@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 : bsu25000: (2016-07-09 )
MRRNKPKKQNHKEKKKSLPIRLNILFLAAFVIFTWIIVELGIKQIVQGDDYKNQANKQEQSEVSSAVPRGKIYDRNFNAIVTNKALNAITYTRSKSTTQEQRLKIAKKLSDMIKVDTKKVTERDKKDYWILTRPKEAKKLISSKERQQVEDKKISDDDLYQLQLKRITDKQLNELTDKDMQILAIKRQMDSGYALTPQYIKNEDVSAKEMAVVSEHLDELPGVDVTSDWEREYPYKNLLRSVLGSVSSSNEGLPSNLLDHYLSLGYSRNDRVGKSYLEYQYESLLQGQKAKVENITDSKGNVTGTKTVSEGKAGKDLVLTIDIDLQKSVEKIIEKKLKAAKARPSTELLDRAFVVMMDPRNGEVLTMAGKQIKRENGAYKFDDYALGAMTSSYAMGSAVKGATVLTGLQTGAINLNTVFKDEPLYIGQDKRGKKSWQNLGPVGIQTALEKSSNVFMFKTAIAVGKGEYKPHQALPLDTSAFDTFRNYFSQFGLGVKTGIDLPNEMTGYKGTSRLSGFLLDFAIGQYDTYTPLELAQYVSTIANGGYRMKPQLVKEVRDSNAKKGIGAVVDSVQPEVLNKVDMKSSYIEEVQAGFRRVATKGTAAGQLASASYKPAAKTGTAQSFYDGPDKSKTGTDTYNTTLVAYAPADNPEIAISVVVPWTYIDYNQRYSITNEIGREVMDKYFELKSKQDKEGTQQKNKDKIEENAENTTSSDN
Atome Classification :
(20 SA)
.........10........20........30........40........50........60........70........80........90....-....100.......110.......120.......130..--.....140---.......150.......160.......170.......180.......190.......200........210.......220.......230.......240.......250.......260.......270.......280.......290.......300...-....310........320.......330.......340.......350.......360.......370-.......-----------380----...-.--.--..390.......400.......410.......420.--.-....--.-430..-..--.----..--440--....--.....450.......460-.......470..----...-------.--.480.......490....---...500.....-..510-.----.--.--.....520....-------------.-..530.......540.......550.......560.....-----..570..----...-..580.......590......------.--600-----..-.....--610.......620.......630...-....640.......650.......660...-....670.......680.......690.......700.......710....
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MRRNKPKKQ
N
H
K
E
K
K
KSL
P
I
R
L
N
I
L
F
L
A
A
F
V
I
F
T
W
I
I
V
E
L
G
I
K
Q
I
VQGDDYKNQAN
K
Q
E
Q
S
E
V
S
SAVPRG
K
I
YDRNF
N
A
I
V
TNKA
L
N
A
I
T
YTRSK-ST
T
Q
E
Q
R
L
K
I
A
K
K
L
S
D
M
I
KV
D
T
K
K
V
T
ERDKK
D
Y
W
I
L
TR
P
--
K
E
A
K
K
L
I
S
---
S
K
E
R
Q
Q
V
EDKKISDD
D
L
Y
Q
L
Q
L
K
R
I
T
D
K
Q
L
N
E
L
T
DKD
M
Q
I
L
A
I
K
RQMDSGYAL
T
P
Q
Y
I-KNEDV
S
A
K
E
M
A
V
V
S
E
H
L
D
ELPGVDVT
S
D
W
E
REY
P
Y
K
N
L
L
R
S
V
L
GSVSSSNEGL
P
S
N
L
L
D
H
Y
L
SLGYSRN
D
R
V
G
K
S
Y
L
E
Y
Q
Y
E
S
L
LQGQKAKVENITDSKGNVTG
T
-
K
T
VSE-GKAG
K
D
L
V
L
T
I
DI
D
L
Q
K
S
V
E
K
I
I
E
K
K
L
K
A
AKAR
P
S
T
E
L
LD
R
A
F
V
V
M
MDPRNG
E
V
L
T
MAGKQI-KRENGAY-----------KFD----
D
Y
A
-
L
--
G
--
A
M
T
S
S
YAMGSAVKG
A
T
V
L
T
GLQTG
A
I
N
L
N
T
V
FKDEP--
L
-
Y
IGQ--D-KRG
K
K
-
S
W
--Q----NL--G----
P
V
G
I
--
Q
T
A
L
EKSS
N
V
F
M
F
K
T
A
I
A-VGKGEYKPHQAL----PLD-------
T
--
S
A
F
D
T
F
R
N
Y
F
S
QFGLGVK---TGIDLPNEMTG-YKG
T
--
S
----
R
--
L
--
S
G
F
L
L
D
F
AIGQY-------------D-TY
T
P
L
E
L
A
Q
Y
V
S
T
I
ANGGYRM
K
P
Q
L
V
K
E
V
R
DSNAKK
G
I
G
A
-----
V
V
D
SV
Q
P
----
E
V
L
-
N
K
V
D
M
K
S
S
Y
I
E
E
V
Q
A
G
F
R
R
V
A------T--KGT-----AA-GQLAS--ASYKPAAKTGTAQSFYDGPDKSKTGT-DTY
N
T
T
L
V
A
Y
APADNP
E
I
A
I
S
V
V
V
P
W
T
Y
ID-YNQRY
S
I
T
N
E
I
G
R
E
V
M
D
K
Y
F
E
L
KSKQDKEGTQQK
N
K
D
K
I
E
ENAENTTSSDN
21
PsiBlast_CBE
92.05
44%
9
- C1 -
3VSL
1
?
