
Q
TD
V
P
P
A
------
S
------------------------
F
---------
W
R
I
L
K
L
N
STE
W
P
Y
F
V
V
G
I
F
C
A
I
I
N
G
G
L
Q
P
A
F
S
V
I
F
S
K
V
V
G
--------------------------------------
V
F
T
NGGPPET
Q
R
Q
N
S
N
L
F
S
L
L
F
L
I
L
G
I
I
S
F
I
T
F
F
L
Q
G
F
T
F
G
K
A
G
E
I
L
T
K
R
L
R
Y
M
V
F
K
S
M
L
R
QD
V
S
W
F
D
DP----
K
N------------------------------------------------
T
---------------
T
G
A
L
T
T
R
L
A
NDAAQ
V
K
G
A
T
G
S
R
L
A
V
I
F
Q
N
I
A
N
L
G
T
G
I
I
I
S
L
I
Y
G
W
Q
L
T
L
L
L
L
A
I
V
P
I
I
A
I
A
G
V
V
E
M
K
M
L
S
G
Q
A
L
------------
K
D
K
K
E
L
E
G
S
G
K
I
A
T
E
A
I
E
N
F
R
T
V
V
S
L
TR------------------------------------------------------------
E
Q
K
F
E
T
M
Y
A
Q
S
L
Q
I
P
Y
R
N
A
M
K
K
A
H
V
F
G
I
T
F
S
F
T
Q
A
M
M
Y
F
S
Y
A
A
C
F
R
F
G
A
Y
L
V
T
Q
QLMT
F
E
N
V
L
L
V
F
S
A
I
V
F
G
A
M
A
V
G
Q
V
S
S
F
APD
Y
A
K
A
T
V
S
A
S
H
I
I
R
I
I
E
K
T-
P
----------------------------------------------------------
E
IDSYSTQGLKP
N
M
L
E
G
N
V
Q
F
S
G
V
V
F
N
Y
P
T
RP
S
I
P
V
L
Q
G
L
S
L
E
V
K
K
G
Q
T
L
A
--
L
V
G
S
S
G
C
G
K
S
T
V
V
Q
L
L
E
R
-
F
Y
D
P
M
A
G
S
V
F
L
D
G
K
E
I
K
Q
L
N
V
Q
-
W
L
R
A
Q
L
G
I
V
S
Q
E
P
----
I
L
F
D
C
S
I
A
E
N
I
A
Y
G
D
N
S
R
--
V
V
S
Y
E
E
I
V
R
A
A
K
E
A
N
I
H
Q
F
I
D
S
L
P
--
D
K
Y
-
N
T
R
V
G
D
K
G
T
Q
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
V
R
Q
P
H
I
L
L
L
D
Q
A
T
S
A
L
D
T
E
S
E
K
V
V
Q
E
A
L
D
K
A
R
E
-
G
R
T
C
I
V
I
A
H
R
L
S
T
I
Q
N
-
A
D
L
I
V
V
I
Q
N
G
K
V
K
E
H
G
T
H
Q
Q
L
L
A
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
52
HHSearch
59.12
22%
50
- C4 -
-
5KO2
-
MDR1A_MOUSE
B:
[385-1225]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
G
N
L
E
F
K
N
I
H
F
S
Y
-
P
----
S
RKE
V
Q
I
L
K
G
L
N
L
K
V
K
S
G
Q
T
V
A
L
V
G
N
S
G
C
G
K
S
T
T
V
Q
L
M
Q
R
L
Y
D
P
L
D
G
M
V
S
I
D
G
Q
D
I
R
T
I
N
V
----
R
Y
L
R
E
--
I
----
I
G
V
V
S
Q
E
P
V
L
F
A
-----
T
T
I
A
E
N
I
R
Y
G
R
E
-
D
V
T
M
----------------
D
E
I
----
E
K
-
A
V
---
K
------------
E
A
N
A
Y
D
F
I
M
K
L
PH
Q
--
F
D
T
L
V
G
E
R
G
A
Q
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
V
R
N
P
K
I
L
L
L
D
Q
A
T
S
A
L
D
T
E
S
E
A
V
V
Q
A
A
L
D
K
A
R
--
E
-
G
R
-
T
T
I
V
I
A
H
R
L
S
T
V
R
N
-
A
D
V
I
A
G
F
D
G
G
V
I
V
E
Q
G
-
N
H
D
E
L
M
R
E
KGIYFKLVMTQTDVPPA------
S
------------------------
F
---------
W
RILKLNSTEWPYFVVGIFCAIINGGLQPAFSVIFSKVV
G
--------------------------------------
V
F
TNGGPPETQRQNSNLFSLLFLILGIISFITFFLQGFTFGKAGEILTKRLRYMVFKSMLRQDVSW
F
D
DP----
K
N------------------------------------------------
T
---------------
T
GALTTRLANDAAQVK
