@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 : jhp_0928: (2015-12-19 )
MERSSDEDLSHQDPSLFIESREQGGTRGVYRSSDQQAVSEESHRERDRIHEHVSRGDGVSARADARANSNGASSPASRMENGARSEEKGDNPSDERGIPQTPQSPSHQQNSSRDLGLSLSREQPGQTGRLRLFDHGQMGSLFPTDHENQRKRSDNELDRRSDKANENGDKSPRQNGSANQESARSERYGIAQGSSNQSVLLPAQSRLHHAGLSAQNGLRDLEENRDQEGRLLSNLDNLESLLNAIRNNTIASEPDFRSRLLEAIQNNDPLKDSIVGAQLLKDPTTKIFYDKFQLKISPKKVLEILENRLKKSIETTNETLNAFNVLDSQAIDLNAISNSVGLNPTQESKITDNSVELNNAQEQTAQEQTTQEQTTQEQTTQEQTTQEQTTQEQTTQEQTTQEQDTQENAPTTIKQETPITPAIPLNPKIDFKPSEEVLIKGAKTRYKANIKAIELLKELQAKQEILKGDYYATLKEQEILAQFSGWGGLESYFKKAQHPEEFKELNALLTKDEFRRAYLSARDAYYTPKLVIDSIYQGLDQLGFNNDNHPKEIFEPSLGTGKFIAHAPSDKNYRFIGTELDPISANLSKFLYPNQVIQNTALENYQFYQEYDAFVGNPPYGNHKIYSSNDKELSNESIHNYFLGKAIKELKDDGIGAFVVSSWFMDAKNPKMREHIAKNATFLGAIRLPNSVFKATGAEVTSDIVFFKKGVEKATNQSFTKAMPYYDKILNSLDDDTLFALQNNRFDSFIPSDQLKIVNAVANHFGFKQEKLQRWYEKIDTANFGYSTQDYKIIKDFIDKVGKNSINLNEQTLNEYFIHHPENILGHLSLEKTRYRFETNGEQIYKYDLQALEDESLDLSQALKQAIEKLPKDVYQYHKTTLKTDVLIIDSSNERYQEVQKLIKNLERRELVKWDNLYFQLEQNNEMGIFLKPTKINSKVQDSRLKAYFKIKDALNDLTSAELNPLSSDLELENKRAKLNLVYDEFVKKFGYLNENKNRKDIRQDLYGAKVLGLEKDFEKEITPRSAKMQNIEPRQAQAKKAQIFFERTLNPKKELIITNAKEALIASINQKGGLDLHFIRDHFTTQSLETTIKELLEQKLIYKDHKDNGGYILANDYLSGNVKRKLKEVKEAINQGVEGLEANVKDLELIIPKDLKATEIMANINSPWIPTQYLEEFLMELSANHYEKQYGDKMTDYQLSNLKEDIKIEHLSGAYEVFVRNNELNELYGIRHKDKPHSYKVPFESLLNKVLNNKDLSVKYAQVDPNDPKKEIFITDEEQSNLARQKAEELKEAFKDWIYKDYSRRTHLEQIYNDTFNNSVLKTYDGSQLELEGFNYHISLRPHQKNAIFRTIQDRAVCLDHQVGAGKTLCAIASCMEQKRMGLVNKTLIAVPNHLTKQWGDEFYKAYPNANVLVVDSKDTTEKERELLFNQIANNNYDAVVIAHTHLELLSNPRGIIEELKEEELVNAEKNFERQELAYKNNPRETKKPNERAFKNKLDKIRAKYDAILEKQGSHIDISQMGIDNLIVDEAHLFKNLAFETSMEKIAGLGNQQGSNRARDLFIKTRYLHQNDKKIMFLTGTPIANSLSEMYHLQRYLTPDVLKERGLEFFDDWAKTYGEVVNDFELDTSAQSYKMVNRFSKFSDVQGLSTMYRAFADIVSNDDILKHNPHFVPKVYGDKPINVVVKRSEEVAQFIGVALENGKYNEGSIIDRMQKCEGKKSQKGQDNILSCTTDARKVALDYRLIDPNAKVEKEFSKSYAMAKNIYENYLETHATKGTQLGFIGLSTPKTHSQKVSLEALDNAHETENKNPLDKAQELLESLSSYDEKGNLIAPSKKELENELKEKEAKSVNLDEEIAKGCSFDVYSDVLRHLVQMGIPQNEIAFIHDAKTEEQKQDLFKKLNRGGVRVLLGSPAKMGVGTNVQERLVAMHELDCPWRPDELLQMEGRGIRQGNILHQNDPENFRMKIYRYATEKTYDSRMWQIIETKSKGIEQFRNAHKLGLNELEDFNMGSSNASEMKAEATGNPLIIEEVKLRAEIKSEESKYKAFNKEHYFNEESLKNNASKLDYLKQELKDLETLQRSVIIPTHTEIKLYDLKNEESKDYELIKVKEVEPLKENASMSEELTHKKLKEQNKQIAEQNKEKLDAIKKQFASNLNTLFVNEEEDYKLLEYKGFVVNAYKTKYQVEFSLSPKDIPNIAYSLAIWFIKTILSTCLALIISALRSSLMGF
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
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MERSSDEDLSHQDPS
L
F
I
E
SREQGGTRGVYRSS
D
Q
Q
A
V
S
E
E
S
H
R
E
R
D
R
I
H
E
H
V
SRGDGVSARADARANSNGASS
P
A
S
R
M
ENGARSEEKGDNPSDERGIPQTPQSPSHQQNSSRDLGLSLSREQPGQTG
R
L
R
L
F
DHGQMGSLFPTDH
E
N
Q
RKRSDN
E
L
DRRSDKANENGDKSPRQNGSAN
Q
E
S
A
RSERYGIAQGSSN
Q
S
V
L
L
P
A
Q
S
R
L
H
HAGLS
A
Q
N
G
L
R
D
L
E
ENRDQE
G
R
L
L
S
N
L
D
N
L
E
S
L
L
N
A
I
RNNTIASE
P
D
F
R
S
R
L
L
E
A
I
QNNDPL
K
D
S
I
V
G
A
Q
LLKDPTT
K
I
F
Y
D
K
F
Q
L
K
I
S
P
K
K
V
L
E
I
L
E
N
R
L
K
K
S
I
E
T
T
N
E
T
L
N
A
F
NVLDSQA
I
D
L
NAISNSVGLNPTQESKITDNSVELN
N
A
Q
E
Q
T
A
Q
E
QT
T
Q
E
QT
T
Q
E
QT
T
Q
E
QT
T
Q
E
QT
T
Q
E
QT
T
Q
EQTTQEQDTQENAPTTIKQETPITPAIPLNPKIDFKPS
E
E
V
L
IKGAKTRYKA
N
I
K
A
I
E
L
L
K
E
L
Q
A
K
Q
E
I
L
KGD
Y
Y
A
T
L
K
E
Q
E
I
L
A
Q
FSGWG
G
L
E
S
Y
F
K
KAQ
H
P
E
E
F
K
E
L
N
A
L
L
T
K
D
E
F
R
R
A
Y
L
SARDAYY
T
P
K
L
V
I
D
S
I
Y
Q
G
L
D
-QLGFNNDN
H
P
K
E
I
FEPSLGTG
K
F
I
-----
A
HA----------PSD--K----------------
N
Y
----
R
F
IGTE-------LD
P
I
S
A
N
L
S
K
FLY------P
N
Q
V
I
Q
NT---AL
E
N
Y
Q
--
F
-----
Y
Q
E
Y
D
A
FVGNPPYG---------NHK---IYSSN--D--------K--------------ELS
N
----
E
--------
S
I
H
N
Y
F
L
G
K
A
I
K
E
L
K
-------DDGI
G
-------
A
F
V
V
--
S
S
W
FM-DAK---N-
P
K
M
R
E
H
I
AKN
A
T
F
L
G
A
IRL
P
N
S
V
F
KATGA
E
V
T
S
D
I
V
F
F
K
K
G
V
E
K
ATNQ
S
F
T
K
AM
P
Y
Y
D
K
I
----
L
N
SLD---DD
T
L
F
A
L
QNNRFDSFIP
S
D
Q
L
K
I
V
N
A
V
A
N
HFGF
K
Q
--
E
K
L
Q
R
W
Y
E
KIDTANFGYST
Q
--
D
Y
K
I
I
K
D
F
I
D
-
K
VGKNSI-----------NL
N
E
Q
T
L
N
E
Y
--
F
IH
H
P
E
N
I
L
---
G
H
LSLE
K
T
R
Y
R
F
ETNG----
E
Q
I
Y
K
Y
D
L
Q
ALEDESL
D
---
L
S
Q
A
L
K
Q
A
I
E
KL
P
K
D
V
Y
Q
Y
------
H
K
TTLK
T
D
V
L
I
IDSS
N
E
R
Y
Q
E
V
Q
K
L
I
K
N
L
E
R
R
E
L
V
--KWD
N
L
Y
F
Q
LEQNNE
M
G
I
F
L
KPTKIN
S
K
V
Q
D
S
R
L
K
A
Y
F
K
I
K
D
A
L
N
D
L
T
S
AELNPLSSDLE----LENKR
A
K
L
N
L
V
Y
D
E
F
V
K
K
FGYLNENK
N
R
K
D
I
R
Q
D
LYG
A
K
VLGLE
K
D
F
E
KEITPRSAKMQNIE
P
R
Q
AQ
A
K
K
A
Q
I
F
F
ERTLNPKK
E
L
I
I
TN
A
K
E
A
L
I
A
S
INQKGG
L
D
L
H
F
I
R
D
HF
T
T
Q
S
L
E
T
T
I
K
E
L
L
---
E
Q
K
L
I
YKDHKDNG
G
Y
I
L
ANDYLS--
G
N
V
K
R
K
L
K
E
V
K
E
A
I
N
Q
G
V
E
G
L
EANV
K
D
L
E
L
IIPK---DL
K
A
T
E
I
MANINSPWI
P
-
T
Q
Y
L
E
E
F
L
M
E
L
SA
N
H
Y
E
K
Q
YGDKMTD
Y
Q
L
S
N
L
K
E
D
I
K
I
EHLS---G
A
Y
---
E
V
F
V
RNNE
L
N
E
L
YGIRHKDKPHSYKV--
P
F
E
S
L
L
N
K
V
L----NNKD
L
S
V
K
Y
A
QVDPNDP--K
K
E
I
F
I
TD
E
E
Q
S
N
L
A
R
Q
K
A
E
E
L
K
E
A
F
K
D
W
I
Y
K
D
Y
SRR
T
H
L
E
Q
I
Y
N
DTFNN
S
V
L
K----TYD--G
S
Q
L
E
L
EG---
F
N
Y
H
I
S
LRPHQK
N
A
I
F
R
T
I
Q
---------
D
R
A
--
V
C
LDHQV----GA
G
K
T
L
C
A
I
A
---
S
C
M
E
Q
K
R
M
G-----LV
N
K
T
LIAV
P
-
N
H
L
T
K
Q
W
G
D
E
F
Y
K
AYPNA-
N
V
L
V
V----D-SKDT------
T
E
K
--
E
R
E
L
L
F
N
Q
I
-ANNNY
D
A
V
V
I
A
H
T
H
L
E
--
L
LSN
P
R
G
-------
I
I
E
E
L
K
E
E
E
L
V
N
A
EKNF
E
R
Q
E
L
AYKNNPRETKKP
N
E
R
A
F
K
N
K
L
D
K
I
R
A
K
Y
D
A
I
L
E
KQGS
H
I
D
I
S
QMGI--DNLIV
D
E
A
H
L
F
K
N
L
-------------
A
F
E
T
S
M
E
K
I
A
GLGNQ------QGSNRA
R
D
L
F
I
K
T
R
Y
LHQND
K
K
I
M
F
L
TGT
P
I
A
N
S
L
S
E
M
Y
H
L
Q
R
YL
T
P
D
V
L
K
E
R
G
L
E
F
F
-----
D
D
W
A
K
T
Y
G
E
V
V
N
D
FELDT
S
A
Q
S
Y
K
M
V
N
R
F
S
K
F
SDVQ
G
L
S
T
M
Y
R
A
F
A
D
I
VSNDDILKHNPHFVPKVYGDKP
I
N
V
V
V
K-R
S
E
E
V
A
Q
F
I
G
V
----
A
LENGKYNE
G
S
I
------
I
D
R
M
Q
K
CEGKKSQKGQD
N
I
L
S
CTTD
A
----
R
K
V
A
L
D
Y
R
LI----DPN
A
K
V
E
K
E
F
S
K
S
-------------
Y
A
M
A
K
N
I
Y
E
-
N
Y
L
E
T
HATK-------G
T
Q
L
G
F
I
GLSTPKTHS
Q
K
V
S
L
EALDNAHETENKNP
L
D
K
A
Q
E
L
L
E
S
L
S
SYDEKGNLIAP
S
K
K
E
L
E
N
E
L
K
E
K
EA--KSVN
L
D
E
E
I
A
KGCS
F
D
V
Y
S
D
V
L
R
H
L
V
Q-MGIPQN
E
-----
I
A
F
I
HDAK
T
E
E
Q
K
Q
D
L
F
K
K
L
NR-G--
G
V
R
V
L
LGSPAKMGVGT
N
V
Q
E
R
L
V
A
M
HELDCPWR
P
D
E
L
L
Q
MEGRGIRQGNILHQNDPEN
F
R
M
K
I
Y
R
Y
ATEK
T
Y
D
S
R
M
W
Q
I
I
E
T
K
S
K
G
I
E
Q
F
R
N
A
H
KLG
L
N
E
L
E
DFNMGSS
N
A
S
E
MKAEATGN
P
L
I
I
E
E
V
K
L
R
A
EIKS
E
E
S
K
Y
K
AFNKEHYF
N
E
E
S
L
KN
N
A
S
K
L
D
Y
L
K
Q
E
L
K
D
L
E
T
L
Q
R
SVIIPTH
T
E
I
K
L
Y
DLKNEESKD
Y
E
L
I
K
V
K
EVEP
L
K
ENA
S
M
S
E
E
L
T
H
K
K
L
K
E
Q
N
K
Q
I
A
E
Q
N
K
E
K
L
D
A
I
K
K
Q
F
A
SNL
N
T
L
F
VNEEED
Y
K
L
L
E
YK
G
F
V
V
N
A
Y
K
T
K
Y
Q
V
E
F
SLSPKD
I
P
N
I
A
Y
S
L
A
I
W
F
I
K
T
I
L
S
T
C
L
A
L
I
I
S
A
L
R
S
S
LMGF
56
Fugue
69.52
17%
16
* C4 *
2EYQ
5
MFD_ECOLI
A:
[5-1150]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
E
Q
Y
R
Y
T
L
P
V
K
A
G
E
Q
R
L
L
GE
L
T
G
A
A
---
C
A
T
L
V
A
E
I
A
E
R
H
A
G
P
V
V
L
I
A
P
D
M
Q
N
A
L
R
L
H
D
E
I
S
Q
F
T
D
Q
M
V
M
N
L
A
D
W
E
T
L
P
Y
D
S
F
S
P
--
H
Q
D
I
I
S
S
R
L
S
-
T
L
Y
Q
L
P
T
MQ
R
G
V
L
I
V
P
V
N
T
L
M
Q
R
V
C
P
H
S
--
F
L
H
G
H
A
L
V
M
K
KG
Q
R
L
S
R
D
A
L
R
T
Q
L
D
S
A
G
Y
R
H
V
D
Q
V
M
E
H
G
E
Y
A
T
R
G
A
L
L
D
---
L
F
P
M
G
S
E
L
P
Y
R
L
D
-----
F
------
F
D
D
E
I
D
S
-
L
R
V
F
D
V
D
S
Q
R
T
L
E
E
V
E
A
I
N
L
L
P
A
H
E
F
P
TD
K
A
A
I
E
L
F
R
S
Q
W
R
D
T
F
E
V
K
R
D
P
E
H
I
Y
Q
Q
V
S
K
G
T
L
P
A
G
--
I
E
Y
W
Q
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L
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F
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L
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Y
