@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 : Wbm0075: (2015-11-28 )
MWIKNKVFNRRAFILGGIQLTISTIFSCRLYSLQIRNRQKYEKLADNNRIRVAAIMPKRGRILDRNGIELAVDKISYIVLFDKQKISSEEVDWETLSEIESNVTKSSETKITALYKRHYPFGSICSHTLGYTKKQQGINEAGISGIEYTYDHILKGKPGRSEQEINSKKRIVRELSSIPQQDGQDVQLTIDIDLQEKIAEIFKGHKGSVTAIDVGNGEILTLYNSPSYDNNLFANKLSNEAWEGLNTPSLPLVNRALSYQIPPGSIFKIIVALAGLKDGIITPEEKFSCVGYMKIGERRFCCLKSKVHGYVSLNEAMALSCNTYFYNIGKKISVDSLVEMARKFGIGSGPLIGAFKEEAPGLLPDKDWRTRKLYSEWYLGDTVNLVIGQGYVLTTPLQLAVLAARIATGKEVIPRIEMSKTMQDFPDIDIAHEHLSIVRKAMFNMVNIKAGTYRKGLSSIRIAGKTGTPEINSKGESHKLFIAYGPYHDPRYAISVFIEYGKAPRQDVAMANEILRYMLKG
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----------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
----------------------------------------------------------------------MWIKNKVFNR
R
A
F
I
LG--
G
I
Q
L
T
I
S
T
I
F
S
C
R
L
Y
S
L
Q
I--R
N
R
Q
K
Y
E
K
LADNN
R
I
R
V
A
A
IMPKR
G
R
ILDRNG
I
E
L
A
--------------
V
D
K
I
S
Y
I
V
L
F
--------DKQKIS------S-------------E------------------------------------------------------------------------------------EV------
D
W
------------
E
------------------
T
L
S
------------
E
I
E
S
N-----------VTKSSE
T
K
I
T
A
L
----------
Y
KRHYP
F
G
S
I
C
S
H
T
LGY
T
----------
K
K
-------------QQ-----------------G
I
N
E
----A---GISG
I
E
Y
T
Y
D
H
ILKGKPG-R
S
E
Q
E
I
N
S
K
-
K
R
I
V
R
E
L
S
---SI-PQ-QDGQ
D
V
Q
L
T
I
D
I
D
L
Q
E
------
K
I
------
A
E
I
F
-K--------G-------------H-------K-G
S
-------
V
T
A
I
DVGN
G
E
I
L
T
L
YNSPSYDNN
L
F
A
N
K
L
S
---
N
E
A
WEGLN-T-PS
L
-
P
L
V
N
R
A
L
S
Y
QI--P
P
G
S
I
F
K
I
I
V
-
A
L
A
GLKDGII
T
P
E
E
K
F
S
C
V
-
G
Y
-
M
KIGE--
R
R
F
----
C
C
L
K
-S----KV
H
G
Y
V
S
LN
E
A
M
A
L
SCN
T
Y
F
YNIGKKI----
S
-----------------
V
D
S
L
V
E
M
A
R
KFGIGSG---P
L
I
G
A
F
K
EEAPGLLP--DKDW
R
T
R
K
L
Y
S
EWYLG
D
T
V
N
L
V
IGQ
G
Y
V
L
T
T
P
L
Q
-
L
A
V
L
A
A
R
IAT-G
K
E
V
-----
I
-
P
R
I
E
------
M
S
K
T
M
Q
D-------F---P----D--I--
D
-
I
-
A
H
E
H
L
S
I
V
R
K
A
M
F
N
M
V---------NI--K---A
G
T
------
Y
RKG-L-S-
S
I
R
I
AGKTGTP-E---INSK----------G----E---------S
H
---------
K
---
L
F
I
A
Y----GPYHDP
R
Y
A
I
S
V
F
I
E----Y--GK-------------AP
R
Q
D
V
--
A
M
A
N
E
I
L
R
Y
M
LKG-----------------------------------------------------------------------------------------------------------------------------
30
HHSearch
74.93
21%
-74
- C1 -
1QME
3
PBPX_STRPN
A:
[23-564]
-------------------------------------------------------------------------------------------------------------------------------
T
V
P
A
K
R
G
T
I
Y
D
R
N
G
V
P
I
A
--------------
E
D
A
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
----------
P
N
R
S
Y
P
N
G
Q
F
A
S
S
F
I
G
L
A
----------
Q
L
-------------
H
E
N
EDG-------------
S
K
S
L
----
L
---
G
T
S
G
M
E
S
S
L
N
S
I
L
A
G
T
D
G
-------------------------
R
T
-
M
D
G
K
D
V
Y
T
T
I
S
S
P
L
Q
S
------
F
M
------
E
T
Q
M
-
D
A
F
Q
E
K
VK-
G
-------------
K
-------
Y
-
M
T
-------
A
T
L
V
S
A
K
T
G
E
I
L
A
T
T
Q
R
P
T
F
D
A
D
T
K
E
G
I
T
E
---------------
D
F
-
V
W
R
D
I
L
Y
Q
S
N
Y
--
E
P
G
S
T
M
K
V
M
M
-
L
A
A
A
I
D
N
N
T
F
P
G
G
E
V
F
N
S
--
S
E
-
L
K
I
A
D
--
A
T
I
----
R
D
W
D
-
V
N
E
GL
T
G
G
R
M
M
T
F
S
Q
G
F
A
H
S
S
N
V
G
M
T
L
L
E
Q
K
M
----
G
-----------------
D
A
T
W
L
D
Y
L
N
R
F
K
F
G
V
P
---
T
R
F
-
G
L
T
D
E
Y
A
G
Q
L
P
--
A
D
-----------
N
I
V
N
I
A
Q
S
S
F
G
Q
G
-
I
S
V
T
Q
T
Q
-
M
I
R
A
F
T
A
I
A
N
D
G
V
M
L
-----
E
-
P
K
F
I
------
S
A
I
Y
D
P
N
DQ
T
A
R
K
-
S
Q
--
K
----
E
I-
V
G-
N
-
P
V
S
K
D
A
A
S
L
T
R
T
N
M
V
L
V
G
---------
T
D
--
P
V--
Y
G
T
MYNHST
G
K
P
T
V
T
-
V
P
G
Q
N
V
A
L
K
S
G
T
A
-
Q
---
I
A
D
E
KNGGYLVGL-
T
----
D
---------
Y
I
---------
F
---
S
A
V
S
M
----
S
P
A
E
N
P
D
F
I
L
Y
V
T
V
Q
----
Q
--
P
E
HY-----------
S
G
I
Q
L
G
--
E
F
A
N
P
I
L
E
R
A
S
A
M
-----------------------------------------------------------------------------------------------------------------------------
28
HHSearch
74.74
24%
-71
* C1 *
3EQU
11
PBP2_NEIGO
A:
[24-523]
------------------------------------------------------------------------------------------------------------------------
N
R
I
V
R
T
Q
A
L
P
A
T
R
G
T
V
S
D
R
N
G
A
V
L
A
--------------
L
S
A
P
T
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
K
R
H
Y
P
M
G
N
L
F
A
H
V
I
G
F
T
----------
D
I
----------------------------------
D
G
----
K
---
G
Q
E
G
L
E
L
S
L
E
D
S
L
Y
G
E
D
G
-
A
E
V
V
L
R
D
R
Q
-
G
N
I
V
D
S
L
D
S
PR
N
K
-
A
P
-
Q
N
G
K
D
I
I
L
S
L
D
Q
R
I
Q
T
------
L
A
------
Y
E
E
L
-
N
K
A
V
E
Y
H
Q-
A
-------------
K
-------
A
-
G
T
-------
V
V
V
L
D
A
R
T
G
E
I
L
A
L
A
N
T
P
A
Y
D
P
N
R
P
G
R
A
D
----------------
S
E
-
Q
R
R
N
R
A
V
T
D
M
I
--
E
P
G
S
A
I
K
P
F
V
-
I
A
K
A
L
D
A
G
K
T
D
L
N
E
R
L
N
T
Q
-
P
--
Y
K
I
G
P
--
S
P
V
----
R
D
T
-------
H
V
Y
P
S
L
D
V
R
G
I
M
Q
K
S
S
N
V
G
T
S
K
L
S
A
R
F
----
G
-----------------
A
E
E
M
Y
D
F
Y
H
E
L
G
I
G
V
R
---
M
H
S
-
G
F
P
G
E
T
A
G
L
L
R
--
N
W
--------
R
R
W
R
P
I
E
Q
A
T
M
S
F
G
Y
G
-
L
Q
L
S
L
L
Q
-
L
A
R
A
Y
T
A
L
T
H
D
G
V
L
L
-----
P
-
L
S
F
E
------
K
Q
A
V
A
P
-----------------
Q
--
G
K
-
R
-
I
F
K
E
S
T
A
R
E
V
R
N
L
M
V
S
V
T
---------
E
P
------
G
G
T
------
G
T
A
G
-
A
-
V
D
G
F
D
V
G
A
K
T
G
T
A
------------------------
K
---------
H
V
---------
A
---
T
F
I
G
F
----
A
P
A
K
N
P
R
V
I
V
A
V
T
I
D
----
E
--
P
T
AHGYY--------