G
A
T
GSRLAVIFQNIANLGTGIIISLIYGWQLTLLLLAIVPIIAIAGVVEMKML
S
GQAL------------
K
DKKELEGSGKIATEAIENFRTVVSLTR------------------------------------------------------------
E
QKFETMYAQSLQIPYRNAMKKAHVFGITFSFTQAMMYFSYAACFRFGAYLVTQQLMTFENVLLVFSAIVFGAMAVGQVSSFAPDYAKATVSASHIIRIIE
K
T-
P
----------------------------------------------------------
E
IDSYSTQGLKP
N
M
L
E
G
N
V
Q
F
S
G
V
V
F
N
Y
P
T
RP
S
I
P
V
L
Q
G
L
S
L
E
V
K
K
G
Q
T
L
A
--
L
V
G
S
S
G
C
G
K
S
T
V
V
Q
L
L
E
R
-
F
Y
D
P
M
A
G
S
V
F
L
D
G
K
E
I
K
Q
L
N
V
Q
-
W
L
R
A
Q
L
G
I
V
S
Q
E
P
----
I
L
F
D
C
S
I
A
E
N
I
A
Y
G
D
N
S
R
--
V
V
S
Y
E
E
I
V
R
A
A
K
E
A
N
I
H
Q
F
I
D
S
L
P
--
D
-
K
Y
N
T
R
V
G
D
K
G
T
Q
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
V
R
Q
P
H
I
L
L
L
D
Q
A
T
S
A
L
D
T
E
S
E
K
V
V
Q
E
A
L
D
K
A
R
E
-
G
R
T
C
I
V
I
A
H
R
L
S
T
I
Q
N
-
A
D
L
I
V
V
I
Q
N
G
K
V
K
E
H
G
T
H
Q
Q
L
L
A
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
53
HHSearch
58.15
23%
34
- C2 -
-
4F4C
2
PGP1_CAEEL
A:
[413-1305]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
G
D
I
T
V
E
N
V
H
F
T
Y
-
P
----
S
RPD
V
P
I
L
R
G
M
N
L
R
V
N
A
G
Q
T
V
A
L
V
G
S
S
G
C
G
K
S
T
I
I
S
L
L
L
R
Y
Y
D
V
L
K
G
K
I
T
I
D
G
V
D
V
R
D
I
N
L
----
E
F
L
R
K
--
N
----
V
A
V
V
S
Q
E
P
A
L
F
N
-----
C
T
I
E
E
N
I
S
L
G
K
E
-
G
I
T
R
----------------
E
E
M
----
V
A
-
A
C
---
K
------------
M
A
N
A
E
K
F
I
K
T
L
PN
G
--
Y
N
T
L
V
G
D
R
G
T
Q
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
V
R
N
P
K
I
L
L
L
D
E
A
T
S
A
L
D
A
E
S
E
G
I
V
Q
Q
A
L
D
K
A
A
--
K
-
G
R
-
T
T
I
I
I
A
H
R
L
S
T
I
R
N
-
A
D
L
I
I
S
C
K
N
G
Q
V
V
E
V
G
-
D
H
R
A
L
M
A
Q
QG
L
Y
Y
D
L
V
T
A
Q
T
F
T
D
A
V
D
S
A
A
E
G-ER
I
G
K
D
A
L
S
R
L
K
Q
E
L
E
ENNAQKTN
L
---------
F
--------------------------------------
E
I
L
Y
H
A
RPH
A
L
S
L
F
I
G
M
S
T
A
T
I
G
G
F
I
Y
P
T
Y
S
V
F
F
T
S
F
M
N
V
F
----------------------------------------------------------------
A
G
NPADFL
S
Q
G
H
F
W
A
L
M
F
L
V
L
A
A
A
Q
G
I
C
S
F
L
M
T
F
F
M
G
I
A
S
E
S
L
T
R
D
L
R
N
K
L
F
R
N
V
L
S
Q
H
---------------
I
---------------
G
F
F
--------------------------------------------------
D
SPQNA-----------
S
G
K
I
S
T
R
L
A
T
D
V
P
N
L
R
T
A
I
D
F
R
F
S
T
V
I
T
T
L
V
S
M
V
A
G
I
G
L
A
F
F
Y
G
W
Q
M
A
L
L
I
I
A
I
L
P
I
V
A
F
G
Q
Y
L
R
G
RRFTGKNVKSA
S
E
F
A
D
S
G
K
I
A
I
E
A
I
E
N
V
R
T
V
Q
A
L
AR
E
D
T
F
Y
E
N
F
C
E
K
L
D
I
P
H
K
E
A
I
K
E
A
F
I
Q
G
L
S
Y
G
C
A
S
S
V
L
Y
L
L
N
T
C
A
Y
R
M
G
L
A
L
I
I
T---------------------------------
D
PP
T
MQ
P
M
R
V
L
R
V
M
Y
A
I
T
I
S
T
S
TLGFAT
