@TOME V2.2
(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 : B3A4_HUMAN: (2015-12-07 )
MEMKLPGQEGFEASSAPRNIPSGELDSNPDPGTGPSPDGPSDTESKELGVPKDPLLFIQLNELLGWPQALEWRETGSSSASLLLDMGEMPSITLSTHLHHRWVLFEEKLEVAAGRWSAPHVPTLALPSLQKLRSLLAEGLVLLDCPAQSLLELVEQVTRVESLSPELRGQLQALLLQRPQHYNQTTGTRPCWGSTHPRKASDNEEAPLREQCQNPLRQKLPPGAEAGTVLAGELGFLAQPLGAFVRLRNPVVLGSLTEVSLPSRFFCLLLGPCMLGKGYHEMGRAAAVLLSDPQFQWSVRRASNLHDLLAALDAFLEEVTVLPPGRWDPTARIPPPKCLPSQHKRLPSQQREIRGPAVPRLTSAEDRHRHGPHAHSPELQRTGRLFGGLIQDVRRKVPWYPSDFLDALHLQCFSAVLYIYLATVTNAITFGGLLGDATDGAQGVLESFLGTAVAGAAFCLMAGQPLTILSSTGPVLVFERLLFSFSRDYSLDYLPFRLWVGIWVATFCLVLVATEASVLVRYFTRFTEEGFCALISLIFIYDAVGKMLNLTHTYPIQKPGSSAYGCLCQYPGPGGNESQWIRTRPKDRDDIVSMDLGLINASLLPPPECTRQGGHPRGPGCHTVPDIAFFSLLLFLTSFFFAMALKCVKTSRFFPSVVRKGLSDFSSVLAILLGCGLDAFLGLATPKLMVPREFKPTLPGRGWLVSPFGANPWWWSVAAALPALLLSILIFMDQQITAVILNRMEYRLQKGAGFHLDLFCVAVLMLLTSALGLPWYVSATVISLAHMDSLRRESRACAPGERPNFLGIREQRLTGLVVFILTGASIFLAPVLKFIPMPVLYGIFLYMGVAALSSIQFTNRVKLLLMPAKHQPDLLLLRHVPLTRVHLFTAIQLACLGLLWIIKSTPAAIIFPLMLLGLVGVRKALERVFSPQELLWLDELMPEEERSIPEKGLEPEHSFSGSDSEDSELMYQPKAPEINISVN
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.......480..-----.....490...-----....500-------------........510..----.....520.......530......--------.540.......550....-------...560.......570.......580.......590.......--600.......610.......620......-.630.......640.......650.......660.......670.......680.-......690.......700.......710...---....720.......730.......740......-.750.......760.......770.......780.......790.......800.......810.......820.....---..830......---------.840......------.850....----------...860.-......870.......880.......890...-------.--...900.........910.......920.......930.......940.......950.......960.......970.......980.
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MEMKLPGQEGF--EASSAPRNIPSGELDSNPDPGTGPSPDGPSDTESKELGVPKD
P
L
L
F
I
Q
L
N
E
LLGW--P
Q
A
L
E
W
RETGSS
S
A
S
L
L
L
DMGEMP
S
I
----
T
L
S
THL
H
H
R
W
V
L
F
E
E
K
L
E
V
AAGRWSAPHVPTLA
L
P
S
L
Q
K
L
R
S
L
L
AE
G
L
-
V
L
LDC---
P
A
Q
S
L
L
E
----
L
V
E
Q
V
T
R
----
V
E
SL
S
P
E
L
R
G
Q
L
Q
A
L
L
L
QR-
P
Q
HYNQTTGT-----RPCW------------------G-ST---HPR--K------ASD-------NEEA
P
L
R
E
Q
---------
C
Q
-----------
N
P
L
R
QKLPPGAEAG
T
V
L
A
G
E
L
G
---
F
-
L
A
Q
P
L
G
A
F
V
RLRN
P
V
V
