@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 : I3TY23: (2017-12-13 )
MKLTIRDIAEMAGVSVTTVSQILNNKGSRFSDKTRKKVLSIVNEHHYKPDYFASNVINRHSKTIGMIVPDVTDFFFSKLIEGVESYLNPLGYVIMLCNSRHSQENEIKYLQELSHRSVDGILLATPNILPEKYALDSGFYQKMPIILIDRGLNRRDNGRLIVKEYEGAYQAVSLFIENGHTKIGMLKETTGYYQLEERFNGYRHALKDHGLPFNGKFVEHGELTVQGGYTASKKLLKHKDITAIFCGNDAMAIGCYQAIDELGKKIPEDISVIGFDGLKLSEYMIPQLTTVQQPSFDIGFYAARFLIDTIEFPQRKVPNKVFETKLIIRESVKVLTKG
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......
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
M
K
L
T
I
R
D
I
A
E
M
AG
V
S
V
T
T
V
S
Q
I
L
NNKGSRF-
S
D
K
T
R
K
K
V
L
S
I
V
N
EHHYK
P
D
Y
F
A
S
N
V
I
N
RHS
K
T
I
G
M
IVPD
V
T
D
F
F
F
S
K
L
I
E
G
V
E
S
Y
L
N
P
L
G
Y
V
I
M
L
CNSRHSQ
E
N
E
I
K
Y
L
Q
E
L
SHRSV
D
G
I
L
L
ATPNILPEKYALDSGF-YQKM
P
I
-
I
L
I
DRGLNR-RD-N
G
R
L
I
V
KEYEG
A
-
Y
Q
A
V
S
L
F
IENGH
T
K
I
G
M
----
L
KETTG
Y
-
Y
Q
L
E
E
R
F
N
G
Y
R
H
A
L
K
DHGLPFN
G
-
K
F
V
EHG
E
L
T
V
QGG
Y
T
A
S
K
K
L
L
K--H-KD
I
T
A
I
F
CGND
A
M
A
I
G
C
Y
Q
A
I
D
E
L
G
K
KIPEDI
S
V
IGFDGL
K
L
S
E
Y
MIPQLTTVQQPSF
D
I
G
F
Y
A
A
R
F
L
I
D
T
IEF
P
Q
RKVP
N
K
V
-
F
E
T
K
L
I
I
R
E
S
V
K
V
LTKG
67
HHSearch
78.19
31%
-64
- C2 -
-
1RZR
2
CCPA_BACME
C:
[1-331]
M
N
V
T
I
Y
D
V
A
R
E
A
S
V
S
M
A
T
V
S
R
V
V
N
G
N
-
P
N
V
-
K
P
S
T
R
K
K
V
L
E
T
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
N
I
F
Y
A
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
Q
D
K
E
L
H
L
L
N
N
M
L
G
K
Q
V
D
G
I
I
F
M
S
G
N
V
T
E
E
-
H
-
V
E
E
L
K
-
K
S
P
V
P
V
-
V
L
A
A
S
I
E
S
T
-
N
Q
-
I
P
S
V
T
I
D
Y
E
Q
A
A
-
F
D
A
V
Q
S
L
I
D
S
G
H
K
N
I
A
F
----
V
S
G
T
L
E
E
P
I
N
H
A
K
K
V
K
G
Y
K
R
A
L
T
E
S
G
L
P
V
R
D
S
Y
I
V
E
-
G
D
Y
T
Y
D
S
G
I
E
A
V
E
K
L
L
E
--
E
D
E
K
P
T
A
I
F
V
G
T
D
E
M
A
L
G
V
I
H
G
A
Q
D
R
G
L
N
V
P
N
D
L
E
I
I
G
F
D
N
T
R
L
S
T
M
V
R
P
Q
L
T
S
V
V
Q
P
M
Y
D
I
G
A
V
A
M
R
L
L
T
K
Y
M
N
K
E
T
V
D
S
S
I
V
Q
-
L
P
H
R
I
E
F
R
Q
S
T
------
66
HHSearch
76.63
31%
-40
- C2 -
-
1JFT
2
PURR_ECOLI
A:
[1-335]
--
A
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
T
-
R
F
V
-
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
Y
P
E
P
L
--
L
A
M
L
E
E
Y
R
H
I
P
M
-
V
V
M
D
A
G
E
A
K
A
D
F
-
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
----
I
P
G
P
L
E
R
-
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
S
W
I
V
Q
-
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
--
Q
P
H
R
P
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
V
N
K
R
E
E
P
Q
S
I
E
-
V
H
P
R
L
I
E
R
R
S
V
A
D
G
P
F
-
26
PsiBlast_CBE
73.80
32%
-10
- C2 -
-
2PUB
2
PURR_ECOLI
A:
[2-330]
---
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
--
T
R
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
-
Y
P
E
P
L
L
A
M
L
E
E
-
Y
R
H
I
P
M
-
V
V
M
D
W
G
E
A
K
-
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
----
I
P
G
P
L
E
A
-
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
