@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 : AGRF4_HUMAN: (2016-01-09 )
MKMKSQATMICCLVFFLSTECSHYRSKIHLKAGDKLQSPEGKPKTGRIQEKCEGPCISSSNCSQPCAKDFHGEIGFTCNQKKWQKSAETCTSLSVEKLFKDSTGASRLSVAAPSIPLHILDFRAPETIESVAQGIRKNCPFDYACITDMVKSSETTSGNIAFIVELLKNISTDLSDNVTREKMKSYSEVANHILDTAAISNWAFIPNKNASSDLLQSVNLFARQLHIHNNSENIVNELFIQTKGFHINHNTSEKSLNFSMSMNNTTEDILGMVQIPRQELRKLWPNASQAISIAFPTLGAILREAHLQNVSLPRQVNGLVLSVVLPERLQEIILTFEKINKTRNARAQCVGWHSKKRRWDEKACQMMLDIRNEVKCRCNYTSVVMSFSILMSSKSMTDKVLDYITCIGLSVSILSLVLCLIIEATVWSRVVVTEISYMRHVCIVNIAVSLLTANVWFIIGSHFNIKAQDYNMCVAVTFFSHFFYLSLFFWMLFKALLIIYGILVIFRRMMKSRMMVIGFAIGYGCPLIIAVTTVAITEPEKGYMRPEACWLNWDNTKALLAFAIPAFVIVAVNLIVVLVVAVNTQRPSIGSSKSQDVVIIMRISKNVAILTPLLGLTWGFGIATLIEGTSLTFHIIFALLNAFQGFFILLFGTIMDHKIRDALRMRMSSLKGKSRAAENASLGPTNGSKLMNRQG
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.......610...---....620....----.----.----------------.------630.....----..-640.......650.......660.......670.......680.......690...
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MKMKS
Q
A
T
M
I
C
C
L
V
F
F
LST
E
C
S
H
Y
R
S
K
I
H
L
KAGDKLQSPEGKPKTG
R
I
Q
E
KCEGPCISSSNCSQ
P
C
A
K
D
FHGEIG
F
T
C
N
Q
K
K
W
Q
K
S
A
E
T
C
T
S
L
S
V
E
K
L
F
KDSTGAS
R
L
S
VAAPSI
P
L
H
I
LDFRA
P
E
T
I
E
S
V
A
Q
G
I
R
KNCPF
D
Y
A
C
I
T
D
M
V
KSSETTS
G
N
I
A
F
I
V
E
L
L
K
N
I
STDLSD
N
V
T
R
E
K
M
K
S
Y
S
E
V
A
N
H
I
L
D
-----
T
A
AIS
N
W
A
F---I--PNKNA
S
S
D
L
L
Q
S
V
N
L
F
A
R
Q
L
H
IHNN
S
E
----------------
N
I
V
N
E
L
----------------
F
I
QTK---
G
F
H
INHNTSEK
S
L
N
F
S
MSMNN
T
T
E
D
I
L
G
M
V
Q--I
P
R
Q
E
L
R
K
LWPNAS
Q
A
I
S
I
A
F
-
P
T
L
G
A
I
L
R
E
A
H
LQNVSLPRQVN
G
L
V
L
S
V
V
L
-
P
E
R
L
Q
E
I
I
L
----
T
F
E
K
I
N
K
T
RNAR
A
Q
CVG
W
---
H
S
K
K
R
R
W
D
E
K
A
C
Q
M
M
L
D
IRN
E
V
K
C
RCN
Y
T
S
V
V
M
--------------------
S
F
S
I
L
MSSKS---
M
T
D
K
V
L
D
Y
I
T
C
I
G
L
S
V
S
I
L
S
L
V
L
C
L
I
I
E
A
T
V
W
S
R
V
V
V
T
E
I
S
Y
M
R
H
V
C
I
V
N
I
A
V
---
S
L
L
TA
N
V
W
F
I
IG
S
-
H
----
F
----
N
------
I
K
AQDY
N
M
C
V
A
V
T
F
F
S
H
F
F
Y
L
S
L
F
F
W
M
L
F
K
A
L
L
I
--
I
Y
G
I
----
L
V
I
F
R
R
M
--
M
--K-SR
M
M
V
I
G
F
AIGYGC
P
L
I
I
A
V
T