L
GSLTE--VSLP
S
R
F
F
C
L
L
L
G
P
C
MLGK
G
Y
H
-
E
-MG
R
A
A
A
V
L
LSDP
Q
F
Q
W
S
V
R
R
AS
N
L
H
D
L
L
A
A
L
D
A
F
L
E
E
VTVLPPGRWDPTARIPPPKCL
P
S
Q
H
KRL
P
S
Q
Q
R
EIRGPAVPRLTSA
E
D
RHRHGPHAH
S
P
E
L
Q
R
T
G
R
L
F
G
G
L
I
Q
D
V
R
R
---KVP-WY
P
-
S
D
-
F
L
D
A
L
H
L
Q
C
F
S
A
V
L
Y
I
Y
L
A
T
V
TN
A
I
T
FGGLLGDAT
D
G
A
Q
G
V
L
E
S
F
L
G
T
A
V
A
G
A
A
F
C
LM-AGQ
P
L
T
I
LSST
G
P
V
L
V
F
E
R
L
L
F
S
-----FSRDYSLD
Y
L
P
-----
F
R
L
W
V
G
--------------
I
W
V
A
T
F
C
L
V
L
V
A
T
----
E
A
S
V
L
V
R
Y
F
T
R
FTEE
G
F
C
A
L
I
S
L
I
--------
F
I
Y
D
A
V
G
K
M
L
NLTHTYPI-------QKPGSSAY
G
C
L
CQYPGPGGNES
Q
W
I
RTRPKDRD
D
I
V
S
M
D
L
G
LI--NASLLPP
P
E
C
TRQGGHPRGPGCHTV
P
D
I
A
-
F
F
S
L
L
L
F
L
T
S
F
F
F
A
M
A
L
K
C
V
K
TSRF
F
P
S
V
V
R
K
G
L
S
D
F
S
S
V
L
A
I
L
L
GC
G
L
D
A
F
L
GL-ATPKLMVPREFKPTLPGRG
W
L
VSPFGAN
P
W
W
W
---
S
V
A
A
A
L
P
A
L
L
L
S
I
L
I
F
MDQ
Q
I
T
A
V
I
L
N
R
M
E
Y
R
L
-QKGAGF
H
L
D
L
F
C
V
A
V
L
M
L
L
T
S
ALGLP
W
Y
V
S
A
T
V
I
S
L
A
H
M
D
S
L
R
R
E
SRACAPGERPNFL
G
I
R
E
Q
RL
T
G
L
V
V
F
I
LTG
A
S
I
F
---
L
A
P
V
L
K
FI
P
M
P
---------
V
L
Y
G
I
F
L
Y
M
G
------
V
A
A
L
S
S
I
Q
----------FT
N
R
V
K
L
-
L
L
M
PAKHQP
D
L
L
L
L
RHVP
L
T
R
V
H
L
F
T
A
I
Q
L
A
C
-------
L
--
G
L
L
W
--
I
IKST
P
A
A
I
I
F
P
L
M
L
L
G
L
V
G
V
R
K
A
L
E
R
VF
S
P
Q
E
L
L
W
L
D
E
LM
P
E
E
E
RSIPEKGLEPEHSFSGSDSEDSE
L
M
YQPKA
P
E
I
N
I
SVN
31
Fugue
77.41
19%
-74
- C4 -
4PKF
3
?
A:
[8-864]
K
V
L
E
Y
K
G
K
K
L
N
FT
P
E
D
P
A
E
E
T
I
P
A
D
E
L
H
E
H
L
Q
K
--------
P
S
T
A
R
T
K
R
L
K
E
R
--------------------
C
R
W
K
H
A
S
A
---------
G
E
F
I
E
K
----
S
V
T
A
G
I
-
E
R
M
R
Y
L
T
E
A
H
K
A
S
E
G
K
P
E
A
I
R
R
A
L
G
L
A
N
V
L
N
K
S
T
L
V
L
Q
E
D
E
-
F
I
V
G
Y
---
H
A
E
D
P
N
M
----
F
------------
P
L
Y
P
E
L
S
-------------
H
M
A
V
Q
D
Y
L
-----
R
S
D
Y
------------------
S
-
P
Q
---
P
A
D
--
E
------
A
A
A
-------
I
N
E
Y
W
K
P
H
S
---------
L
Q
-----------
S
K
C
Q
P
Y
F
--------------------------------
D
P
A
D
L
G
R
M
Y
Q
--
V
S
S
--------
M
E
A
P
S
F
A
S
G
Y
N
-
S
-
I
V
P
P
Y
E
T
V
L
E
D
----
G
L
L
A
R
I
K
L
A
E
K
H
I
A
E
A
Q
A
D
M
S
T
F
P
W
N
G
T
K
G
L
D
N
I
A
K
I
D
N
W
K
A
M
V
I
A
C
K
A
V
I
S
W
A
R
R
Q
G
R
L
C
K
I
V
A
E
N
F
E
-----------
T
D
P
K
R
Q
A
E
L
L
E
--
I
A
D
I
C
Q
---
R
I
P
-
A
E
P
-
C
K
G
L
K
D
A
M
Q
A
K
F
F
T
F
L
I
C
H
A
I
E
R
Y
A
S
