@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 : bsu01660: (2016-06-03 )
MRPVFPLILSAVLFLSCFFGARQTEASASKRAIDANQIVNRMSLDEKLGQMLMPDFRNWQKEGESSPQALTKMNDEVASLVKKYQFGGIILFAENVKTTKQTVQLTDDYQKASPKIPLMLSIDQEGGIVTRLGEGTNFPGNMALGAARSRINAYQTGSIIGKELSALGINTDFSPVVDINNNPDNPVIGVRSFSSNRELTSRLGLYTMKGLQRQDIASALKHFPGHGDTDVDSHYGLPLVSHGQERLREVELYPFQKAIDAGADMVMTAHVQFPAFDDTTYKSKLDGSDILVPATLSKKVMTGLLRQEMGFNGVIVTDALNMKAIADHFGQEEAVVMAVKAGVDIALMPASVTSLKEEQKFARVIQALKEAVKNGDIPEQQINNSVERIISLKIKRGMYPARNSDSTKEKIAKAKKIVGSKQHLKAEKKLAEKAVTVLKNEQHTLPFKPKKGSRILIVAPYEEQTASIEQTIHDLIKRKKIKPVSLSKMNFASQVFKTEHEKQVKEADYIITGSYVVKNDPVVNDGVIDDTISDSSKWATVFPRAVMKAALQHNKPFVLMSLRNPYDAANFEEAKALIAVYGFKGYANGRYLQPNIPAGVMAIFGQAKPKGTLPVDIPSVTKPGNTLYPLGYGLNIKTGRPL
Atome Classification :
(25 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------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MR
P
V
F
P
L
I
L
S
A
V
L
F
L
S
C
F
FGARQTEASASKRAI
D
A
N
Q
I
V
N
R
M
S
L
D
E
K
L
G
Q
M
L
M
P
D
F
R
N
W
Q
K
EGESS
P
Q
A
L
T
K
M
N
D
E
V
A
S
L
V
K
K
YQFG
G
I
I
L
F
AENVK------TT
K
Q
T
V
Q
LT
D
D
Y
Q--K----AS-------P----KI
P
L
M
L
S
IDQEG
G
I
V
T
RL-G-E-G-TN-FPGN
M
A
L
G
A
A
R
S
R
I
N
-AYQT-------
G
S
I
I
G
K
E
L
S
A
LGINTDF
S
P
V
V
DINNNPDN
P
V
I
G
V
R
SFSS
N
R
E
L
T
S
RL
G
L
Y
T
MKGL
Q
R
---------
Q
------
D
I
A
S
A
L
K
HFPGHGDTDVDSHYGL
P
L
V
S
H
G
Q
E
R
L
R
EVELY
P
F
Q
K
A
I
DAG----A----
D
M
V
M
T
A
H
VQFPAFDDTTYKSKLDGS
D
I
L
VP
A
T
L
S
K
K
V
M
T
G
L
L
R
Q
E
MG-FN
G
V
I
V
TDAL
N
M
K
A
I
A
D
HF--GQE
E
A
V
V
M
A
V
KAG
V
D
I
A
LMPA
S
V
T
S
L
K
E
E
Q
K
F
A
R
V
I
Q
A
L
K
E
A
V
KNGDI
P
E
Q
Q
I
N
N
S
V
E
R
I
I
S
L
K
I
KRGMYPARNSD
S
T
K
E
K
I
A
K
A
K
K
I
VG
S
K
Q
H
L
K
A
E
K
K
L
A
E
K
A
V
T
V
L
KNEQHTLPFKPKKG
S
R
I
L
I
VAPY
E
E
Q
T
----
A
S
--------
I
E
----------------
Q
T
I
H
-
D
L
I
K
RKKIKPVS
L
----
S
K
M
N
F
---------------------
A
S
Q
V
F
K
T
E
H
---
E
K
Q
VKEA
D
Y
I
I
TG
S
Y
V
VKNDPVVNDGVIDDTISDSS
K
W
A
--
T
V
F
P
R
A
V
M
K
A
A
L
QHNK
P
F
V
L
M
S-L-RNPYDAA
N
F
-
E
-
E
A
K
A
L
I
A
V
YGFK--GYANG
R
Y
LQPNI
P
A
G
V
M
A
I
FGQ------AKPKGTLPVDIPSVTK---------P-----------------------------G
N
T
L
Y
PLG
Y
G
L
NIKTGRPL------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
99.23
99%
-80
- C1 -
4GYK
1
NAGZ_BACSU
A:
[31-646]
--------------------------
S
A
S
K
R
A
I
D
A
N
Q
I
V
N
R
M
S
L
D
E
K
L
G
Q
M
L
M
P
D
F
R
N
W
Q
K
E
G
E
S
S
P
Q
A
L
T
K
M
N
D
E
V
A
S
L
V
K
K
Y
Q
F
G