S
Y
F
P
E
Y
A
K
A
T
F
A
G
G
I
I
F
G
M
L
R
KISKIDSLSLAGE
K
-----------
K
K
L
Y
G
K
V
I
F
K
N
V
R
F
A
Y
P
E
RP
E
I
E
I
L
K
G
L
S
F
S
V
E
P
G
Q
T
L
A
--
L
V
G
P
S
G
C
G
K
S
T
V
V
A
L
L
E
R
-
F
Y
D
T
L
G
G
E
I
F
I
D
G
S
E
I
K
T
L
N
P
E
-
H
T
R
S
Q
I
A
I
V
S
Q
E
P
T
----
L
F
D
C
S
I
A
E
N
I
I
Y
G
L
D
P
S
-
S
V
T
M
A
-
Q
V
E
E
A
A
R
L
A
N
I
H
N
F
I
A
E
L
P
EG
F
-
E
-
T
-
R
V
G
D
R
G
T
Q
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
V
R
N
P
K
I
L
L
L
D
E
A
T
S
A
L
D
T
E
S
E
K
V
V
Q
E
A
L
D
R
A
R
-
E
G
R
T
C
I
V
I
A
H
R
L
N
T
V
M
N
-
A
D
C
I
A
V
V
S
N
G
T
I
I
E
K
G
T
H
T
Q
L
M
S
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
57.95
30%
-114
- C4 -
-
4U00
1
?
A:
[4-215]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
I
R
I
R
N
L
H
K
W
F
-
G
----
P
---
L
H
V
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
Q
E
G
E
V
V
V
D
G
L
S
V
K
D
D
R
A
---
L
R
E
I
R
R
--
E
----
V
G
M
V
F
Q
Q
F
N
L
F
P
----
H
M
T
V
L
E
N
V
T
L
A
---
P
M
R
V
----------------
R
R
W
----
P
R
-
E
K
---
A
------------
E
K
K
A
L
E
L
L
E
R
V
--
G
--
I
L
D
Q
A
R
K
Y
P
A
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
D
V
M
R
D
L
A
Q
-
G
-
G
M
-
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
A
D
R
V
V
F
M
D
G
G
Q
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
55.85
33%
0
- C4 -
-
3TUI
1
METN_ECOLI
G:
[24-254]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
I
K
L
S
N
I
T
K
V
F
-
H
QGTR
T
---
I
Q
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
T
L
S
E
SEL
T
K
A
R
R
---
Q
----
I
G
M
I
F
Q
H
F
N
L
L
S
----
S
R
T
V
F
G
N
V
A
L
----
P
L
E
L
----------------
D
N
T
----
P
K
-
D
E
---
V
------------
K
R
R
V
T
E
L
L
S
L
V
--
G
--
L
G
D
K
H
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
L
E
L
L
K
D
I
N
R
-
R
L
G
L
-
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
E
V
F
S
H
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
55.73
33%
-2
- C4 -
-
3TUZ
1
METN_ECOLI
C:
[24-254]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
I
K
L
S
N
I
T
K
V
F
-
H
QGTR
T
---
I
Q
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
T
L
S
E
SEL
T
K
A
R
R
---
Q
----
I
G
M
I
F
Q
H
F
N
L
L
S
----
S
R
T
V
F
G
N
V
A
L
----
P
L
E
L
----------------
D
N
T
----
P
K
-
D
E
---
V
------------
K
R
R
V
T
E
L
L
S
L
V
--
G
--
L
G
D
K
H
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
L
E
L
L
K
D
I
N
R
-
R
L
G
L
-
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
E
V
F
S
H
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
55.32
30%
-108
- C4 -
-
4U02
-
?
