@TOME V2.3
(Nov 2016)
Ref.
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Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : Rv0101: (2016-04-19 )
MHRVRLSRSQRNLYNGVRQDNNPALYLIGKSYRFRRLELARFLAALHATVLDNPVQLCVLENSGADYPDLVPRLRFGDIVRVGSADEHLQSTWCSGILGKPLVRHTVHTDPNGYVTGLDVHTHHILLDGGATGTIEADLARYLTTDPAGETPSVGAGLAKLREAHRRETAKVEESRGRLSAVVQRELADEAYHGGHGHSVSDAPGTAAKGVLHESATICGNAFDAILTLSEAQRVPLNVLVAAAAVAVDASLRQNTETLLVHTVDNRFGDSDLNVATCLVNSVAQTVRFPPFASVSDVVRTLDRGYVKAVRRRWLREEHYRRMYLAINRTSHVEALTLNFIREPCAPGLRPFLSEVPIATDIGPVEGMTVASVLDEEQRTLNLAIWNRADLPACKTHPKVAERIAAALESMAAMWDRPIAMIVNDWFGIGPDGTRCQGDWPARQPSTPAWFLDSARGVHQFLGRRRFVYPWVAWLVQRGAAPGDVLVFTDDDTDKTIDLLIACHLAGCGYSVCDTADEISVRTNAITEHGDGILVTVVDVAATQLAVVGHDELRKVVDERVTQVTHDALLATKTAYIMPTSGTTGQPKLVRISHGSLAVFCDAISRAYGWGAHDTVLQCAPLTSDISVEEIFGGAACGARLVRSAAMKTGDLAALVDDLVARETTIVDLPTAVWQLLCADGDAIDAIGRSRLRQIVIGGEAIRCSAVDKWLESAASQGISLLSSYGPTEATVVATFLPIVCDQTTMDGALLRLGRPILPNTVFLAFGEVVIVGDLVADGYLGIDGDGFGTVTAADGSRRRAFATGDRVTVDAEGFPVFSGRKDAVVKISGKRVDIAEVTRRIAEDPAVSDVAVELHSGSLGVWFKSQRTREGEQDAAAATRIRLVLVSLGVSSFFVVGVPNIPRKPNGKIDSDNLPRLPQWSAAGLNTAETGQRAAGLSQIWSRQLGRAIGPDSSLLGEGIGSLDLIRILPETRRYLGWRLSLLDLIGADTAANLADYAPTPDAPTGEDRFRPLVAAQRPAAIPLSFAQRRLWFLDQLQRPAPVYNMAVALRLRGYLDTEALGAAVADVVGRHESLRTVFPAVDGVPRQLVIEARRADLGCDIVDATAWPADRLQRAIEEAARHSFDLATEIPLRTWLFRIADDEHVLVAVAHHIAADGWSVAPLTADLSAAYASRCAGRAPDWAPLPVQYVDYTLWQREILGDLDDSDSPIAAQLAYWENALAGMPERLRLPTARPYPPVADQRGASLVVDWPASVQQQVRRIARQHNATSFMVVAAGLAVLLSKLSGSPDVAVGFPIAGRSDPALDNLVGFFVNTLVLRVNLAGDPSFAELLGQVRARSLAAYENQDVPFEVLVDRLKPTRALTHHPLIQVMLAWQDNPVGQLNLGDLQATPMPIDTRTARMDLVFSLAERFSEGSEPAGIGGAVEYRTDVFEAQAIDVLIERLRKVLVAVAAAPERTVSSIDALDGTERARLDEWGNRAVLTAPAPTPVSIPQMLAAQVARIPEAEAVCCGDASMTYRELDEASNRLAHRLAGCGAGPGECVALLFERCAPAVVAMVAVLKTGAAYLPIDPANPPPRVAFMLGDAVPVAAVTTAGLRSRLAGHDLPIIDVVDALAAYPGTPPPMPAAVNLAYILYTSGTTGEPKGVGITHRNVTRLFASLPARLSAAQVWSQCHSYGFDASAWEIWGALLGGGRLVIVPESVAASPNDFHGLLVAEHVSVLTQTPAAVAMLPTQGLESVALVVAGEACPAALVDRWAPGRVMLNAYGPTETTICAAISAPLRPGSGMPPIGVPVSGAALFVLDSWLRPVPAGVAGELYIAGAGVGVGYWRRAGLTASRFVACPFGGSGARMYRTGDLVCWRADGQLEFLGRTDDQVKIRGYRIELGEVATALAELAGVGQAVVIAREDRPGDKRLVGYATEIAPGAVDPAGLRAQLAQRLPGYLVPAAVVVIDALPLTVNGKLDHRALPAPEYGDTNGYRAPAGPVEKTVAGIFARVLGLERVGVDDSFFELGGDSLAAMRVIAAINTTLNADLPVRALLHASSTRGLSQLLGRDARPTSDPRLVSVHGDNPTEVHASDLTLDRFIDADTLATAVNLPGPSPELRTVLLTGATGFLGRYLVLELLRRLDVDGRLICLVRAESDEDARRRLEKTFDSGDPELLRHFKELAADRLEVVAGDKSEPDLGLDQPMWRRLAETVDLIVDSAAMVNAFPYHELFGPNVAGTAELIRIALTTKLKPFTYVSTADVGAAIEPSAFTEDADIRVISPTRTVDGGWAGGYGTSKWAGEVLLREANDLCALPVAVFRCGMILADTSYAGQLNMSDWVTRMVLSLMATGIAPRSFYEPDSEGNRQRAHFDGLPVTFVAEAIAVLGARVAGSSLAGFATYHVMNPHDDGIGLDEYVDWLIEAGYPIRRIDDFAEWLQRFEASLGALPDRQRRHSVLPMLLASNSQRLQPLKPTRGCSAPTDRFRAAVRAAKVGSDKDNPDIPHVSAPTIINYVTNLQLLGLL
Atome Classification :
(20 SA)
.........10........20........30....-....40........50........60........70-....-----....80...----.....90.--.....-..100.......110........120.......130.......140.......150..--.....160.......170.......180.......190.......200....--...210.......220.......230.......240.......250.......260.......270.......280.......290.......300.......310.......320.......330.......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......1300.--..----...1310......1320......1330......1340......1350......1360......1370.....---------------.1380-.....--------------.-----..1390......1400......1410......1420......1430......1440......1450......1460..-....1470......1480......1490..--.-----...1500......1510......1520......1530......1540......1550......1560......1570......1580......1590......1600..---..----..------1610.-----..--...1620---------.......-1630......1640......1650.....--.-------1660..---.-.--..1670....-----..1680......1690......1700......1710......1720......1730----..---...--------.---.--1740----.----.----......1750.....----.1760.---...--.....1770......--1780....-----....1790-------........1800.....-.1810.-.....1820......1830......1840......1850......1860......1870......1880......1890......1900..----....1910---.....--....1920......1930......1940......1950......1960......1970----...--...-.-1980......1990......2000......2010......2020......2030.......2040......2050..--....2060......2070......2080......2090......2100......2110......2120......2130......2140......2150......2160......2170......2180......2190......2200......2210......2220......2230......2240......2250......2260......2270......2280......2290......2300......2310......2320......2330......2340......2350......2360......2370......2380......2390......2400......2410......2420......2430......2440......2450......2460......2470......2480......2490......2500......2510
