@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 : gbs1364: (2015-12-07 )
MYSGKKAIVFSLFGIAFGYFCHRMILLYDSLPNQPPIEKIAYLFSDGQKVLMQQPWEFGFTKRSLLAFVSGFLSMCLVYLYVSTGQKIYREGAEYGSARFGTRKEKRFFYSKNPFNDTILAQDVRLTLLEKKSPKFDRNKNLIVIGGSGAGKTFRFVKANLIQLNCSNIVVDPKDHLAEKTGKLFLENGYQVKVLDLVNMTNSDGFNPFRYVETENDLNRTLTVYFNNTKGTGSRSDPFWDEASMTLVRAIASYLVDFYNPPGSAKEEAEQRRKRGCYPAFSEIGKLIKLLSKGDNQDKSVLEVMFEEYAKKYGTENFTMRNWADFQNYKDKTLDSVIAVTTAKFALFNIQSVIDVTKRDTLDLKTWGTQKTMVYLVIPDNDTTFRFLSALFFSTVFSTLTRQADVDFKGKLPIHVRSYLDEFPNIGEIPDFAEQTSTVRSRNMSLVPILQNIAQLQGLYKEKEAWKTILGNCDSLLYLGGNDEETFKFMSALLGKQTIDVRNTSRSFGQTGSGSLSHQKIARDLMTPDEVGRMRRDECLVRIAGVPVFRSKKYLPTRHKNWKLLAEKETDDRWCHYHINPLSHDEPLDLFDHKMRDLTAETTLH
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...-
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MYSGKK
A
I
V
F
S
L
F
G
I
A
F
G
Y
F
C
H
R
M
I
L
L
Y
DSLPNQP
P
I
E
K
I
A
Y
L
F
SD
G
Q
K
V
L
M
QQPWEFGF
T
K
R
S
L
L
A
F
V
S
-
G
F
L
S
M
C
L
V
Y
L
Y
VST
G
Q
K
I
Y
R
E
G
AEY---GSARFGTRK
E
K
R
----
F
FYSKNPFN
D
T
I
L
--
A
Q
D
V
R
L
T
LLEKKSPKFDRNK
N
L
I
V
I
--G--GSGAG
K
T
F
R
F
--
V
-
K
A
N
L
I
Q
-
L
NC
S
N
-----
I
V
-VD
P
K
D
H
L
A
E
---
K
TG
K
L
F
LENG
Y
Q
V
K
V
L
D
L
V
NMTNSDGFN
P
F
R
Y
V
ETENDLN
R
T
L
T
V
Y
F
NNTKGTGSRSDPFW
D
E
A
S
M
T
L
V
R
A
I
A
S
-----
Y
L
V
D
FY-NPPGS
A
K
E
E
A
E
Q
R
R
KRGC
Y
P
A
F
S
E
I
G
K
L
I
K
L
L
SKGDNQ
D
K
S
V
L
E
V
M
F
E
E
Y
A
-----
K
K
YGTENFTMRN
W
A
D
F
QNY
K
D
K
--
T
L
D
S
V
I
A
V
T
T
A
K
F
-
A
L
F
N
I
Q
S
V
I
DVTK--RD
T
L
D
L
KTWGTQ--
K
T
M
V
----
Y
-
L
V
I-PDN-
D
T
T
F
R
F
L
S
A
L
F
-----
F
S
T
V
F
S
T
L
T
RQADVDFKGKLP
I
H
V
R
S
Y
L
D
EFPNIGEIP
D
F
A
E
Q
T
S
T
V
RSR-NM--
S
L
V
P
I
L
Q
N
I
A
Q
L
Q
G
L
Y
K
-
E
K
E
A
W
K
T
I
LGNCD
S
L
-
L
Y
LGG--N--
D
E
E
T
F
K
F
M
S
A
L
LGK
Q
-
T
I
D
VRNTSRSFGQTGSGS--
L
S
H
Q
K
I
A
R
D
LM
T
P
D
E
V
G
R
M
R
R
D
E
C
L
V
R
IAGVPVFRSKKY-----LPTRHK
N
W
K
L
L
A
EKETDD
R
--
W
C
----
H
Y
HINPLSHDEP
L
D
L
F
D
H
K
M
R
D
LTAETTLH-
40
Fugue
78.56
17%
-47
* C6 *
1E9R
2
?