G
I
I
L
F
A
E
N
V
K
------
T
T
K
Q
T
V
Q
L
T
D
D
Y
Q
--
K
----
A
S
-------
P
----
K
I
P
L
M
L
S
I
D
Q
E
G
G
I
V
T
R
L
-
G
-
E
-
G
-
T
N
-
F
P
G
N
M
A
L
G
A
A
R
S
R
I
N
-
A
Y
Q
T
-------
G
S
I
I
G
K
E
L
S
A
L
G
I
N
T
D
F
S
P
V
V
D
I
N
N
N
P
D
N
P
V
I
G
V
R
S
F
S
S
N
R
E
L
T
S
R
L
G
L
Y
T
M
K
G
L
Q
R
---------
Q
------
D
I
A
S
A
L
K
H
F
P
G
H
G
D
T
D
V
D
S
H
Y
G
L
P
L
V
S
H
G
Q
E
R
L
R
E
V
E
L
Y
P
F
Q
K
A
I
D
A
G
----
A
----
D
M
V
M
T
A
H
V
Q
F
P
A
F
D
D
T
T
Y
K
S
K
L
D
G
S
D
I
L
V
P
A
T
L
S
K
K
V
M
T
G
L
L
R
Q
E
M
G
-
F
N
G
V
I
V
T
N
A
L
N
M
K
A
I
A
D
H
F
--
G
Q
E
E
A
V
V
M
A
V
K
A
G
V
D
I
A
L
M
P
A
S
V
T
S
L
K
E
E
Q
K
F
A
R
V
I
Q
A
L
K
E
A
V
K
N
G
D
I
P
E
Q
Q
I
N
N
S
V
E
R
I
I
S
L
K
I
K
R
G
M
Y
P
A
R
N
S
D
S
T
K
E
K
I
A
K
A
K
K
I
V
G
S
K
Q
H
L
K
A
E
K
K
L
A
E
K
A
V
T
V
L
K
N
E
Q
H
T
L
P
F
K
P
K
K
G
S
R
I
L
I
V
A
P
Y
E
E
Q
T
----
A
S
--------
I
E
----------------
Q
T
I
H
-
D
L
I
K
R
K
K
I
K
P
V
S
L
----
S
K
M
N
F
---------------------
A
S
Q
V
F
K
T
E
H
---
E
K
Q
V
K
E
A
D
Y
I
I
T
G
S
Y
V
V
K
N
D
P
V
V
N
D
G
V
I
D
D
T
I
S
D
S
S
K
W
A
--
T
V
F
P
R
A
V
M
K
A
A
L
Q
H
N
K
P
F
V
L
M
S
-
L
-
R
N
P
Y
D
A
A
N
F
-
E
-
E
A
K
A
L
I
A
V
Y
G
F
K
--
G
Y
A
N
G
R
Y
L
Q
P
N
I
P
A
G
V
M
A
I
F
G
Q
------
A
K
P
K
G
T
L
P
V
D
I
P
S
V
T
K
---------
P
-----------------------------
G
N
T
L
Y
P
L
G
Y
G
L
N
I
K
T
G
R
P
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
98.89
99%
-81
- C1 -
4GYK
1
NAGZ_BACSU
B:
[38-646]
---------------------------------
D
A
N
Q
I
V
N
R
M
S
L
D
E
K
L
G
Q
M
L
M
P
D
F
R
N
W
Q
K
E
G
E
S
S
P
Q
A
L
T
K
M
N
D
E
V
A
S
L
V
K
K
Y
Q
F
G
G
I
I
L
F
A
E
N
V
K
------
T
T
K
Q
T
V
Q
L
T
D
D
Y
Q
--
K
----
A
S
-------
P
----
K
I
P
L
M
L
S
I
D
Q
E
G
G
I
V
T
R
L
-
G
-
E
-
G
-
T
N
-
F
P
G
N
M
A
L
G
A
A
R
S
R
I
N
-
A
Y
Q
T
-------
G
S
I
I
G
K
E
L
S
A
L
G
I
N
T
D
F
S
P
V
V
D
I
N
N
N
P
D
N
P
V
I
G
V
R
S
F
S
S
N
R
E
L
T
S
R
L
G
L
Y
T
M
K
G
L
Q
R
---------
Q
------
D
I
A
S
A
L
K
H
F
P
G
H
G
D
T
D
V
D
S
H
Y
G
L
P
L
V
S
H
G
Q
E
R
L
R
E
V
E
L
Y
P
F
Q
K
A
I
D
A
G
----
A
----
D
M
V
M
T
A
H
V
Q
F
P
A
F
D
D
T
T
Y
K
S
K
L
D
G
S
D
I
L
V
P
A
T
L
S
K
K
V
M
T
G
L
L
R
Q
E
M
G
-
F
N
G
V
I
V
T
N
A
L
N
M
K
A
I
A
D
H
F
--
G
Q
E
E
A
V
V
M
A
V
K
A
G
V
D
I
A
L
M
P
A
S
V
T
S
L
K
E
E
Q
K
F
A
R
V
I
Q
A
L
K
E
A
V
K
N
G
D
I
P
E
Q
Q
I
N
N
S
V
E
R
I
I
S
L
K
I
K
R
G
M
Y
P
A
R
N
S
D
S
T
K
E
K
I
A
K
A
K
K
I
V
G
S
K
Q
H
L
K
A
E
K
K
L
A
E
K
A
V
T
V
L
K
N
E