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MH
R
V
RL
S
R
S
Q
R
N
L
Y
NGVRQDNN
P
A
L
Y
L
IGKS
Y
R
F
R
-
R
L
E
L
A
R
F
L
A
A
L
H
A
T
V
LDNP
V
Q
L
C
V
L
ENSGADY
P
D
L
V
-
P
RLR-----FG
D
I
V
RVGS----
A
D
E
H
L
Q
S
T
--
W
CSGI-LG
K
P
L
V
R
H
TVHTD-PNG
Y
V
T
G
L
D
V
H
T
H
H
I
L
LDGGATG
T
I
E
A
D
L
A
R
Y
LTTDPAGETPS
V
--
G
A
G
L
A
K
L
R
E
A
H
R
R
E
T
A
K
V
E
E
SR
G
R
L
S
A
V
V
Q
R
E
L
A
D
EAYHGGHGHSVSDAPG
T
--
A
A
K
G
V
L
HE
S
A
T
I
C
G
N
A
F
D
A
I
L
T
L
S
E
AQRV
P
L
N
V
L
V
A
A
A
A
V
A
V
D
A
S
LRQNT
E
T
L
L
V
H
T
VDNRFGDSD
L
N
V
A
T
C
L
V
N
S
V
A
Q
T
VRFPPF
A
S
V
S
D
V
V
R
T
L
D
R
G
Y
V
K
A
V
R
R
R
W
L
R
E
E
H
Y
R
R
M
Y
L
A
INRTSH
V
E
A
L
T
L
N
F
I
REPCAP
G
L
R
P
F
L
S
EVPIATDIGPVEG
M
T
V
A
S
V
LDEEQ
R
T
L
N
L
A
I
WNRADLPACKT
H
P
K
V
A
E
R
I
A
A
A
L
E
S
M
A
A
M
W
DR
P
I
A
M
I
V
----------
N
D
WFGIGPD-G----TRCQGDWPARQPSTPA
W
F
LDS
A
R
G
V
H
Q
F
LGRR
R
F
V
Y
P
W
V
A
W
L
V
QRGAAPG
D
V
L
V
F
TDDDTD
K
T
I
D
L
L
I
A
C
H
LAGCGYSVCDTAD
E
I
S
V
R
T
N
A
ITEHGD
G
I
L
V
T
V
VDVA
A
T
Q
L
A
VV
G
H
D
E
L
R
K
-
V
V
D
E
R
V
T
Q
V
T
H
D
A
L
LAT
K
T
A
Y
I
M
PTSGTTGQ
P
K
L
V
R
ISHG
S
L
A
V
F
C
D
A
I
S
R
AYGWGAHD
T
V
L
QCAPLTSDI
S
V
E
E
IFG
G
A
A
C
G
A
R
L
V
R
S
A
AMKT
G
D
L
A
A
L
V
D
D
L
V
ARE
T
T
I
VD
L
P
T
A
V
W
Q
L
L
CADG
D
A
-
I
D
A
I
G
R
S
R
L
R
Q
I
V
IGGE
A
I
R
C
S
A
V
D
K
W
L
E
S
A
A
S
Q
G
I
S
L
L
S
SYGPTE
A
T
V
V
A
T
F
L
P
IVCDQ-TTM
D
G
A
L
L
R
LGRPILP
N
T
V
F
L
-----------AFG
E
V
V
I
V
G
D
L
VAD
G
Y
LGIDGDG
F
G
T
V
TA-ADGSR
R
R
A
F
ATG
D
R
V
T
VDAEGFPVFSGR
K
D
A
V
V
K
ISGKRV
D
I
A
E
V
T
R
R
IAEDPAV
S
D
V
A
V
E
L
H-----------SGS
L
G
V
W
F
KSQRTREGE
Q
D
A
A
A
A
T
R
I
R
L
V
L
V
SLGV
S
S
F
F
V
V
GVPNIPRKPNGKIDSDNLPRLPQWSAAGLN
T
A
E
T
G
Q
R
A
A
G
L
S
Q
I
W
S
R
Q
LGR-AIGP
D
S
S
L
L
G
E
GIG
S
L
D
L
I
R
I
L
P
E
T
R
R
Y
L
G
W
R
L
S
L
L
D
LIGADTAANLADYAPTPDAPTG
E
D
RF
R
P
L
VAAQRPAAI
P
L
S
F
A
Q
R
R
L
W
F
L
D
Q
LQRPA
P
V
Y
N
M
A
V
A
L
R
LR-----GYL
D
T
-
E
A
L
G
A
A
V
A
D
V
VG
R
H
E
S
L
R
T
V
F
P
AVD-GV
P
R
Q
L
V
I
E
A
RRADLGCDIVD--ATAW--
P
----
A
D
R
L
Q
R
A
I
E
E
A
A
R
HS----FDLA-TEI
P
L
-
R
T
W
L
F
RIADD
E
H
V
L
V
A
V
A
H
H
I
AADGWSVAPL
T
A
D
L
S
A
A
Y
A
S
R
CAGRAPDWAPLP---------
V
Q
Y
V
D
Y
T
L
W
Q
R
E
I
LGDLDDSDS
P
I
A
A
Q
L
A
Y
W
E
N
A
L
AG
M
P
E
RLRLPTARP-----YPPVADQRG
A
S
L
V
V
DW
P
A
S
V
Q
Q
Q
V
R
R
I
A
R
QHNA
T
S
F
M
V
V
A
A
G
L
A
-------------
V
L
L
S
K
LSGSPD
V
A
V
GFPIAGRSD--P
A
----
L
D
N
L
V
G
F
F
V
N
T
L
V
L
R
V
NLAGD
P
S
F
A
E
L
L
G
Q
V
R
A
R
S
L
AAYENQDV
P
F
E
V
L
V
D
RLKPTRALTH
H
P
L
I
Q
V
M
L
A
WQ---------------DNP---VG
Q
L
N--------------L-----GDLQATPMPIDT
R
T
A
R
M
D
L
V
F
S
L
A
E
R
F
SEGSEPAGIGGA
V
E
Y
RTDVF
E
A
Q
A
I
D
V
L
I
E
R
L
R
K
V
L
V
A
V
AAAPER
T
V
S
S
ID-ALDG
T
E
R
A
R
L
D
E
WG
N
R
A
V
L
TAPAPTPV
S
I
P
--
Q
-----
M
L
A
A
Q
V
ARIPEA
E
A
V
CCGDA
S
M
T
Y
R
E
L
D
E
A
S
N
R
L
A
H
R
L
AGCGA
G
P
G
E
C
V
A
L
L
F
E
RC
A
P
A
V
V
A
M
V
A
V
L
KTG
A
A
Y
LPIDPANPP
P
R
V
A
F
M
LGDAV
P
V
A
A
V
T
T
A
G
L
R
S
R
LAG---HD----L
P
------
I
I
D
V
V
-----
D
A
--
L
AAYPG----------TPPPMP
A
-
A
V
N
L
A
Y
I
L
Y
TSGTTGEPK
G
V
G
I
T
H
R
N
V
T
R
--
L
-------
F
A
SL
P
A
---
R
-
L
--
S
A
A
Q
V
W
S
Q
C
H
-----SYGFD
A
S
A
W
E
I
W
G
A
L
LGG
G
R
L
V
I
V
P
E
S
VAASPND
F
H
G
L
L
V
A
E
H
V
S
V
L
TQTP
A
A
V
A
-----ML---PTQ--------
G
---
L
--
E
-
S
-----
V
----
A
----
L
V
VAGEAC
P
A
A
L
V
DR----WA---P---
G
R
V
--
M
L
N
AYGPTE
T
T
I
C
A
A--IS--APLR-----PGSGMP---------PIGVPVS
G
A
A
L
F
V
L
D
S
W
-LRPVPA-GVAG
E
L
Y
I
A
GAGVG
V
G
Y
W
R
RAGLT
A
S
R
F
V
ACPFGGSG
A
R
M
Y
RTG
D
L
V
C
W
RADG
Q
L
E
F
LGRTD
D
Q
V
K
I
R
G
Y
R
I
E
L
G
E
V
A
T
A
L
A
E
L
AGVG
Q
A
V
----
V
I
A
RE------DRPGD--K
R
L
V
G
Y
ATEIAPGAV
D
P
A
G
L
R
A
Q
L
A
Q
RLPG
Y
L
V
P
A
A
V
V
V
I
DAL
P
L
T
VNGKLDHRALP-----APE--YGD-T-NGYRAPAG
P
V
E
K
T
V
A
G
I
F
A
R
V
L
G
L
E
RVGVD
D
S
F
F
E
LGG
D
S
L
A
A
M
R
V
I
A
A
INTT-LNAD
L
P
V
R
A
L
L
HASST
R
G
L
S
Q
L
L--GRDARPTSDP
R
L
V
S
VHGDNPT
E
V
HASDL
T
L
D
R
FI
D
A
D
T
L
A
T
A
VNLPGPSPE
L
R
T
V
L
L
TG
A
T
G
F
L
G
R
Y
L
V
L
E
L
L
R
RLDVDG
R
L
I
C
L
V
RAES
D
E
D
A
R
R
R
L
E
K
TFDSG
D
P
E
L
L
R
H
F
K
E
L
A
A
D
R
L
E
VVAGDKSEPDLGL
D
Q
P
M
W
R
R
L
A
E
T
V
D
L
I
VDS
A
A
M
VNAF
P
Y
H
E
LFGPNVA
G
T
A
E
L
I
R
I
A
L
TTKLK
P
F
T
Y
V
STADVGAAIEPSAFTEDA
D
I
R
V
I
SPTRTVDGGWAGGYGTS
K
W
A
G
E
V
L
L
REANDL
C
A
L
P
V
A
V
F
RCG
M
I
L
ADTSYAGQL
N
M
S
D
W
V
T
R
M
V
L
S
L
M
ATGIAPRSFYEPDSEGNRQRAHFDGL
P
V
T
F
V
A
E
A
I
A
V
L
G
A
R
VAGSSLA
G
F
A
T
Y
H
VMNPHDDGI
G
L
D
E
Y
V
D
W
L
I
EAGYPI
R
R
I
D
D
F
A
E
W
L
Q
R
F
E
A
S
LGALP
D
R
Q
R
R
H
S
V
L
P
M
LLASNSQRLQPLKPTRGCSA
P
T
D
R
F
R
A
A
V
R
A
A
KVGSDKDNPDIPHVSA
P
T
I
I
N
Y
VT
N
L
Q
L
LGLL
3
PsiBlast_PDB
85.37
30%
-104
- C1 -
4ZXI
5
?