B:
[2-633]
----------------------------------------------
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
K
I
T
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
D
G
S
I
K
Q
D
Q
Y
D
K
Q
L
L
S
K
I
R
K
S
Q
L
D
E
L
S
S
K
D
L
Q
V
L
A
I
F
R
E
M
N
A
G
T
V
L
D
P
Q
M
I
-
K
N
E
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
E
G
I
P
K
E
L
T
E
H
Y
L
S
K
G
Y
S
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
K
L
R
S
Q
G
A
K
D
-
M
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
ND
K
Q
A
L
M
H
S
S
N
V
Y
M
F
K
T
A
L
K
-
L
A
G
D
P
Y
Y
S
G
M
A
L
----
P
S
D
I------
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
N
K
D
E
V
G
P
-----
L
K
K
K
I
N
G
----
T
V
L
-
N
K
V
N
N
T
E
K
E
I
K
Q
I
Q
E
G
F
K
M
A
F
------
N
DK
D
-
T
-----
G
Y
-
V
S
F
K
D
--
T
V
V
P
T
A
G
K
T
G
T
A
E
V
F
Q
N
-
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
-
V
P
P
P
W
L
T
G
G
D
L
G
R
D
V
I
N
Y
Y
F
K
------------------------------
1
PsiBlast_PDB
88.52
44%
10
- 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
K
I
T
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
D
G
S
I
K
Q
D
Q
Y
D
K
Q
L
L
S
K
I
R
K
S
Q
L
D
E
L
S
S
K
D
L
Q
V
L
A
I
F
R
E
M
N
A
G
T
V
L
D
P
Q
M
I
-
K
N
E
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
E
G
I
P
K
E
L
T
E
H
Y
L
S
K
G
Y
S
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
K
L
R
S
Q
G
A
K
D
-
M
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
G
D
P
Y
Y
S
G
M
A
L
----
P
S
D
I------
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
N
K
D
E
V
G
P
-----
L
K
K
K
I
N
G
----
T
V
L
-
N
K
V
N
N
T
E
K
E
I
K
Q
I
Q
E
G
F
K
M
A
F
------
N
DK
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
-
V
P
P
P
W
L
T
G
G
D
L
G
R
D
V
I
N
Y
Y
F
K
------------------------------
2
PsiBlast_PDB
87.89
44%
11
- C1 -
3VSL
1
?
A:
[2-633]
----------------------------------------------
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
K
I
T
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
D
G
S
I
K
Q
D
Q
Y
D
K
Q
L
L
S
K
I
R
K
S
Q
L
D
E
L
S
S
K
D
L
Q
V
L
A
I
F
R
E
M
N
A
G
T
V
L
D
P
Q
M
I
-
K
N
E
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
E
G
I
P
K
E
L
T
E
H
Y
L
S
K
G
Y
S
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
K
L
R
S
Q
G
A
K
D
-
M
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
G
D
P
Y
Y
S
G
M
A
L
----
P
S
D
I------
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
N
K
D
E
V
G
P
-----
L
K
K
K
I
N
G
----
T
V
L
-
N
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
-
V
P
P
P
W
L
T
G
G
D
L
G
R
D
V
I
N
Y
Y
F
K
------------------------------
48
Fugue
78.67
32%
8
- C1 -
2WAD
3
PBP2_STRR6
A:
[50-680]
----------------------------------------------------------
S
Q
T
K
V
T
T
S
S
A
R
G
E
I
Y
D
A
S
G
K
P
L
V
E
N
T
L
K
Q
V
V
S
F
T
R
S
N
-
K
M
T
A
T
D
L
K
E
I
A
K
K
L
L
T
Y
V
S
I
S
S
P
N
L
T
E
R
Q
L
A
D
Y
Y
L
-------------
A
---
D
P
E
I
Y
K
K
T
V
E
A
L
P
E
S
E
L
