@TOME V2.3
(Nov 2016)
Ref.
-
-
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 : NPFF2_HUMAN: (2016-01-11 )
MNSFFGTPAASWCLLESDVSSAPDKEAGRERRALSVQQRGGPAWSGSLEWSRQSAGDRRRLGLSRQTAKSSWSRSRDRTCCCRRAWWILVPAADRARRERFIMNEKWDTNSSENWHPIWNVNDTKHHLYSDINITYVNYYLHQPQVAAIFIISYFLIFFLCMMGNTVVCFIVMRNKHMHTVTNLFILNLAISDLLVGIFCMPITLLDNIIAGWPFGNTMCKISGLVQGISVAASVFTLVAIAVDRFQCVVYPFKPKLTIKTAFVIIMIIWVLAITIMSPSAVMLHVQEEKYYRVRLNSQNKTSPVYWCREDWPNQEMRKIYTTVLFANIYLAPLSLIVIMYGRIGISLFRAAVPHTGRKNQEQWHVVSRKKQKIIKMLLIVALLFILSWLPLWTLMMLSDYADLSPNELQIINIYIYPFAHWLAFGNSSVNPIIYGFFNENFRRGFQEAFQLQLCQKRAKPMEAYALKAKSHVLINTSNQLVQESTFQNPHGETLLYRKSAEKPQQELVMEELKETTNSSEI
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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MNSFFGTPAA
S
W
C
L
LESDVSSAP
D
K
E
AGRERR
A
L
S
V
QQRGGPAWSGS
L
E
WSRQSAGD
R
R
RLGLS
R
Q
T
A
K
SSWSRSR
D
R
T
C
C
C
R
R
A
W
W
I
L
VPAA
D
R
A
R
R
E
R
F
I
MNEKWDTNSSENWHPIWNVNDTK
H
H
L
YSD
I
N
I
T
Y
V
N
Y
Y
LHQP
Q
V
-------
A
A
I
F
I
I
S
-
Y
F
L
-
I
F
F
L
C
MMGN
T
V
V
C
F
I
V
MRNKH
M
H
T
V
T
N
L
F
I
L
N
L
A
I
S
D
L
L
V
G
I
F
C
M
P
I
T
L
L
D
N
I
I-AGWPFGN
T
M
C
K
I
S
G
L
V
Q
G
I
S
V
A
A
S
V
F
T
L
V
A
I
A
VD
R
F
Q
C
V
V
Y
P--F-K-
P
K
--
L
-----
T
I
K
T
---
A
F
V
I
I
M
I
I
W
V
L
A
I
T
IMSP
S
A
V
M
L
-
H
VQEE
K
Y
Y
R
V
R
LNSQNKTS
P
V
Y
W
CREDW---P
N
Q
---
E
M
R
--
K
I
Y
T
T
V
L
F
A
N
I
Y
L
A
P
L
S
L
I
V
I
M
Y
G
R
-----------
I
G
I
S
L
--------------------------------
F
R
A
AV-PHTGRK
N
-------------------------------------------------------------------------------------------------------------------------------------
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------
E
--------------
Q
W
H
V
V
S
R
--
K
K
------
Q
K
I
I
K
M
L
L
I
V
A
L
L
F
I
L
S
W
L
P
L
W
T
L
M
M
L
S
D
Y-ADLS----PN-
E
L
Q
I
I
N
I
Y
I
Y
P
---
F
A
H
W
L
AFGNSSVN
P
I
I
Y
G
FF
N
E
N
F
R
R
G
F
Q
E
A
F
Q
L
Q
L
C
Q
K
RAK
P
M
E
A
Y
A
L
KAK
S
H
V
L
I
NTS
N
Q
L
V
Q
E
STFQNPHGE
T
L
L
Y
RKSAEK
P
Q
Q
E
L
V
M
E
E
L
K
E
TTNSSEI
41
HHSearch
84.46
23%
-153
- C4 -
3RZE
5
ENLYS_BPT4 (first)
A:
[10-443]
-----------------------------------------------------------------------------------------------------------------------------------------------------------
P
L
V
V
V
-
L
S
T
-
I
C
L
V
T
V
G
L
N
L
L
V
L
Y
A
V
R
S
E
R
K
L
H
T
V
G
N
L
Y
I
V
S
L
S
V
A
D
L
I
V
G
A
V
V
M
P
M
N
I
L
Y
L
L
M
-
S
K
W
S
L
G
R
P
L
C
L
F
W
L
S
M
D
Y
V
A
S
T
A
S
I
F
S
V
F
I
L
C
I
D
R
Y
R
S
V
Q
Q
P
--
L
-
R
-
Y
L
--
K
YR---
T
K
T
R
---
A
S
A
T
I
L
G
A
W
F
L
S
F
L
W
V
I
P
I
L
G
W
N
-
H
-----------------
R
R
E
D
K
C
E
T
D
F
---
Y
D
V
--------
T
W
F
K
V
M
T
A
I
I
N
F
Y
L
P
T
L
L
M
L
W
F
Y
A
K
-----------
I
Y
K
A
V
--------------------------------
R
Q
H
C
N
-
I
F
E
M
L
R
I
D
E
G
L
R
L
K
I
Y
K
D
TEG
Y
Y
T
I
G
IGHLLTKSPS
L
N
------------------------------------------------------------------------------------------------------
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
-----------------------------------------------
N
R
A
K
R
V
I
T
T
F
R
TGTW
D
A
Y
L
H
M
N
--
R
E
------
R
K
A
A
K
Q
L
G
F
I
M
A
A
F
I
L
C
W
I
P
Y
F
I
F
F
M
V
I
A
F
-
C
K
N
C
----
C
-------
N
E
H
L
H
M
---
F
T
I
W
L
G
Y
I
N
S
T
L
N
P
L
I
Y
P
L
C
N
E
N
F
K
K
T
F
K
R
I
L
H
I
----------------------------------------------------------------------
39
HHSearch
83.44
26%
-144
- C4 -
2RH1
16