A:
[19-1053]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
S
S
E
Q
L
G
I
W
Y
I
Q
R
L
E
P
T
C
S
A
Y
N
M
V
V
A
F
D
V
K
V
N
QSL
G
N
K
P
I
-
E
I
L
E
A
V
M
H
D
----
Y
P
L
L
R
V
S
M
P
A
N
D
-
Q
G
I
E
Q
L
I
W
D
--
R
V
Y
P
N
I
I
F
S
D
--
A
R
H
I
--
E
----
A
S
D
L
T
Q
L
V
E
Q
D
T
K
Q
P
----
F
D
L
--
T
Q
P
P
L
W
R
I
H
C
Y
E
C
G
Q
N
H
Y
V
I
A
F
V
I
H
H
A
L
M
D
F
W
S
I
G
L
L
L
R
D
V
S
K
R
F
G
L
V
A
E
S
D
A
V
N
G
I
E
F
----------
V
Q
Y
A
D
K
Q
--
Q
S
S
V
I
D
D
T
D
E
S
-------
L
I
F
W
K
N
A
L
K
H
A
P
H
V
H
S
I
P
L
D
Y
P
-----
R
P
A
V
Q
Q
H
K
G
S
S
L
V
F
R
V
S
E
S
V
S
S
G
L
V
N
L
A
K
D
Y
E
I
T
L
F
G
L
V
L
S
G
F
Y
-------------
V
L
L
H
K
L
S
N
E
N
N
L
V
I
A
T
P
V
A
G
R
L
E
--
R
S
----
L
R
N
A
L
G
Q
F
V
N
T
I
A
I
H
M
D
I
D
A
D
Q
T
L
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Q
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T
Q
Q
V
Q
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Q
L
R
Q
S
L
K
H
Q
K
I
A
F
S
R
V
V
E
A
V
S
P
K
R
D
G
S
I
N
P
L
A
Q
I
G
M
F
W
E
RLGGMDEFKELLLPI
Q
T
P
A
T
L
V
G
Q
-----------------------
D
L
T
L
G
S
F
P
V
R
Q
Q
E
G
Q
L
D
I
T
L
E
M
G
-----
G
E
Y
Q
G
E
L
V
G
V
L
K
Y
N
T
D
L
F
S
A
Q
S
A
E
N
M
V
Q
L
L
Q
A
V
L
S
E
M
V
A
H
P
E
R
K
I
V
E
L
D
I
A
P
D
Y
K
D
G
I
Q
F
E
A
L
R
G
K
A
T
D
Y
A
Q
H
----
D
L
F
--
A
-----
M
I
L
K
Q
I
D
E
R
G
D
N
H
A
L
T
S
--
H
T
V
S
Y
R
E
L
G
Q
H
I
A
G
I
A
E
Y
L
R
A
H
G
I
T
Q
G
D
R
V
G
L
M
L
D
R
T
A
L
L
P
A
A
I
L
G
I
W
A
A
G
A
A
Y
V
P
L
D
P
N
F
P
T
E
R
L
Q
N
I
I
E
D
A
E
P
K
V
I
L
T
Q
T
E
L
M
D
G
L
-
N
---
V
S
----
V
P
------
R
L
D
I
N
-----
Q
A
--
G
V
V
A
L
E
----------
Q
V
R
E
T
L
A
-
F
G
D
I
A
Y
V
M
Y
T
S
----
K
P
K
G
V
R
I
G
H
P
S
I
I
N
--
F
-------
L
L
S
M
N
D
---
R
-
L
-----
Q
V
T
T
E
T
Q
L
L
A
I
T
T
Y
A
F
D
I
S
I
L
E
L
L
I
P
L
M
Y
G
G
V
V
H
V
C
P
R
E
V
S
Q
D
G
I
Q
L
V
D
Y
L
N
A
K
S
I
N
V
L
Q
A
T
P
A
T
W
K
-----
M
L
L
D
S
E
W
S
--------
G
---
N
--
A
-
G
-----
L
----
T
----
A
L
C
G
G
E
A
L
D
T
I
L
A
E
K
----
L
L
-------
G
K
V
GC
L
W
N
V
Y
G
P
T
E
T
T
V
W
S
----
S
--
A
A
R
I
-----
T
D
A
K
Y
I
---------
D
L
G
E
P
L
A
N
T
Q
L
Y
V
L
D
E
Q
-
Q
R
L
V
P
P
-
G
V
M
G
E
L
W
I
G
G
D
G
L
A
V
D
Y
W
Q
R
P
E
L
T
D
A
Q
F
R
T
L
P
S
L
P
N
A
G
R
L
Y
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G
D
K
V
C
L
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T
D
G
R
L
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H
H
G
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L
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Q
V
K
I
R
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F
R
I
E
L
G
E
I
E
N
V
L
K
Q
I
D
G
I
T
D
A
V
----
V
L
V
K
T
------
T
G
D
N
D
--
Q
K
L
V
A
Y
V
T
---
G
Q
E
L
D
I
A
G
L
K
K
N
L
Q
I
H
L
P
A
Y
M
V
P
S
A
F
I
R
L
D
E
F
P
M
T
A
N
K
K
L
D
R
K
A
F
P
-----
E
P
I
--
F
E
Q
-
S
-
N
D
Y
V
A
P
R
D
P
I
E
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L
C
T
T
F
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L
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V
K
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G
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D
D
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F
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L
G
G
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L
L
A
V
K
L
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H
L
K
K
A
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F
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A
L
L
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T
V
E
R
L
G
E
I
I
R
E
N
K
E
I
K
P
S
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
85.11
30%
-102
- C1 -
4ZXH
3
?
A:
[19-1053]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
S
S
E
Q
L
G
I
W
Y
I
Q
R
L
E
P
T
C
S
A
Y
N
M
V
V
A
F
D
V
K
V
N
QSL
G
N
K
P
I
-
E
I
L
E
A
V
M
H
D
----
Y
P
L
L
R
V
S
M
P
A
N
D
-
Q
G
I
E
Q
L
I
W
D
--
R
V
Y
P
N
I
I
F
S
D
--
A
R
H
I
--
E
----
A
S
D
L
T
Q
L
V
E
Q
D
T
K
Q
P
----
F
D
L
--
T
Q
P
P
L
W
R
I
H
C
Y
E
C
G
Q
N
H
Y
V
I
A
F
V
I
H
H
A
L
M
D
F
W
S
I
G
L
L
L
R
D
V
S
K
R
F
G
L
V
A
E
S
D
A
V
N
G
I
E
F
----------
V
Q
Y
A
D
K
Q
--
Q
S
S
V
I
D
D
T
D
E
S
-------
L
I
F
W
K
N
A
L
K
H
A
P
H
V
H
S
I
P
L
D
Y
P
-----
R
P
A
V
Q
Q
H
K
G
S
S
L
V
F
R
V
S
E
S
V
S
S
G
L
V
N
L
A
K
D
Y
E
I
T
L
F
G
L
V
L
S
G
F
Y
-------------
V
L
L
H
K
L
S
N
E
N
N
L
V
I
A
T
P
V
A
G
R
L
E
--
R
S
----
L
R
N
A
L
G
Q
F
V
N
T
I
A
I
H
M
D
I
D
A
D
Q
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L
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Q
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Q
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Q
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L
K
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A
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V
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E
A
V
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P
K
R
D
G
S
I
N
P
L
A
Q
I
G
M
F
W
E
R
L
G
GMDEFKELLLPI
Q
T
P
A
T
L
V
G
Q
-----------------------
D
L
T
L
G
S
F
P
V
R
Q
Q
E
G
Q
L
D
I
T
L
E
M
G
-----
G
E
Y
Q
G
E
L
V
G
V
L
K
Y
N
T
D
L
F
S
A
Q
S
A
E
N
M
V
Q
L
L
Q
A
V
L
S
E
M
V
A
H
P
E
R
K
I
V
E
L
D
I
A
P
D
Y
K
D
G
I
Q
F
E
A
L
R
G
K
A
T
D
Y
A
Q
H
----
D
L
F
--
A
-----
M
I
L
K
Q
I
D
E
R
G
D
N
H
A
L
T
S
--
H
T
V
S
Y
R
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L
G
Q
H
I
A
G
I
A
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L
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A
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G
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D
R
V
G
L
M
L
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A
L
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P
A
A
I
L
G
I
W
A
A
G
A
A
Y
V
P
L
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N
F
P
T
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L
Q
N
I
I
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D
A
E
P
K
V
I
L
T
Q
T
E
L
M
D
G
L
-
N
---
V
S
----
V
P
------
R
L
D
I
N
-----
Q
A
--
G
V
V
A
L
E
----------
Q
V
R
E
T
L
A
-
F
G
D
I
A
Y
V
M
Y
T
S
----
K
P
K
G
V
R
I
G
H
P
S
I
I
N
--
F
-------
L
L
S
M
N
D
---
R
-
L
-----
Q
V
T
T
E
T
Q
L
L
A
IT
T
Y
A
F
D
I
S
I
L
E
L
L
I
P
L
M
Y
G
G
V
V
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P
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Q
D
G
I
Q
L
V
D
Y
L
N
A
K
S
I
N
V
L
Q
A
T
P
A
T
W
K
-----
M
L
L
D
S
E
W
S
--------
G
---
N
--
A
-
G
-----
L
----
T
----
A
L
C
G
G
E
A
L
D
T
I
L
A
E
K
----
L
L
-------
G
K
V
GC
L
W
N
V
Y
G
P
T
E
T
T
V
W
S
----
S
--
A
A
R
I
-----
T
D
A
K
Y
I
---------
D
L
G
E
P
L
A
N
T
Q
L
Y
V
L
D
E
Q
-
Q
R
L
V
P
P
-
G
V
M
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E
L
W
I
G
G
D
G
L
A
V
D
Y
W
Q
R
P
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A
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L
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A
G
R
L
Y
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L
T
H
H
G
R
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K
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F
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I
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L
G
E
I
E
N
V
L
K
Q
I
D
G
I
T
D
A
V
----
V
L
V
K
T
------
T
G
D
N
D
--
Q
K
L
V
A
Y
V
T
---
G
Q
E
L
D
I
A
G
L
K
K
N
L
Q
I
H
L
P
A
Y
M
V
P
S
A
F
I
R
L
D
E
F
P
M
T
A
N
K
K
L
D
R
K
A
F
P
-----
E
P
I
--
F
E
Q
-
S
-
N
D
Y
V
A
P
R
D
P
I
E
I
E
L
C
T
T
F
E
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I
L
S
V
K
R
V
G
I
H
D
D
F
F
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L
G
G
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L
L
A
V
K
L
V
N
H
L
K
K
A
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F
G
T
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L
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V
A
L
L
A
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Y
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T
V
E
R
L
G
E
I
I
R
E
N
K
E
I
K
P
S
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
83.37
29%
-100
- C1 -
2VSQ
2
SRFAC_BACSU
A:
[15-1056]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
S
P
M
Q
E
G
M
L
F
H
A
I
L
N
P
G
Q
S
F
Y
L
E
Q
I
T
M
K
V
K
-----
G
S
L
N
I
-
K
C
L
E
E
S
M
N
V
I
M
D
R
Y
D
V
F
R
T
V
F
I
H
-
E
-
K
V
K
R
P
V
Q
V
V
L
K
K
R
Q
F
H
I
E
E
I
D
--
L
T
H
L
--
T
----
G
S
E
Q
T
A
K
I
N
E
Y
K
E
Q
D
K
I
R
G
F
D
L
T
-
R
D
I
P
M
-
R
A
A
I
F
K
K
A
E
E
S
F
E
W
V
W
S
Y
H
H
I
I
L
D
G
W
C
F
G
I
V
V
Q
D
L
F
K
V
Y
N
A
-
L
R
E
Q
K
P
Y
S
L
P
P
V
---------
K
P
Y
K
D
Y
I
K
W
-------
L
E
K
Q
D
K
--
Q
A
S
L
R
Y
W
R
E
Y
L
E
G
F
E
G
Q
T
T
F
A
E
Q
R
K
K
Q
K
D
G
Y
E
P
------
K
E
L
L
F
S
P
S
E
A
E
T
K
A
F
T
E
L
A
K
S
Q
H
T
T
L
S
T
A
L
Q
A
V
W
S
-------------
V
L
I
S
R
Y
Q
Q
S
G
D
L
A
F
G
T
V
V
S
G
R
----
P
A
EIKG
V
E
H
M
V
G
L
F
I
N
V
V
P
R
R
V
K
L
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E
G
I
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F
N
G
L
L
K
R
L
Q
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Q
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L
Q
S
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P
H
Q
Y
V
P
L
Y
D
I
Q
S
Q
A
D
Q
P
K
L
I
D
H
------
I
I
V
F
E
---------------
N
Y
P
---
L
Q
D
A
K
--------------
N
-----
E
E
S
S
E
N
G
F
D
M
V
D
V
H
V
F
E
K
S
N
Y
D
L
N
L
M
A
S
P
G
D
E
---
M
L
I
K
L
A
Y
N
E
N
V
F
D
E
A
F
I
L
R
L
K
S
Q
L
L
T
A
I
Q
Q
L
I
Q
N
P
D
Q
P
V
S
T
I
N
-
L
V
D
D
R
E
R
E
F
L
-----
L
T
G
L
N
P
P
A
Q
A
H
E
T
K
P
L
T
Y
-----
W
F
K
E
A
V
N
A
N
P
D
A
P
A
L
T
Y
S
G
Q
T
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L
D
E
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A
N
R
I
A
R
R
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H
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A
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K
G
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V
V
A
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T
K
R
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L
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L
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I
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L
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A
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A
A
Y
L
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E
D
R
I
S
Y
M
L
A
D
S
A
A
A
C
L
L
T
H
Q
E
M
K
E
Q
A
A
-----
E
----
L
P
YT
G
T
T
L
F
I
D
D
Q
-----
T
R
--
F
E
E
Q
A
S
----------
D
P
A
T
A
I
D
-
P
N
D
P
A
Y
I
M
Y
T
S
G
T
T
G
K
P
K
G
N
I
T
T
H
A
N
I
Q
G
--
L
-------
V
K
H
V
D
Y
---
M
A
F
--
S
D
Q
D
T
F
L
S
V
S
-----
N
Y
A
F
D
A
F
T
F
D
F
Y
A
S
M
L
N
A
A
R
L
I
I
A
D
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H
T
L
L
D
T
E
R
L
T
D
L
I
L
Q
E
N
V
N
V
M
F
A
T
T
A
L
F
N
-----
L
L
---
T
D
A
--------
G
---
E
--
D
-
W
-----
M
KGLR
C
----
I
L
F
G
G
E
R
A
S
V
P
H
V
R
K
A
L
R
I
M
G
---
P
---
G
K
---
L
I
N
C
Y
G
P
T
E
G
T
V
F
A
T
A
H
V
V
--
H
D
L
P
-----
D
S
I
S
S
L
---------
P
I
G
K
P
I
S
N
A
S
V
Y
I
L
N
E
Q
-
S
Q
L
Q
P
F
-
G
A
V
G
E
L
C
I
S
G
M
G
V
S
K
G
Y
V
N
R
A
D
L
T
K
E
K
F
I
E
N
P
F
-
K
P
G
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T
L
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T
G
D
L
A
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W
L
P
D
G
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Y
A
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D
D
Q
V
K
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G
H
R
I
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L
E
E
I
E
K
Q
L
Q
E
Y
P
G
V
K
D
A
V
----
V
V
A
D
R
------
H
E
S
G
D
--
A
S
I
N
A
Y
L
--
V
N
R
T
Q
L
S
A
E
D
V
K
A
H
L
K
K
Q
L
P
A
Y
M
V
P
Q
T
F
T
F
L
D
E
L
P
L
T
T
N
G
K
V
N
K
R
L
L
P
-----
K
P
D
--
Q
D
Q
L
A
-
E
E
W
I
G
P
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N
E
M
E
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T
I
A
Q
I
W
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V
L
G
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D
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F
F
A
L
G
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-
L
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L
P
V
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L
L
F
E
A
P
T
I
A
G
I
S
A
Y
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
77.15
28%
-82
- C1 -
4ZXJ
1
ENTF_ECOLI
A:
[2-1042]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
P
L
V
A
A
Q
P
G
I
W
M
A
E
K
L
S
E
L
P
S
A
W
S
V
A
H
Y
V
E
L
T
-----
G
E
V
D
S
-
P
L
L
A
R
A
V
V
A
G
L
A
Q
A
D
T
L
R
M
R
F
T
E
D
N
-
G
E
V
W
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W
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D
D
A
L
T
F
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L
P
-
E
I
I
D
LR
T
N
I
D
--
P
----
H
G
T
A
Q
A
L
M
Q
A
D
L
Q
Q
D
----
L
R
V
D
-
S
G
K
P
L
V
F
H
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L
I
