@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 : PA0043: (2015-12-19 )
MGYWRQRRALGGRRTAVRAPRGRLLLWCAQARRHPLSRRMESSMTLSLDLLLSLCTALAIGLLIGAERGWQERDHEDARQIAGIRTFSLAGLLGGFATLLAGELGSAVWVALLLALAALAVAGYVSDVRRGGDQGMTTEIALLMTFLLGSLALTEQRLLAAAGGIVLTLLLSLKDKLHALLKRLTAEELSGTLKLLFISVVLLPVLPNQGYGPWAFFNPYLTWWMVVLIAALGFSAYLAIRLIGSRKGLLLTAVLGGLVSSTVMTLTLARLRERMPDALLACALLATSALMFPRILVEIGAIHPALLKELALPFAATTLVYLGGTLFHALRGGRASQEAPDEPGLRNPFELLPALRFAALLSAILLLVEVGRRLFGDAGIYAVALLSGLADVDAITLSLARAAQGELDPGVASRGIALAALSNSLVKAGLVVLVGGKRLALQTLPFSLAGLLVGALLILL
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----------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
------------MG
Y
-----------
W
R
Q
R
R
AL-----GGRRT-AVRAPRG
R
L
L
L
W
C
A
Q
ARRH
P
L
S
--
R
R
M
E
SSMT
L
S
L
D
--
L
L
L
S
L
C
T
A
L
A
I
-
G
L
L
IGAERG--WQER
D
H
E
D
A
-
R
-
Q
I
AGIR
T
F
S
L
A
G
L
L
G
G
---------
F
A
T
L
L
A
G
E
L
---
G
S
A
V
----------
W
V
A
L
L
L
A
-
L
A
A
L
A
V
A
G
Y
----
V
S
D
V
R
RG---------GDQG
M
T
T
E
I
A
L
L
M
T
F
L
L
G
S
L
A
L
T
E
Q
R
L
L
A
AA
G
G
----
I
V
L
---
T
L
L
L
S
L
K
D
K
L
H
-
A
L
L
K
--
R
L
T
A
E
E
L
S
G
T
L
K
L
-
L
-
F
I
S
V
V
L
L
P-V--LPNQGYG-P-
W
A
F
----
F
N
P
Y
L
T
W
W
M
-
V
V
L
I
A
A
L
G
F
S
A
Y
L
A
I
R
L
IGSRKG
L
L
L
T
A
V
L
G
G
L
V
S
S
T
V
M
T
L
T
L
A
R
-
L
R
------
E
R-M
P
D
A
L
L
-------
A
-
C
A
-
L
L
A
T
S
A
L
M
F
P
R
I
L
V
E
IGAI
H
P
A
L
L
K
E
LAL
P
F
A
A
---
T
-
T
L
V
Y
L
G
G
-
T
L
F
H
A
L
RGGRASQEAPDEPGLR
N
P
------------
F
-
E
L
L
P
A
L
---------
R
F
A
A
L
L
S
A
I
L
-
L
------------
L
V
E
V
-
G
R
----------
R
L-FGD
A
G
-
I
Y
-
A
V
A
L
L
SGL
A
D
V
D
A
I
T
L
S
L
A
R
AAQ-GEL-----------------------DPGVASR
G
I
A
L
A
A
L
-
S
N
S
L
V
KA
G
----
L
V
V
L
VGG
K
R
L
A
L
Q
T
L
P
F
S
L
A
G
--
L
L
V
G
A
L
L
I
LL------------------------------------------------------------------
20
Fugue
85.87
20%
-117
- C3 -
4QT9
2
?
