@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 : P2RY4_HUMAN: (2016-01-14 )
MASTESSLLRSLGLSPGPGSSEVELDCWFDEDFKFILLPVSYAVVFVLGLGLNAPTLWLFIFRLRPWDATATYMFHLALSDTLYVLSLPTLIYYYAAHNHWPFGTEICKFVRFLFYWNLYCSVLFLTCISVHRYLGICHPLRALRWGRPRLAGLLCLAVWLVVAGCLVPNLFFVTTSNKGTTVLCHDTTRPEEFDHYVHFSSAVMGLLFGVPCLVTLVCYGLMARRLYQPLPGSAQSSSRLRSLRTIAVVLTVFAVCFVPFHITRTIYYLARLLEADCRVLNIVNVVYKVTRPLASANSCLDPVLYLLTGDKYRRQLRQLCGGGKPQPRTAASSLALVSLPEDSSCRWAATPQDSSCSTPRADRL
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...
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MAS
T
E
S
S
L
L
R
--SLGLSPGPGSS
E
V
E
L
D
C
W
FDED-
F
K
F
I
L
L
P
V
S
Y
A
V
V
F
V
L
GLGLNA
P
T
L
W
L
F
I
F
R
LRPWDA
T
A
T
Y
M
F
H
L
ALSD
T
L
Y
V
L
S-
L
P
---
T
L
I
Y
Y
Y
AAHNHWP
F
G
T
E
I
C
K
F
V
R
F
L
F
Y
W
N
L
Y
C
S
V
L
F
L
T
C
I
S
V
H
R
Y
L
G
I
C
H
P
L
R
A
LRW---GR
P
R
L
A
G
-----
L
L
C
L
A
--
V
W
L
V
V
A
G
C
LVP
N
L
F
----
F
V
T
TS-NK
G
T
T
V
L
C-H-DTT
R
P
E
E
----
F
-
D
H
Y
V
H
F
S
S
---
A
V
M
G
L
L
F
G
V
P
C
L
V
T
L
V
C
Y
G
--
L
M
A
R
R
L
---------------Y-QPLPG-------S---------------------------------------------------------------------------------------------------------------------------------------------------------------A---------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
S
S
S
--------------------------------
R
L
R
S
L
-
R
T
I
A
V
V
L
T
V
F
A
V
C
F
V
P
F
H
I
T
R
T
I
Y
Y
L
A
R
L
---
L
--E-AD
C
R
V
L
N
I
V
N
V
V
Y
K
V
T
RPL
A
S
A
N
S
C
L
D
P
V
L
Y
L
LT
G
D
K
Y
R
R
Q
L
---
R
Q
L
CGGGKPQPRTAAS
S
L
A
L
V
SLPEDSSC
R
W
AATPQDSSCSTPRADRL
44
Fugue
88.16
42%
-159
- 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
P
E
D
G
-------
D
---------------------------------------------------------------------------------------------------------------------------------------------------------------
P
DNGVNPGTDFKDIVCPLCGVGKDQ
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
DFQ
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
----------------------------------------------------
2
PsiBlast_PDB
85.43
36%
-162
- C4 -
4XNW
2
RUBR_CLOPA
A:
[48-382]
-----------------------------------
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
L
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
P
E
D
G
-------
D
---------------------------------------------------------------------------------------------------------------------------------------------------------------
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------
D
N
G
V
NPGTDFKDIPDDWVCPLCGVGKDQ
F
E
E
V
EE
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
DFQ
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
----------------------------------------------------
21
PsiBlast_CBE
85.00
36%
-161
- C4 -
4XNW
2
RUBR_CLOPA
C:
[48-386]
-----------------------------------
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
L
K
S
L
-----
G
R
L
K
K
K
N
-----
A
I
C
I
S
VL
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
IYKMKKYTCTVCGYI
Y
-
N
P
E
D
G
-------
D
---------------------------------------------------------------------------------------------------------------------------------------------------------------
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------
D
N
G
V
NPGTDFKDIPDDWVCPLCGVGKDQFEEVEEPL
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
DFQ
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
L
SRA------------------------------------------------
1
PsiBlast_PDB
84.05
36%
-165
- C4 -
4XNV
15
P2RY1_HUMAN (first)
A:
[48-382]
-----------------------------------
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
P
E
D
G
-------
D
---------------------------------------------------------------------------------------------------------------------------------------------------------------
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------
D
N
G
V
NPGTDFKDIVCPLCGVGKDQ
F
E
E
V
EE
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
DFQ
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
----------------------------------------------------
12
PsiBlast_PDB
77.24
21%
-160
- C4 -
4MBS
8
CCR5_HUMAN (first)
A:
[34-361]
---------------------------------------
L
L
P
P
L
Y
S
L
V
F
I
F
G
F
V
G
N
M
L
V
I
L
I
L
I
N
Y
K
R
L
K
S
M
T
D
I
Y
L
L
N
L
A
I
S
D
L
F
F
L
L
T
-
V
P
---
F
W
A
H
Y
A
A
A
Q
--
W
D
F
G
N
T
M
C
Q
L
L
T
G
L
Y
F
I
G
F
F
S
G
I
F
F
I
I
L
L
T
I
D
R
Y
L
A
V
V
H
A
V
F
A
L
K
A
---
R
T
V
T
F
G
V
-----
V
T
S
V
I
--
T
W
V
V
A
V
F
A
S
L
P
N
I
I
----
F
T
R
S
Q
-
K
E
G
L
H
Y
T
C
-
S
-
S
H
F
P
Y
S
Q
----
Y
-
Q
F
W
K
N
F
Q
T
L
K
I
V
I
L
G
L
V
--
L
P
L
L
V
M
V
I
C
Y
S
--
G
I
L
K
T
L
L
R
M
K
K
Y
T
C
TVCG
Y
I
-
Y
-
N
P
E
D
G
-------
D
PDNGVNPGTDFKDIPDDWVCPLCGVGKDQ
F
E
E
V
------------------------------------------------------------------------------------------------------------------------------
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------
E
E
K
K
--------------------------------
R
H
R