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V
A
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N
R
W
Y
W
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Y
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L
L
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G
F
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F
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A
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R
Q
I
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N
I
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C
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L
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G
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P
A
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P
F
T
PF
A
D
V
V
E
E
Y
Q
Q
Y
R
E
S
E
A
W
Q
R
D
A
---------------
A
F
W
A
-------
E
Q
R
R
Q
L
P
P
P
A
-----
S
L
S
P
A
P
L
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G
R
S
A
S
A
D
--------
I
L
R
L
K
L
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F
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L
A
L
A
L
A
A
L
W
L
G
R
L
C
N
R
M
D
Y
A
A
G
F
I
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M
R
R
L
G
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A
----
A
L
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A
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G
P
V
L
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V
L
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L
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P
L
F
G
P
V
L
N
I
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---------------
V
F
D
---
Y
-
Q
L
D
--------------
I
-----
P
D
V
Q
A
Q
T
H
T
L
A
T
G
P
V
N
-
D
L
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L
A
L
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L
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I
L
A
N
K
Q
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Y
D
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P
T
L
I
Q
H
A
-----
E
R
L
K
M
L
I
A
Q
F
A
A
D
P
A
L
L
C
G
D
V
D
-
I
M
L
P
G
E
Y
A
Q
L
------
A
Q
L
N
A
---
T
Q
V
E
I
P
--
E
TT
L
S
A
L
V
A
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A
A
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L
A
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A
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A
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L
L
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D
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A
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A
L
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L
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L
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A
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A
A
W
L
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L
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P
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L
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M
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L
L
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D
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L
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-----
D
----
V
P
------
N
L
T
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L
C
Y
N
--
A
P
--
L
T
P
Q
G
S
----------
A
P
L
Q
L
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Q
-
P
H
H
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A
Y
I
I
F
T
S
G
S
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G
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P
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G
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M
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G
Q
T
A
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V
N
R
L
L
-------
W
M
Q
N
H
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---
P
-
L
--
T
G
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V
A
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T
-----
P
C
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V
W
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F
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A
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A
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L
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A
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L
A
A
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---
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--------
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-----
C
----
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Q
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A
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----
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---
Q
L
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--
L
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L
Y
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T
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----
A
A
--
V
D
--
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W
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-----
P
A
F
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L
A
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VRGSSV
P
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W
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T
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T
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A
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N
Q
A
------
A
A
T
G
G
DA
R
Q
L
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G
Y
L
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S
Q
S
G
L
P
L
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A
L
Q
A
Q
L
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T
L
P
P
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V
V
L
L
Q
L
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Q
L
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L
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A
N
G
K
L
D
R
K
A
L
P
-----
L
P
E
--
L
K
A
-
Q
-
A
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A
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A
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A
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L
A
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----
D
A
E
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
35
HHSearch
75.49
30%
-98
- C1 -
2VSQ
2
SRFAC_BACSU
A:
[8-1060]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
Q
D
M
Y
Y
L
S
P
M
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G
M
L
F
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V
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-----
G
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K
C
L
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M
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V
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M
D
R
Y
D
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F
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K
R
P
V
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V
V
L
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K
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F
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--
L
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G
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T
A
K
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K
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Q
D
K
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----
F
D
L
T
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R
D
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M
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R
A
A
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K
K
A
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W
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W
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L
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A
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L
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P
P
V
---------
K
P
Y
K
D
Y
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K
W
L
E
K
Q
D
---------
K
Q
A
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L
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Y
W
R
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Y
L
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F
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G
Q
T
T
F
A
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Q
R
K
-----
K
Q
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K
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Y
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L
L
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A
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A
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W
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-------------
V
L
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K
L
I
D
H
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V
F
E
---------------
N
Y
P
---
L
Q
D
A
K
--------------
N
EESSE
N
G
F
D
M
V
D
V
-
H
V
F
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N
Y
D
L
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L
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Q
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L
N
P
P
A
---
Q
A
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P
L
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Y
-----
W
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L
P
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G
T
T
L
------
F
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D
D
Q
-----
T
R
--
F
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Q
A
S
----------
D
P
A
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P
N
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G
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P
K
G
N
I
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T
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A
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-------
V
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H
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D
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M--
A
-
F
--
S
D
Q
D
T
F
L
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-----
N
Y
A
F
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A
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A
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L
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A
A
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L
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V
M
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A
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L
L
---
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--------
G
EDW
M
--
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-----
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C
----
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D
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L
---------
P
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N
A
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D
Q
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L
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Q
L
Q
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P
G
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K
D
A
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----
V
V
A
D
R
------
H
E
S
G
D
--
A
S
I
N
A
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L
V
N
R
T
--
Q
L
S
A
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D
V
K
A
H
L
K
K
Q
L
P
A
Y
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Q
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F
T
F
L
D
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L
P
L
T
T
N
G
K
V
N
K
R
L
L
P
-----
K
P
D
--
Q
D
Q
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L
A
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E
W
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G
P
R
N
E
M
E
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A
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D
L
P
V
K
L
L
F
E
A
P
T
I
A
G
I
S
A
Y
L
--
K
N
G
G
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
HHSearch
74.04
30%
-101
- C1 -
4ZXH
3
?