G
G
V
V
A
G
--
P
P
F
K
K
I
M
G
G
S
L
N
I
-----------------------------------------------------------------------------------------------------------------------------
51
Fugue
69.72
22%
-72
- C1 -
1QME
3
PBPX_STRPN
A:
[23-702]
-------------------------------------------------------------------------------------------------------------------------------
T
V
P
A
K
R
G
T
I
Y
D
R
N
G
V
P
I
A
--------------
E
D
A
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
T
---------
S
----------
P
N
R
S
Y
P
N
G
Q
F
A
S
S
F
I
G
L
A
----------
Q
L
-------------
H
E
-----------------
N
E
D
G
S
K
S
L
L
---
G
T
S
G
M
E
S
S
L
N
S
I
L
A
G
T
D
G
-------------------------
R
T
-
M
D
G
K
D
V
Y
T
T
I
S
S
P
L
Q
S
------
F
M
------
E
T
Q
M
-
D
--------
A
-------------
F
-------
Q
-
E
K
VKGK
Y
M
T
A
T
L
V
S
A
K
T
G
E
I
L
A
T
T
Q
R
P
T
F
D
A
D
T
K
E
G
I
T
E
---
D
F
V
W
R
-------------
D
I
L
Y
Q
S
N
Y
--
E
P
G
S
T
M
K
V
M
M
-
L
A
A
A
I
D
N
N
T
F
P
G
G
E
V
F
N
S
--
S
E
-
L
K
I
A
D
--
A
T
I
----
R
D
W
D
-
V
N
E
GL
T
G
G
R
M
M
T
F
S
Q
G
F
A
H
S
S
N
V
G
M
T
L
L
E
Q
K
M
----
G
-----------------
D
A
T
W
L
D
Y
L
N
R
F
K
F
G
V
P
---
T
R
F
G
-
L
T
D
E
Y
A
G
Q
L
P
--
A
D
N
-----------
I
V
N
I
A
Q
S
S
F
G
Q
G
-
I
S
V
T
Q
T
Q
-
M
I
R
A
F
T
A
I
A
N
-
D
G
V
M
L
E
PKF
I
-
S
A
I
Y
D
PNDQ
T
A
R
K
S
Q
K
E
-------
I
---
V
----
G
--
N
--
P
-
V
-
S
K
D
A
A
S
L
T
R
T
N
M
V
L
V
G
TDPVYGTMY
N
H
--
S
---
T
G
K
------
P
T
V
T
-
V
-
P
-
G
Q
N
V
A
L
K
S
G
T
A
-
Q
---
I
A
D
E
----------
K
----
N
---------
G
G
YLVGLTD
Y
I
F
---
S
A
V
S
M
----
S
P
A
E
N
P
D
F
I
L
Y
V
T
V
Q
----
Q
PE
H
Y
-------------
S
G
I
Q
L
G
--
E
F
A
N
P
I
L
E
R
A
S
A
M
K
D
S
LNLQ
Q
S
P
Y
P
MPSVKDIS
P
G
D
L
A
E
E
L
R
R
N
L
V
Q
P
I
V
V
G
TGTKIKNSSAEEGKNLAPN
Q
Q
V
L
I
L
S
DKAEEVPDMYGWT
K
E
T
A
E
T
L
A
K
W
L
N
I
E
L
E
F
Q
G
SGSTVQKQDVRANTAIKDIK
K
I
T
L
T
L
G
D
2
PsiBlast_PDB
69.21
26%
-71
- C1 -
3OCN
1
?
A:
[35-510]
------------------------------------------------------------------------------------------------------------------------
A
R
S
V
R
H
I
A
I
P
A
H
R
G
L
I
T
D
R
N
G
E
P
L
A
--------------
V
S
T
P
V
T
T
L
W
A
--------
N
P
K
E
L
M
------
T
-------------
A
------------------------------------------------------------------------------------
K
E
------
R
W
------------
P
------------------
Q
L
A
A
A
L
GQD
T
K
L
F
A
D
R
I
E
Q
N
A
EREFIYLV
R
G
L
T
P
E
Q
G
E
G
V
I
A
L
KVPG
V
Y
S
I
E
E
F
R
R
F
Y
P
A
G
E
V
V
A
H
A
V
G
F
T
----------
D
----------------------------------
V
D
D
----
R
---
G
R
E
G
I
E
L
A
F
D
E
W
L
A
G
V
P
G
-
K
R
Q
V
L
K
D
R
R
-
G
R
V
I
K
D
V
Q
---
V
T
-
K
N
A
K
P
G
K
T
L
A
L
S
I
D
L
R
L
Q
Y
L
A
H
R
E
L
R
N
------
A
L
L
E
-
N
--------
G
-------------
A
-------
K
A
G
S
-------
L
V
I
M
D
V
K
T
G
E
I
L
A
M
T
N
Q
P
T
Y
N
P
N
---
N
R
-----------
R
N
-
L
-
Q
P
A
-
A
M
R
N
R
A
M
I
D
V
F
--
E
P
G
S
T
V
K
P
F
S
-
M
S
A
A
L
A
S
G
R
W
K
P
S
D
I
V
D
V
Y
P
G
T
-
L
Q
I
G
----
R
Y
----
T
I
R
D
V
S
----
R
N
S
R
Q
L
D
L
T
G
I
L
I
K
S
S
N
V
G
I
S
K
I
A
F
D
I
----
G
-----------------
A
E
S
I
Y
S
V
M
Q
Q
V
G
L
G
Q
D
---
T
G
L
G
-
F
P
G
E
R
V
G
N
L
P
--
N
--------
H
R
K
W
P
K
A
E
T
A
T
L
A
Y
G
Y
G
L
S
V
T
A
-
I
Q
-
L
A
H
A
Y
A
A
L
A
N
-
D
G
K
S
-----
V
-
P
---------
L
S
M
T
R
V
D
R------
V
---
P
----
D
GV
Q
--
V
-
I
-
S
P
E
V
A
S
T
V
Q
G
M
L
Q
Q
V
V
---------
E
A
--
Q
---
G
G
V
------
F
R
A
Q
-
V
-
P
-
G
Y
H
A
A
G
K
S
G
T
A
-
R
K
V----------------E
N
--
A
---------
Y
R
---------
S
---
L
F
A
G
F
----
A
P
A
T
D
P
R
I
A
M
V
V
V
I
D
----
E
--
P
S
-------------
K
A
G
Y
F
G
--
G
L
V
S
A
P
V
F
S
K
V
M
A
-----------------------------------------------------------------------------------------------------------------------------
31
HHSearch
68.83
29%
-70
- C1 -
3UN7
-
PBPA_MYCTU
A:
[48-488]
--------------------------------------------------------------------------------------------------------------------------------
Y
S
R
Q
R
G
Q
I
T
A
-
G
G
Q
L
L
A
--------------
Y
S
V
A
T
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
G
---
R
F
R
----------
F
L
R
V
Y
P
N
P
E
V
Y
A
P
V
T
G
F
Y
----------
S
L
-----------------------------------
R
----
Y
---
S
S
T
A
L
E
R
A
E
D
P
I
L
N
G
S
D
R
-
R
L
F
-------
G
R
R
L
A
D
F
F
---
T
G
-
R
D
-
P
R
G
G
N
V
D
T
T
I
N
P
R
I
Q
Q
------
A
G
------
W
D
A
M
-
Q
Q
GCYG---
P
-------------
C
-------
K
-
G
A
-------
V
V
A
L
E
P
S
T
G
K
I
L
A
L
V
S
S
P
S
Y
D
P
N
L
L
A
S
H
N
P
E
V
Q
A
Q
A
W
Q
R
L
G
-
D
N
P
A
S
-
P
L
T
N
R
A
I
S
E
T
Y
--
P
P
G
S
T
F
K
V
I
T
-
T
A
A
A
L
A
A
G
A
T
E
T
E
Q
-
L
T
A
A
-
P
T
-
I
P
L
P
G
ST
A
Q
L
----
E
N
Y
G
-
G
APC-
G
D
E
P
T
V
S
L
R
E
A
F
V
K
S
C
N
T
A
F
V
Q
L
G
I
R
T
----
G
-----------------
A
D
A
L
R
S
M
A
R
A
F
G
L
D
S
P
P
R
P
T
P
L
-
Q
V
A
E
S
T
V
G
P
I
P
--
D
-------------
S
A
A
L
G
M
T
S
I
G
Q
K
D
V
A
L
T
P
L
A
-
N
A
E
I
A
A
T
I
A
N
G
G
I
T
M
-----
R
-
P
Y
L
V
------
G
S
L
K
G
P
D
LANI---
S
T
T
V
R
Y
---
Q
--
Q
R-
R
-
A
V
S
P
Q
V
A
A
K
L
T
E
L
M
V
G
A
E
---------
K
-------
V
--------
Q
-
K
G
-
A
-
I
P
G
V
Q
I
A
S
K
T
G
T
A
-
E
---
H
G
T
D
PRH-------
T
----
P
---------
P
H
---------
A
---
W
Y
I
A
F
----
A
P
A
Q
A
P
K
V
A
V
A
V
L
V
E
----
N
--
G
A
DRLSAT-------
G
G
A
L
A
A
--
P
I
G
R
A
V
I
E
A
A
L
Q
------------------------------------------------------------------------------------------------------------------------------
50
Fugue
68.26
22%
-69
- C1 -
3OC2
3
?
