@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 : Rv2187: (2016-05-08 )
MREISVPAPFTVGEHDNVAAMVFEHERDDPDYVIYQRLIDGVWTDVTCAEAANQIRAAALGLISLGVQAGDRVVIFSATRYEWAILDFAILAVGAVTVPTYETSSAEQVRWVLQDSEAVVLFAETDSHATMVAELSGSVPALREVLQIAGSGPNALDRLTEAGASVDPAELTARLAALRSTDPATLIYTSGTTGRPKGCQLTQSNLVHEIKGARAYHPTLLRKGERLLVFLPLAHVLARAISMAAFHSKVTVGFTSDIKNLLPMLAVFKPTVVVSVPRVFEKVYNTAEQNAANAGKGRIFAIAAQTAVDWSEACDRGGPGLLLRAKHAVFDRLVYRKLRAALGGNCRAAVSGGAPLGARLGHFYRGAGLTIYEGYGLSGTSGGVAISQFNDLKIGTVGKPVPGNSLRIADDGELLVRGGVVFSGYWRNEQATTEAFTDGWFKTGDLGAVDEDGFLTITGRKKEIIVTAGGKNVAPAVLEDQLRAHPLISQAVVVGDAKPFIGALITIDPEAFEGWKQRNSKTAGASVGDLATDPDLIAEIDAAVKQANLAVSHAESIRKFRILPVDFTEDTGELTPTMKVKRKVVAEKFASDIEAIYNKE
Atome Classification :
(21 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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
-------------------------------------------------------MREISVPA
P
F
TVGEHD
N
V
A
A
M
V
F
EHERDD---P
D
Y
V
I
Y
Q
R
L
-----
I
-
D
-
G
VWTD-
V
T
C
A
E
A
A
N
Q
I
R
A
A
A
L
G
L
I
-
S
L
GVQAG
D
R
V
V
I
F
SAT
R
Y
E
W
A
I
L
D
F
A
I
L
A
V
G
A
V
T
VPTYETSS-
A
E
Q
V
R
W
V
L
QDS
E
A
V
V
L
F
A
--------ETDS
H
A
-
T
--------
M
V
A
E
L----SGS
V
P
----
A
L
R
-
E
V
L
----
Q
I
AGSG
P
----
N
A
L
---
D
R
L
T
EA-GASV--
D
P
-
A
-
E
L
T
A
R
L
A
A
L
---RSTD
P
A
T
L
I
Y
TSGTTGRPKG
C
Q
L
T
Q
S
N
--
L
V
H
E
IKG-A-R-AY
H
-
P
--
T
L
L
RKG
E
R
L
L
V
F
L
P
L
A
H
V
----
L
A
R
A
--
I
--
S
-
M
-
A
A
FH
S
--
K
V
T
V
G
F
------
T
-
S
-----
D
------
I
K
---
N
L
L
P
M
L
A
VFKP
T
V
V
V
S
V
-
P
R
-------
V
F
E
K
V
Y
N
T
A
E
QNAANAGK
G
R
I
F
-----
A
I
A
AQTAV
D
W
S
--
E
A
CDRGGP
G
L
L
L
R
A
K
H
A
V
F
D
R
L
V
Y
R
K
L
R
-----
A
A
LG-GN
C
R
A
AVSGGA
P
L
G
A
R
L
G
H
-
F
Y--RG-A------G
L
T
-
I
Y
EGYGLSGTSG
G
V
----------
A
I
S
Q
F---N-----
D
L
K
I-GT-----VGKPV-P-----------G-N
S
L
R
IA----------D----------------D------------G
E
L
L
V
R-----G-----
G
--
V
--
V
F
S
G
Y
WRNEQAT
T
---
E
A
F---T--------D------------------GWFKTGDLGAVDED
G
F
L
T
ITGRK
K
E
I
I
V
TAGGKNV
A
P
A
V
L
E
D
Q
L
RAHPLIS
Q
A
V
V
VG--DAK----P----
F
----
I
--
G
A
L
I
T
I
D
P
E
A
F
E
------
G
W
K
QRNSKTAGASVGDLAT
D
P
D
L
I
A
E
I
D
A
A
V
K
-
Q
A
N
L
A
V
S
H
A
E
S
I
R
-
K
F
R
I
L
P
V
DFTEDTGELT
P
T
M
K
V
K
R
K
V
V
A
E
K
F
A
S
D
--
I
E
A
I
YNKE--
76
HHSearch
88.84
24%
-93
- C4 -
3R44
2
FAC13_MYCTU
A:
[15-516]
---------------------------------------------------------------------
M
K
N
I
G
W
M
L
R
Q
R
A
T
V
S
---
P
R
L
Q
A
Y
V
E
P
-----
S
-
T
---
D
V
R
-
M
T
Y
A
Q
M
N
A
L
A
N
R
C
A
D
V
L
T
-
A
L
G
I
A
K
G
D
R
V
A
L
L
M
P
N
S
V
E
F
C
C
L
F
Y
G
A
A
K
L
G
A
V
A
V
P
I
N
T
R
L
A
-
A
P
E
V
S
F
I
L
S
D
S
G
S
K
V
V
I
Y
--------
G
A
P
S
A
P
----------
V
I
D
A
I
----
R
A
Q
A
D
----
P
P
G
-
T
V
T
----
D
W
I
G
---------
A
---
D
S
L
A
E
R
----
L
--
R
S
-
A
-
A
A
D
E
P
A
V
E
C
---
G
G
D
D
N
L
F
I
M
Y
T
S
---
G
H
P
K
G
V
V
H
T
H
E
S
--
V
H
S
A
A
S
S
-
W
-
A
-
S
T
I
-
D
----
V
R
Y
R
D
R
L
L
L
P
L
P
M
F
H
V
----
A
A
L
T
--
T
--
V
-
I
-
F
S
A
M
R
--
G
V
T
L
I
S
------
M
-
P
QF---
D
------
A
T
---
K
V
W
S
L
I
V
E
E
R
V
C
I
G
G
A
V
-
P
A
-------
I
L
N
F
M
R
Q
V
P
E
F
--------------------------------------------------------
A
-----
E
L
D
A
-
P
D
F
R
Y
F
I
T
G
G
A
P
M
P
E
A
L
I
K
-
I
Y
--
A
A
-
K
------
N
I
E
-
V
V
Q
G
Y
A
L
T
E
S
C
G
G
G
----------
T
L
L
L
S
---
E
DA---
L
R
K
A
-
G
S
-----
A
G
R
A
T
-
M
-----------
F
-
T
D
V
A
V
R
----------
G
DDGVIREHG-------
E
------------
G
E
V
V
I
K
-----
S
-----
D
--
I
--
L
L
K
E
Y
W
N
R
P
E
A
T
R
---
D
A
F
---
D
--------
N
------------------
G
W
F
R
T
G
D
I
G
E
I
D
D
E
G
Y
L
Y
I
K
D
R
L
K
D
M
I
I
S
-
G
G
E
N
V
Y
P
A
E
I
E
S
V
I
I
G
V
P
G
V
S
E
V
A
V
I
G
--
L
P
D
----
E
KWG
E
I
----
A
--
A
A
I
V
V
A
D
Q
N
E
-----------------------------
V
S
E
Q
Q
I
V
E
Y
C
G
----
T
R
L
A
R
Y
K
L
P
K
-
K
V
I
F
------
A
E
A
I
P
R
N
P
T
G
K
I
L
K
T
V
L
R
E
Q
Y
S
A
T
--
V
P
--------
61
HHSearch
88.06
25%
-78
* C4 *
2D1S
3
LUCI_LUCCR
A:
[18-545]
-----------------------------------------------------------------
Y
P
I
E
E
G