A:
[12-1047]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
V
L
S
R
H
A
I
S
S
E
Q
L
G
I
W
Y
I
Q
R
L
E
P
T
C
S
A
Y
N
M
V
V
A
F
D
V
K
-----
V
N
Q
S
L
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N
K
P
I
E
I
L
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A
V
M
H
D
Y
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N
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-
Q
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--
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D
--
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R
H
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--
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----
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L
T
Q
L
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Q
D
T
K
Q
P
----
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-
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W
-
R
I
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C
Y
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F
W
S
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L
L
L
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G
L
V
A
E
S
D
A
----
V
N
G
---------
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F
V
Q
Y
A
D
K
Q
Q
S
S
V
I
------
D
D
T
D
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L
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K
N
A
L
K
H
A
P
H
V
H
S
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-----
R
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L
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L
A
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Y
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L
F
G
L
V
L
S
G
F
Y
-------------
V
L
L
H
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L
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N
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R
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--
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----
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R
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P
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A
Q
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G
M
F
W
E
---------------
R
L
G
---
G
M
D
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F
KELLLPIQTP
A
T
L
V
G
-----
Q
D
L
T
L
G
S
F
P
V
R
Q
Q
E
G
Q
L
D
I
T
L
E
M
G
G
E
-----
Y
Q
G
E
L
V
G
V
L
K
Y
N
T
D
L
F
S
A
Q
S
A
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M
V
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L
L
Q
A
V
L
S
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M
V
A
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A
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K
D
G
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A
L
R
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A
---
T
D
Y
A
Q
H
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L
F
--
A
-----
M
I
L
K
Q
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R
G
D
N
H
A
L
T
S
--
H
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V
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Y
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A
G
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A
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L
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Q
T
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L
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L
N
V
---
S
-----
V
P
------
R
L
D
I
N
-----
Q
A
--
G
V
V
A
L
E
----------
Q
V
R
E
T
L
A
-
F
G
D
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A
Y
V
M
Y
T
S
----
K
P
K
G
V
R
I
G
H
P
S
I
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N
--
F
-------
L
L
S
M
N
D
---
R
-
L
QV
T
T
E
T
Q
L
L
A
I
T
-----
T
Y
A
F
D
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I
L
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L
L
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L
M
Y
G
G
V
V
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L
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D
Y
L
N
A
K
S
I
N
V
L
Q
A
T
P
A
T
W
K
-----
M
L
---
L
D
S
--------
E
---
W
SG
N
A
G
-----
L
----
T
----
A
L
C
G
G
E
A
L
D
T
I
L
A
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K
----
L
L
---
G
K
--
V
G
C
--
L
W
N
V
Y
G
P
T
E
T
T
V
W
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--
A
A
--
R
I
T
-------
D
A
K
Y
I
---------
D
L
G
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L
A
N
T
Q
L
Y
V
L
D
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-
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R
L
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A
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Q
F
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L
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L
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R
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V
C
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R
L
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K
I
R
G
F
R
I
E
L
G
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I
E
N
V
L
K
Q
I
D
G
I
T
D
A
V
----
V
L
V
K
T
------
T
G
D
N
D
--
Q
K
L
V
A
Y
V
T
G
Q
---
E
L
D
I
A
G
L
K
K
N
L
Q
I
H
L
P
A
Y
M
V
P
S
A
F
I
R
L
D
E
F
P
M
T
A
N
K
K
L
D
R
K
A
F
P
-----
E
P
I
--
F
E
Q
-
S
-
N
D
Y
V
A
P
R
D
P
I
E
I
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L
C
T
T
F
E
Q
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L
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V
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R
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D
D
F
F
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L
G
G
H
S
L
L
A
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K
L
V
N
H
L
K
K
A
-
F
G
T
E
L
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A
L
L
A
Q
Y
S
T
V
E
R
L
G
E
I
I
--
R
E
N
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
72.58
99%
-86
- C1 -
4U5Q
1
?
A:
[41-478]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
T
E
V
H
A
S
D
L
T
L
D
R
F
I
D
A
D
T
L
A
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A
V
N
L
P
G
P
S
P
E
L
R
T
V
L
L
T
G
A
T
G
F
L
G
R
Y
L
V
L
E
L
L
R
R
L
D
V
D
G
R
L
I
C
L
V
R
A
E
S
D
E
D
A
R
R
R
L
E
K
T
F
D
S
G
D
P
E
L
L
R
H
F
K
E
L
A
A
D
R
L
E
V
V
A
G
D
K
S
E
P
D
L
G
L
D
Q
P
M
W
R
R
L
A
E
T
V
D
L
I
V
D
S
A
A
M
V
N
A
F
P
Y
H
E
L
F
G
P
N
V
A
G
T
A
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L
I
R
I
A
L
T
T
K
L
K
P
F
T
Y
V
S
T
A
D
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G
A
A
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A
F
T
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D
A
D
I
R
V
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P
T
R
T
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G
G
W
A
G
G
Y
G
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K
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A
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L
L
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A
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D
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A
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A
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Y
A
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L
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M
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D
W
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R
M
V
L
S
L
M
A
T
G
I
A
P
R
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F
Y
E
P
D
S
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G
N
R
Q
R
A
H
F
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G
L
P
V
T
F
V
A
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A
I
A
V
L
G
A
R
V
A
G
S
S
L
A
G
F
A
T
Y
H
V
M
N
P
H
D
D
G
I
G
L
D
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Y
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W
L
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Y
P
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R
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F
A
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A
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Q
R
R
H
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V
L
P
M
L
L
------
L
Q
P
L
K
P
---
C
S
A
P
T
D
R
F
R
A
A
V
R
A
A
K
V
G
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D
K
D
N
P
D
I
P
H
V
S
A
P
T
I
I
N
Y
V
T
N
L
Q
L
L
G
L
L
21
PsiBlast_CBE
71.56
99%
-84
- C1 -
4U5Q
1
?