T
V
A
I
TEPEKGYMRPE
A
C
W
L-N-W--D---N------
T
----------
K
---------
A
------
L
L
A
F
A
I
P
A
F
V
I
V
A
V
N
L
I
V
V
L
V
V
A
VNTQRPSIG--------S-SKSQ
D
V
V
I
I
M
RISKN
V
A
I
L
T
P
L
L
G
---
L
T
W
G
F
G
I
A
T
L
I----E----G----------------T------
S
L
T
F
H
I
I
F
----
A
L
-
L
N
A
F
Q
G
F
F
I
L
L
F
G
T
I
M
D
H
K
I
R
D
A
L
R
M
R
M
S
SLKGKSRAAENASLGPTN
G
S
K
LMNRQG
45
Fugue
77.29
12%
-92
- C3 -
4K5Y
7
CRFR1_HUMAN (first)
A:
[13-423]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
H
Y
----------------
H
V
A
A
I
---
I
N
Y
L
G
H
C
I
S
L
V
A
L
L
V
A
F
V
L
F
L
R
A
R
S
I
R
C
L
R
N
--
I
I
H
A
N
L
I
A
A
F
I
L
R
N
A
T
W
F
V
V
Q
-
L
T
M
S
P
E
V
H
Q
S
N
V
G
W
C
R
L
V
T
A
A
Y
N
Y
F
H
V
T
N
F
-
F
W
M
F
G
E
G
C
Y
----
L
H
T
A
I
V
L
T
N
I
F
E
M
L
R
I
D
E
---
G
L
R
L
K
I
Y
K
D
T
E
G
Y
Y
T
I
G
I
G
H
L
L
T
K
S
P
S
L
S
V
A
K
S
--------------------
E
L
D
K
A
I
G
R
N
S
NGV
I
T
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
L
D
A
V
R
R
S
A
L
I
N
M
V
F
---
Q
M
G
E
T
G
V
A
G
F
T
N
S
-
L
----
R
----
M
------
L
Q
Q
K
R
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
A
T
F
R
--
T
-
G
T
----
W
D
A
Y
D
R
L
--
R
--
A
-
W
M
F
I
C
I
G
W
G
V
--------
P
F
P
I
I
V
A
W
A
I
G
K
L
Y
Y
D
N
E
K
C
W
A
G
K
-
R
--
P
---
G
------
V
----------
Y
---------
T
------
D
Y
I
Y
Q
G
P
M
A
L
V
L
L
I
N
F
I
F
L
F
N
I
V
R
I
L
M
T
K
-
L
R
--------
A
-
S
T
T
S
E
T
I
Q
A
R
K
A
V
K
A
T
L
V
L
L
P
L
L
G
---
I
T
Y
M
L
A
F
V
N
------
E
----
V
----------------
S
------
R
V
V
F
I
Y
F
N
----
A
F
-
L
E
S
F
Q
G
F
F
V
S
V
F
A
C
F
L
N
S
--------------------------------------
11
PsiBlast_PDB
76.41
22%
3
- C4 -
1E7Y
1
G6PD_LEUME
A:
[199-424]
--------------------------------------------------------------------------------------------------------------------------------------------------------------
D
A
A
W
N
K
D
Y
I
K
N
V
Q
V
T
L
S
E
V
L
G
V
E
E
R
A
G
Y
Y
D
T
A
G
A
L
L
D
MIQN
H
T
M
Q
I
V
G
W
L
A
---
M
EK
P
E
S
F
T
D
K
D
I
R
A
A
K
N
A
A
F
N
A
L
K
I
Y
D
E
A
E
------------------
V
N
K
Y
----------------
F
V
R
A
Q
Y
G
A
G
D
S
A
D
F
K
P
Y
L
E
E
L
D
V
P
A
D
S
K
N
N
T
F
-
I
A
G
E
L
Q
F
D
L
P
R
W
E
G
V
P