Q
H
T
L
P
F
K
P
K
K
G
S
R
I
L
I
V
A
P
Y
E
E
Q
T
----
A
S
--------
I
E
----------------
Q
T
I
H
-
D
L
I
K
R
K
K
I
K
P
V
S
L
----
S
K
M
N
F
---------------------
A
S
Q
V
F
K
T
E
H
---
E
K
Q
V
K
E
A
D
Y
I
I
T
G
S
Y
V
V
K
N
D
P
V
V
N
D
G
V
I
D
D
T
I
S
D
S
S
K
W
A
--
T
V
F
P
R
A
V
M
K
A
A
L
Q
H
N
K
P
F
V
L
M
S
-
L
-
R
N
P
Y
D
A
A
N
F
-
E
-
E
A
K
A
L
I
A
V
Y
G
F
K
--
G
Y
A
N
G
R
Y
L
Q
P
N
I
P
A
G
V
M
A
I
F
G
Q
------
A
K
P
K
G
T
L
P
V
D
I
P
S
V
T
K
---------
P
-----------------------------
G
N
T
L
Y
P
L
G
Y
G
L
N
I
K
T
G
R
P
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
52
Fugue
98.61
100%
-76
- C1 -
3BMX
7
NAGZ_BACSU
A:
[26-642]
-------------------------
A
S
A
S
K
R
A
I
D
A
N
Q
I
V
N
R
M
S
L
D
E
K
L
G
Q
M
L
M
P
D
F
R
N
W
Q
K
E
G
E
S
S
P
Q
A
L
T
K
M
N
D
E
V
A
S
L
V
K
K
Y
Q
F
G
G
I
I
L
F
A
E
N
V
K
------
T
T
K
Q
T
V
Q
L
T
D
D
Y
Q
--
K
----
A
S
-------
P
----
K
I
P
L
M
L
S
I
D
Q
E
G
G
I
V
T
R
L
-
G
-
E
-
G
-
T
N
-
F
P
G
N
M
A
L
G
A
A
R
S
R
I
N
-
A
Y
Q
T
-------
G
S
I
I
G
K
E
L
S
A
L
G
I
N
T
D
F
S
P
V
V
D
I
N
N
N
P
D
N
P
V
I
G
V
R
S
F
S
S
N
R
E
L
T
S
R
L
G
L
Y
T
M
K
G
L
Q
R
---------
Q
------
D
I
A
S
A
L
K
H
F
P
G
H
G
D
T
D
V
D
S
H
Y
G
L
P
L
V
S
H
G
Q
E
R
L
R
E
V
E
L
Y
P
F
Q
K
A
I
D
A
G
----
A
----
D
M
V
M
T
A
H
V
Q
F
P
A
F
D
D
T
T
Y
K
S
K
L
D
G
S
D
I
L
V
P
A
T
L
S
K
K
V
M
T
G
L
L
R
Q
E
M
G
-
F
N
G
V
I
V
T
D
A
L
N
M
K
A
I
A
D
H
F
--
G
Q
E
E
A
V
V
M
A
V
K
A
G
V
D
I
A
L
M
P
A
S
V
T
S
L
K
E
E
Q
K
F
A
R
V
I
Q
A
L
K
E
A
V
K
N
G
D
I
P
E
Q
Q
I
N
N
S
V
E
R
I
I
S
L
K
I
K
R
G
M
Y
P
A
R
N
S
D
S
T
K
E
K
I
A
K
A
K
K
I
V
G
S
K
Q
H
L
K
A
E
K
K
L
A
E
K
A
V
T
V
L
K
N
E
Q
H
T
L
P
F
K
P
K
K
G
S
R
I
L
I
V
A
P
Y
E
E
Q
T
----
A
S
--------
I
E
----------------
Q
T
I
H
-
D
L
I
K
R
K
K
I
K
P
V
S
L
----
S
K
M
N
F
---------------------
A
S
Q
V
F
K
T
E
H
---
E
K
Q
V
K
E
A
D
Y
I
I
T
G
S
Y
V
V
K
N
D
P
V
V
N
D
G
V
I
D
D
T
I
S
D
S
S
K
W
A
--
T
V
F
P
R
A
V
M
K
A
A
L
Q
H
N
K
P
F
V
L
M
S
-
L
-
R
N
P
Y
D
A
A
N
F
-
E
-
E
A
K
A
L
I
A
V
Y
G
F
K
--
G
Y
A
N
G
R
Y
L
Q
P
N
I
P
A
G
V
M
A
I
F
G
Q
------
A
K
P
K
G
T
L
P
V
D
I
P
S
V
T
K
---------
P
-----------------------------
G
N
T
L
Y
P
L
G
Y
G
L
N
I
K
T
G
R
P
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
98.61
100%
-75
- C1 -
3BMX
8
NAGZ_BACSU
B:
[26-642]
-------------------------
A
S
A
S
K
R
A
I
D
A
N
Q
I
V
N
R
M
S
L
D
E
K
L
G
Q
M
L
M
P
D
F
R
N
W
Q
K
E
G
E
S
S
P
Q
A
L
T
K
M
N
D
E
V
A
S
L
V
