@TOME V2.3
(Mar 2018)
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 : B0VV22: (2017-12-21 )
MMRRLSTQDQNFKQVFAELLAFETVNDPNLVQTVDQIIADVRQHGDDHVLKLTQQFDRHPAHQFSDLELSQQQLKAAFDGLNQEIREALQLAADRIRTFHEAQKQDSWTYVDDLGNTLGQKVTPLDRVGIYVPGGLASYPSSVLMNAVPAHVAGVPEIIMVVPAPNGELNPLVLAAAYLAGVSRVFTIGGAQAVAALAYGTQTVPRVDKITGPGNRFVAAAKRAVFGQLGIDMIAGPSEILVYAEGVNNAEWLAMDVLSQAEHDTVAQAIFITPDGALLEAVESAIEKHLNELPKAEIARTSIENRGALVLVKDRAEAVDLINQVAPEHLELCLDDAEAMSQDIRHAGAIFMGRYTPEAIGDYCAGPNHVLPTSGTARFSSPLGVYDFQKRSSLIMCSKDGVKTLAKTADVLAVQENLDAHARSARYRYQ
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--------
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
-------------------------------------MMRRLSTQDQ
N
F
K
Q
V
F
A
E
L
L
-
A
F
ETV-ND
P
N
L
V
Q
T
V
D
Q
I
I
A
D
V
R
QHGD
D
H
V
L
K
L
T
Q
Q
F
DRHPAHQFS
D
L
E
L
S
Q
Q
Q
L
K
A
A
F
D
G
L
N
------------------
Q
E
I
R
E
A
-
L
Q
L
A
A
D
R
I
-
R
T
F
H
E
A
QKQ-----DS
W
T
Y
V
D
D
L
G
N
T
------------LG--------------------QKVTPL
D
R
V
G
I
Y
VPGGLASY
P
S
S
V
L
-
M
N
A
V
P
A
H
VAGV-----
P
E
I
I
M
----
V
V
PAPNGEL
N
P
L
V
L
-----
A
A
A
Y
L
A----G
V
-
S
R
V
-
F
TI--G
G
A
Q
A
V
A
A
L
A
YGTQTVPRVDKI-----TGPG
N
R
F
V
A
A
-
A
K
R
A
V
F
G
---QL---GIDMI---A---GP
S
E
I
L
V
-----
Y
AEG----VNN----
A
E
W
L
A
M
D
V
L
S
QAE-H---D-----T
V
A
Q
-
A
I
F
ITP---
D
G
--
A
-
L
-
L
E
A
V
---
E
S
A
I
-
E
---------
K
H
----------------
L
N
EL-----------
P
K
A
E
I
A
-
R
T
SIENR
G
A
L
V
------------
L
V----KD
R
A
E
A
V
D
L
I
N
Q
V
A
P
E
------
H
-
L
E
----
L
C
------L
D
D
A
E
---
A
M
S
Q
D
I
-----------
R
H
A
G
A
I
F
MGRY
T
P
E
A
I
GDYCAGPNHVLPTSGT--ARF--SSPL-------------GVY
D
F
QKR-S
S
L
I
M
CSKD
G
------------
V
----
K
T
L
A
K
T
A
D
V
L
A
V
Q
EN
L
D
A
H
A
RSARYRYQ----------
1
PsiBlast_PDB
94.38
59%
-120
- C4 -
-
4GIC
-
HISX_METCA
A:
[7-401]
--------------------------------------
I
K
R
L
Y
T
G
D
A
D
F
A
S
Q
L
D
R
L
L
-
A
W
S
----
D
T
D
I
H
Q
R
V
T
E
I
I
G
C
I
R
R
D
G
D
A
A
L
V
E
L
T
A
R
F
D
H
F
V
V
D
T
A
A
A
L
E
L
P
R
D
V
L
E
A
A
W
Q
A
L
P
------------------
A
E
Q
A
K
A
-
L
R
E
A
A
E
R
I
-
R
A
Y
A
E
R
Q
K
L
-----
D
S
W
D
Y
R
E
A
D
G
T
L
------------
L
G
--------------------
Q
K
I
T
P
L
D
R
V
G
L
Y
V
P
G
G
K
A
A
Y
P
S
S
V
L
-
M
N
A
V
P
A
K
V
A
G
V
-----
P
E
L
I
M
----
A
V
P
A
P
R
G
E
L
N
A
L
V
L
-----
A
A
A
Y
I
S
----
G
V
-
D
R
V
-
F
R
I
--
G
G
A
Q
A
V
A
A
L
A
Y
G
T
E
T
V
P
R
V
D
K
I
-----
V
G
P
G
N
I
Y
V
A
T
-
A
K
K
L
V
F
G
---
Q
V
---
G
I
D
M
V
---
A
---
G
P
S
E
I
L
V
-----
I
S
D
G
----
R
T
D
----
P
D
W
I
A
M
D
L
F
S
Q
A
E
-
H
---
D
-----
E
D
A
Q
-
A
I
L
I
S
P
---
D
A
--
A
-
H
-
L
E
A
V
---
Q
A
S
I
-
E
---------
R
L
----------------
L
P
G
M
-----------
E
R
A
E
V
I
-
R
T
S
L
E
R
R
G
G
M
I
------------
L
V
----
D
D
L
E
Q
A
A
A
V
A
N
R
I
A
P
E
------
H
-
L
E
----
L
S
------
V
E
S
P
E
---
V
L
V
E
S
I
-----------
R
N
A
G
A
I
F
M
G
----------------
V
L
P
T
S
G
T
--
A
R
F
--
S
S
P
L
-------------
G
V
