@TOME V2.3
(Nov 2016)
Ref.
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Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : PA4308: (2016-02-26 )
MSQANELLIGAGPDGQPVGQAWRLANRHGLIAGATGTGKTVTLQHLAESFSDAGVAVFAADIKGDLCGIAAPGNPQGKVAERIASMPWLNYQPKAYPTTLWDIAGKTGHPLRTTISEMGPLLLANLLELTDSQQAALFAAFQVADREGLLLLDLKDLKALLNHLKDNPEILGEDRALFTGASGQALLRRLATLEQQGAEAFFGEPALQLEDILRPEPDGRGRIHLLDASRLVHEAPKVYATFLLWLLAELFEQLPERGDADKPVLALFFDEAHLLFNGTPKALRDRLEQVVRLIRSKGVGVYFVTQSPGDLPDDVLAQLGLRIQHGLRAFTAKEQKSLRAVADGFRPNPAFDTLGVLTELGIGEALVGTLEEKGTPAMVQRVAVAPPYSRIGPLSDSERAELVQRSPLKGRYDQPIDRESAYEVLANKAGAKPEVQGQATAQQESSSGVGGMAGQILGSLLSNSTVKSAMRQAANQLSRELVRGLLGSLMGGKKRR
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....---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
--------------------------------------------------------------MSQAN
E
L
L
I
GAGPDGQ-----
P
V
G
-
Q
A
W
R
----LANR-----H---
G
L
I
AGATGTG
K
T
V
T
------
L
Q
-
H
L
A
E
S
F-SDA
G
--
V
A
V
F
A
ADIKG
D
L
C
G-IAAPG-----NP---Q
G
K
V
A
E
R
I
ASMPWLNYQPKAYP
T
T
L
W
DIAGKTGH
P
L
R
----
T
T
I
S
EM
G
P
L
L
L
A
----------
N
-
L
L
E
LTDS
Q
Q
A
A
L
F
A
A
F
Q
VADR------E--------------
G
L
L
L
L
D
L
K
D
L
K
A
L
L
---------
N
H----LKD-NPEILGEDR
A
L
F
T-------------GAS
G
Q
A
L
L
R
R
L
A
T
------------
L
-
E
Q
QG
A
E
A
F-----------------------F-G-EP
A
L
Q
L
E
D
ILRPEP-----D-GR
G
R
I
H
L
L
D
A
-
S
R
L
V
H
E
A
---
P
K
V
Y
A
---------------------
T
F
L
--
L
W
---
L
L
A
E
L
F
E
QLPERGD-----ADK
P
V
----------
L
A
L
F
F--DEA
H
-
L
----
L
FN-G
T
P
K
-
A
L
R
D
R
L
-
E
Q
V
V
------
R
L
I
R
SKG
V
G
V
----
Y
F
--------------------
V
T-QSPG--D--L
P
D
-----------------
D
V
L
A
Q
L
--
G
--
L
R
I
------
Q
-
H
G
L
R
A
F
T
A
K
E
Q
K
S
L
R
A
V
A
---DGFRPNPA------------
F
D
T
L
G
V
L
T
E-------LGI
G
E
A
--
L
V
G
T
L
E---EKG
T
P
A
M
V
Q
R
VAVAP
P
Y
SRIG-PLS
D
S
E
R
A
E
L
V
Q
RSPLKGRYDQPI
D
R
E
S
A
Y
E
V
L
A
NK-------------AGAKPEV---------QGQATAQQESSSG-----V
G
G
M
A
G
Q
I
L
G
S
L
L------S---
N
S
T
V
K
S
A
M
R
Q
-
A
A
N
Q
L
S
R
-----
E
L
V
R
G
L
L
G
S
LMGGKKRR---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
67
Fugue
79.87
19%
-77
- C9 -
4AG6
3
?