A:
[19-432]
--------------------------------
L
-----
S
D
D
A
L
M
D
T
V
Q
R
R
T
F
L
Y
F
W
E
G
A
E
P
N
S
G
L
A
PE
R
Y
H
V
D
G
V
Y
P
Q
N
D
AN
V
V
T
S
G
G
S
G
F
G
I
M
A
I
L
A
G
I
D
R
G
--
Y
V
T
R
E
E
G
L
A
-
R
M
E
R
I
V
S
F
L
E
K
A
D
R
F
H
G
A
---------
Y
P
H
W
W
Y
G
D
T
---
G
K
V
K
PFGQKDNGGD
L
V
E
T
A
F
L
M
Q
G
L
L
A
V
H
Q
Y
----
Y
A
N
--------------
G
N
D
K
E
K
A
I
A
Q
R
I
D
R
L
W
R
E
V
D
W
D
W
Y
R
K
---
G
G
Q
----
N
V
L
---
Y
W
H
W
S
P
T
Y
G
W
E
M
D
F
---------
P
I
H
G
Y
N
E
C
M
I
M
Y
I
L
A
A
A
S
P
-
T
HG
V
P
A
A
V
Y
H
-
D
G
W
A
Q
----
N
G
A
-----
I
-
V
S
P
H
K
V
E
G
I
E
L
H
L
--
R
Y
Q
G
T
E
A
G
P
L
F
W
A
------
Q
Y
S
F
L
G
L
D
P
V
G
-
L
K
------
D
E
Y
C
P
S
Y
F
H
-------
E
M
R
N
-
L
T
L
V
N
R
A
Y
C
I
R
N
P
K
H
Y
K
G
F
G
P
D
C
-------
W
G
L
---
T
-
A
S
Y
S
V
D
G
-
Y
A
A
H
-------
S
P
N
E
Q
D
D
K
G
V
I
S
P
------------
T
-
A
A
L
S
S
I
---------
V
Y
T
P
E
Y
S
L
Q
V
M
R
------------
H
L
Y
N
M
G
D
----------
K
V
-
F
G
P
F
G
-
F
Y
D
A
F
S
E
T
D
N
W
Y
P
Q
R
Y
L
A
I
D
Q
G
P
I
A
V
M
I
E
N
-----------------------
Y
R
----
T
G
L
L
W
K
L
F
M
S
H
P
D
V
Q
A
G
----
L
T
K
L
----------------
G
--
F
N
T
N
------------------------------------------------------------------------
24
Fugue
82.13
18%
-103
- C3 -
4C8H
-
CTF4_YEAST
A:
[25-476]
------------
F
R
Y
MPFSPAGTPFG
F
T
D
R
R
Y
L
TMNEV
G
Y
V
S
T
-
V
K
N
S
E
Q
Y
S
I
T
V
S
F
F
D
V
G
R
F
-----
R
E
Y
H
F
E
D
L
F
G
Y
D
------
L
C
F
L
N
E
K
-
G
T
L
F
G
Q
S
K
T
G
Q
I
Q
Y
R
P
H
D
S
I
-
H
-
S
--
N
W
T
K
I
------------------
I
P
L
Q
A
G
E
R
---
I
T
S
V
----------
A
A
T
P
V
R
V
-
I
V
G
T
S
L
-
G
Y
----
F
R
S
F
N
Q
F
---------
G
-----
V
P
F
A
V
E
K
T
S
P
I
V
A
L
T
A
Q
N
Y
R
V
F
S
V
H
Y
S
----
Q
F
H
---
G
L
S
Y
S
L
S
E
--------------------
L
K
R
-
Y
-
Y
K
R
E
C
P
L
P
M
S
--
L
P
N
I
N
S
D
M
K
-
K
D
A
----
N
L
D
Y
Y
N
F
N
P
M
G
--
I
K
S
L
F
F
S
S
Y
G
D
P
C
I
F
G
S
D
N
T
L
L
L
L
S
K
W
R
S
P
E
E
S
K
W
L
P
I
L
D
S
N
M
E
I
W
K
M
S
GG
K
E
-
T
T
D
I
H
V