Y
N
N
A
V
D
S
V
P
T
S
Q
L
N
-
Y
T
E
D
E
K
K
E
I
Y
L
F
S
Q
L
N
A
V
G
N
F
A
T
G
T
I
-
A
T
D
P
L
N
D
S
Q
V
A
V
I
A
S
I
S
K
E
M
P
G
I
S
I
S
T
S
W
D
R
K
I
-
L
E
T
S
L
S
S
I
V
G
S
V
S
S
E
K
A
G
L
P
A
E
E
A
E
S
Y
L
K
K
G
Y
S
L
N
D
R
V
G
T
S
Y
L
E
K
Q
Y
E
E
V
L
Q
G
K
R
P
V
K
E
I
H
L
D
K
H
G
D
M
E
S
V
-
E
N
I
E
E
-
G
S
K
G
K
N
I
K
L
T
I
D
L
A
F
Q
D
S
V
D
A
L
L
K
S
Y
F
N
S
E
L
G
N
G
G
A
K
Y
S
E
G
V
Y
A
V
A
L
N
P
Q
T
G
A
V
L
S
M
S
G
L
K
H
-
D
L
K
T
G
-------------
E
L
T
----
P
D
S
-
L
--
G
--
T
V
T
N
V
F
V
P
G
S
V
V
K
A
A
T
I
S
S
G
W
E
N
G
V
L
S
G
N
Q
T
L
T
D
Q
P
--
I
-
V
F
-
Q
--
G
-
S
A
P
I
Y
-
S
W
--
Y
----
K
L
--
A
Y
G
S
F
P
I
T
A
--
V
E
A
L
E
Y
S
S
N
A
Y
V
V
Q
T
A
L
G
-
I
M
G
Q
T
Y
Q
P
N
M
F
V
----
G
T
S
N
L
-----
E
--
S
A
M
G
K
L
R
S
T
F
G
E
Y
G
L
G
S
A
---
T
G
I
D
L
P
D
E
S
T
G
-
L
V
P
K
--
E
----
Y
--
N
--
F
A
N
F
I
T
N
A
F
G
Q
F
-------------
D
-
N
Y
T
P
M
Q
L
A
Q
Y
V
A
T
I
A
N
N
G
V
R
L
A
P
H
I
V
E
G
I
Y
D
N
N
D
K
G
G
L
G
E
-----
L
I
Q
A
I
D
T
----
K
E
I
-
N
K
V
N
I
S
E
S
D
M
A
I
L
H
Q
G
F
Y
Q
V
S
------
H
--
G
T
S
-----
P
-----------------
L
T
T
G
R
A
F
S
D
G
A
T
V
S
I
S
G
K
-
T
G
T
N
T
N
A
V
A
Y
A
P
T
E
N
P
Q
I
A
V
A
V
V
F
P
H
N
T
----
N
L
T
K
N
V
G
P
A
I
A
R
D
I
I
N
L
Y
N
Q
H
H
P
M
N
-------------------------
24
HHSearch
75.20
44%
54
- 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
K
I
T
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
D
G
S
I
K
Q
D
Q
Y
D
K
Q
L
L
S
K
I
R
K
S
Q
L
D
E
L
S
S
K
D
L
Q
V
L
A
I
F
R
E
M
N
A
G
T
V
L
D
P
Q
M
I
K
N
E
-
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
E
G
I
P
K
E
L
T
E
H
Y
L
S
K
G
Y
S
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
K
L
R
S
Q
-
G
A
K
D
M
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
DI
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
KN--
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
G
D
P
Y
Y
S
G
M
A
L
PSDI
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
-----
N
K
D----
E
V
G
P
L
K
K
K
I
N
G
T
V
L
-
N
K
V
N
N
T
E
K
E
I
K
Q
I
Q
E
G
F
K
M
A
F
------
N
DK
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
V
P
---
P
P
W
L
T
G
G
D
L
G
R
D
V
I
N
Y
Y
F
K
------------------------------
22
PsiBlast_CBE
71.66
32%
39
- C1 -
2WAD
3
PBP2_STRR6
C:
[50-673]
----------------------------------------------------------
S
Q
T
K
V
T
T
S
S
A
R
G
E
I
Y
D
A
S
G
K
P
L
V
E
N
T
L
K
Q
V
V
S
F
T
R
S
N
-
K
M
T
A
T
D
L
K
E
I
A
K
K
L
L
T
Y
V
S
I
S
S
P
N
L
T
E
R
Q
L
A
D
Y
Y
-
L
A
D
P
--
E
I
Y
K
K
T
V
E
A
LP
S
------------
E
S
E
L
Y
N
N
A
V
D
S
V
P
T
S
Q
L
N
Y
T
E
D
E
K
K
E
I
Y
-
L
F
S
Q
L
N
A
V
G
N
F
A
T
G
T
I
-
A
T
D
P
L
N
D
S
Q
V
A
V
I
A
S
I
S
K
E
M
P
G
I
S
I
S
T
S
W
D
R
K
I
-
L
E
T
S
L
S
S
I
V
G
S
V
S
S
E
K
A
G
L
P
A
E
E
A
E
S
Y
L
K
K
G
Y
S
L
N
D
R
V
G
T
S
Y
L
E
K
Q
Y
E
E
V
L
Q
G
K
R
P
V
K
E
I
H
L
D
K
H
G
D
M
E
S
V
-
E
N
I
E
E
-
G
S
K
G
K
N
I
K
L
T
I
D
L
A
F
Q
D
S
V
D
A
L
L
K
S
Y
F
N
S
E
L
G
N
G
G
A
K
Y
S
E
G
V
Y
A
V
A
L
N
P
Q