S
A
G
T
Q
L
R
K
Y
M
E
R
Y
---
A
K
L
G
A
I
A
F
T
-----
N
-
A
-
V
T
G
V
D
-
Y
S
Y
A
E
Y
L
E
K
S
C
C
L
G
K
A
L
Q
-
N
Y
G
L
V
V
D
G
R
I
A
L
C
S
E
N
C
E
E
F
F
I
P
V
I
A
G
L
F
I
G
V
G
V
A
P
T
N
E
I
Y
T
-
L
R
E
L
V
H
S
L
G
I
S
K
P
T
I
V
F
S
--------
S
K
K
G
L
D
----------
K
V
I
T
V
----
Q
K
T
V
T
----
T
I
K
-
T
I
V
----
I
L
D
S
K
V
D
YRGY
Q
C
L
---
D
T
F
I
K
R
-
N
T
P
P
--
G
F
-
Q
A
S
S
F
K
T
V
E
V
D
---
R
K
E
Q
V
A
L
I
M
N
S
S
G
S
T
G
L
P
K
G
V
Q
L
T
H
E
N
--
I
V
T
R
F
S
H
-
A
-
R
-
D
P
I
Y
G
--
N
Q
V
S
P
G
T
A
V
L
T
V
V
P
F
H
H
G
----
F
G
M
F
--
T
--
T
-
L
-
G
Y
L
I
C
--
G
F
R
V
V
M
------
L
-
T
KF---
D
------
E
E
---
T
F
L
K
T
L
Q
D
Y
K
C
T
S
V
I
L
V
-
P
T
-------
L
F
A
I
L
N
K
S
E
L
L
--------------------------------------------------------
N
-----
K
Y
D
L
-
S
N
L
V
E
I
A
S
G
G
A
P
L
S
K
E
V
G
E
-
A
V
--
A
R
-
R
FN----
L
P
G
-
V
R
Q
G
Y
G
L
T
E
T
T
S
A
I
----------
I
I
T
P
E
---
G
-----
D
D
K
P
-
G
A
-----
S
G
K
V
V
-
P
-----------
L
-
F
K
A
K
V
I
----------
D
LDT
K
K
S
L
G
PNR-----
R
------------
G
E
V
C
V
K
-----
G
-----
P
--
M
--
L
M
K
G
Y
V
N
N
P
E
A
T
K
---
E
L
I
D--
E
--------
E
------------------
G
W
L
H
T
G
D
I
G
Y
Y
D
E
E
K
H
F
F
I
V
D
R
L
K
S
L
I
K
Y
-
K
G
Y
Q
V
P
P
A
E
L
E
S
V
L
L
Q
H
P
S
I
F
D
A
G
V
A
G
--
V
P
D
----
P
VA
G
E
L
----
P
--
G
A
V
V
V
L
E
S
G
K
N
----------------------------
M
T
E
K
E
V
M
D
Y
V
A
-
S
---
Q
V
S
N
A
K
R
L
R
G
G
V
R
------
F
V
D
E
V
P
K
G
L
T
G
K
I
D
G
R
A
I
R
E
I
L
K
K
P
--
V
---------
65
HHSearch
87.40
22%
-92
- C4 -
4WV3
1
?
A:
[10-519]
----------------------------------------------------------------------
Y
N
A
V
D
I
L
E
R
N
L
P
V
R
---
A
N
K
T
A
L
F
T
P
-----
D
------
R
E
-
M
T
F
R
Q
V
S
N
E
A
N
Q
V
G
N
A
L
K
-
G
L
G
V
R
F
G
E
C
V
G
L
L
T
L
D
S
A
E
W
V
T
S
F
F
G
I
V
K
L
G
A
I
A
V
G
I
N
T
L
L
K
-
P
P
E
Y
E
Y
I
L
R
D
C
R
A
R
V
L
I
V
--------
H
Q
E
F
L
P
----------
L
I
E
S
I
----
R
G
N
L
P
----
M
L
E
-
H
I
V
----
V
I
G
---------
G
Y
---
L
S
F
N
D
W
----
I
--
R
P
-
Q
-
P
T
T
L
E
A
A
Q
S
---
H
R
E
D
I
C
S
L
N
Y
S
S
G
-
T
G
G
P
K
G
I
P
H
A
H
K
D
--
Y
P
L
T
A
Q
L
-
W
G
V
-
N
V
L
-
G
----
L
R
E
S
D
R
T
F
A
L
A
K
L
F
F
T
----
F
G
T
G
--
G
--
N
L
I
-
F
P
W
Y
V
--
G
A
S
C
V
L
------
F
-
P
GAAR-
V
------
A
S
---
N
V
L
S
T
I
S
R
F
K
P
T
I
F
Y
N
A
-
P
T
-------
G
Y
A
A
A
L
A
L
K
D
F
--------------------------------------------------------
S
-----
Q
H
D
L
-
S
S
L
R
L
C
V
S
A
S
E
A
L
P
A
A
L
W
Y
-
A
W
--
K
E
A
T
------
G
V
D
-
I
I
D
G
I
G
C
T
E
N
F
H
I
F
----------
I
S
N
R
P
---
G
-----
D
I
R
P
-
G
S
-----
S
G
K
P
V
-
E
-----------
G
-
Y
E
L
K
L
V
----------
D
DEGKTVPAG
E
------
I
------------
G
N
V
L
L
R
-----
S
-----
E
--
T
--
A
A
L
S
Y
W
H
N
F
E
K
S
R
---
Q
T
F
---
Q
--------
G
------------------
E
W
L
A
T
G
D
K
Y
F
V
D
A
D
G
Y
Y
W
H
A
G
R
S
D
D
M
L
K
V
-
G
G
I
W
V
S
P
V
E
V
E
S
T
L
I
Q
H
P
A
V
Q
E
C
A
V
I
G
--
C
P
D
----
Q
SRL
I
K
----
P
--
K
A
F
I
I
L
K
P
E
Q
I
P
-------------------------
S
E
A
L
I
R
Q
I
T
D
H
C
----
T
E
K
M
A
A
Y
K
R
P
R
-
W
I
E
F
V
------
T
E
L
P
K
T
A
T
G
K
I
Q
R
F
K
L
R
S
A
A
K
L
A
------------
81
Fugue
86.44
23%
-63
- C4 -
5EY9
5
FAA32_MYCMM
A:
[3-626]
------------------------------------------------------Y
H
N
P
F
I
V
N
G
K
I
R
F
P
E
N
T
N
L
V
R
H
V
E
K
W
A
R
V
R
---
G
D
K
L
A
Y
R
F
L
DFSTE
R
-
D
-
G
V
E
R
D
-
I
L
W
S
E
F
S
A
R
N
R
A
V
G
A
R
L
Q
-
Q
V
-
T
Q
P
G
D
R
I
A
I
L
C
P
Q
N
L
D
Y
L
I
S
F
F
G
A
L
Y
S
G
R
I
A
V
P
L
F
D
P
A
E
H
V
G
R
L
H
A
V
L
D
D
C
T
P
S
T
I
L
T
--------
T
T
D
S
A
E
-
G
--------
V
R
K
F
I
----
R
-
S
R
S
----
A
K
E
-
R
P
R
----
V
I
A
----------
V
---
D
A
V
P
T
E
-
V
A
S
T
WQ
Q
P
-
N
-
E
L
T
-------------
T
A
Y
L
Q
Y
T
-----
V
P
S
G
V
Q
I
T
H
L
N
--
L
P
T
N
V
---
L
-
Q
-
V
L
N
-
A
--
L
E
G
Q
E
G
D
R
G
V
S
W
L
P
F
F
H
D
----
M
G
L
I
--
T
--
V
-
L
-
L
A
S
V
L
--
G
H
S
F
T
F
------
M
-
T
--------------------
P
A
A
F
V
R
R
P
G
R
W
I
R
E
L
A
R
KPGET
G
G
T
F
S
A
A
P
N
F
A
F
E
H
A
A
M
R
G
V
P
R
---------
D
D
E
P
P
L
D
L
S
NV
K
G
I
L
N
G
S
E
P
V
S
P
A
S
M
R
K
F
F
