@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 : CCR5_HUMAN: (2016-01-09 )
MDYQVSSPIYDINYYTSEPCQKINVKQIAARLLPPLYSLVFIFGFVGNMLVILILINCKRLKSMTDIYLLNLAISDLFFLLTVPFWAHYAAAQWDFGNTMCQLLTGLYFIGFFSGIFFIILLTIDRYLAVVHAVFALKARTVTFGVVTSVITWVVAVFASLPGIIFTRSQKEGLHYTCSSHFPYSQYQFWKNFQTLKIVILGLVLPLLVMVICYSGILKTLLRCRNEKKRHRAVRLIFTIMIVYFLFWAPYNIVLLLNTFQEFFGLNNCSSSNRLDQAMQVTETLGMTHCCINPIIYAFVGEKFRNYLLVFFQKHIAKRFCKCCSIFQQEAPERASSVYTRSTGEQEISVGL
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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MDYQVSS
P
I
Y
--------
D
I
NYYTSEPCQKI
N
V
K
Q
I
A
A
R
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
C
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
AQ--WD
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
LKA---R
T
V
T
F
G
V
V
T
S
V
I
T
W
V
V
A
V
F
A
SLP
G
-
I
I
-
F
T----RSQ-K---E
G
L
H
Y
TCSSHFP
Y
--
S
Q
Y
Q
F
W
K
NF
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
------------------------------------------C-----R---------------------------------------------------
N
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
K
K
R
--
H
--
R
A
V
R
---------
L
I
F
T
I
M
I
V
Y
F
L
F
WAP
Y
N
I
V
L
L
L
N
--
T
F
Q
--
E
F
FGL-NNCSSS
N
R
L
D
----
Q
A
M
Q
V
T
E
T
LGM
T
H
C
C
I
N
P
I
I
Y
A
F
V
G
E
K
F
R
N
Y
L
L
V
F
F
Q
K
H
I
A
K
R
F
C
K
C
C
S
I
F
Q
Q
EA
P
E
R
A
S
S
VYTRSTGEQEISVGL
21
PsiBlast_CBE
95.53
85%
-179
- C2 -
4MBS
7
CCR5_HUMAN (first)
B:
[21-366]
--------------------------
P
C
Q
K
I
N
V
K
Q
I
A
A
R
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
KYTCTVCGYIYNPEDGDPDNGVNPGTDFKDIPDDWVCPLCGVGKDQFEEVE
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
---------------------------------------
1
PsiBlast_PDB
95.51
85%
-177
- C2 -
4MBS
8
CCR5_HUMAN (first)
A:
[21-366]
--------------------------
P
C
Q
K
I
N
V
K
Q
I
A
A
R
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
PEDGDPDNGVNPGTDFKDIPDDWVCPLCGVGKDQ
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
---------------------------------------
26
HHSearch
71.81
32%
-154
- C2 -
3ODU
6
CXCR4_HUMAN (first)
A:
[37-495]
--------------------------
P
C
F
R
E
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
TGTWDAYGSK
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
-----------------------------
3
PsiBlast_PDB
71.56
28%
-169
- C2 -
4XT1
15
US28_HCMVA
A:
[28-310]
------------------------
A
T
P
C
V
F
T
D
V
L
N
Q
S
K
P
V
T
L
F
L
Y
G
V
V
F
L
F
G
S
I
G
N
F
L
V
I
F
T
I
T
W
R
R
R
I
Q
C
S
G
D
V
Y
F
I
N
L
A
A
A
D
L
L
F
V
-
C
-
T
--
L
P
--
L
W
-
M
-
Q
Y
L
--
L
D
-------
S
V
P
C
T
L
L
T
A
C
F
Y
V
A
M
F
A
S
L
C
F
I
T
E
I
A
L
D
R
Y
Y
A
I
V
Y
----
M
R
Y
---
R
P
V
K
Q
A
C
L
F
S
I
F
W
W
I
F
A
V
I
I
A
I
P
H
F
M
V
-
V
T
----
K
K
D
-
N
---
Q
-----
C
M
T
D
Y
D
Y
--
L
E
V
S
Y
-
P
I
I
L
N
V
E
L
M
L
G
A
-
F
V
I
P
L
S
V
I
S
Y
C
Y
Y
R
I
S
R
-
I
-----------------------------------------------
V
A
------------------------------------------
V
-----
S
---------------------------------------------------
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
R
H
K
--
G
--
R
I
V
R
---------
V
L
I
A
V
V
L
V
F
I
I
F
W
L
P
Y
H
L
T
L
F
V
D
--
T
L
K
--
L
L
K
W
I
S
S
S
C
E