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AN
T
L
L
V
N
T
G
-
D
L
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S
A
E
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A
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A
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R
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L
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L
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L
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L
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N
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L
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A
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L
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---------------------
A
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L
A
L
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C
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---
D
L
L
G
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R
V
A
R
R
--------------------
R
Q
D
S
R
R
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I
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P
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L
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L
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V
--
P
V
S
S
L
H
L
-----------
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Y
A
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G
A
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A
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--
L
H
K
L
---
G
G
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A
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A
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A
A
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L
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Q
R
A
A
K
E
---
G
F
A
F
K
H
----------
D
--
R
E
Q
Y
Q
L
F
C
---
D
S
F
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F
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T
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D
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A
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A
I
N
A
V
L
S
---------
D
M
C
QP
L
A
M
D
R
L
V
C
G
D
V
G
F
G
K
T
E
V
A
M
R
---
A
A
F
L
A
V
D
N
H
-------
K
Q
V
A
V
L
V
P
T
T
L
L
A
Q
Q
H
Y
D
N
F
R
D
R
F
A
N
W
-
P
V
R
I
E
----
M
I
S
R
F
R
------
S
A
K
--
E
Q
T
Q
I
L
A
E
V
-
A
E
G
K
I
D
I
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K
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V
K
F
K
D
L
G
-------
L
L
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A
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-
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NDVE
N
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A
A
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A
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---
F
S
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M
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-
L
L
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N
A
V
D
A
L
K
A
GREP
S
L
E
D
L
T
S
Q
Q
T
E
V
------
E
L
R
M
P
S
L
L
P
D
D
F
I
P
D
V
N
T
R
L
S
F
Y
K
R
I
----
A
S
A
K
T
E
N
E
L
E
----
E
I
K
V
E
L
I
D
R
F
G
L
L
-------------
P
D
P
A
R
T
L
L
D
I
A
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L
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Q
A
Q
K
L
GIR
K
L
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P
A
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L
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L
L
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K
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R
I
E
W
V
R
Q
F
M
R
E
L
E
E
N
A
I
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
HHSearch
66.72
19%
-29
- C2 -
1Z63
2
?
A:
[30-477]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
P
---
Y
N
I
K
A
N
L
R
P
Y
Q
I
K
G
F
S
W
M
R
F
M
N
K
L
-----
G
F
G
--
I
C
L
A
D
D
M
----
G
L
G
K
T
L
Q
T
I
A
---
V
F
S
D
A
K
K
E
N
-----
E
L
T
P
S
L
V
I
C
P
-
L
S
V
L
K
N
W
E
E
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L
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A
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L
-
R
F
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----
H
-
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D
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S
------------------
K
I
-
K
L
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Y
D
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T
T
Y
A
V
L
L
--
R
D
------------------------------------------------------------------------
T
R
L
K
E
V
E
W
--
K
Y
I
V
I
D
E
A
Q
N
I
K
N
P
-------------
Q
----------------------
T
K
I
F
K
A
V
K
E
L
------
K
S
K
Y
R
I
A
L
T
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T
P
I
E
N
K
V
D
D
L
W
S
I
M
T
F
L
N
P
G
L
L
G
S
-----
Y
-----
S
E
F
K
S
K
F
A
T
P
I
K
K
G
D
----------------
N
M
A
K
E
E
L
K
A
I
I
S
P
F
I
L
R
R
T
K
Y
D
K
A
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--
N
D
L
P
D
K
I
---
E
T
N
V
Y
C
N
-
L
T
P
E
Q
A
A
M
Y
K
A
----
E
V
E
N
-------
L
------
F
N
N
I
D
S
V
T
G
---
I
K
R
K
G
M
I
L
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T
L
L
K
L
----
K
Q
I
V
D
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P
A
L
L
----
K
G
G
E
Q
---------------------------------------------------------------------------
S
V
R
R
S
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D
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F
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D
---------------------------
M
G
K
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N
I
I
E
K
E
L
N
T
E
V
--------
P
F
L
Y
G
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L
S
K
K
E
R
D
D
I
I
S
K
F
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N
N
P
--
S
V
K
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I
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L
S
V
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A
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-
F
G
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N
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A
-
N
R
V
I
H
F
D
R
W
W
N
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---
D
Q
A
T
D
R
V
Y
R
I
G
Q
T
--------
R
N
V
I
V
H
K
L
I
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V
G
T
L
E
E
K
I
D
Q
L
L
A
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K
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L
F
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D
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I
S
S
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S
W
I
T
E
L
S
T
E
E
L
R
K
V
I
E
L
S
V
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
53
Fugue
62.93
17%
17
- C2 -
2ADM
1
MTTA_THEAQ
A:
[21-413]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
E
T
P
P
E
V
V
D
F
M
V
S
L
A
E
-
A
------
P
R
G
G
R
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L
E
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A
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A
H
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P
F
L
-----
R
A
F
----------
R
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T
----------------
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----