B:
[42-478]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
T
E
V
H
A
S
D
L
T
L
D
R
F
I
D
A
D
T
L
A
T
A
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N
L
P
G
P
S
P
E
L
R
T
V
L
L
T
G
A
T
G
F
L
G
R
Y
L
V
L
E
L
L
R
R
L
D
V
D
G
R
L
I
C
L
V
R
A
E
S
D
E
D
A
R
R
R
L
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F
D
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D
P
E
L
L
R
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F
K
E
L
A
A
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R
L
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V
A
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L
G
L
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R
L
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A
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L
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A
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A
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T
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D
A
D
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R
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P
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R
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--
W
A
G
G
Y
G
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K
W
A
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V
L
L
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C
A
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A
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R
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L
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M
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L
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--
S
A
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R
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D
N
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P
H
V
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A
P
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I
N
Y
V
T
N
L
Q
L
L
G
L
L
36
HHSearch
70.42
27%
-90
- C1 -
4ZXJ
1
ENTF_ECOLI
A:
[2-1041]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
P
L
V
A
A
Q
P
G
I
W
M
A
E
K
L
S
E
L
P
S
A
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A
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V
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-----
G
E
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P
L
L
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A
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V
A
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L
A
Q
A
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-
G
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W
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L
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P
----
H
G
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---------
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-----
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A
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-------------
L
W
L
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R
L
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N
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R
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A
A
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---------------
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---
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Q
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--------------
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M
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L
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-----
A
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--
L
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----------
A
P
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P
H
H
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A
Y
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R
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L
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H
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V
V
A
Q
K
T
-----
P
C
S
F
D
V
S
V
W
E
F
F
W
P
F
I
A
G
A
K
L
V
M
A
E
P
E
A
H
R
D
P
L
A
M
Q
Q
F
F
A
E
Y
G
V
T
T
T
H
F
V
P
S
M
L
A
-----
A
F
---
V
A
S
LT
P
Q
T
A
R
Q
S
---
C
--
A
-
T
-----
L
K---
Q
----
V
F
C
S
G
E
A
L
P
A
D
L
C
R
E
----
W
Q
---
Q
L
T-
G
A
P
--
L
H
N
L
Y
G
P
T
E
A
A
V
D
V
S
--
W
Y
--
P
A
F
G
E
E
L
A
Q
V
R
G
S
S
V
---------
P
I
G
Y
P
V
W
N
T
G
L
R
I
L
D
A
M
-
M
H
P
V
P
P
-
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V
A
G
D
L
Y
L
T
G
I
Q
L
A
Q
G
Y
L
G
R
P
D
L
T
A
S
R
F
I
A
D
P
F
A
-
P
G
E
R
M
Y
R
T
G
D
V
A
R
W
L
D
N
G
A
V
E
Y
L
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S
D
D
Q
L
K
I
R
G
Q
R
I
E
L
G
E
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R
V
M
Q
A
L
P
D
V
E
Q
A
V
----
T
H
A
C
V
INQAAA
T
G
G
D
A
--
R
Q
L
V
G
Y
L
V
S
Q
S
G
L
P
L
D
T
S
A
L
Q
A
Q
L
R
E
T
L
P
P
H
M
V
P
V
V
L
L
Q
L
P
Q
L
P
L
S
A
N
G
K
L
D
R
K
A
L
P
-----
L
P
E
--
L
K
A
-
Q
-
A
P
G
R
A
P
K
A
G
S
E
T
I
I
A
A
A
F
S
S
L
L
G
C
D
V
Q
D
A
D
A
D
F
F
A
L
G
G
H
S
L
L
A
M
K
L
A
A
Q
L
S
R
Q
-
V
A
R
Q
V
T
P
G
Q
V
M
V
A
S
T
V
A
K
L
A
T
I
I
--
D
A
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
63.08
35%
-83
- C1 -
5ES8
1
LGRA_BREPA
B:
[200-768]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
I
D
K
T
F
H
--
Q
-----
L
F
E
Q
Q
V
E
M
T
P
D
H
V
A
V
V
D
R
G
Q
S
L
T
Y
K
Q
L
N
E
R
A
N
Q
L
A
H
H
L
R
G
K
G
V
K
P
D
D
Q
V
A
I
M
L
D
K
S
L
D
M
I
V
S
I
L
A
V
M
K
A
G
G
A
Y
V
P
I
D
P
D
Y
P
G
E
R
I
A
Y
M
L
A
D
S
-
S
A
A
I
L
L
T
N
A
L
H
E
E
K
A
N
---
G
A
----
C
D
------
I
I
D
V
H
DP---
D
S
--
Y
S
E
N
T
N
----------
N
L
P
H
V
N
R
-
P
D
D
L
V
Y
V
M
Y
T
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G
S
T
G
L
A
K
G
V
M
I
E
H
H
N
L
V
N
--
F
CEWYRPY
F
G
V
T
P
A
--------
D
K
A
L
V
Y
S
--------
S
F
S
F
D
G
S
A
L
D
I
F
T
H
L
L
A
G
A
A
L
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V
P
S
E
R
K
Y
D
L
D
A
L
N
D
Y
C
N
Q
E
G
I
T
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L
P
T
G
A
A
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-----
Q
F
---
M
Q
M
--------
D
---
N
--
Q
-
S
-----
F
----
R
----
V
V
I
T
G
G
D
V
L
K
K
-
I
E
R
----
N
G
---
T
---
Y
K
---
L
Y
N
G
Y
G
P
T
E
C
T
I
M
V
T
--
M
F
--
E
V
D
K
-----
P
Y
A
N
I
----------
P
I
G
K
P
I
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I
L
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L
D
E
A
-
L
A
L
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G
V
A
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L
F
I
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G
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G
L
G
R
G
Y
L
N
R
P
E
L
T
A
E
K
F
I
V
H
P
--
Q
T
G
E
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M
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R
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D
R
A
R
F
L
P
D
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N
I
E
F
L
G
R
L
D
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L
V
K
I
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Y
R
I
E
P
G
E
I
E
P
F
L
M
N
H
P
L
I
E
L
T
T
----
V
L
A
K
E
------
Q
A
D
G
R
--
K
Y
L
V
G
Y
Y
--
V
A
P
E
E
I
P
H
G
E
L
R
E
W
L
G
N
D
L
P
D
Y
M
I
P
T
Y
F
V
H
M
K
A
F
P
L
T
A
N
G
K
V
D
R
R
A
L
P
DVQAD
A
E
L
--
L
---
D
---
Y
V
A
P
T
D
E
L
E
Q
Q
L
A
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V
W
S
H
V
L
G
I
P
Q
M
G
I
D
D
H
F
L
E
R
G
G
D
S
I
K
V
M
Q
L
I
H
Q
L
K
-
N
-
I
G
L
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L
R
Y
D
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L
F
T
H
P
T
I
R
Q
L
K
R
L
L
--
T
E
Q
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
62.96
35%
-83
- C1 -
5ES8
1
LGRA_BREPA
A:
[200-768]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
I
D
K
T
F
H
--
Q
-----
L
F
E
Q
Q
V
E
M
T
P
D
H
V
A
V
V
D
R
G
Q
S
L
T
Y
K
Q
L
N
E
R
A
N
Q
L
A
H
H
L
R
G
K
G
V
K
P
D
D
Q
V
A
I
M
L
D
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S
L
D
M
I
V
S
I
L
A
V
M
K
A
G
G
A
Y
V
P
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D
P
D
Y
P
G
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R
I
A
Y
M
L
A
D
S
-
S
A
A
I
L
L
T
N
A
L
H
E
E
K
A
N
---
G
A
----
C
D
------
I
I
D
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H
DP---
D
S
--
Y
S
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N
T
N
----------
N
L
P
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N
R
-
P
D
D
L
V
Y
V
M
Y
T
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G
S
T
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L
A
K
G
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M
I
E
H
H
N
L
V
N
--
F
C
E
W
Y
R
P
Y
F
G
V
T
P
A
--------
D
K
A
L
V
Y
S
--------
S
F
S
F
D
G
S
A
L
D
I
F
T
H
L
L
A
G
A
A
L
H
I
V
P
S
E
R
K
Y
D
L
D
A
L
N
D
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C
N
Q
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T
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S
Y
L
P
T
G
A
A
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-----
Q
F
---
M
Q
M
--------
D
---
N
--
Q
-
S
-----
F
----
R
----
V
V
I
T
G
G
D
V
L
K
K
-
I
E
R
----
N
G
---
T
---
Y
K
---
L
Y
N
G
Y
G
P
T
E
C
T
I
M
V
T
--
M
F
--