A:
[35-545]
--------------------------------------------------------------------A
R
S
V
R
H
I
A
I
P
A
H
R
G
L
I
T
D
RN
G
E
P
L
A
V
S
T
P
V
T
T
L
W
A
N
P
K
E
L
M
T
A
K
E
R
W
P
Q
L
A
A
A
L
G
Q
D
T
K
L
F
A
D
R
I
E
Q
N
A
E
R
E
F
I
Y
L
V
--------------
R
--------------------
G
L
T
------
P
-------------
E
------------------------------------------------------------------------------------
Q
G
------
E
G
------------
V
------------------
I
A
L
------------
K
V
P
G
------------------
V
Y
S
I
E
E
----------
F
R
R
F
Y
P
A
G
E
V
V
A
H
A
V
G
F
T
--------------------------------------------
D
V
D
D
----
R
---
G
R
E
G
I
E
L
A
F
D
E
W
L
A
G
V
P
G
-
K
R
Q
V
L
K
D
R
R
-
G
R
V
I
K
D
V
Q
---
V
T
K
N
A
-
K
P
G
K
T
L
A
L
S
I
D
L
R
L
Q
Y
------
L
A
------
H
R
E
L
-
R
--------
N
-------------
A
L
L
E
N
GAK
A
-
G
S
-------
L
V
I
M
D
V
K
T
G
E
I
L
A
M
T
N
Q
P
T
Y
N
P
N
--------------
N
R
R
N
-
L
-
Q
P
A
-
A
M
R
N
R
A
M
I
D
V
F
--
E
P
G
S
T
V
K
P
F
S
-
M
S
A
A
L
A
S
G
R
W
K
P
S
D
I
V
D
V
Y
P
G
T
-
L
Q
I
G
R
--
Y
T
I
----
R
D
-
V
-
S
----
R
N
S
R
Q
L
D
L
T
G
I
L
I
K
S
S
N
V
G
I
S
K
I
A
F
D
I
----
G
-----------------
A
E
S
I
Y
S
V
M
Q
Q
V
G
L
G
Q
D
---
T
G
L
G
-
F
P
G
E
R
V
G
N
L
P
--
N
H
--------
R
K
W
P
K
A
E
T
A
T
L
A
Y
G
Y
G
-
L
S
V
T
A
I
Q
-
L
A
H
A
Y
A
A
L
A
N
-
D
G
K
S
-----
V
-
P
-
L
S
------
M
T
R
V
D
R
V
-------
P
---
D
----
G
--
V
--
Q
-
V
-
I
S
P
E
V
A
S
T
V
Q
G
M
L
Q
Q
V
---------
V
E
--
A
---
Q
G
G
------
V
F
R
A
Q
V
-
P
-
G
Y
H
A
A
G
K
S
G
T
A
-
R
-----------------
K
----
A
---------
Y
R
---------
S
---
L
F
A
G
F
----
A
P
A
T
D
P
R
I
A
M
V
V
V
I
D
----
E
--
P
F
-------------
G
G
L
V
S
A
--
P
V
F
S
K
V
M
A
G
A
L
R
L
M
NVPPDNL---------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
67.04
26%
-72
- C1 -
4BL2
8
?
A:
[117-617]
---------------------------------------------------------------------------------------------------------------------------
I
H
I
E
N
L
K
S
K
R
G
K
I
L
D
R
N
N
V
E
L
A
N
T
G
T
A
Y
E
I
G
I
VPKN
V
S
K
K
D
Y
K
A
I
A
--------
K
E
L
S
I
S
------
E
-------------
D
Y
I
K
Q
Q
M
------------------------------------------------------------------------------
D
Q
------
N
W
VQDD
T
F
V
P
L
K
TV
K
------------------
K
M
D
------------
E
Y
L
S
D
-----------
F
A
K
K
F
H
L
T
T
N
E
T
----------
E
S
R
N
Y
P
L
G
K
A
T
S
H
L
L
G
Y
V
G
P
I
N
S
E
E
L
K
Q
K
E
-------------
Y
K
-----------------
G
Y
K
D
----
D
AVI
G
K
K
G
L
E
K
L
Y
D
K
K
L
Q
H
E
D
G
Y
R
V
T
I
V
D
D
N
S
-
N
T
I
A
H
T
L
I
---
E
K
-
K
K
-
K
D
G
K
D
I
Q
L
T
I
D
A
K
V
Q
K
------
S
I
------
Y
N
N
M
-
K
--------
N
-------------
D
-------
Y
-
G
S
-------
G
T
A
I
H
P
Q
T
G
E
L
L
A
L
V
S
T
P
S
Y
D
V
Y
P
F
M
Y
G
M
S
---
N
E
E
Y
N
K
L
T
-
E
-
D
K
K
E
P
L
L
N
K
---
F
Q
I
TT
S
P
G
S
T
Q
K
I
L
T
-
A
M
I
G
L
N
N
K
T
L
D
D
K
T
S
Y
K
I
D
-
G
K
-
G
W
Q
K
D
--
K
S
W
GG
Y
N
V
T
R
Y
-
E
----
V
V
N
G
N
I
D
L
K
Q
A
I
E
S
S
D
N
I
F
F
A
R
V
A
L
E
L
----
G
-----------------
S
K
K
F
E
K
G
M
K
K
L
G
V
G
------------
E
D
I
P
S
D
Y
P
F
Y
N
A
Q
I
S
N
K
N
L
D
N
E
I
L
L
A
D
S
---
G
Y
G
Q
G
E
I
L
I
N
P
V
Q
I
L
S
I
Y
S
A
L
E
N
N
-
G
N
I
N
-----
A
-
P
H
L
L
------
K
D
T
K
N
K
V
-------
W
---
K
----
K
--
N
--
I
-
I
-
S
K
E
N
I
N
L
L
T
D
G
M
Q
Q
V
V
---------
N
K
TH
K
---
E
D
I
------
Y
R
-----
S
-
Y
A
N
L
I
G
K
S
G
T
A
-
E
---
L
K
----------------------------
G
---------
R
Q
I
G
W
F
I
S
Y
----
D
K
-
D
N
P
N
M
M
M
A
I
N
V
K
-----------------------
D
V
Q
D
K
--
G
M
A
S
Y
N
A
K
I
S
G
K
V
-----------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
65.13
26%
-77
- C1 -
4BJP
26
?