Y
D
F
Q
K
R
-
S
S
L
I
Y
------------------------------------------------------------
15
HHSearch
93.76
61%
-122
- C4 -
-
4GIC
-
HISX_METCA
B:
[6-403]
-------------------------------------
K
I
K
R
L
Y
T
G
D
A
D
F
A
S
Q
L
D
R
L
L
-
A
W
S
----
D
T
D
I
H
Q
R
V
T
E
I
I
G
C
I
R
R
D
G
D
A
A
L
V
E
L
T
A
R
F
D
H
F
V
V
D
T
A
A
A
L
E
L
P
R
D
V
L
E
A
A
W
Q
A
L
P
------------------
A
E
Q
A
K
A
-
L
R
E
A
A
E
R
I
-
R
A
Y
A
E
R
Q
K
L
-----
D
S
W
D
Y
R
E
A
D
G
T
L
------------
L
G
--------------------
Q
K
I
T
P
L
D
R
V
G
L
Y
V
P
G
G
K
A
A
Y
P
S
S
V
L
-
M
N
A
V
P
A
K
V
A
G
V
-----
P
E
L
I
M
----
A
V
P
A
P
R
G
E
L
N
A
L
V
L
-----
A
A
A
Y
I
S
----
G
V
-
D
R
V
-
F
R
I
--
G
G
A
Q
A
V
A
A
L
A
Y
G
T
E
T
V
P
R
V
D
K
I
-----
V
G
P
G
N
I
Y
V
A
T
-
A
K
K
L
V
F
G
---
Q
V
---
G
I
D
M
V
---
A
---
G
P
S
E
I
L
V
-----
I
S
D
G
----
R
T
D
----
P
D
W
I
A
M
D
L
F
S
Q
A
E
-
H
---
D
-----
E
D
A
Q
-
A
I
L
I
S
P
---
D
A
--
A
-
H
-
L
E
A
V
---
Q
A
S
I
-
E
---------
R
L
----------------
L
P
G
M
-----------
E
R
A
E
V
I
-
R
T
S
L
E
R
R
G
G
M
I
------------
L
V
----
D
D
L
E
Q
A
A
A
V
A
N
R
I
A
P
E
------
H
-
L
E
----
L
S
------
V
E
S
P
E
---
V
L
V
E
S
I
-----------
R
N
A
G
A
I
F
M
G
----------------
V
L
P
T
S
G
T
--
A
R
F
--
S
S
P
L
-------------
G
V
Y
D
F
Q
K
R
-
S
S
L
I
Y
C
S
----------------------------------------------------------
13
HHSearch
89.71
50%
-113
- C4 -
-
4G09
3
HISX_BRUSU
A:
[2-429]
--------------------------------------
V
T
T
L
R
Q
T
D
P
D
F
E
Q
K
F
A
A
F
L
-
S
G
------
E
D
V
D
R
A
V
R
E
I
V
D
R
V
R
R
E
G
D
S
A
L
L
D
Y
S
R
R
F
D
R
I
D
L
E
K
-
T
G
I
A
V
T
E
A
E
I
D
A
A
F
D
A
A
P
------------------
A
S
T
V
E
A
-
L
K
L
A
R
D
R
I
-
E
K
H
H
A
R
Q
L
P
-----
K
D
D
R
Y
T
D
A
L
G
V
E
------------
L
G
--------------------
S
R
W
T
A
I
E
A
V
G
L
Y
V
P
G
G
T
A
S
Y
P
S
S
V
L
-
M
N
A
M
P
A
K
V
A
G
V
-----
D
R
I
V
M
----
V
V
P
A
P
D
G
N
L
N
P
L
V
L
-----
V
A
A
R
L
A
----
G
V
-
S
E
I
-
Y
R
V
--
G
G
A
Q
A
I
A
A
L
A
Y
G
T
E
T
I
R
P
V
A
K
I
-----
V
G
P
G
N
A
Y
V
A
A
-
A
K
R
I
V
F
G
---
T
V
---
G
I
D
M
I
---
A
---
G
P
S
E
V
L
I
-----
V
A
D
K
----
D
N
N
----
P
D
W
I
A
A
D
L
L
A
Q
A
E
-
H
---
D
-----
T
A
A
Q
-
S
I
L
M
T
N
---
D
E
--
A
-
F
-
A
H
A
V
---
E
E
A
V
-
E
---------
R
Q
----------------
L
H
T
L
-----------
A
R
T
E
T
A
-
S
A
S
W
R
D
F
G
A
V
I
------------
L
V
----
K
D
F
E
D
A
I
P
L
A
N
R
I
A
A
E
------
H
-
L
E
----
I
A
------
V
A
D
A
E
---
A
F
V
P
R
I
-----------
R
N
A
G
S
I
F
I
G
G
Y
T
P
E
V
I
G
D
Y
V
G
G
S
N
H
V
L
P
T
A
R
S
--
A
R
F
--
S
S
G
L
-------------
S
V
L
D
Y
M
K
R
-
T
S
L
L
K
L
G
S
E
Q
------------
L
----
R
A
L
G
P
A
A
I
E
I
A
R
A
E
G
L
D
A
H
A
Q
S
V
A
I
R
L
N
----------
3
PsiBlast_PDB
89.09
50%
-112
- C4 -
-
4G09
3
HISX_BRUSU
A:
[2-427]
--------------------------------------
V
T
T
L
R
Q
T
D
P
D
F
E
Q
K
F
A
A
F
L
-
S
G
------
E
D
V
D
R
A
V
R
E
I
V
D
R
V
R
R
E
G
D
S
A
L
L
D
Y
S
R
R
F
D
R
I
D
L
E
K
-
T
G
I
A
V
T
E
A
E
I
