@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 : PF07952_BXA1_CLOBO: (2014-10-14 )
MPFVNKQFNYKDPVNGVDIAYIKIPNVGQMQPVKAFKIHNKIWVIPERDTFTNPEEGDLNPPPEAKQVPVSYYDSTYLSTDNEKDNYLKGVTKLFERIYSTDLGRMLLTSIVRGIPFWGGSTIDTELKVIDTNCINVIQPDGSYRSEELNLVIIGPSADIIQFECKSFGHEVLNLTRNGYGSTQYIRFSPDFTFGFEESLEVDTNPLLGAGKFATDPAVTLAHELIHAGHRLYGIAINPNRVFKVNTNAYYEMSGLEVSFEELRTFGGHDAKFIDSLQENEFRLYYYNKFKDIASTLNKAKSIVGTTASLQYMKNVFKEKYLLSEDTSGKFSVDKLKFDKLYKMLTEIYTEDNFVKFFKVLNRKTYLNFDKAVFKINIVPKVNYTIYDGFNLRNTNLAANFNGQNTEINNMNFTKLKNFTGLFEFYKLLCVRGIITSKTKSLDKGYNKALNDLCIKVNNWDLFFSPSEDNFTNDLNKGEEITSDTNIEAAEENISLDLIQQYYLTFNFDNEPENISIENLSSDIIGQLELMPNIERFPNGKKYELDKYTMFHYLRAQEFEHGKSRIALTNSVNEALLNPSRVYTFFSSDYVKKVNKATEAAMFLGWVEQLVYDFTDETSEVSTTDKIADITIIIPYIGPALNIGNMLYKDDFVGALIFSGAVILLEFIPEIAIPVLGTFALVSYIANKVLTVQTIDNALSKRNEKWDEVYKYIVTNWLAKVNTQIDLIRKKMKEALENQAEATKAIINYQYNQYTEEEKNNINFNIDDLSSKLNESINKAMININKFLNQCSVSYLMNSMIPYGVKRLEDFDASLKDALLKYIYDNRGTLIGQVDRLKDKVNNTLSTDIPFQLSKYVDNQRLLSTFTEYIKNIINTSILNLRYESNHLIDLSRYASKINIGSKVNFDPIDKNQIQLFNLESSKIEVILKNAIVYNSMYENFSTSFWIRIPKYFNSISLNNEYTIINCMENNSGWKVSLNYGEIIWTLQDTQEIKQRVVFKYSQMINISDYINRWIFVTITNNRLNNSKIYINGRLIDQKPISNLGNIHASNNIMFKLDGCRDTHRYIWIKYFNLFDKELNEKEIKDLYDNQSNSGILKDFWGDYLQYDKPYYMLNLYDPNKYVDVNNVGIRGYMYLKGPRGSVMTTNIYLNSSLYRGTKFIIKKYASGNKDNIVRNNDRVYINVVVKNKEYRLATNASQAGVEKILSALEIPDVGNLSQVVVMKSKNDQGITNKCKMNLQDNNGNDIGFIGFHQFNNIAKLVASNWYNRQIERSSRTLGCSWEFIPVDDGWGERPL
Atome Classification :
(21 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.......770.......780.......790.......800.......810.......820.......830.......840.......850.......860.......870.......880.......890.......900.......910.......920.......930.......940.......950.......960.......970.......980.......990.......1000......1010......1020......1030......1040......1050......1060......1070......1080......1090......1100......1110......1120......1130......1140......1150......1160......1170......1180......1190......1200......1210......1220......1230......1240......1250......1260......1270......1280......1290...