A:
[4-436]
------------------------------------------------------------------------------------
V
G
Q
G
------
E
F
---
G
G
A
P
F
K
R
F
L
R
G
T
----
R
I
V
S
G
G
K
L
K
R
M
T
R
--
E
K
A
K
Q
V
T
V
A
G
V
P
M
P
R
D
A
E
P
R
H
L
L
V
N
--
G
A
T
G
T
G
K
S
V
L
L
R
E
--
L
-
A
Y
T
G
L
L
-
R
G
D
R
M
-----
V
I
-
V
D
P
N
G
D
M
L
S
---
K
F
G
R
------
D
K
D
I
I
L
N
P
Y
D
-
Q
R
T
K
G
W
S
F
F
N
E
I
R
N
D
Y
D
W
Q
R
Y
A
L
S
V
V
P
R
G
K
---
T
D
E
A
E
E
W
A
S
Y
G
R
L
L
L
R
E
T
A
K
-----
K
L
A
L
I
G
-
T
P
S
------------------------
M
R
E
L
F
H
W
T
T
I
A
T
F
D
D
L
R
G
F
L
E
--------------
G
T
L
A
E
S
L
F
A
G
S
N
E
A
S
K
--
A
L
T
S
A
R
F
V
L
S
D
K
L
-
P
E
H
V
T
---
M
P
D
G
D
--
F
S
I
R
S
W
L
E
D
P
N
G
--
G
N
L
F
----
I
-
T
W
R
-
E
D
M
-
G
P
A
L
R
P
L
I
S
A
W
-----
V
D
V
V
C
T
S
I
L
S
L
P
E
-----
E
P
K
R
R
L
W
L
F
I
D
E
L
A
S
L
E
K
L
A
S
L
A
D
A
L
T
K
G
R
K
A
-
G
L
--
R
V
V
A
G
L
Q
S
T
S
Q
L
D
D
V
Y
G
--
V
K
E
A
Q
T
L
R
A
S
F
R
S
L
-
V
V
L
G
G
SR
T
--
D
P
K
T
N
E
D
M
S
L
S
L
G
E
H
-
E
V
E
R
D
R
---------------
A
L
E
R
V
R
E
R
V
V
M
P
A
E
I
A
N
L
P
D
L
T
A
Y
V
G
F
A
G
N
R
P
I
A
K
V
P
L
-----
E
I
K
Q
F
A
N
R
Q
P
A
F
V
E
G
T
------------------------------------------
17
HHSearch
77.90
16%
-57
- C6 -
1E9R
2
?
A:
[17-429]
----------------------------------------------------------------------------------------------
F
L
---
R
G
T
R
I
V
S
G
G
K
L
K
----
R
M
T
R
E
K
A
-
K
Q
----------
V
T
V
A
G
V
P
M
P
R
D
A
E
P
R
H
L
L
V
N
--
G
--
A
T
G
T
G
K
S
V
L
L
R
E
L
-
A
Y
T
G
L
L
-
R
G
D
R
M
-----
V
I
-
V
D
P
N
G
D
M
L
S
---
K
F
G
R
------
D
K
D
I
I
L
N
P
Y
D
Q
-
R
T
K
G
W
S
F
F
N
E
I
R
N
D
Y
D
W
Q
R
Y
A
L
S
V
V
P
R
G
---
K
T
D
E
A
E
E
W
A
S
Y
G
R
L
L
L
R
E
T
A
K
-----
K
L
A
L
I
G
-------------------
T
P
S
M
R
E
L
F
H
W
T
T
I
A
T
---------
F
D
D
L
R
G
F
L
E
-----
G
T
-----
L
A
E
S
L
F
A
-----
G
S
N
--
E
A
S
K
A
L
T
S
A
R
F
-----
V
L
S
D
K
L
P
E
H
V
T
MP
D
G
D
F
S
I
R
S
W
L
E
D
PN
G
G
N
L
----
F
-
I
T
W
-
R
E
D
M
G
P
A
L
R
P
L
I
S
A
W
-----
V
D
V
V
C
T
S
I
L
S
L
P
E
-----
E
P
K
R
R
L
W
L
F
I
D
E
L
A
S
L
E
K
L
A
S
L
A
D
A
L
T
K
G
R
K
A
-
G
L
--
R
V
V
A
G
L
Q
S
T
S
Q
L
D
D
V
Y
G
-
V
K
-
E
A
Q
T
L
R
A
S
F
R
S
L
-
V
V
L
G
G
--
S
RT
D
P
K
T
N
E
D
M
S
L
S
L
G
E
H
-
E
V
E
R
D
---------------
R
A
L
E
R
V
R
E
R
V
V
M
P
A
E
I
A
N
L
P
D
L
T
A
Y
V
G
F
A
G
N
R
P
I
A
K
V
P
L
-----
E
I
K
Q
F
A
N
R
Q
P
A
F
V
E
G
T
------------------------------------------
44
Fugue
71.50
21%
-26
* C4 *
2ZB6
2
HEMA_MEASE
A:
[12-462]