A:
[3-385]
------------------------------------------------------------S
G
I
N
D
G
S
G
I
V
L
G
K
D
R
D
G
G
-----
L
V
L
V
D
I
W
K
RGGD
R
T
N
S
-----
N
---
W
T
I
L
A
K
P
G
A
G
K
S
F
T
------
A
K
M
L
L
L
R
E
Y
M
Q
--
G
--
S
R
V
I
I
I
D
P
E
R
E
Y
K
E
M
C
R
K
L
G
-----
G
---------------
V
W
I
N
C
T
G
G
E
G
K
I
N
P
L
Q
V
R
L
R
P
Q
S
P
L
A
----
L
H
I
Q
T
L
R
T
F
F
S
L
----------
Y
-
L
R
D
L
T
D
T
E
K
A
A
L
E
D
A
L
V
E
V
Y
K
------
E
--------------
A
G
I
T
W
D
-
T
D
P
R
G
V
P
---------
N
D
KWPT
V
K
E
-
L
Y
E
Y
C
V
K
K
A
E
-
E
N
-------------
P
E
T
Y
G
R
L
S
V
L
L
K
R
------------
A
-
A
E
G
A
D
S
Y
L
-----------------------
W
-
A
-
G
P
---------
T
A
V
-----
E
-
A
D
S
D
F
I
V
F
D
V
-
H
D
L
Q
N
A
E
---
D
Q
V
K
R
---------------------
A
Q
Y
--
F
N
---
V
L
S
F
A
W
N
I
L
E
R
D
R
R
-----
E
R
-------------
T
V
L
V
V
--
D
E
A
W
M
L
----
V
D
P
-
Q
T
P
Q
-
A
I
A
-
F
L
-
R
D
T
S
------
K
R
I
R
K
Y
N
G
S
L
----
I
V
--------------------
I
S
-
Q
---------------------------------------------------
N
V
I
D
F
L
---
A
P
E
V
Q
R
Y
G
---
Q
A
L
L
D
N
P
T
------------
Y
K
L
L
------------
L
A
Q
G
E
K
--
D
L
E
A
I
T
---
T
L
-------------------
M
N
L
S
E
A
E
H
D
L
L
V
N
A
K
R
----------------------------------------------------------------------
G
E
G
L
F
V
A
G
T
Q
R
------
I
---
H
I
K
I
E
A
A
P
Y
E
M
Q
Y
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
71
Fugue
72.98
19%
-36
- C4 -
4KVM
11
NAT1_SCHPO
A:
[5-731]
QLS
P
K
E
I
T
L
F
R
T
A
L
K
C
Y
E
T
KQY
K
K
G
L
K
A
I
EPLLERHPEH
G
E
S
L
A
I
K
G
I
L
L
H
S
LGNT
K
E
G
Y
D
N
V
R
L
G
L
R
N
D
V
G
S
G
V
C
W
H
-----
I
F
G
-
L
I
S
R
----
A
D
K
D
-----
Y
---
V
Q
A
A
K
C
Y
I
N
A
H
K
L
E
KNN
S
S
L
L
R
-
D
L
A
L
L
Q
-
S
Q
L
R
--
Q
Y
K
A
L
A
D
T
R
N
A
L
L
Q
-
D
N
-
P
G
-----
V
R
---
A
N
W
S
A
L
A
V
A
Q
F
L
R
G
E
Y
A
S
A
Y
K
I
V
D
A
F
E
S
T
I
N
Q
G
V
P
V
-----
D
T
Q
E
E
S
E
A
M
L
F
M
----------
N
-
L
V
I
L
K
K
D
G
V
E
D
A
Y
K
H
L
L
S
I
E
K
------
K
VLD
R
V
A
F
L
E
T
R
A
E
Y
E
L
Y
L
S
K
M
E
E
A
K
S
T
I
---------
Y
L
----
L
L
D
R
N
P
D
N
H
Q
Y
Y
Y
N
L
Q
R
A
Y
GYEDASGKVLD
S
A
E
W
L
N
L
Y
S
Q
L
A
K
RYPKSE
C
P
T
R
L
P
L
-
E
K
L
E
G
D
E
F
-----------------------
L
-
T
-
H
V
D
L
Y
L
R
K
K
L
K
R
G
I
PS
V
F
V
