@TOME V2.3
(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 : PA4358: (2016-02-26 )
MTALTLGLIGNPNSGKTTLFNQLTGSRQRVGNWAGVTVERKEGAFHTVRHAVRLVDLPGTYSLTSVSAQASLDEQIACRYIASGEVDVLVNVVDAANLERNLYLTVQLREMGIPCIVALNMLDIARSQRIRIDIDGLARRLGCPVVPLVSTRADGIDELKAAIDSLQLPQAALAVDYPPAIQAQVGYLLETRAPAASAIEPRWLALQALEGDIFNGPALGLPPATLEQARRGCGEEPELAIVDARYRLIGEICAAVCDHQQAQPHRLTQWLDRVVLNRWLGLPIFLLVMYLMFFFAINIGGALQPIFDKGSSAIFIDGIQWLGIRFGLPDWLTVFLAQGIGGGVNTVLPLVPQIGLMYLFLSLLEDSGYMARAAFVMDRLMQALGLPGKSFVPLIVGFGCNVPSIMGARTLDAQRERLITIMMAPFMSCGARLAIFAVFAGAFFGQGGALVIFSLYLLGIVVAILTGLLLKHTLMRGEASPFVMELPLYHVPHLKSLLLQTWSRLRGFVVRAGKVIILVSLVIGGLNSITLDGKPVQGDIGHSALASVSQRLTPLLAPLGVQPDNWQATVGLVTGAMAKEVVVGTLNTLYTAEQIQGEAFDYEGYDLPGQLREALVETWDGLVDTFSLSVLANPVEASMADGDMETGSMGTMASKFGSPIAAYSYLVFVLLYVPCVTAMGAIARESSKGWMAFSVLWGLNVAYSLATLCYQVATFAAHPERSVLTIAVVLLFNLILMTCLRLFGREQVLQLPGRMADAPSGQGGCH
Atome Classification :
(51 SA)
.........10........20........30........40........50........60........70........80........90........100.......110.......120.......130.......140.......150.....-.-.160.......170.-..---..-...180.......190.......200.......210---.......220.---.---.----...-------.---230...---.---...240.......250.......260.......270.......280.......290.......300.......310.......320.......330.......340.......350.......360.......370.......380.......390.......400.......410.......420.......430.......440.......450.......460.......470.......480.......490.......500.......510.......520.......530.......540.......550.......560.......570.......580.......590.......600.......610.......620.......630.......640.......650.......660.......670.......680.......690.......700.......710.......720.......730.......740.......750.......760....
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
M
T
A
L
T
L
G
L
IGNPNSG
K
T
T
L
F
N
Q
LTGSRQRVGNWA
G
V
T
V
ERKEG
A
F
H
T
V
R
H
A
V
R
L
VDLPGTY
S
L
TSVS
A
Q
AS
L
D
E
Q
I
A
C
R
Y
IASG
E
V
D
V
L
V
N
VVDAANLER
N
L
Y
L
T
V
Q
L
REMG
I
P
C
I
V
A
L
N
M
L
D
IARS
Q
R
I
R
I
D
I
D
G
L
A
R
R
LGCPVVPLVSTRAD
G
I
D
-
E
-
L
K
A
A
I
D
SLQLP
Q
A
-
A
-
L
A---VD-YPP
A
I
Q
A
Q
V
G
Y
L
L
ETRAPAASAIEPR
W
L
A
L
QALEGD---IFNGPALGLP
P
---
A
---
T
----
L
E
Q
-------
A
---
R
RGCGE---E---P
E
L
A
I
V
D
A
R
Y
R
L
I
G
E
I
C
A
A
V
CDHQQAQ
P
H
R
L
T
Q
W
L
D
R
V
V
L
N
RWL
G
L
P
I
F
L
L
V
M
Y
L
M
F
F
F
A
INIGGAL
Q
P
I
FDKGS
S
A
I
F
IDG
I
Q
W
L
G
I
RFG
L
P
D
W
L
T
V
F
L
A
QGIGG
G
V
N
T
V
L
P
L
V
P
Q
I
G
L
M
Y
L
F
L
S
L
L
EDSG
Y
M
A
R
A
A
F
V
M
D
R
L
M
Q
A
LGLPGK
S
F
V
P
L
I
V
GFGCNV
P
S
I
MGART
L
D
A
Q
R
E
R
L
I
T
I
M
M
A
P
F
M
SC
G
A
R
L
A
I
F
A
V
F
A
G
A
F
FGQG
G
A
L
V
I
F
S
L
Y
L
L
G
I
V
V
A
I
L
T
G
L
L
L
K
H
T
L
MRGEAS
P
F
V
M
ELP
L
Y
H
V
P
H
L
K
S
L
L
L
Q
T
W
S
R
L
R
G
F
V
VRA
G
K
V
I
I
L
V
S
L
V
IGGL
N
S
I
TLDGKPVQGDI
G
H
S
A
L
A
S
V
S
Q
R
L
T
P
L
L
APLGVQPDNW
Q
A
T
V
G
L
V
T
G
A
M
A
K
E
V
V
V
G
T
L
N
T
L
Y
T
A
E
Q
IQGEAFDYEGYDL
P
G
Q
L
R
E
A
L
V
E
T
W
D
G
L
V
D
T
F
S
L
S
V
LANP
V
E
ASMADGDMETGS
M
G
T
M