F
E
R
S
L
K
----
R
A
L
I
L
T
E
S
L
A
F
C
H
C
C
L
N
P
L
L
Y
V
F
V
G
T
K
F
R
Q
E
L
H
C
L
L
A
E
F
R
------------------------------------
12
PsiBlast_PDB
71.25
26%
-167
- C2 -
4N6H
23
C562_ECOLX (first)
A:
[107-402]
-------------------
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
RLLSG
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
-----------------------------------
14
PsiBlast_PDB
71.10
27%
-180
- C2 -
4RWD
6
C562_ECOLX (first)
A:
[128-399]
-------------------------------------------
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
RLLSG
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
----------------------------------------
46
Fugue
71.02
25%
-158
- C2 -
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
TD
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
PEDGDPDNGVNPGTDFKDIVCPLCGVGKDQ
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
F
Q
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
---------------------------------------------
13
PsiBlast_PDB
70.67
27%
-178
- C2 -
4RWA
2
C562_ECOLX (first)
A:
[128-399]
-------------------------------------------
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
----------------------------------------------------------------------------------------------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
----------------------------------------
27
HHSearch
70.15
21%
-168
- C2 -
3UON
4
ACM2_HUMAN (first)
A:
[22-457]
------------------------------------
E
V
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
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
GVR
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
TGTWDAYPP--
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
---------------------------------------
4
PsiBlast_PDB
69.78
28%
-164
- C2 -
4XT3
2
US28_HCMVA
A:
[28-310]
------------------------
A
T
P
C
V
F
T
D
V
L
N
Q
S
K
P
V
T
L
F
L
Y
G
V
V
F
L
F
G
S
I
G
N
F
L
V
I
F
T
I
T
W
R
R
R
I
Q
C
S
G
D
V
Y
F
I
N
L
A
A
A
D
L
L
F
V
-
C
-
T
--
L
P
--
L
W
-
M
-
Q
Y
L
--
L
D
H
-----
A
S
V
P
C
T
L
L
T
A
C
F
Y
V
A
M
F
A
S
L
C
F
I
T
E
I
A
L
D
R
Y
Y
A
I
V
Y
----
M
R
Y
---
R
P
V
K
Q
A
C
L
F
S
I
F
W
W
I
F
A
V
I
I
A
I
P
H
F
M
V
-
V
T
----
K
K
D
-
N
---
Q
-----
C
M
T
D
Y
D
Y
--
L
E
V
S
Y
-
P
I
I
L
N
V
E
L
M
L
G
A
-
F
V
I
P
L
S
V
I
S
Y
C
Y
Y
R
I
S
R
-
I
-----------------------------------------------
V
A
------------------------------------------
V
-----
S
---------------------------------------------------
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
R
H
K
--
G
--
R
I
V
R
---------
V
L
I
A
V
V
L
V
F
I
I
F
W
L
P
Y
H
L
T
L
F
V
D
--
T
L
K
--
L
L
K
W
I
S
S
S
C
E
F
E
R
S
L
K
----
R
A
L
I
L
T
E
S
L
A
F
C
H
C
C
L
N
P
L
L
Y
V
F
V
G
T
K
F
R
Q
E
L
H
C
L
L
A
E
--------------------------------------
10
PsiBlast_PDB
68.90
29%
-173
- C2 -
4EA3
3
C562_ECOLX (first)
A:
[131-401]
-------------------------------------------
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
LLSGS----------------------------------------------
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
-------------------------------------------
11
PsiBlast_PDB
68.72
26%
-165
- C2 -
5C1M
7
?