--
V
A
A
E
E
L
M
N
A
L
-----------------
S
K
G
N
C
S
G
P
T
T
I
R
G
Q
F
S
N
M
S
L
S
L
L
D
L
Y
L
G
R
G
Y
N
V
S
S
I
V
T
M
T
S
Q
G
M
Y
G
G
T
Y
L
V
E
K
P
N
L
S
Q
L
S
M
Y
R
V
F
E
V
---
G
V
I
R
-
N
P
G
L
G
A
P
----
V
F
H
M
T
N
Y
L
E
Q
P
V
S
ND
L
S
N
C
M
V
A
L
G
E
L
K
L
A
A
L
C
H
G
E
D
S
I
T
I
P
Y
Q
--
G
S
G
K
G
V
S
F
Q
L
--
V
-
K
L
G
V
W
K
------------------------------------------------------------
S
P
T
D
M
Q
S
W
V
P
L
---------
S
T
D
D
P
V
I
D
R
L
Y
L
S
S
H
R
G
V
I
A
-----
D
N
Q
A
K
W
-
A
V
P
T
T
R
T
D
--
D
K
L
R
M
E
T
C
F
Q
Q
A
C
K
-
G
K
I
Q
A
L
C
E
N
P
E
------
W
A
P
L
K
D
N
R
I
-----
P
S
Y
G
V
L
S
V
D
L
----------
S
L
--
T
V
E
L
K
I
K
I
A
S
G
F
G
-
P
L
I
T
H
G
S
G
M
D
L
Y
K
-----------
S
N
H
--
N
N
V
Y
----
W
-
L
T
I
-
P
----------------------------------
P
M
K
N
L
A
L
G
V
I
N
T
L
E
W
I
P
R
F
------------
K
V
S
P
-
Y
L
--
F
T
V
P
I
--------------
K
E
A
G
----
G
D
C
H
A
P
-
T
Y
L
P
A
--
E
--
V
D
G
D
V
K
L
S
S
N
L
V
I
-----------------------
L
P
G
Q
D
L
Q
Y
V
L
A
T
Y
D
T
S
R
V
E
H
A
V
V
Y
Y
V
Y
S
P
S
----
R
S
F
S
Y
F
YPF
R
L
P
I
K
G
V
P
I
E
L
Q
V
E
C
F
T
W
D
Q
K
L
W
C
----
R
H
F
C
V
L
A
D
S
E
S
G
G
H
I
T
H
S
G
M
V
G
M
G
V
S
C
T
---
49
Fugue
69.33
17%
-14
- C2 -
2BMF
-
?
A:
[169-618]
---------------------------
M
A
S
I
E
D
N
P
E
I
E
D
--
D
I
F
R
K
K
R
L
T
I
M
D
L
H
P
G
A
G
K
T
K
R
Y
L
P
A
I
V
R
-
E
A
I
K
R
G
L
R
T
L
I
L
A
P
T
R
V
V
A
A
E
M
E
E
A
L
RG
L
P
I
R
Y
Q
T
G
R
E
I
V
----
D
L
M
C
H
A
T
F
T
M
R
L
L
--------------
S
P
I
R
V
P
N
Y
N
L
I
I
M
--
D
--
E
A
---------------------------------------------------------------
H
F
T
D
P
A
S
I
A
A
R
G
Y
I
S
T
R
V
E
M
G
E
A
A
G
I
F
M
T
A
T
P
P
G
S
R
D
P
F
P
Q
S
N
A
P
I
M
D
E
E
R
E
I
P
-----------------------
E
R
S
W
N
S
G
H
E
W
V
T
D
F
K
G
K
T
V
W
F
V
P
-
S
I
K
A
G
N
D
I
A
A
C
L
R
K
N
G
K
-----
K
V
I
Q
L
S
R
K
T
F
D
S
--
E
Y
I
K
T
R
T
N
--
D
W
D
F
V
V
T
T
D
I
S
E
M
G
A
N
F
K
A
E
R
V
I
D
P
R
R
--
C
M
K
P
V
I
L
T
D
G
E
E
--
R
V
I
L
----
A
-
G
P
M
-
P
--------------------------
V
T
H
S
S
A
A
Q
R
R
G
R
V
G
R
N
P
K
N
E
N
D
Q
Y
I
Y
M
G
E
P
L
E
N
D
E
D
C
A
H
W
K
E
A
-
K
M
--
L
L
D
N
I
N
T
P
E
G
I
I
P
S
M
F
E
-
P
E
---
R
E
K
V
D
A
I
D
G
E
-
Y
R
L
R
G
--
E
--
A
R
K
T
F
V
D
L
M
R
---------------------
R
G
D
--
L
P
-
V
W
L
A
Y
R
V
A
A
E
G
-----------------
I
N
Y
A
D
R
R
W
-----
C
F
D
G
V
K
N
N
Q
I
L
E
E
N
V
E
V
E
I
--
W
T
KE
G
E
R
K
K
L
K
P
R
W
L
D
A
R
I
Y
S
D
P
L
A
L
K
E
F
K
E
F
A
A
G
R
K
42
Fugue
63.53
19%
-49
- C6 -
4C1N
2
?