K
K
Y
Q
F
G
G
I
I
L
F
A
E
N
V
K
------
T
T
K
Q
T
V
Q
L
T
D
D
Y
Q
--
K
----
A
S
-------
P
----
K
I
P
L
M
L
S
I
D
Q
E
G
G
I
V
T
R
L
-
G
-
E
-
G
-
T
N
-
F
P
G
N
M
A
L
G
A
A
R
S
R
I
N
-
A
Y
Q
T
-------
G
S
I
I
G
K
E
L
S
A
L
G
I
N
T
D
F
S
P
V
V
D
I
N
N
N
P
D
N
P
V
I
G
V
R
S
F
S
S
N
R
E
L
T
S
R
L
G
L
Y
T
M
K
G
L
Q
R
---------
Q
------
D
I
A
S
A
L
K
H
F
P
G
H
G
D
T
D
V
D
S
H
Y
G
L
P
L
V
S
H
G
Q
E
R
L
R
E
V
E
L
Y
P
F
Q
K
A
I
D
A
G
----
A
----
D
M
V
M
T
A
H
V
Q
F
P
A
F
D
D
T
T
Y
K
S
K
L
D
G
S
D
I
L
V
P
A
T
L
S
K
K
V
M
T
G
L
L
R
Q
E
M
G
-
F
N
G
V
I
V
T
D
A
L
N
M
K
A
I
A
D
H
F
--
G
Q
E
E
A
V
V
M
A
V
K
A
G
V
D
I
A
L
M
P
A
S
V
T
S
L
K
E
E
Q
K
F
A
R
V
I
Q
A
L
K
E
A
V
K
N
G
D
I
P
E
Q
Q
I
N
N
S
V
E
R
I
I
S
L
K
I
K
R
G
M
Y
P
A
R
N
S
D
S
T
K
E
K
I
A
K
A
K
K
I
V
G
S
K
Q
H
L
K
A
E
K
K
L
A
E
K
A
V
T
V
L
K
N
E
Q
H
T
L
P
F
K
P
K
K
G
S
R
I
L
I
V
A
P
Y
E
E
Q
T
----
A
S
--------
I
E
----------------
Q
T
I
H
-
D
L
I
K
R
K
K
I
K
P
V
S
L
----
S
K
M
N
F
---------------------
A
S
Q
V
F
K
T
E
H
---
E
K
Q
V
K
E
A
D
Y
I
I
T
G
S
Y
V
V
K
N
D
P
V
V
N
D
G
V
I
D
D
T
I
S
D
S
S
K
W
A
--
T
V
F
P
R
A
V
M
K
A
A
L
Q
H
N
K
P
F
V
L
M
S
-
L
-
R
N
P
Y
D
A
A
N
F
-
E
-
E
A
K
A
L
I
A
V
Y
G
F
K
--
G
Y
A
N
G
R
Y
L
Q
P
N
I
P
A
G
V
M
A
I
F
G
Q
------
A
K
P
K
G
T
L
P
V
D
I
P
S
V
T
K
---------
P
-----------------------------
G
N
T
L
Y
P
L
G
Y
G
L
N
I
K
T
G
R
P
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
98.61
100%
-76
- C1 -
3BMX
7
NAGZ_BACSU
A:
[26-642]
-------------------------
A
S
A
S
K
R
A
I
D
A
N
Q
I
V
N
R
M
S
L
D
E
K
L
G
Q
M
L
M
P
D
F
R
N
W
Q
K
E
G
E
S
S
P
Q
A
L
T
K
M
N
D
E
V
A
S
L
V
K
K
Y
Q
F
G
G
I
I
L
F
A
E
N
V
K
------
T
T
K
Q
T
V
Q
L
T
D
D
Y
Q
--
K
----
A
S
-------
P
----
K
I
P
L
M
L
S
I
D
Q
E
G
G
I
V
T
R
L
-
G
-
E
-
G
-
T
N
-
F
P
G
N
M
A
L
G
A
A
R
S
R
I
N
-
A
Y
Q
T
-------
G
S
I
I
G
K
E
L
S
A
L
G
I
N
T
D
F
S
P
V
V
D
I
N
N
N
P
D
N
P
V
I
G
V
R
S
F
S
S
N
R
E
L
T
S
R
L
G
L
Y
T
M
K
G
L
Q
R
---------
Q
------
D
I
A
S
A
L
K
H
F
P
G
H
G
D
T
D
V
D
S
H
Y
G
L
P
L
V
S
H
G
Q
E
R
L
R
E
V
E
L
Y
P
F
Q
K
A
I
D
A
G
----
A
----
D
M
V
M
T
A
H
V
Q
F
P
A
F
D
D
T
T
Y
K
S
K
L
D
G
S
D
I
L
V
P
A
T
L
S
K
K
V
M
T
G
L
L
R
Q
E
M
G
-
F
N
G
V
I
V
T
D
A
L
N
M
K
A
I
A
D
H
F
--
G
Q
E
E
A
V
V
M
A
V
K
A
G
V
D
I
A
L
M
P
A
S
V
T
S
L
K
E
E
Q
K
F
A
R
V
I
Q
A
L
K
E
A
V
K
N
G
D
I
P
E
Q
Q
I
N
N
S
V
E
R
I
I
S
L
K
I
K
R
G
M
Y
P
A
R
N
S
D
S
T
K
E
K
I
A
K
A
K
K
I
V
G
S
K
Q
H
L
K
A
E
K
K
L
A