A:
[4-215]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
I
R
I
R
N
L
H
K
W
F
-
G
----
P
---
L
H
V
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
Q
E
G
E
V
V
V
D
G
L
S
V
K
D
D
R
A
---
L
R
E
I
R
R
--
E
----
V
G
M
V
F
Q
Q
F
N
L
F
P
----
H
M
T
V
L
E
N
V
T
L
A
---
P
M
R
V
----------------
R
R
W
----
P
R
-
E
K
---
A
------------
E
K
K
A
L
E
L
L
E
R
V
--
G
--
I
L
D
Q
A
R
K
Y
P
A
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
D
V
M
R
D
L
A
Q
-
G
-
G
M
-
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
A
D
R
V
V
F
M
D
G
G
Q
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
71
HHSearch
55.10
28%
-120
- C4 -
-
2AWN
1
MALK_ECOLI
B:
[2-221]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
S
V
Q
L
Q
N
V
T
K
A
W
-
G
----
E
---
V
V
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
P
------
P
A
E
R
--
G
----
V
G
M
V
F
Q
S
Y
A
L
Y
P
----
H
L
S
V
A
E
N
M
S
F
G
L
K
-
L
A
-------------------
G
A
----
K
K
-
E
V
---
I
------------
N
Q
R
V
N
Q
V
A
E
V
L
--
Q
--
L
A
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
-
G
R
-
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
-
K
P
L
E
L
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
70
HHSearch
54.07
28%
-123
- C4 -
-
3RLF
2
MALK_ECOLI
A:
[2-221]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
S
V
Q
L
Q
N
V
T
K
A
W
-
G
----
E
---
V
V
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
I
T
S
G
D
L
F
I
G
E
K
R
M
N
D
T
P
------
P
A
E
R
--
G
----
V
G
M
V
F
Q
S
Y
A
L
Y
P
----
H
L
S
V
A
E
N
M
S
F
G
L
K
-
L
A
-------------------
G
A
----
K
K
-
E
V
---
I
------------
N
Q
R
V
N
Q
V
A
E
V
L
--
Q
--
L
A
H
L
L
D
R
K
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
-
G
R
-
T
M
I
Y
V
T
H
D
Q
V
E
A
M
T
L
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
-
K
P
L
E
L
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
27
PsiBlast_CBE
53.32
33%
0
- C4 -
-
3TUI
1
METN_ECOLI
D:
[24-254]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
I
K
L
S
N
I
T
K
V
F
-
H
QGTR
T
---
I
Q
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
T
L
S
E
SEL
T
K
A
R
R
---
Q
----
I
G
M
I
F
Q
H
F
N
L
L
S
----
S
R
T
V
F
G
N
V
A
L
----
P
L
E
L
----------------
D
N
T
----
P
K
-
D
E
---
V
------------
K
R
R
V
T
E
L
L
S
L
V
--
G
--
L
G
D
K
H
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
L
E
L
L
K
D
I
N
R
-
R
L
G
L
-
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
E
V
F
S
H
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
53.26
33%
0
- C4 -
-
3TUI
1
METN_ECOLI
C:
[24-254]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
I
K
L
S
N
I
T
K
V
F
-
H
QGTR
T
---
I
Q
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
T
L
S
E
SEL
T
K
A
R
R
---
Q
----
I
G
M
I