-
S
W
I
V
Q
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
QP
H
-
R
P
-
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
-
V
N
K
R
E
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
------
24
PsiBlast_CBE
73.26
32%
-12
- C2 -
-
2PUD
2
PURR_ECOLI
A:
[2-330]
---
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
--
T
R
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
-
Y
P
E
P
L
L
A
M
L
E
E
-
Y
R
H
I
P
M
-
V
V
M
D
W
G
E
A
K
-
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
----
I
P
G
P
L
E
A
-
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
-
S
W
I
V
Q
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
QP
H
-
R
P
-
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
-
V
N
K
R
E
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
------
23
PsiBlast_CBE
73.24
34%
-39
- C2 -
-
3OQM
2
CCPA_BACSU
C:
[1-305]
M
N
I
T
I
Y
D
V
A
R
E
A
N
V
S
M
A
T
V
S
R
V
V
N
G
-
N
P
N
V
-
K
P
T
T
R
K
K
V
L
E
A
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
S
I
F
Y
S
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
M
E
K
E
L
H
L
L
N
T
M
L
G
K
Q
V
D
G
I
V
F
M
G
G
N
I
T
D
E
H
V
A
----
E
-
F
K
R
S
P
V
P
I
V
L
A
A
S
V
E
E
-
Q
E
-
E
T
P
S
V
A
I
D
Y
E
Q
A
I
Y
D
A
V
K
L
L
V
D
K
G
H
T
D
I
A
F
----
V
S
G
P
M
A
E
P
I
N
R
S
K
K
L
Q
G
Y
K
R
A
L
E
E
A
N
L
P
F
N
E
-
Q
F
V
A
E
G
D
Y
T
Y
D
S
G
L
E
A
L
Q
H
L
M
S
L-
D
-
K
K
P
T
A
I
L
S
A
T
D
E
M
A
L
G
I
I
H
A
A
Q
D
Q
G
L
S
I
P
E
D
L
D
I
I
G
F
D
N
T
R
L
S
L
M
V
R
P
Q
L
S
T
V
V
Q
P
T
Y
D
I
G
A
V
A
M
R
L
L
---------------------------------
27
PsiBlast_CBE
73.19
32%
-11
- C2 -
-
2PUA
2
PURR_ECOLI
A:
[2-330]
---
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
--
T
R
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
-
Y
P
E
P
L
L
A
M
L
E
E
-
Y
R
H
I
P
M
-
V
V
M
D
W
G
E
A
K
-
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
----
I
P
G
P
L
E
A
-
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
-
S
W
I
V
Q
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
QP
H
-
R
P
-
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
-
V
N
K
R
E
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
------
14
PsiBlast_PDB
73.10
32%
-16
- C2 -
-
1PNR
2
PURR_ECOLI
A:
[2-330]
---
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
--
T
R
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
-
Y
P
E
P
L
L
A
M
L
E
E
-
Y
R
H
I
P
M
-
V
V
M
D
W
G
E
A
K
-
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
IPGP
L
E
R
N
T
G
-----
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
-
S
W
I
V
Q
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
QP
H
-
R
P
-
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
-
V
N
K
R
E
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
------
12
PsiBlast_PDB
72.98
32%
-15
- C2 -
-
1VPW
2
PURR_ECOLI
A:
[2-330]
---
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