D
A
A
F
D
A
A
P
------------------
A
S
T
V
E
A
-
L
K
L
A
R
D
R
I
-
E
K
H
H
A
R
Q
L
P
-----
K
D
D
R
Y
T
D
A
L
G
V
E
------------
L
G
--------------------
S
R
W
T
A
I
E
A
V
G
L
Y
V
P
G
G
T
A
S
Y
P
S
S
V
L
-
M
N
A
M
P
A
K
V
A
G
V
-----
D
R
I
V
M
----
V
V
P
A
P
D
G
N
L
N
P
L
V
L
-----
V
A
A
R
L
A
----
G
V
-
S
E
I
-
Y
R
V
--
G
G
A
Q
A
I
A
A
L
A
Y
G
T
E
T
I
R
P
V
A
K
I
-----
V
G
P
G
N
A
Y
V
A
A
-
A
K
R
I
V
F
G
---
T
V
---
G
I
D
M
I
---
A
---
G
P
S
E
V
L
I
-----
V
A
D
K
----
D
N
N
----
P
D
W
I
A
A
D
L
L
A
Q
A
E
-
H
---
D
-----
T
A
A
Q
-
S
I
L
M
T
N
---
D
E
--
A
-
F
-
A
H
A
V
---
E
E
A
V
-
E
---------
R
Q
----------------
L
H
T
L
-----------
A
R
T
E
T
A
-
S
A
S
W
R
D
F
G
A
V
I
------------
L
V
----
K
D
F
E
D
A
I
P
L
A
N
R
I
A
A
E
------
H
-
L
E
----
I
A
------
V
A
D
A
E
---
A
F
V
P
R
I
-----------
R
N
A
G
S
I
F
I
G
G
Y
T
P
E
V
I
G
D
Y
V
G
G
S
N
H
V
L
P
T
A
R
S
--
A
R
F
--
S
S
G
L
-------------
S
V
L
D
Y
M
K
R
-
T
S
L
L
K
L
G
S
E
Q
------------
L
----
R
A
L
G
P
A
A
I
E
I
A
R
A
E
G
L
D
A
H
A
Q
S
V
A
I
R
------------
2
PsiBlast_PDB
87.50
50%
-112
- C4 -
-
4G07
1
HISX_BRUSU
A:
[2-427]
--------------------------------------
V
T
T
L
R
Q
T
D
P
D
F
E
Q
K
F
A
A
F
L
-
S
G
-------
D
V
D
R
A
V
R
E
I
V
D
R
V
R
R
E
G
D
S
A
L
L
D
Y
S
R
R
F
D
R
I
D
L
E
K
-
T
G
I
A
V
T
E
A
E
I
D
A
A
F
D
A
A
P
------------------
A
S
T
V
E
A
-
L
K
L
A
R
D
R
I
-
E
K
H
H
A
R
Q
L
P
-----
K
D
D
R
Y
T
D
A
L
G
V
E
------------
L
G
--------------------
S
R
W
T
A
I
E
A
V
G
L
Y
V
P
G
G
T
A
S
Y
P
S
S
V
L
-
M
N
A
M
P
A
K
V
A
G
V
-----
D
R
I
V
M
----
V
V
P
A
P
D
G
N
L
N
P
L
V
L
-----
V
A
A
R
L
A
----
G
V
-
S
E
I
-
Y
R
V
--
G
G
A
Q
A
I
A
A
L
A
Y
G
T
E
T
I
R
P
V
A
K
I
-----
V
G
P
G
N
A
Y
V
A
A
-
A
K
R
I
V
F
G
---
T
V
---
G
I
D
M
I
---
A
---
G
P
S
E
V
L
I
-----
V
A
D
K
----
D
N
N
----
P
D
W
I
A
A
D
L
L
A
Q
A
E
-
H
---
D
-----
T
A
A
Q
-
S
I
L
M
T
N
---
D
E
--
A
-
F
-
A
H
A
V
---
E
E
A
V
-
E
---------
R
Q
----------------
L
H
---------------
T
E
T
A
-
S
A
S
W
R
D
F
G
A
V
I
------------
L
V
----
K
D
F
E
D
A
I
P
L
A
N
R
I
A
A
E
------
H
-
L
E
----
I
A
------
V
A
D
A
E
---
A
F
V
P
R
I
-----------
R
N
A
G
S
I
F
I
G
G
Y
T
P
E
V
I
G
D
Y
V
G
G
S
N
H
V
L
P
T
A
R
S
--
A
R
F
--
S
S
G
L
-------------
S
V
L
D
Y
M
K
R
-
T
S
L
L
K
L
G
S
E
Q
------------
L
----
R
A
L
G
P
A
A
I
E
I
A
R
A
E
G
L
D
A
H
A
Q
S
V
A
I
R
------------
4
PsiBlast_PDB
78.03
40%
-72
- C4 -
-
1K75
1
HISX_ECOLI
A:
[31-426]
-------------------------------------------------------------------
S
I
T
R
T
V
N
D
I
L
D
N
V
K
A
R
G
D
E
A
L
R
E
Y
S
A
K
F
D
K
T
---
T
V
T
A
L
K
V
S
A
E
E
I
A
A
A
S
E
R
L
S
------------------
D
E
L
K
Q
A
-
M
A
V
A
V
K
N
I
-
E
T
F
H
T
A
Q
K
L
-----
P
P
V
D
V
E
T
Q
P
G
V
R
------------
C
Q
--------------------
Q
V
T
R
P
V
A
S
V
G
L
Y
I
P
G
G
S
A
P
L
F
S
T
V
L
-
M
L
A
T
P
A
S
I
A
G
C
-----
K
K
V
V
L
----
C
S
P
P
P
I
A
D
E
---
I
L
-----
Y
A
A
Q
L
C
----
G
V
-
Q
D
V
-
F
N
V
--