T
G
A
V
L
S
M
S
G
L
K
H
-
D
L
K
T
G
E
L
-----------
T
P
D
------
S
-
L
--
G
--
T
V
T
N
V
F
V
P
G
S
V
V
K
A
A
T
I
S
S
G
W
E
N
G
V
L
S
G
N
Q
T
L
T
D
Q
P
--
I
--
V
F
Q
--
G
-
S
A
P
I
Y
-
S
W
--
Y
----
K
L
--
A
YG
S
F
P
I
T
A
--
V
E
A
L
E
Y
S
S
N
A
Y
V
V
Q
T
A
L
G
-
I
M
G
Q
T
Y
Q
P
N
M
F
V
----
G
T
S
-------
N
L
E
S
A
M
G
K
L
R
S
T
F
G
E
Y
G
L
G
S
A
---
T
G
I
D
L
P
D
E
S
T
G
-
L
V
P
K
--
E
----
Y
--
N
--
F
A
N
F
I
T
N
A
F
G
Q
F
-------------
D
-
N
Y
T
P
M
Q
L
A
Q
Y
V
A
T
I
A
N
N
G
V
R
L
A
P
H
I
V
E
G
I
Y
D
N
N
D
K
G
G
L
G
E
-----
L
I
Q
A
I
D
T
----
K
E
I
-
N
K
V
N
I
S
E
S
D
M
A
I
L
H
Q
G
F
Y
Q
V
S
HGTSPL
T
--
T
G
R
-----
A
F
-
S
D
G
A
T
--
V
S
I
--
S
G
K
T
G
T
-------------------
N
T
N
A
V
A
Y
A
P
T
E
N
P
Q
I
A
V
A
V
V
F
P
H
---
N
-
T
N
L
T
K
N
V
G
P
A
I
A
R
D
I
I
N
L
Y
--------------------------------
4
PsiBlast_PDB
71.55
32%
40
- C1 -
2WAD
2
PBP2_STRR6
A:
[50-673]
----------------------------------------------------------
S
Q
T
K
V
T
T
S
S
A
R
G
E
I
Y
D
A
S
G
K
P
L
V
E
N
T
L
K
Q
V
V
S
F
T
R
S
N
-
K
M
T
A
T
D
L
K
E
I
A
K
K
L
L
T
Y
V
S
I
S
S
P
N
L
T
E
R
Q
L
A
D
Y
Y
-
L
A
D
P
--
E
I
Y
K
K
T
V
E
A
LP-------------
E
S
E
L
Y
N
N
A
V
D
S
V
P
T
S
Q
L
N
Y
T
E
D
E
K
K
E
I
Y
-
L
F
S
Q
L
N
A
V
G
N
F
A
T
G
T
I
-
A
T
D
P
L
N
D
S
Q
V
A
V
I
A
S
I
S
K
E
M
P
G
I
S
I
S
T
S
W
D
R
K
I
-
L
E
T
S
L
S
S
I
V
G
S
V
S
S
E
K
A
G
L
P
A
E
E
A
E
S
Y
L
K
K
G
Y
S
L
N
D
R
V
G
T
S
Y
L
E
K
Q
Y
E
E
V
L
Q
G
K
R
P
V
K
E
I
H
L
D
K
H
G
D
M
E
S
V
-
E
N
I
E
E
-
G
S
K
G
K
N
I
K
L
T
I
D
L
A
F
Q
D
S
V
D
A
L
L
K
S
Y
F
N
S
E
L
G
N
G
G
A
K
Y
S
E
G
V
Y
A
V
A
L
N
P
Q
T
G
A
V
L
S
M
S
G
L
K
H
-
D
L
K
T
G
E
L
-----------
T
P
D
------
S
-
L
--
G
--
T
V
T
N
V
F
V
P
G
S
V
V
K
A
A
T
I
S
S
G
W
E
N
G
V
L
S
G
N
Q
T
L
T
D
Q
P
--
I
--
V
F
Q
--
G
-
S
A
P
I
Y
-
S
W
--
Y
----
K
L
--
A
Y
G
S
F
P
I
T
A
--
V
E
A
L
E
Y
S
S
N
A
Y
V
V
Q
T
A
L
G
-
I
M
G
Q
T
Y
Q
P
N
M
F
V
----
G
T
S
-------
N
L
E
S
A
M
G
K
L
R
S
T
F
G
E
Y
G
L
G
S
A
---
T
G
I
D
L
P
D
E
S
T
G
-
L
V
P
K
--
E
----
Y
--
N
--
F
A
N
F
I
T
N
A
F
G
Q
F
-------------
D
-
N
Y
T
P
M
Q
L
A
Q
Y
V
A
T
I
A
N
N
G
V
R
L
A
P
H
I
V
E
G
I
Y
D
N
N
D
K
G
G
L
G
E
-----
L
I
Q
A
I
D
T
----
K
E
I
-
N
K
V
N
I
S
E
S
D
M
A
I
L
H
Q
G
F
Y
Q
V
S
HGTSPL
T
--
T
G
R
-----
A
F
-
S
D
G
A
T
--
V
S
I
--
S
G
K
T
G
T
-------------------
N
T
N
A
V
A
Y
A
P
T
E
N
P
Q
I
A
V
A
V
V
F
P
H
---
N
-
T
N
L
T
K
N
V
G
P
A
I
A
R
D
I
I
N
L
Y
--------------------------------
23
PsiBlast_CBE
70.77
32%
37
- C1 -
2WAD
2
PBP2_STRR6
B:
[52-673]
------------------------------------------------------------
T
K
V
T
T
S
S
A
R
G
E
I
Y
D
A
S
G
K
P
L
V
E
N
T
L
K
Q
V
V
S
F
T
R
S
N
-
K
M
T
A
T
D
L
K
E
I
A
K
K
L
L
T
Y
V
S
I
S
S
P
N
L
T
E
R
Q
L
A
D
Y
Y
-
L
A
D
P
--
E
I
Y
K
K
T
V
E
A
LP
S
------------
E
S
E
L
Y
N
N
A
V
D
S
V
P
T
S
Q
L
N
Y
T
E
D
E
K
K
E
I
Y
-
L
F
S
Q
L
N
A
V
G
N
F
A
T
G
T
I
-
A
T
D
P
L
N
D
S
Q
V
A
V
I
A
S
I
S
K
E
M
P
G
I
S
I
S
T
S
W
D
R
K
I
-
L
E
T
S
L
S
S
I
V
G
S
V
S
S