A
S
KFGS
P
I
A
A
Y
S
Y
L
V
F
V
L
L
Y
V
P
C
V
T
A
M
G
A
I
A
RESSKG
W
M
A
F
S
V
L
WG
L
N
V
A
Y
S
L
A
T
L
C
Y
Q
V
A
T
FAAHPER
S
V
L
T
I
A
V
V
L
L
F
N
L
I
L
M
T
C
L
R
L
F
G
R
E
Q
V
L
QLPGRMADAPSGQGGCH
2
PsiBlast_PDB
91.61
59%
-105
- C9 -
3I92
2
FEOB_ECOLI
A:
[1-261]
M
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
----
Q
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
L
A
R
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
82
Fugue
91.08
60%
-108
- C9 -
3I8S
-
FEOB_ECOLI
B:
[1-261]
M
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
I
S
S
Q
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
---
L
A
R
L
R
N
E
MD
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
91.08
59%
-100
- C9 -
3I8S
-
FEOB_ECOLI
A:
[1-264]
M
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
----
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
L
A
R
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
T
L
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
61
HHSearch
90.86
60%
-101
- C9 -
3I8S
-
FEOB_ECOLI
A:
[1-262]
M
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
----
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
L
D
A
A
L
A
R
-------
L
---
R
N
-
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
T
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
90.62
59%
-103
- C9 -
3I8X
1
FEOB_ECOLI
B:
[1-261]
M
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
I
S
S
Q
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
L
A
R
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
90.25
59%
-99
- C9 -
3I92
2
FEOB_ECOLI
B:
[2-261]
-
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
I
S
S
Q
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
L
A
R
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
89.78
58%
-99
- C9 -
4Q5I
-
FEOB_ECOLI
A:
[3-270]
--
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
I
S
S
Q
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
A
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
L
A
R
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
T
L
T
A
E
P
S
R
F
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
89.39
59%
-97
- C9 -
2WIB
2
?
A:
[1-261]
M
Q
K
L
T
V
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
A
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
I
F
A
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
I
S
S
Q
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
M
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
V
V
A
L
N
M
L
D
I
A
E
K
Q
Q
V
R
I
D
I
D
A
L
A
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
I
A
L
D
R
H
Q
A
N
S
D
-
L
-
E
L
---
V
H
-
Y
P
Q
P
L
L
R
E
A
D
L
L
A
Q
Q
M
S
A
Q
I
P
P
R
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
D
A
A
---
D
---
K
----
L
D
I
-------
A
---
L
A
N
L
S
D
---
E
IDD
P
A
L
H
I
A
D
A
R
Y
Q
T
I
A
A
I
C
D
A
V
S
N
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
89.39
59%
-109
- C9 -
2WIA
1
?
