@TOME V2.3
(Mar 2018)
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
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Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
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Structural Clustering:
Cluster Num
3D-Jury Struct. Score
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Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
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Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
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Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
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Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : S7UW66_TOXGG: (2017-06-15 )
MARFCGSPPPCSPKERPDDRPSPSSPPSLSSSAPLSLRASVSPASPSSRLSFPPISDLSYYSSRSPSSSSAFSSSSCASVALLIDEEEMASPFSHAGPASHPESPSRISAILRTLVRHGWLSRKTGMGVQQSEDASEKPQTEETHPAVSSLSPPTSSACGETQAAHTDGREQRRSLLGLATKSNAVPGVSECPSLCLYESPSDGASVSLSPPGEDGAPPVSSRLPAYSSSEGRRLRDLCDASVPRESPPAFPFYSTHPSLLVLPCGRLATDEELCFCHTAGYVSRVESVFPSLGSSLPRKAAKAGAAKGRGVPGEKEKKALHASLPDRFKKGRRWSSHNVDTDSKSTSCHSPCAASSADSSLSAQSSASSPSSRASLPRPSSPSVVSVSETPPSPFSRLNAASADSSSNAFDCHLSTHPRSLDGTQPALFPGSCGGEGNSGHPVSRSEALCEPETVASSELHAAPLAEVTRAPGTGFGGAAAAREEEKSEKREAVFPCSSPVSLSVLSTAPSTVASLEESSDARTACDAYAASLEAEPCAVTDAKPSAALPPALAVSSSCESHLSSEVTEELGNNGPASPALPQFVNLFGGDTFICPRTPHTARLAAGAALELCDLIYGSPTVERHKETRRKRQGLRRKESKGERHAERHRERQQQGGRQERHLEGDDEELKAREGETEARLASGVSDEGGRGACSGVCDGRDKQDSEREDDTPAATEEHGGEDRRDDTPAATEEHGGEDRRDDTPAATEEHGGEDRRDGPNEQRQENKVKRGFAIIRPPGHHACSHEAAGFCIYNNVALAANYLLAKHGLSRVAILDWDVHHGNGTQDLFYNSSSVLYLSVHRFEKAKPVSASHGEALHASPSPGAGAAGPSPESPRASDSPAASGAAFYPGTGSLTETGVSVGRGYTINVPLSRGYTDGDMFWVFCGVIAPALTAFRPQAILVSAGFDAAAGDPLGGCLLSPALFAWMTRQVCRLADIHCEGKALFFLEGGYQGDVLGACVEACVAALVNLSEENKPEERHRPKETADNAEDAGKGEEKLVKRRESPRGARDRGRDCVDQTVQLCQKERRSRDENEAACSRSLLSGRLGETLARLDSGILQGVEEGVELPSTEGPSACGSPPSISLPASLRVHANPPGWPPFRVLSPSSASFPSPASPLSSYALPRLLEEPVAAFCPKCRHRVRKRTSLSATSSAGEALSRGASRRASACNSDLSFFVEKRKEPKFVPEPFPPAERWVVIPPSAVDVAMRDAGDVARWAPTATAETPRRKKGRGDRKKKGEKGRSEARKSGSRNANCEERDSHEDVALRLQGIASEVETETGRATPVSVSESCLSPCSNGLLPAFPADSARFGSTLRIPCPTVRSPGALSQGHGLPAVCPQFGSRPSSPSTVLSLSPLCKVWASSPASRPTEVSSACGPLSDEVTSLCSGFRLDAIEEGSQEMTNSQLPQVLGALSASSLAATPGPQCPTSPALVCAACGVPLETAETAFPSSCPASPTLSFSSFSAAASPASFVARPRSGSVSDRVRVGKTQNDGGRQLQKSVVCRQATYDTLRLVRRVHAGSPFFLPPLPPLPKTVKTKSVEAAREQTDGDAETAEQVSLCLREGGDFRDQATDQQSLARAQPPYSAGDGTETRHSTHGVRGSRASAAPEPRPKTPDLSATPSIASPLTSSCSGLSSSGPPHTSTTPCGSTSSFSSSLSVSASLLPASRTLANVLPAGLLSHVRGRIVGGRARGAREESEAALQRNETIEQGQLVKLCNWGEAAFYTWVQMHSKKGEPEETDSGEDVTVTLQALETLFGRLHRPGKNSGENSGELQRKSKDENPTGSETLVVHTTRMPRQEAVPSAVLSFDPQQVLDLLRIQPDGVAISEPPSASSVASDALSPSSVSSDVATELAKFMPRCHRVFWTHAWALAEPPSTRKTNCEGGRKRCHGDEGRGEKEGESRLPRSPTEPRDASVADVDRRSRSALNSSQQSVPQGSSGEASRSSSSSASSSSCLGSSGPESRGAPLAFPASSACGSRFACAVALADLAQFVRPCVMDIKMGIQMYDPSCTDAGKIQRMQEKARGRSVGSHGFFICGVSAGAVDSGTARVSEEISTEAGKSKVLESETTEDLCGGSEACDECNRGAEQDAGQVAASSLRPFVLSSQEAYAVTQDEAFLRVFTNFFCVNDSTELAARLIRKCLGKLATLQRFFEHQKQVSFYGSSLLFVFDADPAPDRLPVLRDSSDGPPALSVRRTQYAGTTQTQRPPVLQQNDRRGGGNAERRRDAHRAADVECAECGRKREAVYDAIVESFGVYMVDFAHVNFSRKQHDRGYLFGLANLQRLFARVLHSLGSSPSPAIAEAAVVSEEETRANSSGSGEKKNEAEPKHDREGRP
Atome Classification :
(75 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
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MARFCGSPPPCSPKERPDDRPSPSSPPSLSSSA
P
L
S
L
R
A
SVSPASPSSRLSFPPIS
D
L
S
Y
YSSRSPSSSSAFSSSSC
A
S
V
A
L
L
I
D
E
E
E
MASPFSHAGPASHPES
P
S
R
I
S
A
I
L
R
T
L
V
RHGWLSRKTGMGVQQSEDASEKPQTEETHPAVSSLSPPTSSACGETQAAHTD
G
R
E
Q
R
R
S
L
LGLATKSNAVPG
V
S
ECPS
L
C
L
YESPSDG
A
S
V
SLSPPGEDGAPPVSSRLPAYSSSEG
R
R
L
R
D
L
CDAS---VPRESPPAFPFYSTH--P
S
L
L
V
L
PCGRLATDE
E
L
C
F
C
HT
A
G
Y
V
S
R
V
E
S
V
F
P
S
L
G
S
S
L
P
R
K
A
A
KAGAAKGRGV---PG
E
K
E
K
K
A
L
H-ASL
P
D
R
F
K
KGRRWSSHNVDTDSKSTSCHSPCAASSADSSLSAQSSASSPSSRASLPRPSSP
S
V
V
S
VSETPPS
P
F
S
RLNAASADSSS
N
A
F
D
C
H------LSTHPRSLDGTQPALFPGSCGGEGNSGHPVSRSEALCEPETVASSELHAA
P
L
A
E
V
TRAPGTGFGGAA--AA
R
E
E
E
K
S
EKREAVFPCSSP
V
S
L
S
V
LSTAP
S
T
V
A
------
S
L
EESSDA
R
T
A
C
D
A
Y
A
A
SLEA---EPCAVTDAKPSAALPP
A
L
A
V
S
S
S
C
E
S
---
H
L
S
S
E
V
T
E
E
LGNNGPAS
P
A
L
P
Q
F
---
V
N
L
FGG
D
T
F
IC--PRTP
H
T
A
R
LAA
G
A
A
L
E
L
C
D
L
IYGSP
T
V
E
R
H
K
E
T
R
R
K
R
Q
GLR---RKESK
G
E
R
---
H
A
E
R
H
R
E
R
Q
Q
QGGR-QERHLEG
D
D
E
E
L
K
A----REGE