ADRB2_HUMAN (first)
A:
[37-477]
-----------------------------------------------------------------------------------------------------------------------------------------------
E
V
W
-------
V
V
G
M
G
I
V
-
M
S
L
-
I
V
L
A
I
V
F
G
N
V
L
V
I
T
A
I
A
K
F
E
R
L
Q
T
V
T
N
Y
F
I
T
S
L
A
C
A
D
L
V
M
G
L
A
V
V
P
F
G
A
A
H
I
L
M
-
K
M
W
T
F
G
N
F
W
C
E
F
W
T
S
I
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
V
D
R
Y
F
A
I
T
S
P
--
F
-
K
-
Y
Q
--
S
LL---
T
K
N
K
---
A
R
V
I
I
L
M
V
W
I
V
S
G
L
T
S
F
L
P
I
Q
M
H
W
Y
R
A
T
H
Q
E
A
------
I
-
N
C
Y
A
E
E
T
C
C
D
F
F
----------
T
N
--
Q
A
Y
A
I
A
S
S
I
V
S
F
Y
V
P
L
V
I
M
V
F
V
Y
S
R
-----------
V
F
Q
E
A
--------------------------------
K
R
Q
L
N
-
I
F
E
M
L
R
I
-------------------------------------------------------------------------------------------------------------------------------------
D
E
G
L
R
L
K
I
Y
K
D
TEGYYTIGIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGT--
W
--------------
D
A
Y
K
F
C
L
--
K
E
------
H
K
A
L
K
T
L
G
I
I
M
G
T
F
T
L
C
W
L
P
F
F
I
V
N
I
V
H
V
I
-
Q
D
N
L
-----------
I
R
K
E
V
Y
I
---
L
L
N
W
I
G
Y
V
N
S
G
F
N
P
L
I
Y
C
-
R
S
P
D
F
R
I
A
F
Q
E
L
L
C
L
----------------------------------------------------------------------
43
HHSearch
83.13
24%
-141
- C4 -
3EML
13
ENLYS_BPT4
A:
[21-472]
---------------------------------------------------------------------------------------------------------------------------------------------------------
S
S
V
Y
I
T
V
-
E
L
A
-
I
A
V
L
A
I
L
G
N
V
L
V
C
W
A
V
W
L
N
S
N
L
Q
N
V
T
N
Y
F
V
V
S
L
A
A
A
D
I
A
V
G
V
L
A
I
P
F
A
I
T
I
S
T
---
G
F
C
A
A
C
H
G
C
L
F
I
A
C
F
V
L
V
L
T
Q
S
S
I
F
S
L
L
A
I
A
I
D
R
Y
I
A
I
R
I
P
--
L
-
R
-
Y
N
--
G
L
V
---
T
G
T
R
---
A
K
G
I
I
A
I
C
W
V
L
S
F
A
I
G
L
T
P
M
L
G
W
-
N
N
C
G
Q
--------
S
Q
G
C
G
E
G
Q
V
A
C
L
F
E
D
---
V
V
-----
P
M
--
N
Y
M
V
Y
F
N
F
F
A
C
V
L
V
P
L
L
L
M
L
G
V
Y
L
R
-----------
I
F
L
A
A
--------------------------------
R
R
Q
L
N
-
I
F
E
M
L
R
I
-------------------------------------------------------------------------------------------------------------------------------------
D
E
GLRL
K
I
Y
K
D
TEGYYTIGIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTW-
D
--------------
A
Y
R
S
T
L
Q
--
K
E
------
V
H
A
A
K
S
L
A
I
I
V
G
L
F
A
L
C
W
L
P
L
H
I
I
N
C
F
T
F
F
-
C
P
D
C
----
S
-----
H
A
P
L
W
L
M
Y
---
L
A
I
V
L
S
H
T
N
S
V
V
N
P
F
I
Y
A
Y
R
I
R
E
F
R
Q
T
F
R
K
I
I
R
S
H
V
L
R
Q
-----------------------------------------------------------------
46
HHSearch
81.51
26%
-147
- C4 -
3PBL
2
DRD3_HUMAN (first)
A:
[41-472]
------------------------------------------------------------------------------------------------------------------------------------------------------------
Y
A
L
S
-
Y
C
A
-
L
I
L
A
I
V
F
G
N
G
L
V
C
M
A
V
L
K
E
R
A
L
Q
T
T
T
N
Y
L
V
V
S
L
A
V
A
D
L
L
V
A
T
L
V
M
P
W
V
V
Y
L
E
V
T
G
G
V
W
N
F
S
R
I
C
C
D
V
F
V
T
L
D
V
M
M
C
T
A
S
I
W
N
L
C
A
I
S
I
D
R
Y
T
A
V
V
M
P
--
V
-
H
-
Y
Q
--
H
G
T
G
Q
S
S
C
R
R
---
V
A
L
M
I
T
A
V
W
V
L
A
F
A
V
S
C
P
L
L
F
G
F
-
N
T
T
G
D
---------------
P
T
V
C
S
I
S
N
---
P
-----------
D
F
V
I
Y
S
S
V
V
S
F
Y
L
P
F
G
V
T
V
L
V
Y
A
R
-----------
I
Y
V
V
L
--------------------------------
K
Q
R
R
R
-
K
N
I
F
E
M
L
R
I
D
E
GLRL
K
I
Y
K
D
TEG
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
T