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-------
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----------
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A
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---
D
F
L
L
W
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--
P
-----
G
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A
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L
I
L
G
N
P
P
Y
G
---------
I
V
G
---
V
F
K
A
V
--
K
--------
D
--------------
L
Y
K
K
----
A
F
STWKGKY
N
L
Y
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A
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L
E
K
A
V
R
L
L
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-------
P
G
G
V
L
-------
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--
P
A
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W
L
V
L
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---
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-
A
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A
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-
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Y
Y
L
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---
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K
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E
S
G
F
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I
----
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A
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L
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L
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H
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F
A
A
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--
P
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K
H
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A
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R
K
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P
G
P
G
L
V
P
V
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G
R
N
L
K
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G
W
V
D
Y
E
K
N
H
S
G
L
-----------
W
M
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K
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F
Y
A
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---
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---
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A
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R
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L
YRDFVP
H
L
T
L
R
M
L
E
R
L
P
V
R
R
E
Y
G
F
H
T
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
27
HHSearch
62.89
19%
-20
* C2 *
3DMQ
1
RAPA_ECOLI
A:
[91-638]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
E
S
G
V
A
L
R
E
V
F
L
D
S
K
L
V
F
S
K
P
Q
D
R
L
F
A
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Q
I
D
R
M
D
R
F
A
L
R
Y
R
A
R
K
Y
S
--
S
E
Q
F
R
M
P
Y
SGL
R
G
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R
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L
I
P
H
Q
L
N
I
A
H
D
V
G
R
RH-------
A
P
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--
V
L
L
A
D
E
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----
G
L
G
K
T
I
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A
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M
---
I
L
H
Q
Q
L
L
S
G
-----
A
A
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R
V
L
I
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P
-
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T
L
Q
H
Q
W
L
V
E
M
L
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R
F
N
-
L
-
R
F
A
L
F
----
D
-
D
E
R
Y
------
A
E
A
--
Q
-
H
D
A
Y
--
N
-
P
F
D
T
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Q
L
V
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C
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--
R
S
K
--------------------------------------------------------------------
Q
R
L
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L
C
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A
E
W
--
D
L
L
V
V
D
E
A
H
H
L
V
W
S
-------------
E
D
A
-------------------
P
S
R
E
Y
Q
A
----
I
E
Q
L
A
E
H
V
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V
L
L
L
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A
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--
F
A
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-----
V
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P
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A
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A
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A
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L
L
A
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N
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L
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N
------
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L
N
M
L
G
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M
I
G
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Q
D
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L
L
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A
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----
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---
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G
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------
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K
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-------
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---
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L
P
L
P
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Q
Y
----
Q
T
A
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----
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A
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---
K
S
A
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D
R
A
-------------
R
D
M
L
Y
-------
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---------------
R
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Y
Q
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F
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-------------
D
N
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W
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L
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L
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----
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L
V
I
C
A
K
A
---------------------------
A
T
A
L
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V
L
R
E
R
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G
I
R
--------
A
A
V
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S
I
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R
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A
A
A
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F
A
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A
--------
H
D
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Q
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P
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L
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A
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V
L
V
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W
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H
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Y