E
K
A
G
L
P
A
E
E
A
E
S
Y
L
K
K
G
Y
S
L
N
D
R
V
G
T
S
Y
L
E
K
Q
Y
E
E
V
L
Q
G
K
R
P
V
K
E
I
H
L
D
K
H
G
D
M
E
S
V
-
E
N
I
E
E
-
G
S
K
G
K
N
I
K
L
T
I
D
L
A
F
Q
D
S
V
D
A
L
L
K
S
Y
F
N
S
E
L
G
N
G
G
A
K
Y
S
E
G
V
Y
A
V
A
L
N
P
Q
T
G
A
V
L
S
M
S
G
L
K
H
-
D
L
K
T
G
E
L
-----------
T
P
D
------
S
-
L
--
G
--
T
V
T
N
V
F
V
P
G
S
V
V
K
A
A
T
I
S
S
G
W
E
N
G
V
L
S
G
N
Q
T
L
T
D
Q
P
--
I
--
V
F
Q
--
G
-
S
A
P
I
Y
-
S
W
--
Y
----
K
L
--
A
Y
G
S
F
P
I
T
A
--
V
E
A
L
E
Y
S
S
N
A
Y
V
V
Q
T
A
L
G
-
I
M
G
Q
T
Y
Q
P
N
M
F
V
----
G
T
S
-------
N
L
E
S
A
M
G
K
L
R
S
T
F
G
E
Y
G
L
G
S
A
---
T
G
I
D
L
P
D
E
S
T
G
-
L
V
P
K
--
E
----
Y
--
N
--
F
A
N
F
I
T
N
A
F
G
Q
F
-------------
D
-
N
Y
T
P
M
Q
L
A
Q
Y
V
A
T
I
A
N
N
G
V
R
L
A
P
H
I
V
E
G
I
Y
D
N
N
D
K
G
G
L
G
E
-----
L
I
Q
A
I
D
T
----
K
E
I
-
N
K
V
N
I
S
E
S
D
M
A
I
L
H
Q
G
F
Y
Q
V
S
HGTSPL
T
--
T
G
R
-----
A
F
-
S
D
G
A
T
--
V
S
I
--
S
G
K
T
G
T
-------------------
N
T
N
A
V
A
Y
A
P
T
E
N
P
Q
I
A
V
A
V
V
F
P
H
---
N
-
T
N
L
T
K
N
V
G
P
A
I
A
R
D
I
I
N
L
Y
--------------------------------
25
HHSearch
69.12
31%
35
- C1 -
2WAD
3
PBP2_STRR6
A:
[50-677]
----------------------------------------------------------
S
Q
T
K
V
T
T
S
S
A
R
G
E
I
Y
D
A
S
G
K
P
L
V
E
N
T
L
K
Q
V
V
S
F
T
R
S
N
K
M
T
A
-
T
D
L
K
E
I
A
K
K
L
L
T
Y
V
S
I
S
S
P
N
L
T
E
R
Q
L
A
D
Y
Y
L
A
D
P
E
I
Y
K
K
T
V
E
A
L
P
----------------
E
S
E
L
Y
N
N
A
V
D
S
V
P
T
S
Q
-
L
N
Y
T
E
D
E
K
K
E
I
Y
L
F
S
Q
L
N
A
V
G
N
F
A
T
G
T
I
-
A
T
D
P
L
N
D
S
Q
V
A
V
I
A
S
I
S
K
E
M
P
G
I
S
I
S
T
S
W
D
R
K
I
L
E
-
T
S
L
S
S
I
V
G
S
V
S
S
E
K
A
G
L
P
A
E
E
A
E
S
Y
L
K
K
G
Y
S
L
N
D
R
V
G
T
S
Y
L
E
K
Q
Y
E
E
V
L
Q
G
K
R
P
V
K
E
I
H
L
D
K
H
G
D
M
E
S
V
-
E
N
I
E
E
-
G
S
K
G
K
N
I
K
L
T
I
D
L
A
F
Q
D
S
V
D
A
L
L
K
S
Y
F
N
S
E
L
G
N
G
G
A
K
Y
S
E
G
V
Y
A
V
A
L
N
P
Q
T
G
A
V
L
S
M
S
G
L
K
H
-
D
L
K
T
G
E
L
-------------------
T
P
D
S
L-
G
--
T
V
T
N
V
F
V
P
G
S
V
V
K
A
A
T
I
S
S
G
W
E
N
G
V
L
S
G
N
Q
T
L
T
D
Q
P
--
I
-
V
F
Q
G
--
S
-
A
P
I
Y
S
-
W
Y
--
K
L---
A
Y
G
S
F
----
P
I
T
A
--
V
E
A
L
E
Y
S
S
N
A
Y
V
V
Q
T
A
L
G
-
I
M
G
Q
T
Y
Q
P
N
M
F
V
------
G
TSN
L
E
S
A
M
--
G
---
K
L
R
S
T
F
G
E
Y
G
L
G
S
A
---
T
G
I
D
L
P
D
E
S
T
G
-
L
V
P
K
--
E
----
Y
--
N
--
F
A
N
F
I
T
N
A
F
G
Q
F
-------------
D
-
N
Y
T
P
M
Q
L
A
Q
Y
V
A
T
I
A
N
N
G
V
R
L
A
P
H
I
V
E
G
I
Y
D
N
N
-----
D
K
G
G
L
G
E
L
I
Q
A
I
D
T
----
K
E
I
N
K
V
-
N
I
S
E
S
D
M
A
I
L
H
Q
G
F
Y
Q
V
S
------
H
---
G
T
SPLTT
G
R
-
A
F
S
D
G
--
A
T
V
S
I
S
G
K
T
G
T
-------------------
N
T
N
A
V
A
Y
A
P
T
E
N
P
Q
I
A
V
A
V
V
F
P
H
N
T
N
----
L
T
K
N
V
G
P
A
I
A
R
D
I
I
N
L
Y
N
Q
H
H
----------------------------
5
PsiBlast_PDB
68.87
32%
41
- C1 -
2WAE
1
PBP2_STRR6
A:
[48-673]
--------------------------------------------------------
S
A
S
Q
T
K
V
T
T
S
S
A
R
G
E
I
Y
D
A
S
G
K
P
L
V
E
N
T
L
K
Q
V
V
S
F
T
R
S
N
-
K
M
T
A
T
D
L
K
E
I
A
K
K
L
L
T
Y
V
S
I
S
S
P
N
L
T
E
R
Q
L
A
D
Y
Y
-
L
A
D
P
