@TOME V2.3
(Mar 2018)
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 : spr0525: (2017-12-24 )
MTLLQLQDVTYRYKNTAEAVLYQINYNFEPGKFYSIIGESGAGKSTLLSLLAGLDSPVEGSILFQGEDIRKKGYSYHRMHHISLVFQNYNLIDYLSPLENIQLVNKKASKDTLLELGLDESQIKRNVLQLSGGQQQRVAIARSLVSEAPVILADEPTGNLDPKTAGDIVELLKSLAQKTGKCVIVVTHSKEVAQASDITLELKDKKLTETRNTSK
Atome Classification :
(30 SA)
.........10.......-.20-.........30........40........50........60.....---...---70------------.---...-.--.--.-..80-........90........100---..--.-----------.-------------.------...----------.-----110-----.-.----.--...-----------...---120--------........----.130.......140.......150.......160.......170.......180......----.190.-.-.-....200.......210...-----------------------------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
M
T
L
L
Q
LQD
V
T
Y
RYKNTA
E
-
A
V
--
L
Y
Q
I
N
Y
NFEP
G
K
F
Y
S
I
IGESGA
G
K
S
T
L
L
S
L
L
A
GLDSPVE
G
S
I
L
FQG---E
D
I
---
R
-------------
K
---KGY-S--Y--
H
-
R
M
H
H
-
I
S
L
V
FQNY
N
L
I
D
Y
LSPL
E
N
-----
I
Q
--
L
-----------
V
-------------N------KKA----------S-----K-------
D
-
T
----
L
--
L
EL-----------GL
D
---
E
----------
S
Q
I
K
R
N
V
L
----QLSGG
Q
Q
Q
R
V
A
I
A
R
S
L
V
SEA
P
V
I
L
A
DEPTGNLDPKT
A
G
D
I
V
E
L
L
K
S
L
A
Q
KTG
K
C
V
I
V
V
TH----
S
K
EVA-Q-A-S
D
I
T
L
E
LKDKKLTETRNTSK-----------------------------------------------------------------------------------------------------------------------------
127
HHSearch
76.12
33%
-47
- C1 -
-
3RLF
2
MALK_ECOLI
A:
[2-218]
-
A
S
V
Q
L
Q
N
V
T
K
A
W
G
E
--
V
-
V
V
--
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
I
T
S
G
D
L
F
I
G
E
---
K
R
M
---
N
-------------
D
---
T
P
P
---------
A
E
R
G
-
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
-----
M
S
--
F
-----------
G
-------------
L
------
K
L
A
GAK
K
E
V
I
N
Q
R
V
-----
N
-------
Q
-
V
----
A
--
E
V
L
-----------
Q
L
A
---
H
-----------
L
L
D
R
K
P
K
----
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
----
D
Q
V
E
A
-
M
T
L
-
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
-------------------------------------------------------------------------------------------------------------------------------
126
HHSearch
72.58
33%
-39
* C1 *
-
2AWN
1
MALK_ECOLI
B:
[2-218]
-
A
S
V
Q
L
Q
N
V
T
K
A
W
G
E
--
V
-
V
V
--
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
I
T
S
G
D
L
F
I
G
E
---
K
R
M
---
N
-------------
D
---
T
P
P
---------
A
E
R
G
-
V
G
M
V
F
Q
S
Y
A
L
Y
P
H
L
S
V
A
E
N
-----
M
S
--
F
-----------
G
-------------
L
------
K
L
A
GAK
K
E
V
I
N
Q
R
V
-----
N
-------
Q
-
V
----
A
--
E
V
L
-----------
Q
L
A
---
H
-----------
L
L
D
R
K
P
K
----
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
