@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 : bsu02410: (2016-06-04 )
MNPIQHILDTYPLIVLDGAMATELERKGCNLNDSLWSAKILMEEPELIKQVHTDYFAAGADCAITASYQSTFEGFAARGLSEAEARRLIELSVSIAAEARDEFWSLEENRLNRPKPIIAASIGPYGAYLADGSEYRGNYAISEDELIEFHRPRMKALIEAGADVLACETIPCLTEAKAIVRLLKEFPETYAWISFSAKDGLHISDGTPAADCASWLDEHRQIAALGINCTPLQHIPSLIEELKKNTSKPIIVYPNSGEQYDPETKTWNGAACAESYGASARTWHEKGARLIGGCCRTKPENIQEIAAWARSLKTT
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...-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
--M
N
P
I
Q
H
I
L
DTY
P
L
I
V
LDG
A
M
A
T
E
L
E
R-------K-------GCNL-----------NDSLWS
A
K
-----
I
--LMEE
P
E
L
I
K
Q
V
H
T
D
Y
FAAGA
D
C
A
I
T
A
S
Y
Q
S
T
F
E
G
F
A
ARGL
S
E
A
E
A
R
R
L
I
E
L
S
V
S
I
A
A
E
A
R
D
E
FW
S
L
E
E
NRLNRPK
P
I
I
A
A
SIGPYGAYL--A-D-GSEYRGNY-A-I
S
E
D
E
L
I
E
F
H
R
P
R
M
K
A
L
I
E
AGA
D
V
L
A
CETIP
C
L
T
E
A
K
-
A
I
V
R
L
L
K
E-----F-PE
T
Y
A
----
W
I
S
FSA-KD--
G
L
HISDGT
P
A
A
D
C
A
S
W
L
D
E
HR
Q
I
A
A
LGINC-----T--
P
-
L
Q
H
I
P
S
L
I
E
-----
E
L
K
KN-T-----SK
P
I
I
V
Y-PNSGEQ-----------YDPETKT-WNG-----------
A
A
C
A
E
SYGASA
R
T
W
H
E
K
G
-
A
R
L
I
G
G
C
CRTK
P
E
N
I
Q
E
I
A
A
W
A
R
SLKTT-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
76.63
52%
-115
- C4 -
5DMM
5
MMUM_ECOLI
A:
[5-308]
---
N
P
L
R
A
L
L
D
K
Q
D
I
L
L
L
D
G
A
M
A
T
E
L
E
A
-------
R
-------
G
C
N
L
-----------
A
D
S
L
W
S
A
K
-----
V
--
L
V
E
N
P
E
L
I
R
E
V
H
L
D
Y
Y
R
A
G
A
Q
C
A
I
T
A
S
Y
Q
A
T
P
A
G
F
A
A
R
G
L
D
E
A
Q
S
K
A
L
I
G
K
S
V
E
L
A
R
K
A
R
E
A
Y
--
L
A
E
N
P
-
Q
A
G
T
L
L
V
A
G
S
V
G
P
Y
G
A
Y
L
--
A
-
D
-
G
S
E
Y
R
G
D
Y
-
H
-
C
S
V
E
A
F
Q
A
F
H
R
P
R
V
E
A
L
L
D
A
G
A
D
L
L
A
C
E
T
L
P
N
F
S
E
I
E
-
A
L
A
E
L
L
T
A
-----
Y
-
P
R
A
R
A
----
W
F
S
F
T
L
-
R
D
--
S
E
H
L
S
D
G
T
P
L
R
D
V
V
A
L
L
A
G
Y
P
Q
V
V
A
L
G
I
N
C
-----
I
--
A
-
L
E
N
T
T
A
A
L
Q
-----
H
L
H
G
L
-
T
-----
V
L
P
L
V
V
Y
-
P
N
S
G
---------------------------------------
Q
-
L
A
D
Y
L
P
Q
W
Q
A
A
G
-
A
R
L
I
G
G
C
C
R
T
T
P
A
D
I
A
A
L
K
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
76.20
52%
-114
- C4 -
5DML
1
MMUM_ECOLI
A:
[5-308]
---
N
P
L
R
A
L
L
D
K
Q
D
I
L
L
L
D
G
A
M
A
T
E
L
E
A
-------
R
-------
G
C
N
L
-----------
A
D
S
L
W
S
A
K
-----
V
--
L
V
E
N
P
E
L
I
R
E