-------
W
-
P
L
-
A
L
A
Y
D
--
T
L
N
C
I
L
V
K
G
K
H
I
W
P
----
E
F
P
L
P
L
P
S
---
E
M
E
I
----
R
M
P
V
F
V
K
S
K
L
L
E
E
N
K
A
I
L
N
K
E
I
Q
I
P
V
------------
S
M
A
A
E
E
E
Y
---------
L
R
S
K
V
L
S
E
L
L
-
T
------------
D
T
L
E
-
N
D
----------
G
E
M
Y
G
N
----
E
-
N
E
V
L
A
A
L
N
G
A
Y
D
K
A
L
L
R
L
F
A
S
A
C
-
S
D
Q
-----------------------
N
V
E
K
A
L
S
L
A
H
E
L
K
Q
-
D
R
A
L
T
A
A
V
----
K
I
S
E
R
A
E
L
P
S
L
V
K
K
I
N
N
I
R
E
A
--
R
Y
E
Q
Q
-----------------------------------------------------------------------
26
Fugue
80.58
18%
-116
- C3 -
4UI9
-
ANC2_HUMAN
N:
[15-730]
-------RPGQE
L
L
V
-----------
A
W
N
T
V
S
T
-----
E
E
L
R
A
-
A
V
E
V
L
R
G
H
V
L
---
E
E
W
F
V
E
V
L
Q
--
N
D
L
Q
A
N
I
S
P
E
F
W
--
N
A
I
S
Q
C
E
N
S
A
C
-
L
L
L
L
L
D
A
F
G
--
L
L
E
S
R
L
D
P
Y
L
R
-
S
L
E
L
L
E
K
W
T
R
L
G
L
L
M
G
TGAQGLREE
V
H
T
M
L
R
G
V
L
FFS
T
P
R
T
----------
F
Q
E
M
I
Q
R
-
L
Y
G
C
F
L
R
V
Y
----
M
Q
S
K
R
K
G
DPELEGELD
S
R
Y
A
R
R
R
Y
Y
R
L
L
Q
S
P
L
W
C
R
Q
A
L
E
Q
F
H
Q
L
S
Q
V
L
H
RLSL
L
E
R
---
V
S
A
E
A
V
T
T
T
L
H
-
Q
V
T
R
--
E
R
M
E
D
R
C
R
G
E
Y
E
R
-
S
-
F
L
R
E
F
H
K
W
-
I
--
E
R
V
V
G
W
L
-
G
-
K
V
F
TLRR
W
R
C
H
V
Q
R
F
F
-
Y
R
I
Y
A
S
L
R
I
E
E
L
F
S
I
V
R
D
F
P
D
S
R
P
A
I
E
D
L
K
Y
C
L
E
R
T
D
Q
R
Q
Q
L
L
V
S
-
L
K
------
A
A
-
L
E
T
R
L
L
HPGVNTC
D
-
I
I
-
T
L
Y
I
S
A
I
K
A
L
R
V
I
D
P
S
M
V
I
L
E
V
A
C
E
P
I
R
R
Y
L
R
T
RED
T
-
V
R
Q
I
V
A
G
-
L
T
D
L
A
V
E
L
S
K
E
P
E
D
W
V
P
D
P
V
D
A
D
P
GKSSSKRRSSDI
I
-
S
L
L
V
S
I
YGSKDLFIN
E
Y
R
S
L
L
A
D
R
L
-
L
HQFSFSPEREIR
N
V
E
L
-
L
K
----------
L
R
-
F
G
E
A
P
M
H
F
-
C
E
V
M
L
K
D
M
A
D
S
R
R
I
N
A
N
I
R
E
E
D
E
-
K
R
P
AEEQPPFGVYAVILSSEFWPPFK
D
E
K
L
E
V
P
E
D
I
R
A
A
L
-
E
A
Y
C
K
K
Y
E
QLKA
M
R
T
L
S
W
K
H
T
L
G
L
V
T
M
D
V
E
L
A
D
RT
L
S
V
A
V
T
P
V
Q
A
VILLYFQDQASWTLEELSKAVKMPVALLRRRMSVWLQQGVLREEPPGTFSVIEEERPQDRDNMVLI
19
Fugue
66.99
18%
-125
- C3 -
4K6N
1
PABC_YEAST
A:
[32-383]
PN
F
E
V
L
A
T
F
R