D
-
V
K
S
L
Y
K
D
T
K
K
-
C
K
V
V
E
D
L
---
V
S
K
Y
A
S
S
L
S
TTNKFSEDDDNS
Q
I
E
I
P
T
T
L
--
L
W
T
Y
Y
F
L
A
Q
H
F
D
H
V
G
E
L
E
K
-----
A
E
K
Y
V
D
L
A
I
D
H
TPTL
V
E
L
F
M
--
T
K
A
R
-
I
----
S
K
H
K
G
E
L
Q
-
T
A
M
E
I
M
-
D
H
A
R
K
L
D
LQD
R
F
I
N
G
K
C
A
K
Y
----
M
L
R
N
DE
N
E
L
A
A
K
T
V
SLFTRNEA
V
G
-
G
A
V
G
--
D
--
L
A
D
M
QC
L
W
Y
M
L
E
D
G
K
S
F
A
R
Q
K
K
F
A
L
A
--
L
--
K
R
F
------
S
-
T
V
F
K
I
F
D
T
W
A
D
D
Q
F
D
F
H
F
---
F
A
F
R
K
G
S
L
------------
R
T
Y
L
D
L
M
S
W
E
D
S
V
YDD
P
S
F
R
E
A
--
A
Q
G
S
I
E
I
Y
F
A
L
F
D
L
P
F
A
K
Y
S
P
K
L
P
D
F
E
K
L
S
-
S
G
E
I
N
E
E
E
E
K
K
I
Y
K
K
L
K
K
D
L
S
K
R
L
E
R
A
E
K
L
K
E
A
D
K
S
RKYDEDPLGENLV
A
T
S
E
P
L
K
---------
E
A
Q
K
C
L
E
K
L
L
P
Y
G
DKNP
S
A
Y
I
L
A
A
Q
L
Y
T
R
L
K
------
N
---
F
D
T
A
S
K
Y
L
E
Q
-
A
K
V
I
L
G
Q
ND
P
T
V
I
S
T
E
K
F
Y
N
S
I
K
T
Q
S
N
A
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
73
Fugue
72.27
26%
-33
- C9 -
4NH0
5
?
A:
[246-1147]
----------------------------------SANMT
L
T
S
L
L
HIDNPYNLD
P
A
V
L
W
RPRP
Q
R
N
R
L
R
V
P
I
G
L
D
A
D
G
R
-----
P
L
E
-
L
D
I
K
----
E
S
A
Q
GGMGP
H
---
G
L
C
I
G
A
T
G
S
G
K
S
E
L
------
L
R
-
T
L
V
L
A
L
-
A
------------------------------------------------
M
T
H
S
P
E
V
L
N
F
V
L
V
D
F
K
G
-----------------------------------------------------------------------------
G
A
T
F
L
G
M
E
G
L
R
H
V
S
---------
A
I
----
I
T
N
-
L
E
E
E
L
P
L
V
D
R
M
Y
D
-------------
A
L
H
G
E
-
M
V
R
R
Q
E
H
------------
L
-
R
H
S
G
N
Y
A
--------------------------------
S
L
R
D
Y
E
K
A
R
M
-----
E
-
G
A
P
L
P
P
M
------------------------------------------------------------------------
P
T
----------
L
F
I
V
L
--
D
E
F
S
-
E
----
L
L
S
-
A
K
P
D
--
F
A
E
L
F
-
V
M
I
G
------
R
L
G
R
S
L
G
V
H
L
----
L
L
--------------------
A
S
-
Q
R
-------
L
E
E
-----------------
G
K
L
R
G
L
--
D
TH
L
S
Y
------
R
-
I
G
L
R
T
F
S
A
M
E
S
R
V
V
L
G
V
P
---
D
A
Y
E
L
P
P
---------------------
S
-------
P
G
N
G
Y
L
--
K
F
A
T
-------------------
E
P
L
V
R
-------------
F
K
A
A
Y
V
S
G
P
V
D
E
E
--
S
E
S
L
F
D
V
V
V
R
Q
L
------------
A
G
H
G
P
E
P
---------
H
Q
I
W
L
P
P
L
D
V
P
P
T
-------------
L
D
E
L
L
------
P