A:
[100-495]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
R
Y
Y
P
S
G
E
V
T
A
H
L
I
G
F
T
----------
N
----------------------------------
V
D
S
----
Q
---
G
I
E
G
V
E
K
S
F
D
K
W
L
T
----------------------------------
A
H
N
L
A
L
S
I
D
E
R
L
Q
A
------
L
V
Y
R
E
L
N
N
A
V
A
F
N
K
--------
A
-------------
E
-------
S
-
G
S
-------
A
V
L
V
D
V
N
T
G
E
V
L
A
M
A
N
S
P
S
Y
N
P
N
N
L
S
--------------
G
-
T
-
P
K
E
-
A
M
R
N
R
T
I
T
D
V
F
--
E
P
G
S
T
V
K
P
M
V
-
V
M
T
A
L
Q
R
G
V
V
R
E
N
S
V
L
N
T
I
-
P
Y
-
R
I
N
G
H
--
E
I
K
----
D
V
A
R
--------
Y
S
E
L
T
L
T
G
V
L
Q
K
S
S
N
V
G
V
S
K
L
A
L
A
M
----
P
-----------------
S
S
A
L
V
D
T
Y
S
R
F
G
L
G
K
A
---
T
N
L
G
L
V
G
E
R
S
-
G
L
Y
P
--
Q
K
Q
--------
R
W
S
D
I
E
R
A
T
F
S
F
G
Y
G
-
L
M
V
T
P
L
Q
-
L
A
R
V
Y
A
T
I
G
S
-
Y
G
I
Y
-----
R
-
P
-
L
S
------
I
T
K
V
D
P
P
-------
V
---
P
----
G
--
E
--
R
-
V
-
F
P
E
--
S
I
V
R
T
V
V
H
M
M
E
---------
S
V
--
A
LPG
G
G
G
------
V
K
A
A
-
I
-
K
-
G
Y
R
I
A
I
K
T
G
T
A
K
K
---
V
G
P
D
----------
G
----
R
---------
Y
I
---------
N
---
K
Y
I
A
Y
T
A
G
V
A
P
A
S
Q
P
R
F
A
L
V
V
V
I
N
DPQA-------------------
V
S
A
P
V
F
G
A
I
M
G
G
V
L
R
T
M
N
I
E
-----------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
64.99
26%
-74
- C1 -
4KQQ
5
?
A:
[36-510]
-------------------------------------------------------------------------------------------------------------------------
R
S
V
R
H
I
A
I
P
A
H
R
G
L
I
T
D
R
N
G
E
P
L
A
--------------
V
S
T
P
V
T
T
L
W
A
--------
N
P
K
E
L
M
------
T
-------------
A
------------------------------------------------------------------------------------
K
E
------
R
W
------------
P
------------------
Q
L
A
A
A
L
GQD
T
K
L
F
A
D
R
I
E
Q
N
A
EREFIYLVRG
L
T
P
E
Q
G
E
G
V
I
A
L
KVPG
V
Y
S
I
E
E
F
R
R
F
Y
P
A
G
E
V
V
A
H
A
V
G
F
T
----------
D
----------------------------------
V
D
D
----
R
---
G
R
E
G
I
E
L
A
F
D
E
W
L
A
G
V
P
G
-
K
R
Q
V
L
K
D
R
R
-
G
R
V
I
K
D
V
Q
---
V
T
-
K
N
A
K
P
G
K
T
L
A
L
S
I
D
L
R
L
Q
Y
L
A
H
R
E
L
R
N
------
A
L
L
E
-
N
--------
G
-------------
A
-------
K
A
G
S
-------
L
V
I
M
D
V
K
T
G
E
I
L
A
M
T
N
Q
P
T
Y
N
P
N
---
N
R
-----------
R
N
-
L
-
Q
P
A
-
A
M
R
N
R
A
M
I
D
V
F
--
E
P
G
S
T
V
K
P
F
S
-
M
S
A
A
L
A
S
G
R
W
K
P
S
D
I
V
D
V
Y
P
G
T
-
L
Q
I
G
----
R
Y
----
T
I
R
D
V
S
----
R
N
S
R
Q
L
D
L
T
G
I
L
I
K
S
S
N
V
G
I
S
K
I
A
F
D
I
----
G
-----------------
A
E
S
I
Y
S
V
M
Q
Q
V
G
L
G
Q
D
---
T
G
L
G
-
F
P
G
E
R
V
G
N
L
P
--
N
--------
H
R
K
W
P
K
A
E
T
A
T
L
A
Y
G
Y
G
L
S
V
T
A
-
I
Q
-
L
A
H
A
Y
A
A
L
A
N
-
D
G
K
S
-----
V
-
P
---------
L
S
M
T
R
V
D
R------
V
---
P
----
D
GV
Q
--
V
-
I
-
S
P
E
V
A
S
T
V
Q
G
M
L
Q
Q
V
V
---------
E
A
--
Q
---
G
G
V
------
F
R
A
Q
-
V
-
P
-
G
Y
H
A
A
G
K
S
G
T
A
-
R
K
VS
V
G
T
K
----------
G
YREN
A
---------
Y
R
---------
S
---
L
F
A
G
F
----
A
P
A
T
D
P
R
I
A
M
V
V
V
I
D
----
E
--
P
S
-------------
K
A
G
Y
F
G
--
G
L
V
S
A
P
V
F
S
K
V
M
A
-----------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
64.74
26%
-72
- C1 -
4KQR
11
?
A:
[36-510]
-------------------------------------------------------------------------------------------------------------------------
R
S
V
R
H
I
A
I
P
A
H
R
G
L
I
T
D
R
N
G
E
P
L
A
--------------
V
S
T
P
V
T
T
L
W
A
--------
N
P
K
E
L
M
------
T
-------------
A
------------------------------------------------------------------------------------
K
E
------
R
W
------------
P
------------------
Q
L
A
A
A
L
GQD
T
K
L
F
A
D
R
I
E
Q
N
AEREFIYLVRG
L
T
P
E
Q
G
E
G
V
I
A
L
KVPG
V
Y
S
I
E
E
F
R
R
F
Y
P
A
G
E
V
V
A
H
A
V
G
F
T
----------
D
----------------------------------
V
D
D
----
R
---
G
R
E
G
I
E
L
A
F
D
E
W
L
A
G
V
P
G
-
K
R
Q
V
L
K
D
R
R
-
G
R
V
I
K
D
V
Q
---
V
T
-
K
N
A
K
P
G
K
T
L
A
L
S
I
D
L
R
L
Q
Y
L
A
H
R
E
L
R
N
------
A
L
L
E
-
N
--------
G
-------------
A
-------
K
A
G
S
-------
L
V
I
M
D
V
K
T
G
E
I
L
A
M
T
N
Q
P
T
Y
N
P
N
---
N
R
-----------
R
N
-
L
-
Q
P
A
-
A
M
R
N
R
A
M
I
D
V
F
--
E
P
G
S
T
V
K
P
F
S
-
M
S
A
A
L
A
S
G
R
W
K
P
S
D
I
V
D
V
Y
P
G
T
-
L
Q
I
G
----
R
Y
----
T
I
R
D
V
S
----
R
N
S
R
Q
L
D
L
T
G
I
L
I
K
S
S
N
V
G
I
S
K
I
A
F
D
I
----
G
-----------------
A
E
S
I
Y
S
V
M
Q
Q
V
G
L
G
Q
D
---
T
G
L
G
-
F
P
G
E
R
V
G
N
L
P
--
N
--------
H
R
K
W
P
K
A
E
T
A
T
L
A
Y
G
Y
G
L
S
V
T
A
-
I
Q
-
L
A
H
A
Y
A
A
L
A
N
-
D
G
K
S
-----
V
-
P
---------
L
S
M
T
R
V
D
R------
V
---
P
----
D
GV
Q
--
V
-
I
-
S
P
E
V
A
S
T
V
Q
G
M
L
Q
Q
V
V
---------
E
A
--
Q
---
G
G
V
------
F
R
A
Q
-
V
-
P
-
G
Y
H
A
A
G
K
S
G
T
A
-
R
K
VS
V
G
T
K
----------
G
YREN
A
---------
Y
R
---------
S
---
L
F
A
G
F
----
A
P
A
T
D
P
R
I
A
M
V
V
V
I
D
----
E
--
P
S
-------------
K
A
G
Y
F
G
--
G
L
V
S
A
P
V
F
S
K
V
M
A
-----------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
64.69
25%
-68
- C1 -
4CJN
10
?