G
G
A
Q
A
I
A
A
L
A
F
G
T
E
S
V
P
K
V
D
K
I
-----
F
G
P
G
N
A
F
V
T
E
-
A
K
R
Q
V
S
Q
---
R
L
D
G
A
A
I
D
M
P
---
A
---
G
P
S
E
V
L
V
-----
I
A
D
S
----
G
A
T
----
P
D
F
V
A
S
D
L
L
S
Q
A
E
-
H
---
G
-----
P
D
S
Q
-
V
I
L
L
T
P
---
A
A
--
D
-
M
-
A
R
R
V
---
A
E
A
V
-
E
---------
R
Q
----------------
L
A
E
L
-----------
P
R
A
E
T
A
-
R
Q
A
L
-
N
A
S
R
L
I
------------
V
T
----
K
D
L
A
Q
C
V
E
I
S
N
Q
Y
G
P
E
------
H
-
L
I
----
I
Q
------
T
R
N
A
R
---
E
L
V
D
S
I
-----------
T
S
A
G
S
V
F
L
G
D
W
S
P
E
S
A
G
D
Y
A
S
G
T
N
H
V
L
P
T
Y
G
Y
--
T
A
T
--
C
S
S
L
-------------
G
L
A
D
F
Q
K
R
-
M
T
V
Q
E
L
S
K
E
G
------------
F
----
S
A
L
A
S
T
I
E
T
L
A
A
A
E
R
L
T
A
H
K
N
A
V
T
L
R
------------
5
PsiBlast_PDB
77.02
40%
-70
- C4 -
-
1KAE
3
HISX_ECOLI
A:
[31-426]
-------------------------------------------------------------------
S
I
T
R
T
V
N
D
I
L
D
N
V
K
A
R
G
D
E
A
L
R
E
Y
S
A
K
F
D
K
T
---
T
V
T
A
L
K
V
S
A
E
E
I
A
A
A
S
E
R
L
S
------------------
D
E
L
K
Q
A
-
M
A
V
A
V
K
N
I
-
E
T
F
H
T
A
Q
K
L
-----
P
P
V
D
V
E
T
Q
P
G
V
R
------------
C
Q
--------------------
Q
V
T
R
P
V
A
S
V
G
L
Y
I
P
G
G
S
A
P
L
F
S
T
V
L
-
M
L
A
T
P
A
S
I
A
G
C
-----
K
K
V
V
L
----
C
S
P
P
P
I
A
D
E
---
I
L
-----
Y
A
A
Q
L
C
----
G
V
-
Q
D
V
-
F
N
V
--
G
G
A
Q
A
I
A
A
L
A
F
G
T
E
S
V
P
K
V
D
K
I
-----
F
G
P
G
N
A
F
V
T
E
-
A
K
R
Q
V
S
Q
---
R
L
D
G
A
A
I
D
M
P
---
A
---
G
P
S
E
V
L
V
-----
I
A
D
S
----
G
A
T
----
P
D
F
V
A
S
D
L
L
S
Q
A
E
-
H
---
G
-----
P
D
S
Q
-
V
I
L
L
T
P
---
A
A
--
D
-
M
-
A
R
R
V
---
A
E
A
V
-
E
---------
R
Q
----------------
L
A
E
L
-----------
P
R
A
E
T
A
-
R
Q
A
L
-
N
A
S
R
L
I
------------
V
T
----
K
D
L
A
Q
C
V
E
I
S
N
Q
Y
G
P
E
------
H
-
L
I
----
I
Q
------
T
R
N
A
R
---
E
L
V
D
S
I
-----------
T
S
A
G
S
V
F
L
G
D
W
S
P
E
S
A
G
D
Y
A
S
G
T
N
H
V
L
P
T
Y
G
Y
--
T
A
T
--
C
S
S
L
-------------
G
L
A
D
F
Q
K
R
-
M
T
V
Q
E
L
S
K
E
G
------------
F
----
S
A
L
A
S
T
I
E
T
L
A
A
A
E
R
L
T
A
H
K
N
A
V
T
L
R
------------
7
PsiBlast_PDB
76.82
40%
-68
- C4 -
-
1KAR
2
HISX_ECOLI
A:
[31-426]
-------------------------------------------------------------------
S
I
T
R
T
V
N
D
I
L
D
N
V
K
A
R
G
D
E
A
L
R
E
Y
S
A
K
F
D
K
T
---
T
V
T
A
L
K
V
S
A
E
E
I
A
A
A
S
E
R
L
S
------------------
D
E
L
K
Q
A
-
M
A
V
A
V
K
N
I
-
E
T
F
H
T
A
Q
K
L
-----
P
P
V
D
V
E
T
Q
P
G
V
R
------------
C
Q
--------------------
Q
V
T
R
P
V
A
S
V
G
L
Y
I
P
G
G
S
A
P
L
F
S
T
V
L
-
M
L
A
T
P
A
S
I
A
G
C
-----
K
K
V
V
L
----
C
S
P
P
P
I
A
D
E
---
I
L
-----
Y
A
A
Q
L
C
----
G
V
-
Q
D
V
-
F
N
V
--
G
G
A
Q
A
I
A
A
L
A
F
G
T
E
S
V
P
K
V
D
K
I
-----
F
G
P
G
N
A
F
V
T
E
-
A
K
R
Q
V
S
Q
---
R
L
D
G
A
A
I
D
M
P
---
A
---
G
P
S
E
V
L
V
-----
I
A
D
S
----
G
A
T
----
P
D
F
V
A
S
D
L
L
S
Q
A
E
-
H
---
G
-----
P
D
S
Q
-
V
I
L
L
T
P
---
A
A
--
D
-
M
-
A
R
R
V
---
A
E
A
V
-
E
---------
R
Q
----------------
L
A
E
L
-----------
P
R
A
E
T
A
-
R
Q