F
Y
V
R
S
G
K
R
L
A
-
A
K
-
Q
T
R
V
D
I
V
F
K
A
G
T
F
N
F
G
S
E
Q
E
A
Q
E
A
V
L
S
I
I
I
D
P
K
G
A
I
E
L
K
L
----
N
A
K
S
V
E
D
A
F
N
T
R
T
I
D
L
G
W
T
V
S
D
E
D
K
K
N
T
P
E
P
Y
E
R
M
I
H
D
T
M
N
G
D
G
S
N
F
A
D
W
N
G
V
S
--------------------
I
A
W
K
F
V
D
A
I
S
---
A
V
Y
T
A
D
K
A
P
L
E
T
Y
K
S
G
S
M
G
P
E
A
S
D
K
L
L
A
A
N
G
D
A
W
V
F
K
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
75.63
22%
-0
- C4 -
1E7M
1
G6PD_LEUME
A:
[199-424]
--------------------------------------------------------------------------------------------------------------------------------------------------------------
D
A
A
W
N
K
D
Y
I
K
N
V
Q
V
T
L
S
E
V
L
G
V
E
E
R
A
G
Y
Y
D
T
A
G
A
L
L
D
MIQN
H
T
M
Q
I
V
G
W
L
A
---
M
EK
P
E
S
F
T
D
K
D
I
R
A
A
K
N
A
A
F
N
A
L
K
I
Y
D
E
A
E
------------------
V
N
K
Y
----------------
F
V
R
A
Q
Y
G
A
G
D
S
A
D
F
K
P
Y
L
E
E
L
D
V
P
A
D
S
K
N
N
T
F
-
I
A
G
E
L
Q
F
D
L
P
R
W
E
G
V
P
F
Y
V
R
S
G
K
R
L
A
-
A
K
-
Q
T
R
V
D
I
V
F
K
A
G
T
F
N
F
G
S
E
Q
E
A
Q
E
A
V
L
S
I
I
I
D
P
K
G
A
I
E
L
K
L
----
N
A
K
S
V
E
D
A
F
N
T
R
T
I
D
L
G
W
T
V
S
D
E
D
K
K
N
T
P
E
P
Y
E
R
M
I
H
D
T
M
N
G
D
G
S
N
F
A
D
W
N
G
V
S
--------------------
I
A
W
K
F
V
D
A
I
S
---
A
V
Y
T
A
D
K
A
P
L
E
T
Y
K
S
G
S
M
G
P
E
A
S
D
K
L
L
A
A
N
G
D
A
W
V
F
K
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
75.61
22%
5
- C4 -
1DPG
2
G6PD_LEUME
A:
[199-424]
--------------------------------------------------------------------------------------------------------------------------------------------------------------
D
A
A
W
N
K
D
Y
I
K
N
V
Q
V
T
L
S
E
V
L
G
V
E
E
R
A
G
Y
Y
D
T
A
G
A
L
L
D
MIQN
H
T
M
Q
I
V
G
W
L
A
---
M
EK
P
E
S
F
T
D
K
D
I
R
A
A
K
N
A
A
F
N
A
L
K
I
Y
D
E
A
E
------------------
V
N
K
Y
----------------
F
V
R
A
Q
Y
G
A
G
D
S
A
D
F
K
P
Y
L
E
E
L
D
V
P
A
D
S
K
N
N
T
F
-
I
A
G
E
L
Q
F
D
L
P
R
W
E
G
V
P
F
Y
V
R
S
G
K
R
L
A
-
A
K
-
Q
T
R
V
D
I
V
F
K
A
G
T
F
N
F
G
S
E
Q
E
A
Q
E
A
V
L
S
I
I
I
D
P
K
G
A
I
E
L
K
L
----
N
A
K
S
V
E
D
A
F
N
T
R
T
I
D
L
G
W
T
V
S
D
E
D
K
K
N
T
P
E
P
Y
E
R
M
I
H
D
T
M
N
G
D
G
S
N
F
A
D
W
N
G
V
S
--------------------
I
A
W
K
F
V
D
A