GT-------------------------------------------------------------------------------------------------------------------------------------
W
--------------
D
A
Y
G
V
P
L
--
R
E
------
K
K
A
T
Q
M
V
A
I
V
L
G
A
F
I
V
C
W
L
P
F
F
L
T
H
V
L
N
T
H
-
C
Q
T
C
----------
H
V
S
P
E
L
Y
S
---
A
T
T
W
L
G
Y
V
N
S
A
L
N
P
V
I
Y
T
T
F
N
I
E
F
R
K
A
F
L
K
I
L
S
C
----------------------------------------------------------------------
42
HHSearch
75.40
23%
-142
- C4 -
3V2Y
1
ENLYS_BPT4
A:
[59-495]
----------------------------------------------------------------------------------------------------------------------------------------------
K
E
N
S
-------
I
K
L
T
S
V
V
-
F
I
L
-
I
C
C
F
I
I
L
E
N
I
F
V
L
L
T
I
W
K
T
K
K
F
H
R
P
M
Y
Y
F
I
G
N
L
A
L
S
D
L
L
A
G
V
A
Y
T
A
N
L
L
L
S
G
A
--
T
T
Y
K
L
T
P
A
Q
W
F
L
R
E
G
S
M
F
V
A
L
S
A
S
V
F
S
L
L
A
I
A
I
E
R
Y
I
T
M
L
K
-----------------
N
N
F
R
---
L
F
L
L
I
S
A
C
W
V
I
S
L
I
L
G
G
L
P
I
M
G
W
-
N
C
I
S
A
---------------
L
S
S
C
S
T
V
L
---
P
L
Y
--------
H
K
H
Y
I
L
F
C
T
T
V
F
T
L
L
L
L
S
I
V
I
L
Y
C
R
-----------
I
Y
S
L
V
--------------------------------
R
T
R
N
I
-
F
E
M
L
R
I
D
-------------------------------------------------------------------------------------------------------------------------------------
E
GLRL
K
I
Y
K
D
TE
G
Y
Y
T
I
G
IGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
N
A
K
L
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTW--
D
--------------
A
Y
A
S
R
S
S
--
E
N
------
V
A
L
L
K
T
V
I
I
V
L
S
V
F
I
A
C
W
A
P
L
F
I
L
L
L
L
D
V
G
-
C
K
V
K
----
T
C
-----
D
I
L
F
R
A
E
---
Y
F
L
V
L
A
V
L
N
S
G
T
N
P
I
I
Y
T
L
T
N
K
E
M
R
R
A
F
I
R
I
M
G
R
P
L
--------------------------------------------------------------------
35
HHSearch
75.12
22%
-133
- C4 -
3ODU
6
CXCR4_HUMAN (first)
A:
[42-498]
--------------------------------------------------------------------------------------------------------------------------------------------
E
N
A
N
F
N
-------
K
I
F
L
P
T
I
-
Y
S
I
-
I
F
L
T
G
I
V
G
N
G
L
V
I
L
V
M
G
Y
Q
K
K
L
R
S
M
T
D
K
Y
R
L
H
L
S
V
A
D
L
L
F
V
I
-
T
L
P
F
W
A
V
D
A
V
--
A
N
W
Y
F
G
N
F
L
C
K
A
V
H
V
I
Y
T
V
N
L
Y
S
S
V
W
I
L
A
F
I
S
L
D
R
Y
L
A
I
V
H
A
--
T
-
N
-
S
Q
--
R
P
R
---
K
L
L
A
---
E
K
V
V
Y
V
G
V
W
I
P
A
L
L
L
T
I
P
D
F
I
F
A
-
N
V
S
E
A
D
-------------
D
R
Y
I
C
D
R
F
Y
---
P
N
D
---
L
W
V
--
V
V
F
Q
F
Q
H
I
M
V
G
L
I
L
P
G
I
V
I
L
S
C
Y
C
I
-----------
I
I
S
K
L
--------------------------------
S
H
S
G
S
-
N
I
F
E
M
L
R
-------------------------------------------------------------------------------------------------------------------------------------
I
D
E
G
L
R
L
K
I
Y
K
D
TEG
Y
Y
T
I
GIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
IGRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKLK
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KRW
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGTW
D
--------------
A
Y
G
S
K
G
H
--
Q
K
------
R
K
A
L
K
T
T
V
I
L
I
L
A
F
F
A
C
W
L
P
Y
Y
I
G
I
S
I
D
S
F
-
I
L
L
E
I
I
K
Q
G
C
-
E
F
E
N
T
V
H
K
W
I
S
---
I
T
E
A
L
A
F
F
H
C
C
L
N
P
I
L
Y
A
F
L
G
A
K
F
K
T
S
A
Q
H
A
L
T
S
G
R
P
L
E
V
L
F
Q
-------------------------------------------------------------
11
PsiBlast_PDB
74.66
28%
-148
- C4 -
4N6H
23
C562_ECOLX (first)
A:
[106-411]