A:
[1-442]
-----
G
L
T
G
L
E
I
Y
K
H
L
P
K
K
N
C
K
E
C
--------
G
Q
P
T
C
L
A
F
A
M
Q
I
A
A
G
K
A
G
L
D
A
C
P
Y
V
S
D
E
A
K
E
L
L
E
S
A
S
A
-
P
P
V
A
L
----
I
K
V
G
K
G
E
K
V
L
E
I
G
H
E
T
---
V
L
F
R
H
D
K
R
F
E
H
P
C
G
L
A
I
L
V
E
D
T
L
S
E
G
E
I
K
--
E
R
V
E
K
I
N
K
L
V
F
D
R
V
G
Q
M
H
S
V
N
L
V
A
L
K
-
G
--
S
S
Q
D
A
A
T
F
A
K
--
A
-
V
A
T
A
R
E
-
V
T
D
L
P
-----
F
I
-
L
I
G
T
---
P
E
---
Q
L
A
A
A
L
E
T
E
G
A
N
N
P
L
L
Y
A
A
T
A
D
N
-----
Y
E
Q
M
V
E
L
A
K
K
Y
N
V
P
L
T
V
S
A
K
G
------------
L
D
A
L
A
E
L
V
Q
K
I
T
A
L
GYKN
L
I
L
D
P
Q
P
E
N
I
S
E
G
L
F
Y
Q
T
Q
I
R
R
L
A
I
K
K
L
F
R
P
F
G
Y
P
T
I
A
F
A
L
D
E
N
P
Y
Q
A
V
M
E
A
--
S
V
Y
I
-----
A
K
Y
A
-----------------------
G
I
I
V
L
N
T
V
---
E
P
A
D
I
L
P
L
I
T
L
R
L
--
N
I
Y
T
D
P
Q
K
P
I
A
V
--
E
P
K
V
----
Y
-
E
I
L
N
P
G
P
-
D
------
A
P
V
F
-----
I
T
T
N
F
S
L
T
Y
F
C
V
A
G
D
V
E
G
A
----------------
R
I
P
--------------
A
--
Y
I
L
P
V
-------------------------
D
T
-----
D
G
------------
T
S
V
L
T
A
W
A
----------------
A
G
K
--
F
T
P
E
K
I
A
Q
F
L
K
E
S
G
I
A
E
K
V
N
H
R
K
A
I
L
-
P
G
G
V
A
V
L
S
G
K
L
Q
-----
E
L
S
---
G
W
E
I
L
V
----------------------
G
P
R
E
S
S
G
I
N
S
F
I
K
Q
R
W
--------
41
Fugue
62.03
13%
-24
- C6 -
4AG6
3
?
A:
[3-385]
-------------------------------------------------------------------------------------------------------
S
G
I
N
D
G
S
G
----
I
V
L
G
K
D
R
D
G
G
L
V
L
--
V
-----
D
I
W
K
R
G
G
D
R
--
T
N
S
N
W
T
I
L
--
A
--
K
P
G
A
G
K
S
F
T
A
--
K
M
L
L
L
R
E
Y
M
Q
G
S
R
V
-----
I
I
-
I
D
P
E
R
E
Y
K
E
M
C
R
K
L
G
G
V
W
I
N
C
T
G
G
E
G
K
I
N
P
L
Q
V
R
L
R
P
Q
S
P
L
A
L
H
I
Q
T
L
R
T
F
F
S
L
Y
L
-----------------
R
D
L
T
D
T
E
K
A
A
L
E
D
-----
A
L
V
E
V
Y
-
K
E
A
G
I
T
W
D
T
D
P
R
G
V
P
N
D
K
W
P
T
V
K
E
L
Y
E
Y
C
V
K
K
A
E
E
N
P
E
T
Y
G
R
L
S
V
L
L
K
R
A
A
-----
E
--
G
A
D
S
Y
L
W
A
G
P
T
A
V
E
A
D
S
D
F
--
I
V
F
D
V
H
D
L
Q
N
A
E
D
-
Q
V
K
R
A
Q
Y
F
N
V
L
S
F
--
A
W
N
I
L
E
R
D
R
R
E
R
--
T
V
L
V
V
D
EA
W
M
L
V
D
-
P
Q
T
-
P
Q
A
I
A
F
L
R
D
T
S
K
R
I
R
K
Y
N
G
S
L
I
V
I
S
Q
N
V
I
D
F
L
A
P
E
V
Q
R
Y
G
Q
A
L
L
D
N
P
T
Y
K
L
L
L
A
Q
G
E
K
D
L
E
A
I
T
T
L
M
N
L
S
E
A
E
H
D
L
L
V
N
A
K
R
G
E
G
L
F
V
A
G
T
Q
R
I
H
I
K
I
E
A
A
P
Y
E
M
Q
Y
--------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
61.14
25%
-46
- C5 -
1GL7
1
?