A:
[1-260]
M
Q
K
L
T
V
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
A
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
I
F
A
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
----
Q
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
M
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
V
V
A
L
N
M
L
D
I
A
E
K
Q
Q
V
R
I
D
I
D
A
L
A
A
R
L
G
C
P
V
I
P
L
---
R
G
R
G
I
E
-
A
-
L
K
I
A
L
D
R
H
Q
A
N
S
D
-
L
-
E
L
---
V
H
-
Y
P
Q
P
L
L
R
E
A
D
L
L
A
Q
Q
M
S
A
Q
I
P
P
R
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
D
A
A
---
D
---
K
----
L
D
I
-------
A
---
L
A
N
L
S
D
---
E
IDD
P
A
L
H
I
A
D
A
R
Y
Q
T
I
A
A
I
C
D
A
V
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
89.27
59%
-104
- C9 -
3I92
2
FEOB_ECOLI
C:
[2-262]
-
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
I
S
S
Q
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
LAR
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
T
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
89.22
59%
-110
- C9 -
2WIA
1
?
B:
[1-260]
M
Q
K
L
T
V
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
A
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
I
F
A
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
-----
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
M
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
V
V
A
L
N
M
L
D
I
A
E
K
Q
Q
V
R
I
D
I
D
A
L
A
A
R
L
G
C
P
V
I
P
L
---
R
G
R
G
I
E
-
A
-
L
K
I
A
L
D
R
H
Q
A
N
S
D
-
L
-
E
L
---
V
H
-
Y
P
Q
P
L
L
R
E
A
D
L
L
A
Q
Q
M
S
A
Q
I
P
P
R
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
D
A
A
---
D
---
K
----
L
D
I
-------
A
---
L
A
N
L
S
D
---
E
IDD
P
A
L
H
I
A
D
A
R
Y
Q
T
I
A
A
I
C
D
A
V
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
29
PsiBlast_CBE
88.63
58%
-99
- C9 -
4Q5I
1
FEOB_ECOLI
D:
[2-264]
-
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
I
S
S
Q
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
A
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
L
A
R
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
T
L
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
88.59
59%
-102
- C9 -
3I8X
1
FEOB_ECOLI
C:
[1-261]
M
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
I
S
S
Q
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
LAR
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
PsiBlast_CBE
88.42
59%
-97
- C9 -
2WIB
2
?
B:
[1-262]
M
Q
K
L
T
V
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
A
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
I
F
A
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
I
-----
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
M
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
V
V
A
L
N
M
L
D
I
A
E
K
Q
Q
V
R
I
D
I
D
A
L
A
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
I
A
L
D
R
H
Q
A
N
S
D
-
L
-
E
L
---
V
H
-
Y
P
Q
P
L
L
R
E
A
D
L
L
A
Q
Q
M
S
A
Q
I
P
P
R
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
D
A
A
---
D
---
K
----
L
D
I
-------
A
---
L
A
N
L
S
D
---
E
IDD
P
A
L
H
I
A
D
A
R
Y
Q
T
I
A
A
I
C
D
A
V
S
N
T
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
PsiBlast_CBE
88.24
57%
-103
- C9 -
4R98
1
FEOB_ECOLI
B:
[2-264]
-
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
G
N
W
A
G
V
T
V
E
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
I
S
--
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
A
T
D
T
K
N
V
Q
F
V
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
L
A
R
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
T
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
88.07
59%
-108
- C9 -
2WIC
3
?