--------
G
Y
A
Q
K
-
E
D
T
L
L
W
P
Y
Y
K
A
S
V
V
D
K
K
F
------
Q
P
M
S
H
M
D
A
V
-
E
L
V
E
M
E
R
L
K
I
S
E
HGAG
K
S
R
A
Y
-
R
E
I
F
P
GSN
D
L
F
I
L
T
V
G
GTNAKGEDACN
D
M
T
D
A
I
L
E
A
A
K
R
I
R
T
A
----
E
P
S
I
V
F
R
Y
S
K
K
N
R
E
K
T
L
R
W
V
F
E
C
I
R
D
GLGYP
S
I
K
H
D
E
I
G
T
E
Q
M
K
E
Y
A
K
F
S
LNGNGAT
D
E
E
A
H
N
W
V
N
V
L
C
M
S
P
G
I
H
G
R
-
R
K
T
Q
K
T
R
S
E
G
G
G
S
I
F
P
A
K
L
L
E
I
S
L
N
D
G
Y
D
W
S
Y
A
D
M
Q
L
G
--
P
K
T
G
D
L
S
S
L
K
S
F
E
D
V
W
E
A
F
R
K
Q
Y
Q
Y
A
I
N
L
C
I
S
T
K
D
V
S
R
Y
F
E
Q
R
F
L
Q
-
M
P
F
V
S
A
I
D
D
G
C
M
E
L
G
M
D
A
C
A
L
S
-
E
Q
P
------------------------
N
G
W
H
N
P
I
T
T
I
V
A
A
N
S
L
V
A
I
K
K
L
V
F
E
E
K
K
Y
T
L
E
Q
L
S
Q
A
L
K
A
N
-
W
E
G
------
F
E
E
M
R
V
D
F
K
R
A
P
K
W
G
N
D
D
D
Y
A
D
G
I
I
T
R
F
Y
E
E
I
I
G
G
E
M
R
K
-----
I
T
N
Y
S
G
-------
G
P
V
M
P
T
G
Q
A
V
G
L
Y
---
M
E
V
G
S
R
T
G
P
T
P
DGRFGGEAA
D
D
G
G
I
S
P
Y
M
G
TDKKG
P
T
A
V
L
R
S
V
S
K
VQKNQK
G
N
L
L
N
Q
R
L
S
V
-
P
I
M
R
S
K
H
G
F
E
I
W
N
S
Y
I
K
T
W
H
D
L
N
I
-
D
H
V
Q
F
N
V
-------
V
S
T
D
E
M
R
--
A
A
Q
R
E
P
E
K
H
H
D
L
I
V
R
V
S
G
Y
S
A
R
--------------
F
V
D
I
P
T
Y
G
Q
N
T
I
I
A
R
---
Q
E
Q
D
F
S
A
S
D
L
E
F
-----------
L
N
V
E
I
-
26
Fugue
76.15
29%
-66
- C4 -
1HYN
-
B3AT_HUMAN
P:
[56-348]
------------------------------------------------------------------------------------
K
V
Y
V
E
L
Q
E
L
V
M
D
EKNQ
E
L
R
W
M
E
A
A
R
W
V
Q
L
E
E
N
L
G
-
E
N
G
A
W
G
R
P
H
L
S
H
L
T
F
W
S
L
L
E
L
R
R
V
F
T
K
G
T
-
V
L
L
D
L
---
Q
E
T
S
L
A
G
VANQ
L
L
D
R
F
I
F
----
E
D
Q
I
R
P
Q
D
R
E
E
L
L
R
A
L
L
L
K
-
H
S
H
A
G
E
L
E
A
L
-----
G
G
V
K
PAVLTRSGDPSQPLLPQH
S
-
S
L
---
E
T
Q
--
L
------
F
C
E
-------
Q
G
D
G
G
T
E
G
H
---------
S
P
-----------
S
G
I
L
E
K
I
P
P
D
S
E
A
T
L
V
L
V
G
R
A
D
---
F
-
L
E
Q
P
V
L
G
F
V
R
L
Q
E
A
A
E
L
E
A
V
-
E
--
L
P
V
P
I
R
F
L
F
V
L
L
G
P
E
A
P
H
I
D
Y
T
-
Q
-
L
G
R
A
A
A
T
L
M
S
E
R
V
F
R
I
D
A
Y
M
A
Q
S
R
G
E
L
L
H
S
L
E
G
F
L
D
C
S
L
V
L
P
P
T
D
A
P
S
E
Q
A
L
L
S
L
V
P
V
Q
R
E
L
L
R
R
R
Y
Q
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
HHSearch
76.12
29%
-70
- C4 -
1HYN
-
B3AT_HUMAN
P:
[56-348]
--------------------------------------------------------
K
V
Y
V
E
L
Q
E
L
V
M
D
EK
N
Q
E
L
R
W
M
E
A
A
----------------------------
R
W
V
Q
L
E
E
N
L
G
E
-
N
G
A
W
G
R
P
H
L
S
H
L
T
F
W
S
L
L
E