F
Q
H
F
N
L
L
S
----
S
R
T
V
F
G
N
V
A
L
----
P
L
E
L
----------------
D
N
T
----
P
K
-
D
E
---
V
------------
K
R
R
V
T
E
L
L
S
L
V
--
G
--
L
G
D
K
H
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
L
E
L
L
K
D
I
N
R
-
R
L
G
L
-
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
E
V
F
S
H
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
59
HHSearch
53.24
21%
52
- C3 -
-
3J5S
-
ETTA_ECOLI
D:
[7-544]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
T
M
H
R
V
G
K
V
V
P
P
----
K
---
R
H
I
L
K
N
I
S
L
S
F
F
P
G
A
K
I
G
V
L
G
L
N
G
A
G
K
S
T
L
L
R
I
M
A
G
I
D
K
D
I
E
G
E
A
R
P
Q
---------------
P
D
I
--
K
----
I
G
Y
L
P
Q
E
P
Q
L
N
P
----
E
H
T
V
R
E
S
I
E
E
A
V
S
-
E
V
V
N
ALKRLDEVYALYADPD
A
D
F
DKLA
A
E
Q
G
R
---
L
EEIIQAHDGHNL
N
V
Q
L
E
R
A
A
D
A
L
--
R
--
L
P
-
D
W
D
A
K
I
A
N
L
S
G
G
E
R
R
R
V
A
L
C
R
L
L
L
E
K
P
D
M
L
L
L
D
E
P
T
N
H
L
D
A
E
S
V
A
W
L
E
R
F
L
H
D
F
-----
E
G
-
T
V
V
A
I
T
H
D
R
Y
F
L
D
N
V
A
G
W
I
L
E
L
D
R
G
E
G
I
P
W
E
G
N
Y
S
S
W
L
E
Q
KDQRLAQ----------------
E
------------------------
A
SQEAARRKS
I
--------------------------------------
E
--------------------------------------
K
E
----------------------------------------------------------------
L
E
------
W
-------------------------------------------------
V
RQGTKGRQSKGKARL
A
---------------
R
F
E
--------------------------------------------------
E
LNSTEYQKRNETNELF
I
---------------------------------------------------------------------------------------
P
----------------------------------------------------------------------------------------------------
P
--
G
----------------------------------------------------------
P
-----------
R
L
G
D
K
V
L
E
V
S
N
L
R
K
S
Y
G
D
---
R
L
L
I
D
D
L
S
F
S
I
P
K
G
A
I
V
G
--
I
I
G
P
N
G
A
G
K
S
T
L
F
R
M
I
S
G
-
Q
E
Q
P
D
S
G
T
I
T
L
G
E
T
V
K
L
------------
A
S
V
D
Q
F
--
R
D
S
M
D
N
S
K
T
V
W
E
E
V
S
G
G
L
D
I
----
M
K
--
I
-
G
N
--
T
E
M
P
S
R
A
Y
V
G
R
F
N
--
F
-
K
-
G
V
D
Q
G
K
R
V
G
E
L
S
G
G
E
R
G
R
L
H
L
A
K
L
L
Q
V
G
G
N
M
L
L
L
D
E
P
T
N
D
L
D
I
E
T
L
R
A
L
E
N
A
L
L
E
F
---
P
G
C
A
M
V
I
S
H
D
R
W
F
L
D
R
I
A
T
H
I
L
D
Y
Q
D
E
G
K
V
E
F
F
E
G
N
F
T
E
Y
E
E
Y
K
K
R
T
L
G
A
D
A
L
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
PsiBlast_CBE
53.17
33%
3
- C4 -
-
3TUI
1
METN_ECOLI
H:
[24-254]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
I
K
L
S
N
I
T
K
V
F
-
H
QGTR
T
---
I
Q
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
T
L
S
E
SEL
T
K
A
R
R
---
Q
----
I
G
M
I
F
Q
H
F
N
L
L
S
----
S
R
T
V
F
G
N
V
A
L
----
P
L
E
L
----------------
D
N
T
----
P
K
-
D
E
---
V
------------
K
R
R
V
T
E
L
L
S
L
V
--
G
--
L
G
D
K
H
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
L
E
L
L