A:
[1-264]
M
Q
K
L
T
V
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
A
R
Q
------------
K
E
G
I
F
A
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
I
S
S
----
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
M
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
V
V
A
L
N
M
L
D
I
A
E
K
Q
Q
V
R
I
D
I
D
A
L
A
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
I
A
L
D
R
H
Q
A
N
S
D
-
L
-
E
L
---
V
H
-
Y
P
Q
P
L
L
R
E
A
D
L
L
A
Q
Q
M
S
A
Q
I
P
P
R
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
D
A
A
---
D
---
K
----
L
D
I
-------
A
---
L
A
N
L
S
D
---
E
IDD
P
A
L
H
I
A
D
A
R
Y
Q
T
I
A
A
I
C
D
A
V
S
N
T
L
T
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
86.84
59%
-101
- C9 -
4Q00
2
FEOB_ECOLI
A:
[2-260]
-
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
G
N
W
A
----
E
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
T
I
S
S
Q
T
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
A
T
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
L
A
R
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
85.98
58%
-106
- C9 -
3HYT
2
FEOB_ECOLI
A:
[2-261]
-
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
---------
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
------
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
L
A
R
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
28
PsiBlast_CBE
85.92
58%
-103
- C9 -
3HYT
2
FEOB_ECOLI
B:
[2-260]
-
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
---------
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
T
------
S
L
D
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
L
A
R
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
27
PsiBlast_CBE
85.60
58%
-102
- C9 -
3HYT
2
FEOB_ECOLI
C:
[2-261]
-
K
K
L
T
I
G
L
I
G
N
P
N
S
G
K
T
T
L
F
N
Q
L
T
G
S
R
Q
R
V
---------
R
K
E
G
Q
F
S
T
T
D
H
Q
V
T
L
V
D
L
P
G
T
Y
S
L
----------
E
Q
I
A
C
H
Y
I
L
S
G
D
A
D
L
L
I
N
V
V
D
A
S
N
L
E
R
N
L
Y
L
T
L
Q
L
L
E
L
G
I
P
C
I
V
A
L
N
M
L
D
I
A
E
K
Q
N
I
R
I
E
I
D
A
L
S
A
R
L
G
C
P
V
I
P
L
V
S
T
R
G
R
G
I
E
-
A
-
L
K
L
A
I
D
R
Y
K
A
N
E
N
-
V
-
E
L
---
V
H
-
Y
A
Q
P
L
L
N
E
A
D
S
L
A
K
V
M
P
S
D
I
P
L
K
Q
R
R
W
L
G
L
Q
M
L
E
G
D
---
I
Y
S
R
A
Y
A
G
E
A
S
---
Q
---
H
----
L
D
A
-------
A
LAR
L
R
N
E
M
D
---
D
---
P
A
L
H
I
A
D
A
R
Y
Q
C
I
A
A
I
C
D
V
V
S
N
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
77.99
36%
-98
- C9 -
3B1W
1
?
A:
[6-263]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
A
----
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
A
E
S
H
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
42
PsiBlast_CBE
76.02
36%
-91
- C9 -
3TAH
3
?
B:
[6-264]
-----
I
A
L
I
G
N
P
A
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
----
E
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
A
E
S
H
T
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
36
PsiBlast_CBE
75.75
36%
-100
- C9 -
3B1W
1
?
C:
[6-262]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
A
----
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
----
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
A
E
S
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
74.97
36%
-92
- C9 -
3B1V
3
?
A:
[6-265]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
A
----
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
A
E
S
H
T
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
74.35
36%
-92
- C9 -
3LX5
3
?
A:
[6-265]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
----
E
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
-------
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
A
E
S
H
T
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
35
PsiBlast_CBE
74.02
36%
-95
- C9 -
3B1W
1
?
D:
[6-259]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
A
----
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
-----
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
IEDIIRI
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
48
PsiBlast_CBE
73.95
37%
-95
- C9 -
3A1T
1
?
A:
[6-232]
---
V
K
V
A
L
A
G
C
P
N
V
G
K
T
S
L
F
N
A
L
T
G
T
K
Q
Y
V
A
N
W
P
G
V
T
V
E
K
K
E
G
V
F
T
Y
K
G
Y
T
I
N
L
I
D
L
P
G
T
Y
S
L
----
G
Y
S
S
I
D
E
K
I
A
R
D
Y
L
L
K
G
D
A
D
L
V
I
L
V
A
D
S
V
N
P
E
Q
S
L
Y
L
L
L
E
I
L
E
M
E
K
K
V
I
L
A
M
T
A
I
D
E
A
K
K
T
G
M
K
I
D
R
Y
E
L
Q
K
H
L
G
I
P
V
V
F
T
S
S
V
T
G
E
G
L
E
-
E
-
L
K
E
K
I
V
E
Y
A
Q
K
N
T
-
I
-
L
H
R
M
I
L
D
-
Y
G
E
K
V
E
S
E
I
K
K
V
E
N
F
L
R
D
K
K
L
R
I
N
P
R
Y
F
A
L
K
Y
L
S
G
D
PE
F
Y
S
E
G
V
K
L
G
L
P
E
---
L
---
S
----
E
E
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
73.79
38%
-91
- C9 -
4NON
1
?