L
R
R
V
F
T
K
G
T
-
V
L
L
D
L
---
Q
E
T
S
L
A
G
----
V
A
N
Q
L
L
D
RFIF
E
D
Q
I
R
P
Q
D
R
E
E
L
L
R
A
L
L
L
K
-
H
S
H
A
G
E
L
E
A
L
GGVKP
A
V
L
T
------------------
R
-
S
G
---
D
P
S
--
Q
PLLPQH
S
S
L
ETQLFCE
Q
G
D
G
G
T
E
G
H
---------
S
P
-----------
S
G
I
L
E
K
I
P
P
D
S
E
A
T
L
V
L
V
G
R
A
D
---
F
-
L
E
Q
P
V
L
G
F
V
R
L
Q
E
A
A
E
L
E
A
-
V
E
--
L
P
V
P
I
R
F
L
F
V
L
L
G
P
E
A
P
H
I
D
Y
T
-
Q
-
L
G
R
A
A
A
T
L
M
S
E
R
V
F
R
I
D
A
Y
M
A
Q
S
R
G
E
L
L
H
S
L
E
G
F
L
D
C
S
L
V
L
P
P
T
D
A
P
S
E
Q
A
L
L
S
L
V
P
V
Q
R
E
L
L
R
R
R
Y
Q
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
71.15
32%
-75
- C4 -
4KY9
-
B3AT_HUMAN
A:
[30-273]
------------------------------------------------------------------------------------------------------------
R
W
V
Q
L
E
E
N
L
G
-
E
N
G
A
W
G
R
P
H
L
S
H
L
T
F
W
S
L
L
E
L
R
R
V
F
T
K
G
T
-
V
L
L
D
L
---
Q
E
T
S
L
A
G
----
V
A
N
Q
L
L
D
----
R
F
I
F
E
D
Q
I
R
P
Q
D
R
E
E
L
L
R
A
-
L
L
L
K
H
S
H
A
G
E
-----
L
E
A
L
------------------
G
-
G
V
---
K
P
A
V
L
T
------
R
----------
P
S
Q
P
L
L
P
Q
HSS
L
E
T
Q
L
F
C
E
---------------
E
K
I
P
P
D
S
E
A
T
L
V
L
V
G
R
A
D
---
F
-
L
E
Q
P
V
L
G
F
V
R
L
Q
E
A
A
E
L
E
A
V
-
E
--
L
P
V
P
I
R
F
L
F
V
L
L
G
P
E
A
P
H
I
D
Y
T
-
Q
-
L
G
R
A
A
A
T
L
M
S
E
R
V
F
R
I
D
A
Y
M
A
Q
S
R
G
E
L
L
H
S
L
E
G
F
L
D
C
S
L
V
L
P
P
T
D
A
P
S
E
Q
A
L
L
S
L
V
P
V
Q
R
E
L
L
R
R
R
Y
Q
S
S
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
71.13
32%
-73
- C4 -
1HYN
-
B3AT_HUMAN
P:
[80-323]
------------------------------------------------------------------------------------------------------------
R
W
V
Q
L
E
E
N
L
-
G
E
N
G
A
W
G
R
P
H
L
S
H
L
T
F
W
S
L
L
E
L
R
R
V
F
T
K
G
T
-
V
L
L
D
L
---
Q
E
T
S
L
A
G
----
V
A
N
Q
L
L
D
----
R
F
I
F
E
D
Q
I
R
P
Q
D
R
E
E
L
L
R
A
-
L
L
L
K
H
S
H
A
G
E
-----
L
E
A
L
------------------
G
-
G
V
---
K
P
A
VL
T
------
R
S
G
-------
D
P
S
Q
P
L
L
P
Q
HSSLETQLF
C
E
QGDGGTEGHSP
S
G
I
L
E
K
I
P
P
D
S
E
A
T
L
V
L
V
G
R
A
D
---
F
-
L
E
Q
P
V
L
G
F
V
R
L
Q
E
A
A
E
L
E
A
V
-
E
--
L
P
V
P
I
R
F
L
F
V
L
L
G
P
E
A
P
H
I
D
Y
T
-
Q
-
L
G
R
A
A
A
T
L
M
S
E
R
V
F
R
I
D
A
Y
M
A
Q
S
R
G
E
L
L
H
S
L
E
G
F
L
D
C
S
L
V
L
P
P
T
D
A
P
S
E
Q
A
L
L
S
L
V
P
V
Q
R
E
L
L
R
R
R
Y
Q
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
HHSearch
57.53
23%
-66
- C4 -
3URR
3
?