--
E
I
Y
K
K
T
V
E
A
LP--------------
S
E
L
Y
N
N
A
V
D
S
V
P
T
S
Q
L
N
Y
T
E
D
E
K
K
E
I
Y
-
L
F
S
Q
L
N
A
V
G
N
F
A
T
G
T
I
-
A
T
D
P
L
N
D
S
Q
V
A
V
I
A
S
I
S
K
E
M
P
G
I
S
I
S
T
S
W
D
R
K
I
-
L
E
T
S
L
S
S
I
V
G
S
V
S
S
E
K
A
G
L
P
A
E
E
A
E
S
Y
L
K
K
G
Y
S
L
N
D
R
V
G
T
S
Y
L
E
K
Q
Y
E
E
V
L
Q
G
K
R
P
V
K
E
I
H
L
D
K
H
G
D
M
E
S
V
-
E
N
I
E
E
-
G
S
K
G
K
N
I
K
L
T
I
D
L
A
F
Q
D
S
V
D
A
L
L
K
S
Y
F
N
S
E
L
G
N
G
G
A
K
Y
S
E
G
V
Y
A
V
A
L
N
P
Q
T
G
A
V
L
S
M
S
G
L
K
H
-
D
L
K
T
G
E
L
-----------
T
P
D
------
S
-
L
--
G
--
T
V
T
N
V
F
V
P
G
S
V
V
K
A
A
T
I
S
S
G
W
E
N
G
V
L
S
G
N
Q
T
L
T
D
Q
P
--
I
--
V
F
Q
--
G
-
S
A
P
I
Y
-
S
W
--
Y
----
K
L
--
A
Y
G
S
F
P
I
T
A
--
V
E
A
L
E
Y
S
S
N
A
Y
V
V
Q
T
A
L
G
-
I
M
G
Q
T
Y
Q
P
N
M
F
V
----
G
T
S
-------
N
L
E
S
A
M
G
K
L
R
S
T
F
G
E
Y
G
L
G
S
A
---
T
G
I
D
L
P
D
E
S
T
G
-
L
V
P
K
--
E
----
Y
--
N
--
F
A
N
F
I
T
N
A
F
G
Q
F
-------------
D
-
N
Y
T
P
M
Q
L
A
Q
Y
V
A
T
I
A
N
N
G
V
R
L
A
P
H
I
V
E
G
I
Y
D
N
N
D
K
G
G
L
G
E
-----
L
I
Q
A
I
D
T
----
K
E
I
-
N
K
V
N
I
S
E
S
D
M
A
I
L
H
Q
G
F
Y
Q
V
S
HGTSPL
T
--
T
G
R
-----
A
F
-
S
D
G
A
T
--
V
S
I
--
S
G
K
T
G
T
------------------
N
N
T
N
A
V
A
Y
A
P
T
E
N
P
Q
I
A
V
A
V
V
F
P
H
---
N
-
T
N
L
T
K
N
V
G
P
A
I
A
R
D
I
I
N
L
Y
--------------------------------
3
PsiBlast_PDB
66.02
32%
39
- C1 -
2WAF
2
PBP2_STRR6
A:
[52-673]
------------------------------------------------------------
T
K
I
T
S
S
S
A
R
G
E
I
Y
D
A
S
G
K
P
L
V
E
N
T
L
K
Q
V
V
S
F
T
R
S
N
-
K
M
T
A
T
D
L
K
E
T
A
K
K
L
L
T
Y
V
S
I
S
S
P
N
L
T
E
R
Q
L
A
D
Y
Y
-
L
A
D
P
--
E
I
Y
K
K
I
V
E
A
LP
S
------------
E
S
E
L
Y
N
N
A
V
D
S
V
Q
T
S
Q
L
N
Y
T
E
D
E
K
K
E
I
Y
-
L
F
S
Q
L
N
A
V
G
N
F
A
T
G
T
I
-
A
T
D
P
L
N
D
S
Q
V
A
V
I
A
S
I
S
K
E
M
P
G
I
S
I
S
T
S
W
D
R
K
V
-
L
E
T
S
L
S
S
I
V
G
S
V
S
S
E
K
A
G
L
P
A
E
E
A
E
A
Y
L
K
K
G
Y
S
L
N
D
R
V
G
T
S
Y
L
E
K
Q
Y
E
E
T
L
Q
G
K
R
S
V
K
E
I
H
L
D
K
Y
G
N
M
E
S
V
-
D
T
I
E
E
-
G
S
K
G
N
N
I
K
L
T
I
D
L
A
F
Q
D
S
V
D
A
L
L
K
S
Y
F
N
S
E
L
E
N
G
G
A
K
Y
S
E
G
V
Y
A
V
A
L
N
P
K
T
G
A
V
L
S
M
S
G
I
K
H
-
D
L
K
T
G
E
L
-----------
T
P
D
------
S
-
L
--
G
--
T
V
T
N
V
F
V
P
G
S
V
V
K
A
A
T
I
S
S
G
W
E
N
G
V
L
S
G
N
Q
T
L
T
D
Q
S
--
I
--
V
F
Q
--
G
-
S
A
P
I
N
-
S
W
YT
Q
----
A
Y
--
G
S
F
--
P
I
T
A
--
V
Q
A
L
E
Y
S
S
N
T
Y
M
V
Q
T
A
L
G
-
L
M
G
Q
T
Y
Q
P
N
M
F
V
----
G
T
S
-------
N
L
E
S
A
M
E
K
L
R
S
T
F
G
E
Y
G
L
G
T
A
---
T
G
I
D
L
P
D
E
S
T
G
-
F
V
P
K
--
E
----
Y
--
S
--
F
A
N
Y
I
T
N
A
F
G
Q
F
-------------
D
-
N
Y
T
P
M
Q
L
A
Q
Y
V
A
T
I
A
N
N
G
V
R
V
A
P
R
I
V
E
G
I
Y
G
N
N
D
K
G
G
L
G
D
-----
L
I
Q
Q
L
Q
P
----
T
E
M
-
N
K
V
N
I
S
D
S
D
M
S
I
L
H
Q
G
F
Y
Q
V
A
HG----
T
--
S
G
L
-----
T
T
-
G
R
A
F
S
NG
A
L
V
S
I
S
G
K
T
G
T
A
E
S
Y
V
------
A
D
G
Q
-
Q
A
T
N
T
N
A
V
A
Y
A
P
S
D
N
P
Q
I
A
V
A
V
V
F
P
H
---
N
-
T
N
L
T
N
G
V
G
P
S
I
A
R
D
I
I
N
L
Y
--------------------------------
49
Fugue
56.37
22%
19
- C1 -
3OC2
3
?