Y
D
P
G
F
-----------
A
R
Q
S
A
--------
S
K
K
E
-
I
F
E
T
P
D
P
R
L
G
L
R
D
E
D
I
R
Q
Q
I
I
N
--
E
D
Y
S
S
Y
L
R
V
R
E
V
--
N
-----
S
G
G
D
L
-
L
E
N
I
Q
H
P
D
A
--
W
K
H
----
D
C
-
K
-
T
I
V
C
Q
R
V
E
D
M
L
Q
V
I
-----------
Y
E
R
F
F
---
L
---
L
D
E
Q
----------
Y
Q
R
I
R
I
A
-
L
S
Y
F
K
I
--------------------------
D
F
S
T
S
L
N
D
L
L
K
L
L
V
E
N
L
I
N
C
K
E
G
N
S
E
Y
H
E
K
----
I
Q
K
---
M
I
N
E
R
Q
C
Y
K
M
R
-
V
L
V
S
--
K
------
T
G
D
I
R
I
-
E
-
A
I
P
M
P
M
E
P
-
I
--
L
K
L
T
T
D
Y
-----------
D
S
V
S
T
Y
F
I
-
K
T
M
L
N
G
F
L
I
D
S
T
I
N
W
D
V
V
V
S
S
E
P
L
N
A
S
A
F
T
S
F
K
T
T
S
R
---
D
H
Y
A
R
-
A
R
------
V
R
-
M
Q
T
A
I
N
-------
N
-
L
R
G
S
E
P
T
S
S
V
S
Q
C
E
I
L
F
S
N
---
K
S
G
L
L
M
E
G
S
I
T
N
V
A
---
V
-
I
Q
K
D
P
N
G
-----------------------
S
K
------------
K
-
Y
V
T
P
R
L
---------
A
T
G
C
L
C
G
T
M
R
-
H
------------
Y
L
L
R
------------------------------
L
G
L
I
E
E
G
D
I
D
-------
I
-
G
S
L
-----------------------
T
V
G
-------------------
N
----
E
V
L
L
F
N
G
V
M
-----------
G
--
C
I
K
G
T
V
K
T
K
Y
------------------------------------------------------------------
3
PsiBlast_PDB
43.56
27%
-51
- C4 -
3NXS
1
?
A:
[117-228]
--------------------------------------------------------------------------------------------------------------
H
P
D
A
-
Y
-----
I
R
P
S
P
T
S
G
T
L
G
G
---------
V
A
K
-------------------------
A
T
R
E
T
-
I
V
L
L
E
A
A
G
Y
D
V
I
L
V
E
T
V
--
G
---------
V
G
Q
S
E
V
T
V
A
G
M
V
D
T
F
V
F
L
T
L
A
R
T
G
D
Q
L
Q
G
I
K
K
G
----
V
L
E
LAD
V
I
V
V
N
K
A
D
G
E
H
-
A
V
E
A
--
K
A
A
A
R
E
L
S
G
A
I
R
L
-
I
-
Y
P
R
E
S
L
W
R
-
P
--
P
V
L
T
M
S
A
-
V
-
E
G
T
----
G
L
P
E
L
W
E
T
V
-
L
R
H
R
E
V
L
E
E
A
G
E
F
E
A
R
R
R
T
Q
Q
V
E
W
T
W
S
M
V
R
D
A
V
L
D
R
V
M
N
H
P
E
V
R
R
-
I
R
------
D
D
-
V
E
Q
R
V
R
-------
L
-
G
E
-
L
T
P
A
L
A
A
Q
E
I
L
D
A
A
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
HHSearch
40.54
28%
43
- C4 -
3N9T
1
?