A:
[2-152]
---------------------------------------------------------------------------------------------------------------------------------------
S
M
N
R
L
A
K
I
L
P
L
E
N
-
V
V
I
G
L
---
S
V
T
S
K
K
R
----
V
F
E
Q
A
G
L
I
F
--
E
N
Q
N
-
G
I
A
R
S
T
V
T
D
N
L
F
A
R
-
E
R
-------------
L
G
S
T
------------------
G
-
L
G
---
E
G
V
-------------------------------------------------------
A
I
P
H
---------
G
R
I
K
---
G
-
L
K
H
P
L
A
A
F
V
R
L
A
E
P
I
P
F
E
A
P
D
G
----
Q
P
V
S
L
L
I
F
L
L
V
P
E
Q
A
T
Q
A
H
L
-
E
-
I
L
S
E
I
A
Q
L
L
S
D
R
D
T
R
E
R
L
H
T
E
P
D
R
D
E
L
H
R
L
L
T
Q
W
Q
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
HHSearch
52.50
19%
-72
- C4 -
1A6J
1
PTSN_ECOLI
A:
[8-157]
-----------------------------------------------------------------------------------------------------------------------------------------
L
Q
L
S
S
V
L
N
R
E
C
-
T
R
S
R
V
---
H
C
Q
S
K
K
R
----
A
L
E
I
I
S
E
L
A
--
A
K
Q
L
-
S
L
P
P
Q
V
V
F
E
A
I
L
T
R
-
E
K
-------------
M
G
S
T
------------------
G
-
I
G
---
N
G
I
-------------------------------------------------------
A
I
P
H
---------
G
K
L
E
E--
D
-
T
L
R
A
V
G
V
F
V
Q
L
E
T
P
I
A
F
D
A
I
D
N
----
Q
P
V
D
L
L
F
A
L
L
V
P
A
D
Q
T
K
T
H
L
-
H
-
T
L
S
L
V
A
K
R
L
A
D
K
T
I
C
R
R
L
R
A
A
Q
S
D
E
E
L
Y
Q
I
I
T
D
T
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
HHSearch
51.72
22%
-62
- C4 -
2A0J
-
?
A:
[4-147]
-------------------------------------------------------------------------------------------------------------------------------------------
I
G
E
I
L
P
L
S
H
-
I
V
L
D
M
---
E
V
G
S
K
K
R
----
L
F
E
E
A
G
L
L
L
--
E
R
E
-
S
S
L
S
H
A
D
V
F
E
C
L
F
A
R
-
E
K
-------------
L
G
S
T
------------------
G
-
L
G
---
Q
G
V
-------------------------------------------------------
A
I
P
H
---------
G
R
H
A
---
G
-
V
K
Q
A
T
G
A
F
I
R
T
R
E
P
V
G
F
D
A
P
D
G
----
K
P
V
S
L
I
F
I
L
L
V
P
E
N
A
T
G
E
H
L
-
E
-
V
L
S
K
L
A
G
K
F
S
Q
K
S
I
R
E
S
L
M
T
V
S
S
A
E
E
V
R
A
I
L
T
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
HHSearch
49.14
12%
-71
- C4 -
3BJV
-
?