I
S
---
A
V
Y
T
A
D
K
A
P
L
E
T
Y
K
S
G
S
M
G
P
E
A
S
D
K
L
L
A
A
N
G
D
A
W
V
F
K
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
75.40
22%
3
- C4 -
1E77
1
G6PD_LEUME
A:
[199-424]
--------------------------------------------------------------------------------------------------------------------------------------------------------------
D
A
A
W
N
K
D
Y
I
K
N
V
Q
V
T
L
S
E
V
L
G
V
E
E
R
A
G
Y
Y
D
T
A
G
A
L
L
D
MIQN
H
T
M
Q
I
V
G
W
L
A
---
M
EK
P
E
S
F
T
D
K
D
I
R
A
A
K
N
A
A
F
N
A
L
K
I
Y
D
E
A
E
------------------
V
N
K
Y
----------------
F
V
R
A
Q
Y
G
A
G
D
S
A
D
F
K
P
Y
L
E
E
L
D
V
P
A
D
S
K
N
N
T
F
-
I
A
G
E
L
Q
F
D
L
P
R
W
E
G
V
P
F
Y
V
R
S
G
K
R
L
A
-
A
K
-
Q
T
R
V
D
I
V
F
K
A
G
T
F
N
F
G
S
E
Q
E
A
C
E
A
V
L
S
I
I
I
D
P
K
G
A
I
E
L
K
L
----
N
A
K
S
V
E
D
A
F
N
T
R
T
I
D
L
G
W
T
V
S
D
E
D
K
K
N
T
P
E
P
Y
E
R
M
I
H
D
T
M
N
G
D
G
S
N
F
A
D
W
N
G
V
S
--------------------
I
A
W
K
F
V
D
A
I
S
---
A
V
Y
T
A
D
K
A
P
L
E
T
Y
K
S
G
S
M
G
P
E
A
S
D
K
L
L
A
A
N
G
D
A
W
V
F
K
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
75.14
22%
1
- C4 -
2DPG
-
G6PD_LEUME
A:
[199-424]
--------------------------------------------------------------------------------------------------------------------------------------------------------------
D
A
A
W
N
K
D
Y
I
K
N
V
Q
V
T
L
S
E
V
L
G
V
E
E
R
A
G
Y
Y
D
T
A
G
A
L
L
D
MIQNN
T
M
Q
I
V
G
W
L
A
---
M
EK
P
E
S
F
T
D
K
D
I
R
A
A
K
N
A
A
F
N
A
L
K
I
Y
D
E
A
E
------------------
V
N
K
Y
----------------
F
V
R
A
Q
Y
G
A
G
D
S
A
D
F
K
P
Y
L
E
E
L
D
V
P
A
D
S
K
N
N
T
F
-
I
A
G
E
L
Q
F
D
L
P
R
W
E
G
V
P
F
Y
V
R
S
G
K
R
L
A
-
A
K
-
Q
T
R
V
D
I
V
F
K
A
G
T
F
N
F
G
S
E
Q
E
A
Q
E
A
V
L
S
I
I
I
D
P
K
G
A
I
E
L
K
L
----
N
A
K
S
V
E
D
A
F
N
T
R
T
I
D
L
G
W
T
V
S
D
E
D
K
K
N
T
P
E
P
Y
E
R
M
I
H
D
T
M
N
G
D
G
S
N
F
A
D
W
N
G
V
S
--------------------
I
A
W
K
F
V
D
A
I
S
---
A
V
Y
T
A
D
K
A
P
L
E
T
Y
K
S
G
S
M
G
P
E
A
S
D
K
L
L
A
A
N
G
D
A
W
V
F
K
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
75.00
22%
1
- C4 -
1H9B
1
G6PD_LEUME
A:
[199-424]