A:
[116-616]
---------------------------------------------------------------------------------------------------------------------------
I
H
I
E
N
L
K
S
E
R
G
K
I
L
D
R
N
N
V
E
L
A
N
T
G
T
A
Y
E
I
G
I
VPKN
V
S
K
K
D
Y
K
A
I
A
--------
K
E
L
S
I
S
------
E
-------------
D
Y
I
K
Q
Q
M
------------------------------------------------------------------------------
D
Q
------
N
W
VQDD
T
F
V
P
L
K
TV
K
------------------
K
M
D
------------
E
Y
L
S
D
-----------
F
A
K
K
F
H
L
T
T
N
E
T
----------
E
S
R
N
Y
P
L
G
K
A
T
S
H
L
L
G
Y
V
G
PIN
S
E
E
L
K
Q
K
E
-------------
Y
K
-----------------
G
Y
K
D
----
D
A
V
I
G
K
K
G
L
E
K
L
Y
D
K
K
L
Q
H
E
D
G
Y
R
V
T
I
V
D
D
N
S
-
N
T
I
A
H
T
L
I
---
E
K
-
K
K
-
K
D
G
K
D
I
Q
L
T
I
D
A
K
V
Q
K
------
S
I
------
Y
N
N
M
-
K
--------
N
-------------
D
-------
Y
-
G
S
-------
G
T
A
I
H
P
Q
T
G
E
L
L
A
L
V
S
T
P
S
Y
D
V
Y
P
F
M
Y
G
M
S
---
N
E
E
Y
N
K
L
T
-
E
-
D
K
K
E
P
L
L
N
K
---
F
Q
I
TT
S
P
G
S
T
Q
K
I
L
T
-
A
M
I
G
L
N
N
K
T
L
D
D
K
T
S
Y
K
I
D
-
G
K
-
G
W
Q
K
D
--
K
S
W
GGYN
V
T
R
Y
-
E
----
V
V
N
G
N
I
D
L
K
Q
A
I
E
S
S
D
N
I
F
F
A
R
V
A
L
E
L
----
G
-----------------
S
K
K
F
E
K
G
M
K
K
L
G
V
G
------------
E
D
I
P
S
D
Y
P
F
Y
N
A
Q
I
S
N
K
N
L
D
N
E
I
L
L
A
D
S
---
G
Y
G
Q
G
E
I
L
I
N
P
V
Q
I
L
S
I
Y
S
A
L
E
N
N
-
G
N
I
N
-----
A
-
P
H
L
L
------
K
D
T
K
N
K
V
-------
W
---
K
----
K
--
N
--
I
-
I
-
S
K
E
N
I
N
L
L
T
D
G
M
Q
Q
V
V
---------
N
K
TH
K
---
E
D
I
------
Y
R
-----
S
-
Y
A
N
L
I
G
K
S
G
T
A
-
E
---
L
K
M
K
Q---------
G
----
E
---------
T
G
---------
R
Q
I
G
W
F
I
S
Y
----
D
K
-
D
N
P
N
M
M
M
A
I
N
V
K
-----------------------
D
V
Q
D
K
--
G
M
A
S
Y
N
A
K
I
S
G
K
V
-----------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
64.58
25%
-63
- C1 -
4BL3
10
?
A:
[117-614]
---------------------------------------------------------------------------------------------------------------------------
I
H
I
E
K
L
K
S
E
R
G
K
I
L
D
R
N
N
V
E
L
A
N
T
G
T
A
Y
E
I
G
I
VPKN
V
S
K
K
D
Y
K
A
I
A
--------
K
E
L
S
I
S
------
E
-------------
D
------------------------------------------------------------------------------------
Y
I
K
Q
Q
M
D
Q
N
W
VQDD
T
F
V
P
L
K
TV
K
------------------
K
M
D
------------
E
Y
L
S
D
-----------
F
A
K
K
F
H
L
T
T
N
E
T
----------
E
S
R
N
Y
P
L
G
K
A
T
S
H
L
L
G
Y
V
G
P
I
N
S
E
E
L
K
Q
K
E
-------------
Y
K
-----------------
G
Y
K
D
----
D
AVI
G
K
K
G
L
E
K
L
Y
D
K
K
L
Q
H
E
D
G
Y
R
V
T
I
V
D
D
N
S
-
N
T
I
A
H
T
L
I
---
E
K
-
K
K
-
K
D
G
K
D
I
Q
L
T
I
D
A
K
V
Q
K
------
S
I
------
Y
N
N
M
-
K
--------
N
-------------
D
-------
Y
-
G
S
-------
G
T
A
I
H
P
Q
T
G
E
L
L
A
L
V
S
T
P
S
Y
D
V
Y
P
F
M
Y
G
M
S
---
N
E
E
Y
N
K
L
T
-
E
-
D
K
K
E
P
L
L
N
K
---
F
Q
I
TT
S
P
G
S
T
Q
K
I
L
T
-
A
M
I
G
L
N
N
K
T
L
D
D
K
T
S
Y
K
I
D
-
G
K
-
G
W
Q
K
D
--
K
S
W
GGYN
V
T
R
Y
-
E
----
V
V
N
G
N
I
D
L
K
Q
A
I
E
S
S
D
N
I
F
F
A
R
V
A
L
E
L
----
G
-----------------
S
K
K
F
E
K
G
M
K
K
L
G
V
G
------------
E
D
I
P
S
D
Y
P
F
Y
N
A
Q
I
S
N
K
N
L
D
N
E
I
L
L
A
D
S
---
G
Y
G
Q
G
E
I
L
I
N
P
V
Q
I
L
S
I
Y
S
A
L
E
N
N
-
G
N
I
N
-----
A
-
P
H
L
L
------
K
D
T
K
N
K
V
-------
W
---
K
----
K
--
N
--
I
-
I
-
S
K
E
N
I
N
L
L
T
D
G
M
Q
Q
V
V
---------
N
K
TH
K
---
E
D
I
------
Y
R
-----
S
-
Y
A
N
L
I
G
K
S
G
T
A
-
E
---
L
K
M
K
Q---------
G
----
R
---------
Q
I
---------
G
---
W
F
I
S
Y
----
D
K
-
D
N
P
N
M
M
M
A
I
N
V
K
-----------------------
D
V
Q
D
K
--
G
M
A
S
Y
N
A
K
I
S
G
K
V
-----------------------------------------------------------------------------------------------------------------------------
52
Fugue
63.97
22%
-66
- C1 -
1QME
3
PBPX_STRPN
A:
[23-702]
-------------------------------------------------------------------------------------------------------------------------------
T
V
P
A
K
R
G
T
I
Y
D
R
N
G
V
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
I
A
E
D
A
T
S
----------
P
N
R
S
Y
P
N
G
Q
F
A
S
S
F
I
G
L
A
----------
Q
L
-------------
H
E
-----------------
N
E
D
G
S
K
S
L
L
---
G
T
S
G
M
E
S
S
L
N
S
I
L
A
G
T
D
G
-
R
T
-------------------------
M
D
G
K
D
V
Y
T
T
I
S
S
P
L
Q
S
------
F
M
------
E
T
Q
M
-
D
--------
A
-------------
F
-------
Q
-
E
K
VKGK
Y
M
T
A
T
L
V
S
A
K
T
G
E
I
L
A
T
T
Q
R
P
T
F
D
A
D
T
K
E
G
I
T
E
---
D
F
V
W
R
-------------
D
I
L
Y
Q
S
N
Y
--
E
P
G
S
T
M
K
V
M
M
-
L
A
A
A
I
D
N
N
T
F
P
G
G
E
V
F
N
S
--
S
E
-
L
K
I
A
D
--
A
T
I
----
R
D
W
D
-
V
N
E
GL
T
G
G
R
M
M
T
F
S
Q
G
F
A
H
S
S
N
V
G
M
T
L
L
E
Q
K
M
----
G
-----------------
D
A
T
W
L
D
Y
L
N
R
F
K
F
G
V
P
---
T
R
F
G
-
L
T
D
E
Y
A
G
Q
L
P
--
A
D
N
-----------
I
V
N
I
A
Q
S
S
F
G
Q
G
-
I
S
V
T
Q
T
Q
-
M
I
R
A
F
T
A
I
A
N
-
D
G
V
M
L
E
PKF
I
-
S
A
I
Y
D
PNDQ
T
A
R
K
S
Q
K
E
-------
I
---
V
----
G
--
N
--
P
-
V
-
S
K
D
A
A
S
L
T
R
T
N
M
V
L
V
G
TDPVYGTMY
N
H
--
S
---
T
G
K
------
P
T
V
T
-
V
-
P
-
G
Q
N
V
A
L
K
S
G
T
A
-
Q
---
I
A
D
E
----------
K
----
N
GGYLVGLTD
Y
I
---------
F
---
S
A
V
S
M
----
S
P
A
E
N
P
D
F
I
L
Y
V
T
V
Q
----
Q
PE
H
Y
-------------
S
G
I
Q
L
G
--
E
F
A
N
P
I
L
E
R
A
S
A
M
K
D
S
LNLQ
Q
S
P
Y
P
MPSVKDIS
P
G
D
L
A
E
E
L
R
R
N
L
V
Q
P
I
V
V
G
TGTKIKNSSAEEGKNLAPN
Q
Q
V
L
I
L
S
DKAEEVPDMYGWT
K
E
T
A
E
T
L
A
K
W
L
N
I
E
L
E
F
Q
G
SGSTVQKQDVRANTAIKDIK
K
I
T
L
T
L
G
D
49
Fugue
63.04
23%
-73
- C1 -
4DKI
13
?