---------------------------------------------------------------------------------------------------------------------------------------
Y
I
Q
K
Y
L
G
S
P
G
A
R
S
A
S
S
L
A
L
A
I
A
I
T
A
L
Y
S
A
-
V
C
A
V
G
L
L
G
N
V
L
V
M
F
G
I
V
R
Y
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
A
L
-
A
T
S
T
L
P
F
Q
S
A
K
Y
L
M
-
E
T
W
P
F
G
E
L
L
C
K
A
V
L
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
T
M
M
S
V
D
R
Y
I
A
V
C
H
P
--
V
-
K
--
A
--
L
-----
D
F
R
T
P
A
K
A
K
L
I
N
I
C
I
W
V
L
A
S
G
V
G
V
P
I
M
V
M
--
A
V
T
R
P
R
D
G
A
V
V
C
M
L
Q
F
P
S
P
S
W
Y
W
----------
D
---
T
V
T
--
K
I
-
C
V
F
L
F
A
--
F
V
V
P
I
L
I
I
T
V
C
Y
G
L
-----------
M
L
L
R
L
--------------------------------
R
S
V
R
L
--
L
S
G
S
K
E
-------------------------------------------------------------------------------------------------------------------------------------
K
-----------------------------------------------------------------------------------------------------------------------------------------------------
D
--------------------
R
--
S
L
------
R
R
I
T
R
M
V
L
V
V
V
G
A
F
V
V
C
W
A
P
I
H
I
F
V
I
V
W
T
L
-
V
D
I
D
----
R
R
-
D
P
L
V
V
A
A
L
H
L
C
---
I
A
--
L
G
Y
A
N
S
S
L
N
P
V
L
Y
A
F
L
D
E
N
F
K
R
C
F
R
-----
Q
L
C
R
K
P
C
G
--------------------------------------------------------------
10
PsiBlast_PDB
74.49
28%
-144
- C4 -
4GBR
1
ADRB2_HUMAN
A:
[14-286]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
-
I
V
L
A
I
V
F
G
N
V
L
V
I
T
A
I
A
K
F
E
R
L
Q
T
V
T
N
Y
F
I
T
S
L
A
C
A
D
L
V
M
G
L
A
V
V
P
F
G
A
A
H
I
L
T
-
K
T
W
T
F
G
N
F
W
C
E
F
W
T
S
I
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
V
D
R
Y
F
A
I
T
S
P
--
F
-
K
-
Y
Q
SL
L
-----
T
K
N
K
---
A
R
V
I
I
L
M
V
W
I
V
S
-
G
L
T
S
F
L
P
I
Q
M
-
H
-----
W
Y
R
A
T
H
Q
E
A
I
N
C
Y
A
E
E
T
C
C
D
F
F
---
T
N
Q
---
A
Y
A
--
I
A
S
S
I
V
S
F
----
Y
V
P
L
V
I
M
V
F
V
Y
S
R
-----------
V
------------------------------------
F
Q
E
A
------
K
R
Q
-------------------------------------------------------------------------------------------------------------------------------------
L
-----------------------------------------------------------------------------------------------------------------------------------------------------
Q
--------------
K
I
D
K
F
C
L
--
K
E
------
H
K
A
L
K
T
L
G
I
I
M
G
T
F
T
L
C
W
L
P
F
F
I
V
N
I
V
H
V
I
-
Q
D
-----------
N
L
I
R
K
E
V
Y
I
---
L
L
N
W
I
G
Y
V
N
S
G
F
N
P
L
I
Y
C
-
R
S
P
D
F
R
I
A
F
Q
E
L
----
L
C
L
------------------------------------------------------------------
37
HHSearch
74.44
22%
-139
- C4 -
3UON
4
ACM2_HUMAN (first)
A:
[24-457]
----------------------------------------------------------------------------------------------------------------------------------------------------------
V
F
I
V
L
V
-
A
G
S
-
L
S
L
V
T
I
I
G
N
I
L
V
M
V
S
I
K
V
N
R
H
L
Q
T
V
N
N
Y
F
L
F
S
L
A
C
A
D
L
I
I
G
V
F
S
M
N
L
Y
T
L
Y
T
V
I
-
G
Y
W
P
L
G
P
V
V
C
D
L
W
L
A
L
D
Y
V
V
S
N
A
S
V
M
N
L
L
I
I
S
F
D
R
Y
F
C
V
T
K
P
--
L
-
T
-
Y
P
--
V
KR---
T
T
K
M
---
A
G
M
M
I
A
A
A
W
V
L
S
F
I
L
W
A
P
A
I
L
F
W
-
Q
F
I
V
G
V
R
----------
T
V
E
D
G
E
C
Y
I
Q
F
---
F
S
------
N
--
A
A
V
T
F
G
T
A
I
A
A
F
Y
L
P
V
I
I
M
T
V
L
Y
W
H
-----------
I
S
R
A
S
--------------------------------
K
S
R
I
N
-
I
F
E
M
L
R
I
-------------------------------------------------------------------------------------------------------------------------------------