A:
[284-411]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
I
D
E
L
A
S
L
E
K
L
A
S
L
A
D
A
L
T
K
G
R
K
A
-
G
L
--
R
V
V
A
G
L
Q
S
T
S
Q
L
D
D
V
Y
G
-
V
K
E
A
-
Q
T
L
R
A
S
F
R
S
L
-
V
V
L
G
G
--
S
RT
D
P
K
T
N
E
D
M
S
L
S
L
G
E
H
-
E
V
E
R
D
------------------
E
R
V
R
E
R
V
V
M
P
A
E
I
A
N
L
P
D
L
T
A
Y
V
G
F
A
G
N
R
P
I
A
K
V
P
L
-----
E
I
K
Q
F
A
N
R
Q
P
A
F
V
E
--------------------------------------------
8
PsiBlast_PDB
61.01
25%
-47
- C5 -
1E9R
-
?
A:
[284-411]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
I
D
E
L
A
S
L
E
K
L
A
S
L
A
D
A
L
T
K
G
R
K
A
-
G
L
--
R
V
V
A
G
L
Q
S
T
S
Q
L
D
D
V
Y
G
-
V
K
E
A
-
Q
T
L
R
A
S
F
R
S
L
-
V
V
L
G
G
--
S
RT
D
P
K
T
N
E
D
M
S
L
S
L
G
E
H
-
E
V
E
R
D
---------------
R
A
L
E
R
V
R
E
R
V
V
M
P
A
E
I
A
N
L
P
D
L
T
A
Y
V
G
F
A
G
N
R
P
I
A
K
V
P
L
-----
E
I
K
Q
F
A
N
R
Q
P
A
F
V
E
G
T
------------------------------------------
12
PsiBlast_PDB
60.81
25%
-45
- C5 -
1GL6
3
?
A:
[283-410]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
I
D
E
L
A
S
L
E
K
L
A
S
L
A
D
A
L
T
K
G
R
K
A
-
G
L
--
R
V
V
A
G
L
Q
S
T
S
Q
L
D
D
V
Y
G
-
V
K
E
A
-
Q
T
L
R
A
S
F
R
S
L
-
V
V
L
G
G
--
S
RT
D
P
K
T
N
E
D
M
S
L
S
L
G
E
H
-
E
V
E
R
D
----------------
A
L
E
R
V
R
E
R
V
V
M
P
A
E
I
A
N
L
P
D
L
T
A
Y
V
G
F
A
G
N
R
P
I
A
K
V
P
L
-----
E
I
K
Q
F
A
N
R
Q
P
A
F
V
E
G
T
------------------------------------------
9
PsiBlast_PDB
60.48
25%
-48
- C5 -
1E9S
-
?
A:
[354-481]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
I
D
E
L
A
S
L
E
K
L
A
S
L
A
D
A
L
T
K
G
R
K
A
-
G
L
--
R
V
V
A
G
L
Q
S
T
S
Q
L
D
D
V
Y
G
-
V
K
E
A
-
Q
T
L
R
A
S
F
R
S
L
-
V
V
L
G
G
--
S
RT
D
P
K
T
N
E
D
M
S
L
S
L
G
E
H
-
E
V
E
R
D
R
Y
S
K
-----------
R
A
L
E
R
V
R
E
R
V
V
M
P
A
E
I
A
N
L
P
D
L
T
A
Y
V
G
F
A
G
N
R
P
I
A
K
V
P
L
-----
E
I
K
Q
F
A
N
R
Q
P
A
F
V
E
G
T
I
-----------------------------------------
10
PsiBlast_PDB
57.80
25%
-53
- C5 -
1GKI
2
?
A:
[284-411]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
I
D
E
L
A
S
L
E
K
L
A
S
L
A
D
A
L
T
K
G
R
K
A
-
G
L
--
R
V
V
A
G
L
Q
S
T
S
Q
L
D
D
V
Y
G
-
V
K
E
A
-
Q
T
L
R
A
S
F
R
S
L
-
V
V
L
G
G
--
S
RT
D
P
K
T
N
E
D
M
S
L
S
L
G
E
H
-
E
V
E
R
D
----------------
A
L
E
R
V
R
E
R
V
V
M
P
A
E
I
A
N
L
P
D
L
T
A
Y
V
G
F
A
G
N
R
P
I
A
K
V
P
L
-----
E
I
K
Q
F
A
N
R
Q
P
A
F
V
E
G
T
------------------------------------------
46
Fugue
53.94
17%
-27
- C4 -
4ZFV
4
?