---
P
L
S
P
S
A
A
H
G
Y
-
T
A
D
G
W
E
W
--------
R
G
R
L
H
A
V
V
G
L
V
D
R
P
FDQ
R
R
D
P
YWLDLSGGAG
H
V
G
V
A
G
G
P
QTG
K
S
T
M
L
R
T
L
I
T
S
L
A
L
L
H
TPQE
V
Q
F
Y
C
LDFGGGTLAGLAELPHVG
S
V
A
T
RLD
A
D
R
I
R
R
T
V
A
E
V
S
A
L
L
E
Q
R
E
Q
E
F
T
E
R
GIDS
M
A
T
Y
R
R
L
R
A
T
GEYAGDGF
G
D
V
F
L
V
V
DN
W
L
T
L
R
Q
DY
E
A
L
E
D
S
I
T
Q
L
A
A
R
GLGYG
I
H
V
V
L
S
S
NKWSEFR
T
S
I
R
D
L
LG
T
K
L
E
L
RLGDPYESEVD
R
K
K
A
A
N
VPENRPG
R
G
L
T
RDG
Y
H
F
L
T
A
L
PRIDGDTSAET
L
T
E
G
I
A
T
T
V
K
T
I
R
E
A
W
HGPTAPPVRMLPNVLPAAQLPSAAESGTRIPIGIDEDSL
S
P
V
Y
L
D
FNTDP
H
F
L
V
F
G
D
T
ECG
K
S
N
L
L
R
L
I
T
A
G
I
I
E
R
Y
TPQQ
A
R
L
I
F
IDYSRSLLDVATTEHQIGYAAS
S
T
A
A
S
S
L
V
R
D
I
K
G
A
M
E
A
R
LPPPDLT
P
E
Q
L
R
S
RSW
W
T
G
A
E
L
F
L
V
V
D
DYEMVATSDNPLRPLAELLPQARDIG
L
H
L
I
I
A
R
S
MGGAGRALYE
P
I
I
Q
R
I
K
E
M
A
S
P
G
L
V
M
S
GNKDEGILLGN
V
K
P
H
KLPQG
R
G
Y
F
V
E
RRS
G
T
R
L
I
Q
T
A
Y
R
E
S
42
HHSearch
64.54
16%
-73
* C9 *
1E9R
2
?
A:
[45-410]
------------------------------------------------------------------------------------
V
P
-
M
P
R
D
----
A
E
P
R
-----
H
---
L
L
V
N
G
A
T
G
T
G
K
S
V
L
------
L
R
-
E
L
A
Y
T
G
-
L
L
R
G
--
D
R
M
V
I
V
D
P
N
G
D
M
L
S
-
K
F
G
R
D
------------------
K
D
I
I
L
N
P
Y
D
Q
R
T
K
G
W
S
F
F
N
E
I
R
N
D
-
Y
D
W
Q
----
R
Y
A
L
S
V
V
P
R
G
K
T
----------
D
E
A
E
E
W
A
S
Y
G
R
L
L
L
R
E
T
A
K
K
L
A
L
------
I
--------------
G
T
--
P
S
M
R
E
L
F
H
W
T
TIAT
F
D
D
L
R
G
F
----
L
E
G
-
T
L
A
E
--
S
L
F
A
G
---------------
S
N
E
A
S
K
A
L
T
S
A
R
F
------------
V
-
L
S
D
K
L
P
E
H
-----------------------
V
T
M
P
D
G
D
F
S
I
R
S
W
L
E
D
---------
P
N
G
G
N
L
F
I
T
W
-
R
E
D
M
------
G
P
A
L
R
---------------------
P
L
I
--
S
A
---
W
V
D
V
V
C
T
S
I
L
S
L
P
E
-----
E
P
K
R
R
----------
L
W
L
F
I
--
D
E
L
A
-
S
----
L
E
K
-
L
-------
A
S
L
-
A
D
A
L
------
T
K
G
R
K
A
G
L
R
V
----
V
A
--------------------
G
L
-
Q
S
T
S
--
Q
--
L
D
D
V
YG
V
K
E
A
Q
---------
T
L
R
A
S
F
--
R
--
S
L
V
------
V
-
L
--
G
G
S
-
R
T
D
P
K
T
N
E
D
M
S
---
L
S
L
G
E
H
E
V
E
R
D
RA
L
E
R
V
R
E
R
V
V
M
P
A
E
I
A
N
-------
L
P
D
L
T
A
--
Y
V
G
F
A
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
69
Fugue
62.67
16%
-43
- C9 -
1E9R
2
?