V
H
L
D
Y
Y
R
A
G
A
Q
C
A
I
T
A
S
Y
Q
A
T
P
A
G
F
A
A
R
G
L
D
E
A
Q
S
K
A
L
I
G
K
S
V
E
L
A
R
K
A
R
E
A
Y
--
L
A
E
N
P
-
Q
A
G
T
L
L
V
A
G
S
V
G
P
Y
G
A
Y
L
--
A
-
D
-
G
S
E
Y
R
G
D
Y
-
H
-
C
S
V
E
A
F
Q
A
F
H
R
P
R
V
E
A
L
L
D
A
G
A
D
L
L
A
C
E
T
L
P
N
F
S
E
I
E
-
A
L
A
E
L
L
T
A
-----
Y
-
P
R
A
R
A
----
W
F
S
F
T
L
-
R
D
--
S
E
H
L
S
D
G
T
P
L
R
D
V
V
A
L
L
A
G
Y
P
Q
V
V
A
L
G
I
N
C
-----
I
--
A
-
L
E
N
T
T
A
A
L
Q
-----
H
L
H
G
L
-
T
-----
V
L
P
L
V
V
Y
-
P
N
S
G
E
H
------------------------------------
A
Q
-
L
A
D
Y
L
P
Q
W
Q
A
A
G
-
A
R
L
I
G
G
C
C
R
T
T
P
A
D
I
A
A
L
K
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_CBE
75.10
52%
-143
- C4 -
5DMN
1
MMUM_ECOLI
B:
[5-308]
---
N
P
L
R
A
L
L
D
K
Q
D
I
L
L
L
D
G
A
M
A
T
E
L
E
A
-------
R
-------
G
C
N
-----------------
S
A
K
-----
V
--
L
V
E
N
P
E
L
I
R
E
V
H
L
D
Y
Y
R
A
G
A
Q
C
A
I
-----------
A
A
R
G
L
D
E
A
Q
S
K
A
L
I
G
K
S
V
E
L
A
R
K
A
R
E
A
Y
--
L
A
E
N
P
-
Q
A
G
T
L
L
V
A
G
S
V
G
P
Y
G
----------------
Y
-
H
-
C
S
V
E
A
F
Q
A
F
H
R
P
R
V
E
A
L
L
D
A
G
A
D
L
L
A
C
E
T
L
P
N
F
S
E
I
E
-
A
L
A
E
L
L
T
A
-----
Y
-
P
R
A
R
A
----
W
F
S
F
T
L
-
R
D
--
S
E
H
L
S
D
G
T
P
L
R
D
V
V
A
L
L
A
G
Y
P
Q
V
V
A
L
G
I
N
C
-----
I
--
A
-
L
E
N
T
T
A
A
L
Q
-----
H
L
H
G
L
-
T
-----
V
L
P
L
V
V
Y
-
P
N
S
G
---------------------------------------
Q
-
L
A
D
Y
L
P
Q
W
Q
A
A
G
-
A
R
L
I
G
G
C
C
R
T
T
P
A
D
I
A
A
L
K
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
HHSearch
75.07
51%
-116
- C4 -
5DMM
5
MMUM_ECOLI
A:
[5-309]
---
N
P
L
R
A
L
L
D
K
Q
D
I
L
L
L
D
G
A
M
A
T
E
L
E
A
-------
R
-------
G
C
N
L
-----------
A
D
S
L
W
S
A
K
-----
V
--
L
V
E
N
P
E
L
I
R
E
V
H
L
D
Y
Y
R
A
G
A
Q
C
A
I
T
A
S
Y
Q
A
T
P
A
G
F
A
A
R
G
L
D
E
A
Q
S
K
A
L
I
G
K
S
V
E
L
A
R
K
A
R
E
A
Y
L
A
E
---
N
P
Q
A
G
T
L
L
V
A
G
S
V
G
P
Y
G
A
Y
L
--
A
-
D
-
G
S
E
Y
R
G
D
Y
-
H
-
C
S
V
E
A
F
Q
A
F
H
R
P
R
V
E
A
L
L
D
A
G
A
D
L
L
A
C
E
T
L
P
N
F
S
E
I
E
-
A
L
A
E
L
L
T
A
-----
Y
-
P
R
A
R
A
----
W
F
S
F
T
L
-
R
D
--
S
E
H
L
S
D
G
T
P
L
R
D
V
V
A
L
L
A
G
Y
P
Q
V
V
A
L
G
I
N
C
-----
I
--
A
-
L
E
N
T
T
A
A
L
Q
-----
H
L
H
G
L
-
T
-----
V
L
P
L
V
V
Y
-
P
N
S
G
----------------------------------------
Q
L
A
D
Y
L
P
Q
W
Q
A
A
G
-
A
R
L
I
G
G
C
C
R
T
T
P
A
D
I