D
EGLRL
K
I
Y
K
D
TEG
Y
Y
T
I
GIGHLLTKSPS
L
N
A
A
K
S
E
L
D
K
A
I
GRNTNGVIT
K
D
E
A
E
K
L
F
N
Q
D
V
D
A
A
V
R
G
I
L
R
NAKL
K
P
V
Y
D
S
LD
A
V
R
R
A
A
L
I
N
M
V
F
Q
MG
E
T
G
V
A
G
F
T
N
S
L
R
M
L
Q
Q
KR
W
D
E
A
A
V
N
L
A
K
S
R
W
Y
N
Q
T
P
N
R
A
K
R
V
I
T
T
F
R
TGT--
W
--------------
D
A
Y
P
P
P
S
--
R
E
------
K
K
V
T
R
T
I
L
A
I
L
L
A
F
I
I
T
W
A
P
Y
N
V
M
V
L
I
N
T
F
-
C
A
P
C
-----------
I
P
N
T
V
W
T
---
I
G
Y
W
L
C
Y
I
N
S
T
I
N
P
A
C
Y
A
L
C
N
A
T
F
K
K
T
F
K
H
L
L
M
-----------------------------------------------------------------------
59
Fugue
74.06
25%
-144
- C4 -
4XNV
15
P2RY1_HUMAN (first)
A:
[38-382]
--------------------------------------------------------------------------------------------------------------------------------------
S
F
K
C
A
L
T
K
T
G
F
Q
-------
F
Y
Y
L
P
A
V
-
Y
I
L
-
V
F
I
I
G
F
L
G
N
S
V
A
I
W
M
F
V
F
H
M
K
P
W
S
G
I
S
V
Y
M
F
N
L
A
L
A
D
F
L
Y
V
L
T
L
P
A
L
I
F
Y
Y
F
N
K
-
T
D
W
I
F
G
D
A
M
C
K
L
Q
R
F
I
F
H
V
N
L
Y
G
S
I
L
F
L
T
C
I
S
A
H
R
Y
S
G
V
V
Y
P
--
K
-
S
L
G
R
--
L
-----
K
K
K
N
---
A
I
C
I
S
V
L
V
W
L
I
V
V
V
A
I
S
P
I
L
F
Y
S
-
G
T
G
V
R
K
---------
N
K
T
---
I
T
C
Y
D
T
T
---
S
D
E
---
Y
L
R
S
Y
F
I
Y
S
M
C
T
T
V
A
M
F
C
V
P
L
V
L
I
L
G
C
Y
G
L
-----------
I
V
R
A
L
I
Y
K
M
K
K
Y
T
C
TVCG
Y
I
Y
N
PEDGDPDNGVNPGTD
F
K
D
I
V
C
P
L
C
G
V
G
K
-------------------------------------------------------------------------------------------------------------------------------------
D
-----------------------------------------------------------------------------------------------------------------------------------------------------
Q
--------------
F
E
E
V
E
E
P
--
L
R
------
R
K
S
I
Y
L
V
I
I
V
L
T
V
F
A
V
S
Y
I
P
F
H
V
M
K
T
M
N
L
R
-
A
R
L
D
FQ--
T
P
-
A
M
C
A
F
N
D
R
V
Y
A
T
Y
Q
V
T
R
G
L
A
S
L
N
S
C
V
N
P
I
L
Y
F
L
A
G
D
T
F
R
R
R
-----------------------------------------------------------------------------
5
PsiBlast_PDB
73.78
26%
-158
- C4 -
4EA3
3
C562_ECOLX (first)
A:
[121-405]
-----------------------------------------------------------------------------------------------------------------------------------------------
P
L
G
-------
L
K
V
T
I
V
G
-
L
Y
L
A
V
C
V
G
G
L
L
G
N
C
L
V
M
Y
V
I
L
R
H
T
K
M
K
T
A
T
N
I
Y
I
F
N
L
A
L
A
D
T
L
V
-
L
L
T
L
P
F
Q
G
T
D
I
L
L
-
G
F
W
P
F
G
N
A
L
C
K
T
V
I
A
I
D
Y
Y
N
M
F
T
S
T
F
T
L
T
A
M
S
V
D
R
Y
V
A
I
C
H
P
-------------------
T
S
S
K
A
Q
A
V
N
V
A
I
W
A
L
A
S
V
V
G
V
P
V
A
I
M
G
-
S
A
Q
V
E
D
-
E
E
I
E
C
L
V
E
I
P
T
P
Q
D
Y
W
----------------
G
--
P
V
F
A
I
C
I
F
L
F
S
F
I
V
P
V
L
V
I
S
V
C
Y
S
L
-----------
M
-
I
R
R
--------------------------------
L
R
G
V
R
-
L
L
S
G
S
R
E
-------------------------------------------------------------------------------------------------------------------------------------
K
-----------------------------------------------------------------------------------------------------------------------------------------------------
D
--------------------
R
--
N
L
------
R
R
I
T
R
L
V
L
V
V
V
A
V
F
V
G
C
W
T
P
V
Q
V
F
V
L
A
Q
G
L
-
G
V
Q
P
----
S
S
-
E
T
A
V
A
---
I
L
R
---
F
C
T
A
L
G
Y
V
N
S
C
L
N
P
I
L
Y
A
F
L
D
E
N
F
K
A
C
F
R
---------------------------------------------------------------------------
12
PsiBlast_PDB
73.60
28%
-157
- C4 -
3SN6
1
R:
[191-490]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
-
I
V
L
A
I
V
F
G
N
V
L
V
I
T
A
I
A
K
F
E
R
L
Q
T
V
T
N
Y
F
I
T
S
L
A
C
A
D
L
V
M
G
L
A
V
V
P
F
G
A
A
H
I
L
T
-
K
T
W
T
F
G
N
F
W
C
E
F
W
T
S
I
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
V
D
R
Y
F
A
I
T
S
P
--
F
-
K
-
Y
Q
SL
L
-----
T
K
N
K
---
A
R
V
I
I
L
M
V
W
I
V
S
-
G
L
T
S
F
L
P
I
Q
M
-
H
-----
W
Y
R
---
Q
E
A
I
N
C
Y
A
E
E
T
C
C
D
F
F
---
T
N
Q
---
A
Y
A
--
I
A
S
S
I
V
S
F
----
Y
V
P
L
V
I
M
V
F
V
Y
S
R
VFQEAKRQLQK
I
D
K
S
E
--------------------------------
G
R
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------CL
K
E
------
H
K
A
L
K
T
L
G
I
I
M
G
T
F
T
L
C
W
L
P
F
F
I
V
N
I
V
H
V
I
-
Q
D
-----------
N
L
I
R
K
E
V
Y
I
---
L
L
N
W
I
G
Y
V
N
S
G
F
N
P
L
I
Y
-
C
R
S
P
D
F
R
I
A
F
Q
E
L
----
L
C
-------------------------------------------------------------------
58
Fugue
72.99
20%
-109
- C4 -
1F88
8
OPSD_BOVIN
A:
[1-348]
------------------------------------------------------------------------------------------------------------
M
N
G
T
E
G
P
N
F
Y
V
P
F
S
N
K
T
G
V
V
R
S
--
P
F
E
A
P
Q
Y
Y
L
A
E
P
W
Q
-------
F
S
M
L
A
A
Y
-
M
F
L
-
L
I
M
L
G
F
P
I
N
F
L
T
L
Y
V
T
V
Q
H
K
K
L
R
T
P
L
N
Y
I
L
L
N
L
A
V
A
D
L
F
M
V
F
G
G
F
T
T
T
L
Y
T
S
L
H
-
G
Y
F
V
F
G
P
T
G
C
N
L
E
G
F
F
A
T
L
G
G
E
I
A
L
W
S
L
V
V
L
A
I
E
R
Y
V
V
V
C
K
P
--
M
S
N
-
F
R
--
F
-----
G
E
N
H
---
A
I
M
G
V
A
F
T
W
V
M
A
L
A
C
A
A
P
P
L
V
G
W
-
S
----
R
Y
I
P
E
G
M
--
Q
C
S
C
G
I
D
Y
Y
T
P
H
E
E
---
T
N
------
N
--
E
S
F
V
I
Y
M
F
V
V
H
F
I
I
P
L
I
V
I
F
F
C
Y
G
Q
-----------
L
V
F
T
V
--------------------------------
K
E
A
A
A
-
S
A
T
T
Q
K
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
E
------
K
E
V
T
R
M
V
I
I
M
V
I
A
F
L
I
C
W
L
P
Y
A
G
V
A
F
Y
I
F
T
-
H
Q
G
S
----
D
F
------
G
P
I
F
M
T
---
I
P
A
F
F
A
K
T
S
A
V
Y
N
P
V
I
Y
I
M
M
N
K
Q
F
R
N
C
M
V
T
T
L
C
C
G
K
N
P
S
T
T
V
S
K
T
E
T
S
Q
V
A
P
A
---------------------------------------------------
7
PsiBlast_PDB
72.86
28%
-147
- C4 -
4LDL
3
ADRB2_HUMAN
A:
[191-463]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
-
I
V
L
A
I
V
F
G
N
V
L
V
I
T
A
I
A
K
F
E
R
L
Q
T
V
T
N
Y
F
I
T
S
L
A
C
A
D
L
V
M
G
L
A
V
V
P
F
G
A
A
H
I
L
T
-
K
T
W
T
F
G
N
F
W
C
E
F
W
T
S
I
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
V
D
R
Y
F
A
I
T
S
P
--
F
-
K
-
Y
Q
S
L
L
-----
T
K
N
K
---
A
R
V
I
I
L
M
V
W
I
V
S
-
G
L
T
S
F
L
P
I
Q
M
-
H
-----
W
Y
R
A
T
H
Q
E
A
I
N
C
Y
A
E
E
T
C
C
D
F
F
---
T
N
Q
---
A
Y
A
--
I
A
S
S
I
V
S
F
----
Y
V
P
L
V
I
M
V
F
V
Y
S
R
-----------
V
------------------------------------
F
Q
E
A
------
K
R
Q
-------------------------------------------------------------------------------------------------------------------------------------
L
-----------------------------------------------------------------------------------------------------------------------------------------------------
Q
-----------------
K
F
A
L
--
K
E
------
H
K
A
L
K
T
L
G
I
I
M
G
T
F
T
L
C
W
L
P
F
F
I
V
N
I
V
H
V
I
-
Q
D
-----------
N
L
I
R
K
E
V
Y
I
---
L
L
N
W
I
G
Y
V
N
S
G
F
N
P
L
I
Y
C
-
R
S
P
D
F
R
I
A
F
Q
E
L
----
L
C
L
------------------------------------------------------------------
40
HHSearch
72.70
29%
-140
- C4 -
2KS9
1
NK1R_HUMAN
A:
[32-325]