A:
[4-436]
-------------------------------------------VGQGEFGGAPFKRFLR
G
T
R
I
V
S
G
G
K
L
K
R
M
T
R
E
K
A
K
Q
V
T
V
A
G
V
P
-
M
P
R
D
----
A
E
P
R
-----
H
---
L
L
V
N
G
A
T
G
T
G
K
S
V
L
------
L
R
-
E
L
A
Y
T
G
-
L
L
R
G
--
D
R
M
V
I
V
D
P
N
G
D
M
L
S
-
K
F
G
R
D
K
D
I
I
L
N
P
---
Y
D
Q
R
T
K
G
W
S
F
F
N
E
I
R
N
D
Y
D
W
Q
R
Y
A
L
S
V
V
P
R
G
K
T
D
E
A
E
----
E
W
A
S
Y
G
R
L
L
L
R
E
----------
T
-
A
K
K
L
A
L
I
G
T
P
S
M
R
E
L
F
H
W
T
T
I
------
A
-------------------
T
F
D
D
L
R
G
F
L
---------
E
G
----
T
L
A
-
E
S
L
F
A
G
S
N
E
A
S
K
A
-------------
L
T
S
A
R
F
V
L
S
D
K
L
------------------
P
E
H
V
T
-----------------------
M
-
P
-
D
G
D
F
S
I
R
S
W
L
E
D
P
N
-----
G
-
G
N
--
L
F
I
T
W
R
-----
E
D
M
---
G
P
A
L
R
---------------------
P
L
I
--
S
A
---
W
V
D
V
V
C
T
S
I
L
S
L
P
E
-----
E
P
K
R
R
----------
L
W
L
F
I
--
D
E
L
A
-
S
----
L
E
K
-
L
A
S
-------
L
-
A
D
A
L
------
T
K
G
R
K
A
G
L
R
V
----
V
A
--------------------
G
L
-
Q
S
T
S
--
Q
--
L
D
D
-----------------
V
Y
-----------------------------
G
V
K
E
A
Q
T
L
R
---
A
S
F
R
S
L
V
V
------------
L
G
G
------------------------
S
R
T
---
D
P
K
T
N
E
D
M
S
L
S
L
G
E
H
E
V
E
R
D
R
-
A
L
E
R
V
R
E
R
V
V
M
---------
P
A
E
I
A
N
L
P
D
L
T
A
Y
V
G
F
-------------
A
G
N
R
P
I
A
---------
K
V
P
L
E
I
K
Q
F
A
N
R
Q
-----
P
A
F
V
E
G
T
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
74
Fugue
55.58
13%
-49
- C3 -
4WZR
1
K0020_HUMAN
A:
[9-524]
-------------------------------------------------------N
Y
D
I
V
V
R
A
K
Q
M
W
E
I
L
R
R
K
D
C
D
K
E
-----
K
R
V
-
K
L
M
S
----
D
L
Q
K
-----
L
I
QG
K
I
K
T
I
A
F
A
H
D
S
T
R
V
------
I
Q
-
C
Y
I
Q
Y
G
-
N
E
E
Q
--
R
K
Q
A
F
E
E
L
R
D
D
L
V
E
-
L
S
K
A
-------------
K
Y
S
R
N
I
V
K
K
F
L
M
Y
G
S
K
P
Q
I
A
E
I
I
R
S
F
K
G
H
V
R
K
M
L
R
H
A
E
A
S
A
I
V
E
Y
A
Y
N
D
K
A
----------
I
-
L
E
Q
R
N
M
L
T
E
E
L
Y
G
N
T
F
Q
L
Y
K
S
ADHPT
L
D
--------------
K
V
L
E
L
Q
P
E
K
L
E
L
I
M
---------
D
E
----
M
K
Q
-
I
L
T
P
M
A
Q
K
E
A
V
I
K
-------------
H
S
L
V
H
K
V
F
L
D
F
F
T
------------
Y
A
P
P
K
L
R
S
E
M
-----------------------
I
-
E
-
A
I
R
E
A
V
V
Y
L
A
H
T
H
D
-----
G
-
A
R
V
A
M
H
C
L
W
H
-
G
---------
T
P
K
D
R
---------------------
K
V
I
--
V
K
---
T
M
K
T
Y
V
E
K
V
A
N
G
Q
Y
-----
S
H
L
V
L
----------
L
A
A
F
D
CI
D
D
T
K
-
L
----
V
K
Q
-
I
I
I
S