R
I
E
I
S
R
L
H
K
R
L
G
R
T
M
I
Y
V
T
H
----
D
Q
V
E
A
-
M
T
L
-
A
D
K
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
-------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
71.94
39%
31
- C1 -
-
3TIF
4
Y796_METJA
B:
[1-220]
--
M
V
K
L
K
N
V
T
K
T
Y
K
M
G
E
E
-
I
I
YA
L
K
N
V
N
L
N
I
K
E
G
E
F
V
S
I
M
G
P
S
G
S
G
K
S
T
M
L
N
I
I
G
C
L
D
K
P
T
E
G
E
V
Y
I
D
N
IKT
N
D
L
---
D
-------------
D
---
D
E
L
-
T
--
K
--
I
-
R
R
D
K
-
I
G
F
V
F
Q
Q
F
N
L
I
P
L
L
T
A
L
E
N
-----
V
E
--
L
-----------
P
LIFKYRGAMSGEE
R
------
R
K
R
----------
A
-----
L
-------
E
-
C
----
L
--
K
M
A
-----------
E
L
E
---
E
----------
R
F
A
N
H
K
P
N
----
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
N
N
P
P
I
I
L
A
D
Q
P
T
W
A
L
D
S
K
T
G
E
K
I
M
Q
L
L
K
K
L
N
E
E
D
G
K
T
V
V
V
V
T
H
----
D
I
N
V
A
-
R
-
F
-
G
E
R
I
I
Y
L
K
D
----------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
71.84
39%
29
- C1 -
-
3TIF
4
Y796_METJA
A:
[1-220]
--
M
V
K
L
K
N
V
T
K
T
Y
K
M
G
E
E
-
I
I
Y
A
L
K
N
V
N
L
N
I
K
E
G
E
F
V
S
I
M
G
P
S
G
S
G
K
S
T
M
L
N
I
I
G
C
L
D
K
P
T
E
G
E
V
Y
I
D
N
IKT
N
D
L
---
D
-------------
D
---
D
E
L
-
T
--
K
--
I
-
R
R
D
K
-
I
G
F
V
F
Q
Q
F
N
L
I
P
L
L
T
A
L
E
N
-----
V
E
--
L
-----------
P
LIFKYR
G
A
M
S
G
E
E
R
------
R
K
R
----------
A
-----
L
-------
E
-
C
----
L
--
K
M
A
-----------
E
L
E
---
E
----------
R
F
A
N
H
K
P
N
----
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
N
N
P
P
I
I
L
A
D
Q
P
T
W
A
L
D
S
K
T
G
E
K
I
M
Q
L
L
K
K
L
N
E
E
D
G
K
T
V
V
V
V
T
H
----
D
I
N
V
A
-
R
-
F
-
G
E
R
I
I
Y
L
K
D
----------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
71.52
40%
29
- C1 -
-
1L2T
3
Y796_METJA
A:
[1-220]
--
M
I
K
L
K
N
V
T
K
T
Y
K
M
G
E
E
-
I
I
Y
A
L
K
N
V
N
L
N
I
K
E
G
E
F
V
S
I
M
G
P
S
G
S
G
K
S
T
M
L
N
I
I
G
C
L
D
K
P
T
E
G
E
V
Y
I
D
N
IKT
N
D
L
---
D
-------------
D
---
D
E
L
-
T
--
K
--
I
-
R
R
D
K
-
I
G
F
V
F
Q
Q
F
N
L
I
P
L
L
T
A
L
E
N
-----
V
E
--
L
-----------
P
LIFKYR
G
A
M
S
G
E
E
R
------
R
K
R
----------
A
-----
L
-------
E
-
C
----
L
--
K
M
A
-----------
E
L
E
---
E
----------
R
F
A
N
H
K
P
N
----
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
N
N
P
P
I
I
L
A
D
Q
P
T
G
A
L
D
S
K
T
G
E
K
I
M
Q
L
L
K
K
L
N
E
E
D
G
K
T
V
V
V
V
T
H
----
D
I
N
V
A
-
R
-
F
-
G
E
R
I
I
Y
L
K
D
----------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
71.36
40%
37
- C1 -
-
1F3O
1
Y796_METJA
A:
[2-220]
---
I
K
L
K
N
V
T
K
T
Y
K
M
G
E
E
-
I
I
YA
L
K
N
V
N
L
N
I
K
E
G
E
F
V
S
I
M
G
P
S
G
S
G
K
S
T
M
L
N
I
I
G
C
L
D
K
P
T
E
G
E
V
Y
I
D
N
IKT
N
D
L
---
D
-------------
D
---
D
E
L
-
T
--
K
--
I
-
R
R
D
K
-
I
G
F
V
F
Q
Q
F
N
L
I
P
L
L
T
A
L
E
N