K
D
I
N
R
-
R
L
G
L
-
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
E
V
F
S
H
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
52.56
33%
6
- C4 -
-
3TUZ
1
METN_ECOLI
D:
[24-254]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
I
K
L
S
N
I
T
K
V
F
-
H
QGTR
T
---
I
Q
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
T
L
S
E
SEL
T
K
A
R
R
---
Q
----
I
G
M
I
F
Q
H
F
N
L
L
S
----
S
R
T
V
F
G
N
V
A
L
----
P
L
E
L
----------------
D
N
T
----
P
K
-
D
E
---
V
------------
K
R
R
V
T
E
L
L
S
L
V
--
G
--
L
G
D
K
H
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
L
E
L
L
K
D
I
N
R
-
R
L
G
L
-
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
E
V
F
S
H
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
52.39
33%
1
- C4 -
-
3TUZ
1
METN_ECOLI
G:
[24-254]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
I
K
L
S
N
I
T
K
V
F
-
H
QGTR
T
---
I
Q
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
T
L
S
E
SEL
T
K
A
R
R
---
Q
----
I
G
M
I
F
Q
H
F
N
L
L
S
----
S
R
T
V
F
G
N
V
A
L
----
P
L
E
L
----------------
D
N
T
----
P
K
-
D
E
---
V
------------
K
R
R
V
T
E
L
L
S
L
V
--
G
--
L
G
D
K
H
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
L
E
L
L
K
D
I
N
R
-
R
L
G
L
-
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
E
V
F
S
H
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
38
Fugue
52.29
26%
29
- C4 -
-
3TUZ
1
METN_ECOLI
H:
[23-362]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
H
M
I
K
L
S
N
I
T
K
V
F
-
H
QGTR
T
---
I
Q
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
E
L
T
T
L
S
E
---
S
E
L
T
K
A
RR
Q
----
I
G
M
I
F
Q
H
F
N
L
L
S
----
S
R
T
V
F
G
N
V
A
L
P
L
E
-
L
D
N
-------------------
T
----
P
K
-
D
E
---
V
------------
K
R
R
V
T
E
L
L
S
L
V
--
G
--
L
G
D
K
H
D
S
Y
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
L
E
L
L
K
D
I
N
R
-
R
L
G
L
-
T
I
L
L
I
T
H
E
M
D
V
V
K
R
I
C
D
C
V
A
V
I
S
N
G
E
L
I
E
Q
D
-
T
V
S
E
V
F
S
H
PKT--------------------
P
------------------------
L
---------
A
--------------------------------------
Q
--------------------------------------
K
F
----------------------------------------------------------------
I
Q
------
S
-------------------------------------------------
T
---------------
L
HLDIPEDYQE-----
R
L
Q
--------------------------------------------------
A
----------------
E
---------------------------------------------------------------------------------------
P
----------------------------------------------------------------------------------------------------
F
--
T
----------------------------------------------------------
D
-----------
C
V
P
M
L
R
L
E
F
T
G
Q
S
V
D
A
P
L
--
L
S
E
T
A
R
R
F
N
V
N
N
N
I
I
S
A
-
Q
--
M
D
Y
A
G
G
V
K
F
G
I
M
L