K
A
F
E
P
Y
G
L
R
ETA
V
K
P
S
Y
G
L
A
E
A
T
L
F
V
S
T
T
-
P
M
D
E
V
P
T
V
-
I
H
--
V
D
-
R
------
D
E
L
-
N
K
Q
R
F
V
E
V
A
A
D
A
P
N
----------
A
V
A
Q
V
---
S
-----
A
G
K
V
-
G
V
D
E
W
A
V
I
V
D
T
E
-
T
-----------
A
-
S
E
L
P
D
G
----------
Q
----------------
I
------------
G
E
I
W
L
H
-----
G
-----
N
--
N
--
L
G
I
G
Y
W
G
K
E
E
E
S
A
---
Q
T
F
---
R
--------
N
ILKSRVPESHAEGAPDD
G
L
W
V
R
T
G
D
Y
G
T
Y
F
K
-
G
H
L
Y
I
A
G
R
I
K
D
L
-
V
I
I
D
G
R
N
H
Y
P
Q
D
L
E
Y
T
A
Q
E
S
---
T
K
A
L
R
V
G
--
Y
V
A
----
A
----
F
----
S
--
V
P
A
N
Q
L
P
Q
K
V
F
D
DPHAGL
S
F
D
P
E
D
T
S
E
Q
L
V
I
V
G
E
R
A
A
G
T
H
K
L
E
Y
Q
P
I
A
D
D
I
R
A
A
I
A
V
G
H
G
V
T
V
R
-
D
V
L
L
V
S
----
A
G
T
I
P
R
T
S
S
G
K
I
G
R
R
A
C
R
T
A
Y
I
D
G
SL
R
S
T
V
F
A
----
74
HHSearch
85.31
21%
-86
- C4 -
1MDB
4
DHBE_BACSU
A:
[25-536]
----------------------------------------------------------------------
E
T
F
G
D
L
L
R
D
R
A
A
K
Y
---
G
D
R
I
A
I
T
C
G
-----
N
------
T
H
-
W
S
Y
R
E
L
D
T
R
A
D
R
L
A
A
G
F
Q
-
K
L
G
I
Q
Q
K
D
R
V
V
V
Q
L
P
N
I
K
E
F
F
E
V
I
F
A
L
F
R
L
G
A
L
P
V
F
A
L
P
S
H
R
-
S
S
E
I
T
Y
F
C
E
F
A
E
A
A
A
Y
I
I
--------
P
D
A
Y
S
G
-
F
--------
D
Y
R
S
L
A
R
Q
V
Q
S
K
L
P
----
T
L
K
-
N
I
I
----
V
A
G
E
A
------
E
E
F
---
L
P
L
----
E
D
L
----
H
-
T
--
E
P
V
K
L
P
E
V
---
K
S
S
D
V
A
F
L
Q
L
S
G
G
S
T
G
L
S
K
L
I
P
R
T
H
D
D
--
Y
I
Y
S
L
K
R
-
S
-
V
-
E
V
C
-
W
----
L
D
H
S
T
V
Y
L
A
A
L
P
M
A
H
N
----
Y
P
L
S
--
S
PG
V
-
L
-
G
V
L
Y
A
--
G
G
R
V
V
L
------
S
-
P
SP---
S
------
P
D
---
D
A
F
P
L
I
E
R
E
K
V
T
I
T
A
L
V
-
P
P
-------
L
A
M
V
W
M
D
A
A
S
S
R
-------------------------------------------------------------
R
D
D
L
-
S
S
L
Q
V
L
Q
V
G
G
A
K
F
S
A
E
A
A
R
-
R
V
--
K
A
V
F
------
G
C
T
-
L
Q
Q
V
F
G
M
A
E
G
L
V
N
Y
----------
T
R
L
D
D
P--
E
-----
E
I
I
V
-
N
T
-----
Q
G
K
P
M
-
S
-----------
P
Y
D
E
S
R
V
W
D
DHDRDVKPG
E
----------------
T
------------
G
H
L
L
T
R
-----
G
-----
P
--
Y
--
T
I
R
G
Y
Y
K
A
E
E
H
N
A
---
A
S
F
T--
E
--------
D
------------------
G
F
Y
R
T
G
D
I
V
R
L
T
R
D
G
Y
I
V
V
E
G
R
A
K
D
Q
I
N
R
-
G
G
E
K
V
A
A
E
E
V
E
N
H
L
L
A
H
P
A
V
H
D
A
A
M
V
S
--
M
P
D
----
Q
FLG
E
R
----
S
--
C
V
F
I
I
P
R
D
E
A
-----------------------------
P
K
A
A
E
L
K
A
F
L
R
-
E
--
R
G
L
A
A
Y
K
I
P
D
-
R
V
E
------
F
V
E
S
F
P
Q
T
G
V
G
K
V
S
K
K
A
L
R
E
A
I
S
E
K
--
L
L
A
G
------
77
HHSearch
85.20
23%
-85
- C4 -
4ISB
2
?
A:
[15-532]
----------------------------------------------------------------------
S
T
V
L
D
R
V
F
E
Q
A
R
Q
Q
---
P
E
A
I
A
L
R
R
C
-----
D
---
G
-
T
S
A
-
L
R
Y
R
E
L
V
A
E
V
G
G
L
A
A
D
L
R
-
A
Q
S
V
S
R
G
S
R
V
L
V
I
S
D
N
G
P
E
T
Y
L
S
V
L
A
C
A
K
L
G
A
I
A
V
M
A
D
G
N
L
P
-
I
A
A
I
E
R
F
C
Q
I
T
D
P
A
A
A
L
V
--------
A
P
G
S
K
M
-
A
--------
S
-
S
A
V
----
P
E
A
L
H
----
S
-
I
-
P
V
I
----
A
V
D
I
--------------------------
L
D
-
A
-
A
S
L
A
G
N
A
D
Q
---
G
S
E
D
P
L
A
M
I
F
T
S
G
T
T
G
E
P
K
A
V
L
L
A
N
R
T
--
F
F
A
V
P
D
I
-
L
-
Q
-
K
E
G
-
L
NW
V
T
W
V
V
G
E
T
T
Y
S
P
L
P
A
T
H
I
----
G
G
L
W
--
W
--
I
-
L
-
T
C
L
M
H
--
G
G
L
C
V
T
------
G
G
E
-----
N
------
T
T
---
S
L
L
E
I
L
T
T
N
A
V
A
T
T
C
L
V
-
P
T
-------
L
L
S
K
L
V
S
E
L
K
S
A
-------------------------------------------------------------
N
A
T
V
-
P
S
L
R
L
V
G
Y
G
G
S
R
A
I
A
A
D
V
R
-
F
I
--
E
A
-
T
------
G
V
R
-
T
A
Q
V
Y
G
L
S
E
T
G
C
T
A
----------
L
C
L
P
T
---
D
DG
S
I
V
K
I
E
A
-
G
A
-----
V
G
R
P
Y
-
P
-----------
G
-
V
D
V
Y
L
A
----------
A
TDGIGPTAPGAGPSAS
F
------------
G
T
L
W
I
K
-----
S
-----
P
--
A
--
N
M
L
G
Y
W
N
N
P
E
R
T
A
---
E
V
L
---
I
--------
D
------------------
G
W
V
N
T
G
D
L
L
E
R
R
E
D
G
F
F
Y
I
K
G
R
S
-
E
M
I
I
C
-
G
G
V
N
I
A
P
D
E
V
D
R
I
A
E
G
V
S
G
V
R
E
A
A
C
Y
E
--
I
P
D
----
E
----
E
FG
A
L
V
--
G
L
A
V
V
A
S
A
E
---------------------------
A
A
R
A
L
K
H
T
I
A
A
R
F
----
R
R
E
S
E
P
M
A
R
P
S
-
T
I
V
------
I
V
T
D
I
P
R
T
Q
S
G
K
V
M
R
A
S
L
A
A
A
A
T
A
-------------
57
HHSearch
84.31
20%
-92
- C4 -
3ETC
11
?