A:
[4-255]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
----
E
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
S
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
37
PsiBlast_CBE
73.64
36%
-100
- C9 -
3B1W
1
?
B:
[6-261]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
A
----
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
A
E
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
62
HHSearch
73.28
36%
-89
- C9 -
3B1V
3
?
A:
[3-262]
--
M
T
E
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
-
K
N
K
D
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
----
Y
S
P
E
A
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
-
V
V
K
K
A
A
H
T
T
T
S
T
V
G
D
L
A
F
---
P
I
-
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
F
Q
R
K
E
I
E
D
I
---
I
R
I
-------
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
A
E
S
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
38
PsiBlast_CBE
73.28
38%
-94
- C9 -
4NON
1
?
B:
[4-255]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
----
E
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
--
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
S
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
47
PsiBlast_CBE
72.95
37%
-90
- C9 -
3A1U
5
?
A:
[6-232]
---
V
K
V
A
L
A
G
C
P
N
V
G
K
T
S
L
F
N
A
L
T
G
T
K
Q
Y
V
A
N
W
P
G
V
T
V
E
K
K
E
G
V
F
T
Y
K
G
Y
T
I
N
L
I
D
L
P
G
T
Y
S
L
----
G
Y
S
S
I
D
E
K
I
A
R
D
Y
L
L
K
G
D
A
D
L
V
I
L
V
A
D
S
V
N
P
E
Q
S
L
Y
L
L
L
E
I
L
E
M
E
K
K
V
I
L
A
M
T
A
I
D
E
A
K
K
T
G
M
K
I
D
R
Y
E
L
Q
K
H
L
G
I
P
V
V
F
T
S
S
V
T
G
E
G
L
E
-
E
-
L
K
E
K
I
V
E
Y
A
Q
K
N
T
-
I
---RMI
L
D
-
Y
G
E
K
V
E
S
E
I
K
K
V
E
N
F
L
R
D
K
K
L
R
I
N
P
R
Y
F
A
L
K
Y
L
S
G
D
PE
F
Y
S
E
G
V
K
L
G
L
P
E
---
L
---
S
----
E
E
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
41
PsiBlast_CBE
72.82
36%
-93
- C9 -
3B1Y
1
?
A:
[6-261]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
A
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
----
E
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
----
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
A
E
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
PsiBlast_CBE
72.80
36%
-89
- C9 -
3TAH
3
?
A:
[6-261]
-----
I
A
L
I
G
N
P
A
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
----
E
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
A
E
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
72.39
36%
-90
- C9 -
3SS8
4
?
A:
[6-259]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
----
E
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
46
PsiBlast_CBE
71.99
37%
-92
- C9 -
3A1U
5
?
B:
[6-232]
---
V
K
V
A
L
A
G
C
P
N
V
G
K
T
S
L
F
N
A
L
T
G
T
K
Q
Y
V
A
N
----
T
V
E
K
K
E
G
V
F
T
Y
K
G
Y
T
I
N
L
I
D
L
P
G
T
Y
S
L
----
G
Y
S
S
I
D
E
K
I
A
R
D
Y
L
L
K
G
D
A
D
L
V
I
L
V
A
D
S
V
N
P
E
Q
S
L
Y
L
L
L
E
I
L
E
M
E
K
K
V
I
L
A
M
T
A
I
D
E
A
K
K
T
G
M
K
I
D
R
Y
E
L
Q
K
H
L
G
I
P
V
V
F
T
S
S
V
T
G
E
G
L
E
-
E
-
L
K
E
K
I
V
E
Y
A
Q
K
N
------RMI
L
D
-
Y
G
E
K
V
E
S
E
I
K
K
V
E
N
F
L
R
D
K
K
L
R
I
N
P
R
Y
F
A
L
K
Y
L
S
G
D
P
E
F
Y
S
E
G
V
K
L
G
L
P
E
---
L
---
S
----
E
E
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
71.90
36%
-93
- C9 -
3LX8
1
?