T
E
M
H
G
T
Q
Q
D
T
Q
A
A
I
A
W
L
Q
E
H
H
V
K
V
E
V
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
52.07
30%
-109
- C4 -
-
1V43
-
?
A:
[13-226]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
K
L
E
N
L
T
K
R
F
-
G
----
N
---
F
T
A
V
N
K
L
N
L
T
I
K
D
G
E
F
L
V
L
L
G
P
S
G
C
G
K
T
T
T
L
R
M
I
A
G
L
E
E
P
T
E
G
R
I
Y
F
G
D
R
D
V
T
Y
L
P
P
---
K
D
R
N
---------
I
S
M
V
F
Q
----------
H
M
T
V
Y
E
N
I
A
F
----
P
L
------------------
K
K
F
----
P
K
-
D
E
---
I
------------
D
K
R
V
R
W
A
A
E
L
L
--
Q
--
I
E
E
L
L
N
R
Y
P
A
Q
L
S
G
G
Q
R
Q
R
V
A
V
A
R
A
I
V
V
E
P
D
V
L
L
M
D
E
P
L
S
N
L
D
A
K
L
R
V
A
M
R
A
E
I
K
K
L
Q
Q
-
K
-
L
K
V
T
T
I
Y
V
T
H
D
Q
V
E
A
M
T
M
G
D
R
I
A
V
M
N
R
G
Q
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
45
Fugue
51.52
19%
33
- C4 -
-
4F4C
3
PGP1_CAEEL
A:
[4-1306]
N
G
S
L
R
Q
S
L
R
T
L
D
S
F
SLA
P
E
D
V
L
K
T
A
I
K
T
V
E
D
Y
EGDNIDSNG
E
I
K
I
TRDEVV
N
K
V
S
I
P
Q
L
Y
RYTT
T
L
E
K
L
L
L
F
I
G
T
L
V
A
V
I
T
G
A
G
L
P
L
M
S
I
L
Q
G
K
V
S
Q
A
F
I
N
E
Q
I
V
I
N
N
N
G
S
T
F
LPTGQNYT
K
T
D
F
E
H
D
V
M
N
V
V
W
S
Y
A
A
M
T
V
G
M
W
A
A
G
Q
I
T
V
T
C
Y
L
Y
V
A
E
Q
M
N
N
R
L
R
R
E
F
V
K
S
I
L
R
QE
I
S
W
F
D
T
N
HSGT
L
A
T
K
L
F
D
N
L
E
R
V
K
E
G
T
GD
K
I
G
M
A
F
Q
Y
L
S
Q
F
I
T
G
F
I
V
A
F
T
H
S
W
Q
L
T
L
V
M
L
A
V
T
P
I
Q
A
L
C
G
F
A
I
A
K
S
M
S
T
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A
I
R
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T
L
R
Y
A
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A
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K
V
V
E
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I
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I
R
T
V
V
S
L
NG
L
R
Y
E
L
E
R
Y
S
T
A
V
E
E
A
K
K
A
G
V
L
K
G
L
F
L
G
I
S
F
G
A
M
Q
A
S
N
F
I
S
F
A
L
A
F
Y
I
G
V
G
W
V
H
D
GSLN
F
G
D
M
L
T
T
F
S
S
V
M
M
G
S
M
A
L
G
L
A
G
P
Q
L
A
V
L
G
T
A
Q
G
A
A
S
G
I
Y
E
V
LDRKPVIDSS
S
K
A
G
R
KDM
K
I
K
G
D
I
T
V
E
N
V
H
F
T
Y
P
S
-
R
P---
D
---
V
P
I
L
R
G
M
N
L
R
V
N
A
G
Q
T
V
A
L
V
G
S
S
G
C
G
K
S
T
I
I
S
L
L
L
R
Y
Y
D
V
L
K
G
K
I
T
I
D
G
V
D
V
R
D
I
N
L
---
E
F
L
R
K
N
-------
V
A
V
V
S
Q
E
P
A
L
F
N
-----
C
T
I
E
E
N
I
S
L
G
K
E
G
I
T
R
E
----------------
E
M
V
----
A
A
-
C
K
M
A
N
A
------------
E
K
F
I
K
T
L
P
N
G
Y
--
N
--
T
L
V
G
D
R
G
--
T
Q
L
S
G
G
Q
K
Q
R
I
A
I
A
R
A
L
V
R
N
P
K
I
L
L
L
D
E
A
T
S
A
L
D
A
E
S
E
G
I
V
Q
Q
A
L
D
K
A
A
K
---
G
R
-
T
T
I
I
I
A
H
R
L
S
T
I
R
N
-
A
D
L
I
I
S
C
K
N
G
Q
V
V
E
V
G
-
D
H
R
A
L
M
A
Q
-----------------------
Q
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
--------------------------------------------------
L
----------------
Y
---------------------------------------------------------------------------------------
Y