A
L
-
N
A
S
R
L
I
------------
V
T
----
K
D
L
A
Q
C
V
E
I
S
N
Q
Y
G
P
E
------
H
-
L
I
----
I
Q
------
T
R
N
A
R
---
E
L
V
D
S
I
-----------
T
S
A
G
S
V
F
L
G
D
W
S
P
E
S
A
G
D
Y
A
S
G
T
N
H
V
L
P
T
Y
G
Y
--
T
A
T
--
C
S
S
L
-------------
G
L
A
D
F
Q
K
R
-
M
T
V
Q
E
L
S
K
E
G
------------
F
----
S
A
L
A
S
T
I
E
T
L
A
A
A
E
R
L
T
A
H
K
N
A
V
T
L
R
------------
6
PsiBlast_PDB
76.72
40%
-68
- C4 -
-
1KAH
1
HISX_ECOLI
A:
[31-426]
-------------------------------------------------------------------
S
I
T
R
T
V
N
D
I
L
D
N
V
K
A
R
G
D
E
A
L
R
E
Y
S
A
K
F
D
K
T
---
T
V
T
A
L
K
V
S
A
E
E
I
A
A
A
S
E
R
L
S
------------------
D
E
L
K
Q
A
-
M
A
V
A
V
K
N
I
-
E
T
F
H
T
A
Q
K
L
-----
P
P
V
D
V
E
T
Q
P
G
V
R
------------
C
Q
--------------------
Q
V
T
R
P
V
A
S
V
G
L
Y
I
P
G
G
S
A
P
L
F
S
T
V
L
-
M
L
A
T
P
A
S
I
A
G
C
-----
K
K
V
V
L
----
C
S
P
P
P
I
A
D
E
---
I
L
-----
Y
A
A
Q
L
C
----
G
V
-
Q
D
V
-
F
N
V
--
G
G
A
Q
A
I
A
A
L
A
F
G
T
E
S
V
P
K
V
D
K
I
-----
F
G
P
G
N
A
F
V
T
E
-
A
K
R
Q
V
S
Q
---
R
L
D
G
A
A
I
D
M
P
---
A
---
G
P
S
E
V
L
V
-----
I
A
D
S
----
G
A
T
----
P
D
F
V
A
S
D
L
L
S
Q
A
E
-
H
---
G
-----
P
D
S
Q
-
V
I
L
L
T
P
---
A
A
--
D
-
M
-
A
R
R
V
---
A
E
A
V
-
E
---------
R
Q
----------------
L
A
E
L
-----------
P
R
A
E
T
A
-
R
Q
A
L
-
N
A
S
R
L
I
------------
V
T
----
K
D
L
A
Q
C
V
E
I
S
N
Q
Y
G
P
E
------
H
-
L
I
----
I
Q
------
T
R
N
A
R
---
E
L
V
D
S
I
-----------
T
S
A
G
S
V
F
L
G
D
W
S
P
E
S
A
G
D
Y
A
S
G
T
N
H
V
L
P
T
Y
G
Y
--
T
A
T
--
C
S
S
L
-------------
G
L
A
D
F
Q
K
R
-
M
T
V
Q
E
L
S
K
E
G
------------
F
----
S
A
L
A
S
T
I
E
T
L
A
A
A
E
R
L
T
A
H
K
N
A
V
T
L
R
------------
14
HHSearch
73.93
39%
-6
- C4 -
-
1KAE
4
HISX_ECOLI
A:
[3-428]
--------------------------------------
F
N
T
I
I
D
W
N
S
C
T
A
E
Q
Q
R
Q
L
L
-
M
R
P
A
I
S
A
S
E
S
I
T
R
T
V
N
D
I
L
D
N
V
K
A
R
G
D
E
A
L
R
E
Y
S
A
K
F
D
K
T
T
V
---
T
A
L
K
V
S
A
E
E
I
A
A
A
S
E
R
L
S
------------------
D
E
L
K
Q
A
-
M
A
V
A
V
K
N
I
-
E
T
F
H
T
A
Q
K
L
-----
P
P
V
D
V
E
T
Q
P
G
V
R
------------
C
Q
--------------------
Q
V
T
R
P
V
A
S
V
G
L
Y
I
P
G
G
S
A
P
L
F
S
T
V
L
-
M
L
A
T
P
A
S
I
A
G
C
-----
K
K
V
V
L
----
C
S
P
P
P
---
I
A
D
E
I
L
-----
Y
A
A
Q
L
C
----
G
V
-
Q
D
V
-
F
N
V
--
G
G
A
Q
A
I
A
A
L
A
F
G
T
E
S
V
P
K
V
D
K
I
-----
F
G
P
G
N
A
F
V
T
E
-
A
K
R
Q
V
S
Q
RLD
G
A
---
A
I
D
M
P
---
A
---
G
P
S
E
V
L
V
-----
I
A
D
S
----
G
A
T
----
P
D
F
V
A
S
D
L
L
S
Q
A
E
-
H
---
G
-----
P
D
S
Q
-
V
I
L
L
T
P
---
A
A
--
D
-
M
-
A
R
R
V
---
A
E
A
V
-
E
---------
R
Q
----------------
L
A
E
L
-----------
P
R
A
E
T
A
-
R
Q
A
L
N
A
S
-
R
L
I
------------
V
T
----
K
D
L
A
Q
C
V
E
I
S
N
Q
Y
G
P
E
------
H
-
L
I
----
I
Q
------
T
R
N
A
R
---
E
L
V
D
S
I
-----------
T
S
A
G
S
V
F
L
G
D
W
S
P
E
S
A
G
D
Y
A
S
G
T
N
H
V
L
P
T
Y
G
Y
--
T
A
T
--
C
S
S
L
-------------
G
L
A
D
F
Q
K
R
-
M
T
V
Q
E
L
S
K
E
G
------------
F
----
S
A
L
A
S
T
I
E
T
L
A