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A
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L
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A
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A
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A
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N
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L
A
A
Q
V
E
F
E
T
F
N
R
Q
L
N
A
V
N
R
24
HHSearch
61.19
16%
-12
- C2 -
1Z3I
8
?
X:
[53-552]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
K
V
L
R
P
H
Q
R
E
G
V
K
F
L
W
D
CVTGRRIEN
S
Y
G
--
C
I
M
A
D
E
M
----
G
L
G
K
T
L
Q
C
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---
L
I
W
T
L
L
K
Q
S
PDCKP
E
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K
V
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V
V
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P
-
S
S
L
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N
W
Y
N
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----
D
-
G
G
S
K
------
D
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DS
K
L
V
N
F
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Q
G
M
R
I
P
T
P
I
L
I
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S
Y
E
T
F
R
--
L
H
A
-----------------------------------------------------------------------
E
V
L
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K
V
--
G
L
V
I
C
D
E
G
H
R
L
K
N
S
-------------
D
N
Q
-------------------
T
Y
L
A
L
N
S
M
---------
N
A
Q
R
R
V
L
I
S
G
T
P
I
Q
N
D
L
L
E
Y
F
S
L
V
H
F
V
N
S
G
I
L
G
T
A
----------
Q
E
F
K
K
R
F
E
I
P
I
L
K
G
R
D
A
D
----
A
S
D
K
D
R
A
A
G
E
Q
K
L
Q
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L
I
S
I
V
N
R
C
L
I
R
R
T
S
D
I
L
S
K
Y
L
P
V
K
I
-------
E
Q
V
V
C
C
N
-
L
T
P
L
Q
K
E
L
Y
K
L
----
F
L
K
-----------------
Q
A
K
P
V
E
S
L
Q
T
G
K
I
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V
S
S
L
S
S
I
T
S
L
----
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K
L
C
N
H
P
A
L
I
----
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E
K
C
L
T
G
--
E
E
G
F
-------------
D
G
A
L
D
-----
L
--------------------
F
P
Q
N
Y
S
-------------
T
K
A
V
E
P
Q
L
S
G
K
M
L
V
L
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Y
I
L
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-
T
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V
V
L
V
S
N
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Q
---------------------------
T
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L
F
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K
L
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R
N
-
R
R
Y
L
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V
--------
R
L
D
G
T
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S
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A
K
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R
F
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N
-
P
SS
P
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F
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M
L
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A
R
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W
R
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G
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K
--------
K
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T
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R
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C
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P
P
D
D
S
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L
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W
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C
A
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R
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L
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P
V
L
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A
S
W
D
A
A
V
S
F
V
F
H
Q
R
S
H
E
D
Q
R
-------------------------------------------------------------------------------------------------------------------------------------------
52
Fugue
55.56
13%
28
- C2 -
1Z3I
10
?
X:
[1-644]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
----
G
L
R
R
A
G
V
R
K
A
L
H
D
P
F
E
D
--
G
A
L
V
L
Y
E
P
P
A
I
S
A
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L
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A
D
K
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K
L
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V
H
V
V
V
D
P
V
L
S
K
V
L
R
--------------------------
P
H
Q
R
E
G
---
V
K
F
L
W
D
C
V
T
G
R
R
I
E
-----
N
---------
S
Y
G
--
C
I
M
A
D
E
M
----
G
L
G
K
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L
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T
L
L
K
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G
K
W
L
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R
-
V
Q
P
V
A
IDGG
S
-
K
D
E
I
------
D
S
K
--
L
V
N
F
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S
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G
-
M
R
I
P
T
P
I
L
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S
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L
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F
K
K
R
F
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P
I
--
L
K
G
R
D
A
D
A
S
D
K
D
R
A
-------------
A
G
E
Q
K
L
Q
E
L
I
S
I
V
N
R
------
C
L
I
R
R
T
S
D
I
L
S
K
--
Y
L
P
V
K
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V
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C
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L
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L
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L
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L
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L
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K
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V
S
S
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L
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V
V
L
V
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Y
T
Q
T
L
D
L
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----
L
C
R
N
R
R
Y
L
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R
L
DGTMSI
K
K
R
A
K
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V
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R
F
N
N
P
S
S
P
E
F
I
F
M
L
S
S
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A
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L
N
L
I
G
A
N
R
L
V
MFDP
D
W
N
P
A
N
D
E
Q
A
M
A
R
VWRDGQKKTCYIY
R
L
L
S
T
G
T
I
E
-
E
K
I
L
Q
R
Q
A
H
-------
K
K
A
L
S
S
C
V
V
D
E
E
Q
D
V
E
R
H
F
S
L
G
E
L
R
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L
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S
L
N
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L
S
-
D
T
H
D
R
F
R
C
R
R
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N
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R
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R
P
P
P
D
D
S
D
C
T
C
D
L
S
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W
H
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D
K
R
G
L
R
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P
V
L
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D
A
A
V
S
F
V
F
H
Q
R
S
H
-
E
D
Q
R
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
39
HHSearch
54.40
20%
28
- C2 -
3UFB
-
?