A:
[6-260]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
----
E
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
A
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
39
PsiBlast_CBE
71.39
36%
-88
- C9 -
3B1X
2
?
B:
[6-259]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
A
----
E
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
IEDIIRI
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
40
PsiBlast_CBE
71.37
36%
-88
- C9 -
3B1X
2
?
A:
[6-261]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
A
----
E
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
I
E
D
I
I
R
I
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
A
E
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
PsiBlast_CBE
70.99
36%
-88
- C9 -
3SS8
4
?
B:
[6-259]
-----
I
A
L
I
G
N
P
N
S
G
K
T
S
L
F
N
L
I
T
G
H
N
Q
R
V
G
N
W
P
G
V
T
V
E
R
K
S
G
L
V
K
K
N
K
D
-
L
E
I
Q
D
L
P
G
I
Y
S
M
S
P
Y
S
P
E
----
E
K
V
A
R
D
Y
L
L
S
Q
R
A
D
S
I
L
N
V
V
D
A
T
N
L
E
R
N
L
Y
L
T
T
Q
L
I
E
T
G
I
P
V
T
I
A
L
N
M
I
D
V
L
D
G
Q
G
K
K
I
N
V
D
K
L
S
Y
H
L
G
V
P
V
V
A
T
S
A
L
K
Q
T
G
V
D
-
Q
V
V
K
K
A
A
H
T
T
T
S
T
V
G
-
D
-
L
A
---
F
P
I
Y
D
D
R
L
E
A
A
I
S
Q
I
L
E
V
L
G
N
S
V
P
Q
R
S
A
R
F
Y
A
I
K
L
F
E
Q
D
---
S
L
V
E
A
E
L
D
L
S
Q
---
F
---
Q
----
R
K
E
IEDIIRI
T
---
E
E
I
F
T
E
---
D
---
A
E
S
I
V
I
N
E
R
Y
A
F
I
E
R
V
C
Q
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
31
PsiBlast_CBE
69.81
49%
-102
- C9 -
2WJG
1
FEOB_METJA
B:
[5-169]
M
K
S
Y
E
I
A
L
I
G
N
P
N
V
G
K
S
T
I
F
N
A
L
T
G
E
N
V
Y
I
G
N
W
P
G
V
T
V
E
K
K
E
G
E
F
E
Y
N
G
E
K
F
K
V
V
D
L
P
G
V
Y
S
L
T
A
----
N
S
I
D
E
I
I
A
R
D
Y
I
I
N
E
K
P
D
L
V
V
N
I
V
D
A
T
A
L
E
R
N
L
Y
L
T
L
Q
L
M
E
M
G
A
N
L
L
L
A
L
N
K
M
D
L
A
K
S
L
G
I
E
I
D
V
D
K
L
E
K
I
L
G
V
K
V
V
P
L
S
A
A
K
K
M
G
I
E
-
E
-
L
K
K
A
I
S
I
A
V
K
D
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
68.94
53%
-104
- C9 -
2WJJ
1
FEOB_METJA
A:
[7-160]
-----
I
A
L
I
G
N
P
N
V
G
K
S
T
I
F
N
A
L
T
G
E
N
V
Y
I
G
N
W
P
G
V
T
V
E
K
K
E
G
E
F
E
Y
N
G
E
K
F
K
V
V
D
L
P
G
V
Y
S
L
T
A
----
N
S
I
D
E
I
I
A
R
D
Y
I
I
N
E
K
P
D
L
V
V
N
I
V
D
A
T
A
L
E
R
N
L