A:
[10-445]
-----
N
V
L
D
F
T
V
L
G
L
N
S
G
T
S
M
D
G
I
D
C
A
L
C
H
F
Y
Q
K
T
P
D
A
P
M
E
F
E
L
L
E
Y
G
E
V
P
L
A
Q
P
I
K
Q
R
V
-
M
R
M
I
L
E
D
T
T
-
S
--
P
S
E
L
S
E
V
N
V
I
L
G
E
H
F
A
D
A
V
R
Q
F
---
A
A
E
R
N
V
D
L
S
T
--------------
I
D
A
I
A
--
S
H
G
Q
T
I
W
L
L
S
M
P
E
E
G
Q
V
K
S
A
L
T
M
A
E
--
G
--
A
I
L
A
S
R
T
---------------
G
I
T
S
-----
I
T
D
F
R
I
S
D
Q
A
A
G
---
R
Q
G
------
A
P
L
I
A
F
F
D
A
L
L
L
H
H
P
---
T
K
L
R
A
C
Q
---
N
I
G
G
I
A
N
V
C
F
I
P
P
D
V
D
G
R
R
T
D
E
Y
---------------------
Y
D
F
D
-
T
G
P
G
N
V
F
I
D
A
V
V
R
H
F
T
N
G
E
Q
E
Y
D
K
D
G
---
A
M
G
K
R
G
K
V
D
Q
E
L
V
D
D
F
L
K
M
P
Y
F
QLDPP
K
T
T
G
R
E
V
F
R
D
T
L
A
H
D
L
I
R
R
A
E
A
K
G
L
S
P
D
D
I
V
A
T
T
T
R
I
-
T
A
---
Q
A
I
V
D
H
Y
R
--
R
Y
A
P
S
-----------------------
Q
E
I
-
D
E
I
F
M
C
G
G
G
A
Y
-----
N
P
N
I
V
E
F
I
Q
Q
S
-------------------
Y
P
N
T
----------------------------
K
I
M
M
L
D
E
A
---------
G
V
P
A
G
A
K
E
A
-
I
T
F
A
----------
W
Q
G
M
E
A
L
V
G
R
S
I
P
V
P
T
R
V
E
T
R
Q
H
Y
V
L
G
K
V
S
P
G
L
N
Y
R
S
V
M
K
K
G
M
A
F
G
G
D
A
Q
--------
Q
L
P
W
V
S
E
M
I
V
K
K
K
-----
G
K
V
I
T
N
N
W
A
G
S
H
---------------
H
H
H
----------------------------
6
PsiBlast_PDB
41.28
33%
27
- C5 -
3FMP
1
DD19B_HUMAN
B:
[112-186]
--------------------------------------------------------------------------------------------------------------------------
F
N
R
P
S
K
--
I
Q
E
N
A
L
P
L
M
L
A
E
P
P
Q
-----
N
L
I
A
Q
--
S
--
Q
S
G
T
G
K
T
A
A
F
--
V
-
L
A
M
L
S
Q
-
V
E
P
A
N
KYPQ
C
L
C
-
L
S
P
T
Y
E
L
A
L
---
Q
T
G
K
V
I
E
Q
M
G
K
F
Y
P
E
L
K
L
A
Y
A
V
R
G
N
K
L
E
R
G
Q
K
I
S
E
Q
I
V
I
G
T
P
G
T
V
L
D
W
C
S
K
L
K
F
I
D
P
K
K
I
K
V
F
V
L
D
E
A
D
V
M
I
A
T
-----
Q
G
H
Q
D
Q
-
S
I
R
I
Q
R
M
L
P
R
N
C
Q
M
L
L
F
S
A
T
F
E
D
S
V
W
K
F
A
Q
K
V
V
P
D
P
N
V
I
K
L
K
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
40.94
33%
27
- C5 -
3FMO
1
DD19B_HUMAN
B:
[112-186]
--------------------------------------------------------------------------------------------------------------------------
F
N
R
P
S
K
--
I
Q
E
N
A
L
P
L
M
L
A
E
P
P
Q
-----
N
L
I
A
Q
--
S
--
Q
S
G
T
G
K
T
A
A
F
--
V
-
L
A
M
L
S
Q
-
V
E
P
A
N
KYPQ
C
L
C
-
L
S
P
T
Y
E
L
A
L
---
Q
T
G
K
V
I
E
Q
M
G
K
F
Y
P
E
L
K
L
A
Y
A
V
R
G
N
K
L
E
R
G
Q
K
I
S
E
Q
I
V
I
G
T
P
G
T
V
L
D
W
C
S
K
L
K
F
I
D
P
K
K
I
K
V
F
V
L
D
E
A
D
V
M
I
A
T
-----
Q
G
H
Q
D
Q
-
S
I
R
I
Q
R
M
L
P
R
N
C
Q
M
L
L
F
S
A
T
F
E
D
S
V
W
K
F
A
Q
K
V
V
P
D
P
N
V
I
K
L
K
R
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_CBE
40.91
33%
-6
- C5 -
3FHT
5
DD19B_HUMAN
B:
[45-119]