A:
[193-415]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
G
D
S
G
E
F
Y
T
P
R
P
V
V
R
F
M
V
E
V
M
D
-
P
Q
------
L
G
E
S
V
L
D
P
A
C
G
T
G
G
F
L
-----
V
E
A
----------
F
E
H
--
L
E
R
Q
CKT
V
E
D
R
E
V
L
Q
--
E
S
----
S
I
F
G
G
E
-------
A
K
S
L
P
Y
L
L
V
Q
M
N
L
L
L
H
GL-
E
Y
P
R
I
D
P
E
---
N
S
L
R
F
P
--
L
REMGD
K
D
R
V
D
V
I
L
T
N
P
P
F
G
---------
G
E
E
---
E
K
G
I
L
G
N
F
--------
P
E-------------
D
M
Q
T
----
A
--------
E
T
A
M
L
F
L
Q
L
I
M
R
K
L
K
RPGHGSD
N
G
G
R
A
-------
A
V
V
V
--
P
N
G
T
L
-
F
S
D
G
I
-
S
-
A
R
I
K
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E
L
L
K
N
F
N
L
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T
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R
L
P
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G
V
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A
P
-
Y
T
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N
L
L
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R
S
G
P
T
D
D
I
W
Y
Y
Q
I
T
V
P
E
G
R
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K
----
Y
T
K
T
K
---
P
M
E
S
H
E
F
D
E
C
L
N
W
W
S
N
R
I
V
N
Q
N
A
W
K
E
S
A
S
E
I
I
K
Y
S
--
E
S
G
Q
L
I
D
V
N
L
D
R
K
N
P
N
S
L
E
V
--
L
E
H
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
44
HHSearch
52.30
17%
35
- C2 -
2F8L
7
?
A:
[103-308]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
Q
V
N
H
Q
M
T
P
D
S
I
G
F
I
V
A
Y
L
L
E
-
K
V
I
Q
K
--
K
K
N
V
S
I
L
D
P
A
C
G
T
A
N
L
L
-----
T
T
V
----------
I
N
Q
--
L
E
LKGDV----------
D
V
----
H
A
S
G
V
D
-------
V
D
D
L
L
I
S
L
A
L
V
G
A
D
L
Q
R--
Q
K
M
T
L
L
H
Q
---
D
G
L
A
N
L
--
L
-----
V
D
P
V
D
V
V
I
S
D
L
P
V
G
---------
Y
Y
P
---
D
D
E
N
A
--
K
--------
T
FELCR---------
E
E
G
H
----
S
--------
F
A
H
F
L
F
I
E
Q
G
M
R
Y
T
K
-------
P
G
G
Y
L
-------
F
F
L
V
--
P
D
A
M
F
-
G
T
S
---
D
F
A
K
V
D
K
F
I
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K
N
G
H
I
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G
I
I
K
L
P
E
T
L
F
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S
---
Q
A
R
K
S
I
L
I
L
E
K
A
D
V
D
V
K
P
P
K
E
V
L
L
A
N
L
S
S
L
T
----
D
P
S
V
T
---
A
P
I
L
A
E
I
E
N
W
F
K
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
59
Fugue
52.21
13%
19
- C3 -
4M59
3
?
A:
[6-714]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
P
D
A
-
Q
V
L
V
L
A
I
-----------
S
S
H
P
L
P
T
L
A
A
--
F
L
A
S
R
R
D
E
L
---
L
R
A
D
I
T
S
L
L
K
A
L
E
L
S
G
----
H
--
W
E
W
A
L
A
L
L
R
W
A
G
K
E
GAA
D
A
S
A
L
E
M
V
V
R
A
L
G
R
E
G
Q
H
D
------
A
V
C
A
L
L
D
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T
P
L
P
P
G
S
R
L
D
V
R
A
Y
T
T
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L
H
A
L
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R
A
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R
Y
--
E
R
A
L
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L
F
A
E
L
R
R
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V
A
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L
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T
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N
V
V
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D
V
Y
G
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M
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R
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W
P
R
I
V
A
L
L
D
E
M
R
A
A
G
V
E
P
D
G
F
T
A
S
----
T
V
I
A
A
C
S
R
D
G
L
V
D
E
A
V
A
F
F
E
D
L
K
A
R
G
H
A
P
S
V
V
T
Y
N
A
L
L
Q
V
F
G
K
A
G
N
Y
T
E
A
L
----
R
V
L
G
E
M
E
Q
N
G
C
Q
P
D
------
A
V
T
Y
N
---
E
L
A
G
T
E
E
A
A
R
C
L
D
T
M
A
S
P
N
A
F
T
Y
N
T
V
M
T
A
Y
G
N
V
G
K
V
D
E
A
L
A
L
F
---
D
Q
M
K
K
T
G
F
V
P
N
V
N
T
Y
N
L
V
L
G
M
L
G
K
K
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R
F
T
V
M
L
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M
L
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E
M
S
R
S
G
C
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R