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MPFVNKQFNYKDPVNG
V
D
I
A
Y
I
KIPNVGQMQP
V
K
A
F
K
IH
N
K
I
W
V
I
PERDTFTNPEEGDLNPPPEAKQV
P
V
S
YYD
S
T
Y
LSTDNEK
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
ST
D
L
G
R
M
L
L
T
S
I
VRGIPFWGGSTI
D
T
E
L
K
V
I
DTN
C
I
N
V
IQPDGSYRS
E
E
L
N
L
V
I
IGPSA
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
TRNGYGST
Q
Y
I
R
FSPDFTFGFEESLEVDTNPLLGAGKFATD
P
A
V
T
L
A
H
E
L
I
HAG
H
R
L
Y
G
I
A
INP
N
R
V
F
K
VNT
N
A
Y
Y
E
MSG
L
E
V
S
F
E
E
L
R
T
FGGH
D
A
K
F
I
D
S
LQEN
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
VG
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
YLLSEDTSGKF
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
YTED
N
F
V
K
F
F
K
V
LNRKTYLNFD
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
YD
G
F
N
L
RN
T
N
L
A
A
NFNGQNTEINNM
N
F
T
K
L
K
N
F
T
G
L
F
E
F
Y
K
L
L
C
V
R
G
IITSK
T
K
S
L
D
K
G
Y
N
K
A
L
N
D
L
C
I
K
VNN
W
D
L
F
F
SPSEDNFTNDLNKGEEITSDTNI
E
A
A
E
ENI
S
L
D
L
I
Q
Q
Y
Y
L
T
F
NFDNEPE
N
I
S
I
E
NL
S
S
D
I
I
G
Q
L
E
LMP
N
I
E
RFPNGKKYEL
D
K
Y
T
M
F
H
Y
L
R
A
Q
E
F
EHGK
S
R
I
A
L
TNS
V
N
E
ALL
N
P
S
R
V
Y
T
FF
S
S
D
Y
V
K
K
V
N
K
A
T
E
A
A
M
F
L
G
W
V
E
Q
L
V
Y
DFTDETSEVSTTDKI
A
D
I
T
I
I
I
PYIGP
A
L
N
I
G
N
M
L
Y
K
D
D
F
V
G
A
L
I
F
S
G
A
V
I
L
L
E
F
I
P
E
I
A
I
P
V
L
G
T
F
A
L
V
S
Y
I
ANK
V
L
T
V
Q
T
I
D
N
A
L
S
KRN
E
K
W
D
E
V
Y
K
Y
I
V
T
N
W
L
A
K
V
N
T
Q
I
D
L
I
R
K
K
M
K
E
A
L
E
N
Q
A
E
A
T
K
A
I
I
N
YQYNQYTEEEKNN
I
N
F
N
I
D
D
L
S
S
K
L
N
E
S
I
N
K
A
M
I
N
I
N
K
F
L
N
Q
C
S
V
S
Y
L
M
N
S
M
I
P
Y
G
V
K
R
L
E
D
F
D
A
S
L
K
D
A
L
L
K
Y
I
YDNRG
T
L
I
G
Q
V
D
R
L
K
D
K
VNNTLSTDI
P
F
Q
L
S
K
Y
VD
N
Q
R
L
L
S
T
F
T
E
Y
I
K
N
I
I
N
T
S
I
L
N
L
R
YESN
H
L
I
D
L
S
R
Y
A
S
KINIGSKVNFDPIDKN
Q
I
Q
L
F
NLES
S
K
I
E
V
I
L
KN
A
I
V
Y
N
S
M
Y
E
NFS
T
S
F
W
I
RI
P
K
Y
F
N
SISLNN
E
Y
T
I
I
N
C
M
ENNS
G
W
K
V
S
LNY
G
E
I
I
W
T
LQ
D
T
Q
E
I
K
Q
R
V
V
F
K
Y
S
Q
MI
N
I
S
D
Y
IN
R
W
I
F
V
T
I
TNNRLNN
S
K
I
Y
I
N
G
R
L
IDQKP
I
S
N
LGNIHASN
N
I
M
F
K
LDGCRDT
H
R
Y
I
W
I
K
Y
F
N
L
F
D
KEL
N
E
K
E
I
K
D
L
YDNQSNSG
I
L
K
D
F
W
G
D
Y
L
QYDK
P
Y
Y
M
L
N
LYDPN
K
Y
V
D
VNNV
G
I
R
G
Y
M
Y
L
KGPRG
S
V
M
T
T
N
I
Y
LNSSLYR
G
T
K
F
I
I
K
K
YASGNKD
N
I
VRNN
D
R
V
Y
I
N
V
V
V
KNK
E
Y
R
L
ATN
A
S
Q
A
G
V
E
K
I
L
S
A
LEIPDVGNL
S
Q
V
V
V
M
KSKNDQGITNK
C
K
M
N
L
QDNNGN
D
I
G
F
I
G
F
H
Q
F
N
N
I
A
K
L
V
A
S
NWY
N
R
Q
I
ERSSRTLGC
S
W
E
F
I
PVDDGWGERPL
26
PsiBlast_CBE
30.07
99%
-72
- C1 -
3BOO
1
BXA1_CLOBO
A:
[1-425]
M
Q
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
V
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
------
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
Y
Y
E
M
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
L
F
E
F
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
PsiBlast_CBE
29.21
99%
-67
- C1 -
4EL4
5
BXA1_CLOBO
A:
[21-445]
M
P
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
S
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
S
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
Y
Y
E
M
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
L
F
E
F
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
28.91
99%
-69
- C1 -
3QW7
1
BXA1_CLOBH
A:
[2-423]
-
P
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
Y
Y
E
M
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
L
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
28.71
99%
-68
- C1 -
3DDA
1
BXA1_CLOBO
A:
[1-423]
M
P
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
Y
Y
E
M
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
L
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
28.58
99%
-67
- C1 -
3DDB
1
BXA1_CLOBO
A:
[1-423]
M
P
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
Y
Y
E
M
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
L
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
28.39
99%
-68
- C1 -
3QW5
1
BXA1_CLOBH
A:
[1-423]
M
P
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
Y
Y
E
M
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
L
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
38
PsiBlast_CBE
28.37
99%
-72
- C1 -
3NF3
1
?