--------------------------------------------------------------------------------------------------------------------------------------------------------------
D
A
A
W
N
K
D
Y
I
K
N
V
Q
V
T
L
S
E
V
L
G
V
E
E
R
A
G
Y
Y
D
T
A
G
A
L
L
D
MIQN
H
T
M
Q
I
V
G
W
L
A
---
M
EK
P
E
S
F
T
D
K
D
I
R
A
A
K
N
A
A
F
N
A
L
K
I
Y
D
E
A
E
------------------
V
N
K
Y
----------------
F
V
R
A
Q
Y
G
A
G
D
S
A
D
F
K
P
Y
L
E
E
L
D
V
P
A
D
S
K
N
N
T
F
-
I
A
G
E
L
Q
F
D
L
P
R
W
E
G
V
P
F
Y
V
R
S
G
K
R
L
A
-
A
K
-
Q
T
R
V
D
I
V
F
K
A
G
T
F
N
F
G
S
E
Q
E
A
C
E
A
V
L
S
I
I
I
D
P
K
G
A
I
E
L
K
L
----
N
A
K
S
V
E
D
A
F
N
T
R
T
I
D
L
G
W
T
V
S
D
E
D
K
K
N
T
P
E
P
Y
E
R
M
I
H
D
T
M
N
G
D
G
S
N
F
A
D
W
N
G
V
S
--------------------
I
A
W
K
F
V
D
A
I
S
---
A
V
Y
T
A
D
K
A
P
L
E
T
Y
K
S
G
S
M
G
P
E
A
S
D
K
L
L
A
A
N
G
D
A
W
V
F
K
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
74.91
22%
2
- C4 -
1H9A
1
G6PD_LEUME
A:
[199-424]
--------------------------------------------------------------------------------------------------------------------------------------------------------------
D
A
A
W
N
K
D
Y
I
K
N
V
Q
V
T
L
S
E
V
L
G
V
E
E
R
A
G
Y
Y
D
T
A
G
A
L
L
D
MIQN
H
T
M
Q
I
V
G
W
L
A
---
M
EK
P
E
S
F
T
D
K
D
I
R
A
A
K
N
A
A
F
N
A
L
K
I
Y
D
E
A
E
------------------
V
N
K
Y
----------------
F
V
R
A
Q
Y
G
A
G
D
S
A
D
F
K
P
Y
L
E
E
L
D
V
P
A
D
S
K
N
N
T
F
-
I
A
G
E
L
Q
F
D
L
P
R
W
E
G
V
P
F
Y
V
R
S
G
K
R
L
A
-
A
K
-
Q
T
R
V
D
I
V
F
K
A
G
T
F
N
F
G
S
E
Q
E
A
C
E
A
V
L
S
I
I
I
D
P
K
G
A
I
E
L
K
L
----
N
A
K
S
V
E
D
A
F
N
T
R
T
I
D
L
G
W
T
V
S
D
E
D
K
K
N
T
P
E
P
Y
E
R
M
I
H
D
T
M
N
G
D
G
S
N
F
A
D
W
N
G
V
S
--------------------
I
A
W
K
F
V
D
A
I
S
---
A
V
Y
T
A
D
K
A
P
L
E
T
Y
K
S
G
S
M
G
P
E
A
S
D
K
L
L
A
A
N
G
D
A
W
V
F
K
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
HHSearch
68.73
12%
-143
- C3 -
2Z73
5
OPSD_TODPA
A:
[37-332]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
FGPLEW---------
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
25
HHSearch
68.64
12%
-146
- C3 -
2KS9
1
NK1R_HUMAN
A:
[40-325]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
EHP
N
------
K
IY
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
LYLKKF