D
V
-
R
L
I
F
T
I
M
I
V
Y
F
L
F
W
A
P
Y
N
I
V
L
L
L
N
T
F
Q
E
F
---
F
--
G
L
N
N
C
S
S
S
N
R
L
D
Q
A
M
Q
V
T
E
T
L
G
M
T
H
C
C
I
N
P
I
I
Y
A
F
V
G
E
E
F
R
N
Y
L
---
L
V
F
F
Q
-------------------------------------------
25
HHSearch
77.16
25%
-154
- C4 -
3ODU
6
CXCR4_HUMAN (first)
A:
[43-499]
-------------------------------
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
TGTWDAYG
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
---------------------------------
6
PsiBlast_PDB
76.73
31%
-157
- C4 -
4RWD
6
C562_ECOLX (first)
A:
[129-406]
--------------------------------------------
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
--------------------------------------------
22
PsiBlast_CBE
76.55
31%
-157
- C4 -
4RWD
5
OPRD_HUMAN
B:
[129-405]
--------------------------------------------
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
LM
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
---------------------------------------------
4
PsiBlast_PDB
75.83
31%
-161
- C4 -
4N6H
22
OPRD_HUMAN
A:
[132-409]
--------------------------------------------
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
---------------------------------------
5
PsiBlast_PDB
75.74
31%
-159
- C4 -
4RWA
2
C562_ECOLX (first)
A:
[129-406]
--------------------------------------------
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
-------------------------
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
--------------------------------------------
23
PsiBlast_CBE
74.63
31%
-158
- C4 -
4RWA
1
OPRD_HUMAN
B:
[129-403]
--------------------------------------------
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
------------------------
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
-----------------------------------------------
3
PsiBlast_PDB
74.59
32%
-168
- C4 -
5C1M
7
?
A:
[24-294]
--------------------------------------------
Y
S
I
V
C
V
V
G
L
F
G
N
F
L
V
M
Y
V
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
V
N
Y
L
M
G
T
-
W
P
F
G
N
I
L
C
K
I
V
I
S
I
D
Y
Y
N
M
F
T
S
I
F
T
L
C
T
M
S
V
D
R
Y
I
A
V
C
H
P
V
K
A
L
D
F
---
R
T
P
R
N
A
K
-----
I
V
N
V
C
--
N
W
I
L
S
S
A
I
G
L
P
V
M
F
----
M
A
T
T
K
-
Y
R
Q
G
S
I
D
C
-
T
-
L
T
F
S
H
P
T
----
W
-
Y
W
E
N
L
L
K
I
---
C
V
F
I
F
A
F
I
M
P
V
L
I
I
T
V
C
Y
G
--
L
M
I
L
R
L
K
S
-------------
V
-
R
M
L
S
G
-------
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------
E
K
D
R
--------------------------------
N
L
R
R
I
T
R
M
V
L
V
V
V
A
V
F
I
V
C
W
T
P
I
H
I
Y
V
I
I
K
A
L
I
T
I
---
P
--
E
-
T
T
F
Q
-----
T
V
S
W
H
F
C
I
A
L
G
Y
T
N
S
C
L
N
P
V
L
Y
A
F
L
D
E
N
F
K
R
C
F
---------------------------------------------------
24
PsiBlast_CBE
74.11
32%
-164
- C4 -
4EA3
3
OPRX_HUMAN
B:
[132-407]
--------------------------------------------
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
I
R
A
L
D
V
---
R
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
------
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
K
F
---------------------------------------------
7
PsiBlast_PDB
73.63
32%
-162
- C4 -
4EA3
3
C562_ECOLX (first)
A:
[132-405]
--------------------------------------------
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
RG-------------
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
-----------------------------------------------
36
HHSearch
72.38
22%
-152
- 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
GTWDAYG
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
------------------------------------------
15
PsiBlast_PDB
71.16
23%
-148
- C4 -
2KSB
1
NK1R_HUMAN
A:
[10-318]
--------------
D
L
S
P
N
I
S
T
N
T
S
E
P
N
Q
F
V
Q
P
A
-
W
Q
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
PNKI
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
SDRYH
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
14
PsiBlast_PDB
71.16
23%
-148
- C4 -
2KSA
1
NK1R_HUMAN
A:
[10-318]
--------------
D
L
S
P
N
I
S
T
N
T
S
E
P
N
Q
F
V
Q
P
A
-
W
Q
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
PNKI
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
SDRYH
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
13
PsiBlast_PDB
71.16
23%
-148
- C4 -
2KS9
1
NK1R_HUMAN
A:
[10-318]
--------------
D
L
S
P
N
I
S
T
N
T
S
E
P
N
Q
F
V
Q
P
A
-
W
Q
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
PNKI
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
SDRYH
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
46
Fugue
70.73
18%
-129
- C4 -
1F88
8
OPSD_BOVIN
A:
[1-348]
M
N
G
T
E
G
P
N
F
Y
VP
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
GW
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
----
33
HHSearch
69.64
21%
-143
- C4 -
2KS9
1
NK1R_HUMAN
A:
[30-327]
-----------------------------------
W
Q
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
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
GDSSDRY
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