A:
[31-61]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
M
Q
S
L
V
R
H
L
H
-
D
F
V
S
E
V
E
L
T
E
Q
E
W
F
E
G
I
R
F
-
L
-
T
A
T
G
Q
K
C
D
-
G
--
K
V
R
Q
E
F
I
-
L
-
L
S
D
----
T
L
G
V
S
M
L
V
D
-
A
I
N
H
R
Q
S
T
N
A
T
E
T
T
V
F
G
P
F
F
I
E
G
M
P
D
R
G
Y
G
E
N
M
A
L
T
D
G
V
P
A
L
V
Y
G
-
R
V
------
L
D
-
V
Q
G
R
P
V
-------
V
-
G
A
-
V
L
D
V
W
Q
T
A
D
N
G
M
Y
S
G
Q
D
P
D
Q
P
F
G
N
L
R
G
R
Y
R
S
D
N
---
D
-
G
C
F
A
I
Q
T
-
T
V
P
V
C
Y
P
I
P
T
D
G
P
V
G
E
M
L
D
A
A
N
R
H
------------
A
-
W
R
P
A
H
L
---------
H
F
M
I
Q
A
P
G
Y
R
-
K
------------
L
V
T
H
-
L
F
----------
N
S
-
D
D
P
Y
L
-
D
S
-
D
A
V
F
G
V
K
G
S
L
Q
V
K
Y
E
D
R
P
A
H
D
E
D
-
A
G
G
-----------------------
L
D
M
P
Y
P
Y
K
S
A
Y
Y
E
F
-
V
M
E
A
E
----------------------------------------------------------------------------------------------------------
12
HHSearch
40.07
14%
70
- C4 -
3HHY
2
CATA_RHOOP
A:
[37-67]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
A
K
D
A
L
G
A
L
N
-
D
V
I
L
K
H
G
V
T
Y
P
E
Y
R
V
F
K
Q
W
-
L
-
I
D
V
G
E
G
G
E
-
W
--
P
L
F
L
D
V
F
-
I
-
E
H
S
----
V
E
E
V
L
A
R
S
R
-
K
G
T
M
G
S
I
E
G
P
Y
Y
I
E
N
S
P
E
L
P
S
K
C
T
L
P
M
R
E
E
D
E
K
I
T
P
L
V
F
S
G
Q
V
T
D
-
L
D
------
G
N
-
G
L
A
G
A
K
-------
V
-
E
L
-
W
H
A
D
N
D
G
Y
Y
S
Q
F
A
P
H
L
P
E
W
N
L
R
G
T
I
I
A
D
E
E
G
R
Y
---
E
-
I
T
T
I
Q
P
A
-
P
Y
Q
I
P
T
D
G
P
T
G
Q
F
I
E
A
Q
N
G
H
P
W
R
P
------------
A
-
H
L
H
L
I
V
---------
S
A
P
G
K
E
S
V
T
T
-
Q
------------
L
Y
F
K
-
G
G
----------
E
W
-
I
D
S
D
V
-
A
S
-
A
T
K
P
E
L
I
L
D
P
K
T
G
D
D
G
K
N
Y
V
T
Y
N
-
F
V
L
-----------------------
D
P
A
---------------------------------------------------------------------------------------------------------------------------
11
HHSearch
37.86
33%
47
- C4 -
1TMX
4
CHQB_NOCSI
A:
[35-66]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
M
Q
A
L
T
R
H
L
H
-
A
F
L
R
E
V
R
L
T
E
A
E
W
E
T
G
I
G
F
-
L
-
T
D
A
G
H
V
T
N
-
E
--
R
R
Q
E
F
I
L
-
L
-
S
D
V
----
L
G
A
S
M
Q
T
I
A
-
M
N
N
E
A
H
G
D
A
T
E
A
T
V
F
G
P
F
F
V
E
G
S
P
R
I
E
S
G
G
D
I
A
G
G
A
A
G
E
P
C
W
V
E
G
-
T
V
------
T
D
-
T
D
G
N
P
V
-------
P
-
D
A
-
R
I
E
V
W
E
A
D
D
D
G
F
Y
D
V
Q
Y
D
D
D
R
T
A