A:
[35-545]
--------------------------------------------------------
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
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
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
NR
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
WP
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
---------------------
N
V
P
P
D
N
L
31
HHSearch
56.13
22%
1
* C1 *
4OVD
1
?
A:
[51-561]
------------------------------------------------------------
N
D
I
V
L
H
A
R
R
G
T
I
Y
D
R
N
G
N
V
L
A
M
S
V
D
C
K
--------------------------------------------------------------------------------------------------------------------------------------------------
N
N
T
K
R
V
Y
P
Y
G
N
V
G
V
Q
I
L
G
F
V
N
A
D
---------------------
N
E
G
A
S
G
L
E
Y
Y
Y
N
D
I
L
A
G
T
N
G
H
M
I
-------------
S
N
I
T
E
-
A
Q
N
G
Q
D
I
V
L
S
I
D
I
E
L
Q
K
K
A
E
E
Q
L
T
A
A
V
K
D
F
E
------
A
K
Q
G
G
S
I
M
A
M
N
P
R
T
G
E
I
Y
A
A
A
S
Y
P
L
P
D
F
-----V----------
D
Y
------
E
S
-
L
NL
K
--
L
V
S
S
I
Y
E
P
G
S
V
F
K
V
I
T
T
S
I
G
V
D
N
N
L
F
G
P
N
S
T
F
N
I
P
T
--
E
L
Q
V
G
D
----
N
K
V
T
D
-
D
D
W-
R
T---
S
A
--
M
----
D
M
S
V
--
R
E
M
L
R
R
S
S
N
V
G
M
A
F
L
E
T
Q
L
I
-----------------
G
-------
D
--
K
---
R
F
A
E
G
I
D
K
F
G
I
G
H
T
---
T
G
I
D
F
P
G
E
A
T
G
-
I
V
R
S
--
L
DQ--
Y
--
E
--
G
P
T
G
G
N
M
A
F
G
Q
G
-------------
L
-
A
I
P
F
I
Q
V
I
R
A
Y
T
A
V
A
N
K
G
T
M
V
T
P
H
F
M
V
S
K
G
--------
G
Q
-----
E
V
S
W
--------
P
T
-
K
D
-
V
I
S
S
S
T
A
S
A
E
L
D
M
M
T
T
V
V
------
K
--
E
G
T
-----
G
V
R
A
G
I
----
Y
G
Y
T
V
A
G
K
T
G
T
G
Q
Q
V
V
E
E
T
--
G
S
Y
G
E
N
S
G
F
V
A
S
F
C
G
I
V
N
P
S
E
S
D
L
M
V
Y
V
G
L
N
D
T
H
Q
----
L
A
S
Q
S
A
A
V
V
F
S
Q
F
A
K
D
A
A
T
R
L
N
I
Q
P
------------------------
34
HHSearch
50.90
22%
-8
- C1 -
4R23
7
?