A:
[1-417]
M
P
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
--
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
-
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
------------
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
---------
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
-
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
53
PsiBlast_CBE
28.35
99%
-70
* C1 *
3DS9
1
BXA1_CLOBO
A:
[3-417]
--
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
--
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
-----------
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
----
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
28.33
99%
-67
- C1 -
3C88
1
BXA1_CLOBO
A:
[2-423]
-
P
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
Y
Y
E
M
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
L
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
28.21
99%
-67
- C1 -
3QW6
1
BXA1_CLOBH
A:
[2-423]
-
P
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
Y
Y
E
M
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
L
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
27.73
99%
-66
- C1 -
3C89
1
BXA1_CLOBO
A:
[2-423]
-
P
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
Y
Y
E
M
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
L
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
36
PsiBlast_CBE
27.71
99%
-70
- C1 -
3QIY
3
?
A:
[2-421]
-
G
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
--
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
------------
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
-------------
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
--
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
27.71
99%
-66
- C1 -
3QW8
2
BXA1_CLOBH
A:
[2-423]
-
P
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
Y
Y
E
M
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
L
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
27.62
99%
-66
- C1 -
3C8A
1
BXA1_CLOBO
A:
[2-423]
-
P
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
Y
Y
E
M
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
L
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
27.38
99%
-65
- C1 -
3C8B
1
BXA1_CLOBO
A:
[1-423]
M
P
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
V
N
T
N
A
Y
Y
E
M
S
G
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
L
F
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
31
PsiBlast_CBE
27.21
99%
-68
- C1 -
2IMA
1
BXA1_CLOBO
A:
[21-438]
M
Q
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
----
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
-----
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
---
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
------------
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
--
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
32
PsiBlast_CBE
27.01
99%
-68
- C1 -
2ILP
1
BXA1_CLOBO
B:
[21-437]
M
Q
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
--
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
------
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
------------
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
35
PsiBlast_CBE
26.87
99%
-67
- C1 -
3QIZ
2
BXA1_CLOBH
A:
[2-421]
-
G
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
----------
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
-----------
L
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
G
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
PsiBlast_CBE
26.87
99%
-67
- C1 -
3QJ0
4
BXA1_CLOBH
A:
[2-420]
-
G
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
A
G
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
P
E
A
K
Q
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
-----------
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
-------------
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
T
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
F
T
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
29
PsiBlast_CBE
26.41
99%
-71
- C1 -
2IMB
1
BXA1_CLOBO
A:
[21-438]
M
Q
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
-------
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
-----
V
P
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
---------
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
K
------------
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
--
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
K
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
PsiBlast_CBE
26.31
99%
-68
- C1 -
2IMA
1
BXA1_CLOBO
B:
[21-436]
M
Q
F
V
N
K
Q
F
N
Y
K
D
P
V
N
G
V
D
I
A
Y
I
K
I
P
N
--
Q
M
Q
P
V
K
A
F
K
I
H
N
K
I
W
V
I
P
E
R
D
T
F
T
N
P
E
E
G
D
L
N
P
P
-------
V
S
Y
Y
D
S
T
Y
L
S
T
D
N
E
K
D
N
Y
L
K
G
V
T
K
L
F
E
R
I
Y
S
T
D
L
G
R
M
L
L
T
S
I
V
R
G
I
P
F
W
G
G
S
T
I
D
T
E
L
K
V
I
D
T
N
C
I
N
V
I
Q
P
D
G
S
Y
R
S
E
E
L
N
L
V
I
I
G
P
S
A
D
I
I
Q
F
E
C
K
S
F
G
H
E
V
L
N
L
T
R
N
G
Y
G
S
T
Q
Y
I
R
F
S
P
D
F
T
F
G
F
E
E
S
L
E
V
D
T
N
P
L
L
G
A
G
K
F
A
T
D
P
A
V
T
L
A
H
E
L
I
H
A
G
H
R
L
Y
G
I
A
I
N
P
N
R
V
F
-------------
E
V
S
F
E
E
L
R
T
F
G
G
H
D
A
K
F
I
D
S
L
Q
E
N
E
F
R
L
Y
Y
Y
N
K
F
K
D
I
A
S
T
L
N
K
A
K
S
I
V
G
-
T
A
S
L
Q
Y
M
K
N
V
F
K
E
K
Y
L
L
S
E
D
T
S
G
K
F
S
V
D
K
L
K
F
D
K
L
Y
K
M
L
T
E
I
Y
T
E
D
N
F
V
K
F
F
K
V
L
N
R
K
T
Y
L
N
F
D
K
A
V
F
K
I
N
I
V
P
K
V
N
Y
T
I
Y
D
G
F
N
L
R
N
T
N
L
A
A
N
F
N
G
Q
N
T
E
I
N
N
M
N
F
T
K
L
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------