-
E
I
I
S
S
L
-
P
S
I
V
------
N
D
K
Y
G
R
K
V
L
L
----
Y
L
--------------------
L
S
P
R
D
P
A
--
H
--
T
V
R
-----------------
E
I
I
E
V
L
Q
K
G
--
D
G
N
------
A
-
H
S
K
K
D
T
E
V
R
R
R
E
L
L
E
S
I
S
---
P
A
L
L
S
Y
L
Q
------------
E
H
A
Q
E
V
V
L
D
KSA----
C
V
L
V
S
D
--
I
L
G
S
A
T
---
G
D
V
Q
P
T
M
N
A
I
A
S
L
A
A
T
--
G
L
H
-
P
G
G
K
D
G
E
L
H
I
A
E
H
P
A
G
H
L
V
L
K
W
L
I
E
Q
D
K
K
M
K
E
N
G
R
E
-------------
G
C
F
A
K
T
L
---------
V
E
H
V
G
M
K
N
L
K
S
W
A
-----
S
V
N
R
G
A
I
I
L
S
S
L
L
Q
SCD
L
E
V
---
A
N
K
V
K
A
A
L
K
S
-
L
I
P
T
L
E
S
-----
K
G
I
E
I
L
L
E
K
L
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
72
Fugue
52.50
14%
-21
- C1 -
7REQ
2
MUTB_PROFR
A:
[3-559]
--------------------------------------------------------------
L
P
R
F
D
S
V
D
L
G
N
A
P
V
P
A
-----
D
A
A
-
R
R
F
E
----
E
L
A
A
-----
K
---
A
G
T
G
E
A
W
E
T
A
E
Q
I
P
------
V
G
-
T
L
F
N
-------------
E
D
V
Y
K
D
M
D
W
L
-
D
T
Y
A
G
-----
I
P
PFV
H
G
P
Y
A
T
M
Y
A
F
R
P
W
-
T
I
R
Q
Y
A
G
F
S
T
A
K
E
S
N
A
F
Y
R
R
N
L
A
----
A
G
Q
K
G
L
S
V
A
F
D
L
----------
P
-
T
H
R
G
Y
D
S
D
N
P
R
V
A
G
D
---
V
G
M
------
A
--------------
G
V
A
I
D
S
I
Y
D
M
R
E
L
F
---------
A
G
----
I
P
------
L
D
Q
M
S
V
S
M
T
MN-----------
G
A
V
L
P
I
L
A
L
Y
V
V
T
------------
A
-
E
E
Q
G
V
K
P
E
Q
L
A
G
T
I
QND
I
L
K
E
F
M
VRNTYIYP
P
-
Q
-
P
S
M
R
I
I
S
E
I
F
A
Y
T
S
-----
A
-
N
M
P
K
W
N
S
I
S
I
S
G
Y
H
M
Q
E
A
GAT
A
D
I
E
M
---------------------
A
Y
T
--
L
A
---
D
G
V
D
Y
I
R
A
G
E
S
V
G
L
NVDQF
A
P
R
L
S
----------
F
F
W
G
I
--
G
M
N
F
-
F
----
M
E
V
-
A
K
L
R
-
A
A
R
M
L
W
-
A
K
L
V
------
H
Q
F
G
P
K
N
P
K
S
M
S
L
R
T
H
--------------------
S
Q
-
T
S
G
W
--
S
--
L
T
A
-----------------
Q
D
V
Y
N
N
--
V
--
V
R
T
------
C
-
I
E
A
M
A
A
T
Q
G
H
T
Q
S
L
H
T
N
S
LDE
A
I
A
L
P
T
D
F
------------
S
A
R
I
A
R
N
T
Q
-------
L
F
L
Q
Q
E
SG
T
T
R
V
I
D
---
P
W
S
G
S
A
Y
V
E
E
L
T
W
D
L
A
R
K
A
W
G
-
H
I
Q
E
V
E
K
V
G
G
M
A
K
A
I
E
K
G
I
P
K
M
R
I
E
E
A
A
A
R
T
Q
A
R
I
D
-------------
S
G
R
Q
P
L
I
GVNKYRLEH
E
P
P
L
D
V
L
K
V
D
N
S
T
-----
V
L
A
E
Q
K
A
K
L
V
K
L
R
------
A
E
RD
P
E
K
V
K
A
A
L
D
K
-
I
T
W
A
A
G
N
-----
P
D
D
K
D
P
D
R
N
L
L
K
L
C
I
D
A
G
R
A
MAT
V
G
E
M
S
D
A
L
E
K
V
F
G
R
Y
T
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
66
Fugue
51.66
14%
-49
- C9 -
4KFU
6
?