A:
[50-476]
--------------------------------------------------------------
K
S
A
Y
V
Q
R
G
A
I
I
T
S
D
G
V
T
L
A
E
S
V
K
-
Q
---------------------------------------------------------------------------------------------------------------------------
D
---------------------
D
G
T
Y
V
R
N
Y
P
H
D
G
M
A
S
H
T
V
G
Y
I
S
T
Q
----------------------
Y
G
T
A
G
I
E
S
S
M
N
E
T
L
T
G
H
------
R
S
A
-----
L
Y
S
-
M
-
A
G
I
--
T
T
G
S
S
V
V
L
T
I
N
S
Q
M
Q
A
V
A
E
A
A
L
Q
G
--------------
Y
S
G
S
I
V
V
M
D
P
S
T
G
A
V
L
A
K
A
S
S
P
S
Y
T
H
A
E
L
G
T
-----------
I
-------
S
Q
-
L
VD
R
--
T
T
Q
A
L
Y
S
P
G
S
S
F
K
T
V
T
L
A
A
G
I
D
T
H
K
T
T
L
D
T
T
Y
S
A
P
G
T
-
M
-
E
I
G
G
----
G
T
I
H
N
-
Y
A
--
N
E---
D
M
--
G
----
T
I
P
L
--
R
E
A
F
A
R
S
S
N
T
A
L
A
Q
L
G
V
A
-
L
-----------------
G
-------
A
--
D
---
N
L
V
S
Y
A
R
A
F
G
Y
G
T
A
---
L
G
Q
D
F
S
T
T
-
P
S
-
L
M
P
N
PA
E
----
M
--
T
--
T
W
E
L
A
W
A
S
C
G
L
P
V
G
E
H
ASPA-----
G
P
Q
T
T
V
M
Q
N
A
V
I
A
A
A
I
A
N
G
G
V
V
M
N
P
Y
I
V
D
R
V
L
S
P
E
-----
G
A
-----
V
V
S
T
T
S
P
----
K
S
L
-
G
Q
-
A
V
S
A
D
T
A
A
Q
V
R
E
A
M
L
G
V
V
------
E
--
S
G
T
-----
G
M
G
A
R
V
----
P
G
V
K
I
A
G
K
T
G
T
A
D
V
E
N
G
-----------
N
F
N
S
F
F
I
G
F
A
P
Y
D
H
P
T
L
V
V
S
V
V
I
E
G
N
G
E
----
N
V
L
G
Y
G
A
Q
V
G
G
R
V
L
A
Q
C
L
N
I
Q
----------------------------
36
HHSearch
50.66
26%
11
- C1 -
4MNR
3
?
A:
[49-454]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Y
E
R
E
Y
P
A
G
D
L
A
S
H
V
V
G
Y
S
S
P
Q
----------------------
F
G
N
S
G
I
E
K
A
Y
N
D
T
L
K
G
--------------------------
T
A
G
N
D
V
T
L
T
L
N
S
K
I
Q
Q
A
A
Q
D
A
L
A
G
--------------
R
K
G
A
C
V
V
M
D
P
D
T
G
A
I
L
A
M
A
S
A
P
T
Y
N
A
A
D
F
A
A
V
I
E
--------
Q
A
N
A
N
PD
D
S
T
-
L
VD
R
--
A
A
G
S
L
Y
A
P
G
S
T
F
K
I
V
T
L
A
T
A
L
E
D
D
V
A
G
E
D
T
V
F
S
S
P
G
--
T
M
E
I
-
G
--
N
-
A
T
V
S
N
-
F
N
--
K
A---
N
Y
--
G
----
S
L
T
L
--
A
Q
A
T
E
L
S
S
N
T
V
F
G
Q
L
G
V
E
-
M
-----------------
G
-------
A
--
D
---
K
L
V
A
G
A
E
S
F
G
F
N
K
E
---
I
D
F
P
L
Y
-
T
P
E
S
-
L
M
P
S
--
A
E
D
L
Q
K
--
S
--
P
W
E
L
A
W
A
A
A
G
E
P
VGDTTRPGRESPA
G
P
Q
A
T
V
L
E
M
A
M
V
G
T
A
I
A
N
D
G
V
I
M
Q
P
Y
L
V
D
S
V
N
N
A
N
-----
G
E
-----
R
S
F
S
A
S
P
----
T
K
L
-
M
Q
-
A
V
S
K
T
T
A
G
R
V
R
D
V
L
L
G
V
V
------
Q
--
N
G
T
-----
G
T
-
A
A
A
-
I
--
P
G
I
D
V
A
G
K
T
G
T
A
E
K
E
N
-----------
G
N
-
D
S
W
F
V
G
M
A
P
A
E
D
P
R
V
V
V
A
I
V
I
E
D
G
E
E
-----
G
--
V
G
T
A
K
A
Q
N
V
L
K
T
A
L
E
V
Q
----------------------------
10
PsiBlast_PDB
50.47
24%
29
- C1 -
5DF7
5
?
A:
[149-509]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
NR
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
KW
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
V
S
V
G
T
K
G
Y
R
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
----------------------------------------------------------
46
HHSearch
50.46
21%
1
- C1 -
4U3T
-
PBP2_NEIGO
A:
[236-569]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
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
G
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
WR
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
R
K
L
V
N
G
----
R
Y
V
D
-
N
K
H
V
G
T
F
I
G
F
A
P
A
K
N
P
R
V
I
V
A
V
T
I
D
E
P
T
A
H
-
G
----
V
V
A
G
S
P
F
K
K
I
M
G
G
S
L
N
I
L
G
I
S
P
T
-----------------------
9
PsiBlast_PDB
49.55
24%
30
- C1 -
4KQR
11
?
A:
[149-509]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
NR
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
KW
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
V
S
V
G
T
K
G
Y
R
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
----------------------------------------------------------
11
PsiBlast_PDB
48.89
24%
28
- C1 -
5DF8
8
?
A:
[149-509]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
NR
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
KW
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
V
S
V
G
T
K
G
Y
R
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
----------------------------------------------------------
37
HHSearch
48.85
22%
26
- C1 -
3UN7
-
PBPA_MYCTU
A:
[74-488]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
G
C
--
Y
-------
G
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
HN
P
E
V
Q
A
Q
A
W
Q
R
L
G
D
NP-
A
S
P
-
L
TN
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
--
S
T
A
Q
L
E
N
-
Y
G
--
G
APCG
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
-----
L
A
-----
N
I
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
P
R
------
H
-
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
D
R
L
S
A
T
G
G
A
L
A
A
P
I
G
R
A
V
I
E
A
A
L
Q
------------------------------