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
2
PsiBlast_PDB
63.76
20%
-107
- C3 -
4L6R
1
GLR_HUMAN
A:
[208-392]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
C
R
V
A
A
V
F
M
Q
Y
G
I
V
A
N
Y
C
W
L
L
V
E
G
L
Y
L
H
N
L
L
G
L
----
A
T
L
P
E
R
S
--
F
--
F
-
S
L
Y
L
----
G
I
G
W
G
A
P
M
L
F
V
V
P
W
A
V
V
----
K
C
L
F
E
N
V
Q
C
W
T
-
S
-
N
--
D
---
N
------
M
----------
G
---------
F
------
W
W
I
L
R
F
P
V
F
L
A
I
L
I
N
F
F
-
I
F
V
R
I
V
Q
L
L
V
A
K
L
R
--------
A
-
R
Q
M
H
H
T
D
Y
K
F
R
L
A
K
S
T
L
T
L
I
P
L
L
G
V
H
E
V
V
F
A
F
V
T
D
E
H
A
----
Q
----
G
----------------
T
------
L
R
S
A
K
L
F
F
----
D
L
F
L
S
S
F
Q
G
L
L
V
A
V
L
Y
C
F
L
N
K
E
V
Q
S
E
L
R
R
R
W
H
R
W
R
L
G
K
V
L
W
E
E
R
N
--------------
32
HHSearch
60.25
12%
-141
- C3 -
2LNL
-
CXCR1_HUMAN
A:
[46-321]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Y
A
L
V
F
L
L
S
L
L
G
N
S
L
V
M
L
V
I
L
Y
--
S
R
----
V
G
R
S
V
T
D
V
Y
L
L
N
L
A
L
---
A
D
L
L
F
A
L
T
L
P
I
W
A
-
A
----
S
K
V
--
N
------
G
W
I
F
G
T
F
L
C
K
V
V
S
L
L
K
E
V
N
F
Y
S
G
I
L
L
L
A
C
I
S
V
D
R
--
Y
L
A
I
----
V
H
A
T
R
T
L
--
T
--
Q
K
R
H
L
V
K
F
V
C
L
G
C
W
G
L
S
M
N
L
S
L
P
F
F
L
F
R
Q
A
Y
H
P
N
N
S
S
P
V
C
Y
E
-
V
-
L
GN
D
---
T
------
A
----------
K
WRMVLRILP
H
------
T
F
G
F
I
V
P
L
F
V
M
L
F
C
Y
G
F
T
----
L
R
T
L
F
K
A
H
M
-----------------
G
Q
K
H
R
A
M
R
V
I
F
A
V
V
L
I
F
L
---
L
C
W
L
P
Y
N
L
V
L
L
----
A
----
D
T
L
M
RTQVIQE
S
C
E
R
R
N
N
------
I
G
R
A
L
D
A
T
----
E
I
-
L
G
F
L
H
S
C
L
N
P
I
I
Y
A
F
I
G
Q
N
F
R
H
G
F
L
K
I
L
A
M
H
G
------------------------
42
Fugue
59.45
8%
-104
- C3 -
7REQ
3
MUTA_PROFR
B:
[15-474]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
T
P
T
T
L
S
L
A
G
--
D
F
P
K
A
T
E
E
Q
W
E
R
E
V
E
K
V
L
N
R
G
-
R
P
P
E
K
Q
L
T
F
A
E
C
L
K
R
L
T
V
H
T
V
D
G
I
D
I
V
P
M
Y
-
R
P
K
D
A
P
K
K
L
GYPG
V
A
P
F
T
R
G
T
T
V
R
N
G
D
M
D
A
W
---
D
V
R
A
L
H
E
D
P
D
E
K
F
T
R
K
A
I
L
E
G
L
E
R
G
V
T
S
L
L
L
R
V
DPDAIAPEH
L
D
E
V
L
S
DVLLE
M
T
K
V
E
V
F
S
R
Y
---
D
Q
G
A
A
A
E
A
L
V
S
V
Y
E
R
S
D
K
P
A
K
D
L
A
L
N
L
G
L
D
P
I
G
F
A
A
L
Q
G
T
E
P
D
L
T
V
L
G
D
W
V
R
R
L
AK
F
S
P