--
T
R
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
M
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
-
Y
P
E
P
L
L
A
M
L
E
E
-
Y
R
H
I
P
M
-
V
V
M
D
W
G
E
A
K
-
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
P
L
E
R
N
T
G
-----
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
-
S
W
I
V
Q
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
QP
H
-
R
P
-
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
-
V
N
K
R
E
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
------
25
PsiBlast_CBE
72.94
32%
-11
- C2 -
-
2PUC
2
PURR_ECOLI
A:
[2-330]
---
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
--
T
R
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
-
Y
P
E
P
L
L
A
M
L
E
E
-
Y
R
H
I
P
M
-
V
V
M
D
W
G
E
A
K
-
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
----
I
P
G
P
L
E
A
-
N
T
G
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
-
S
W
I
V
Q
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
QP
H
-
R
P
-
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
-
V
N
K
R
E
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
------
7
PsiBlast_PDB
72.59
32%
-16
- C2 -
-
2PUG
2
PURR_ECOLI
A:
[2-330]
---
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
--
T
R
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
-
Y
P
E
P
L
L
A
M
L
E
E
-
Y
R
H
I
P
M
-
V
V
M
D
W
G
E
A
K
-
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
P
L
E
Q
N
T
G
-----
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
-
S
W
I
V
Q
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
QP
H
-
R
P
-
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
-
V
N
K
R
E
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
------
1
PsiBlast_PDB
72.46
34%
-41
- C2 -
-
3OQO
2
CCPA_BACSU
A:
[1-305]
M
N
I
T
I
Y
D
V
A
R
E
A
N
V
S
M
A
T
V
S
R
V
V
N
G
-
N
P
N
V
-
K
P
T
T
R
K
K
V
L
E
A
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
S
I
F
Y
S
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
M
E
K
E
L
H
L
L
N
T
M
L
G
K
Q
V
D
G
I
V
F
M
G
G
N
I
T
D
E
H
V
A
----
E
-
F
K
R
S
P
V
P
I
V
L
A
A
S
V
E
E
-
Q
E
-
E
T
P
S
V
A
I
D
Y
E
Q
A
I
Y
D
A
V
K
L
L
V
D
K
G
H
T
D
I
A
F
----
V
S
G
P
M
A
E
P
I
N
R
S
K
K
L
Q
G
Y
K
R
A
L
E
E
A
N
L
P
F
N
E
-
Q
F
V
A
E
G
D
Y
T
Y
D
S
G
L
E
A
L
Q
H
L
M
S
L-
D
-
K
K
P
T
A
I
L
S
A
T
D
E
M
A
L
G
I
I
H
A
A
Q
D
Q
G
L
S
I
P
E
D
L
D
I
I
G
F
D
N
T
R
L
S
L
M
V
R
P
Q
L
S
T
V
V
Q
P
T
Y
D
I
G
A
V
A
M
R
L
L
---------------------------------
5
PsiBlast_PDB
72.33
32%
-15
- C2 -
-
2PUE
2
PURR_ECOLI
A:
[2-330]
---
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
--
T
R
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
-
Y
P
E
P
L
L
A
M
L
E
E
-
Y
R
H
I
P
M
-
V
V
M
D
W
G
E
A
K
-
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
P
L
E
Q
N
T
G
-----
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
-
S
W
I
V
Q