A:
[2-149]
------------------------------------------------------------------------------------------------------------------------------------------
N
L
A
Q
A
F
K
E
N
H
S
I
R
L
G
L
---
T
A
K
D
W
K
E
----
A
V
K
L
S
V
T
P
L
I
E
S
G
A
----
V
K
P
E
Y
Y
N
A
I
I
E
S
T
E
S
-------------
Y
G
P
Y
------------------
Y
I
L
M
---
P
G
M
-------------------------------------------------------
A
M
P
H
---------
A
R
P
E
A--
G
-
V
Q
R
D
A
F
S
L
V
T
L
T
E
P
V
T
F
T
D
--
G
----
K
E
V
Q
V
L
L
A
L
A
A
T
S
S
--
K
I
H
T
S
V
-
A
I
P
Q
I
I
A
L
F
E
L
D
H
S
I
E
R
L
V
N
C
K
T
P
E
E
V
L
A
M
V
E
E
S
K
S
S
P
Y
L
E
G
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
HHSearch
47.76
14%
-137
- C4 -
3QE7
2
URAA_ECOLI
A:
[9-341]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
E
---
R
P
P
--
L
L
-
Q
T
-
I
P
L
S
L
Q
H
L
F
A
M
F
G
A
---
T
V
L
V
P
V
L
F
H
------------
I
N
P
A
T
V
L
L
F
N
G
I
G
T
L
L
Y
L
F
I
C
K
G
K
I
P
A
Y
L
G
S
S
F
A
F
I
S
---
P
V
L
L
-----
L
L
-
P
L
G
Y
E
V
A
--------
L
G
G
F
--------------
I
M
C
G
V
L
F
C
L
V
S
F
I
V
K
K
A
G
T
G
W
L
D
V
L
F
P
P
A
A
M
G
A
I
V
A
V
I
G
L
E
--------
L
A
G
V
A
A
G
M
A
G
L
-
L
---
P
A
-------
E
G
--------------------------------------------------------------------
Q
T
P
D
-
S
K
T
I
I
I
S
I
T
T
L
A
V
T
V
L
G
S
V
L
F
R
-
G
--------
F
L
A
I
I
P
I
L
I
G
V
L
V
G
Y
A
L
S
F
A
M
G
I
V
D
T
T
P
--
I
I
--------
N
A
H
W
F
A
L
P
T
L
Y
T
P
R
F
E
----
W
F
A
I
L
T
I
L
P
A
A
L
V
V
I
A
E
H
V
G
H
L
V
V
T
A
N
I
V
K
K
D
L
L
R
D
P
G
L
H
R
S
M
F
A
N
G
L
S
T
V
I
S
G
F
F
G
S
T
P
N
T
T
Y
G
E
N
I
G
V
M
A
I
T
---------
R
V
---------
Y
S
T
W
V
I
G
G
A
A
I
F
A
I
L
L
S
C
V
G
K
L
A
A
A
I
Q
M
I
P
L
P
---------
V
M
G
G
V
S
L
L
L
Y
------
G
V
I
G
A
S
G
I
----------
R
V
L
I
E
S
K
-
V
D
Y
N
K
A
Q
N
L
I
L
T
S
V
I
L
I
I
G
V
S
G
A
K
V
N
I
G
A
A
E
L
-------
K
--
G
M
A
L
--
A
T
I
V
G
I
G
L
S
L
I
F
K
L
I
S
-------------------------------------------------------------------
20
HHSearch
46.28
11%
-73
- C4 -
3OXP
-
?
A:
[4-150]
------------------------------------------------------------------------------------------------------------------------------------------
M
L
K
T
L
L
T
S
D
V
-
I
Q
V
V
S
---
Q
A
K
D
W
R
D
----
A
I
A
I
S
C
Q
P
L
I
D
N
G
A
----
V
E
A
R
Y
V
E
A
I
Y
R
S
H
E
A
-------------
I
G
P
Y
------------------
Y
V
V
G
---
P
G
I
-------------------------------------------------------
A
M
P
H
---------
A
R
P
E
D--
G
-
V
N
R
L
S
L
A
L
T
V
I
T
E
G
V
T
F
N
A
E
G
N
----
D
P
V
K
L
L
I
V
L
A
A
T
D
S
--
N
S
H
I
-
E
-
A
I
S
Q
L
A
Q
L
F
D
T
A
S
D
V
Q
A
L
L
N
A
K
T
P
Q
D
I
L
S
V
I
A
R
Y
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
HHSearch
45.95
11%
-66
- C4 -
2OQ3
-
PTMA_ECOLI
A:
[2-146]
------------------------------------------------------------------------------------------------------------------------------------------
R
L
S
D
Y
F
P
E
S
S
-
I
S
V
I
H
---
S
A
K
D
W
Q
E
----
A
I
D
F
S
M
V
S
L
L
D
K
N
Y
----
I
S
E
N
Y
I
Q
A
I
K
D
S
-
T
I
N
N
-----------
G
P
Y
Y
------------------
I
-
L
A
---
P
G
V
-------------------------------------------------------
A
M
P
H
---------
A
R
P
E
---
C
G
A
L
K
T
G
M
S
L
T
L
L
E
Q
G
V
Y
F
P
G
N
D
-----
E
P
I
K
L
L
I
G
L
S
A
A
D
A
--
D
S
H
I
-
G
-
A
I
Q
A
L
S
E
L
L
C
E
E
E
I
L
E
Q
L
L
T
A
S
S
E
K
Q
L
A
D
I
I
S
R
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
HHSearch
45.47
12%
-59
- C4 -
3T43
-
?