T
E
A
R
L
ASGVSDEGGRGACSGVCDGRDKQDSEREDDTPAA
T
E
EHGGEDRRDDTPAA
T
E
EHGGEDRRDDTPAA
T
E
EHGGEDRRDGP
N
E
Q
R
Q
E
N
K
V
KR
G
F
A
IIRPPGHHACSHEAA
G
F
C
I
YN
N
V
A
L
A
A
N
Y
L
--
L
A
K-HG--L
S
-
R
V
A
I
L
D
W
D
VHHGNGT
Q
D
L
F
YNSS
S
V
L
Y
L
S
V
HRFEKAKPVSASHGEALHASPSPGAGAAGPSPESPRASDSPAASGAAFYPGT--G--S--LT--ETGVSVGR
G
Y
T
I
N
V
PLS-R-G-YT----DG
D
M
F
W
V
F
C
G
V
I
A
P
A
L
---
T
AFRP
Q
A
I
L
V
SAGFDAAAGD--PL
G
G
C
L
L
S
P
A
L
F
A
W
M
T
R
Q
V
C
R
L
ADIHCE
G
K
A
L
F
-
F
L
EGGY--QG
D
V
L
G
A
C
V
E
A
C
V
A
A
L
V
N
-----LSEENKPEE--RHRPKETADNAEDAGK
G
E
E
--
K
L
---------
V
K
R
-RESPRGARDR
G
R
D
C
V
D
Q
T
V
Q
L
C
Q
K
E
RRSRDE
N
--
E
A
A
C
S
R
S
L
L
S
G
R
L
G
E
T
L
A
R
L
D
S
G
I
L
Q
G
V
E
EGVELPS-TEGPSACGSPPSISL
P
--
A
S
L
R
V
HANPPGWPP
F
R
V
LSPSSASFPSPAS
P
L
S
S
Y
A
L
P
R
L
L
E
E
P
V
A
A
F
C
P
K
C
R
H
R
V
R
K
RTSLSATSS
A
G
E
A
L
S
R
G
A
S
R
R
A
S
ACN
S
D
L
S
F
F
V
E
--------KRKEPKFVPEPFPPAE
R
W
V
V
IPP
S
A
V
----
D
V
A
M
RDAGDVARWAPTATAETPRRKKGRGDRKKKGEK
G
R
S
E
A
R
KSGSRNANCEERDSH
E
D
V
A
L
R
L
Q
G
I
A
S
E
V
ETETGRATPV
S
V
S
E
S
C
L
S
P
C
SNGLLPAFPADSARFG
S
T
L
RIPCPTVRSPGALSQGHGLP
A
V
C
P
QFGSRPSSP
S
T
V
L
S
L
S
P
L
C
K
V
W
ASSPASRPT
E
V
SSACGP
L
S
D
E
V
T
S
L
C
SGFRL
D
A
I
EE
G
S
Q
EM
T
N
S
Q
L
P
Q
V
L
G
A
L
S
A
S
SLAATPGPQCPTSP
A
L
V
C
AACGVPLETAETAFPSSCPASP
T
L
SFSSFSAAAS
P
A
S
FVARPRSGSVSD
R
V
R
VGKTQND
G
G
R
Q
L
Q
K
S
V
V
C
R
QA
T
Y
D
T
L
R
L
V
R
R
V
HAGSPFFLPPLPPLPKTVKTK
S
V
E
A
A
REQTDG
D
A
E
T
A
E
Q
V
S
L
C
L
REGGDFRDQAT
D
Q
Q
S
L
A
RAQPPYSAGDGTETRHSTHGVRGSRASAAPEPRPKTPDLSATPSIAS
P
L
T
S
S
CSGLSSSGPPHTSTTPCGSTSSFSSSL
S
V
S
A
SLL
P
A
S
R
T
L
A
N
V
L
P
A
G
L
L
S
H
V
R
G
RIVGGRARGAR
E
E
S
E
A
A
L
QRNETIEQG
Q
L
V
K
LCNWG
E
A
A
F
Y
T
W
V
Q
M
HSKKGEPEETDSGE
D
V
T
V
T
L
Q
A
L
E
T
L
F
G
R
LHRPGKNSGENS
G
E
L
QRKSKDENPTGS
E
T
L
V
V
H
TTRM
P
R
Q
E
AV
P
S
A
V
LSF
D
P
Q
Q
V
L
D
L
L
RIQPDGVAISEPPSA
S
S
V
A
SDALSPSSV
S
S
D
V
A
T
E
L
A
K
F
M
P
R
C
H
R
V
F
W
THAWALAEPPSTRKTNCEGGRKRCHGDEGRGEKEGESRLPRSPTEPRDA
S
V
A
D
V
D
R
R
S
R
S
ALN
S
S
Q
QSVPQGSSGEASRSSSSSASSSSCLGSSGPESRGAPLAFPASSACGS
R
F
A
C
A
V
A
L
A
D
L
A
Q
F
V
R
P
C
V
M
D
I
K
M
G
I
Q
MYDPSCT
D
A
G
K
I
Q
R
M
Q
E
K
ARGRSVGSH
G
F
F
I
CGVSAGAVDSG
T