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
QP
H
-
R
P
-
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
-
V
N
K
R
E
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
------
3
PsiBlast_PDB
72.33
34%
-40
- C2 -
-
3OQN
2
CCPA_BACSU
A:
[1-305]
M
N
I
T
I
Y
D
V
A
R
E
A
N
V
S
M
A
T
V
S
R
V
V
N
G
-
N
P
N
V
-
K
P
T
T
R
K
K
V
L
E
A
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
S
I
F
Y
S
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
M
E
K
E
L
H
L
L
N
T
M
L
G
K
Q
V
D
G
I
V
F
M
G
G
N
I
T
D
E
H
V
A
----
E
-
F
K
R
S
P
V
P
I
V
L
A
A
S
V
E
E
-
Q
E
-
E
T
P
S
V
A
I
D
Y
E
Q
A
I
Y
D
A
V
K
L
L
V
D
K
G
H
T
D
I
A
F
----
V
S
G
P
M
A
E
P
I
N
R
S
K
K
L
Q
G
Y
K
R
A
L
E
E
A
N
L
P
F
N
E
-
Q
F
V
A
E
G
D
Y
T
Y
D
S
G
L
E
A
L
Q
H
L
M
S
L-
D
-
K
K
P
T
A
I
L
S
A
T
D
E
M
A
L
G
I
I
H
A
A
Q
D
Q
G
L
S
I
P
E
D
L
D
I
I
G
F
D
N
T
R
L
S
L
M
V
R
P
Q
L
S
T
V
V
Q
P
T
Y
D
I
G
A
V
A
M
R
L
L
---------------------------------
2
PsiBlast_PDB
72.26
34%
-37
- C2 -
-
3OQM
2
CCPA_BACSU
A:
[1-305]
M
N
I
T
I
Y
D
V
A
R
E
A
N
V
S
M
A
T
V
S
R
V
V
N
G
-
N
P
N
V
-
K
P
T
T
R
K
K
V
L
E
A
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
S
I
F
Y
S
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
M
E
K
E
L
H
L
L
N
T
M
L
G
K
Q
V
D
G
I
V
F
M
G
G
N
I
T
D
E
H
V
A
----
E
-
F
K
R
S
P
V
P
I
V
L
A
A
S
V
E
E
-
Q
E
-
E
T
P
S
V
A
I
D
Y
E
Q
A
I
Y
D
A
V
K
L
L
V
D
K
G
H
T
D
I
A
F
----
V
S
G
P
M
A
E
P
I
N
R
S
K
K
L
Q
G
Y
K
R
A
L
E
E
A
N
L
P
F
N
E
-
Q
F
V
A
E
G
D
Y
T
Y
D
S
G
L
E
A
L
Q
H
L
M
S
L-
D
-
K
K
P
T
A
I
L
S
A
T
D
E
M
A
L
G
I
I
H
A
A
Q
D
Q
G
L
S
I
P
E
D
L
D
I
I
G
F
D
N
T
R
L
S
L
M
V
R
P
Q
L
S
T
V
V
Q
P
T
Y
D
I
G
A
V
A
M
R
L
L
---------------------------------
13
PsiBlast_PDB
72.21
32%
-15
- C2 -
-
1JFT
2
PURR_ECOLI
A:
[2-330]
---
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
--
T
R
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
-
Y
P
E
P
L
L
A
M
L
E
E
-
Y
R
H
I
P
M
-
V
V
M
D
A
G
E
A
K
-
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
P
L
E
R
N
T
G
-----
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
-
S
W
I
V
Q
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
QP
H
-
R
P
-
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
-
V
N
K
R
E
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
------
4
PsiBlast_PDB
72.18
32%
-16
- C2 -
-
1JH9
2
PURR_ECOLI
A:
[2-330]
---
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
--
T
R
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
-
Y
P
E
P
L
L
A
M
L
E
E
-
Y
R
H
I
P
M
-
V
V
M
D
R
G
E
A
K
-
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
P
L
E
R
N
T
G
-----
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
-
S
W
I
V
Q
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
QP
H
-
R
P
-
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
-
V
N
K
R
E
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
------