A:
[3-646]
SKD
K
E
I
N
N
T
I
D
A
I
E
D
KN
F
K
Q
V
Y
K
D
SS
Y
I
S
K
S
D
N
GEVEMT
E
R
P
I
K
I
Y
N
S
L
GVKDINIQD
R
K
I
K
K
V
S
KN
K
K
R
V
D
A
Q
Y
K
I
K
T
N
Y
G
N
I
D
R
--
N
V
Q
F
N
F
V
K
E
D
--
G
M
W
K
L
D
W
--
D
H
S
V
I
I
P
G
M
Q
K
D
Q
S
I
H
I
E
N
L
K
S
E
R
G
K
I
L
D
R
N
N
V
E
L
A
--------------
N
T
G
T
A
Y
E
I
G
I
V
PKNVSKK
D
Y
K
A
I
A
------
K
E
L
SIS
E
-------
D
------------------------------------------------------------------------------------
Y
I
------
K
Q
------------
Q
M
D
QNWVQDD
T
F
V
P
L
K
TVK
K
M
D
------------
E
Y
L
S
D
-----------
F
A
K
K
F
H
L
T
T
N
E
T
----------
E
S
R
N
Y
P
L
E
K
A
T
S
H
L
L
G
Y
V
----------
G
P
IN
S
E
E
L
K
QKEYKG
Y
K
-----------------
D
D
A
V
----
I
---
G
K
K
G
L
E
K
L
Y
D
K
K
L
Q
H
E
D
G
-
Y
R
V
T
I
V
D
D
N
S
N
T
I
A
H
T
L
I
---
E
K
-
K
K
-
K
D
G
K
D
I
Q
L
T
I
D
A
K
V
Q
K
------
S
I
------
Y
N
N
M
-
K
--------
N
-------------
D
-------
Y
-
G
S
-------
G
T
A
I
H
P
Q
T
G
E
L
L
A
L
V
S
T
P
S
Y
D
V
Y
P
F
M
Y
G
M
S
---
N
E
E
Y
N
K
L
T
E
D
-
K
K
E
-
P
L
L
N
K
-
F
Q
I
T
T
--
S
P
G
S
T
Q
K
I
L
T
-
A
M
I
G
L
N
N
K
T
L
D
D
K
T
S
Y
K
I
D
-
G
K
-
G
W
Q
K
D
--
K
S
W
GGYN
V
T
R
Y
-
E
----
V
V
N
G
N
I
D
L
K
Q
A
I
E
S
S
D
N
I
F
F
A
R
V
A
L
E
L
----
G
-----------------
S
K
K
F
E
K
G
M
K
K
L
G
V
G
E
D
---
I
P
S
D
Y
-------
P
F
Y
--
N
A
Q
I
S
N
K
N
L
D
N
E
I
L
L
A
D
S
G
---
Y
G
Q
G
E
I
L
I
N
P
V
Q
-
I
L
S
I
Y
S
A
L
E
N
-
N
G
N
I
-----
N
A
P
H
L
L
------
K
D
T
K
N
K
V
-------
W
---
K
----
K
--
N
--
I
-
I
-
S
K
E
N
I
N
L
L
T
D
G
M
Q
Q
V
V
---------
N
K
--
T
---
H
K
E
------
D
I
Y
--
R
-
S
-
Y
A
N
L
I
G
K
S
G
T
A
-
E
---
L
K
M
K
----------
Q
----
E
---------
T
G
---------
R
Q
I
G
W
F
I
S
Y
----
D
K
-
D
N
P
N
M
M
M
A
I
N
V
K
D---
V
--
Q
D
-------------
M
A
S
Y
N
A
--
K
I
S
G
K
V
Y
D
E
L
Y
E
N
GN
K
K
Y
D
IDE--------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
62.94
25%
-70
- C1 -
3ZG0
14
?
A:
[116-616]
---------------------------------------------------------------------------------------------------------------------------
I
H
I
E
N
L
K
S
E
R
G
K
I
L
D
R
N
N
V
E
L
A
N
T
G
T
A
Y
E
I
G
I
VPKN
V
S
K
K
D
Y
K
A
I
A
--------
K
E
L
S
I
S
------
E
-------------
D
Y
I
K
Q
Q
M
------------------------------------------------------------------------------
D
Q
------
N
W
VQDD
T
F
V
P
L
K
TV
K
------------------
K
M
D
------------
E
Y
L
S
D
-----------
F
A
K
K
F
H
L
T
T
N
E
T
----------
E
S
R
N
Y
P
L
G
K
A
T
S
H
L
L
G
Y
V
G
P
IN
S
E
E
L
K
Q
K
E
-------------
Y
K
-----------------
G
Y
K
D
----
D
AVI
G
K
K
G
L
E
K
L
Y
D
K
K
L
Q
H
E
D
G
Y
R
V
T
I
V
D
D
N
S
-
N
T
I
A
H
T
L
I
---
E
K
-
K
K
-
K
D
G
K
D
I
Q
L
T
I
D
A
K
V
Q
K
------
S
I
------
Y
N
N
M
-
K
--------
N
-------------
D
-------
Y
-
G
S
-------
G
T
A
I
H
P
Q
T
G
E
L
L
A
L
V
S
T
P
S
Y
D
V
Y
P
F
M
Y
G
M
S
---
N
E
E
Y
N
K
L
T
-
E
-
D
K
K
E
P
L
L
N
K
---
F
Q
I
TT
S
P
G
S
T
Q
K
I
L
T
-
A
M
I
G
L
N
N
K
T
L
D
D
K
T
S
Y
K
I
D
-
G
K
-
G
W
Q
K
D
--
K
S
W
GGYN
V
T
R
Y
-
E
----
V
V
N
G
N
I
D
L
K
Q
A
I
E
S
S
D
N
I
F
F
A
R
V
A
L
E
L
----
G
-----------------
S
K
K
F
E
K
G
M
K
K
L
G
V
G
------------
E
D
I
P
S
D
Y
P
F
Y
N
A
Q
I
S
N
K
N
L
D
N
E
I
L
L
A
D
S
---
G
Y
G
Q
G
E
I
L
I
N
P
V
Q
I
L
S
I
Y
S
A
L
E
N
N
-
G
N
I
N
-----
A
-
P
H
L
L
------
K
D
T
K
N
K
V
-------
W
---
K
----
K
--
N
--
I
-
I
-
S
K
E
N
I
N
L
L
T
D
G
M
Q
Q
V
V
---------
N
K
TH
K
---
E
D
I
------
Y
R
-----
S
-
Y
A
N
L
I
G
K
S
G
T
A
-
E
---
L
K
M
K
Q---------
G
----
E
---------
T
G
---------
R
Q
I
G
W
F
I
S
Y
----
D
K
-
D
N
P
N
M
M
M
A
I
N
V
K
-----------------------
D
V
Q
D
K
--
G
M
A
S
Y
N
A
K
I
S
G
K
V
-----------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
62.32
26%
-71
- C1 -
4KQO
3
?