A
A
L
K
A
R
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
74.52
52%
-139
- C4 -
5DMN
1
MMUM_ECOLI
A:
[5-308]
---
N
P
L
R
A
L
L
D
K
Q
D
I
L
L
L
D
G
A
M
A
T
E
L
E
A
-------
R
-------
G
C
N
-----------------
S
A
K
-----
V
--
L
V
E
N
P
E
L
I
R
E
V
H
L
D
Y
Y
R
A
G
A
Q
C
A
I
T
A
S
Y
-------
A
A
R
G
L
D
E
A
Q
S
K
A
L
I
G
K
S
V
E
L
A
R
K
A
R
E
A
Y
--
L
A
E
N
P
-
Q
A
G
T
L
L
V
A
G
S
V
G
P
Y
G
----------------
Y
-
H
-
C
S
V
E
A
F
Q
A
F
H
R
P
R
V
E
A
L
L
D
A
G
A
D
L
L
A
C
E
T
L
P
N
F
S
E
I
E
-
A
L
A
E
L
L
T
A
-----
Y
-
P
R
A
R
A
----
W
F
S
F
T
L
-
R
D
--
S
E
H
L
S
D
G
T
P
L
R
D
V
V
A
L
L
A
G
Y
P
Q
V
V
A
L
G
I
N
C
-----
I
--
A
-
L
E
N
T
T
A
A
L
Q
-----
H
L
H
G
L
-
T
-----
V
L
P
L
V
V
Y
-
P
N
S
G
---------------------------------------
Q
-
L
A
D
Y
L
P
Q
W
Q
A
A
G
-
A
R
L
I
G
G
C
C
R
T
T
P
A
D
I
A
A
L
K
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
44
Fugue
62.66
30%
-108
- C4 -
4CCZ
1
METH_HUMAN
A:
[4-638]
T
L
R
D
E
I
N
A
I
L
Q
K
-
R
I
M
V
L
D
G
G
M
G
T
M
I
Q
R
-------
E
KLEEHFR
G
Q
E
F
-----------
K
D
H
A
R
P
L
K
GNNDI
L
--
S
I
T
Q
P
D
V
I
Y
Q
I
H
K
E
Y
L
L
A
--
D
I
I
E
T
N
T
F
S
S
T
S
I
A
Q
A
D
Y
G
L
-
E
H
L
A
Y
R
M
N
M
C
S
A
G
V
A
R
K
A
A
E
E
V
-
T
L
Q
T
G
----
I
K
R
F
V
A
G
A
L
G
P
T
N
K
T
L
SV
S
-
P
-
S
V
E
R
P
D
Y
R
-
N
-
I
T
F
D
E
L
V
E
A
Y
Q
E
Q
A
K
G
L
L
D
G
G
V
D
I
L
L
I
E
T
I
F
D
T
A
N
A
K
-
A
A
L
F
A
L
Q
N
-----
L
F
E
E
K
Y
A
P
R
P
I
F
I
S
G
T
I
-
V
D
--
K
S
G
R
T
L
S
G
Q
T
G
E
G
F
V
I
S
V
S
H
G
E
P
L
C
I
G
L
N
C
A----
L
--
G
-
A
A
E
M
R
P
F
I
E
-----
I
I
G
K
C
-
T
-----
T
A
Y
V
L
C
Y
-
P
N
A
G
F
A
-----------
M
D
G
L
V
N
-------------------------------------
I
V
G
G
C
C
G
S
T
P
D
H
I
R
E
I
A
E
A
V
K
N
C
K
P
R
VPPATAFEGHM
L
L
S
G
L
E
P
F
R
I
G
PYT
N
F
V
N
I
G
ERCNVAGS
R
K
F
A
K
L
I
M
A
GN
Y
E
E
A
L
C
V
A
K
V
Q
V
E
M
GAQ
V
L
D
V
N
MDDGMLD
G
P
S
A
M
T
R
F
C
N
L
I
A
S
E
PDIAK
V
P
L
C
I
D
S
SN
F
A
V
I
E
A
G
L
K
C
CQ
G
K
C
I
V
NSISLKEG
E
D
D
F
L
E
K
A
R
K
I
K
K
Y
G
A
A
M
V
V
M
AFDEEGQATE
T
D
T
K
I
R
V
C
T
R
A
Y
H
L
L
V
KKLGFNPND
I
I
F
D
PNILTIGTGMEEHNL
Y
A
I
N
F
I
H
A
T
K
V
I
K
E
T
L
PG
A
R
I
S
G
GLSNLSFSFRGM
E
A
I
R
E
A
M
H
G
V
F
L
Y
H
A
I
K
S
GMDMGIVNAGNLPVYDDIH
K
E
L
L
Q
L
C
E
D
L
I
W
NKDPE
A
T
E
K
L
L
R
YAQ
24
HHSearch
58.86
26%
-105
- C4 -
1Q7Z
1
?