E
K
A
V
T
V
L
K
N
E
Q
H
T
L
P
F
K
P
K
K
G
S
R
I
L
I
V
A
P
Y
E
E
Q
T
----
A
S
--------
I
E
----------------
Q
T
I
H
-
D
L
I
K
R
K
K
I
K
P
V
S
L
----
S
K
M
N
F
---------------------
A
S
Q
V
F
K
T
E
H
---
E
K
Q
V
K
E
A
D
Y
I
I
T
G
S
Y
V
V
K
N
D
P
V
V
N
D
G
V
I
D
D
T
I
S
D
S
S
K
W
A
--
T
V
F
P
R
A
V
M
K
A
A
L
Q
H
N
K
P
F
V
L
M
S
-
L
-
R
N
P
Y
D
A
A
N
F
-
E
-
E
A
K
A
L
I
A
V
Y
G
F
K
--
G
Y
A
N
G
R
Y
L
Q
P
N
I
P
A
G
V
M
A
I
F
G
Q
------
A
K
P
K
G
T
L
P
V
D
I
P
S
V
T
K
---------
P
-----------------------------
G
N
T
L
Y
P
L
G
Y
G
L
N
I
K
T
G
R
P
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
98.41
99%
-76
- C1 -
4GYJ
3
NAGZ_BACSU
A:
[29-646]
------------------------
E
A
S
A
S
K
R
A
I
D
A
N
Q
I
V
N
R
M
S
L
D
E
K
L
G
Q
M
L
M
P
D
F
R
N
W
Q
K
E
G
E
S
S
P
Q
A
L
T
K
M
N
D
E
V
A
S
L
V
K
K
Y
Q
F
G
G
I
I
L
F
A
E
N
V
K
------
T
T
K
Q
T
V
Q
L
T
D
D
Y
Q
--
K
----
A
S
-------
P
----
K
I
P
L
M
L
S
I
D
Q
E
G
G
I
V
T
R
L
-
G
-
E
-
G
-
T
N
-
F
P
G
N
M
A
L
G
A
A
R
S
R
I
N
-
A
Y
Q
T
-------
G
S
I
I
G
K
E
L
S
A
L
G
I
N
T
D
F
S
P
V
V
D
I
N
N
N
P
D
N
P
V
I
G
V
R
S
F
S
S
N
R
E
L
T
S
R
L
G
L
Y
T
M
K
G
L
Q
R
---------
Q
------
D
I
A
S
A
L
K
H
F
P
G
H
G
D
T
D
V
D
S
H
Y
G
L
P
L
V
S
H
G
Q
E
R
L
R
E
V
E
L
Y
P
F
Q
K
A
I
D
A
G
----
A
----
D
M
V
M
T
A
H
V
Q
F
P
A
F
D
D
T
T
Y
K
S
K
L
D
G
S
D
I
L
V
P
A
T
L
S
K
K
V
M
T
G
L
L
R
Q
E
M
G
-
F
N
G
V
I
V
T
N
A
L
N
M
K
A
I
A
D
H
F
--
G
Q
E
E
A
V
V
M
A
V
K
A
G
V
D
I
A
L
M
P
A
S
V
T
S
L
K
E
E
Q
K
F
A
R
V
I
Q
A
L
K
E
A
V
K
N
G
D
I
P
E
Q
Q
I
N
N
S
V
E
R
I
I
S
L
K
I
K
R
G
M
Y
P
A
R
N
S
D
S
T
K
E
K
I
A
K
A
K
K
I
V
G
S
K
Q
H
L
K
A
E
K
K
L
A
E
K
A
V
T
V
L
K
N
E
Q
H
T
L
P
F
K
P
K
K
G
S
R
I
L
I
V
A
P
Y
E
E
Q
T
----
A
S
--------
I
E
----------------
Q
T
I
H
-
D
L
I
K
R
K
K
I
K
P
V
S
L
----
S
K
M
N
F
---------------------
A
S
Q
V
F
K
T
E
H
---
E
K
Q
V
K
E
A
D
Y
I
I
T
G
S
Y
V
V
K
N
D
P
V
V
N
D
G
V
I
D
D
T
I
S
D
S
S
K
W
A
--
T
V
F
P
R
A
V
M
K
A
A
L
Q
H
N
K
P
F
V
L
M
S
-
L
-
R
N
P
Y
D
A
A
N
F
-
E
-
E
A
K
A
L
I
A
V
Y
G
F
K
--
G
Y
A
N
G
R
Y
L
Q
P
N
I
P
A
G
V
M
A
I
F
G
Q
------
A
K
P
K
G
T
L
P
V
D
I
P
S
V
T
K
---------
P
-----------------------------
G
N
T
L
Y
P
L
G
Y
G
L
N
I
K
T
G
R
P
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
31
HHSearch
98.36
100%
-77
- C1 -
3BMX
7
NAGZ_BACSU
A:
[26-642]
-------------------------
A
S
A
S
K
R
A
I
D
A
N
Q
I
V
N
R
M
S
L
D
E
K
L
G
Q
M
L
M
P
D
F
R
N
W
Q
K
E
G
E
S
S
P
Q
A
L
