@TOME V2.2
(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 : S29A3_HUMAN: (2015-12-10 )
MAVVSEDDFQHSSNSTYRTTSSSLRADQEALLEKLLDRPPPGLQRPEDRFCGTYIIFFSLGIGSLLPWNFFITAKEYWMFKLRNSSSPATGEDPEGSDILNYFESYLAVASTVPSMLCLVANFLLVNRVAVHIRVLASLTVILAIFMVITALVKVDTSSWTRGFFAVTIVCMVILSGASTVFSSSIYGMTGSFPMRNSQALISGGAMGGTVSAVASLVDLAASSDVRNSALAFFLTATVFLVLCMGLYLLLSRLEYARYYMRPVLAAHVFSGEEELPQDSLSAPSVASRFIDSHTPPLRPILKKTASLGFCVTYVFFITSLIYPAICTNIESLNKGSGSLWTTKFFIPLTTFLLYNFADLCGRQLTAWIQVPGPNSKALPGFVLLRTCLIPLFVLCNYQPRVHLKTVVFQSDVYPALLSSLLGLSNGYLSTLALLYGPKIVPRELAEATGVVMSFYVCLGLTLGSACSTLLVHLI
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...------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
----MAVVSEDDFQH-SSNS
T
Y
R
TTSSSLRA
D
Q
E
A
L
L
E
K
L
LDR-P-PPGLQRP
E
D
RF-C
G
--------------
T
Y
I
I
F
F
SLGIGSLLP
W
N
F
F
I
T
A
K
E
Y
-------------------------
W
M
F
K
LRNSSSPATGEDPE
G
-------
S
D
I
L
N
Y
F
E
S
Y
L
A
V
A
S
T
V
P
S
M
L
C
L
V
A
N
F
L
L
--
V
N
R
V
A
V
H
I
R
V
L
A
S
L
T
V
I
L
A
I
F
M
V
I
T
A
L
V
K--VDTSSWT
R
G
F
F
A
V
--
T
I
V
C
M
V
I
LSG
A
S
T
V
F
SSSIYGMTG-SFPMRN
S
Q
A
LI--S---G---GAMG------
G
T
V
S
A
V
A
S
L
V
D
L
AASSDV
R
N
S
A
L
A
F
F
L
T
A
T
V
F
L
------------
V
L
C
M
G
L
Y
L
L
-
L
S
R
L
E
Y
-
A
R
Y
Y
M
R
P
V
L
A
A
H
VFS-GEEELPQDSLSA
P
S
V
A
-
S
R
F
I
DSHTP
P
L
R
--
P
I
L
--------------------
K
K
TAS
L
-
G
F
C
V
T
Y
V
F
F
------
I
T
S
L
I
Y
P
A
-
I
C
T
N
I
E
S
LNKGSG
S
L
-
W
T
T
K
-
F
F
I
--
P
-
L
T
T
F
L
-
L
Y
N
F
A
D
L
C---------GRQ
L
T
A
W
I
Q
VPGPNSKA
L
P
G
F
V
L
L
R
T
C
L
I
P
L
F
V
L
CNYQP
R
V
H
L
K
T
V
V
FQSD
V
Y
P
-
A
L
L
S
S
L
L
GLSN
G
Y
L
S
T
L
A
L
L
YGPKIV
P
R
E
L
A
E
A
-
T
G
V
V
M
S
F
Y
-
V
C
L
G
L
T
L
G
S
A
C
S
T
L
L
V
HLI------------
39
Fugue
74.25
19%
-117
- C1 -
4Q9T
-
?