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V
D
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-----
P
Y
A
N
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----------
P
I
G
K
P
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L
I
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A
-
L
A
L
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P
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-
G
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A
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N
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L
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L
T
T
----
V
L
A
K
E
------
Q
A
D
G
R
--
K
Y
L
V
G
Y
Y
--
V
A
P
E
E
I
P
H
G
E
L
R
E
W
L
G
N
D
L
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D
Y
M
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P
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Y
F
V
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A
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A
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G
K
V
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R
R
A
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P
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V
A
P
T
D
E
L
E
Q
Q
L
A
Q
V
W
S
H
V
L
G
I
P
Q
M
G
I
D
D
H
F
L
E
R
G
G
D
S
I
K
V
M
Q
L
I
H
Q
L
K
-
N
-
I
G
L
S
L
R
Y
D
Q
L
F
T
H
P
T
I
R
Q
L
K
R
L
L
--
T
E
Q
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
40
HHSearch
62.03
35%
-87
* C1 *
5ES8
1
LGRA_BREPA
A:
[202-768]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
K
T
F
H
--
Q
-----
L
F
E
Q
Q
V
E
M
T
P
D
H
V
A
V
V
D
R
G
Q
S
L
T
Y
K
Q
L
N
E
R
A
N
Q
L
A
H
H
L
R
G
K
G
V
K
P
D
D
Q
V
A
I
M
L
D
K
S
L
D
M
I
V
S
I
L
A
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M
K
A
G
G
A
Y
V
P
I
D
P
D
Y
P
G
E
R
I
A
Y
M
L
A
D
S
S
A
A
I
L
L
T
N
A
L
H
E
E
K
A
N
G
---
A
-----
C
D
------
I
I
D
V
H
-----
D
P
DS
Y
S
E
N
T
N
----------
N
L
P
H
V
N
R
-
P
D
D
L
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Y
V
M
Y
T
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G
S
T
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L
A
K
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I
E
H
H
N
L
V
N
--
F
-------
C
E
W
Y
R
P
---
Y
-
F
GV
T
P
A
D
K
A
L
V
Y
S
-----
S
F
S
F
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A
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T
H
L
L
A
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A
A
L
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P
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E
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K
Y
D
L
D
A
L
N
D
Y
C
N
Q
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Y
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P
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G
A
A
E
-----
Q
F
---
M
Q
M
--------
D
---
N
--
Q
-
S
-----
F
R---
V
----
V
I
T
G
G
D
V
L
K
K
I
E
-------
R
N
---
G
---
T
Y
K
--
L
Y
N
G
Y
G
P
T
E
C
T
I
M
V
T
--
M
F
--
E
V
D
------
K
P
Y
A
N
I
---------
P
I
G
K
P
I
D
R
T
R
I
L
I
L
D
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A
-
L
A
L
Q
P
I
-
G
V
A
G
E
L
F
I
V
G
E
G
L
G
R
G
Y
L
N
R
P
E
L
T
A
E
K
F
I
V
H
P
Q
T
--
G
E
R
M
Y
R
T
G
D
R
A
R
F
L
P
D
G
N
I
E
F
L
G
R
L
D
N
L
V
K
I
R
G
Y
R
I
E
P
G
E
I
E
P
F
L
M
N
H
P
L
I
E
L
T
T
----
V
L
A
K
E
------
Q
A
D
G
R
--
K
Y
L
V
G
Y
Y
V
A
P
E
--
E
I
P
H
G
E
L
R
E
W
L
G
N
D
L
P
D
Y
M
I
P
T
Y
F
V
H
M
K
A
F
P
L
T
A
N
G
K
V
D
R
R
A
L
P
-----
D
V
------------
V
A
P
T
D
E
L
E
Q
Q
L
A
Q
V
W
S
H
V
L
G
I
P
Q
M
G
I
D
D
H
F
L
E
R
G
G
D
S
I
K
V
M
Q
L
I
H
Q
L
K
N
--
I
G
L
S
L
R
Y
D
Q
L
F
T
H
P
T
I
R
Q
L
K
R
L
L
--
T
E
Q
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
61.07
35%
-88
- C1 -
5ES9
1
LGRA_BREPA
A:
[200-768]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
I
D
K
T
F
H
--
Q
-----
L
F
E
Q
Q
V
E
M
T
P
D
H
V
A
V
V
D
R
G
Q
S
L
T
Y
K
Q
L
N
E
R
A
N
Q
L
A
H
H
L
R
G
K
G
V
K
P
D
D
Q
V
A
I
M
L
D
K
S
L
D
M
I
V
S
I
L
A
V
M
K
A
G
G
A
Y
V
P
I
D
P
D
Y
P
G
E
R
I
A
Y
M
L
A
D
S
-
S
A
A
I
L
L
T
N
A
L
H
E
E
K
A
N
---
G
A
----
C
D
------
I
I
D
V
H
DP---
D
S
--
Y
S
E
N
T
N
----------
N
L
P
H
V
N
R
-
P
D
D
L
V
Y
V
M
Y
T
S
----
L
A
K
G
V
M
I
E
H
H
N
L
V
N
--
F
C
E
W
Y
R
P
Y
F
G
V
T
P
A
--------
D
K
A
L
V
Y
S
--------
S
F
S
F
D
G
S
A
L
D
I
F
T
H
L
L
A
G
A
A
L
H
I
V
P
S
E
R
K
Y
D
L
D
A
L
N
D
Y
C
N
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P
T
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A
A
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-----
Q
F
---
M
Q
M
--------
D
---
N
--
Q
-
S
-----
F
----
R
----
V
V
I
T
G
G
D
V
L
K
K
-
I
E
R
----
N
G
---
T
---
Y
K
---
L
Y
N
G
Y
G
P
T
E
C
T
I
M
V
T
--
M
F
--
E
V
D
K
-----
P
Y
A
N
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----------
P
I
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P
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R
T
R
I
L
I
L
D
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A
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L
A
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A
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G
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L
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P
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L
T
A
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F
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--
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M
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A
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G
R
L
D
N
L
V
K
I
R
G
Y
R
I
E
P
G
E
I
E
P
F
L
M
N
H
P
L
I
E
L
T
T
----
V
L
A
K
E
------
Q
A
D
G
R
--
K
Y
L
V
G
Y
Y
--
V
A
P
E
E
I
P
H
G
E
L
R
E
W
L
G
N
D
L
P
D
Y
M
I
P
T
Y
F
V
H
M
K
A
F
P
L
T
A
N
G
K
V
D
R
R
A
L
P
D
V
Q
A
D
A
-------------
V
A
P
T
D
E
L
E
Q
Q
L
A
Q
V
W
S
H
V
L
G
I
P
Q
M
G
I
D
D
H
F
L
E
R
G
G
D
S
I
K
V
M
Q
L
I
H
Q
L
K
-
N
-
I
G
L
S
L
R
Y
D
Q
L
F
T
H
P
T
I
R
Q
L
K
R
L
L
--
T
E
Q
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
60.35
34%
-90
- C1 -
1AMU
4
GRSA_ANEMI
A:
[33-530]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
E
Y
P
R
D
K
T
I
H
--
Q
-----
L
F
E
E
Q
V
S
K
R
P
N
N
V
A
I
V
C
E
N
E
Q
L
T
Y
H
E
L
N
V
K
A
N
Q
L
A
R
I
F
I
E
K
G
I
G
K
D
T
L
V
G
I
M
M
E
K
S
I
D
L
F
I
G
I
L
A
V
L
K
A
G
G
A
Y
V
P
I
D
I
E
Y
P
K
E
R
I
Q
Y
I
L
D
D
S
Q
A
R
M
L
L
T
Q
K
H
L
V
H
L
I
-----
H
N
----
I
Q
------
F
N
G
Q
V
E
I
FEE
D
T
--
I
K
I
R
E
G
----------
T
N
L
H
V
P
S
K
S
T
D
L
A
Y
V
I
Y
T
S
-----
P
K
G
T
M
L
E
H
K
G
I
S
N
--
L
K
V
-----
F
F
E
N
S
L
---
N
-
V
--
T
E
K
D
R
I
G
Q
F
A
-----
S
I
S
F
D
A
S
V
W
E
M
F
M
A
L
L
T
G
A
S
L
Y
I
I
L
K
D
T
I
N
D
F
V
K
F
E
Q
Y
I
N
Q
K
E
I
T
V
I
T
L
P
P
T
Y
V
V
-----
H
L
D--
P
E
R
--------
I
---
L
--
S
-
I
-----
Q
----
T
----
L
I
T
A
G
S
A
T
S
P
S
L
V
N
K
----
W
K
---
E
---
K
V
T
--
Y
I
N
A
Y
G
P
T
E
T
T
I
C
A
T
--
T
W
--
V
A
T
K
-----
E
T
I
G
H
S
V--------
P
I
G
A
P
I
Q
N
T
Q
I
Y
I
V
D
E
N
-
L
Q
L
K
S
V
-
G
E
A
G
E
L
C
I
G
G
E
G
L
A
R
G
Y
W
K
R
P
E
L
T
S
Q
K
F
V
D
N
P
F
-
V
P
G
E
K
L
Y
K
T
G
D
Q
A
R
W
L
S
D
G
N
I
E
Y
L
G
R
I
D
N
Q
V
K
I
R
G
H
R
V
E
L
E
E
V
E
S
I
L
L
K
H
M
Y
I
S
E
T
A
----
V
S
V
H
K
------
D
H
Q
E
Q
--
P
Y
L
C
A
Y
F
--
V
S
E
K
H
I
P
L
E
Q
L
R
Q
F
S
S
E
E
L
P
T
Y
M
I
P
S
Y
F
I
Q
L
D
K
M
P
L
T
S
N
G
K
I
D
R
K
Q
L
P
-----
E
P
D
LT
F
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
61
Fugue
59.66
32%
-84
- C1 -
1AMU
4
GRSA_ANEMI
A:
[17-530]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
T
H
E
E
E
Q
Y
L
F
A
V
N
N
T
K
A
E
Y
P
-
R
D
K
T
I
H
--
Q
-----
L
F
E
E
Q
V
S
K
R
P
N
N
V
A
I
V
C
E
N
E
Q
L
T
Y
H
E
L
N
V
K
A
N
Q
L
A
R
I
F
I
E
K
G
I
G
K
D
T
L
V
G
I
M
M
E
K
S
I
D
L
F
I
G
I
L
A
V
L
K
A
G
G
A
Y
V
P
I
D
I
E
Y
P
K
E
R
I
Q
Y
I
L
D
D
S
Q
A
R
M
L
L
T
Q
K
H
L
V
H
L
I
H
N
I
QF
N
------
G
------
Q
V
E
I
F
-----
E
E
--
D
-----TIKIREGTNL
H
-
V
P
S
K
S
-
T
-
D
L
A
Y
V
I
Y
T
S
-----
P
K
G
T
M
L
E
H
K
G
I
S
N
--
L
-------
K
V
F
F
E
N
SLN--
V
--
T
E
K
D
R
I
G
Q
F
A
-----
S
I
S
F
D
A
S
V
W
E
M
F
M
A
L
L
T
G
A
S
L
Y
I
I
L
K
D
T
I
N
D
F
V
K
F
E
Q
Y
I
N
Q
K
E
I
T
V
I
T
L
P
P
T
Y
V
V
-----
H
L
------------------
D
--
P
-
E
RILSI
Q
----
T
----
L
I
T
A
G
S
A
T
S
P
S
L
V
N
K
----
W
K
---
E
KV---
T
--
Y
I
N
A
Y
G
P
T
E
T
T
I
C
A
T
--
T
W
--
V
A
T
K
-----
E
T
I
G
H
S
V--------
P
I
G
A
P
I
Q
N
T
Q
I
Y
I
V
D
E
-N
L
Q
L
K
S
V
-
G
E
A
G
E
L
C
I
G
G
E
G
L
A
R
G
Y
W
K
R
P
E
L
T
S
Q
K
F
V
D
N
P
F
V
-
P
G
E
K
L
Y
K
T
G
D
Q
A
R
W
L
S
D
G
N
I
E
Y
L
G
R
I
D
N
Q
V
K
I
R
G
H
R
V
E
L
E
E
V
E
S
I
L
L
K
H
M
Y
I
S
E
T
A
----
V
S
V
H
K
------
D
H
Q
E
Q
--
P
Y
L
C
A
Y
F
V
S
E
--
K
H
I
P
L
E
Q
L
R
Q
F
S
S
E
E
L
P
T
Y
M
I
P
S
Y
F
I
Q
L
D
K
M
P
L
T
S
N
G
K
I
D
R
K
Q
L
P
-----
E
P
D
--
L
T
F
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
59.15
34%
-89
- C1 -
1AMU
4
GRSA_ANEMI
B:
[33-530]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
E
Y
P
R
D
K
T
I
H
--
Q
-----
L
F
E
E
Q
V
S
K
R
P
N
N
V
A
I
V
C
E
N
E
Q
L
T
Y
H
E
L
N
V
K
A
N
Q
L
A
R
I
F
I
E
K
G
I
G
K
D
T
L
V
G
I
M
M
E
K
S
I
D
L
F
I
G
I
L
A
V
L
K
A
G
G
A
Y
V
P
I
D
I
E
Y
P
K
E
R
I
Q
Y
I
L
D
D
S
Q
A
R
M
L
L
T
Q
K
H
L
V
H
L
I
-----
H
N
-----
Q
------
F
N
G
Q
V
EIFEE
D
T
--
I
K
I
R
E
G
----------
T
N
L
H
V
P
S
K
S
T
D
L
A
Y
V
I
Y
T
-----
N
P
K
G
T
M
L
E
H
K
G
I
S
N
--
L
K
V
-----
F
F
E
N
S
L
---
N
-
V
--
T
E
K
D
R
I
G
Q
F
A
-----
S
I
S
F
D
A
S
V
W
E
M
F
M
A
L
L
T
G
A
S
L
Y
I
I
L
K
D
T
I
N
D
F
V
K
F
E
Q
Y
I
N
Q
K
E
I
T
V
I