A:
[57-559]
-----------------------------------------------------------------------
F
A
Y
D
V
V
D
V
Y
A
R
D
S
---
P
E
K
L
A
M
I
W
C
-----
D
-
D
Y
G
N
E
K
I
-
F
T
F
K
D
L
K
Y
Y
S
D
K
A
A
N
F
F
V
-
K
H
G
I
G
K
G
D
Y
V
M
L
T
L
K
S
R
Y
D
F
W
Y
C
M
L
G
L
H
K
L
G
A
I
A
V
P
A
T
H
M
L
K
-
T
R
D
I
V
Y
R
I
E
K
A
G
L
K
M
I
V
C
--------
I
A
E
D
D
V
P
E
--------
Q
V
D
E
A
----
H
A
E
C
G
----
D
I
P
L
K
K
A
----
K
V
G
G
D
V
L
----
E
G
W
---
I
D
F
R
K
E
-
L
E
E
S
--
S
P
I
F
-
E
R
P
T
G
E
V
S
T
---
K
N
E
D
I
C
L
V
Y
F
S
S
G
T
A
G
F
P
K
M
V
E
H
D
N
T
Y
--
P
L
G
H
I
L
T
-
A
-
K
-
Y
W
Q
-
N
----
V
E
D
D
G
L
H
Y
T
V
A
D
S
G
W
G
----
K
C
V
W
--
G
K-
L
-
Y
-
G
Q
W
I
A
--
G
C
A
V
F
V
------
Y
-
D
YDRF-
E
------
A
K
---
N
M
L
E
K
A
S
K
Y
G
V
T
T
F
C
A
P
-
P
T
-------
I
Y
R
F
L
I
K
E
D
L
-----------------------------------------------------------------
N
F
-
S
T
L
K
Y
A
V
V
A
G
E
P
L
N
P
E
V
F
N
-
R
F
--
L
E
-
F
T-----
G
I
K
-
L
M
E
G
F
G
Q
T
E
T
V
V
T
I
----------
A
T
F
P
W
---
M
-----
E
P
K
P
-
G
S
-----
I
G
K
P
T
-
P
-----------
G
-
Y
K
I
E
L
M
----------
D
RDG
R
L
C
E
V
G
E
------
E
------------
G
E
I
V
I
N
-----
T
MEGKP
V
--
G
--
L
F
V
H
Y
G
K
D
P
E
R
T
E
---
E
T
W
---
H
--------
D
------------------
G
Y
Y
H
T
G
D
M
A
W
M
D
E
D
G
Y
L
W
F
V
G
R
A
D
D
I
I
K
T
-
S
G
Y
K
V
G
P
F
E
V
E
S
A
L
I
Q
H
P
A
V
L
E
C
A
I
T
G
--
V
P
D
----
P
VRG
Q
V
----
I
--
K
A
T
I
V
L
T
K
D
Y
T
-------------------------
P
S
D
S
L
K
N
E
L
Q
D
H
V
K
----
N
V
T
A
P
Y
K
Y
P
R
-
I
I
E
F
------
V
P
E
---------------------------------
18
PsiBlast_PDB
81.89
24%
-90
- C4 -
2D1R
2
LUCI_LUCCR
A:
[52-482]
-------------------------------------------------------------------------------------------------------------
D
-
Y
S
Y
A
E
Y
L
E
K
S
C
C
L
G
K
A
L
Q
-
N
Y
G
L
V
V
D
G
R
I
A
L
C
S
E
N
C
E
E
F
F
I
P
V
I
A
G
L
F
I
G
V
G
V
A
P
T
N
E
I
Y
T
-
L
R
E
L
V
H
S
L
G
I
S
K
P
T
I
V
F
S
--------
S
K
K
G
L
D
-
K
--------
V
I
T
-
V
----
Q
K
T
V
T
----
T
I
K
-
T
I
V
ILDS
K
V
D
Y
R
G
Y
----
Q
C
L
---
D
T
F
I
K
R
---
N
T
--
P
P
-
G
-
F
Q
A
S
S
F
K
T
V
EVD
R
K
E
Q
V
A
L
I
M
N
S
S
G
S
T
G
L
P
K
G
V
Q
L
T
H
E
N
--
I
V
T
R
F
S
H
-
A
-
R
D
P
I
Y
-
G
--
N
Q
V
S
P
G
T
A
V
L
T
V
V
P
F
H
H
G
----
F
G
M
F
--
T
--
T
-
L
-
G
Y
L
I
C
G
F
R
V
V
M
L
T
------
K
-
F
-----
D
------
E
E
---
T
F
L
K
T
L
Q
D
Y
K
C
T
S
V
I
L
V
-
P
T
-------
L
F
-
A
I
L
N
K
S
E
-----------------------------------------
L
L
N
K
Y
D
L
--------------------
S
N
L
V
E
I
A
S
G
G
A
P
L
S
K
E
V
G
E
A
V
A
--
R
R
-
F
------
N
L
P
G
V
R
Q
G
Y
G
L
T
E
T
T
S
A
I
----------
I
I
T
P
E
---
G
-----
D
D
K
P
-
G
A
-----
S
G
K
V
V
-
P
-----------
L
-
F
K
A
K
V
I
----------
D
LD
T
K
K
S
L
GPN
R
-----
R
------------
G
E
V
C
V
K
-----
G
-----
P
--
M
--
L
M
K
G
Y
V
N
N
P
E
A
T
K
---
E
L
I
D--
E
--------
E
------------------
G
W
L
H
T
G
D
I
G
Y
Y
D
E
E
K
H
F
F
I
V
D
R
L
K
S
L
I
-
K
Y
K
G
Y
Q
V
P
P
A
E
L
E
S
V
L
L
Q
H
P
S
I
F
D
A
G
V
A
G
--
V
P
D
----
P
----
V
----
A
--
G
E
L
------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
81.77
24%
-93
- C4 -
2D1Q
1
LUCI_LUCCR
A:
[52-482]
-------------------------------------------------------------------------------------------------------------
D
-
Y
S
Y
A
E
Y
L
E
K
S
C
C
L
G
K
A
L
Q
-
N
Y
G
L
V
V
D
G
R
I
A
L
C
S
E
N
C
E
E
F
F
I
P
V
I
A
G
L
F
I
G
V
G
V
A
P
T
N
E
I
Y
T
-
L
R
E
L
V
H
S
L
G
I
S
K
P
T
I
V
F
S
--------
S
K
K
G
L
D
-
K
--------
V
I
T
-
V
----
Q
K
T
V
T
----
T
I
K
-
T
I
V
ILDS
K
V
D
Y
R
G
Y
----
Q
C
L
---
D
T
F
I
K
R
---
N
T
--
P
P
-
G
-
F
Q
A
S
S
F
K
T
V
EVD
R
K
E
Q
V
A
L
I
M
N
S
S
----
L
P
K
G
V
Q
L
T
H
E
N
--
I
V
T
R
F
S
H
-
A
-
R
D
P
I
Y
-
G
--
N
Q
V
S
P
G
T
A
V
L
T
V
V
P
F
H
H
G
----
F
G
M
F
--
T
--
T
-
L
-
G
Y
L
I
C
G
F
R
V
V
M
L
T
------
K
-
F
-----
D
------
E
E
---
T
F
L
K
T
L
Q
D
Y
K
C
T
S
V
I
L
V
-
P
T
-------
L
F
-
A
I
L
N
K
S
E
-----------------------------------------
L
L
N
K
Y
D
L
--------------------
S
N
L
V
E
I
A
S
G
G
A
P
L
S
K
E
V
G
E
A
V
A
--
R
R
-
F
------
N
L
P
G
V
R
Q
G
Y
G
L
T
E
T
T
S
A
I
----------
I
I
T
P
E
---
G
-----
D
D
K
P
-
G
A
-----
S
G
K
V
V
-
P
-----------
L
-
F
K
A
K
V
I
----------
D
LD
T
K
K
S
L
GPN
R
-----
R
------------
G
E
V
C
V
K
-----
G
-----
P
--
M
--
L
M
K
G
Y
V
N
N
P
E
A
T
K
---
E
L
I
D--
E
--------
E
------------------
G
W
L
H
T
G
D
I
G
Y
Y
D
E
E
K
H
F
F
I
V
D
R
L
K
S
L
I
-
K
Y
K
G
Y
Q
V
P
P
A
E
L
E
S
V
L
L
Q
H
P
S
I
F
D
A
G
V
A
G
--
V
P
D
----
P
----
V
----
A
--
G
E
L
------------------------------------------------------------------------------------------------------------
62
HHSearch
81.32
21%
-95
- C4 -
3C5E
7
ACS2A_HUMAN
A:
[53-562]
--------------------------------------------------------------------------------
A
G
K
R
---
P
P
S
P
A
L
W
W
V