A:
[11-292]
----------
L
S
E
R
V
L
L
L
D
G
A
Y
G
T
E
F
M
K
-------
Y
-------
G
Y
D
---------------
D
L
P
E
E
-----
L
--
N
I
K
A
P
D
V
V
L
K
V
H
R
S
Y
I
E
S
G
S
D
V
I
L
T
N
T
F
G
A
T
R
M
K
L
R
K
H
G
L
E
-
D
K
L
D
P
I
V
R
N
A
V
R
I
A
R
R
A
A
G
-------------
E
K
L
V
F
G
D
I
G
P
T
G
E
L
P
--
Y
-
P
-----
L
G
S
----
T
L
F
E
E
F
Y
E
N
F
R
E
T
V
E
I
M
V
E
E
G
V
D
G
I
I
F
E
T
F
S
D
I
L
E
L
K
-
A
A
V
L
A
A
R
E
-----
V
S
R
D
V
F
L
----
I
A
H
M
T
F
-
D
E
--
K
G
R
S
L
T
G
T
D
P
A
N
F
A
I
T
F
D
-
E
L
D
I
D
A
L
G
I
N
C
-----
S
--
L
G
P
E
E
I
L
P
I
F
Q
-----
E
L
S
Q
Y
-
T
-----
D
K
F
L
V
V
E
-
P
N
A
G
K
P
-----------
I
V
E
N
G
K
T
-
V
Y
P
-----------
L
K
-
P
H
D
F
A
V
H
I
D
S
Y
Y
E
L
G
-
V
N
I
F
G
G
C
C
G
T
T
P
E
H
V
K
L
F
R
K
V
L
G
N
R
K
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
57.82
29%
-111
- C4 -
4CCZ
-
METH_HUMAN
A:
[17-329]
--------------
I
M
V
L
D
G
G
M
G
T
M
I
Q
R
E
KLEEHF
R
-------
G
Q
E
F
-----------
K
D
H
A
R
P
L
K
GNNDI
L
--
S
I
T
Q
P
D
V
I
Y
Q
I
H
K
E
Y
L
L
A
--
D
I
I
E
T
N
T
F
S
S
T
S
I
A
Q
A
D
Y
G
L
-
E
H
L
A
Y
R
M
N
M
C
S
A
G
V
A
R
K
A
A
E
E
V
-
T
L
Q
T
G
----
I
K
R
F
V
A
G
A
L
G
P
T
N
K
T
L
--
S
V
S
-
P
S
V
E
R
P
D
Y
R
N
-
I
T
F
D
E
L
V
E
A
Y
Q
E
Q
A
K
G
L
L
D
G
G
V
D
I
L
L
I
E
T
I
F
D
T
A
N
A
K
-
A
A
L
F
A
L
Q
N
L
----
F
-
E
E
K
Y
A
P
R
P
I
F
I
S
G
T
I
-
V
D
KS
G
R
T
L
S
G
Q
T
G
E
G
F
V
I
S
V
--
S
H
G
E
P
L
C
I
G
L
N
C
-----
A
L-
G
-
A
A
E
M
R
P
F
I
E
-----
I
I
G
K
C
-
T
-----
T
A
Y
V
L
C
Y
-
P
N
A
G
------------------------------------------------
F
A
M
D
G
L
V
N
I
V
G
G
C
C
G
S
T
P
D
H
I
R
E
I
A
E
A
V
K
N
C
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
HHSearch
57.58
27%
-114
- C4 -
4CCZ
-
METH_HUMAN
A:
[12-330]
---------
I
L
Q
K
R
I
M
V
L
D
G
G
M
G
T
M
I
Q
R
-------
E
-------
K
L
-
E
EHFRGQEFKDH
A
R
P
L
K
G
N
N
-----
D
IL
S
I
T
Q
P
D
V
I
Y
Q
I
H
K
E
Y
L
L
A
--
D
I
I
E
T
N
T
F
S
S
T
S
I
A
Q
A
D
Y
G
L
E
-
H
L
A
Y
R
M
N
M
C
S
A
G
V
A
R
K
A
A
E
E
V
T
L
-----
Q
T
G
I
K
R
F
V
A
G
A
L
G
P
T
N
K
T
L
--
S
-
V
S
P
S
V
E
R
P
D
Y
-
R
N
I
T
F
D
E
L
V
E
A
Y
Q
E
Q
A
K
G
L
L
D
G
G
V
D
I
L
L
I
E
T
I
F
D
T
A
N
A
K
-
A
A
L
F
A
L
Q
N
L
F
EEK
Y
-
A
P
R
P
I
----
F
I
S
G
T
I
V
D
K
--
S
G
R
T
L
S
G
Q
T
G
E
G
F
V
I
S
V
S
-
H
G
E
P
L
C
I
G
L
N
C
-----
A
--
L
G
A
A
E
M
R
P
F
I
E
-----
I
I
G
K
C
-
T
-----
T
A
Y
V
L
C
Y
-
P
N
A
G
------------------------------------------------
F
A
M
D
G
L
V
N
I
V
G
G
C
C
G
S
T
P
D
H
I
R
E
I
A
E
A
V
K
N
C
K
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
56.79
27%
-96
- C4 -
1Q7Z
1
?