Y
L
T
L
Q
L
M
E
M
G
A
N
L
L
L
A
L
N
K
M
D
L
A
K
S
L
G
I
E
I
D
V
D
K
L
E
K
I
L
G
V
K
V
V
P
L
S
A
A
K
K
M
G
I
E
-
E
-
L
K
K
A
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
64
HHSearch
68.84
51%
-103
- C9 -
2WJG
1
FEOB_METJA
A:
[6-170]
-
K
S
Y
E
I
A
L
I
G
N
P
N
V
G
K
S
T
I
F
N
A
L
T
G
E
N
V
Y
I
G
N
W
P
G
V
T
V
E
K
K
E
G
E
F
E
Y
N
G
E
K
F
K
V
V
D
L
P
G
V
Y
S
L
T
A
----
N
S
I
D
E
I
I
A
R
D
Y
I
I
N
E
K
P
D
L
V
V
N
I
V
D
A
T
A
L
E
R
N
L
Y
L
T
L
Q
L
M
E
M
G
A
N
L
L
L
A
L
N
K
M
D
L
A
K
S
L
G
I
E
I
D
V
D
K
L
E
K
I
L
G
V
K
V
V
P
L
S
A
A
K
K
M
G
I
E
-
E
-
L
K
K
A
I
S
I
A
V
K
D
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
68.72
49%
-103
- C9 -
2WJG
1
FEOB_METJA
A:
[5-170]
M
K
S
Y
E
I
A
L
I
G
N
P
N
V
G
K
S
T
I
F
N
A
L
T
G
E
N
V
Y
I
G
N
W
P
G
V
T
V
E
K
K
E
G
E
F
E
Y
N
G
E
K
F
K
V
V
D
L
P
G
V
Y
S
L
T
A
----
N
S
I
D
E
I
I
A
R
D
Y
I
I
N
E
K
P
D
L
V
V
N
I
V
D
A
T
A
L
E
R
N
L
Y
L
T
L
Q
L
M
E
M
G
A
N
L
L
L
A
L
N
K
M
D
L
A
K
S
L
G
I
E
I
D
V
D
K
L
E
K
I
L
G
V
K
V
V
P
L
S
A
A
K
K
M
G
I
E
-
E
-
L
K
K
A
I
S
I
A
V
K
D
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
PsiBlast_CBE
67.13
52%
-104
- C9 -
2WJH
2
FEOB_METJA
B:
[1-159]
M
K
S
Y
E
I
A
L
I
G
N
P
N
V
G
K
S
T
I
F
N
A
L
T
G
E
N
V
Y
I
G
N
W
P
G
V
T
V
E
K
K
E
G
E
F
E
Y
N
G
E
K
F
K
V
V
D
L
P
G
V
Y
S
L
T
A
----
N
S
I
D
E
I
I
A
R
D
Y
I
I
N
E
K
P
D
L
V
V
N
I
V
D
A
T
A
L
E
R
N
L
Y
L
T
L
Q
L
M
E
M
G
A
N
L
L
L
A
L
N
K
M
D
L
A
K
S
L
G
I
E
I
D
V
D
K
L
E
K
I
L
G
V
K
V
V
P
L
S
A
A
K
K
M
G
I
E
-
E
-
L
K
K
A
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
67.02
52%
-104
- C9 -
2WJH
3
FEOB_METJA
A:
[1-159]
M
K
S
Y
E
I
A
L
I
G
N
P
N
V
G
K
S
T
I
F
N
A
L
T
G
E
N
V
Y
I
G
N
W
P
G
V
T
V
E
K
K
E
G
E
F
E
Y
N
G
E
K
F
K
V
V
D
L
P
G
V
Y
S
L
T
A
----
N
S
I
D
E
I
I
A
R
D
Y
I
I
N
E
K
P
D
L
V
V
N
I
V
D
A
T
A
L
E
R
N
L
Y
L
T
L
Q
L
M
E
M
G
A
N
L
L
L
A
L
N
K
M
D
L
A
K
S
L
G
I
E
I
D
V
D
K
L
E
K
I
L
G
V
K
V
V
P
L
S
A
A
K
K
M
G
I
E
-
E
-
L
K
K
A
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
65
HHSearch
66.85
52%
-99
* C9 *
2WJI
3
FEOB_METJA
A:
[2-163]
-
K
S
Y
E
I
A
L
I
G
N
P
N
V
G
K
S
T
I
F
N
A
L
T
G
E
N
V
Y
I
G
-----
T
V