D
S
R
A
V
T
I
D
A
N
-
I
----
Y
----
H
N
A
GAG
D
V
A
E
L
A
W
A
L
A
T
G
A
E
Y
V
R
A
L
V
E
Q
G
F
T
A
T
E
A
F
D
T
I
N
F
--
R
V
T
A
T
HD
Q
F
L
T
I
A
R
L
--
R
--
A
-
L
R
E
A
W
A
R
I
G
E
V
F
G
V
D
E
D
K
R
G
A
R
Q
N
A
I
T
S
W
R
E
L
T
R
E
D
P
---------
Y
---
V
------
N
----------
I
---------
L
------
R
G
S
I
A
T
F
S
A
S
V
G
G
A
E
S
I
T
T
L
P
F
T
Q
A
L
G
L
P
E
D
D
--------
F
-
P
L
R
I
A
R
N
T
G
I
V
L
A
E
E
V
N
I
G
R
V
N
D
P
---
A
G
G
S
Y
Y
V
E
S
L
T
----
R
----
S
----------------
L
------
A
D
A
A
W
K
E
F
----
Q
E
-
V
E
K
L
G
G
M
S
K
A
V
M
T
E
H
V
T
K
V
L
D
A
C
N
A
E
R
A
K
R
L
A
N
R
K
Q
P
I
T
A
V
S
E
F
P
M
I
G
A
R
S
I
E
T
K
P
24
HHSearch
58.90
12%
-124
- C3 -
1U19
13
OPSD_BOVIN
A:
[74-327]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
PHEETN
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
Q
--------
Q
Q
E
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
GSD-------------
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
L
G
D
D
E
A
S
T
T
V
S
K
T
E
T
S
Q
V
A
P
A
-
18
PsiBlast_PDB
51.95
24%
10
- C4 -
3U75
2
?
A:
[296-452]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
T
F
S
E
V
E
H
G
V
L
G
-----
L
A
W
A
S
N
W
Q
Y
ADQ
V
--
P
T
N
P
W
R
S
S
T
S
L
A
R
N
Y
T
L
R
--
Y
V
H
T
N
A
E
TKQL
T
L
I
Q
N
P
V
L
P
DSI
N
V
V
D
K
L
K
K
K
N
V
K
L
T
NKK
P
I
K
T
N
F
K
G
S
T
---
G
L
-
F
D
F
N
I
T
F
K
V
L
N
L
N
V
S
P
G
K
T
H
F
D
I
L
------
I
N
S
Q
E
L
N
----
S
S
V
D
S
I
K
I
G
F
D
S
S
Q
S
S
F
Y
I
D
R
H
I
P
N
V
E
F
P
R
K
Q
F
F
T
D
K
L
A
A
Y
-
L
E
P
L
D
Y
D
Q
D
----
L
R
V
F
S
L
Y
G
I
V
D
K
N
I
I
E
L
Y
---
F
N
D
G
T
V
A
M
T
N
T
F
F
M
G
E
G
K
Y
P
H
D
I
Q
I
V
T
D
T
E
E
P
L
--------------------
F
E
L
E
S
V
I
I
R
E
---
L
N
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
HHSearch
51.06
13%
-142
- C3 -
3ODU
6
CXCR4_HUMAN (first)
A:
[54-236]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
T
E
G
Y
Y
T
I
G
I
G
H
---
L
L
T
K
S
P
S
L
N
A
A
----
K
----
S
----------------
E
------
L
D
K
A
I
G
R
N
----
T
N
-
G
V
I
T
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
L
D
A
V
R
R
A
A
L
I
N
M
V
F
Q
M
G
E
T
G
V
17
PsiBlast_PDB
50.31
24%
14
- C4 -
3U14
4
?