A:
[12-446]
----
T
K
I
L
T
E
T
E
--
K
-
Y
S
V
T
K
L
S
T
D
L
S
F
L
P
------
F
E
G
L
V
D
T
-
A
-
L
Q
--------------------------
K
A
L
V
N
---
D
L
D
H
I
Y
I
W
N
Y
N
S
I
Q
K
D
T
-------------------------
P
I
C
K
I
S
L
H
S
S
P
P
----------------
I
C
L
F
T
S
S
I
N
G
I
C
I
I
N
K
K
N
----
S
Q
F
L
Y
--
F
E
D
I
S
T
I
N
N
L
A
H
V
L
D
L
K
L
K
D
N
E
N
I
T
S
T
I
N
--
C
E
P
S
G
--------------
I
I
I
A
T
S
L
G
R
V
L
F
I
T
I
K
D
S
T
G
-
K
P
K
L
E
L
K
Q
Q
L
I
KP
Q
---
N
---
S
F
F
F
------
R
N
L
D
S
S
K
E
I
I
S
L
K
K
G
P
I
V
G
K
G
E
R
L
L
Y
I
T
T
R
G
G
S
------------
L
Q
I
W
Q
L
-----
S
I
N
S
K
-
S
F
K
R
L
E
I
N
I
Y
E
H
V
L
D
-
S
L
Q
D
L
Y
P
F
A
H
G
T
L
-----
A
F
L
D
S
H
P
-------
I
Y
--------------------
S
D
T
S
S
A
-
H
L
T
L
A
S
I
S
N
-------
G
N
E
I
Y
Y
L
M
I
T
V
I
L
D
E
-
K
T
N
S
F
Q
I
-
F
S
I
Y
---------------------------------
K
L
N
T
Y
F
T
K
S
T
V
D
L
N
H
K
P
------
Q
L
F
I
P
N
A
L
D
S
I
V
S
P
--
T
L
S
V
Y
V
L
F
N
N
A
V
V
M
T
Q
I
S
S
K
L
D
S
S
F
----
P
L
R
R
K
W
E
D
I
I
R
F
N
K
D
V
E
----------------
I
I
G
S
G
Y
S
T
D
S
I
Y
V
I
C
KDM
G
V
L
K
I
A
S
H
30
Fugue
68.93
14%
-72
- C3 -
3V7I
-
?
A:
[0-389]
------------
A
M
A
-
A
Y
L
C
A
P
A
V
I
H
G
E
H
S
V
E
T
R
E
I
V
E
E
V
R
G
R
H
P
-
H
A
P
W
A
P
R
I
D
G
I
-
A
A
--------------
S
T
G
I
-----------------
E
S
R
G
-------------------------
W
M
L
P
L
E
A
A
V
A
P
G
G
G
G
D
L
G
A
-------
A
R
E
A
L
E
Q
D
A
N
R
A
I
A
A
L
K
A
----
V
P
A
S
Q
T
V
--
Q
E
R
T
A
P
A
W
E
A
V
Q
A
Y
G
E
R
A
A
R
G
A
L
Q
I
A
-------------
G
L
D
V
A
--
D
V
D
C
L
I
T
S
N
S
T
T
P
A
L
P
G
L
D
V
A
L
A
N
-
R
L
P
L
R
G
D
T
M
L
L
--
P
---
A
TQW
A
C
V
A
------
G
T
R
S
L
A
L
A
A
D
L
V
A
A
D
P
D
R
V
V
L
V
V
I
S
E
A
L
S
T
T
Y
Q
------------
P
A
D
D
T
L
E
S
L
-
I
V
R
L
L
F
-
A
-----
D
T
A
V
A
A
V
V
T
-
G
R
P
-
R
P
E
S
V
L
R
L
D
A
A
W
-
H
H
T
L
P
G
T
R
D
L
H
R
--
L
E
T
--------------------
R
A
D
G
T
H
-
F
V
M
D
R
R
G
P
R
------
A
V
Q
E
T
V
T
A
-
M
W
E
W
L
R
V
R
Y
E
D
D
P
S
S
-
W
H
P
D
-
V
L
L
AH
P
-
G
G
T
R
V
-
L
E
Y
M
E
Q
T
M
---------
P
D
E
W
P
S
-----------------------------------------------
G
-
L
L
S
Y
S
R
D
S
Y
T
S
G
N
R
G
G
A
A
V
F
D
I
L
R
R
A
H
D
A
G
Q
K
T
-
G
S
R
A
V
L
Y
A
-
A
A
P
G
L
T
A
T
A
L
E
G
E
W
L
----------------
32
Fugue
61.71
17%
-62
- C3 -
4YCZ
-
?