A:
[3-141]
----------------------------------------------------------------------------------------------------------------------------------------------------------------
S
Q
N
D
----
I
I
K
A
L
A
S
P
L
I
N
D
G
M
----
V
V
S
D
F
A
D
H
V
I
T
R
-
E
Q
-------------
N
A
P
T
------------------
G
-
L
P
VEP
V
G
V
-------------------------------------------------------
A
I
P
H
---------
T
D
S
K
---
Y
-
V
R
Q
N
A
I
S
V
G
I
L
A
E
P
V
N
F
E
D
A
G
G
EP
D
P
V
P
V
R
V
V
F
M
L
A
L
G
N
W
--
F
D
I
T
-
N
-
V
L
W
W
I
M
D
V
I
Q
D
A
D
F
M
Q
Q
L
L
V
M
N
D
D
-
E
I
Y
Q
S
I
Y
T
R
I
S
E
A
A
G
M
A
G
I
H
F
R
R
H
Y
V
R
H
L
P
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
HHSearch
43.73
12%
-68
- C4 -
1A3A
-
PTM3C_ECOLI
A:
[4-146]
--------------------------------------------------------------------------------------------------------------------------------------------
L
F
K
L
G
A
E
N
-
I
F
L
G
R
---
K
A
A
T
K
E
E
----
A
I
R
F
A
G
E
Q
L
V
K
G
G
Y
----
V
E
P
E
Y
V
Q
A
M
L
D
R
-
E
K
-------------
L
T
P
T
------------------
Y
-
L
G
---
E
S
I
-------------------------------------------------------
A
V
P
H
---------
G
T
V
E
AKD
R
-
V
L
K
T
G
V
V
F
C
Q
Y
P
E
G
V
R
F
G
E
E
E
D
----
D
I
A
R
L
V
I
G
I
A
A
R
N
---
N
E
H
I
-
Q
-
V
I
T
S
L
T
N
A
L
D
D
E
S
V
I
E
R
L
A
H
T
T
S
V
D
E
V
L
E
L
L
A
G
R
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
41.70
31%
29
- C4 -
2VEF
-
DHPS_STRR6
A:
[35-88]
---------------------------------------------------------------------------------------------------------------------------------------
A
L
Q
Q
A
R
K
L
I
A
E
G
A
-
S
M
L
D
I
G
GE--
S
S
Y
V
E
----
I
E
E
E
I
Q
R
----
V
V
P
V
I
K
A
I
R
K
E
S
D
V
L
I
S
I
D
-
T
W
K
S
Q
V
A
E
A
A
-----
L
A
A
G
------------------
A
-
D
L
---
V
N
D
--
I
------
T
G
L
-------
M
G
D
E
K
M
P
H
V
---------
V
A
-----------
E
A
R
A
Q
V
V
I
M
F
N
P
V
M
A
R
P
Q
H
P
S
S
---
L
-
I
F
P
H
F
G
F
A
F
T
E
L
A
D
F
E
T
L
P
I
E
E
--
L
M
E
A
F
F
E
R
A
L
A
R
A
A
E
A
G
I
A
P
E
N
-
I
-
L
L
D
P
G
I
G
F
G
L
T
K
K
E
N
L
L
L
L
R
D
L
D
K
L
H
Q
K
G
Y
P
I
F
L
G
V
S
R
K
R
F
V
I
N
I
L
E
E
N
G
F
E
V
N
P
E
T
E
L
G
F
R
N
R
D
T
A
S
A
H
V
T
S
I
A
A
R
Q
G
V
E
V
V
R
V
H
D
V
A
S
H
R
M
A
V
E
I
A
S
A
I
R
L
A
D
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
41.28
31%
34
- C4 -
2VEG
-
DHPS_STRR6
A:
[35-88]
---------------------------------------------------------------------------------------------------------------------------------------
A
L
Q
Q
A
R
K
L
I
A
E
G
A
-
S
M
L
D
I
G
GE--
S
S
Y
V
E
----
I
E
E
E
I
Q
R
----
V
V
P
V
I
K
A
I
R
K
E
S
D
V
L
I
S
I
D
-
T
W
K
S
Q
V
A
E
A
A
-----
L
A
A
G
------------------
A
-
D
L
---
V
N
D
--
I
------
T
G
L
-------
M
G
D
E
K
M
P
H
V
---------
V
A
-----------
E
A
R
A
Q
V
V
I
M
F
N
P
V
M
A
R
P
Q
H
P
S
S
---
L
-
I
F
P
H
F
G
F
A
F
T
E
L
A
D
F
E
T
L
P
I
E
E
--
L
M
E
A
F
F
E
R
A
L
A
R
A
A
E
A
G
I
A
P
E
N
-
I
-
L
L
D
P
G
I
G
F
G
L
T
K
K
E
N
L
L
L
L
R
D
L
D
K
L
H
Q
K
G
Y
P
I
F
L
G
V
S
R
K
R
F
V
I
N
I
L
E
E
N
G
F
E
V
N
P
E
T
E
L
G
F
R
N
R
D
T
A
S
A
H
V
T
S
I
A
A
R
Q
G
V
E
V
V
R
V
H
D
V
A
S
H
R
M
A
V
E
I
A
S
A
I
R
L
A
D
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
HHSearch
40.75
11%
-20
- C4 -
2OQT
-
?