--------------------------------------------------------------------------------------------------------------------------
F
N
R
P
S
K
--
I
Q
E
N
A
L
P
L
M
L
A
E
P
P
Q
-----
N
L
I
A
Q
--
S
--
Q
S
G
T
G
K
T
A
A
F
--
V
-
L
A
M
L
S
Q
-
V
E
P
A
N
KYPQ
C
L
C
-
L
S
P
T
Y
E
L
A
L
---
Q
T
G
K
V
I
E
Q
M
G
K
F
Y
P
E
L
K
L
A
Y
A
V
R
G
N
K
I
S
E
Q
I
V
I
G
T
P
G
T
V
L
D
W
C
S
K
L
K
F
I
D
P
K
K
I
K
V
F
V
L
D
E
A
D
V
M
I
A
T
Q
G
H
Q
D
Q
-----
S
I
R
I
Q
R
-
M
L
P
R
N
C
Q
M
L
L
F
S
A
T
F
E
D
S
V
W
K
F
A
Q
K
V
V
P
D
P
N
V
I
K
L
K
R
E
E
E
T
L
D
T
I
K
Q
Y
Y
V
L
-----
C
S
S
R
D
E
K
F
Q
A
L
C
N
L
Y
G
A
I
T
I
A
Q
--
A
M
I
F
C
H
T
R
K
T
A
S
W
-
L
A
A
E
L
S
K
E
G
H
Q
V
A
--
L
L
S
G
E
M
M
V
E
Q
R
A
--
A
V
I
E
----
R
-
F
R
E
-
G
K
E
-
K
V
L
V
T
T
N
V
C
A
R
-----
G
I
D
V
E
Q
V
S
V
V
I
N
F
D
L
P
V
D
K
D
G
N
P
D
N
E
T
Y
L
H
R
I
G
R
T
G
R
F
G
K
R
G
L
A
V
N
M
V
D
S
-
K
H
--
S
M
N
I
L
N
R
I
Q
E
H
F
N
K
K
I
E
-
R
L
D
-----------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
40.69
33%
-2
- C5 -
3EWS
1
DD19B_HUMAN
A:
[82-156]
--------------------------------------------------------------------------------------------------------------------------
F
N
R
P
S
K
--
I
Q
E
N
A
L
P
L
M
L
A
E
P
P
Q
-----
N
L
I
A
Q
--
S
--
Q
S
G
T
G
K
T
A
A
F
--
V
-
L
A
M
L
S
Q
-
V
E
P
A
N
KYPQ
C
L
C
-
L
S
P
T
Y
E
L
A
L
---
Q
T
G
K
V
I
E
Q
M
G
K
F
Y
P
E
L
K
L
A
Y
A
V
R
G
N
K
L
E
R
G
Q
K
I
S
E
Q
I
V
I
G
T
P
G
T
V
L
D
W
C
S
K
L
K
F
I
D
P
K
K
I
K
V
F
V
L
D
E
A
D
V
M
I
A
T
-----
Q
G
H
Q
D
Q
-
S
I
R
I
Q
R
M
L
P
R
N
C
Q
M
L
L
F
S
A
T
F
E
D
S
V
W
K
F
A
Q
K
V
V
P
D
P
N
V
I
K
L
K
R
E
E
E
T
L
D
T
I
-----
K
Q
Y
Y
V
L
C
S
S
R
D
E
K
F
Q
A
L
C
N
L
Y
G
--
A
I
T
I
A
Q
A
M
I
F
C
H
T
-
R
K
T
A
S
W
L
A
A
E
L
S
K
--
E
G
H
Q
V
A
L
L
S
G
E
M
--
M
V
E
Q
----
R
-
A
A
V
-
I
E
R
-
F
R
E
G
K
E
K
V
L
V
T
-----
T
N
V
C
A
R
G
I
D
V
E
Q
V
S
V
V
I
N
F
D
L
P
V
D
K
D
G
N
P
D
N
E
T
Y
L
H
R
I
G
R
G
K
R
G
L
A
V
N
M
V
-
D
S
--
K
H
S
M
N
I
L
N
R
I
Q
E
H
F
N
K
K
-
I
E
R
L
D
T
D
D
L
D
----------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
40.44
33%
-16
- C5 -
3G0H
3
DD19B_HUMAN
A:
[61-135]
--------------------------------------------------------------------------------------------------------------------------
F
N
R
P
S
K
--
I
Q
E
N
A
L
P
L
M
L
A
E
P
P
Q
-----
N
L
I
A
Q
--
S
--
Q
S
G
T
G
K
T
A
A
F
--
V
-
L
A
M
L
S
Q
-
V
E
P
A
N
KYPQ
C
L
C
-
L
S
P
T
Y
E
L
A
L
---
Q
T
G
K
V
I
E
Q
M
G
K
F
Y
P
E
L
K
L
A
Y
A
V
R
G
N
K
L
E
R
G
Q
K
I
S
E
Q
I
V
I
G
T
P
G
T
V
L
D
W
C
S
K
L
K
F
I
D
P
K
K
I
K
V
F
V
L
D
E
A
D
V
M
I
A
T
-----
Q
G
H
Q
D
Q
-
S
I
R
I
Q
R
M
L
P
R
N
C
Q
M
L
L
F
S
A
T
F
E
D
S
V
W
K
F
A
Q
K
V
V
P
D
P
N
V
I
K
L
K
R
E
E
E
T
L
D
T
I
-----
K
Q
Y
Y
V
L
C
S
S