B:
[66-928]
S
E
Y
R
Y
A
A
L
A
K
D
A
Y
Q
Q
M
G
T
A
P
V
--
T
E
P
P
Q
V
I
L
G
T
E
D
L
L
S
R
L
Y
D
E
-
K
M
D
D
T
L
A
T
A
A
A
Q
L
-
A
A
L
W
R
E
H
V
D
ET
P
F
E
K
A
N
Y
L
A
N
L
A
L
Q
I
H
H
P
L
P
Q
T
L
F
R
W
L
N
E
Y
HMYGS
Q
V
D
D
I
L
R
H
RPSPACHSL
F
W
Q
A
V
F
I
A
L
K
V
G
D
A
A
R
L
L
D
Q
A
G
WGHVYAY
V
N
V
Q
R
A
V
D
E
T
I
A
V
L
E
S
C
P
T
L
F
R
V
R
A
R
G
L
L
E
H
L
R
R
F
A
E
G
W
E
I
Y
E
N
L
N
I
V
F
D
I
V
L
G
Q
Q
G
A
I
L
--
E
A
A
Q
D
W
L
E
A
T
V
G
L
AN
S
E
S
Y
L
D
R
L
A
R
A
F
H
T
A
V
E
S
D
F
V
E
I
G
M
A
C
V
F
E
D
N
I
K
G
V
--
I
---
G
---
L
L
R
G
WSLPI
A
A
A
V
A
E
I
A
S
L
G
K
W
L
E
V
D
G
I
K
D
S
T
L
V
Q
Y
A
Q
A
L
A
D
Y
EGLSSVQDRDGW
E
L
S
I
S
V
L
G
R
M
P
E
R
S
E
E
M
V
R
D
L
V
E
H
L
V
Q
Q
L
H
V
D
-
S
N
A
T
V
D
R
L
W
F
L
L
N
E
L
G
M
I
E
F
A
E
D
T
T
E
T
Y
G
--
D
I
L
ARDSHR
Y
G
E
A
M
W
Y
Y
A
L
AHR
P
N
K
V
R
E
V
M
N
L
L
T
S
Y
S
L
I
QPPAND
L
D
D
Y
L
Y
K
L
-
L
N
D
R
K
N
T
L
E
Q
C
A
S
Q
D
M
E
A
A
E
-
L
L
G
--
K
M
L
S
G
Y
A
S
L
R
Q
F
Y
D
I
R
PH
A
T
P
L
S
R
R
K
Q
A
A
T
A
L
I
S
V
I
A
S
S
D
D
E
D
F
L
L
A
L
L
G
E
A
L
V
F
V
S
D
P
T
L
D
Q
I
D
V
L
L
K
A
I
E
D
L
Q
A
V
G
S
-
R
V
Y
N
A
C
D
E
F
L
Q
L
V
L
A
S
A
P
--
G
G
S
S
L
V
A
S
Q
L
Q
R
S
L
S
G
T
G
G
E
D
I
M
R
R
L
R
L
G
L
A
K
D
L
A
G
L
W
L
A
E
A
------------
36
Fugue
59.28
15%
-103
- C3 -
4K5Y
5
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
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
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-----------
8
PsiBlast_PDB
54.11
36%
-179
- C4 -
4GQ6
1
MEN1_HUMAN
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
11
PsiBlast_PDB
53.29
36%
-179
- C4 -
5DD9
1
?
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
31
Fugue
53.09
11%
-113
- C3 -
3MX1
-
?