-----
N
G
K
-
G
K
E
L
M
-
W
N
F
R
E
L
S
E
N
S
Q
Q
A
A
N
V
L
S
G
A
C
G
L
Q
R
G
D
R
V
A
V
V
L
P
R
V
P
E
W
W
L
V
I
L
G
C
I
R
A
G
L
I
F
M
P
G
T
I
Q
M
K
-
S
T
D
I
L
Y
R
L
Q
M
S
K
A
K
A
I
V
A
--------
G
D
E
V
I
Q
----------
E
V
D
T
V
----
A
S
E
C
P
----
S
L
R
-
I
K
L
----
L
V
S
E
K
S
C
----
D
G
W
---
L
N
F
K
----
K
L
L
--
N
E
-
A
-
S
T
T
H
H
C
V
E
T
---
G
S
Q
E
A
S
A
I
Y
F
T
S
G
T
S
G
L
P
K
M
A
E
H
S
Y
S
S
--
L
G
L
K
A
K
M
-
D
-
A
-
G
W
T
-
G
----
L
Q
A
S
D
I
M
W
T
I
S
D
T
G
W
I
----
L
N
I
L
--
C
--
S
L
M
-
E
P
W
A
L
--
G
A
C
T
F
V
H
LLP--
K
-
F
-----
D
------
P
L
---
V
I
L
K
T
L
S
S
Y
P
I
K
S
M
M
G
A
-
P
I
-------
V
Y
R
M
L
L
Q
Q
D
L
S
--------------------------------------------------------------
S
Y
K
F
-
P
H
L
Q
N
C
V
T
V
G
E
S
L
L
P
E
T
L
E
-
N
W
--
R
A
Q
T
------
G
L
D
-
I
R
E
S
Y
G
Q
T
E
T
G
L
T
C
----------
M
V
S
K
T
---
M
-----
K
I
K
P
-
G
Y
-----
M
G
T
A
A
-
S
-----------
C
-
Y
D
V
Q
I
I
----------
D
DKG
N
V
L
P
P
G
T
------
E
------------
G
D
I
G
I
R
VKP
I
R
P
-----
I
--
G
--
I
F
S
G
Y
V
D
N
P
D
K
T
A
---
A
N
I
---
R
--------
G
------------------
D
F
W
L
L
G
D
R
G
I
K
D
E
D
G
Y
F
Q
F
M
G
R
A
D
D
I
I
N
S
-
S
G
Y
R
I
G
P
S
E
V
E
N
A
L
M
E
H
P
A
V
V
E
T
A
V
I
S
--
S
P
D
----
P
VRG
E
V
----
V
--
K
A
F
V
V
L
A
S
Q
F
L
S
------
H
-----------------
D
P
E
Q
L
T
K
E
L
Q
Q
H
V
K
----
S
V
T
A
P
Y
K
Y
P
R
-
K
I
E
F
------
V
L
N
L
P
K
T
V
T
G
K
I
Q
R
A
K
L
R
D
K
E
W
K
-------------
19
PsiBlast_PDB
81.22
24%
-89
- C4 -
2D1T
3
LUCI_LUCCR
A:
[52-482]
-------------------------------------------------------------------------------------------------------------
D
-
Y
S
Y
A
E
Y
L
E
K
S
C
C
L
G
K
A
L
Q
-
N
Y
G
L
V
V
D
G
R
I
A
L
C
S
E
N
C
E
E
F
F
I
P
V
I
A
G
L
F
I
G
V
G
V
A
P
T
N
E
I
Y
T
-
L
R
E
L
V
H
S
L
G
I
S
K
P
T
I
V
F
S
--------
S
K
K
G
L
D
-
K
--------
V
I
T
-
V
----
Q
K
T
V
T
----
T
I
K
-
T
I
V
ILDS
K
V
D
Y
R
G
Y
----
Q
C
L
---
D
T
F
I
K
R
---
N
T
--
P
P
-
G
-
Y
Q
A
S
S
F
K
T
V
E
VD
R
K
E
Q
V
A
L
I
M
N
S
S
G
S
T
G
L
P
K
G
V
Q
L
T
H
E
N
--
I
V
T
R
F
S
H
-
A
-
R
D
P
I
Y
-
G
--
N
Q
V
S
P
G
T
A
V
L
T
V
V
P
F
H
H
G
----
F
G
M
F
--
T
--
T
-
L
-
G
Y
L
I
C
GF
R
V
V
M
L
T
------
K
-
F
-----
D
------
E
E
---
T
F
L
K
T
L
Q
D
Y
K
C
T
N
V
I
L
V
-
P
T
-------
L
F
-
A
I
L
N
K
S
E
-----------------------------------------
L
L
N
K
Y
D
L
--------------------
S
N
L
V
E
I
A
S
G
G
A
P
L
S
K
E
V
G
E
A
V
A
--
R
R
-
F
------
N
L
P
G
V
R
Q
G
Y
G
L
T
E
T
T
S
A
I
----------
I
I
T
P
E
---
G
-----
D
D
K
P
-
G
A
-----
S
G
K
V
V
-
P
-----------
L
-
F
K
A
K
V
I
----------
D
LDT
K
K
S
L
G
PNR-----
R
------------
G
E
V
C
V
K
-----
G
-----
P
--
M
--
L
M
K
G
Y
V
N
N
P
E
A
T
K
---
E
L
I
D--
E
--------
E
------------------
G
W
L
H
T
G
D
I
G
Y
Y
D
E
E
K
H
F
F
I
V
D
R
L
K
S
L
I
-
K
Y
K
G
Y
Q
V
P
P
A
E
L
E
S
V
L
L
Q
H
P
S
I
F
D
A
G
V
A
G
--
V
P
D
----
P
----
V
----
A
--
G
E
L
------------------------------------------------------------------------------------------------------------
83
Fugue
81.02
17%
-76
- C4 -
1PG4
7
ACSA_SALTY
A:
[5-647]
HKHAIP
A
N
I
A
D
RCLIN
P
E
Q
Y
E
T
K
Y
K
Q
S
I
N
D
P
D
T
F
W
G
E
Q
G
KILDWITPYQK
V
K
N
T
S
F
A
P
G
N
V
S
I
K
W
Y
E
D
G
T
L
N
L
A
A
N
C
L
D
R
H
L
Q
E
NGD
R
T
A
I
I
W
E
G
D
-----
D
-
T
-
S
Q
S
K
H
-
I
S
Y
R
E
L
H
R
D
V
C
R
F
A
N
T
L
L
-
D
L
G
I
K
K
G
D
V
V
A
I
Y
M
P
M
V
P
E
A
A
V
A
M
L
A
C
A
R
I
G
A
V
H
S
V
I
F
G
G
F
S
-
P
E
A
V
A
G
C
I
I
D
S
S
S
R
L
V
I
T
A
D
E
G
V
R
AG
R
S
I
P
L
K
-
K
--------
N
V
D
D
A
L
K
--
N
P
N
V
T
----
S
V
E
-
H
V
I
----
V
L
K
R
T
G
S
----
D
I
D
W
Q
E
G
R
D
L
W
W
-
R
D
L
I
--
E
K
-
A
-
S
P
E
H
Q
P
E
A
M
---
N
A
E
D
P
L
F
I
L
Y
T
S
G
S
T
G
K
P
K
G
V
L
H
T
T
G
G
--
Y
L
V
Y
A
A
T
-
T
-
F
-
K
Y
V
-
F
--
D
Y
-
H
P
G
D
I
Y
W
C
T
A
D
V
G
W
V
----
T
G
H
S
Y-
L
--
L
-
Y
-
G
P
L
A
C
--
G
A
T
T
L
M
F
EGVPN
W
-
P
-----
T
------
P
A
---
R
M
C
Q
V
V
D
K
H
Q
V
N
I
L
Y
T
A
-
P
T
-------
A
I
R
A
L
M
A
E
G
D
K
A
I
E
G
T
D
R
S
S
L
R
-----
I
L
G
S
V
-------------
G
E
P
----------
I
N
P
E
A
W
E
W
Y
W
-----
K
K
I
G
-
K
E
--------------------------------
K
C
P
-
V
V
D
T
W
-
W
Q
T
E
T
G
G
F
----------
M
I
T
P
L
PGA
I
-----
E
L
K
A
-
G
S
-----
A
T
R
P
F
-
F
-----------
G
-
V
Q
P
A
L
V
----------
D
----------------
N
EG
H
P
Q
E
G
ATE--
G
N
L
V
I
T
-----
D
-----
S
--
W
PG
Q
A
R
T
L
F
G
D
H
E
R
F
E
---
Q
T
Y
FST
F
--------
K
------------------
N
M
Y
F
S
G
D
G
A
R
R
D
E
D
G
Y
Y
W
I
T
G
R
V
D
D
-
V
L
N
V
S
G
H
R
L
G
T
A
E
I
E
S
A
L
V
A
H
P
K
I
A
E
A
A
V
V
G
--
I
P
H
----
A
----
I
----
K
--
G
Q
A
I
Y
A
Y
V
T
L
N
H
------
G
E
E
P
---------------
S
P
E
L
Y
A
E
V
R
N
W
V
R
-
K
E
I
G
P
L
A
T
P
D
V
L
H
-
W
T
D
S
L
P
----
K
T
R
S
G
K
I
M
R
R
I
L
R
K
I
A
A
G
D
A
D
P
G
V
--
V
E
K
L
L
E
E
K
Q
A
3
PsiBlast_PDB
79.30
26%
-91
- C4 -
4FUQ
7
?