T
K
M
N
D
E
V
A
S
L
V
K
K
Y
Q
F
G
G
I
I
L
F
A
E
N
V
K
------
T
T
K
Q
T
V
Q
L
T
D
D
Y
Q
--
K
----
A
S
-------
P
----
K
I
P
L
M
L
S
I
D
Q
E
G
G
I
V
T
R
L
-
G
-
E
-
G
-
T
N
-
F
P
G
N
M
A
L
G
A
A
R
S
R
I
N
-
A
Y
Q
T
-------
G
S
I
I
G
K
E
L
S
A
L
G
I
N
T
D
F
S
P
V
V
D
I
N
N
N
P
D
N
P
V
I
G
V
R
S
F
S
S
N
R
E
L
T
S
R
L
G
L
Y
T
M
K
G
L
Q
R
---------
Q
------
D
I
A
S
A
L
K
H
F
P
G
H
G
D
T
D
V
D
S
H
Y
G
L
P
L
V
S
H
G
Q
E
R
L
R
E
V
E
L
Y
P
F
Q
K
A
I
D
A
G
----
A
----
D
M
V
M
T
A
H
V
Q
F
P
A
F
D
D
T
T
Y
K
S
K
L
D
G
S
D
I
L
V
P
A
T
L
S
K
K
V
M
T
G
L
L
R
Q
E
M
G
-
F
N
G
V
I
V
T
D
A
L
N
M
K
A
I
A
D
H
F
--
G
Q
E
E
A
V
V
M
A
V
K
A
G
V
D
I
A
L
M
P
A
S
V
T
S
L
K
E
E
Q
K
F
A
R
V
I
Q
A
L
K
E
A
V
K
N
G
D
I
P
E
Q
Q
I
N
N
S
V
E
R
I
I
S
L
K
I
K
R
G
M
Y
P
A
R
N
S
D
S
T
K
E
K
I
A
K
A
K
K
I
V
G
S
K
Q
H
L
K
A
E
K
K
L
A
E
K
A
V
T
V
L
K
N
E
Q
H
T
L
P
F
K
P
K
K
G
S
R
I
L
I
V
A
P
Y
E
E
Q
T
----
A
S
--------
I
E
----------------
Q
T
I
H
-
D
L
I
K
R
K
K
I
K
P
V
S
L
----
S
K
M
N
F
---------------------
A
S
Q
V
F
K
T
E
H
---
E
K
Q
V
K
E
A
D
Y
I
I
T
G
S
Y
V
V
K
N
D
P
V
V
N
D
G
V
I
D
D
T
I
S
D
S
S
K
W
A
--
T
V
F
P
R
A
V
M
K
A
A
L
Q
H
N
K
P
F
V
L
M
S
-
L
-
R
N
P
Y
D
A
A
N
F
-
E
-
E
A
K
A
L
I
A
V
Y
G
F
K
G
Y
A
N
G
--
R
Y
L
Q
P
N
I
P
A
G
V
M
A
I
F
G
Q
------
A
K
P
K
G
T
L
P
V
D
I
P
S
V
T
K
---------
P
-----------------------------
G
N
T
L
Y
P
L
G
Y
G
L
N
I
K
T
G
R
P
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
98.36
100%
-78
- C1 -
3NVD
4
NAGZ_BACSU
B:
[26-642]
-------------------------
A
S
A
S
K
R
A
I
D
A
N
Q
I
V
N
R
M
S
L
D
E
K
L
G
Q
M
L
M
P
D
F
R
N
W
Q
K
E
G
E
S
S
P
Q
A
L
T
K
M
N
D
E
V
A
S
L
V
K
K
Y
Q
F
G
G
I
I
L
F
A
E
N
V
K
------
T
T
K
Q
T
V
Q
L
T
D
D
Y
Q
--
K
----
A
S
-------
P
----
K
I
P
L
M
L
S
I
D
Q
E
G
G
I
V
T
R
L
-
G
-
E
-
G
-
T
N
-
F
P
G
N
M
A
L
G
A
A
R
S
R
I
N
-
A
Y
Q
T
-------
G
S
I
I
G
K
E
L
S
A
L
G
I
N
T
D
F
S
P
V
V
D
I
N
N
N
P
D
N
P
V
I
G
V
R
S
F
S
S
N
R
E
L
T
S
R
L
G
L
Y
T
M
K
G
L
Q
R
---------
Q
------
D
I
A
S
A
L
K
H
F
P
G
H
G
D
T
D
V
D
S
H
Y
G
L
P
L
V
S
H
G
Q
E
R
L
R
E
V
E
L
Y
P
F
Q
K
A
I
D
A
G
----
A
----
D
M
V
M
T
A
H
V
Q
F
P
A
F
D
D
T
T
Y
K
S
K
L
D
G
S
D
I
L
V
P
A
T
L
S
K
K
V
M
T
G
L
L
R
Q
E
M
G
-
F
N
G
V
I
V
T
D
A
L
N
M
K
A
I
A
D
H
F
--
G
Q
E
E
A
V
V
M
A
V
K
A
G
V
D
I
A
L
M
P
A
S
V
T
S
L
K
E
E
Q
K
F
A
R
V
I
Q
A
L
K
E
A
V
K
N
G
D
I
P
E
Q
Q
I
N
N
S
V
E
R
I
I
S
L
K
I
K
R
G
M
Y
P
A
R
N
S
D
S
T
K
E
K
I
A
K
A
K
K
I
V
G
S