A:
[35-510]
------------------------------------------------------------------------------------------------------------------------
A
R
S
V
R
H
I
A
I
P
A
H
R
G
L
I
T
D
R
N
G
E
P
L
A
--------------
V
S
T
P
V
T
T
L
W
A
--------
N
P
K
E
L
M
------
T
-------------
A
------------------------------------------------------------------------------------
K
E
------
R
W
------------
P
------------------
Q
L
A
A
A
L
GQD
T
K
L
F
A
D
R
I
E
Q
N
AEREFIYLVRG
L
T
P
E
Q
G
E
G
V
I
A
L
KVPG
V
Y
S
I
E
E
F
R
R
F
Y
P
A
G
E
V
V
A
H
A
V
G
F
T
----------
D
----------------------------------
V
D
D
----
R
---
G
R
E
G
I
E
L
A
F
D
E
W
L
A
G
V
P
G
-
K
R
Q
V
L
K
D
R
R
-
G
R
V
I
K
D
V
Q
---
V
T
-
K
N
A
K
P
G
K
T
L
A
L
S
I
D
L
R
L
Q
Y
L
A
H
R
E
L
R
N
------
A
L
L
E
-
N
--------
G
-------------
A
-------
K
A
G
S
-------
L
V
I
M
D
V
K
T
G
E
I
L
A
M
T
N
Q
P
T
Y
N
P
N
---
N
R
-----------
R
N
-
L
-
Q
P
A
-
A
M
R
N
R
A
M
I
D
V
F
--
E
P
G
S
T
V
K
P
F
S
-
M
S
A
A
L
A
S
G
R
W
K
P
S
D
I
V
D
V
Y
P
G
T
-
L
Q
I
G
----
R
Y
----
T
I
R
D
V
S
----
R
N
S
R
Q
L
D
L
T
G
I
L
I
K
S
S
N
V
G
I
S
K
I
A
F
D
I
----
G
-----------------
A
E
S
I
Y
S
V
M
Q
Q
V
G
L
G
Q
D
---
T
G
L
G
-
F
P
G
E
R
V
G
N
L
P
--
N
--------
H
R
K
W
P
K
A
E
T
A
T
L
A
Y
G
Y
G
L
S
V
T
A
-
I
Q
-
L
A
H
A
Y
A
A
L
A
N
-
D
G
K
S
-----
V
-
P
---------
L
S
M
T
R
V
D
R------
V
---
P
----
D
GV
Q
--
V
-
I
-
S
P
E
V
A
S
T
V
Q
G
M
L
Q
Q
V
V
---------
E
A
--
Q
---
G
G
V
------
F
R
A
Q
-
V
-
P
-
G
Y
H
A
A
G
K
S
G
T
A
-
R
K
V
S
V
G
T
K
----------
G
YREN
A
---------
Y
R
---------
S
---
L
F
A
G
F
----
A
P
A
T
D
P
R
I
A
M
V
V
V
I
D
----
E
--
P
S
-------------
K
A
G
Y
F
G
--
G
L
V
S
A
P
V
F
S
K
V
M
A
-----------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
62.05
25%
-71
- C1 -
3ZFZ
13
?
A:
[116-616]
---------------------------------------------------------------------------------------------------------------------------
I
H
I
E
N
L
K
S
E
R
G
K
I
L
D
R
N
N
V
E
L
A
N
T
G
T
A
Y
E
I
G
I
VPKN
V
S
K
K
D
Y
K
A
I
A
--------
K
E
L
S
I
S
------
E
-------------
D
Y
I
K
Q
Q
M
------------------------------------------------------------------------------
D
Q
------
N
W
VQDD
T
F
V
P
L
K
TV
K
------------------
K
M
D
------------
E
Y
L
S
D
-----------
F
A
K
K
F
H
L
T
T
N
E
T
----------
E
S
R
N
Y
P
L
G
K
A
T
S
H
L
L
G
Y
V
G
P
I
N
S
E
E
L
K
Q
K
E
-------------
Y
K
-----------------
G
Y
K
D
----
D
AVI
G
K
K
G
L
E
K
L
Y
D
K
K
L
Q
H
E
D
G
Y
R
V
T
I
V
D
D
N
S
-
N
T
I
A
H
T
L
I
---
E
K
-
K
K
-
K
D
G
K
D
I
Q
L
T
I
D
A
K
V
Q
K
------
S
I
------
Y
N
N
M
-
K
--------
N
-------------
D
-------
Y
-
G
S
-------
G
T
A
I
H
P
Q
T
G
E
L
L
A
L
V
S
T
P
S
Y
D
V
Y
P
F
M
Y
G
M
S
---
N
E
E
Y
N
K
L
T
-
E
-
D
K
K
E
P
L
L
N
K
---
F
Q
I
TT
S
P
G
S
T
Q
K
I
L
T
-
A
M
I
G
L
N
N
K
T
L
D
D
K
T
S
Y
K
I
D
-
G
K
-
G
W
Q
K
D
--
K
S
W
GG
Y
N
V
T
R
Y
-
E
----
V
V
N
G
N
I
D
L
K
Q
A
I
E
S
S
D
N
I
F
F
A
R
V
A
L
E
L
----
G
-----------------
S
K
K
F
E
K
G
M
K
K
L
G
V
G
------------
E
D
I
P
S
D
Y
P
F
Y
N
A
Q
I
S
N
K
N
L
D
N
E
I
L
L
A
D
S
---
G
Y
G
Q
G
E
I
L
I
N
P
V
Q
I
L
S
I
Y
S
A
L
E
N
N
-
G
N
I
N
-----
A
-
P
H
L
L
------
K
D
T
K
N
K
V
-------
W
---
K
----
K
--
N
--
I
-
I
-
S
K
E
N
I
N
L
L
T
D
G
M
Q
Q
V
V
---------
N
K
TH
K
---
E
D
I
------
Y
R
-----
S
-
Y
A
N
L
I
G
K
S
G
T
A
-
E
---
L
-----------------------------
G
---------
R
Q
I
G
W
F
I
S
Y
----
D
K
-
D
N
P
N
M
M
M
A
I
N
V
K
-----------------------
D
V
Q
D
K
--
G
M
A
S
Y
N
A
K
I
S
G
K
V
-----------------------------------------------------------------------------------------------------------------------------
35
HHSearch
62.00
17%
-98
- C1 -
2OLV
-
?