A
A
E
R
L
T
A
H
K
N
A
V
T
L
R
V
N
----------
33
Fugue
72.55
39%
-3
- C4 -
-
1K75
1
HISX_ECOLI
A:
[4-434]
---------------------------------------
N
T
I
I
D
W
N
S
C
T
A
E
Q
Q
R
Q
L
L
M
R
P
A
I
S
-
A
S
E
S
I
T
R
T
V
N
D
I
L
D
N
V
K
A
R
G
D
E
A
L
R
E
Y
S
A
K
F
D
K
T
---
T
V
T
A
L
K
V
S
A
E
E
I
A
A
A
S
E
R
L
S
------------------
D
E
L
K
Q
A
M
A
-
V
A
V
K
N
I
-
E
T
F
H
T
A
Q
K
L
-----
P
P
V
D
V
E
T
Q
P
G
V
R
------------
C
Q
--------------------
Q
V
T
R
P
V
A
S
V
G
L
Y
I
P
G
G
S
A
P
L
F
S
T
V
L
M
L
-
A
T
P
A
S
I
A
G
C
-----
K
K
V
V
L
----
C
S
P
P
P
---
I
A
D
E
I
L
-----
Y
A
A
Q
L
C
----
G
V
-
Q
D
V
-
F
N
V
--
G
G
A
Q
A
I
A
A
L
A
F
G
T
E
S
V
P
K
V
D
K
I
-----
F
G
P
G
N
A
F
V
T
E
-
A
K
R
Q
V
S
Q
---
R
L
---
D
G
A
A
I
D
M
P
A
---
G
P
S
E
V
L
V
-----
I
A
D
S
----
G
A
T
----
P
D
F
V
A
S
D
L
L
S
Q
A
E
-
H
---
G
-----
P
D
S
Q
-
V
I
L
L
T
P
---
A
---
A
-
D
M
A
R
R
V
---
A
E
A
V
-
E
---------
R
Q
----------------
L
A
E
L
-----------
P
R
A
E
T
A
-
R
Q
A
L
N
A
S
-
R
L
I
------------
V
T
----
K
D
L
A
Q
C
V
E
I
S
N
Q
Y
G
P
E
------
H
-
L
I
----
I
Q
------
T
R
N
A
R
---
E
L
V
D
S
I
-----------
T
S
A
G
S
V
F
L
G
D
W
S
P
E
S
A
G
D
Y
A
S
G
T
N
H
V
L
P
T
Y
G
Y
--
T
A
T
--
C
S
S
L
-------------
G
L
A
D
F
Q
K
R
M
T
V
Q
E
L
-
S
K
E
G
------------
F
----
S
A
L
A
S
T
I
E
T
L
A
A
A
E
R
L
T
A
H
K
N
A
V
T
L
R
V
N
A
L
K
E
Q
A----
35
Fugue
38.25
21%
-57
* C1 *
-
4K7J
3
?
A:
[26-375]
-----------------------------------------------------
G
L
L
T
-
D
Y
G
N
A
-
S
A
S
P
W
M
K
K
L
Q
S
V
A
-----
Q
G
S
G
E
T
F
R
I
L
Q
I
G
D
S
H
T
A
G
----------------
D
F
F
T
------------------
D
S
L
R
K
R
-
L
Q
K
T
W
G
D
G
-
G
I
-------------
G
W
V
Y
P
---
A
N
V
------------
K
G
--------------------
Q
R
M
A
A
V
R
H
N
G
N
W
Q
S
L
T
S
R
N
N
T
G
D
F
P
-
L
G
G
I
L
A
H
T
G
S
G
-----
G
S
M
T
L
----
T
A
S
D
G
I
A
S
K
Q
R
V
S
L
-----
F
A
K
P
L
L
----
A
--
E
Q
T
-
L
T
V
--
N
G
-
N
T
V
S
A
N
G
G
G
W
Q
V
L
D
T
G
A
A
L
-----
P
----
L
T
I
H
T
-
E
M
P
W
D
I
G
---
F
I
---
N
I
E
N
P
---
A
---
G
--
G
I
T
V
-----
S
A
M
G
----
I
N
G
----
A
Q
L
T
Q
W
S
K
W
R
A
D
R
-
M
---
N
-----
D
L
A
Q
-
T
---------
G
--
A
-
D
-
L
V
I
L
---
S
Y
G
T
-
N
---------
E
A
----------------
F
N
N
-------------
N
I
D
I
A
-
D
T
E
Q
K
W
L
D
T
V
R
------------
Q
I
----
R
D
S
L
P
A
A
G
I
L
I
I
G
A
P
E
------
S
-
L
K
NTLG
V
C
GTRPVR
L
T
E
V
Q
---
Q
M
Q
R
R
V
-----------
A
R
Q
G
Q
T
M
F
W
S
W
Q
-
N
A
M
G
G
I
C
S
------------------------------------
M
K
N
W
L
N
Q
-
G
W
---
A
A
K
D
G
------------
V
HFS
A
K
G
Y
R
R
A
A
E
M
L
A
--
D
S
L
E
E
L
V
R
S
A
---------------
30
HHSearch
36.63
18%
-162
- C4 -
-
5J7I
1
?
B:
[121-165]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
N
R
------------
V
W
--------------------
E
I
A
Q
P
V
G
I
V
A
G
I
I
P
S
T
N
-
P
T
S
-
T
V
I
-
F
K
A
L
I
A
V
K
A
R
N
-----
A
I
V
F
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
HHSearch
36.16
11%
-137
- C4 -
-
5VBF
2
?