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T
W
N
T
M
L
A
V
S
G
K
RG
M
E
D
Y
V
T
R
V
L
E
G
M
R
S
S
G
V
E
L
S
R
D
T
Y
N
T
L
I
A
A
Y
G
R
C
G
S
R
T
N
A
F
K
M
Y
N
-
E
M
T
S
A
G
F
T
P
C
I
T
T
Y
N
---
A
L
L
---
N
V
L
S
R
Q
G
D
W
S
T
A
Q
S
I
V
S
K
M
R
T
K
G
F
K
P
N
E
Q
S
Y
S
L
L
L
Q
C
Y
A
K
G
G
N
V
A
G
I
A
A
I
E
N
E
V
Y
G
S
G
A
VF
P
S
W
V
I
L
R
T
L
V
I
A
N
F
K
C
R
R
L
D
G
M
E
T
A
F
Q
E
V
K
A
R
G
Y
N
P
--------
D
L
V
I
F
N
S
M
L
S
----
I
Y
A
--
K
N
G
M
Y
S
K
A
---
T
E
V
F
D
S
I
K
R
S
G
L
S
P
D
L
I
T
Y
N
---------
S
L
M
--
D
M
Y
A
K
C
S
----
E
S
W
E
A
E
K
I
L
N
---
Q
L
K
C
S
Q
T
M
K
-----
P
D
V
V
S
Y
N
T
V
I
-
N
G
F
C
K
Q
G
L
--
V
K
E
A
Q
R
V
L
-
S
E
M
V
A
----
D
-
G
M
A
P
------
C
---------------
A
V
T
Y
H
T
L
V
G
G
Y
S
S
L
E
--
M
F
S
E
A
R
E
-------
V
I
G
Y
M
V
Q
H
G
L
K
P
M
E
L
T
Y
R
R
V
V
E
S
Y
C
R
A
F
E
E
A
R
G
F
L
S
E
--
V
K
A
L
E
A
Y
I
E
D
A
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
49
HHSearch
51.83
23%
22
- C2 -
2IH2
5
MTTA_THEAQ
A:
[21-214]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
E
T
P
P
E
V
V
D
F
M
V
S
L
A
E
-
A
P
------
R
G
G
R
V
L
E
P
A
C
A
H
G
P
F
L
-----
R
A
F
----------
R
E
A
--
H
GT--------------
A
Y
----
R
F
V
G
V
E
-------
I
D
P
K
A
L
D
L
P
P
W
----------
A
E
G
I
L
A
---
D
F
L
L
W
E
--
P
-----
G
E
A
F
D
L
I
L
G
N
P
P
Y
G
---------
I
V
G
---
E
A
S
K
Y
--
P
I
H
V
F
K
A
V
K
D
L
Y
K
K
A
F
ST------
W
K
G
K
----
Y
--------
N
L
Y
G
A
F
L
E
K
A
V
R
L
L
K
-------
P
G
G
V
L
-------
V
F
V
V
--
P
A
T
W
L
-
V
L
E
---
D
F
A
L
L
R
E
F
L
A
R
E
G
K
T
-
S
V
Y
Y
L
G
-
E
V
F
P
Q
--
K
K
V
S
A
V
V
I
R
F
Q
K
S
G
K
G
L
S
L
W
D
T
Q
E
S
E
S
G
F
T
P
I
----
L
W
A
E
Y
---
P
H
W
E
G
E
I
I
R
F
E
T
E
E
T
R
K
L
E
I
S
G
M
P
L
G
D
L
F
H
I
R
F
A
A
--
R
S
P
E
F
K
K
H
P
A
V
R
K
E
P
G
P
G
L
V
--
P
V
L
T
G
R
N
L
K
P
-
G
W
V
D
Y
E
K
-----------
N
H
S
G
L
W
M
P
K
E
--
R
A
K
E
L
R
D
F
Y
---
A
T
P
H
L
V
V
A
H
T
K
G
T
R
V
V
----
A
A
W
D
E
R
A
Y
P
W
R
E
E
F
H
L
L
---
P
K
E
G
V
R
L
D
P
S
S
L
V
Q
W
L
N
S
E
------
A
M
Q
K
H
V
R
T
L
Y
R
D
F
V
P
H
L
T
L
R
M
L
E
R
L
P
V
R
R
E
Y
G
F
H
T
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
51.21
22%
35
- C2 -
3UFB
-
?
A:
[199-412]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
F
Y
T
P
R
P
V
V
R
F
M
V
E
V
M
D
P
Q
L
G
-------
E
S
V
L
D
P
A
C
G
T
G
G
F
L
-----
V
E
A
F
E
H
L
E
R
Q
CKT
V
E
D
--
R
----------------
E
V
L
Q
E
S
S
I
F
G
G
E
AK
S
L
P
Y
L
L
V
Q
M
N
L
L
L
H
G
L
E
Y
------
P
R
I
D
P
E
N
S
LRF
P
L
R
E
M
G
--
D
-----
K
D
R
V
D
V
I
L
T
N
P
P
F
G
---------
G
E
E
E
K
G
I
L
G
N
F
--
P
--------
E
--------------
D
M
Q
T
----
A
--------
E
T
A
M
L
F
L
Q
L
I
M
R
K
L
K
-------
R
P
G
H
G
SDN
G
G
R
A
A
V
V
V
P
N
G
T
L
F
S
-
D
G
I
---
S
-
A
R
I
K
E
E
L
L
K
N
F
N
L
H
T
I
V
R
L
P
E
G
V
F
-
A
P
Y
T
D
I
A
G
N
L
L
F
F
D
R
S
G
P
T
D
D
I
W
Y
Y
Q
I
T
V
P
E
G
R
K
K
----
Y
T
K
T
K
---
P
M
E
S
H
E
F
D
E
C
L
N
W
W
S
N
R
I
V
N
Q
N
A
W
K
E
S
A
S
E
I
I
K
Y
S
--
E
S
G
Q
L
I
D
V
N
L
D
R
K
N
P
N
S
L
E
V
--
L
E
H
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
37
HHSearch
49.57
17%
34
- C2 -
3KHK
1
?
A:
[220-448]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
G
K
Q
G
G
Q
Y
Y
T
P
K
S
I
V
T
L
I
V
E
M
L
E
-
P
Y
-------
K
G
R
V
Y
D
P
A
M
G
S
G
G
F
F
-----
V
S
S
----------
D
K
F
--
I
E
K
H
ANVKHYN
A
S
E
Q
K
K
Q
I
----
S
V
Y
G
Q
E
-------
S
N
P
T
T
W
K
L
A
A
M
N
M
V
I
R
G
I
D
F
N
F
G
K
K
N
A
---
D
S
F
L
D
D
QH
P
-----
D
L
R
A
D
F
V
M
T
N
P
P
F
N
---------
M
K
D
---
W
W
H
E
K
--
L
--------
A
DDPRW
T
I
N
T
NKRIL
T
P
P
T
----
G
--------
N
A
N
F
A
W
M
L
H
M
L
Y
H
L
A
-------
P
T
G
S
M
-------
A
L
L
L
--
A
N
G
S
M
-
S
S
N
TNN
E
-
G
E
I
R
K
T
L
V
E
Q
D
L
V
E
C
M
V
A
L
P
G
Q
L
F
T
N
--
T
Q
I
P
A
C
I
W
F
L
T
K
D
K
N
A
K
N
G
K
R
D
R
R
G
Q
V
L
F
I
D
A
----
R
K
L
G
Y
---
M
K
D
R
V
L
R
D
F
K
D
E
D
I
Q
K
L
A
D
T
F
H
N
W
Q
Q
E
W
S
E
E
N
N
Q
A
--
G
F
C
F
S
A
D
L
A
L
I
R
K
N
D
F
V
L
T
P
--
G
R
Y
V
G
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
48.41
16%
100
- C2 -
1WP9
-
?