A:
[15-281]
--------------
V
L
L
L
D
G
A
Y
G
T
E
F
M
K
-------
Y
-------
G
Y
--------------
D
D
L
-
P
E
E
-----
L
--
N
I
K
A
P
D
V
V
L
K
V
H
R
S
Y
I
E
S
G
S
D
V
I
L
T
N
T
F
G
A
T
R
M
K
L
R
K
H
G
L
-
E
D
K
L
D
P
I
V
R
N
A
V
R
I
A
R
R
A
A
G
E
-------------
K
L
V
F
G
D
I
G
P
T
G
E
L
---------
P
Y
P
L
G
S
-
T
-
L
F
E
-
E
F
Y
E
N
F
R
E
T
V
E
I
M
V
E
E
G
V
D
G
I
I
F
E
T
F
S
D
I
L
E
L
K
-
A
A
V
L
A
A
R
E
-----
V
-
S
R
D
V
F
----
L
I
A
H
M
T
-
F
D
EK
G
R
S
L
T
-
G
T
D
P
A
N
F
A
I
T
F
D
E
-
L
D
I
D
A
L
G
I
N
C
-----
S
LG
P
-
E
E
I
L
P
-
I
F
Q
-----
E
L
S
Q
Y
-
T
-----
D
K
F
L
V
V
E
-
P
N
A
G
K
P
-----------
I
V
E
N
G
K
T
-
V
Y
------------
P
L
K
P
H
D
F
A
V
H
I
D
S
Y
Y
E
L
G
-
V
N
I
F
G
G
C
C
G
T
T
P
E
H
V
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
56.47
27%
-95
- C4 -
1Q85
2
?
A:
[15-281]
--------------
V
L
L
L
D
G
A
Y
G
T
E
F
M
K
-------
Y
-------
G
Y
--------------
D
D
L
-
P
E
E
-----
L
--
N
I
K
A
P
D
V
V
L
K
V
H
R
S
Y
I
E
S
G
S
D
V
I
L
T
N
T
F
G
A
T
R
M
K
L
R
K
H
G
L
-
E
D
K
L
D
P
I
V
R
N
A
V
R
I
A
R
R
A
A
G
E
-------------
K
L
V
F
G
D
I
G
P
T
G
E
L
---------
P
Y
P
L
G
S
-
T
-
L
F
E
-
E
F
Y
E
N
F
R
E
T
V
E
I
M
V
E
E
G
V
D
G
I
I
F
E
T
F
S
D
I
L
E
L
K
-
A
A
V
L
A
A
R
E
-----
V
-
S
R
D
V
F
----
L
I
A
H
M
T
-
F
D
EK
G
R
S
L
T
-
G
T
D
P
A
N
F
A
I
T
F
D
E
-
L
D
I
D
A
L
G
I
N
C
-----
S
LG
P
-
E
E
I
L
P
-
I
F
Q
-----
E
L
S
Q
Y
-
T
-----
D
K
F
L
V
V
E
-
P
N
A
G
K
P
-----------
I
V
E
N
G
K
T
-
V
Y
------------
P
L
K
P
H
D
F
A
V
H
I
D
S
Y
Y
E
L
G
-
V
N
I
F
G
G
C
C
G
T
T
P
E
H
V
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
56.45
27%
-93
- C4 -
1Q7M
-
?
A:
[15-281]
--------------
V
L
L
L
D
G
A
Y
G
T
E
F
M
K
-------
Y
-------
G
Y
--------------
D
D
L
-
P
E
E
-----
L
--
N
I
K
A
P
D
V
V
L
K
V
H
R
S
Y
I
E
S
G
S
D
V
I
L
T
N
T
F
G
A
T
R
M
K
L
R
K
H
G
L
-
E
D
K
L
D
P
I
V
R
N
A
V
R
I
A
R
R
A
A
G
E
-------------
K
L
V
F
G
D
I
G
P
T
G
E
L
---------
P
Y
P
L
G
S
-
T
-
L
F
E
-
E
F
Y
E
N
F
R
E
T
V
E
I
M
V
E
E
G
V
D
G
I
I
F
E
T
F
S
D
I
L
E
L
K
-
A
A
V
L
A
A
R
E
-----
V
-
S
R
D
V
F
----
L
I
A
H
M
T
-
F
D
EK
G
R
S
L
T
-
G
T
D
P
A
N
F
A
I
T
F
D
E
-
L
D
I
D
A
L
G
I
N
C
-----
S
LG
P
-
E
E
I
L
P
-
I
F
Q
-----
E
L
S
Q
Y
-
T
-----
D
K
F
L
V
V
E
-
P
N
A
G
K
P
-----------
I
V
E
N
G
K
T
-
V
Y
------------
P
L
K
P
H
D
F
A
V
H
I
D
S
Y
Y
E
L
G
-
V
N
I
F
G
G
C
C
G
T
T
P
E
H
V
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
56.16
27%
-95
- C4 -
1Q8A
2
?