B:
[133-178]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
V
M
------------
Q
T
--------------------
V
L
R
E
P
I
G
V
C
A
A
F
S
P
W
N
F
-
P
F
-
S
Q
A
M
-
H
K
I
A
A
A
L
A
S
G
C
-----
T
L
V
L
K
----
G
P
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
32
HHSearch
32.71
19%
-129
- C4 -
-
3K9D
-
?
B:
[98-145]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
E
K
K
------------
V
M
--------------------
E
V
A
V
P
L
G
V
V
A
G
L
I
P
S
T
N
-
P
T
-
S
T
V
I
-
Y
K
T
L
I
S
I
K
A
G
N
-----
S
I
V
F
S
----
P
H
P
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
31.54
29%
-72
* C2 *
-
3T90
-
GNA1_ARATH
A:
[7-58]
--------------------------------------
I
R
K
L
E
I
S
D
K
--
R
K
G
F
I
E
L
L
-
G
Q
L
T
V
-
T
G
S
V
T
D
E
E
F
D
R
R
F
E
E
I
R
S
Y
G
D
D
H
V
I
C
V
I
E
E
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
37
Fugue
30.25
15%
-8
- C4 -
-
1AD3
1
AL3A1_RAT
A:
[2-447]
----------------------------------------------------------------------------------
S
I
S
D
T
V
K
R
A
R
E
A
F
N
S
G
-
K
T
R
--
S
L
Q
F
R
I
Q
Q
L
E
A
L
Q
R
M
I
N
------------------
E
N
L
K
S
I
-
S
G
A
L
A
S
D
L
G
K
N
E
W
T
S
Y
Y
E
-----
E
V
A
H
V
L
E
E
L
D
T
T
------------
I
K
E
LPDWA
E
D
E
P
V
A
K
T
RQTQQ
D
D
L
Y
I
H
S
E
P
L
G
V
V
L
V
I
G
A
W
N
Y
P
F
N
L
T
-
I
Q
P
M
V
G
A
V
A
A
G
-----
N
A
V
I
L
KPSE
V
S
G
H
M
A
D
L
L
A
T
L
I
P
-----
Q
Y
-
M
D
Q
----
N
L
-
Y
L
V
-
V
K
G
--
G
-
V
P
E
T
T
E
L
L
K
E
-----
R
F
D
H
I
M
Y
T
G
S
T
A
V
G
K
I
V
M
A
A
-
A
A
K
-
H
L
T
---
P
V
---
T
L
E
L
----
G
---
G
K
S
P
C
Y
V
D
KDCD
L
D
V
A
----
C
R
R
----
I
A
W
G
K
F
M
N
S
G
Q
T
C
-
V
---
A
-----
P
D
Y
I
-
L
C
D
P
S
I
---
Q
N
--
Q
-
I
-
V
E
K
L
---
K
K
S
L
-
K
---------
D
F
YGEDAKQSRD
Y
G
R
I
IN
D
R
H
F
-----------
Q
R
V
K
G
L
-
I
D
-----
N
Q
K
V
------------
A
H
GGTW
D
Q
S
------
S
R
Y
I
A
P
T
------
I
-
L
V
----
D
V
------
D
P
Q
S
P
---
V
M
Q
E
E
I
FGP
V
M
P
I
V
C
V
R
S
L
E
E
A
I
Q
F
I
N
Q
R
E
K
P
L
A
L
Y
V
F
S
N
N
E
K
V
I
K
K
M
I
--
A
E
T
--
S
S
G
G
-------------
V
T
A
N
D
V
I
V
-
H
I
T
V
P
T
L
P
F
G
G
V
GNS
G
M
G
A
Y
H
G
K
----
K
S
F
E
T
F
S
H
R
R
S
C
L
V
K
S
L
L
N
E
E
A
H
K
A
R
Y
P
PSPA------
36
Fugue
29.96
12%
-15
- C4 -
-
1EZ0
1
ALDH_VIBHA
A:
[5-508]
-------------------------------------
T
D
N
V
F
Y
A
T
N
A
F
T
G
E
A
L
P
--
L
-
A
F
P
V
H
-
T
E
V
E
V
N
Q
A
A
T
A
A
A
K
V
A
R
D
F
R
R
L
N
N
S
K
R
A
S
L
L
R
T
I
A
S
E
L
E
A
R
S
D
D
I
I
A
R
A
H
L
E
T
A
L
P
E
------------------
V
R
L
T
G
E
-
I
A
R
T
A
N
Q
L
-
R
L
F
A
D
V
V
N
S
-----
G
S
Y
H
Q
A
I
L
D
T
P
N
PTRAP
L
P
K
P
D--
I
R
--------------------
R
Q
Q
I
A
L
G
P
V
A
V
F
G
A
S
N
F
P
L
A
F
S
A
A
G
-
G
D
T
A
S
A
L
A
A
G
C
-----
P
V
I
V
K
GHT-
A
H
P
G
T
S
Q
I
V
A
E
C
I
E
-----
Q
A
L
K
Q
E
----
Q
L
P
Q
A
I
-
F
T
L
L
Q
G
N
Q
R
A
L
G
Q
A
L
V
S
H
P
E
I
K
A
V
-
G
F
-----
T
G
S
V
G
G
G
R
A
L
-
F
N
L
A
H
E
R
---
P
E
---
P
I
P
F
Y
---
G
ELG
A
I
N
P
T
F
I
-----
F
P
S
A
----
M
R
A
----
K
A
D
L