A:
[4-431]
-----------------------------------------------------------------------
N
L
F
A
R
L
F
D
-
K
L
D
D
---
P
----
H
K
L
A
-----
I
-
E
-
T
A
A
G
D
K
I
S
Y
A
E
L
V
A
R
A
G
R
V
A
N
V
L
V
-
A
R
G
L
Q
V
G
D
R
V
A
A
Q
T
E
K
S
V
E
A
L
V
L
Y
L
A
T
V
R
A
G
G
V
Y
L
P
L
N
T
A
Y
T
-
L
H
E
L
D
Y
F
I
T
D
A
E
P
K
I
V
V
C
--------
D
P
-
S
K
R
-
D
--------
G
I
A
A
I
----
A
A
K
V
G
----
A
T
V
-
E
T
L
---------
G
P
----
D
G
R
---
G
S
L
T
D
A
-
A
A
G
A
--
S
E
-
A
-
F
A
T
I
D
R
G
A
------
D
D
L
A
A
I
L
Y
T
S
--
T
G
R
S
K
G
A
M
L
S
H
D
N
--
L
A
S
N
S
L
T
-
L
-
V
-
D
Y
W
-----
R
F
T
P
D
D
V
L
I
H
A
L
P
I
Y
H
T
HGLF
V
A
S
N
--
V
--
T
-
L
-
F
A
R
G
S
--
M
I
F
L
P
-------
K
-
F
-----
D
------
P
D
---
K
I
L
D
L
M
A
--
R
A
T
V
L
M
G
V
-
P
T
-------
F
Y
T
R
L
L
Q
S
P
R
L
T
K
E
T
T
G
H
M
R
L
F
I
S
G
SA
P
L
L
A
D
T
H
R
E
W
S
--
A
-----------
K
T
G
H
A
V
L
E
R
-----------------------------------------------------------
Y
G
M
T
E
T
N
M
N
T
----------
S
N
P
Y
D
---
G
-----
D
R
V
P
-
G
A
-----
V
G
P
A
L
-
P
-----------
G
-
V
S
A
R
V
T
----------
D
----------------
P
ETGKELPRGDI-
G
M
I
E
V
K
-----
G
-----
P
--
N
--
V
F
K
G
Y
W
R
M
P
E
K
T
K
---
S
E
F
R--
D
--------
D
------------------
G
F
F
I
T
G
D
L
G
K
I
D
E
R
G
Y
V
H
I
L
G
R
G
K
D
L
V
I
T
-
G
G
F
N
V
Y
P
K
E
I
E
S
E
I
D
A
M
P
G
V
V
E
S
A
V
I
G
-------------------------------------------------------------------------------------------------------------------------------------
78
HHSearch
79.23
20%
-82
- C4 -
4IZ6
2
ENTE_ECOLI
A:
[45-557]
----------------------------------------------------------------------
L
P
L
T
D
I
L
T
R
H
A
A
-----
S
D
S
I
A
V
I
D
G
-----
E
------
R
Q
-
L
S
Y
R
E
L
N
Q
A
A
D
N
L
A
C
S
L
R
-
R
Q
G
I
K
P
G
E
T
A
L
V
Q
L
G
N
V
A
E
L
Y
I
T
F
F
A
L
L
K
L
G
V
A
P
V
L
A
L
F
S
H
Q
-
R
S
E
L
N
A
Y
A
S
Q
I
E
P
A
L
L
I
A
--------
D
R
Q
H
A
L
-
F
--------
S
G
D
D
F
----
L
N
T
F
V
T
E
H
S
S
I
R
-
V
V
Q
----
L
L
N
D
-------
S
G
E
---
H
N
L
Q
D
A
----
I
--
N
H
-
P
-
A
E
D
F
T
A
T
P
S
---
P
A
D
E
V
A
Y
F
Q
L
S
G
G
-
T
G
T
P
K
L
I
P
R
T
H
N
D
--
Y
Y
Y
S
V
R
R
-
S
-
V
-
E
I
C
-
Q
----
F
T
Q
Q
T
R
Y
L
C
A
I
P
A
A
H
N
----
Y
A
M
S
--
S
PG
S
-
L
-
G
V
F
L
A
--
G
G
T
V
V
L
------
A
-
A
DP---
S
------
A
T
---
L
C
F
P
L
I
E
K
H
Q
V
N
V
T
A
L
V
-
P
P
-------
A
V
S
L
W
L
Q
A
L
I
E
G
E
------------------------------------------------------
S
-----
R
A
Q
L
-
A
S
L
K
L
L
Q
V
G
G
A
R
L
S
A
T
L
A
A
-
R
I
--
P
A
E
I
------
G
C
Q
-
L
Q
Q
V
F
G
M
A
E
G
L
V
N
Y
----------
T
R
L
D
D
S--
A
-----
E
K
I
I
-
H
T
-----
Q
G
Y
P
M
C
P
-----------
D
-
D
E
V
W
V
A
----------
D
AEG
N
P
L
P
QG
E
------
V
------------
G
R
L
M
T
R
-----
G
-----
P
--
Y
--
T
F
R
G
Y
Y
K
S
P
Q
H
N
A
---
S
A
F
D--
A
--------
N
------------------
G
F
Y
C
S
G
D
L
I
S
I
D
P
E
G
Y
I
T
V
Q
G
R
E
K
D
Q
I
N
R
-
G
G
E
K
I
A
A
E
E
I
E
N
L
L
L
R
H
P
A
V
I
Y
A
A
L
V
S
--
M
E
D
----
E
LMG
E
K
----
S
--
C
A
Y
L
V
V
K
E
P
L
------------------------------
R
A
V
Q
V
R
R
F
L
R
-
E
--
Q
G
I
A
E
F
K
L
P
D
-
R
V
E
------
C
V
D
S
L
P
L
T
A
V
G
K
V
D
K
K
Q
L
R
Q
W
L
A
S
R
------------
6
PsiBlast_PDB
79.16
27%
-89
- C4 -
1ULT
1
LCFCS_THET8
A:
[36-471]
-------------------------------------------------------------------------------------------
V
V
S
R
L
-----
H
-
T
-
G
E
V
H
R
-
T
T
Y
A
E
V
Y
Q
R
A
R
R
L
M
G
G
L
R
-
A
L
G
V
G
V
G
D
R
V
A
T
L
G
F
N
H
F
R
H
L
E
A
Y
F
A
V
P
G
M
G
A
V
L
H
T
A
N
P
R
L
S
-
P
K
E
I
A
Y
I
L
N
H
A
E
D
K
V
L
L
F
--------
D
P
N
L
-
L
-
P
--------
L
V
E
A
I
----
R
G
E
L
K
----
T
V
Q
-
H
F
V
----
V
M
D
E
K
A
P
----
E
G
Y
---
L
A
Y
E
E
A
L
G
E
E
A
--
D
P
-
V
-
R
V
P
E
R
A
A
C
----------
G
M
A
Y
T
T
G
T
T
G
L
P
K
G
V
V
Y
S
H
R
A
--
L
V
L
H
S
L
A
-
A
-
S
-
L
V
D
-
G
--
T
A
L
S
E
K
D
V
V
L
P
V
V
P
M
F
H
V
----
N
A
W
C
--
L
--
P
-
Y
-
A
A
------
T
L
V
G
----------------------
A
K
---
Q
V
L
P
G
-------------
P
R
-------
L
-----
D
P
A
S
L
V
E
L
F
D
G
E
G
V
T
F
-----
T
A
G
V
P
T
V
--
W
L
--
A
L
A
D
-----
Y
L
E
S
T
G
H
R
L
------
K
T
L
R
-------------
R
L
V
V
G
G
S
A
A
P
R
S
L
I
A
R
-
F
E
--
R
--
M
------
G
V
E
-
V
R
Q
G
Y
G
L
T
E
T
S
P
V
V
V
Q
N
F
V
K
SHLE
S
L
S
E
E
---
E
-----
K
L
T
L
K
A
K
-----
T
G
L
P
I
-
P
-----------
L
-
V
R
L
R
V
A
----------
D
----------------
E
EGRPVPKDGK
A
L
G
E
V
Q
L
K
-----
G
-----
P
--
W
--
I
T
G
G
Y
Y
G
N
E
E
A
T
R
---
S
A
L
---
T
P-------
D
------------------
G
F
F
R
T
G
D
I
A
V
W
D
E
E
G
Y
V
E
I
K
D
R
L
K
D
L
I
-
K
S
G
G
E
W
I
S
S
V
D
L
E
N
A
L
M
G
H
P
K
V
K
E
A
A
V
V
A
--
I
P
H
----
P
---------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
78.36
23%
-98
- C4 -
4WV3
1
?