A:
[2-206]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
P
D
D
I
V
V
L
V
-------------
G
R
K
K
S
G
K
S
Y
L
I
K
H
------------
Y
-
F
I
P
V
L
K
A
H
-----------------------
K
-
I
-
S
Y
I
I
D
D
H
N
L
L
R
S
G
S
-----
E
Y
S
K
F
G
Y
N
A
T
S
L
-
S
D
I
V
S
K
Q
---
Y
V
V
V
Y
---------------------
D
R
A
KN
D
D
---
F
F
E
K
L
W
Q
A
S
K
L
H
S
K
-----
K
Y
G
T
-----------
T
V
L
I
I
--
D
E
A
Y
-
Y
----
H
F
K
-
Y
K
Q
K
-
V
T
-
P
A
I
-
D
E
A
L
------
H
A
N
R
H
A
G
L
G
L
----
I
L
--------------------
S
T
-
Q
R
V
Y
--
D
--
L
M
P
-----------------
I
V
Y
K
Q
A
--
D
--
L
I
I
M
F
Y
TRE
P
-
N
E
L
R
W
I
S
K
Y
I
S
A
E
A
A
E
K
V
---
K
T
L
K
Q
Y
H
F
------------
L
I
Y
D
V
N
S
Q
T
-------
I
K
I
H
K
P
--
I
L
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
68
Fugue
50.07
24%
-83
- C2 -
3WX4
-
ARN_BPT4
A:
[1-98]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
I
I
D
S
Q
---
S
V
V
Q
Y
---------------------
T
F
K
--
I
D
---
I
L
E
K
L
Y
K
F
L
P
N
L
--------
Y
H
S
I
----------
V
N
E
L
V
--
E
E
L
H
-
L
E
N
ND
F
L
I
-
G
T
Y
K
-
D
L
S
K
A
--------------------
G
Y
----
F
Y
--------------------
V
I
-
P
A
P
G
--
K
--
N
I
D
-----------------
D
V
L
K
T
I
--
M
--
I
Y
V
------
H
D
Y
E
I
E
D
Y
F
E
L
E
H
H
H
H
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
47.94
27%
-27
- C8 -
4AK9
-
?
A:
[185-341]
-------------------------------------------------------------------------------------------------------------
M
I
V
G
V
N
G
G
G
K
T
T
T
------
L
G
-
K
L
A
N
R
F
-
K
K
E
G
--
V
K
V
L
M
A
--
A
G
D
T
----
A
A
A
G
-----
E
Q
---
L
E
V
W
A
Q
R
T
G
S
E
I
V
M
A
----
P
R
P
------
A
A
V
L
S
Q
A
V
R
----
R
A
V
E
E
D
F
D
V
V
L
C
D
T
S
G
R
LHTN
Y
N
-
L
M
E
E
L
R
G
C
K
R
A
V
S
K
A
L
S
S
A
P
N
------
E
--------------
V
L
L
V
L
D
G
T
T
G
L
N
M
L
---------
A
Q
----
A
R
E
-
F
N
Q
V
I
G
V
T
G
F
I
L
T
-------------
K
L
D
G
T
A
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
47.26
26%
-46
- C10 -
4D2I
1
?