---------------------------------------------------------------------------------------------------------------------------------------------------------
I
V
L
W
A
A
A
-
Y
T
V
-
I
V
V
T
S
V
V
G
N
V
V
V
M
W
I
I
L
A
H
K
R
M
R
T
V
T
N
Y
F
L
V
N
L
A
F
A
E
A
S
M
A
A
F
N
T
V
V
N
F
T
Y
A
V
H
-
N
E
W
Y
Y
G
L
F
Y
C
K
F
H
N
F
F
P
I
A
A
V
F
A
S
I
Y
S
M
T
A
V
A
F
D
R
Y
M
A
I
I
H
P
--
L
-
Q
-
P
R
--
L
-----
S
A
T
A
---
T
K
V
V
I
C
V
I
W
V
L
A
L
L
L
A
F
P
Q
G
Y
Y
S
-
T
T
E
T
M
P
-------------
S
R
V
V
C
M
I
E
W
---
P
E
H
PNK
I
Y
E
--
K
V
Y
H
I
C
V
T
V
L
I
Y
F
L
P
L
L
V
I
G
Y
A
Y
T
V
-----------
V
G
I
T
L
--------------------------------
W
A
S
E
I
-
P
G
D
S
S
D
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
Y
H
E
Q
V
S
--
A
K
------
R
K
V
V
K
M
M
I
V
V
V
C
T
F
A
I
C
W
L
P
F
H
I
F
F
L
L
P
Y
I
-
N
P
D
L
----
Y
---
L
K
K
F
I
Q
Q
V
Y
L
---
A
I
M
W
L
A
M
S
S
T
M
Y
N
P
I
I
Y
C
C
L
N
D
R
F
R
L
G
F
K
H
A
F
R
C
C
P
F
I
S
A
G
D
Y
E
G
L
E
M
K
S
T
R
Y
L
Q
T
Q
G
S
V
Y
K
V
S
R
L
E
T
T
I
S
T
V
V
G
A
----------------------------
6
PsiBlast_PDB
72.49
28%
-146
- C4 -
4LDE
3
A:
[191-463]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
-
I
V
L
A
I
V
F
G
N
V
L
V
I
T
A
I
A
K
F
E
R
L
Q
T
V
T
N
Y
F
I
T
S
L
A
C
A
D
L
V
M
G
L
A
V
V
P
F
G
A
A
H
I
L
T
-
K
T
W
T
F
G
N
F
W
C
E
F
W
T
S
I
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
V
D
R
Y
F
A
I
T
S
P
--
F
-
K
-
Y
Q
S
L
L
-----
T
K
N
K
---
A
R
V
I
I
L
M
V
W
I
V
S
-
G
L
T
S
F
L
P
I
Q
M
-
H
-----
W
Y
R
A
T
H
Q
E
A
I
N
C
Y
A
E
E
T
C
C
D
F
F
---
T
N
Q
---
A
Y
A
--
I
A
S
S
I
V
S
F
----
Y
V
P
L
V
I
M
V
F
V
Y
S
R
-----------
V
------------------------------------
F
Q
E
A
------
K
R
Q
-------------------------------------------------------------------------------------------------------------------------------------
L
-----------------------------------------------------------------------------------------------------------------------------------------------------
Q
-----------------
K
F
A
L
--
K
E
------
H
K
A
L
K
T
L
G
I
I
M
G
T
F
T
L
C
W
L
P
F
F
I
V
N
I
V
H
V
I
-
Q
D
-----------
N
L
I
R
K
E
V
Y
I
---
L
L
N
W
I
G
Y
V
N
S
G
F
N
P
L
I
Y
C
-
R
S
P
D
F
R
I
A
F
Q
E
L
----
L
C
L
------------------------------------------------------------------
9
PsiBlast_PDB
72.28
28%
-147
- C4 -
4QKX
2
ADRB2_HUMAN
A:
[191-463]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
-
I
V
L
A
I
V
F
G
N
V
L
V
I
T
A
I
A
K
F
E
R
L
Q
T
V
T
N
Y
F
I
T
S
L
A
C
A
D
L
V
M
G
L
A
V
V
P
F
G
A
A
C
I
L
T
-
K
T
W
T
F
G
N
F
W
C
E
F
W
T
S
I
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
V
D
R
Y
F
A
I
T
S
P
--
F
-
K
-
Y
Q
S
L
L
-----
T
K
N
K
---
A
R
V
I
I
L
M
V
W
I
V
S
-
G
L
T
S
F
L
P
I
Q
M
-
H
-----
W
Y
R
A
T
H
Q
E
A
I
N
C
Y
A
E
E
T
C
C
D
F
F
---
T
N
Q
---
A
Y
A
--
I
A
S
S
I
V
S
F
----
Y
V
P
L
V
I
M
V
F
V
Y
S
R
-----------
V
------------------------------------
F
Q
E
A
------
K
R
Q
-------------------------------------------------------------------------------------------------------------------------------------
L
-----------------------------------------------------------------------------------------------------------------------------------------------------
Q
-----------------
K
F
A
L
--
K
E
------
H
K
A
L
K
T
L
G
I
I
M
G
T
F
T
L
C
W
L
P
F
F
I
V
N
I
V
H
V
I
-
Q
D
-----------
N
L
I
R
K
E
V
Y
I
---
L
L
N
W
I
G
Y
V
N
S
G
F
N
P
L
I
Y
C
-
R
S
P
D
F
R
I
A
F
Q
E
L
----
L
C
L