A:
[342-486]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
H
P
K
M
D
K
L
K
E
I
I
R
E
Q
L
Q
R
K
Q
N
S
K
I
I
V
F
T
N
Y
R
E
---------------------------
T
A
K
K
I
V
N
E
L
V
K
-
D
G
I
K
A
K
R
F
V
G
QA
S
K
-------
Q
R
E
Q
K
L
I
L
D
E
F
A
R
-
G
--
E
F
N
V
L
V
A
T
S
V
-
G
E
E
G
L
D
V
P
E
-
V
D
L
V
V
F
Y
E
P
V
P
S
A
I
R
S
I
Q
R
R
G
R
T
G
R
H
M
P
-----------
G
R
V
I
I
L
M
A
K
G
T
R
D
E
A
Y
Y
W
S
S
R
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
47.61
27%
97
- C2 -
2ADM
1
MTTA_THEAQ
A:
[43-183]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
E
P
A
C
A
H
G
P
F
L
R
A
F
R
E
A
H
G
---------------
T
----------------
G
Y
----
R
F
V
G
V
E
-------
I
D
P
K
A
L
D
L
P
P
--
W
------
A
E
G
I
L
A
D
F
---
L
L
--
W
E
--
P
-----
G
E
A
F
D
L
I
L
G
N
P
P
Y
G
IVG--------
V
---
F
K
A
V
K
--
D
L
Y
K
-----
K
--------------
A
F
S
T
WKGK
Y
--------
N
L
Y
G
A
F
L
E
K
A
V
R
L
L
K
-------
P
G
G
V
L
-------
V
F
V
V
P
-
A
T
W
L
V
-
L
E
D
---
F
-
A
L
L
R
E
F
L
A
R
E
G
K
T
S
V
Y
Y
L
G
E
V
F
P
Q
K
K
V
S
A
V
V
I
R
F
Q
K
S
G
K
G
L
S
L
W
D
T
Q
E
S
E
S
G
F
T
P
I
L
W
A
E
----
Y
P
H
W
E
---
G
E
I
I
R
F
E
T
E
E
T
R
K
L
E
I
S
G
M
P
L
G
D
L
F
H
I
R
F
A
A
R
S
P
E
--
F
K
K
H
P
A
V
R
K
E
P
G
P
G
L
V
P
V
L
T
--
G
R
N
L
K
P
G
W
V
D
-
Y
E
K
N
H
S
G
-----------
L
W
M
P
K
E
R
A
K
E
--
L
R
D
F
Y
A
T
P
H
---
L
V
V
A
H
T
K
G
T
R
V
V
A
A
W
D
----
E
R
A
Y
P
W
R
E
E
F
H
L
L
P
K
E
G
---
V
R
L
D
P
S
T
L
V
Q
W
L
N
S
E
A
M
Q
K
------
H
V
R
T
L
Y
R
D
F
V
P
H
L
T
L
R
M
L
E
R
L
P
V
R
R
E
Y
G
F
H
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
47.57
27%
97
- C2 -
1AQJ
1
MTTA_THEAQ
A:
[43-183]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
E
P
A
C
A
H
G
P
F
L
R
A
F
R
E
A
H
G
---------------
T
----------------
G
Y
----
R
F
V
G
V
E
-------
I
D
P
K
A
L
D
L
P
P
--
W
------
A
E
G
I
L
A
D
F
---
L
L
--
W
E
--
P
-----
G
E
A
F
D
L
I
L
G
N
P
P
Y
G
IV---------------
A
V
K
--
D
L
Y
K
-----
K
--------------
A
F
S
T
WKGK
Y
--------
N
L
Y
G
A
F
L
E
K
A
V
R
L
L
K
-------
P
G
G
V
L
-------
V
F
V
V
P
-
A
T
W
L
V
-
L
E
D
---
F
-
A
L
L
R
E
F
L
A
R
E
G
K
T
S
V
Y
Y
L
G
E
V
F
P
Q
K
K
V
S
A
V
V
I
R
F
Q
K
S
G
K
G
L
S
L
W
D
T
Q
E
S
E
S
G
F
T
P
I
L
W
A
E
----
Y
P
H
W
E
---
G
E
I
I
R
F
E
T
E
E
T
R
K
L
E
I
S
G
M
P
L
G
D
L
F
H
I
R
F
A
A
R
S
P
E
--
F
K
K
H
P
A
V
R
K
E
P
G
P
G
L
V
P
V
L
T
--
G
R
N
L
K
P
G
W
V
D
-
Y
E
K
N
H
S
G
-----------
L
W
M
P
K
E
R
A
K
E
--
L
R
D
F
Y
A
T
P
H
---
L
V
V
A
H
T
K
G
T
R
V
V
A
A
W
D
----
E
R
A
Y
P
W
R
E
E
F
H
L
L
P
K
E
G
---
V
R
L
D
P
S
S
L
V
Q
W
L
N
S
E
A
M
Q
K
------
H
V
R
T
L
Y
R
D
F
V
P
H
L
T
L
R
M
L
E
R
L
P
V
R
R
E
Y
G
F
H
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
47.21
27%
102
- C2 -
1AQI
1
MTTA_THEAQ
A:
[43-183]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
E
P
A
C
A
H
G
P
F
L
R
A
F
R
E
A
H
G
---------------
T
----------------
G
Y
----
R
F
V
G
V
E
-------
I
D
P
K
A
L
D
L
P
P
--
W
------
A
E
G
I
L
A
D
F
---
L
L
--
W
E
--
P
-----
G
E
A
F
D
L
I
L
G
N
P
P
Y
G
IV--------------
K
A
V
K
--
D
L
Y
K
-----
K
--------------
A
F
S
T
WKGK
Y
--------
N
L
Y
G
A
F
L
E
K
A
V
R
L
L
K
-------
P
G
G
V
L
-------
V
F
V
V
P
-
A
T
W
L
V
-
L
E
D
---
F
-
A
L
L
R
E
F
L
A
R
E
G
K
T
S
V
Y
Y
L
G
E
V
F
P
Q
K
K
V
S
A
V
V
I
R
F
Q
K
S
G
K
G
L
S
L
W
D
T
Q
E
S
E
S
G
F
T
P
I
L
W
A
E
----
Y
P
H
W
E
---
G
E
I
I
R
F
E
T
E
E
T
R
K
L
E
I
S
G
M
P
L
G
D
L
F
H
I
R
F
A
A
R
S
P
E
--
F
K
K
H
P
A
V
R
K
E
P
G
P
G
L
V
P
V
L
T
--
G
R
N
L
K
P
G
W
V
D
-
Y
E
K
N
H
S
G
-----------
L
W
M
P
K
E
R
A
K
E
--
L
R
D
F
Y
A
T
P
H
---
L
V
V
A
H
T
K
G
T
R
V
V
A
A
W
D
----
E
R
A
Y
P
W
R
E
E
F
H
L
L
P
K
E
G
---
V
R
L
D
P
S
T
L
V
Q
W
L
N
S
E
A
M
Q
K
------
H
V
R
T
L
Y
R
D
F
V
P
H
L
T
L
R
M
L
E
R
L
P
V
R
R
E
Y
G
F
H
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
46.90
27%
100
- C2 -
1G38
3
MTTA_THEAQ
A:
[23-163]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