A:
[35-465]
-------------------------------------------------------------------------------------------------------------
E
-
M
T
F
R
Q
V
S
N
E
A
N
Q
V
G
N
A
L
K
-
G
L
G
V
R
F
G
E
C
V
G
L
L
T
L
D
S
A
E
W
V
T
S
F
F
G
I
V
K
L
G
A
I
A
V
G
I
N
T
L
L
K
-
P
P
E
Y
E
Y
I
L
R
D
C
R
A
R
V
L
I
V
--------
H
Q
E
-
F
L
-
P
--------
L
I
E
S
I
----
R
G
N
L
P
----
M
L
E
-
H
I
V
----
V
I
-
G
--------------
G
Y
L
S
F
-
N
D
W
I
--
R
P
-
Q
-
P
T
T
L
E
A
A
Q
S
---
H
R
E
D
I
C
S
L
N
Y
S
S
G
-
T
G
G
P
K
G
I
P
H
A
H
K
D
Y
P
L
T
A
Q
L
W
G
-
V
-
N
-
V
L
G
------
L
R
E
S
D
R
T
F
A
L
A
K
L
F
F
T
----
F
G
T
G
G
N
L
--
I
-
F
-
P
W
Y
V
G
--
A
S
C
V
L
F
------
P
-
G
-----
A
------
A
R
V
A
S
N
V
L
S
T
I
S
R
F
K
P
T
I
F
Y
N
A
-
P
T
-------
G
Y
A
--------------------------
A
A
L
A
L
K
D
F
S
--
Q
--------------
H
D
L
--------------------
S
S
L
R
L
C
V
S
A
S
E
A
L
P
A
A
L
W
Y
-
A
W
--
K
E
-
A
T-----
G
V
D
-
I
I
D
G
I
G
C
T
E
N
F
H
I
F
----------
I
S
N
R
P
---
G
-----
D
I
R
P
-
G
S
-----
S
G
K
P
V
-
E
-----------
G
-
Y
E
L
K
L
V
----------
D
----------------
D
EGKTVPAG
E
I
--
G
N
V
L
L
R
-----
S
-----
E
--
T
--
A
A
L
S
Y
W
H
N
F
E
K
S
R
---
Q
T
F
---
Q
--------
G
------------------
E
W
L
A
T
G
D
K
Y
F
V
D
A
D
G
Y
Y
W
H
A
G
R
S
D
D
M
L
-
K
V
G
G
I
W
V
S
P
V
E
V
E
S
T
L
I
Q
H
P
A
V
Q
E
C
A
V
I
G
C
P
D
Q
S
----
R
----
L
----
I
K
P
K
A
F
I
I
L
K
P
E
------------------------------------------------------------------------------------------------------
70
HHSearch
77.93
21%
-91
- C4 -
2VSQ
2
A:
[464-979]
----------------------------------------------------------------------
K
P
L
T
Y
W
F
K
E
A
V
N
A
N
---
P
D
A
P
A
L
T
Y
S
-----
G
------
Q
T
-
L
S
Y
R
E
L
D
E
E
A
N
R
I
A
R
R
L
Q
-
K
H
G
A
G
K
G
S
V
V
A
L
Y
T
K
R
S
L
E
L
V
I
G
I
L
G
V
L
K
A
G
A
A
Y
L
P
V
D
P
K
L
P
-
E
D
R
I
S
Y
M
L
A
D
S
A
A
A
C
L
L
T
--------
H
Q
E
M
K
E
----------
Q
A
A
E
--------
L
P
----
Y
T
G
-
T
T
L
----
F
I
D
D
Q
------
T
R
F
---
E
---------------
E
-
Q
A
S
D
P
A
T
A
I
---
D
P
N
D
P
A
Y
I
M
Y
T
S
G
T
T
G
K
P
K
G
N
I
T
T
H
A
N
--
I
Q
G
L
V
K
H
-
V
-
D
--
Y
M
-
A
----
F
S
D
Q
D
T
F
L
S
V
S
N
Y
A
F
D
----
A
F
T
F
--
D
--
F
-
Y
-
A
S
M
L
N
--
A
A
R
L
I
I
------
A
-
D
EHTLL
D
------
T
E
---
R
L
T
D
L
I
L
Q
E
N
V
N
V
M
F
A
T
-
T
A
-------
L
F
N
L
L
T
D
A
G
E
----------------------------------------------------------------
D
W
M
-
K
G
L
R
C
I
L
F
G
G
E
R
A
S
V
P
H
V
R
-
K
A
--
L
R
-
I
M
G----
P
G
K
-
L
I
N
C
Y
G
P
T
E
G
T
V
F
A
----------
T
A
H
V
V
---
H
D
LPD-
S
I
S
S
-
L
P
-----
I
G
K
P
I
-
S
-----------
N
-
A
S
V
Y
I
L
----------
N
EQSQLQPFGA------
V
------------
G
E
L
C
I
S
-----
G
-----
M
--
G
--
V
S
K
G
Y
V
N
R
A
D
L
T
K
---
E
K
F
I--
E
NPFKPG--
E
------------------
T
L
Y
R
T
G
D
L
A
R
W
L
P
D
G
T
I
E
Y
A
G
R
I
D
D
Q
V
K
I
-
R
G
H
R
I
E
L
E
E
I
E
K
Q
L
Q
E
Y
P
G
V
K
D
A
V
V
V
A
--
D
R
H
ESGD
A
----
S
----
I
--
N
A
Y
L
V
N
R
T
Q
L
------------------------------
S
A
E
D
V
K
A
H
L
----
K
K
Q
L
P
A
Y
M
V
P
Q
-
T
F
T
F
------
L
D
E
L
P
L
T
T
N
G
K
V
N
K
R
L
L
P
K
P
D
Q
D
Q
--
L
---------
68
HHSearch
77.07
22%
-86
- C4 -
4ZXH
-
?