-----
V
E
--
L
-----------
P
L
I
F
K
YRGAMS
G
E
E
R
------
R
K
R
----------
A
-----
L
-------
E
-
C
----
L
--
K
M
A
-----------
E
L
E
---
E
----------
R
F
A
N
H
K
P
N
----
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
N
N
P
P
I
I
L
A
D
E
P
T
G
A
L
D
S
K
T
G
E
K
I
M
Q
L
L
K
K
L
N
E
E
D
G
K
T
V
V
V
V
T
H
----
D
I
N
V
A
-
R
-
F
-
G
E
R
I
I
Y
L
K
D
----------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
70.06
40%
32
- C1 -
-
1L2T
3
Y796_METJA
B:
[1-220]
--
M
I
K
L
K
N
V
T
K
T
Y
K
M
G
E
E
-
I
I
YA
L
K
N
V
N
L
N
I
K
E
G
E
F
V
S
I
M
G
P
S
G
S
G
K
S
T
M
L
N
I
I
G
C
L
D
K
P
T
E
G
E
V
Y
I
D
N
IKT
N
D
L
---
D
-------------
D
---
D
E
L
-
T
--
K
--
I
-
R
R
D
K
-
I
G
F
V
F
Q
Q
F
N
L
I
P
L
L
T
A
L
E
N
-----
V
E
--
L
-----------
P
LIFKYRGAMSGEE
R
------
R
K
R
----------
A
-----
L
-------
E
-
C
----
L
--
K
M
A
-----------
E
L
E
---
E
----------
R
F
A
N
H
K
P
N
----
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
N
N
P
P
I
I
L
A
D
Q
P
T
G
A
L
D
S
K
T
G
E
K
I
M
Q
L
L
K
K
L
N
E
E
D
G
K
T
V
V
V
V
T
H
----
D
I
N
V
A
-
R
-
F
-
G
E
R
I
I
Y
L
K
D
----------------------------------------------------------------------------------------------------------------------------------------
139
HHSearch
68.12
32%
-76
- C1 -
-
4MRP
-
ATM1_NOVAD
A:
[360-580]
--
S
V
T
F
D
N
V
V
F
G
Y
D
R
D
-
R
-
E
I
--
L
H
G
L
S
F
E
V
A
A
G
S
R
V
A
I
V
G
P
S
G
A
G
K
S
T
I
A
R
L
L
F
R
F
Y
D
P
W
E
G
R
I
L
I
D
G
---
Q
D
I
---
A
-------------
H
---
V
T
Q
-
T
--
S
--
L
--
R
A
A
-
L
G
I
V
P
Q
D
S
V
L
F
N
D
-
T
I
G
Y
N
-----
I
A
--
Y
-----------
G
-------------
R
------
D
G
A
----------
S
-----
R
A
E
V
D
---
A
-
A
----
A
--
K
G
A
AI
A
D
F
I
A
R
LPQ
G
Y
D
---
T
-----------
E
V
G
E
R
G
L
----
K
L
S
G
G
E
K
Q
R
V
A
I
A
R
T
L
V
K
N
P
P
I
L
L
F
D
E
A
T
S
A
L
D
T
R
T
E
Q
D
I
L
S
T
M
R
A
V
A
--
S
H
R
T
T
I
S
I
A
H
----
R
L
S
T
I
-
A
-
D
-
S
D
T
I
L
V
L
D
Q
G
R
L
A
E
Q
G
S
H
L
------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
68.07
34%
0
- C- -
-
5NIL
-
?
J:
[4-240]
--
L
L
E
L
K
D
I
R
R
S
Y
P
A
G
D
E
-
Q
V
EV
L
K
G
I
S
L
D
I
Y
A
G
E
M
V
A
I
V
G
A
S
G
S
G
K
S
T
L
M
N
I
L
G
C
L
D
K
A
T
S
G
T
Y
R
V
A
G
---
Q
D
V
---
A
-------------
T
LDA
D
A
L
-
A
--
Q
--
L
-
R
R
E
H
-
F
G
F
I
F
Q
R
Y
H
L
L
S
H
L
T
A
E
Q
N
-----
V
E
--
V
PAVYAG-----
L
-------------
E
------
R
K
Q
RLLR------
A
-----
Q
-------
E
-
L
----
L
--
Q
R
L
-----------
G
L
----
E
----------
D
R
T
E
Y
Y
P
A
----
Q
L
S
G
G
Q
Q
Q
R
V
S
I
A
R
A
L
M
N
G
G
Q
V
I
L
A
D
E
P
T
G
A
L
D
S
H
S
G
E
E
V
M
A
I
L
H
Q
L
R
D
R
-
G
H
T
V
I
I
V
T
H
----
D
P
Q
V
A
-
A
-
Q
-
A
E
R
V
I
E
I
R
D
G
E
I
-------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
68.07
34%
0
- C- -
-
5NIK
-
?