A
R
A
H
L
L
S
G
P
D
---
G
-
G
Y
A
F
W
A
I
-
T
P
T
P
Y
P
I
P
H
D
G
P
V
G
R
M
L
A
A
T
G
R
S
P
------------
M
-
R
A
S
H
L
H
---------
F
M
V
T
A
P
G
R
R
T
-
L
------------
V
T
H
I
-
F
V
----------
E
G
-
D
E
L
L
D
-
R
D
-
S
V
F
G
V
K
D
S
L
V
K
S
F
E
R
Q
P
A
G
A
P
T
P
-
G
G
R
-----------------------
E
I
D
G
P
W
S
R
V
R
F
D
I
V
-
L
A
P
A
-----------------------------------------------------------------------------------------------------------
13
HHSearch
37.15
14%
72
- C4 -
2BOY
1
?
A:
[10-39]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
G
K
M
I
A
A
I
N
-
A
V
I
K
D
E
K
V
S
Y
S
E
Y
K
A
S
T
G
W
-
L
-
I
S
V
G
E
K
N
E
-
W
--
P
L
F
L
D
V
F
-
F
-
E
H
A
----
I
E
S
V
A
A
E
S
N
-
R
G
S
Q
S
S
I
Q
G
P
Y
F
I
P
G
A
P
E
L
S
I
P
Y
T
M
P
M
R
D
D
E
S
G
D
T
L
I
F
R
G
E
V
V
D
Q
-
E
G
------
A
P
-
L
A
D
V
L
L
-------
D
-
M
W
-
Q
A
D
A
A
G
E
Y
S
F
I
N
P
T
L
P
D
Y
L
F
R
G
K
I
R
T
D
E
N
G
R
F
T
---
L
-
R
T
I
V
P
A
P
-
Y
E
I
P
K
N
G
P
T
G
A
L
L
A
A
A
G
W
H
A
W
R
P
A
------------
H
-
L
H
W
I
I
A
---------
K
E
G
Y
E
S
L
T
T
Q
-
L
------------
Y
F
E
N
-
G
Q
----------
W
T
-
G
S
D
V
A
-
N
A
-
V
K
P
E
L
L
L
S
L
D
K
I
E
A
Q
S
G
P
H
F
E
T
S
-
Y
K
F
-----------------------
T
L
G
K
V
-------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
37.09
38%
-77
- C4 -
1QP8
1
?
A:
[35-74]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
L
V
S
--
R
I
T
A
E
E
L
A
K
M
P
R
L
-
K
-
F
I
Q
V
V
T
A
G
-
L
------
D
H
L
-
P
-
W
E
S
----
I
P
P
H
V
T
V
A
G
-
N
A
G
S
N
A
D
A
V
A
E
F
A
L
A
L
L
L
A
P
Y
K
R
I
I
Q
Y
G
E
K
M
K
R
G
D
Y
G
R
D
V
E
I
P
L
I
-
Q
G
------
E
K
-
V
A
V
L
G
L
-------
G
-
E
I
-
G
T
R
V
G
K
I
L
A
A
L
G
A
Q
V
R
G
F
S
R
T
P
K
E
G
P
W
R
F
T
N
S
L
---
E
-
E
A
L
R
E
A
R
-
A
A
V
C
A
L
P
L
N
K
H
T
R
G
L
V
K
Y
Q
H
L
A
L
M
------------
A
-
E
D
A
V
F
V
---------
N
V
G
R
A
E
V
L
D
R
-
D
------------
G
V
L
R
-
I
L
----------
K
E
-
R
P
Q
F
I
-
F
A
-
S
D
V
W
W
G
R
N
D
F
A
K
D
A
E
F
F
S
L
P
N
V
V
-
A
T
P
-----------------------
W
V
A
G
G
Y
G
N
E
R
V
W
R
Q
-
M
V
M
E
A
V
R
N
----
L
I
T
Y
A
T
G
G
R
P
R
N
I
A
K
R
E
D
Y
I
G
------------------------------------------------------------------------------
17
HHSearch
36.78
16%
8
- C4 -
2AZQ
1
?