E
P
A
C
A
H
G
P
F
L
R
A
F
R
E
A
H
G
---------------
T
----------------
G
Y
----
R
F
V
G
V
E
-------
I
D
P
K
A
L
D
L
P
P
--
W
------
A
E
G
I
L
A
D
F
---
L
L
--
W
E
--
P
-----
G
E
A
F
D
L
I
L
G
N
P
P
Y
G
I
V
GEASKYP
I
H
V
---
F
K
A
V
K
--
D
L
Y
K
-----
K
--------------
A
F
S
T
WKGK
Y
--------
N
L
Y
G
A
F
L
E
K
A
V
R
L
L
K
-------
P
G
G
V
L
-------
V
F
V
V
P
-
A
T
W
L
V
-
L
E
D
---
F
-
A
L
L
R
E
F
L
A
R
E
G
K
T
S
V
Y
Y
L
G
E
V
F
P
Q
K
K
V
S
A
V
V
I
R
F
Q
K
S
G
K
G
L
S
L
W
D
T
Q
E
S
E
S
G
F
T
P
I
L
W
A
E
----
Y
P
H
W
E
---
G
E
I
I
R
F
E
T
E
E
T
R
K
L
E
I
S
G
M
P
L
G
D
L
F
H
I
R
F
A
A
R
S
P
E
--
F
K
K
H
P
A
V
R
K
E
P
G
P
G
L
V
P
V
L
T
--
G
R
N
L
K
P
G
W
V
D
-
Y
E
K
N
H
S
G
-----------
L
W
M
P
K
E
R
A
K
E
--
L
R
D
F
Y
A
T
P
H
---
L
V
V
A
H
T
K
G
T
R
V
V
A
A
W
D
----
E
R
A
Y
P
W
R
E
E
F
H
L
L
P
K
E
G
---
V
R
L
D
P
S
S
L
V
Q
W
L
N
S
E
A
M
Q
K
------
H
V
R
T
L
Y
R
D
F
V
P
H
L
T
L
R
M
L
E
R
L
P
V
R
R
E
Y
G
F
H
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
46.64
27%
98
- C2 -
2IBS
3
MTTA_THEAQ
A:
[43-183]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
E
P
A
C
A
H
G
P
F
L
R
A
F
R
E
A
H
G
----------
T
A
---------------------
Y
----
R
F
V
G
V
E
-------
I
D
P
K
A
L
D
L
P
P
--
W
------
A
E
G
I
L
A
D
F
---
L
L
--
W
E
--
P
-----
G
E
A
F
D
L
I
L
G
N
P
P
Y
G
I
V
GEASKYP
I
H
V
---
F
K
A
V
K
--
D
L
Y
K
-----
K
--------------
A
F
S
T
WKGK
Y
--------
N
L
Y
G
A
F
L
E
K
A
V
R
L
L
K
-------
P
G
G
V
L
-------
V
F
V
V
P
-
A
T
W
L
V
-
L
E
D
---
F
-
A
L
L
R
E
F
L
A
R
E
G
K
T
S
V
Y
Y
L
G
E
V
F
P
Q
K
K
V
S
A
V
V
I
R
F
Q
K
S
G
K
G
L
S
L
W
D
T
Q
E
S
E
S
G
F
T
P
I
L
W
A
E
----
Y
P
H
W
E
---
G
E
I
I
R
F
E
T
E
E
T
R
K
L
E
I
S
G
M
P
L
G
D
L
F
H
I
R
F
A
A
R
S
P
E
--
F
K
K
H
P
A
V
R
K
E
P
G
P
G
L
V
P
V
L
T
--
G
R
N
L
K
P
G
W
V
D
-
Y
E
K
N
H
S
G
-----------
L
W
M
P
K
E
R
A
K
E
--
L
R
D
F
Y
A
T
P
H
---
L
V
V
A
H
T
K
G
T
R
V
V
A
A
W
D
----
E
R
A
Y
P
W
R
E
E
F
H
L
L
P
K
E
G
---
V
R
L
D
P
S
S
L
V
Q
W
L
N
S
E
A
M
Q
K
------
H
V
R
T
L
Y
R
D
F
V
P
H
L
T
L
R
M
L
E
R
L
P
V
R
R
E
Y
G
F
H
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
60
Fugue
46.59
18%
85
- C4 -
2FZ4
-
?
A:
[24-229]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
A
E
I
Y
Y
E
R
G
T
I
V
V
K
G
D
A
H
V
P
H
A
K
F
D
S
R
S
G
T
Y
R
A
L
A
F
R
Y
R
D
I
I
E
Y
F
E
S
N
G
I
E
----
F
V
D
NA
A
D
P
I
P
T
P
Y
---
F
D
A
E
I
S
L
R
D
Y
Q
E
K
A
L
E
R
W
L
V
---------
D
K
R
--
G
C
I
V
L
P
T
----
G
S
G
K
T
H
V
A
M
A
---
A
I
N
E
L
S
T
----------
P
T
L
I
V
V
P
T
L
A
L
A
E
Q
W
K
E
R
L
G
I
F
G
E
E
Y
-
V
G
E
F
S
----
G
-
R
I
K
E
L
K
P
L
T
V
S
T
Y
--
D
S
A
Y
V
N
A
E
K
-
L
G
N
R
F
M
L
L
I
F
D
E
V
H
H
L
--
P
A
E
S
Y
V
Q
-------
I
A
Q
M
S
I
A
P
F
R
L
G
L
T
A
T
F
E
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
46.26
27%
98
- C2 -
2IH2
5
MTTA_THEAQ
A:
[43-183]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
L
E
P
A
C
A
H
G
P
F
L
R
A
F
R
E
A
H
G
----------
T
A
---------------------
Y
----
R
F
V
G
V
E
-------
I
D
P
K
A
L
D
L
P
P
--
W
------
A
E
G
I
L
A
D
F
---
L
L
--
W
E
--
P
-----
G
E
A
F
D
L
I
L
G
N
P
P
Y
G
I
V
GEASKYP
I
H
V
---
F
K
A
V
K
--
D
L
Y
K
-----
K
--------------
A
F
S
T
WKGK
Y
--------
N
L
Y
G
A
F
L
E
K
A
V
R
L
L
K
-------
P
G
G
V
L
-------
V
F
V
V
P
-
A
T
W
L
V
-
L
E
D
---
F
-
A
L
L
R
E
F
L
A
R
E
G
K
T
S
V
Y
Y
L
G
E
V
F
P
Q
K
K
V
S
A
V
V
I
R
F
Q
K
S
G
K
G
L
S
L
W
D
T
Q
E
S
E
S
G
F
T
P
I
L
W
A
E
----
Y
P
H
W
E
---
G
E
I
I
R
F
E
T
E
E
T
R
K
L
E
I
S
G
M
P
L
G
D
L
F
H
I
R
F
A
A
R
S
P
E
--
F
K
K
H
P
A
V
R
K
E
P
G
P
G
L
V
P
V
L
T
--
G
R
N
L
K
P
G
W
V
D
-
Y
E
K
N
H
S
G
-----------
L
W
M
P
K
E
R
A
K
E
--
L
R
D
F
Y
A
T
P
H
---
L
V
V
A
H
T
K
G
T
R
V
V
A
A
W
D
----
E
R
A
Y
P
W
R
E
E
F
H
L
L
P
K
E
G
---
V
R
L
D
P
S
S
L
V
Q
W
L
N
S
E
A
M
Q
K
------
H
V
R
T
L
Y
R
D
F
V
P
H
L
T
L
R
M
L
E
R
L
P
V
R
R
E
Y
G
F
H
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------