J:
[4-240]
--
L
L
E
L
K
D
I
R
R
S
Y
P
A
G
D
E
-
Q
V
EV
L
K
G
I
S
L
D
I
Y
A
G
E
M
V
A
I
V
G
A
S
G
S
G
K
S
T
L
M
N
I
L
G
C
L
D
K
A
T
S
G
T
Y
R
V
A
G
---
Q
D
V
---
A
-------------
T
LDA
D
A
L
-
A
--
Q
--
L
-
R
R
E
H
-
F
G
F
I
F
Q
R
Y
H
L
L
S
H
L
T
A
E
Q
N
-----
V
E
--
V
PAVYAG-----
L
-------------
E
------
R
K
Q
RLLR------
A
-----
Q
-------
E
-
L
----
L
--
Q
R
L
-----------
G
L
----
E
----------
D
R
T
E
Y
Y
P
A
----
Q
L
S
G
G
Q
Q
Q
R
V
S
I
A
R
A
L
M
N
G
G
Q
V
I
L
A
D
E
P
T
G
A
L
D
S
H
S
G
E
E
V
M
A
I
L
H
Q
L
R
D
R
-
G
H
T
V
I
I
V
T
H
----
D
P
Q
V
A
-
A
-
Q
-
A
E
R
V
I
E
I
R
D
G
E
I
-------------------------------------------------------------------------------------------------------------------------------------
138
HHSearch
67.02
32%
-71
- C1 -
-
4MRS
-
ATM1_NOVAD
B:
[360-580]
--
S
V
T
F
D
N
V
V
F
G
Y
D
R
D
-
R
-
E
I
--
L
H
G
L
S
F
E
V
A
A
G
S
R
V
A
I
V
G
P
S
G
A
G
K
S
T
I
A
R
L
L
F
R
F
Y
D
P
W
E
G
R
I
L
I
D
G
---
Q
D
I
---
A
-------------
H
---
V
T
Q
-
T
--
S
--
L
--
R
A
A
-
L
G
I
V
P
Q
D
S
V
L
F
N
D
-
T
I
G
Y
N
-----
I
A
--
Y
-----------
G
-------------
R
------
D
G
A
----------
S
-----
R
A
E
V
D
---
A
-
A
----
A
--
K
G
A
AI
A
D
F
I
A
R
LPQ
G
Y
D
---
T
-----------
E
V
G
E
R
G
L
----
K
L
S
G
G
E
K
Q
R
V
A
I
A
R
T
L
V
K
N
P
P
I
L
L
F
D
E
A
T
S
A
L
D
T
R
T
E
Q
D
I
L
S
T
M
R
A
V
A
--
S
H
R
T
T
I
S
I
A
H
----
R
L
S
T
I
-
A
-
D
-
S
D
T
I
L
V
L
D
Q
G
R
L
A
E
Q
G
S
H
L
------------------------------------------------------------------------------------------------------------------------------
133
HHSearch
66.52
32%
-31
- C1 -
-
3FVQ
2
FBPC_NEIG1
B:
[3-223]
-
A
A
L
H
I
G
H
L
S
K
S
F
Q
N
--
T
-
P
V
--
L
N
D
I
S
L
S
L
D
P
G
E
I
L
F
I
I
G
A
S
G
C
G
K
T
T
L
L
R
C
L
A
G
F
E
Q
P
D
S
G
E
I
S
L
S
G
---
K
T
I
---
F
-------------
S
---
K
N
T
N
L
--
P
--
V
-
R
E
R
R
-
L
G
Y
L
V
Q
E
G
V
L
F
P
H
L
T
V
Y
R
N
-----
I
A
--
Y
-----------
G
-------------
L
------
G
N
G
KGRTAQERQR
I
-----
E
-------
A
-
M
----
L
--
E
L
T
-----------
G
I
S
---
E
-----------
L
A
G
R
Y
P
H
----
E
L
S
G
G
Q
Q
Q
R
A
A
L
A
R
A
L
A
P
D
P
E
L
I
L
L
D
E
P
F
S
A
L
D
E
Q
L
R
R
Q
I
R
E
D
M
I
A
A
L
R
A
N
G
K
S
A
V
F
V
S
H
----
D
R
E
E
A
-
L
Q
Y
-
A
D
R
I
A
V
M
K
Q
G
R
I
L
Q
T
A
S
P
-------------------------------------------------------------------------------------------------------------------------------
147
Fugue
65.68
31%
-19
- C1 -
-
1OXS
-
?