22
PsiBlast_CBE
72.15
34%
-35
- C2 -
-
3OQN
2
CCPA_BACSU
C:
[1-305]
M
N
I
T
I
Y
D
V
A
R
E
A
N
V
S
M
A
T
V
S
R
V
V
N
G
-
N
P
N
V
-
K
P
T
T
R
K
K
V
L
E
A
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
S
I
F
Y
S
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
M
E
K
E
L
H
L
L
N
T
M
L
G
K
Q
V
D
G
I
V
F
M
G
G
N
I
T
D
E
H
V
A
----
E
-
F
K
R
S
P
V
P
I
V
L
A
A
S
V
E
E
-
Q
E
-
E
T
P
S
V
A
I
D
Y
E
Q
A
I
Y
D
A
V
K
L
L
V
D
K
G
H
T
D
I
A
F
----
V
S
G
P
M
A
E
P
I
N
R
S
K
K
L
Q
G
Y
K
R
A
L
E
E
A
N
L
P
F
N
E
-
Q
F
V
A
E
G
D
Y
T
Y
D
S
G
L
E
A
L
Q
H
L
M
S
L-
D
-
K
K
P
T
A
I
L
S
A
T
D
E
M
A
L
G
I
I
H
A
A
Q
D
Q
G
L
S
I
P
E
D
L
D
I
I
G
F
D
N
T
R
L
S
L
M
V
R
P
Q
L
S
T
V
V
Q
P
T
Y
D
I
G
A
V
A
M
R
L
L
---------------------------------
21
PsiBlast_CBE
72.14
34%
-36
- C2 -
-
3OQO
2
CCPA_BACSU
C:
[1-305]
M
N
I
T
I
Y
D
V
A
R
E
A
N
V
S
M
A
T
V
S
R
V
V
N
G
-
N
P
N
V
-
K
P
T
T
R
K
K
V
L
E
A
I
E
R
L
G
Y
R
P
N
A
V
A
R
G
L
A
S
K
K
T
T
T
V
G
V
I
I
P
D
I
S
S
I
F
Y
S
E
L
A
R
G
I
E
D
I
A
T
M
Y
K
Y
N
I
I
L
S
N
S
D
Q
N
M
E
K
E
L
H
L
L
N
T
M
L
G
K
Q
V
D
G
I
V
F
M
G
G
N
I
T
D
E
H
V
A
----
E
-
F
K
R
S
P
V
P
I
V
L
A
A
S
V
E
E
-
Q
E
-
E
T
P
S
V
A
I
D
Y
E
Q
A
I
Y
D
A
V
K
L
L
V
D
K
G
H
T
D
I
A
F
----
V
S
G
P
M
A
E
P
I
N
R
S
K
K
L
Q
G
Y
K
R
A
L
E
E
A
N
L
P
F
N
E
-
Q
F
V
A
E
G
D
Y
T
Y
D
S
G
L
E
A
L
Q
H
L
M
S
L-
D
-
K
K
P
T
A
I
L
S
A
T
D
E
M
A
L
G
I
I
H
A
A
Q
D
Q
G
L
S
I
P
E
D
L
D
I
I
G
F
D
N
T
R
L
S
L
M
V
R
P
Q
L
S
T
V
V
Q
P
T
Y
D
I
G
A
V
A
M
R
L
L
---------------------------------
18
PsiBlast_PDB
72.00
32%
-16
- C2 -
-
1QP4
2
PURR_ECOLI
A:
[2-330]
---
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
--
T
R
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
-
Y
P
E
P
L
L
A
M
L
E
E
-
Y
R
H
I
P
M
-
V
V
M
D
W
G
E
A
K
-
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
P
L
E
R
N
T
G
-----
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
-
S
W
I
V
Q
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
QP
H
-
R
P
-
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
-
V
N
K
R
E
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
------
15
PsiBlast_PDB
71.93
32%
-15
- C2 -
-
1BDI
2
PURR_ECOLI
A:
[2-330]
---
T
I
K
D
V
A
K
R
A
N
V
S
T
T
T
V
S
H
V
I
N
K
--
T
R
F
V
A
E
E
T
R
N
A
V
W
A
A
I
K
E
L
H
Y
S
P
S
A
V
A
R
S
L
K
V
N
H
T
K
S
I
G
L
L
A
T
S
S
E
A
A
Y
F
A
E
I
I
E
A
V
E
K
N
C
F
Q
K
G
Y
T
L
I
L
G
N
A
W
N
N
L
E
K
Q
R
A
Y
L
S
M
M
A
Q
K
R
V
D
G
L
L
V
M
C
S
E
-
Y
P
E
P
L
L
A
M
L
E
E
-
Y
R
H
I
P
M
-
V
V
M
D
W
G
E
A
K
-
A
D
F
T
D
A
V
I
D
N
A
F
E
G
G
-
Y
M
A
G
R
Y
L
I
E
R
G
H
R
E
I
G
V
I
P
G
P
L
E
R
N
T
G
-----
A
G
R
L
A
G
F
M
K
A
M
E
E
A
M
I
K
V
P
E
-
S
W
I
V
Q
G
D
F
E
P
E
S
G
Y
R
A
M
Q
Q
I
L
S
QP
H
-
R
P
-
T
A
V
F
C
G
G
D
I
M
A
M
G
A
L
C
A
A
D
E
M
G
L
R
V
P
Q
D
V
S
L
I
G
Y
D
N
V
R
N
A
R
Y
F
T
P
A
L
T
T
I
H
Q
P
K
D
S
L
G
E
T
A
F
N
M
L
L
D
R
I
-
V
N
K
R
E
E
P
Q
S
I
E
V
H
P
R
L
I
E
R
R
S
V
------