----------------------------------------------------------------------------------------------------
D
--
L
----------------------------------------------------------
V
-----------
T
A
Q
T
F
T
D
A
V
D
S
A
A
E
G
E
R
I
--
G
K
D
A
L
S
R
L
K
Q
E
L
E
E
N
N
A
Q
K
TN
L
F
E
I
L
Y
H
A
R
P
H
A
L
S
L
F
I
G
-
M
S
T
A
T
I
G
G
F
I
Y
P
T
Y
S
V
F
F
T
S
F
M
N
V
F
A
G
N
P
A
D
F
L
S
Q
G
H
F
W
A
L
M
F
-
L
V
L
A
A
A
Q
G
I
C
S
F
L
M
T
F
F
M
--
G
I
A
S
E
S
L
T
R
D
L
R
N
K
L
F
R
N
V
L
--
S
-
Q
-
H
I
G
F
F
D
S
P
Q
N
------
A
S
G
K
I
S
T
R
L
A
T
D
V
P
N
L
R
T
A
I
D
F
R
F
S
T
V
I
T
T
L
V
S
M
V
A
G
I
G
L
A
F
F
Y
G
--
W
Q
M
A
L
L
I
I
A
I
L
P
I
V
A
F
G
Q
Y
L
R
G
R
R
F
T
G
-
K
N
V
K
S
A
S
E
F
A
D
S
G
K
I
A
I
E
A
I
E
N
V
R
T
V
Q
A
L
A
R
E
D
T
F
Y
E
N
F
C
E
K
L
D
I
P
H
K
E
A
I
K
E
A
F
I
Q
G
L
S
Y
G
C
A
S
S
V
L
Y
L
L
N
T
C
A
Y
R
M
G
L
A
L
I
I
TDPPTMQ
P
M
R
V
L
R
V
M
Y
A
I
T
I
S
T
S
TLGFAT
S
Y
F
P
E
Y
A
K
A
T
F
A
G
G
I
I
F
G
M
L
R
KISKIDSLSLAGEKKKLYGK
V
I
F
K
N
V
R
F
A
Y
PERPEIEILK
G
L
S
F
S
V
E
PG
Q
T
L
A
L
V
G
P
S
GCGKST
V
V
A
L
L
E
RFYDTL
G
G
E
I
F
I
DGSEIKTLN
P
E
H
T
R
S
Q
I
A
I
V
S
Q
E
P
T
L
F
DCS
I
A
E
N
I
I
YGLDPSSVT
M
A
Q
V
E
E
A
A
R
L
A
NI
H
N
F
I
A
E
LPEGFETRVGDRGTQLS
G
G
Q
K
Q
R
I
A
I
A
R
A
L
V
R
NPK
I
L
L
L
D
EATSALDT
E
S
E
K
V
V
Q
E
A
L
D
R
A
R
EG
R
T
C
I
V
I
A
HRLNTVMNAD
C
I
A
V
V
S
NGTII
E
K
G
T
H
T
Q
L
M
S
E
K
32
PsiBlast_CBE
43.92
31%
10
- C4 -
-
5X40
2
CBIO_RHOCB
B:
[16-229]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
L
A
A
E
A
L
T
Y
A
F
P
G
----
G
---
V
K
A
L
D
D
L
S
L
A
V
P
K
G
E
S
L
A
I
L
G
P
N
G
A
G
K
S
T
L
L
L
H
L
N
G
T
L
R
P
Q
S
G
R
V
L
L
G
G
T
A
---
T
G
H
---
S
R
K
D
L
T
--
G
WRRR
V
G
L
V
L
Q
D
---
A
D
DQLF
A
T
T
V
F
E
D
V
S
F
G
---
P
L
N
L
----------------
G
-
L
----
S
E
-
A
E
---
A
------------
R
A
R
V
E
E
A
L
A
A
L
--
S
--
I
S
D
L
R
D
R
P
T
H
M
L
S
G
G
Q
K
R
R
V
A
I
A
G
A
V
A
M
R
P
E
V
L
L
L
D
Q
P
T
A
G
L
D
L
A
G
T
E
Q
L
L
T
L
L
R
G
L
R
A
-
A
-
G
M
-
T
L
V
F
S
T
H
D
V
E
L
A
A
A
L
A
D
R
V
A
L
F
R
T
G
R
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
PsiBlast_CBE
42.18
31%
14
- C4 -
-
5X40
2
CBIO_RHOCB
A:
[16-229]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
L
A
A
E
A
L
T
Y
A
F
P
G
----
G
---
V
K
A
L
D
D
L
S
L
A
V
P
K
G
E
S
L
A
I
L
G
P
N
G
A
G
K
S
T
L
L
L
H
L
N
G
T
L
R
P
Q
S
G
R
V
L
L
G
G
T
A
---
T
G
H
---
S
R
K
D
L
T
--
G
W
R
R
R
V
G
L
V
L
Q
D
---
A
D
DQLF
A
T
T
V
F
E
D
V
S
F
G
---
P
L
N
L
----------------
G
-
L
----
S
E
-
A
E
---
A
------------
R
A
R
V
E
E
A
L
A
A
L
--
S
--
I
S
D
L
R
D
R
P
T
H
M
L
S
G
G
Q
K
R
R
V
A
I
A
G
A
V
A
M
R
P
E
V
L
L
L
D
Q
P
T
A
G
L
D
L
A
G
T
E
Q
L
L
T
L
L
R
G
L
R
A
-
A
-
G
M
-
T
L
V
F
S
T
H
D
V
E
L
A
A
A
L
A
D
R
V
A
L
F
R
T
G
R
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------