C:
[1-352]
M
V
R
I
I
V
K
N
V
S
K
V
F
K
K
G
K
V
-
V
A
--
L
D
N
V
N
I
N
I
E
N
G
E
R
F
G
I
L
G
P
S
G
A
G
K
T
T
F
M
R
I
I
A
G
L
D
V
P
S
T
G
E
L
Y
F
D
D
---
R
L
V
---
A
-------------
S
---
N
G
K
-
L
--
I
VP
P
-
E
D
R
K
-
I
G
M
V
F
Q
T
W
A
L
Y
P
N
L
T
A
F
E
N
-----
I
A
--
F
-----------
P
LTNMKM-------
S
------
K
E
E
----------
I
-----
R
-------
K
-
R
----
V
--
E
E
V
-----------
A
K
I
LDI
H
----------
H
V
L
N
H
F
P
R
----
E
L
S
G
G
Q
Q
Q
R
V
A
L
A
R
A
L
V
K
D
P
S
L
L
L
L
D
E
P
F
S
N
L
D
A
R
M
R
D
S
A
R
A
L
V
K
E
V
Q
S
R
L
G
V
T
L
L
V
V
S
H
----
D
P
A
D
I
-
F
-
A
I
A
D
R
V
G
V
L
V
K
G
K
L
V
Q
V
G
K
P
E
D
LYDNPVSIQVASLIGEINELEGKVTNEGVVIGSLRFPVSVSSDRAIIGIRPEDVKLSKDVIKDDSWILVGKGKVKVIGYQGGLFRITITPLDSEEEIFTYSDHPIHSGEEVLVYVRKDKIKVFEK
4
PsiBlast_PDB
64.49
39%
-4
- C1 -
-
2PCJ
-
LOLD_AQUAE
A:
[19-218]
--------------------
I
--
L
K
G
I
S
L
S
V
K
K
G
E
F
V
S
I
I
G
A
S
G
S
G
K
S
T
L
L
Y
I
L
G
L
L
D
A
P
T
E
G
K
V
F
L
E
G
---
K
E
V
D
YT
N
-------------
E
---
K
E
L
-
S
--
L
--
L
-
R
N
R
K
-
L
G
F
V
F
Q
F
H
Y
L
I
P
E
L
T
A
L
E
N
-----
V
I
--
V
-----------
P
M
L
K
M
GK-------
P
------
K
K
E
----------
A
-----
K
-------
E
-
R
G
E
Y
L
L
--
S
E
L
-----------
G
L
G
---
D
-----------
K
L
S
R
K
P
Y
----
E
L
S
G
G
E
Q
Q
R
V
A
I
A
R
A
L
A
N
E
P
I
L
L
F
A
D
E
P
T
G
N
L
D
S
A
N
T
K
R
V
M
D
I
F
L
K
I
-
N
E
G
G
T
S
I
V
M
V
T
H
----
E
R
E
L
A
-
E
-
L
-
T
H
R
T
L
E
M
K
D
G
K
V
V
------------------------------------------------------------------------------------------------------------------------------------
120
PsiBlast_CBE
64.17
32%
-24
- C1 -
-
3FVQ
2
FBPC_NEIG1
B:
[5-220]
---
L
H
I
G
H
L
S
K
S
F
Q
N
T
P
---
V
--
L
N
D
I
S
L
S
L
D
P
G
E
I
L
F
I
I
G
A
S
G
C
G
K
T
T
L
L
R
C
L
A
G
F
E
Q
P
D
S
G
E
I
S
L
S
G
---
K
T
I
---
F
-------------
S
---
K
N
T
-
N
--
L
--
P
V
R
E
R
R
-
L
G
Y
L
V
Q
E
G
V
L
F
P
H
L
T
V
Y
R
N
-----
I
A
YG
L
-----------
G
-------------
N
------
G
K
G
----------
R
-----
T
AQERQRI
E
-
A
----
M
--
L
E
L
-----------
T
G
I
---
S
----------
E
L
A
G
R
Y
P
H
----
E
L
S
G
G
Q
Q
Q
R
A
A
L
A
R
A
L
A
P
D
P
E
L
I
L
L
D
E
P
F
S
A
L
D
E
Q
L
R
R
Q
I
R
E
D
M
I
A
A
L
R
A
N
G
K
S
A
V
F
V
S
H
----
D
R
E
E
A
L
Q
-
Y
-
A
D
R
I
A
V
M
K
Q
G
R
I
L
Q
T
----------------------------------------------------------------------------------------------------------------------------------
121
PsiBlast_CBE
64.07
32%
-27
- C1 -
-
3FVQ
2
FBPC_NEIG1
A:
[5-225]
---
L
H
I
G
H
L
S
K
S
F
Q
N
T
P
---
V
--
L
N
D
I
S
L
S
L
D
P
G
E
I
L
F
I
I
G
A
S
G
C
G
K
T
T
L
L
R
C
L
A
G
F
E
Q
P
D
S
G
E
I
S
L
S
G
---
K
T
I
---
F
-------------
S
---
K
N
T
-
N
--
L
--
P
V
R
E
R
R
-
L
G
Y
L
V
Q
E
G
V
L
F
P
H
L
T
V
Y
R
N
-----
I
A
YG
L
-----------
G
-------------
N
------
G
K
G
----------
R
-----
T
A
Q
E
R
Q
R
I
E
-
A
----
M
--
L
E
L
-----------
T
G
I
---
S
----------
E
L
A
G
R
Y
P
H
----
E
L
S
G
G
Q
Q
Q
R
A
A
L
A
R
A
L
A
P
D
P
E
L
I
L
L
D
E
P
F
S
A
L
D
E
Q
L
R
R
Q
I
R
E
D
M
I
A
A
L
R
A
N
G
K
S
A
V
F
V
S
H
----
D
R
E
E
A
L
Q
-
Y
-
A
D
R
I
A
V
M
K
Q
G
R
I
L
Q
T
----------------------------------------------------------------------------------------------------------------------------------