------------------------------------------------------------------
8
PsiBlast_PDB
72.05
28%
-144
- C4 -
4LDO
3
A:
[191-463]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
-
I
V
L
A
I
V
F
G
N
V
L
V
I
T
A
I
A
K
F
E
R
L
Q
T
V
T
N
Y
F
I
T
S
L
A
C
A
D
L
V
M
G
L
A
V
V
P
F
G
A
A
H
I
L
T
-
K
T
W
T
F
G
N
F
W
C
E
F
W
T
S
I
D
V
L
C
V
T
A
S
I
E
T
L
C
V
I
A
V
D
R
Y
F
A
I
T
S
P
--
F
-
K
-
Y
Q
S
L
L
-----
T
K
N
K
---
A
R
V
I
I
L
M
V
W
I
V
S
-
G
L
T
S
F
L
P
I
Q
M
-
H
-----
W
Y
R
A
T
H
Q
E
A
I
N
C
Y
A
E
E
T
C
C
D
F
F
---
T
N
Q
---
A
Y
A
--
I
A
S
S
I
V
S
F
----
Y
V
P
L
V
I
M
V
F
V
Y
S
R
-----------
V
------------------------------------
F
Q
E
A
------
K
R
Q
-------------------------------------------------------------------------------------------------------------------------------------
L
-----------------------------------------------------------------------------------------------------------------------------------------------------
Q
-----------------
K
F
A
L
--
K
E
------
H
K
A
L
K
T
L
G
I
I
M
G
T
F
T
L
C
W
L
P
F
F
I
V
N
I
V
H
V
I
-
Q
D
-----------
N
L
I
R
K
E
V
Y
I
---
L
L
N
W
I
G
Y
V
N
S
G
F
N
P
L
I
Y
C
-
R
S
P
D
F
R
I
A
F
Q
E
L
----
L
C
L
------------------------------------------------------------------
13
PsiBlast_PDB
71.86
26%
-136
- C4 -
4MQS
1
?
A:
[55-333]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
I
G
N
I
L
V
M
V
S
I
K
V
N
R
H
L
Q
T
V
N
N
Y
F
L
F
S
L
A
C
A
D
L
I
I
G
V
F
S
M
N
L
Y
T
L
Y
T
V
I
-
G
Y
W
P
L
G
P
V
V
C
D
L
W
L
A
L
D
Y
V
V
S
N
A
S
V
M
N
L
L
I
I
S
F
D
R
Y
F
C
V
T
K
P
L
T
Y
-
P
-
V
K
--
R
-----
T
T
K
M
---
A
G
M
M
I
A
A
A
W
V
L
S
F
I
L
W
A
P
A
--
I
L
-
F
W
Q
F
I
V
G
V
R
T
V
E
D
G
E
--------
C
Y
I
Q
F
---
F
S
N
---
A
A
V
--
T
F
G
T
A
I
--
A
A
F
Y
L
-
P
V
I
I
M
T
V
L
Y
W
H
-----------
I
S
------------------------------------
R
A
S
K
-
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PPPS
R
E
K
K
V
T
R
T
I
L
A
I
L
L
A
F
I
I
T
W
A
P
Y
N
V
M
V
L
I
N
T
F
C
A
P
C
I
----
P
N
-
T
-------
V
W
T
---
I
G
Y
W
L
C
Y
I
N
S
T
I
N
P
A
C
Y
A
L
C
N
A
T
F
K
K
T
F
K
---
H
L
L
M
--------------------------------------------------------------------
4
PsiBlast_PDB
71.18
26%
-93
- C4 -
2KSB
1
NK1R_HUMAN
A:
[56-356]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
I
L
A
H
K
R
M
R
T
V
T
N
Y
F
L
V
N
L
A
F
A
E
A
S
M
A
A
F
N
T
V
V
N
F
T
Y
A
V
H
-
N
E
W
Y
Y
G
L
F
Y
C
K
F
H
N
F
F
P
I
A
A
V
F
A
S
I
Y
S
M
T
A
V
A
F
D
R
Y
M
A
I
I
H
P
--
L
-
Q
-
P
R
--
L
-----
S
A
T
A
---
T
K
V
V
I
C
V
I
W
V
L
A
L
L
L
A
F
P
----------
Q
G
Y
Y
S
T
T
E
T
M
P
S
R
V
V
----
C
M
I
E
W
PEH
P
N
K
---
I
Y
E
--
K
V
Y
H
I
C
V
T
V
L
I
Y
F
L
P
L
L
V
I
G
Y
A
Y
T
V
-----------
V
G
I
T
L
--------------------------------
W
A
S
E
I
-
P
---
G
D
S
-------------------------------------------------------------------------------------------------------------------------------------
S
-----------------------------------------------------------------------------------------------------------------------------------------------------
D
--------------
R
Y
H
E
Q
V
S
--
A
K
------
R
K
V
V
K
M
M
I
V
V
V
C
T
F
A
I
C
W
L
P
F
H
I
F
F
L
L
P
----
Y
I
N
----
P
D
L
Y
L
K
K
F
I
Q
Q
V
Y
L
---
A
I
M
W
L
A
M
S
S
T
M
Y
N
P
I
I
Y
C
C
L
N
D
R
F
R
L
G
F
K
H
A
F
R
---
C
C
P
F
I
S
A
G
D
Y
E
G
L
E
M
K
S
T
R
Y
L
Q
T
Q
G
S
V
Y
K
V
S
R
L
E
T
T
I
S
T
V
V
G
A
-------------------------