A:
[33-65]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
I
L
R
V
L
Q
D
T
A
-
R
L
I
E
D
L
E
I
T
E
D
E
F
W
H
A
V
D
Y
-
L
-
N
R
L
G
G
R
N
E
-
A
--
G
L
L
A
A
G
L
-
G
-
I
E
H
----
F
L
D
L
L
Q
D
A
K
-
D
A
E
A
G
L
G
G
G
T
P
R
T
I
E
G
P
L
Y
V
A
G
A
P
L
A
Q
G
E
V
R
M
D
D
G
T
D
P
G
V
V
M
F
L
Q
-
G
Q
------
V
F
-
D
A
N
G
K
P
-------
L
-
A
G
-
A
T
V
D
L
W
H
A
N
T
Q
G
T
Y
S
Y
F
D
S
T
Q
S
E
F
N
L
R
R
R
I
I
T
D
---
A
-
E
G
R
Y
R
A
R
-
S
I
V
P
S
G
Y
G
C
D
P
Q
G
P
T
Q
E
C
L
D
L
L
G
R
------------
H
-
G
Q
R
P
A
H
---------
V
H
F
F
I
S
A
F
G
H
-
R
------------
H
L
T
T
-
Q
I
----------
N
F
-
A
G
D
K
Y
-
L
W
-
D
D
F
A
Y
A
T
R
D
G
L
I
G
E
L
R
F
V
E
D
A
A
A
-
A
R
D
-----------------------
R
G
V
Q
G
E
R
F
A
E
L
S
F
D
-
F
R
L
Q
G
A
Q
S
----
P
D
A
E
A
R
S
H
R
P
R
A
L
Q
E
G
-----------------------------------------------------------------------------------
15
HHSearch
36.69
17%
77
- C4 -
3TH1
1
CLCA_PSEPU
A:
[10-40]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
A
I
V
E
A
V
R
-
K
I
L
L
D
K
R
V
T
E
A
E
Y
R
A
G
V
D
Y
-
L
-
T
E
V
A
Q
T
R
E
-
T
--
A
L
L
L
D
V
F
-
L
-
N
S
T
----
I
I
E
G
K
A
Q
R
S
-
R
T
S
A
P
A
I
Q
G
P
Y
F
L
E
G
A
P
V
V
E
G
V
L
K
T
Y
D
T
D
D
H
K
P
L
I
I
R
G
T
V
R
S
D
T
G
-
E
L
------
L
A
-
G
A
V
I
D
V
-------
W
-
H
S
-
T
P
D
G
L
Y
S
G
I
H
D
N
I
P
V
D
Y
Y
R
G
K
L
V
T
D
S
Q
G
N
Y
R
V
R
---
T
-
T
M
P
V
P
Y
Q
-
I
P
Y
E
G
P
T
G
R
L
L
G
H
L
G
S
H
T
W
R
P
A
H
V
------------
H
-
F
K
V
R
K
D
---------
G
F
E
P
L
T
T
Q
Y
Y
-
F
------------
E
G
G
K
-
W
V
----------
D
D
-
D
C
C
H
G
-
V
T
-
P
D
L
I
T
P
E
T
I
E
D
G
V
R
V
M
T
L
D
F
V
I
E
-
R
-------------------------------------------------------------------------------------------------------------------------------------------------------
10
HHSearch
35.58
10%
58
- C4 -
3O5U
3
CLCA_RHOOP
A:
[10-41]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
D
E
F
T
D
L
I
R
-
D
F
I
V
R
H
E
I
T
T
P
E
Y
E
T
I
M
Q
Y
-
M
-
I
S
V
G
E
A
G
E
-
W
--
P
L
W
L
D
A
F
-
F
-
E
T
T
----
V
D
S
V
S
Y
G
K
G
-
N
W
T
S
S
A
I
Q
G
P
F
F
K
E
G
A
P
L
L
T
G
K
P
A
T
L
P
M
R
A
D
E
P
G
D
R
M
R
F
T
G
S
V
R
D
-
T
S
------
G
T
-
P
I
T
G
A
V
-------
I
-
D
V
-
W
H
S
T
N
D
G
N
Y
S
F
F
S
P
A
L
P
D
Q
Y
L
L
R
G
R
V
V
P
A
E
D
G
S
---