128
HHSearch
63.54
29%
-74
- C1 -
-
3B60
2
MSBA_SALTY
D:
[341-562]
--
D
L
E
F
R
N
V
T
F
T
Y
P
G
R
E
V
-
P
A
--
L
R
N
I
N
L
K
I
P
A
G
K
T
V
A
L
V
G
R
S
G
S
G
K
S
T
I
A
S
L
I
T
R
F
Y
D
I
D
E
G
H
I
L
M
D
G
---
H
D
L
---
R
-------------
E
---
Y
T
L
-
A
--
S
--
L
--
R
N
Q
-
V
A
L
V
S
Q
N
V
H
L
F
N
D
-
T
V
A
N
N
-----
I
A
--
Y
-----------
A
-------------
R
------
T
E
E
----------
Y
SREQI
E
-------
E
-
A
----
A
--
R
M
A
-----------
Y
A
M
---
D
FINKMDNGLD
T
I
I
G
E
N
G
V
----
L
L
S
G
G
Q
R
Q
R
I
A
I
A
R
A
L
L
R
D
S
P
I
L
I
L
D
E
A
T
S
A
L
D
T
E
S
E
R
A
I
Q
A
A
L
D
E
L
Q
--
K
N
R
T
S
L
V
I
A
H
----
R
L
S
T
I
-
E
-
Q
-
A
D
E
I
V
V
V
E
D
G
I
I
V
E
R
G
T
H
-------------------------------------------------------------------------------------------------------------------------------
143
HHSearch
63.11
30%
-43
- C1 -
-
2YYZ
1
?
A:
[2-218]
-
P
S
I
R
V
V
N
L
K
K
Y
F
G
K
--
V
-
K
A
--
V
D
G
V
S
F
E
V
K
D
G
E
F
V
A
L
L
G
P
S
G
C
G
K
T
T
T
L
L
M
L
A
G
I
Y
K
P
T
S
G
E
I
Y
F
D
D
---
V
L
V
---
N
-------------
D
---
I
P
P
-
K
--------
Y
R
E
-
V
G
M
V
F
Q
N
Y
A
L
Y
P
H
M
T
V
F
E
N
-----
I
A
--
F
-----------
P
-------------
L
------
R
A
R
RISKD
E
V
E
K
R
V
-----
V
-------
E
-
I
----
A
--
R
K
L
-----------
L
I
D
---
N
-----------
L
L
D
R
K
P
T
----
Q
L
S
G
G
Q
Q
Q
R
V
A
L
A
R
A
L
V
K
Q
P
K
V
L
L
F
D
E
P
L
S
N
L
D
A
N
L
R
M
I
M
R
A
E
I
K
H
L
Q
Q
E
L
G
I
T
S
V
Y
V
T
H
----
D
Q
A
E
A
-
M
T
M
-
A
S
R
I
A
V
F
N
Q
G
K
L
V
Q
Y
G
T
P
-------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
62.89
39%
-3
- C1 -
-
2PCL
5
LOLD_AQUAE
A:
[19-218]
--------------------
I
--
L
K
G
I
S
L
S
V
K
K
G
E
F
V
S
I
I
G
A
S
G
S
G
K
S
T
L
L
Y
I
L
G
L
L
D
A
P
T
E
G
K
V
F
L
E
G
---
K
E
V
D
YT
N
-------------
E
---
K
E
L
-
S
--
L
--
L
-
R
N
R
K
-
L
G
F
V
F
Q
F
H
Y
L
I
P
E
L
T
A
L
E
N
-----
V
I
--
V
-----------
P
M
L
K
M
GK-------
P
------
K
K
E
----------
A
-----
K
-------
E
-
R
G
E
Y
L
L
--
S
E
L
-----------
G
L
G
---
D
-----------
K
L
S
R
K
P
Y
----
E
L
S
G
G
E
Q
Q
R
V
A
I
A
R
A
L
A
N
E
P
I
L
L
F
A
D
E
P
T
G
N
L
D
S
A
N
T
K
R
V
M
D
I
F
L
K
I
-
N
E
G
G
T
S
I
V
M
V
T
H
----
E
R
E
L
A
-
E
-
L
-
T
H
R
T
L
E
M
K
D
G
K
V
V
------------------------------------------------------------------------------------------------------------------------------------
47
PsiBlast_CBE
62.36
31%
-7
- C1 -
-
3TUI
1
METN_ECOLI
H:
[24-228]
--
M
I
K
L
S
N
I
T
K
V
F
H
Q
G
T
R
-
T
I
QA
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
---
Q
E
L
---
T
-------------
T
---
L
S
E
-
S
EL
T
--
K
-
A
R
R
Q
-
I
G
M
I
F
Q
H
F
N
L
L
S
S
R
T
V
F
G
N
-----
V
A
--
L
PLELDNTPKDE
V
-------------
K
------
R
R
V
----------
T
-----
E
-------
L
L
S
----
L
--
V
G
L
-----------
G
D
K
---
H
----------
D
S
Y
P
S
N
-------
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
L
E
L
L
K
D
I
N
R
R
L
G
L
T
I
L
L
I
T
H
----
E
M
D
V
V
-
K
----------------------------------------------------------------------------------------------------------------------------------------------------
37
PsiBlast_CBE
57.14
36%
31
- C1 -
-
2OLK
1
?