T
L
P
P
T
Y
V
V
-----
H
L
D--
P
E
R
--------
I
---
L
--
S
-
I
-----
Q
----
T
----
L
I
T
A
G
S
A
T
S
P
S
L
V
N
K
----
W
K
---
E
---
K
V
T
--
Y
I
N
A
Y
G
P
T
E
T
T
I
C
A
T
--
T
W
--
V
A
T
K
-----
E
T
I
G
H
S
V--------
P
I
G
A
P
I
Q
N
T
Q
I
Y
I
V
D
E
N
-
L
Q
L
K
S
V
-
G
E
A
G
E
L
C
I
G
G
E
G
L
A
R
G
Y
W
K
R
P
E
L
T
S
Q
K
F
V
D
N
P
F
-
V
P
G
E
K
L
Y
K
T
G
D
Q
A
R
W
L
S
D
G
N
I
E
Y
L
G
R
I
D
N
Q
V
K
I
R
G
H
R
V
E
L
E
E
V
E
S
I
L
L
K
H
M
Y
I
S
E
T
A
----
V
S
V
H
K
------
D
H
Q
E
Q
--
P
Y
L
C
A
Y
F
--
V
S
E
K
H
I
P
L
E
Q
L
R
Q
F
S
S
E
E
L
P
T
Y
M
I
P
S
Y
F
I
Q
L
D
K
M
P
L
T
S
N
G
K
I
D
R
K
Q
L
P
-----
E
P
D
LT
F
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
58.08
35%
-85
- C1 -
5ES5
1
LGRA_BREPA
B:
[200-685]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
I
D
K
T
F
H
--
Q
-----
L
F
E
Q
Q
V
E
M
T
P
D
H
V
A
V
V
D
R
G
Q
S
L
T
Y
K
Q
L
N
E
R
A
N
Q
L
A
H
H
L
R
G
K
G
V
K
P
D
D
Q
V
A
I
M
L
D
K
S
L
D
M
I
V
S
I
L
A
V
M
K
A
G
G
A
Y
V
P
I
D
P
D
Y
P
G
E
R
I
A
Y
M
L
A
D
S
-
S
A
A
I
L
L
T
N
A
L
H
E
E
K
A
N
---
G
A
----
C
D
------
I
I
D
V
H
DP---
D
S
--
Y
S
E
N
T
N
----------
N
L
P
H
V
N
R
-
P
D
D
L
V
Y
V
M
Y
T
S
G
S
T
G
L
A
K
G
V
M
I
E
H
H
N
L
V
N
--
F
CEWYRPY
F
G
V
T
P
A
--------
D
K
A
L
V
Y
S
--------
S
F
S
F
D
G
S
A
L
D
I
F
T
H
L
L
A
G
A
A
L
H
I
V
P
S
E
R
K
Y
D
L
D
A
L
N
D
Y
C
N
Q
E
G
I
T
I
S
Y
L
P
T
G
A
A
E
-----
Q
F
---
M
Q
M
--------
D
---
N
--
Q
-
S
-----
F
----
R
----
V
V
I
T
G
G
D
V
L
K
K
-
I
E
R
----
N
G
---
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---
Y
K
---
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Y
N
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Y
G
P
T
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C
T
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V
T
--
M
F
--
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V
D
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-----
P
Y
A
N
I
----------
P
I
G
K
P
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D
R
T
R
I
L
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L
D
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A
-
L
A
L
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G
V
A
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F
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L
G
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L
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F
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--
Q
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M
Y
R
T
G
D
R
A
R
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L
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D
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N
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L
G
R
L
D
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L
V
K
I
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G
Y
R
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P
G
E
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E
P
F
L
M
N
H
P
L
I
E
L
T
T
----
V
L
A
K
E
------
Q
A
D
G
R
--
K
Y
L
V
G
Y
Y
--
V
A
P
E
E
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P
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A
F
P
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T
A
N
G
K
V
D
R
R
A
L
P
DVQAD
A
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
58
Fugue
57.90
27%
-73
- C1 -
4DG9
1
?
A:
[18-604]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
N
S
L
L
D
L
Y
A
H
P
T
V
V
--
A
-----
R
F
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M
A
A
L
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A
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R
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G
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L
L
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Q
L
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Y
L
L
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P
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V
C
L
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C
L
L
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L
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H
Y
L
Y
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L
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Q
P
A
A
W
N
A
E
L
C
R
Q
V
D
C
R
L
I
L
D
C
S
T
T
P
T
P
A
-----
N
G
----
L
P
------
C
V
P
V
R
-----
H
L
--
P
A
A
P
A
S
----------
V
A
R
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C
F
A
-
A
D
Q
I
A
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F
S
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G
T
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K
A
I
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L
-------
C
L
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L
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A
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L
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-----
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L
---
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D
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--------
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--
D
-
C
-----
L
GGLR
Q
----
L
L
T
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G
D
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P
H
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----
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L
---
L
R
H
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R
L
H
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L
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N
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Y
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T
C
--
C
H
V
V
T
D
D
D
-----
L
E
E
D
D
I
---------
P
I
G
K
A
I
A
G
T
A
V
L
L
L
D
E
H
-
G
Q
E
I
A
E
P
D
R
A
G
E
I
V
A
F
G
A
G
L
A
Q
G
Y
R
N
D
A
A
R
T
R
A
S
F
V
E
L
P
Y
R
G
R
L
L
R
A
Y
R
T
G
D
R
A
R
Y
D
E
Q
G
R
L
R
F
I
G
R
G
D
G
Q
V
K
L
N
G
Y
R
L
D
L
P
A
L
E
Q
R
F
R
R
Q
P
G
I
L
D
C
A
----
L
L
V
R
E
------
R
N
G
V
K
--
Q
L
L
C
A
W
T
-------
G
K
A
D
A
S
P
Q
A
L
L
R
Q
L
P
T
W
Q
R
P
H
A
C
V
R
V
E
A
L
P
L
T
A
H
G
K
L
D
R
A
A
L
L
-----
R
R
L
-------------
E
L
D
P
D
Q
R
G
C
A
Q
L
W
S
E
L
L
G
---
C
E
V
G
A
D
F
F
L
C
G
G
N
S
L
L
A
L
Q
L
V
A
L
C
Q
S
A
G
A
G
A
N
L
G
L
A
D
L
Q
A
N
S
R
L
D
Q
F
S
R
L
L
--
R
S
H
G
L
A
P
E
R
L
L
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
57.27
35%
-86
- C1 -
5ES5
1
LGRA_BREPA
A:
[200-683]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
I
D
K
T
F
H
--
Q
-----
L
F
E
Q
Q
V
E
M
T
P
D
H
V
A
V
V
D
R
G
Q
S
L
T
Y
K
Q
L
N
E
R
A
N
Q
L
A
H
H
L
R
G
K
G
V
K
P
D
D
Q
V
A
I
M
L
D
K
S
L
D
M
I
V
S
I
L
A
V
M
K
A
G
G
A
Y
V
P
I
D
P
D
Y
P
G
E
R
I
A
Y
M
L
A
D
S
-
S
A
A
I
L
L
T
N
A
L
H
E
E
K
A
N
---
G
A
----
C
D
------
I
I
D
V
H
DP---
D
S
--
Y
S
E
N
T
N
----------
N
L
P
H
V
N
R
-
P
D
D
L
V
Y
V
M
Y
T
S
G
S
T
G
L
A
K
G
V
M
I
E
H
H
N
L
V
N
--
F
C
E
W
Y
R
P
Y
F
G
V
T
P
A
--------
D
K
A
L
V
Y
S
--------
S
F
S
F
D
G
S
A
L
D
I
F
T
H
L
L
A
G
A
A
L
H
I
V
P
S
E
R
K
Y
D
L
D
A
L
N
D
Y
C
N
Q
E
G
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T
I
S
Y
L
P
T
G
A
A
E
-----
Q
F
---
M
Q
M
--------
D
---
N
--
Q
-
S
-----
F
----
R
----
V
V
I
T
G
G
D
V
L
K
K
-
I
E
R
----
N
G
---
T
---
Y
K
---
L
Y
N
G
Y
G
P
T
E
C
T
I
M
V
T
--
M
F
--
E
V
D
K
-----
P
Y
A
N
I
----------
P
I
G
K
P
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D
R
T
R
I
L
I
L
D
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A
-
L
A
L
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P
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-
G
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A
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L
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L
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A
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K
F
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--
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G
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M
Y
R
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A
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F
L
P
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G
N
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F
L
G
R
L
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L
V
K
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R
G
Y
R
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P
G
E
I
E
P
F
L
M
N
H
P
L
I
E
L
T
T
----
V
L
A
K
E
------
Q
A
D
G
R
--
K
Y
L
V
G
Y
Y
--
V
A
P
E
E
I
P
H
G
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L
R
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W
L
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N
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L
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M
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F
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A
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P
L
T
A
N
G
K
V
D
R
R
A
L
P
D
V
Q
A--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
39
HHSearch
56.93
19%
-60
- C1 -
4ZXJ
1
ENTF_ECOLI
A:
[2-1040]
---
L
P
L
V
A
A
Q
P
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L
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D
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------