A:
[482-966]
-----------------------------------------------------------------------
D
L
F
A
M
I
L
K
Q
I
D
E
R
---
G
D
N
H
A
L
T
S
-------------
H
T
-
V
S
Y
R
E
L
G
Q
H
I
A
G
I
A
E
Y
L
R
-
A
H
G
I
T
Q
G
D
R
V
G
L
M
L
D
R
T
A
L
L
P
A
A
I
L
G
I
W
A
A
G
A
A
Y
V
P
L
D
P
N
F
P
-
T
E
R
L
Q
N
I
I
E
D
A
E
P
K
V
I
L
T
--------
Q
T
E
L
M
D
----------
G
L
N
V
-------
S
V
---------
P
R
L
----
D
I
N
Q
------------------
A
-
G
V
-------
V
-
A
L
E
Q
V
R
E
T
L
---
A
F
G
D
I
A
Y
V
M
Y
T
S
----
K
P
K
G
V
R
I
G
H
P
S
--
I
I
N
F
L
L
S
-
M
-
N
-
D
R
L
-
Q
----
V
T
T
E
T
Q
L
L
A
I
T
T
Y
A
F
D
----
I
S
I
L
--
E
--
L
-
L
-
I
P
L
M
Y
--
G
G
V
V
H
V
------
C
-
P
R
E
V
S
Q
D
------
G
I
---
Q
L
V
D
Y
L
N
A
K
S
I
N
V
L
Q
A
T
-
P
A
-------
T
W
K
M
L
L
D
S
E
W
S
-----------------------------------------------------------------
G
-
N
A
G
L
T
A
L
C
G
G
E
A
L
D
T
I
L
A
E
-
K
L
--
L
G
-
K
------
V
G
C
-
L
W
N
V
Y
G
P
T
E
T
T
V
W
S
----------
S
A
A
R
I
---
T
-----
D
A
K
Y
-
I
D
-----
L
G
E
P
L
-
A
-----------
N
-
T
Q
L
Y
V
L
----------
D
EQQRLVPPG
V
------
M
------------
G
E
L
W
I
G
-----
G
-----
D
--
G
--
L
A
V
D
Y
W
Q
R
P
E
L
T
D
---
A
Q
F
---
R
TLPSLPNA
G
------------------
R
L
Y
R
T
G
D
K
V
C
L
R
T
D
G
R
L
T
H
H
G
R
L
D
F
Q
V
K
I
-
R
G
F
R
I
E
L
G
E
I
E
N
V
L
K
Q
I
D
G
I
T
D
A
V
V
L
V
--
K
T
T
GDN
D
Q
----
K
----
L
--
V
A
Y
V
T
G
Q
E
L
-------------------------------
D
I
A
G
L
K
K
N
L
----
Q
I
H
L
P
A
Y
M
V
P
S
-
A
F
I
------
R
L
D
E
F
P
M
T
A
N
K
K
L
D
R
K
A
F
P
E
P
I
F
E
-------------
59
HHSearch
76.27
21%
-85
- C4 -
4WD1
19
?
A:
[90-630]
---------------------------------------------------------------------
T
L
N
Y
A
E
H
A
L
R
A
A
G
T
R
---
P
D
E
P
A
L
L
Y
V
-----
D
-
E
T
H
E
P
A
P
-
V
T
W
A
E
L
R
R
Q
V
A
S
L
A
A
E
L
R
-
A
L
G
V
R
P
G
D
R
V
S
G
Y
L
P
N
I
P
Q
A
V
V
A
L
L
A
T
A
A
V
G
G
V
W
T
S
C
A
P
D
F
G
-
A
R
S
V
L
D
R
F
Q
Q
V
E
P
V
V
L
F
T
--------
V
D
G
Y
R
Y
-
G
G
K
E
H
D
R
R
D
T
V
A
E
L
----
R
R
E
L
P
----
T
L
R
-
A
V
I
----
H
I
P
L
L
G
T
----
E
A
P
---
D
G
T
L
D
W
-
E
T
-
L
--
T
A
-
A
-
D
A
E
P
V
Y
E
Q
V
---
P
F
D
H
P
L
W
V
L
Y
S
S
G
T
T
G
L
P
K
A
I
V
Q
S
Q
G
G
--
I
L
V
E
H
L
K
Q
L
-
G
-
L
H
C
-
D
----
L
G
P
G
D
R
F
F
W
Y
T
S
T
G
W
M
----
M
W
N
F
-----
L
-
V
-
S
G
L
L
T
--
G
T
T
I
V
L
------
Y
-
D
-----
G
SPGFPA
T
D
---
A
Q
W
R
I
A
E
R
T
G
A
T
L
F
G
T
S
-
A
A
-------
Y
V
M
A
C
R
K
A
G
V
H
P
------------------------------------------------------
A
R
-----
D
L
D
L
-
S
A
I
Q
C
V
A
T
T
G
S
P
L
P
P
D
G
F
R
-
W
L
--
H
D
-
E
F
A
A
G
G
A
D
L
W
-
I
A
S
V
S
G
G
T
D
V
C
S
C
F
----------
A
G
A
V
P
T--
L
-----
P
V
H
I
-
G
E
-----
L
Q
A
P
G
-
L
-----------
G
-
T
D
L
Q
S
W
----------
D
PSG
D
P
L
T
D
E
-------
V
------------
G
E
L
V
V
T
-----
N
-----
P
MP
S
--
M
P
I
R
F
W
N
D
P
D
G
S
R
Y
H
D
S
Y
F
DT-
Y
--------
P
------------------
G
V
W
R
H
G
D
W
I
T
L
T
S
R
G
S
V
V
I
H
G
R
S
D
S
T
L
N
R
---
V
R
M
G
S
A
D
I
Y
E
A
V
E
R
L
P
E
I
R
E
S
L
V
I
G
--
I
E
------Y---
W
----
M
--
P
L
F
V
H
L
A
P
G
A
T
L
-------------------------
D
D
A
L
L
D
R
I
K
R
T
I
R
----
V
N
L
S
P
R
H
V
P
D
-
E
V
I
E
------
V
P
G
I
P
H
T
L
T
G
K
R
I
E
V
P
V
K
R
L
L
Q
G
T
------------
79
HHSearch
75.99
22%
-90
- C4 -
2V7B
1
?
A:
[22-463]
---------------------------------------------------------------------
L
F
N
F
A
A
Y
L
F
R
L
N
E
T
R
---
A
G
K
T
A
Y
I
D
D
-----
T
------
G
S
-
T
T
Y
G
E
L
E
E
R
A
R
R
F
A
S
A
L
R
-
T
L
G
V
H
P
E
E
R
I
L
L
V
M
L
D
T
V
A
L
P
V
A
F
L
G
A
L
Y
A
G
V
V
P
V
V
A
N
T
L
L
T
-
P
A
D
Y
V
Y
M
L
T
H
S
H
A
R
A
V
I
A
--------
S
G
A
L
V
Q
----------
N
V
T
Q
A
----
L
E
S
A
------
G
C
-
Q
L
I
----
V
S
Q
P
---------
L
---
A
P
L
--
F
-
E
E
L
I
--
D
A
-
A
-
A
P
A
A
K
A
A
A
T
---
G
C
D
D
I
A
F
W
L
Y
S
-----
K
P
K
G
T
V
H
T
H
A
N
--
L
Y
W
T
A
E
L
-
Y
-
A
-
K
P
I
-
L
---
G
I
A
E
N
D
V
V
F
S
A
A
K
L
F
F
A
----
Y
G
L
G
--
N
--
G
-
L
T
F
P
L
S
V
--
G
A
T
A
I
L
------
M
-
A
ERP--
T
------
A
D
---
A
I
F
A
R
L
V
E
H
R
P
T
V
F
Y
G
V
-
P
T
-------
L
Y
A
N
M
L
V
S
P
N
L
--------------------------------------------------------
P
-----
A
R
A
D
-
V
A
I
R
I
C
T
S
A
G
E
A
L
P
R
E
I
G
E
-
R
F
--
T
A
H
F
------
G
C
E
-
I
L
D
G
I
G
S
T
E
M
L
H
I
F
----------
L
S
N
R
A
---
G
-----
A
V
E
Y
-
G
T
-----
T
G
R
P
V
-
P
-----------
G
-
Y
E
I
E
L
R
----------
D
EAGHAVPDG
E
------
V
------------
G
D
L
Y
I
K
-----
G
-----
P
--
S
--
A
A
V
M
Y
W
N
N
R
E
K
S
R
---
A
T
F
---
L
--------
G
------------------
E
W
I
R
S
G
D
K
Y
C
R
L
P
N
G
C
Y
V
Y
A
G
R
S
D
D
M
L
K
-----
Y
V
S
P
V
E
V
E
M
V
L
V
Q
H
D
A
V
L
E
A
A
V
V
G
--
V
D
---------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
36.89
38%
-25
- C4 -
3RIX
1
LUCI_PHOPY
A:
[308-435]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
L
H
E
I
A
S
G
G
A
P
L
S
K
E
V
G
E
-
A
V
A
K
R
F
-
H
------
L
P
G
-
I
R
Q
G
Y
G
L
T
E
T
T
S
A
I
----------
L
I
T
P
E
---
G
-----
D
D
K
P
-
G
A
-----
V
G
K
V
V
-
P
F
F
E
A
K
V
V
D
LDT
G
-
K
T
L
G
V
N
----------
Q
----------------
R
------------
G
E
L
C
V
R
-----
G
-----
P
--
M
--
I
M
S
G
Y
V
N
N
P
E
A
T
N
---
A
L
I
D--
K
--------
D
------------------
G
W
L
H
S
G
D
I
A
Y
W
D
E
D
E
H
F
F
I
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------