D:
[22-223]
---
L
Q
M
I
D
V
H
Q
L
K
K
S
F
G
S
L
E
V
--
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
---
I
N
L
---
K
-------------
A
---
K
D
T
-
N
--
L
--
N
-
K
V
R
E
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
-----
I
T
--
L
-----------
A
-------------
P
------
M
K
V
----------
R
-----
K
WPREKAE
A
-
K
----
A
--
M
E
L
------------
L
D
---
K
----------
V
G
L
K
D
K
A
H
AYPD
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
----
E
M
G
F
A
-
R
----------------------------------------------------------------------------------------------------------------------------------------------------
39
PsiBlast_CBE
55.85
36%
23
- C1 -
-
2OLK
2
?
B:
[22-223]
---
L
Q
M
I
D
V
H
Q
L
K
K
S
F
G
S
L
E
V
--
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
---
I
N
L
---
K
-------------
A
---
K
D
T
-
N
--
L
--
N
-
K
V
R
E
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
-----
I
T
--
L
-----------
A
-------------
P
------
M
K
V
----------
R
-----
K
WPREKAE
A
-
K
----
A
--
M
E
L
------------
L
D
---
K
----------
V
G
L
K
D
K
A
H
AYPD
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
----
E
M
G
F
A
-
R
----------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
55.77
37%
-19
- C1 -
-
4U00
1
?
A:
[19-205]
--------------------
V
--
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
Q
E
G
E
V
V
V
D
G
---
L
S
V
---
K
-------------
D
---
D
R
A
-
L
--
R
--
E
-
I
R
R
E
-
V
G
M
V
F
Q
Q
F
N
L
F
P
H
M
T
V
L
E
N
-----
V
T
--
L
-----------
A
P
M
R
V
RRWP-----
R
------
E
K
A
----------
E
-----
K
-------
K
-
A
----
L
E
L
L
E
R
-----------
V
G
I
---
L
----------
D
Q
A
R
K
Y
P
A
----
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
D
V
M
R
D
L
A
Q
-
G
G
M
T
M
V
V
V
T
H
E
M
G
F
A
R
E
V
A
------------------------------------------------------------------------------------------------------------------------------------------------------
41
PsiBlast_CBE
53.41
36%
33
- C1 -
-
3C41
2
?
K:
[1-202]
---
L
Q
M
I
D
V
H
Q
L
K
K
S
F
G
S
L
E
V
--
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
---
I
N
L
---
K
-------------
A
---
K
D
T
-
N
--
L
--
N
-
K
V
R
E
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
-----
I
T
--
L
-----------
A
-------------
P
------
M
K
V
----------
R
-----
K
WPREKAE
A
-
K
----
A
--
M
E
L
------------
L
D
---
K
----------
V
G
L
K
D
K
A
H
AYPD
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
----
E
M
G
F
A
-
R
----------------------------------------------------------------------------------------------------------------------------------------------------
42
PsiBlast_CBE
51.16
36%
35
- C1 -
-
3C41
2
?
J:
[1-202]
---
L
Q
M
I
D
V
H
Q
L
K
K
S
F
G
S
L
E
V
--
L
K
G
I
N
V
H
I
R
E
G
E
V
V
V
V
I
G
P
S
G
S
G
K
S
T
F
L
R
C
L
N
L
L
E
D
F
D
E
G
E
I
I
I
D
G
---
I
N
L
---
K
-------------
A
---
K
D
T
-
N
--
L
--
N
-
K
V
R
E
E
V
G
M
V
F
Q
R
F
N
L
F
P
H
M
T
V
L
N
N
-----
I
T
--
L
-----------
A
-------------
P
------
M
K
V
----------
R
-----
K
WPREKAE
A
-
K
----
A
--
M
E
L
------------
L
D
---
K
----------
V
G
L
K
D
K
A
H
AYPD
S
L
S
G
G
Q
A
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
L
S
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
----
E
M
G
F
A
-
R
----------------------------------------------------------------------------------------------------------------------------------------------------
28
PsiBlast_CBE
46.25
35%
42
- C1 -
-
4YMV
1
?