A
D
Q
F
V
A
S
M
T
-
M
---
G
CGQFC
T
K
P
G
-
V
V
F
A
L
N
T
P
E
T
Q
--
A
-
F
-
I
E
T
A
---
Q
S
L
I
-
R
Q
Q
S
P
S
T
L
LT
P
G
----------------
I
R
D
S
-----------
Y
Q
S
Q
V
V
-
S
R
G
S
D
D
G
I
D
V
T
F
S
Q
AESP
C
V
A
S
A
L
F
----
V
T
S
S
E
N
W
R
K
H
P
A
W
E
E
E
I
F
G
P
Q
S
L
-
I
V
----
V
C
------
E
N
V
A
D
---
M
L
S
L
S
E
-----------
M
L
A
G
S
L
T
A
T
I
H
A
T
E
E
D
Y
P
Q
V
S
Q
L
I
P
R
L
E
E
I
A
G
--
R
L
V
--
F
N
G
W
PTGVEVGYAMVHG
G
P
Y
P
A
S
T
H
-
S
A
S
T
S
V
G
A
E
A
------------
I
----
H
R
W
L
R
P
V
A
Y
Q
A
L
P
E
S
L
L
P
D
S
L
K
A
E
N
P
L
E
I
A
R
A
V
DGKAA
34
Fugue
29.44
22%
14
- C1 -
-
4ZLA
1
AMPA_HELPY
A:
[7-502]
M
L
K
I
K
L
E
KTTFENAKAE
C
S
L
V
F
I
I
NKDFSHAWVKN
K
E
L
L
E
T
F
K
Y
E
G
E
G
V
F
L
D
Q
E
N
K
I
-
L
Y
A
G
V
-
K
E
D
D
V
H
L
L
R
E
S
A
C
L
A
V
R
T
L
K
K
L
A
F
K
S
V
K
V
G
V
Y
T
C
G
A
H
-----
N
A
L
L
E
N
L
K
A
L
F
L
G
L
K
L
GLYEYDTFKSN
K
K
E
S
VL
K
E
A
I
V
A
-
L
E
L
H
K
S
L
E
-
K
S
A
K
E
A
L
K
Y
A
E
I
M
T
E
S
L
N
I
V
K
D
L
V
N
T
PPMIGT
P
V
Y
M
A
E
V
A
--------------------
Q
K
V
A
K
E
N
H
L
E
I
H
V
H
D
--
E
K
F
L
E
E
K
K
-
M
N
A
F
L
A
V
N
K
A
S
LSV
N
P
P
R
L
I
H
----
L
V
Y
K
P
K
K
A
K
K
K
I
A
L
-----
V
G
K
G
L
T
YDCG
G
L
-
S
L
K
-
P
A
D
--
Y
M
V
T
M
K
A
D
K
G
G
G
S
A
V
I
G
L
L
N
A
L
-----
A
K
L
G
V
E
A
E
V
H
-
G
I
I
G
A
T
E
---
N
M
---
I
G
P
A
A
---
Y
---
K
P
D
D
I
L
I
-----
S
K
E
G
K
S
I
E
V
R
N
TDAE
G
R
L
V
L
A
D
C
L
S
Y
A
Q
D
L
---
N
-----
P
D
V
I
-
V
D
F
A
T
L
---
T
G
--
A
-
C
-
V
V
G
L
GEF
T
S
A
I
-
M
---------
G
H
-----------------
N
E
E
-----------
L
K
N
L
F
E
-
T
S
G
L
E
S
G
E
L
L
A
------------
K
L
----
P
F
N
R
H
L
K
K
L
I
E
S
K
I
A
-------------------------
D
V
C
---
N
I
S
S
S
------------
R
Y
G
G
A
I
T
A
G
L
F
L
N
E
F
I
R
D
E
F
K
D
K
W
L
H
I
D
I
A
G
P
--
A
Y
V
--
E
K
E
W
-------------
D
V
N
S
F
--------
G
A
S
G
A
G
------------
V
----
R
A
C
T
A
F
V
E
E
L
L
K
K
A
------------------------
17
HHSearch
25.74
15%
-17
* C4 *
-
2H5G
-
P5CS_HUMAN
B:
[131-434]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
L
E
------------
L
E
--------------------
Q
V
T
V
P
I
G
V
L
L
V
I
F
E
S
R
--
P
D
C
L
P
---
Q
V
A
A
L
A
I
A
S
G
N
-----
G
L
L
L
K
----
G
G
K
E
A
A
--
H
S
N
R
I
L
H
L
L
T
Q
E
A
L
S
I
H
----
G
V
-
K
E
A
V
Q
L
V
--
N
T
R
E
E
V
E
-------
L
D
K
M
I
D
L
I
-----
I
P
R
G
S
S
Q
L
V
R
D
I
Q
K
A
A
K
G
I
--
P
V
---
M
-
G
H
S
---
E
---
G
I
C
H
--
M
-----
Y
V
D
S
----
E
A
S
----
V
D
K
V
T
R
L
V
R
D
S
K
C
-
E
YPA
A
-----
C
N
A
L
E
T
L
L
I
H
R
---
D
L
LR
T
P
L
-
F
D
Q
I
---
I
D
M
L
R
V
---------
E
Q
----------------
V
K
I
H
A
G
P
K
F
A
S
Y
LTF--
V
K
S
L
R
T
E
Y
G
D
L
E
L
C
I
E
------------
V
V
----
D
N
V
Q
D
A
I
D
H
I
H
K
Y
G
S
S
------
H
T
D
V
----
I
V
------
T
E
D
E
N
T
A
E
F
F
L
Q
H
V
------------
D
S
A
C
V
F
W
N
A
S
T
R
F
S
D
G
Y
----
R
F
G
L
G
A
E
V
G
I
ST
S
R
I
HA
R
G
P
V
-------------
G
L
E
G
L
L
T
T
-
K
W
L
L
R
G
-----------------------------------------------------------