A:
[15-281]
--------------
V
L
L
L
D
G
A
Y
G
T
E
F
M
K
-------
Y
-------
G
Y
--------------
D
D
L
-
P
E
E
-----
L
--
N
I
K
A
P
D
V
V
L
K
V
H
R
S
Y
I
E
S
G
S
D
V
I
L
T
N
T
F
G
A
T
R
M
K
L
R
K
H
G
L
-
E
D
K
L
D
P
I
V
R
N
A
V
R
I
A
R
R
A
A
G
E
-------------
K
L
V
F
G
D
I
G
P
T
G
E
L
---------
P
Y
P
L
G
S
-
T
-
L
F
E
-
E
F
Y
E
N
F
R
E
T
V
E
I
M
V
E
E
G
V
D
G
I
I
F
E
T
F
S
D
I
L
E
L
K
-
A
A
V
L
A
A
R
E
-----
V
-
S
R
D
V
F
----
L
I
A
H
M
T
-
F
D
EK
G
R
S
L
T
-
G
T
D
P
A
N
F
A
I
T
F
D
E
-
L
D
I
D
A
L
G
I
N
C
-----
S
LG
P
-
E
E
I
L
P
-
I
F
Q
-----
E
L
S
Q
Y
-
T
-----
D
K
F
L
V
V
E
-
P
N
A
G
K
P
-----------
I
V
E
N
G
K
T
-
V
Y
------------
P
L
K
P
H
D
F
A
V
H
I
D
S
Y
Y
E
L
G
-
V
N
I
F
G
G
C
C
G
T
T
P
E
H
V
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
56.16
27%
-94
- C4 -
3BOL
3
?
A:
[15-282]
--------------
V
L
L
L
D
G
A
Y
G
T
E
F
M
K
-------
Y
-------
G
Y
--------------
D
D
L
-
P
E
E
-----
L
--
N
I
K
A
P
D
V
V
L
K
V
H
R
S
Y
I
E
S
G
S
D
V
I
L
T
N
T
F
G
A
T
R
M
K
L
R
K
H
G
L
-
E
D
K
L
D
P
I
V
R
N
A
V
R
I
A
R
R
A
A
G
E
-------------
K
L
V
F
G
D
I
G
P
T
G
E
L
---------
P
Y
P
L
G
S
-
T
-
L
F
E
-
E
F
Y
E
N
F
R
E
T
V
E
I
M
V
E
E
G
V
D
G
I
I
F
E
T
F
S
D
I
L
E
L
K
-
A
A
V
L
A
A
R
E
-----
V
-
S
R
D
V
F
----
L
I
A
H
M
T
-
F
D
EK
G
R
S
L
T
-
G
T
D
P
A
N
F
A
I
T
F
D
E
-
L
D
I
D
A
L
G
I
N
C
-----
S
LG
P
-
E
E
I
L
P
-
I
F
Q
-----
E
L
S
Q
Y
-
T
-----
D
K
F
L
V
V
E
-
P
N
A
G
K
P
-----------
I
V
E
N
G
K
T
-
V
Y
------------
P
L
K
P
H
D
F
A
V
H
I
D
S
Y
Y
E
L
G
-
V
N
I
F
G
G
C
C
G
T
T
P
E
H
V
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
55.89
27%
-92
- C4 -
3BOF
3
?