K
Q
H
L
K
A
E
K
K
L
A
E
K
A
V
T
V
L
K
N
E
Q
H
T
L
P
F
K
P
K
K
G
S
R
I
L
I
V
A
P
Y
E
E
Q
T
----
A
S
--------
I
E
----------------
Q
T
I
H
-
D
L
I
K
R
K
K
I
K
P
V
S
L
----
S
K
M
N
F
---------------------
A
S
Q
V
F
K
T
E
H
---
E
K
Q
V
K
E
A
D
Y
I
I
T
G
S
Y
V
V
K
N
D
P
V
V
N
D
G
V
I
D
D
T
I
S
D
S
S
K
W
A
--
T
V
F
P
R
A
V
M
K
A
A
L
Q
H
N
K
P
F
V
L
M
S
-
L
-
R
N
P
Y
D
A
A
N
F
-
E
-
E
A
K
A
L
I
A
V
Y
G
F
K
--
G
Y
A
N
G
R
Y
L
Q
P
N
I
P
A
G
V
M
A
I
F
G
Q
------
A
K
P
K
G
T
L
P
V
D
I
P
S
V
T
K
---------
P
-----------------------------
G
N
T
L
Y
P
L
G
Y
G
L
N
I
K
T
G
R
P
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
98.04
99%
-76
- C1 -
4GYJ
3
NAGZ_BACSU
B:
[30-646]
-------------------------
A
S
A
S
K
R
A
I
D
A
N
Q
I
V
N
R
M
S
L
D
E
K
L
G
Q
M
L
M
P
D
F
R
N
W
Q
K
E
G
E
S
S
P
Q
A
L
T
K
M
N
D
E
V
A
S
L
V
K
K
Y
Q
F
G
G
I
I
L
F
A
E
N
V
K
------
T
T
K
Q
T
V
Q
L
T
D
D
Y
Q
--
K
----
A
S
-------
P
----
K
I
P
L
M
L
S
I
D
Q
E
G
G
I
V
T
R
L
-
G
-
E
-
G
-
T
N
-
F
P
G
N
M
A
L
G
A
A
R
S
R
I
N
-
A
Y
Q
T
-------
G
S
I
I
G
K
E
L
S
A
L
G
I
N
T
D
F
S
P
V
V
D
I
N
N
N
P
D
N
P
V
I
G
V
R
S
F
S
S
N
R
E
L
T
S
R
L
G
L
Y
T
M
K
G
L
Q
R
---------
Q
------
D
I
A
S
A
L
K
H
F
P
G
H
G
D
T
D
V
D
S
H
Y
G
L
P
L
V
S
H
G
Q
E
R
L
R
E
V
E
L
Y
P
F
Q
K
A
I
D
A
G
----
A
----
D
M
V
M
T
A
H
V
Q
F
P
A
F
D
D
T
T
Y
K
S
K
L
D
G
S
D
I
L
V
P
A
T
L
S
K
K
V
M
T
G
L
L
R
Q
E
M
G
-
F
N
G
V
I
V
T
N
A
L
N
M
K
A
I
A
D
H
F
--
G
Q
E
E
A
V
V
M
A
V
K
A
G
V
D
I
A
L
M
P
A
S
V
T
S
L
K
E
E
Q
K
F
A
R
V
I
Q
A
L
K
E
A
V
K
N
G
D
I
P
E
Q
Q
I
N
N
S
V
E
R
I
I
S
L
K
I
K
R
G
M
Y
P
A
R
N
S
D
S
T
K
E
K
I
A
K
A
K
K
I
V
G
S
K
Q
H
L
K
A
E
K
K
L
A
E
K
A
V
T
V
L
K
N
E
Q
H
T
L
P
F
K
P
K
K
G
S
R
I
L
I
V
A
P
Y
E
E
Q
T
----
A
S
--------
I
E
----------------
Q
T
I
H
-
D
L
I
K
R
K
K
I
K
P
V
S
L
----
S
K
M
N
F
---------------------
A
S
Q
V
F
K
T
E
H
---
E
K
Q
V
K
E
A
D
Y
I
I
T
G
S
Y
V
V
K
N
D
P
V
V
N
D
G
V
I
D
D
T
I
S
D
S
S
K
W
A
--
T
V
F
P
R
A
V
M
K
A
A
L
Q
H
N
K
P
F
V
L
M
S
-
L
-
R
N
P
Y
D
A
A
N
F
-
E
-
E
A
K
A
L
I
A
V
Y
G
F
K
--
G
Y
A
N
G
R
Y
L
Q
P
N
I
P
A
G
V
M
A
I
F
G
Q
------
A
K
P
K
G
T
L
P
V
D
I
P
S
V
T
K
---------
P
-----------------------------
G
N
T
L
Y
P
L
G
Y
G
L
N
I
K
T
G
R
P
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
97.94
100%
-76
- C1 -
3NVD
5
NAGZ_BACSU
A:
[26-642]
-------------------------
A
S
A
S
K
R
A
I
D
A
N
Q
I
V
N
R
M
S
L
D
E
K
L
G
Q
M
L
M
P
D
F
R
N
W
Q
K
E
G
E
S