A:
[296-452]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
T
F
S
E
V
E
H
G
V
L
G
-----
L
A
W
A
S
N
W
Q
Y
ADQ
V
--
P
T
N
P
W
R
S
S
T
S
L
A
R
N
Y
T
L
R
--
Y
V
H
T
N
A
E
TKQL
T
L
I
Q
N
P
V
L
P
DSI
N
V
V
D
K
L
K
K
K
NVKLTNK
K
P
I
K
T
N
F
K
G
S
T
---
G
L
-
F
D
F
N
I
T
F
K
V
L
N
L
N
V
S
P
G
K
T
H
F
D
I
L
------
I
N
S
Q
E
L
N
----
S
S
V
D
S
I
K
I
G
F
D
S
S
Q
S
S
F
Y
I
D
R
H
I
P
N
V
E
F
P
R
K
Q
F
F
T
D
K
L
A
A
Y
-
L
E
P
L
D
Y
D
Q
D
----
L
R
V
F
S
L
Y
G
I
V
D
K
N
I
I
E
L
Y
---
F
N
D
G
T
V
A
M
T
N
T
F
F
M
G
E
G
K
Y
P
H
D
I
Q
I
V
T
D
T
E
E
P
L
--------------------
F
E
L
E
S
V
I
I
R
E
---
L
N
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
50.02
24%
14
- C4 -
3KF3
3
INV_SCHOC
A:
[270-426]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
T
F
S
E
V
E
H
G
V
L
G
-----
L
A
W
A
S
N
W
Q
Y
ADQ
V
--
P
T
N
P
W
R
S
S
T
S
L
A
R
N
Y
T
L
R
--
Y
V
H
T
N
A
E
TKQL
T
L
I
Q
N
P
V
L
P
DSI
N
V
V
D
K
L
K
K
K
N
V
K
L
T
NK
K
P
I
K
T
N
F
K
G
S
T
---
G
L
-
F
D
F
N
I
T
F
K
V
L
N
L
N
V
S
P
G
K
T
H
F
D
I
L
------
I
N
S
Q
E
L
N
----
S
S
V
D
S
I
K
I
G
F
D
S
S
Q
S
S
F
Y
I
D
R
H
I
P
N
V
E
F
P
R
K
Q
F
F
T
D
K
L
A
A
Y
-
L
E
P
L
D
Y
D
Q
D
----
L
R
V
F
S
L
Y
G
I
V
D
K
N
I
I
E
L
Y
---
F
N
D
G
T
V
A
M
T
N
T
F
F
M
G
E
G
K
Y
P
H
D
I
Q
I
V
T
D
T
E
E
P
L
--------------------
F
E
L
E
S
V
I
I
R
E
---
L
N
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
49.80
24%
9
- C4 -
3KF5
3
INV_SCHOC
A:
[273-429]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
T
F
S
E
V
E
H
G
V
L
G
-----
L
A
W
A
S
N
W
Q
Y
ADQ
V
--
P
T
N
P
W
R
S
S
T
S
L
A
R
N
Y
T
L
R
--
Y
V
H
T
N
A
E
TKQL
T
L
I
Q
N
P
V
L
PDSI
N
V
V
D
K
L
K
K
K
NVKLTNK
K
P
I
K
T
N
F
K
G
S
T
---
G
L
-
F
D
F
N
I
T
F
K
V
L
N
L
N
V
S
P
G
K
T
H
F
D
I
L
------
I
N
S
Q
E
L
N
----
S
S
V
D
S
I
K
I
G
F
D
S
S
Q
S
S
F
Y
I
D
R
H
I
P
N
V
E
F
P
R
K
Q
F
F
T
D
K
L
A
A
Y
-
L
E
P
L
D
Y
D
Q
D
----
L
R
V
F
S
L
Y
G
I
V
D
K
N
I
I
E
L
Y
---
F
N
D
G
T
V
A
M
T
N
T
F
F
M
G
E
G
K
Y
P
H
D
I
Q
I
V
T
D
T
E
E
P
L
--------------------
F
E
L
E
S
V
I
I
R
E
---
L
N
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
49.04
24%
-63
- C3 -
4K5Y
4
CRFR1_HUMAN (first)
A:
[289-423]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
G
W
G
V
P
F
P
I
I
V
A
W
A
I
----
G
K
L
Y
Y
D
N
E
K
C
W
A
-
G
K
R
--
P
---
G
------
V
----------
Y
---------
T
------
D
Y
I
Y
Q
G
P
M
A
L
V
L
L
I
N
F
I
F
L
F
N
I
-
V
R
I
L
M
T
K
L
R
--------
A
-
S
T
T
S
E
T
I
Q
A
R
K
A
V
K
A
T
L
V
L
L
P
L
L
G
---
I
T
--
Y
M
L
A
F
V
N
----------------------------------
E
V
S
R
V
V
F
I
Y
F
N
A
F
-
L
E
S
F
Q
G
F
F
V
S
V
F
A
C
F
L
N
S
--------------------------------------