A:
[267-599]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
-
Q
S
G
I
K
I
Y
T
N
M
D
K
D
V
Q
K
------
T
L
------
Q
N
D
V
-
D
N
GSFYKNK
D
-------------
Q
-------
Q
-
V
G
-------
A
T
I
L
D
S
K
T
G
G
L
V
A
I
S
G
G
R
D
F
K
D
V
-------------------------
V
N
R
N
Q
A
T
-
D
P
H
--
P
T
G
S
S
L
K
P
F
L
A
Y
G
P
A
I
E
N
M
K
W
A
T
N
H
A
I
Q
D
E
-
S
S
-
Y
Q
V
D
G
--
S
T
F
----
R
N
Y
D
-
T
----
K
S
H
G
T
V
S
I
Y
D
A
L
R
Q
S
F
N
I
P
A
L
K
A
W
Q
S
V
K
Q
NA
G
-----------------
N
D
A
P
K
K
F
A
A
K
L
G
L
N
Y
E
---
G
D
I
-
G
------------------------------
P
S
E
V
L
G
G
S
A
S
E
F
S
P
T
Q
-
L
A
S
A
F
A
A
I
A
N
G
G
T
Y
N
-----
N
-
A
H
S
I
------
Q
K
V
V
T
R
D
G
E
T
----
I
E
Y
-
D
H
---
T
--
S
H
-
K
-
A
M
S
D
Y
T
A
Y
M
L
A
E
M
L
K
G
T
F
---------
K
P
------
Y
G
S
------
A
Y
G
H
-
G
-
V
S
G
V
N
M
G
A
K
T
G
T
G
-
T
---
Y
G
A
E
T
Y
S
Q
Y
NLPDN
A
----
A
---------
K
D
---------
V
---
W
I
N
G
F
----
T
P
----
Q
Y
T
M
S
V
W
M
G
----
F
--
S
K
V
K
Q
YGENSFVG
H
S
Q
Q
E
Y
P
Q
--
F
L
Y
E
N
V
M
S
K
I
S
S
R
-----------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
61.98
25%
-66
- C1 -
1VQQ
9
?
A:
[120-620]
---------------------------------------------------------------------------------------------------------------------------
I
H
I
E
N
L
K
S
E
R
G
K
I
L
D
R
N
N
V
E
L
A
N
T
G
T
A
Y
E
I
G
I
VPKN
V
S
K
K
D
Y
K
A
I
A
--------
K
E
L
S
I
S
------
E
-------------
D
Y
I
K
Q
Q
M
------------------------------------------------------------------------------
D
Q
------
N
W
VQDD
T
F
V
P
LKTV
K
------------------
K
M
D
------------
E
Y
L
S
D
-----------
F
A
K
K
F
H
L
T
T
N
E
T
----------
E
S
R
N
Y
P
L
E
K
A
T
S
H
L
L
G
Y
V
G
P
I
N
S
E
E
L
K
Q
K
E
-------------
Y
K
-----------------
G
Y
K
D
----
D
A
V
I
G
K
K
G
L
E
K
L
Y
D
K
K
L
Q
H
E
D
G
Y
R
V
T
I
V
D
D
-
S
-
N
T
I
A
H
T
L
I
---
E
K
-
K
K
-
K
D
G
K
D
I
Q
L
T
I
D
A
K
V
Q
K
------
S
I
------
Y
N
N
M
-
K
--------
N
-------------
D
-------
Y
-
G
S
-------
G
T
A
I
H
P
Q
T
G
E
L
L
A
L
V
S
T
P
S
Y
D
V
Y
P
F
M
Y
G
M
S
---
N
E
E
Y
N
K
L
T
-
E
-
D
K
K
E
P
L
L
N
K
---
F
Q
I
TT
S
P
G
S
T
Q
K
I
L
T
-
A
M
I
G
L
N
N
K
T
L
D
D
K
T
S
Y
K
I
D
-
G
K
-
G
W
Q
K
D
--
K
S
W
GG
Y
N
V
T
R
Y
-
E
----
V
V
N
G
N
I
D
L
K
Q
A
I
E
S
S
D
N
I
F
F
A
R
V
A
L
E
L
----
G
-----------------
S
K
K
F
E
K
G
M
K
K
L
G
V
G
------------
E
D
I
P
S
D
Y
P
F
Y
N
A
Q
I
S
N
K
N
L
D
N
E
I
L
L
A
D
S
---
G
Y
G
Q
G
E
I
L
I
N
P
V
Q
I
L
S
I
Y
S
A
L
E
N
N
-
G
N
I
N
-----
A
-
P
H
L
L
------
K
D
T
K
N
K
V
-------
W
---
K
----
K
--
N
--
I
-
I
-
S
K
E
N
I
N
L
L
T
D
G
M
Q
Q
V
V
---------
N
K
TH
K
---
E
D
I
------
Y
R
-----
S
-
Y
A
N
L
I
G
K
S
G
T
A
-
E
---
L
K
----------------------------
G
---------
R
Q
I
G
W
F
I
S
Y
----
D
K
-
D
N
P
N
M
M
M
A
I
N
V
K
-----------------------
D
V
Q
D
K
--
G
M
A
S
Y
N
A
K
I
S
G
K
V
-----------------------------------------------------------------------------------------------------------------------------
27
HHSearch
61.87
22%
-68
- C1 -
3VSK
-
?
A:
[47-678]
--------------------------------------------------------------------------------------------------------------
Q
G
S
H
Y
K
Q
I
I
K
N
D
E
N
I
T
V
N
E
S
V
P
R
G
R
I
L
D
R
N
G
K
V
L
V
--------------
D
N
A
S
K
M
A
I
T
Y
--------
T
R
G
R
K
T
T
Q
S
E
M
L
D
T
A
E
K
L
S
K
L
I
K
M
D
T
K
KIT
E
R
D
K
K
D
F
W
I
Q
L
H
P
K
K
A
K
A
M
M
T
K
E
Q
A
M
L
A
DGSIK
Q
D
Q
Y
D
K
Q
L
L
S
K
IRKSQLDELS
S
K
D
L
Q
V
L
A
I
F
R
E
M
N
AGTVLDPQMIKNE
D
V
------
S
E
------------
K
------------------
E
Y
A
------------
A
V
S
Q
Q
-----------
L
S
K
L
P
G
V
N
T
S
M
D
----------
W
D
R
K
Y
P
Y
G
D
T
L
R
G
I
F
G
D
V
----------
S
T
-------------
P
A
EGIPKEL
T
E
H
Y
L
S
K
GYS
R
N
D
R
----
V
---
G
K
S
Y
L
E
Y
Q
Y
E
D
V
L
R
G
K
K
K
-
E
M
K
Y
T
T
D
K
S
-
G
K
V
T
S
S
E
V
---
L
N
-
P
G
-
A
R
G
Q
D
L
K
L
T
I
D
I
D
L
Q
K
------
E
V
------
E
A
L
L
-
D
--------
K
Q
I
K
KLRSQGAKDM
D
-------
N
-
A
M
-------
M
V
V
Q
N
P
K
N
G
D
I
L
A
L
A
G
K
Q
I
N
K
S
G
K
M
T
----------------------
D
Y
D
I
G
T
F
T
S
Q
F
--
A
V
G
S
S
V
K
G
G
T
-
L
L
A
G
Y
Q
N
K
A
I
K
V
G
E
T
M
V
D
E
-
P
L
H
F
Q
-
G
G
--
L
T
K
----
R
S
Y
F
-
N
K---
N
G
H
V
S
I
N
D
K
Q
A
L
M
H
S
S
N
V
Y
M
F
K
T
A
L
K
L
----
A
GDPYYSGMALPSDI
S
S
P
A
Q
K
L
R
R
G
L
N
Q
V
G
L
G
V
K
---
T
G
I
-
D
L
P
N
E
T
R
G
Q
I
E
--
P
L
---------
T
N
N
P
G
N
Y
L
D
L
S
I
G
Q
Y
-
D
T
Y
T
P
L
Q
-
L
S
Q
Y
V
S
T
I
A
N
D
G
Y
R
I
-----
Q
-
P
H
I
G
------
L
T
I
H
E
S
T
NKDEVGP
L
K--
K
K
I
N
G
T
--
V
LN
K
V
N
N
T
E
K
E
I
K
Q
I
Q
E
G
F
K
M
A
F
---------
N
D
--
K
---
D
G
T
------
G
Y
V
S
-
F
K
D
T
V
V
P
T
A
G
K
T
G
T
A
-
E
---
V
F
Q
-E---------
P
----
R
---------
V
N
---------
S
---
T
Y
I
G
Y
----
A
P
I
D
D
P
K
L
A
F
S
I
V
Y
T
----
N
--
Q
P
VPP----------
P
W
L
T
G
G
--
D
L
G
R
D
V
I
N
Y
Y
F
K
------------------------------------------------------------------------------------------------------------------------------