E
K
K
E
G
E
F
E
Y
N
G
E
K
F
K
V
V
D
L
P
G
V
Y
S
L
T
A
----
N
S
I
D
E
I
I
A
R
D
Y
I
I
N
E
K
P
D
L
V
V
N
I
V
D
A
T
A
L
E
R
N
L
Y
L
T
L
Q
L
M
E
M
G
A
N
L
L
L
A
L
N
K
M
D
L
A
K
S
L
G
I
E
I
D
V
D
K
L
E
K
I
L
G
V
K
V
V
P
L
S
A
A
K
K
M
G
I
E
-
E
-
L
K
K
A
I
S
I
A
V
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
32
PsiBlast_CBE
66.61
52%
-105
- C9 -
2WJI
3
FEOB_METJA
B:
[1-159]
M
K
S
Y
E
I
A
L
I
G
N
P
N
V
G
K
S
T
I
F
N
A
L
T
G
E
N
V
---------
V
E
K
K
E
G
E
F
E
Y
N
G
E
K
F
K
V
V
D
L
P
G
V
Y
S
L
T
A
----
N
S
I
D
E
I
I
A
R
D
Y
I
I
N
E
K
P
D
L
V
V
N
I
V
D
A
T
A
L
E
R
N
L
Y
L
T
L
Q
L
M
E
M
G
A
N
L
L
L
A
L
N
K
M
D
L
A
K
S
L
G
I
E
I
D
V
D
K
L
E
K
I
L
G
V
K
V
V
P
L
S
A
A
K
K
M
G
I
E
-
E
-
L
K
K
A
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
65.90
52%
-101
- C9 -
2WJI
3
FEOB_METJA
A:
[1-159]
M
K
S
Y
E
I
A
L
I
G
N
P
N
V
G
K
S
T
I
F
N
A
L
T
G
E
N
V
Y
I
G
-----
T
V
E
K
K
E
G
E
F
E
Y
N
G
E
K
F
K
V
V
D
L
P
G
V
Y
S
L
T
A
----
N
S
I
D
E
I
I
A
R
D
Y
I
I
N
E
K
P
D
L
V
V
N
I
V
D
A
T
A
L
E
R
N
L
Y
L
T
L
Q
L
M
E
M
G
A
N
L
L
L
A
L
N
K
M
D
L
A
K
S
L
G
I
E
I
D
V
D
K
L
E
K
I
L
G
V
K
V
V
P
L
S
A
A
K
K
M
G
I
E
-
E
-
L
K
K
A
I
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
66
HHSearch
59.48
34%
-97
- C9 -
3W5J
2
?
A:
[2-165]
-
Q
F
K
R
I
A
L
L
G
M
P
N
T
G
K
S
T
L
F
N
R
M
T
G
G
A
A
R
V
G
N
W
P
G
I
T
V
E
L
L
S
G
K
I
L
L
G
A
D
M
V
E
I
I
D
L
P
G
I
Y
D
L
H
G
----
F
S
D
D
E
Q
V
V
R
H
F
L
H
D
N
V
P
D
L
A
L
V
I
L
N
A
T
Q
I
E
R
Q
M
S
L
L
L
Q
L
K
Q
L
N
M
N
I
V
V
L
L
N
M
S
D
E
A
K
Q
Y
G
I
T
I
D
S
R
K
M
S
E
L
L
Q
I
P
V
F
Q
L
S
----
T
G
Y
Q
-
E
-
A
L
Q
A
V
T
R
A
L
R
Y
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
51
PsiBlast_CBE
58.50
35%
-94
- C9 -
3W5J
2
?
A:
[6-171]
-----
I
A
L
L
G
M
P
N
T
G
K
S
T
L
F
N
R
M
T
G
G
A
A
R
V
G
N
W
P
G
I
T
V
E
L
L
S
G
K
I
L
L
G
A
D
M
V
E
I
I
D
L
P
G
I
Y
D
L
H
G
F
S
D
----
D
E
Q
V
V
R
H
F
L
H
D
N
V
P
D
L
A
L
V
I
L
N
A
T
Q
I
E
R
Q
M
S
L
L
L
Q
L
K
Q
L
N
M
N
I
V
V
L
L
N
M
S
D
E
A
K
Q
Y
G
I
T
I
D
S
R
K
M
S
E
L
L
Q
I
P
V
F
Q
L
S
----
T
G
Y
Q
-
E
A
L
Q
A
V
T
R
A
L
R
Y
P
T
P
-
G
-
M
A
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------