A:
[7-151]
----------------------------------------------------------------------------------------------------------------------------------------------
L
I
D
N
N
S
-
I
R
L
G
L
---
S
A
D
T
W
Q
E
----
A
V
R
L
A
V
Q
P
L
I
D
S
K
A
----
V
T
S
A
Y
Y
D
A
I
I
A
S
T
E
K
-------------
Y
G
P
Y
------------------
Y
V
L
M
---
P
G
M
-------------------------------------------------------
A
M
P
H
---------
A
E
A
-L--
G
-
V
N
R
N
A
F
A
L
I
T
L
T
K
P
V
T
F
S
D
--
G
----
K
E
V
S
V
L
L
T
L
A
A
T
D
P
--
S
I
H
T
-
T
V
A
I
P
Q
I
V
A
L
F
E
L
D
N
A
I
E
R
L
V
A
C
Q
S
P
K
E
V
L
E
M
V
E
E
S
K
D
S
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
35.14
37%
116
- C2 -
3CR8
-
?
A:
[298-361]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
R
L
I
A
Y
P
R
M
V
Y
V
E
D
R
A
E
H
L
P
E
A
E
A
P
Q
G
A
R
L
L
T
L
S
G
E
E
F
Q
R
R
M
R
A
GL
K
I
P
E
W
Y
S
F
P
E
-
V
L
A
E
L
H
R
Q
T
P
P
R
E
R
Q
G
F
T
V
F
F
T
G
L
S
G
A
G
K
S
T
L
A
R
A
L
A
A
R
L
M
E
M
G
G
R
C
V
T
L
L
D
G
D
I
V
R
R
-
H
L
S
S
E
L
G
F
S
K
A
H
R
D
V
N
V
R
R
I
G
F
V
-----
A
S
E
I
T
K
N
R
G
I
A
-----
I
C
A
P
I
A
--------------
P
Y
R
Q
T
R
R
D
V
R
A
M
I
----
E
A
V
G
G
F
V
E
I
H
V
A
T
D
P
Y
E
V
P
E
T
P
E
L
--------
A
I
D
T
T
G
L
A
I
D
E
A
V
Q
Q
I
L
L
-------
K
L
E
H
E
G
Y
L
R
L
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
31.20
28%
-57
- C4 -
4CZ8
3
?
A:
[25-137]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
R
T
G
I
S
Y
V
P
I
F
I
L
T
G
--
L
V
---
I
G
P
L
L
K
L
I
P
R
D
---------
L
A
H
E
I
F
D
F
V
R
------
V
F
G
L
V
I
I
L
----------
F
T
E
G
H
N
L
S
W
R
L
L
K
K
N
M
P
T
I
V
T
L
D
T
I
G
L
I
L
T
A
L
I
A
G
F
I
F
K
V
V
FNSS
F
L
L
--
G
F
L
F
G
A
I
I
G
A
T
D
P
A
T
L
I
P
L
F
R
Q
Y
R
V
K
Q
D
I
E
T
V
I
V
T
E
S
I
F
N
D
P
L
G
I
V
L
T
L
I
A
I
S
M
L
V
P
G
Y
G
G
G
I
F
S
T
L
S
E
K
L
G
I
Y
A
G
G
V
I
Y
F
L
Y
N
V
S
V
S
I
11
PsiBlast_PDB
30.70
28%
-49
- C4 -
4CZ9
-
?
A:
[25-137]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
R
T
G
I
S
Y
V
P
I
F
I
L
T
G
--
L
V
---
I
G
P
L
L
K
L
I
P
R
D
---------
L
A
H
E
I
F
D
F
V
R
------
V
F
G
L
V
I
I
L
----------
F
T
E
G
H
N
L
S
W
R
L
L
K
K
N
M
P
T
I
V
T
L
D
T
I
G
L
I
L
T
A
L
I
A
G
F
I
F
K
V
V
FNSS
F
L
L
--
G
F
L
F
G
A
I
I
G
A
T
D
P
A
T
L
I
P
L
F
R
Q
Y
R
V
K
Q
D
I
E
T
V
I
V
T
E
S
I
F
N
D
P
L
G
I
V
L
T
L
I
A
I
S
M
L
V
P
G
Y
G
G
G
I
F
S
T
L
S
E
K
L
G
I
Y
A
G
G
V
I
Y
F
L
Y
N
V
S
V
S
I