R
D
E
K
F
Q
A
L
C
N
L
Y
G
--
A
I
T
I
A
Q
A
M
I
F
C
H
T
-
R
K
T
A
S
W
L
A
A
E
L
S
K
--
E
G
H
Q
V
A
L
L
S
G
E
M
--
M
V
E
Q
----
R
-
A
A
V
-
I
E
R
-
F
R
E
G
K
E
K
V
L
V
T
-----
T
N
V
C
A
R
G
I
D
V
E
Q
V
S
V
V
I
N
F
D
L
P
V
D
K
D
G
N
P
D
N
E
T
Y
L
H
R
I
G
R
T
G
R
F
G
K
R
G
L
A
-
V
N
--
M
V
D
S
K
H
S
M
N
I
L
N
R
I
Q
E
H
-
F
N
K
K
I
E
R
L
D
-----------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_CBE
40.23
33%
24
- C5 -
3FMP
1
DD19B_HUMAN
D:
[112-186]
--------------------------------------------------------------------------------------------------------------------------
F
N
R
P
S
K
--
I
Q
E
N
A
L
P
L
M
L
A
E
P
P
Q
-----
N
L
I
A
Q
--
S
--
Q
S
G
T
G
K
T
A
A
F
--
V
-
L
A
M
L
S
Q
-
V
E
P
A
N
KYPQC
L
C
-
L
S
P
T
Y
E
L
A
L
---
Q
T
G
K
V
I
E
Q
M
G
K
F
Y
P
E
L
K
L
A
Y
A
V
R
G
N
K
L
E
R
G
Q
K
I
S
E
Q
I
V
I
G
T
P
G
T
V
L
D
W
C
S
K
L
K
F
I
D
P
K
K
I
K
V
F
V
L
D
E
A
D
V
M
I
A
T
-----
Q
G
H
Q
D
Q
-
S
I
R
I
Q
R
M
L
P
R
N
C
Q
M
L
L
F
S
A
T
F
E
D
S
V
W
K
F
A
Q
K
V
V
P
D
P
N
V
I
K
L
K
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
39.87
33%
43
- C5 -
3FHC
-
DD19B_HUMAN
B:
[112-186]
--------------------------------------------------------------------------------------------------------------------------
F
N
R
P
S
K
--
I
Q
E
N
A
L
P
L
M
L
A
E
P
P
Q
-----
N
L
I
A
Q
--
S
--
Q
S
G
T
G
K
T
A
A
F
--
V
-
L
A
M
L
S
Q
-
V
E
P
A
N
KYPQ
C
L
C
-
L
S
P
T
Y
E
L
A
L
---
Q
T
G
K
V
I
E
Q
M
G
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
39.86
33%
-2
- C5 -
3FHT
4
DD19B_HUMAN
A:
[45-119]
--------------------------------------------------------------------------------------------------------------------------
F
N
R
P
S
K
--
I
Q
E
N
A
L
P
L
M
L
A
E
P
P
Q
-----
N
L
I
A
Q
--
S
--
Q
S
G
T
G
K
T
A
A
F
--
V
-
L
A
M
L
S
Q
-
V
E
P
A
N
KYPQ
C
L
C
-
L
S
P
T
Y
E
L
A
L
---
Q
T
G
K
V
I
E
Q
M
G
K
F
Y
P
E
L
K
L
A
Y
A
V
R
G
N
K
L
E
R
G
Q
K
I
S
E
Q
I
V
I
G
T
P
G
T
V
L
D
W
C
S
K
L
K
F
I
D
P
K
K
I
K
V
F
V
L
D
E
A
D
V
M
I
A
T
-----
Q
G
H
Q
D
Q
-
S
I
R
I
Q
R
M
L
P
R
N
C
Q
M
L
L
F
S
A
T
F
E
D
S
V
W
K
F
A
Q
K
V
V
P
D
P
N
V
I
K
L
K
R
E
E
E
T
L
D
T
I
-----
K
Q
Y
Y
V
L
C
S
S
R
D
E
K
F
Q
A
L
C
N
L
Y
G
--
A
I
T
I
A
Q
A
M
I
F
C
H
T
-
R
K
T
A
S
W
L
A
A
E
L
S
K
--
E
G
H
Q
V
A
L
L
S
G
E
M
--
M
V
E
Q
----
R
-
A
A
V
-
I
E
R
-
F
R
E
G
K
E
K
V
L
V
T
-----
T
N
V
C
A
R
G
I
D
V
E
Q
V
S
V
V
I
N
F
D
L
P
V
D
K
D
G
N
P
D
N
E
T
Y
L
H
R
I
G
R
T
G
R
F
G
K
R
G
L
A
-
V
N
--
M
V
D
S
K
H
S
M
N
I
L
N
R
I
Q
E
H
-
F
N
K
K
I
E
R
L
------------------------------------------------------------------------------------------------------------------------------------------------------------