I
-
E
F
H
S
I
R
P
-
V
P
Y
E
I
P
K
A
G
P
T
G
Q
L
M
N
S
Y
L
G
R
H
S
W
------------
R
-
P
A
H
I
H
I
---------
R
I
T
A
D
G
Y
R
P
L
-
I
------------
T
Q
L
Y
-
F
E
----------
G
D
-
P
Y
L
D
S
-
D
S
-
C
S
A
V
K
S
E
L
V
L
P
V
N
K
I
D
I
D
G
E
T
W
Q
-
L
V
D
-----------------------
F
N
F
I
L
Q
H
N
----------------------------------------------------------------------------------------------------------------------
25
Fugue
33.49
18%
10
- C3 -
1DU2
-
HOLE_ECOLI
A:
[1-76]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
L
K
N
L
A
K
-
L
D
------
Q
T
-
E
M
D
K
V
N
-------
V
----
D
L
A
A
A
G
V
A
F
K
E
-----
R
Y
N
M
P
V
I
A
E
A
V
E
R
E
Q
P
E
---
H
-
L
R
S
W
F
R
E
-
R
L
I
A
H
R
L
A
S
V
N
L
S
R
L
P
Y
E
P
K
L
K
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
33.36
27%
113
- C4 -
4FDG
-
MCM_SULSO
B:
[551-604]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
K
S
S
E
T
P
D
S
P
I
L
I
T
P
------------
R
-
Q
L
E
A
L
I
---------
R
I
S
E
A
Y
A
K
M
A
-
L
------------
K
A
E
V
-
T
R
EDAERAINIM
R
L
-
F
L
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
Fugue
30.73
36%
1111
- C2 -
1CB3
2
A:
[1-11]
------------
I
D
Y
-----------
W
L
A
H
K
A
L
-----
A
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
27
Fugue
26.55
36%
713
* C3 *
2O5G
-
B:
[4-19]
---------------------------------------------------------------------------------------------------
A
R
R
K
--
W
Q
K
T
G
H
A
-
V
-
R
-
A
I
G
R
L
S
N
H
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
24.39
37%
156
- C4 -
2LLM
-
A:
[12-43]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
G
S
N
K
G
A
I
I
G
L
M
V
G
G
V
V
I
A
T
V
I
V
I
T
L
V
M
-
L
K
------
K
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
24.11
37%
173
- C4 -
2LOH
-
A4_HUMAN
A:
[12-43]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
G
S
N
K
G
A
I
I
G
L
M
V
G
G
V
V
I
A
T
V
I
V
I
T
L
V
M
-
L
K
------
K
K
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
23.84
54%
567
* C6 *
2YRF
-
MTNA_BACSU
A:
[305-326]
--------------------------------------------------------------------------------------------------
G
A
D
I
P
--
I
E
E
R
D
P
E
E
V
-
R
-
Q
I
S
G
V
R
T
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------