A:
[15-281]
--------------
V
L
L
L
D
G
A
Y
G
T
E
F
M
K
-------
Y
-------
G
Y
--------------
D
D
L
-
P
E
E
-----
L
--
N
I
K
A
P
D
V
V
L
K
V
H
R
S
Y
I
E
S
G
S
D
V
I
L
T
N
T
F
G
A
T
R
M
K
L
R
K
H
G
L
-
E
D
K
L
D
P
I
V
R
N
A
V
R
I
A
R
R
A
A
G
E
-------------
K
L
V
F
G
D
I
G
P
T
G
E
L
---------
P
Y
P
L
G
S
-
T
-
L
F
E
-
E
F
Y
E
N
F
R
E
T
V
E
I
M
V
E
E
G
V
D
G
I
I
F
E
T
F
S
D
I
L
E
L
K
-
A
A
V
L
A
A
R
E
-----
V
-
S
R
D
V
F
----
L
I
A
H
M
T
-
F
D
EK
G
R
S
L
T
-
G
T
D
P
A
N
F
A
I
T
F
D
E
-
L
D
I
D
A
L
G
I
N
C
-----
S
LG
P
-
E
E
I
L
P
-
I
F
Q
-----
E
L
S
Q
Y
-
T
-----
D
K
F
L
V
V
E
-
P
N
A
G
K
P
-----------
I
V
E
N
G
K
T
-
V
Y
------------
P
L
K
P
H
D
F
A
V
H
I
D
S
Y
Y
E
L
G
-
V
N
I
F
G
G
C
C
G
T
T
P
E
H
V
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
55.84
27%
-95
- C4 -
1Q8J
2
?
A:
[15-281]
--------------
V
L
L
L
D
G
A
Y
G
T
E
F
M
K
-------
Y
-------
G
Y
--------------
D
D
L
-
P
E
E
-----
L
--
N
I
K
A
P
D
V
V
L
K
V
H
R
S
Y
I
E
S
G
S
D
V
I
L
T
N
T
F
G
A
T
R
M
K
L
R
K
H
G
L
-
E
D
K
L
D
P
I
V
R
N
A
V
R
I
A
R
R
A
A
G
E
-------------
K
L
V
F
G
D
I
G
P
T
G
E
L
---------
P
Y
P
L
G
S
-
T
-
L
F
E
-
E
F
Y
E
N
F
R
E
T
V
E
I
M
V
E
E
G
V
D
G
I
I
F
E
T
F
S
D
I
L
E
L
K
-
A
A
V
L
A
A
R
E
-----
V
-
S
R
D
V
F
----
L
I
A
H
M
T
-
F
D
EK
G
R
S
L
T
-
G
T
D
P
A
N
F
A
I
T
F
D
E
-
L
D
I
D
A
L
G
I
N
C
-----
S
LG
P
-
E
E
I
L
P
-
I
F
Q
-----
E
L
S
Q
Y
-
T
-----
D
K
F
L
V
V
E
-
P
N
A
G
K
P
-----------
I
V
E
N
G
K
T
-
V
Y
------------
P
L
K
P
H
D
F
A
V
H
I
D
S
Y
Y
E
L
G
-
V
N
I
F
G
G
C
C
G
T
T
P
E
H
V
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
54.96
27%
-89
- C4 -
1Q7Q
-
?
A:
[15-281]
--------------
V
L
L
L
D
G
A
Y
G
T
E
F
M
K
-------
Y
-------
G
Y
--------------
D
D
L
-
P
E
E
-----
L
--
N
I
K
A
P
D
V
V
L
K
V
H
R
S
Y
I
E
S
G
S
D
V
I
L
T
N
T
F
G
A
T
R
M
K
L
R
K
H
G
L
-
E
D
K
L
D
P
I
V
R
N
A
V
R
I
A
R
R
A
A
G
E
-------------
K
L
V
F
G
D
I
G
P
T
G
E
L
---------
P
Y
P
L
G
S
-
T
-
L
F
E
-
E
F
Y
E
N
F
R
E
T
V
E
I
M
V
E
E
G
V
D
G
I
I
F
E
T
F
S
D
I
L
E
L
K
-
A
A
V
L
A
A
R
E
-----
V
-
S
R
D
V
F
----
L
I
A
H
M
T
-
F
D
EK
G
R
S
L
T
-
G
T
D
P
A
N
F
A
I
T
F
D
E
-
L
D
I
D
A
L
G
I
N
C
-----
S
LG
P
-
E
E
I
L
P
-
I
F
Q
-----
E
L
S
Q
Y
-
T
-----
D
K
F
L
V
V
E
-
P
N
A
G
K
P
-----------
I
V
E
N
G
K
T
-
V
Y
------------
P
L
K
P
H
D
F
A
V
H
I
D
S
Y
Y
E
L
G
-
V
N
I
F
G
G
C
C
G
T
T
P
E
H
V
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
53.52
22%
0
- C- -
1LT7
1
BHMT1_HUMAN
A:
[17-331]
---------
L
N
A
G
E
I
V
I
G
D