S
P
Q
A
L
T
K
M
N
D
E
V
A
S
L
V
K
K
Y
Q
F
G
G
I
I
L
F
A
E
N
V
K
------
T
T
K
Q
T
V
Q
L
T
D
D
Y
Q
--
K
----
A
S
-------
P
----
K
I
P
L
M
L
S
I
D
Q
E
G
G
I
V
T
R
L
-
G
-
E
-
G
-
T
N
-
F
P
G
N
M
A
L
G
A
A
R
S
R
I
N
-
A
Y
Q
T
-------
G
S
I
I
G
K
E
L
S
A
L
G
I
N
T
D
F
S
P
V
V
D
I
N
N
N
P
D
N
P
V
I
G
V
R
S
F
S
S
N
R
E
L
T
S
R
L
G
L
Y
T
M
K
G
L
Q
R
---------
Q
------
D
I
A
S
A
L
K
H
F
P
G
H
G
D
T
D
V
D
S
H
Y
G
L
P
L
V
S
H
G
Q
E
R
L
R
E
V
E
L
Y
P
F
Q
K
A
I
D
A
G
----
A
----
D
M
V
M
T
A
H
V
Q
F
P
A
F
D
D
T
T
Y
K
S
K
L
D
G
S
D
I
L
V
P
A
T
L
S
K
K
V
M
T
G
L
L
R
Q
E
M
G
-
F
N
G
V
I
V
T
D
A
L
N
M
K
A
I
A
D
H
F
--
G
Q
E
E
A
V
V
M
A
V
K
A
G
V
D
I
A
L
M
P
A
S
V
T
S
L
K
E
E
Q
K
F
A
R
V
I
Q
A
L
K
E
A
V
K
N
G
D
I
P
E
Q
Q
I
N
N
S
V
E
R
I
I
S
L
K
I
K
R
G
M
Y
P
A
R
N
S
D
S
T
K
E
K
I
A
K
A
K
K
I
V
G
S
K
Q
H
L
K
A
E
K
K
L
A
E
K
A
V
T
V
L
K
N
E
Q
H
T
L
P
F
K
P
K
K
G
S
R
I
L
I
V
A
P
Y
E
E
Q
T
----
A
S
--------
I
E
----------------
Q
T
I
H
-
D
L
I
K
R
K
K
I
K
P
V
S
L
----
S
K
M
N
F
---------------------
A
S
Q
V
F
K
T
E
H
---
E
K
Q
V
K
E
A
D
Y
I
I
T
G
S
Y
V
V
K
N
D
P
V
V
N
D
G
V
I
D
D
T
I
S
D
S
S
K
W
A
--
T
V
F
P
R
A
V
M
K
A
A
L
Q
H
N
K
P
F
V
L
M
S
-
L
-
R
N
P
Y
D
A
A
N
F
-
E
-
E
A
K
A
L
I
A
V
Y
G
F
K
--
G
Y
A
N
G
R
Y
L
Q
P
N
I
P
A
G
V
M
A
I
F
G
Q
------
A
K
P
K
G
T
L
P
V
D
I
P
S
V
T
K
---------
P
-----------------------------
G
N
T
L
Y
P
L
G
Y
G
L
N
I
K
T
G
R
P
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
97.38
99%
-78
- C1 -
3LK6
6
NAGZ_BACSU
C:
[1-616]
--------------------------
S
A
S
K
R
A
I
D
A
N
Q
I
V
N
R
M
S
L
D
E
K
L
G
Q
M
L
M
P
D
F
R
N
W
Q
K
E
G
E
S
S
P
Q
A
L
T
K
M
N
D
E
V
A
S
L
V
K
K
Y
Q
F
G
G
I
I
L
F
A
E
N
V
K
------
T
T
K
Q
T
V
Q
L
T
D
D
Y
Q
--
K
----
A
S
-------
P
----
K
I
P
L
M
L
S
I
D
Q
E
G
G
I
V
T
R
L
-
G
-
E
-
G
-
T
N
-
F
P
G
N
M
A
L
G
A
A
R
S
R
I
N
-
A
Y
Q
T
-------
G
S
I
I
G
K
E
L
S
A
L
G
I
N
T
D
F
S
P
V
V
D
I
N
N
N
P
D
N
P
V
I
G
V
R
S
F
S
S
N
R
E
L
T
S
R
L
G
L
Y
T
M
K
G
L
Q
R
---------
Q
------
D
I
A
S
A
L
K
H
F
P
G
H
G
D
T
D
V
D
S
H
Y
G
L
P
L
V
S
H
G
Q
E
R
L
R
E
V
E
L
Y
P
F
Q
K
A
I
D
A
G
----
A
----
D
M
V
M
T
A
H
V
Q
F
P
A
F
D
D
T
T
Y
K
S
K
L
D
G
S
D
I
L
V
P
A
T
L
S
K
K
V
M
T
G
L
L
R
Q
E
M
G
-
F
N
G
V
I
V
T
N
A
L
N
M
K
A
I
A
D
H
F
--
G
Q
E
E
A
V
V
M
A
V
K
A
G
V
D
I
A
L
M
P
A
S
V
T
S
L
K
E
E
Q
K
F
A
R
V
I
Q
A
L
K
E
A
V
K
N
G
D
I
P
E
Q
Q
I
N
N
S
V
E
R
I
I
S
L
K
I
K
R
G
M
Y
P
A
R
N
S
D
S
T
K
E
K
I
A
K
A
K
K
I