A:
[8-293]
----------------------------
Q
T
G
S
P
S
M
V
T
A
I
T
I
M
A
L
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
MLSGS----------------------------------------------
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
--------------------------------------------
44
Fugue
68.71
20%
-136
- C2 -
1F88
8
OPSD_BOVIN
A:
[1-348]
M
N
G
T
E
G
P
N
F
Y
VPFSNKTG
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
GY
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
AASA-
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
-----
30
HHSearch
68.42
24%
-163
* C2 *
2RH1
16
ADRB2_HUMAN (first)
A:
[42-477]
---------------------------------------
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
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
---------------------------------------------------
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
TGTWDAYKF--
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
68.32
24%
-153
- C2 -
2Z73
5
OPSD_TODPA
A:
[32-335]
-----------------------------------
A
V
Y
Y
S
L
G
I
F
I
G
I
C
G
I
I
G
C
G
G
N
G
I
V
I
Y
L
F
T
K
T
K
S
L
Q
T
P
A
N
M
F
I
I
N
L
A
F
S
D
F
T
F
S
-
L
-
V
N
G
F
P
--
L
M
-
T
-
I
S
C
F
-
L
K
K
--
W
I
F
G
F
A
A
C
K
V
Y
G
F
I
G
G
I
F
G
F
M
S
I
M
T
M
A
M
I
S
I
D
R
Y
N
V
I
G
R
P
M
A
A
S
K
K
---
M
S
H
R
R
A
F
I
M
I
I
F
V
W
L
W
S
V
L
W
A
I
G
P
-
I
F
-
G
W
----
G
A
Y
T
L
---
E
G
V
L
C
N
C
S
F
D
Y
I
S
--
R
D
S
T
--
T
R
S
N
I
L
C
M
F
I
L
G
-
F
F
G
P
I
L
I
I
F
F
C
Y
F
N
I
V
M
S
V
-----------------------------------------------
S
N
------------------------------------------
H
-----
E
---------------------------------------------------
K
E
M
A
A
M
A
K
RLNAKE
L
R
K
A
Q
A
G
-----------------------------------------------------------------------------------------------------------------------------------------------
A
N
A
E
--
M
--
R
L
A
K
---------
I
S
I
V
I
V
S
Q
F
L
L
S
W
S
P
Y
A
V
V
A
L
L
A
--
Q
F
G
--
P
L
---------
E
W
V
T
P
----
Y
A
A
Q
L
P
V
M
F
A
K
A
S
A
I
H
N
P
M
I
Y
S
V
S
H
P
K
F
R
E
A
I
S
Q
T
F
P
W
V
L
T
C
C
Q
F
D
D
K
E
T
E
D
D
K
D
A
E
T
E
I
P
A
G
E
------------
36
HHSearch
68.24
23%
-174
- C2 -
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
GTWDAYGV
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
--------------------------------------
28
HHSearch
67.28
22%
-170
- C2 -
3RZE
5
ENLYS_BPT4 (first)
A:
[12-443]
-----------------------------------------
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
Y
---
R
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
TGTWDAYLH--
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
--------------------------------------
33
HHSearch
66.81
22%
-160
- C2 -
3EML
13
ENLYS_BPT4
A:
[22-470]
--------------------------------------
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
CL
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
---------------------------------
19
PsiBlast_PDB
66.09
22%
-156
- C2 -
4XNW
2
RUBR_CLOPA
A:
[53-382]
----------------------------------------
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
PEDGDPDNGVNPGTDFKDIPDDWVCPL
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
F
Q
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
---------------------------------------------
38
HHSearch
66.06
18%
-159
- C2 -
3V2Y
1
ENLYS_BPT4
A:
[62-495]
------------------------------------
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
IDEGLRL
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
TGTWDAYA
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
------------------------------------