A:
[8-200]
------------
Y
K
N
F
G
S
L
E
V
--
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
T
K
G
E
V
F
I
D
G
---
V
K
I
---
N
-------------
N
---
G
K
V
-
N
--
I
--
N
-
K
V
R
Q
K
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
-----
I
T
--
L
APVKVKK----
M
-------------
N
------
K
K
E
----------
A
-----
E
E
L
A
V
---
D
-
L
----
L
--
A
K
V
-----------
G
L
L
---
D
----------
K
K
-
D
Q
Y
P
I
----
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
K
E
V
L
N
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
----
E
M
G
F
A
-
R
----------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
46.21
35%
47
- C1 -
-
4YMV
1
?
J:
[8-200]
------------
Y
K
N
F
G
S
L
E
V
--
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
T
K
G
E
V
F
I
D
G
---
V
K
I
---
N
-------------
N
---
G
K
V
-
N
--
I
--
N
-
K
V
R
Q
K
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
-----
I
T
--
L
APVKVKK----
M
-------------
N
------
K
K
E
----------
A
-----
E
ELAV---
D
-
L
----
L
--
A
K
V
-----------
G
L
L
---
D
----------
K
K
-
D
Q
Y
P
I
----
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
K
E
V
L
N
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
----
E
M
G
F
A
-
R
----------------------------------------------------------------------------------------------------------------------------------------------------
29
PsiBlast_CBE
44.42
35%
51
- C1 -
-
4YMU
1
?
A:
[8-200]
------------
Y
K
N
F
G
S
L
E
V
--
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
T
K
G
E
V
F
I
D
G
---
V
K
I
---
N
-------------
N
---
G
K
V
-
N
--
I
--
N
-
K
V
R
Q
K
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
-----
I
T
--
L
APVKVKK----
M
-------------
N
------
K
K
E
----------
A
-----
E
E
L
A
V
---
D
-
L
----
L
--
A
K
V
-----------
G
L
L
---
D
----------
K
K
-
D
Q
Y
P
I
----
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
K
E
V
L
N
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
----
E
M
G
F
A
-
R
----------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
44.11
35%
55
- C1 -
-
4YMU
1
?
J:
[8-200]
------------
Y
K
N
F
G
S
L
E
V
--
L
K
G
V
T
L
K
V
N
K
G
E
V
V
V
I
I
G
P
S
G
S
G
K
S
T
L
L
R
C
I
N
L
L
E
E
P
T
K
G
E
V
F
I
D
G
---
V
K
I
---
N
-------------
N
---
G
K
V
-
N
--
I
--
N
-
K
V
R
Q
K
V
G
M
V
F
Q
H
F
N
L
F
P
H
L
T
A
I
E
N
-----
I
T
--
L
APVKVKK----
M
-------------
N
------
K
K
E
----------
A
-----
E
ELAV---
D
-
L
----
L
--
A
K
V
-----------
G
L
L
---
D
----------
K
K
-
D
Q
Y
P
I
----
K
L
S
G
G
Q
K
Q
R
L
A
I
A
R
A
L
A
M
Q
P
E
V
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
K
E
V
L
N
V
M
K
Q
L
A
N
E
-
G
M
T
M
V
V
V
T
H
----
E
M
G
F
A
-
R
----------------------------------------------------------------------------------------------------------------------------------------------------
89
PsiBlast_CBE
37.90
34%
5
- C1 -
-
1B0U
1
HISP_SALTY
A:
[45-217]
----------------------------------------------
K
S
T
F
L
R
C
I
N
F
L
E
K
P
S
E
G
A
I
I
V
N
G
---
Q
N
I
---
N
L
V
R
D
KDGQLKVAD
K
---
N
Q
L
-
R
--
L
--
L
-
R
T
R
--
L
T
M
V
F
Q
H
F
N
L
W
S
H
M
T
V
L
E
N
V
M
EAP
I
Q
--
V
-----------
L
-------------
G
LS
K
H
D
A
R
E
R
----------
A
-----
L
-------
K
-
Y
----
L
--
A
K
V
-----------
G
I
D
---
E
----------
R
A
Q
G
K
Y
P
V
----
H
L
S
G
G
Q
Q
Q
R
V
S
I
A
R
A
L
A
M
E
P
D
V
L
L
F
D
E
P
T
S
A
L
D
P
E
L
V
G
E
V
L
R
I
M
Q
Q
L
A
E
E
-
G
K
T
M
V
V
V
T
H
----
E
M
G
F
A
-
R
----------------------------------------------------------------------------------------------------------------------------------------------------