A:
[349-447]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
I
----------
I
A
V
I
---
E
E
A
H
-
V
----
F
L
S
-
K
N
E
N
-
T
L
T
K
Y
W
A
S
R
I
A
------
R
E
G
R
K
F
G
V
G
L
----
T
I
--------------------
V
S
-
Q
R
P
K
--
G
--
L
D
E
-----------------
N
I
L
S
Q
M
--
T
--
N
K
I
------
I
---
L
K
I
I
E
P
T
D
K
K
Y
I
L
E
S
S
---
D
----
N
L
S
------------
E
D
L
A
E
Q
L
S
S
-------
L
D
V
G
E
A
--
I
I
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
HHSearch
46.89
19%
-47
- C10 -
2IUS
-
FTSK_ECOLI
A:
[1112-1209]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
E
P
Y
----------
I
V
V
L
V
--
D
E
F
A
-
D
----
L
M
M
-
T
V
G
K
-
K
V
E
E
L
I
-
A
R
L
A
------
Q
K
A
R
A
A
G
I
H
L
----
V
L
--------------------
A
T
-
Q
R
P
S
VD
V
--
I
T
G
-----------------
L
I
K
A
N
I
--
P
--
T
R
I
------
A
-
F
--
T
V
S
S
K
I
D
S
---
R
T
I
------
L
D
Q
A
----------------
G
A
--
E
S
L
-------
L
G
M
G
D
M
--
L
Y
S
G
P
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
44
HHSearch
44.39
17%
-41
* C10 *
2IUT
1
FTSK_PSEAE
A:
[341-437]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
T
L
P
T
----------
I
V
V
V
V
--
D
E
F
A
-
D
----
M
M
M
-
I
V
G
K
-
K
V
E
E
L
I
-
A
R
I
A
------
Q
K
A
R
A
A
G
I
H
L
----
I
L
--------------------
A
T
-
Q
R
P
S
--
V
DV
I
T
G
-----------------
L
I
K
A
N
I
--
P
--
T
R
I
------
A
-
F
--
Q
V
S
S
K
I
D
S
R
T
---
I
------
L
D
Q
G
----------------
G
A
E
--
Q
L
-------
L
G
H
G
D
M
--
L
Y
L
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
45
HHSearch
41.84
16%
-40
- C10 -
2R2A
-
?
A:
[88-150]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
----------
S
I
V
I
V
--
D
E
A
Q
-
D
----
V
W
P
-
A
R
S
A
G
S
K
I
P
E
N
-
V
Q
W
L
------
N
T
H
R
H
Q
G
I
D
I
----
F
V
--------------------
L
T
-
Q
G
P
K
--
L
--
L
D
Q
-----------------
N
L
R
T
L
V
--
R
--
K
H
Y
------
H
-
I
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
41.41
30%
-47
- C6 -
4H79
1
?
A:
[112-163]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
W
---
G
L
G
E
A
V
R
R
L
M
P
S
S
E
-----
I
D
E
P
L
----------
R
K
R
F
V
--
Q
V
G
H
-
A
----
V
----
T
Y
K
-
A
L
A
Q
R
L
-
R
E
I
V
------
T
L
L
R
R
D
A
I
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
39.36
30%
-29
- C8 -
3NXS
1
?
A:
[42-138]
----------------------------------------------------------------
Q
A
Q
Q
L
L
L
D
L
M
P
E
A
--------
G
-
S
A
---------
M
-----
H
---
V
G
I
T
G
V
P
G
V
G
K
S
T
T
------
I
E
-
A
L
G
M
H
L
-
I
E
A
G
H
R
V
A
V
L
A
V
D
-------------------------
R
M
A
-
R
L
A
V
H
P
D
A
Y
I
R
P
S
P
T
S
G
T
L
G
G
V
A
K
A
T
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
34.33
45%
102
- C8 -
1GL7
2
?
B:
[54-107]
--------------------------------------------------------------------------------------------------
R
-----
H
---
L
L
V
N
G
A
T
G
T
G
K
S
V
L
------
L
R
-
E
L
A
Y
T
G
-
L
L
R
G
--
D
R
M
V
I
V
D
P
N
G
D
M
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
PsiBlast_CBE
34.25
45%
90
- C8 -
1GKI
3
?
D:
[54-107]
--------------------------------------------------------------------------------------------------
R
-----
H
---
L
L
V
N
G
A
T
G
T
G
K
S
V
L
------
L
R
-
E
L
A
Y
T
G
-
L
L
R
G
--
D
R
M
V
I
V
D
P
N
G
D
M
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
PsiBlast_CBE
34.22
45%
94
- C8 -
1E9R
1
?
E:
[54-106]
--------------------------------------------------------------------------------------------------
R
-----
H
---
L
L
V
N
G
A
T
G
T
G
K
S
V
L
------
L
R
-
E
L
A
Y
T
G
-
L
L
R
G
--
D
R
M
V
I
V
D
P
N
G
D
M
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
32
PsiBlast_CBE
33.39
45%
93
- C8 -
1E9R
1
?
G:
[54-106]
--------------------------------------------------------------------------------------------------
R
-----
H
---
L
L
V
N
G
A
T
G
T
G
K
S
V
L
------
L
R
-
E
L
A
Y
T
G
-
L
L
R
G
--
D
R
M
V
I
V
D
P
N
G
D
M
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------