A:
[3-210]
------------
N
K
K
-
F
D
R
S
E
H
V
Y
R
N
D
S
F
L
E
L
I
K
D
A
V
R
F
F
S
G
T
-
P
-
V
H
S
L
P
P
P
E
R
F
Q
G
A
G
--------------
V
Y
A
L
Y
Y
T
G
H
Y
S
L
Y
D
E
Y
S
R
I
N
R
L
A
Y
N
-------------------------
L
P
I
Y
V
G
K
A
V
P
A
G
W
R
Q
S
R
I
S
-------
D
H
E
T
R
-------------------
A
G
S
E
L
--
S
N
R
I
R
E
H
G
R
N
I
A
K
T
S
N
L
D
L
C
D
F
S
C
R
F
V
I
F
--
E
A
-----
T
G
S
D
M
I
--
S
T
V
Q
A
A
L
I
K
I
Y
K
P
L
W
N
T
V
V
D
G
F
G
N
-
H
T
P
G
A
G
R
F
A
Q
A
--
K
S
D
W
D
---
V
I
H
P
------
G
R
E
W
A
E
K
C
T
G
V
H
S
E
P
Y
F
I
E
E
R
I
K
Q
Y
F
S
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
53.08
36%
-179
- C4 -
4OG4
2
MEN1_HUMAN
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
14
PsiBlast_PDB
52.96
36%
-178
- C4 -
5DDD
1
?
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
3
PsiBlast_PDB
52.93
36%
-178
- C4 -
4OG8
1
MEN1_HUMAN
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
7
PsiBlast_PDB
52.70
36%
-177
- C4 -
4GQ4
2
MEN1_HUMAN
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
13
PsiBlast_PDB
52.62
36%
-179
- C4 -
5DDB
1
?
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
1
PsiBlast_PDB
52.58
36%
-175
- C4 -
4OG6
2
MEN1_HUMAN
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
5
PsiBlast_PDB
52.53
36%
-176
- C4 -
4GPQ
-
MEN1_HUMAN
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
12
PsiBlast_PDB
52.49
36%
-179
- C4 -
5DDA
1
?
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
15
PsiBlast_PDB
52.45
36%
-174
* C4 *
5DDE
1
?
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
17
PsiBlast_PDB
52.43
36%
-176
- C4 -
4OG3
1
MEN1_HUMAN
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
9
PsiBlast_PDB
52.37
36%
-173
- C4 -
4X5Y
2
MEN1_HUMAN
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
6
PsiBlast_PDB
52.35
36%
-180
- C4 -
4GQ3
1
MEN1_HUMAN
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------
16
PsiBlast_PDB
52.30
36%
-175
- C4 -
5DDF
1
?
A:
[45-93]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
G
F
V
E
H
F
L
A
--
V
N
R
V
G
L
T
Y
F
P
V
A
D
L
S
I
I
A
A
L
Y
A
R
F
T
A
Q
I
R
G
A
V
D
L
S
L
Y
P
R
E
G
G
V
S
--
S
R
E
L
V
K
K
V
S
D
V
I
W
N
S
L
S
R
S
Y
F
K
D
R
-
A
H
I
Q
S
L
F
S
F
I
T
--
G
---
T
---
K
L
D
S
------
S
G
V
A
F
A
V
V
G
A
C
Q
A
L
G
L
R
D
V
H
L
A
L
S
E
D
H
A
W
V
V
F
G
------------
P
N
G
E
Q
T
A
E
V
-
T
W
H
G
K
G
-
N
E
D
R
R
G
Q
T
V
N
A
G
V
A
E
-
R
S
W
L
Y
L
K
G
S
Y
M
R
C
D
R
K
-
M
E
V
A
F
M
V
C
A
I
N
P
--
S
I
D
--------------------
L
H
T
D
S
L
-
E
L
L
Q
L
Q
Q
K
L
------
L
W
L
L
Y
D
L
G
-
H
L
E
R
Y
P
M
A
L
G
N
L
A
D
L
-
E
E
L
E
-
P
T
P
--
G
-
R
P
D
P
L
-
T
L
Y
H
K
G
I
A
---------
S
A
K
T
Y
Y
R
D
E
H
I
Y
P
Y
M
Y
L
A
G
Y
H
C
R
N
R
N
V
R
E
A
L
Q
A
W
A
D
T
A
T
V
I
Q
D
Y
N
Y
C
R
E
D
E
E
I
Y
-
K
E
F
F
E
V
A
N
D
V
I
P
N
L
L
K
E
A
A
S
L
L
E
A
G
S
Q
G
S
A
L
Q
D
-
P
E
C
F
A
H
L
L
-
R
F
Y
D
G
I
C
K
W
E
E
G
S
P
T
P
V
L
H
------------