G
G
F
V
F
A
L
E
K
-------
R
-------
G
Y
--------------------------------
H
P
E
A
V
R
Q
L
H
R
E
F
L
R
A
G
S
N
V
M
Q
T
F
T
--------------------
V
N
E
A
A
A
D
I
A
R
Q
V
A
D
E
G
D
A
L
-----------
V
A
G
G
V
S
Q
T
P
S
Y
L
--
S
------------
A
-
K
S
E
T
E
V
K
K
V
F
L
Q
Q
L
E
V
F
M
K
K
N
V
D
F
L
I
A
E
Y
F
E
H
V
E
E
A
V
W
A
V
E
T
L
I
A
S
-----
G
-
K
P
V
A
A
----
T
M
A
I
G
P
-
E
G
--
D
L
H
---
G
V
P
P
G
E
A
A
V
R
L
V
K
-
A
G
A
S
I
I
G
V
N
C
HFD
P
T
I
--
S
-
L
K
T
V
K
L
M
K
E
G
L
E
A
A
Q
L
K
A
H
L
M
-----
S
Q
P
L
A
Y
H
T
P
D
A
N
K
Q
GFIDLPEFPFG
L
E
P
R
V
A
T
R
W
D
---------------
I
Q
K
Y
---
A
R
E
A
Y
N
L
G
-
V
R
Y
I
G
G
C
C
G
F
E
P
Y
H
I
R
A
I
A
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
Fugue
52.36
20%
-93
- C4 -
1LT8
5
BHMT1_HUMAN
A:
[11-371]
---
K
G
I
L
E
R
L
N
A
G
E
I
V
I
G
D
G
G
F
V
F
A
L
E
K
-------
R
-------
G
-
Y
V
-----------
K
A
G
P
W
T
P
E
-----
A
--
A
V
E
H
P
E
A
V
R
Q
L
H
R
E
F
L
R
A
G
S
N
V
M
Q
T
F
T
F
Y
A
S
----------
E
D
K
G
Q
E
V
N
E
A
A
A
D
I
A
R
Q
V
A
D
E
-----------
G
D
A
L
V
A
G
G
V
S
Q
T
P
S
Y
L
--
S
-
A
-
K
S
-----------
E
T
E
V
K
K
V
F
L
Q
Q
L
E
V
F
M
K
K
N
V
D
F
L
I
A
E
Y
F
E
H
V
E
E
A
V
-
W
A
V
E
T
L
I
A
-----
S
-
G
K
P
-
V
----
A
A
T
M
A
I
-
G
P
--
E
G
D
L
H
G
V
P
P
G
E
A
A
V
R
L
V
K
A
G
--
A
S
I
I
G
V
N
C
-----
H
--
F
D
P
T
I
S
L
K
T
V
K
-----
L
M
K
E
G
-
L
E
A
A
Q
L
K
A
H
L
M
S
Q
-
P
L
A
Y
H
T
-----------
P
D
A
N
K
Q
G
-
F
I
D
LPEFPFGLEPR
V
A
T
R
W
D
I
Q
K
Y
A
R
E
A
Y
N
L
G
-
V
R
Y
I
G
G
C
C
G
F
E
P
Y
H
I
R
A
I
A
E
E
L
A
P
E
R
G
F
LPPASEKHGSWGSGLDMHTK
P
W
V
R
A
R
AR
K
E
Y
W
E
N
LRIASGRPYNPS
M
S
K
P
D----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
49.07
22%
-94
- C4 -
1LT8
3
BHMT1_HUMAN
A:
[17-311]
---------
L
N
A
G
E
I
V
I
G
D
G
G
F
V
F
A
L
E
K
-------
R
-------
G
Y
-
V
-----------
K
A
G
P
W
T
P
E
-----
A
--
A
V
E
H
P
E
A
V
R
Q
L
H
R
E
F
L
R
A
G
S
N
V
M
Q
T
F
T
F
Y
A
S
E
D
K
----------
G
Q
E
V
N
E
A
A
A
D
I
A
R
Q
V
A
D
E
G
D
A
L
-----------
V
A
G
G
V
S
Q
T
P
S
Y
L
--
S
------------
A
-
K
S
E
T
E
V
K
K
V
F
L
Q
Q
L
E
V
F
M
K
K
N
V
D
F
L
I
A
E
Y
F
E
H
V
E
E
A
V
W
A
V
E
T
L
I
A
S
-----
G
-
K
P
V
A
A
----
T
M
A
I
G
P
-
E
G
--
D
L
H
---
G
V
P
P
G
E
A
A
V
R
L
V
K
-
A
G
A
S
I
I
G
V
N
C
HFD
P
T
I
--
S
-
L
K
T
V
K
L
M
K
E
G
L
E
A
A
Q
L
K
A
H
L
M
-----
S
Q
P
L
A
Y
H
T
P
D
A
N
K
Q
GFIDLPEFPFG
L
E
P
R
V
A
T
R
W
D
---------------
I
Q
K
Y
---
A
R
E
A
Y
N
L
G
-
V
R
Y
I
G
G
C
C
G
F
E
P
Y
H
I
R
A
I
A
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------