A
R
V
S
E
E
ISTEAGKSKVLESET
T
E
D
LCGG
S
E
A
C
D
E
C
NRGAEQ
D
A
G
Q
V
A
A
S
SLR
P
F
V
LSSQE
A
Y
A
VT
Q
D
E
A
F
L
R
V
F
T
N
F
F
CVND
S
T
E
L
A
A
R
L
I
R
K
C
L
G
K
L
A
T
L
Q
R
F
F
E
H
Q
K
Q
V
S
FYG
S
S
L
L
F
V
FDADPAPDRLPVLRDSSDGPPA
L
S
V
R
R
T
QYAGTTQTQRPPVLQQNDRRGGG
N
A
E
R
R
R
D
A
H
RAADV
E
C
A
E
CG
R
K
R
E
A
V
Y
D
A
I
V
E
S
FG
V
Y
M
V
D
F
A
HVNFSRKQHDR
G
Y
L
F
G
L
A
N
L
Q
R
L
F
A
R
V
L
H
S
LGSSPS
P
A
I
A
E
A
AVVS
E
E
E
TRANSSGSGEKKNEAEPKHDREGRP
173
Fugue
55.90
28%
-60
- C2 -
-
1ZZ1
5
HDAH_ALCSD
A:
[2-368]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
A
I
G
Y
V
---
W
N
T
L
Y
G
W
V
---
D
T
G
T
G
S
L
A
A
A
N
L
T
A
-
R
M
Q
P
I
S
H
H
L
A
H
P
D
T
----
K
R
R
F
H
E
L
V
C
A
S
G
Q
I
E
H
L
T
P
I
A
A
V
A
A
T
D
A
D
I
L
R
A
H
S
A
A
H
L
E
N
M
K
R
V
S
N
L
P
T
G
G
D
T
G
D
G
I
T
M
M
G
N
G
G
L
E
I
A
R
L
S
A
G
G
A
V
E
L
T
R
R
V
A
---------
T
G
E
L
S
A
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
H
L
C
------------------------------------------
F
P
P
D
S
--
G
--
Y
--
S
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
Y
H
--
E
F
L
A
G
M
G
G
N
T
L
L
D
A
E
R
A
A
I
--
E
E
---------
I
V
P
-
L
L
A
D
I
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
179
Fugue
55.30
24%
2
- C2 -
-
5IKK
12
CLR3_SCHPO
A:
[24-650]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
K
K
---
S
G
L
C
Y
D
P
R
M
R
F
H
A
T
-
L
S
E
H
P
E
D
P
R
R
V
L
R
V
----
F
E
A
I
K
K
A
G
Y
V
S
N
V
P
S
P
------
S
D
V
F
L
R
I
P
A
R
E
A
T
L
E
E
L
L
Q
V
H
S
Q
E
M
Y
D
K
M
S
H
E
D
L
A
N
L
E
K
I
S
D
S
L
Y
Y
N
N
E
S
A
F
C
A
R
L
A
C
G
S
A
I
E
T
C
T
A
V
V
--
T
G
Q
V
K
N
A
F
A
V
V
R
P
P
G
H
H
A
---------
L
F
N
N
V
S
V
T
A
R
S
M
--
L
Q
R
-
F
P
DK
I
K
-
R
V
L
I
V
D
W
D
I
H
H
G
N
G
T
Q
M
A
F
Y
D
D
P
N
V
L
Y
V
S
L
H
R
Y
E
N
G
R
----------------------------------------
F
Y
P
G
T
NY
G
--
C
--
A
E
--
N
C
G
E
G
P
G
L
G
R
T
V
N
I
P
W
S
C
A
-
G
-
M
G
----
D
G
D
Y
I
Y
A
F
Q
R
V
V
M
P
V
A
---
Y
E
F
D
P
D
L
V
I
V
S
C
G
F
D
A
A
A
G
D
--
H
I
G
Q
F
L
L
T
P
A
A
Y
A
H
M
T
Q
M
L
M
G
L
A
D
----
G
K
V
F
I
-
S
L
E
G
G
Y
--
N
L
D
S
I
S
T
S
A
L
A
V
A
Q
S
L
L
G
-----
I
P
P
G
R
L
H
T
T
--
Y
A
C
P
Q
A
V
A
T
I
N
H
V
T
K
I
Q
S
Q
YW
R
C
---------
M
R
P
-
K
H
F
D
A
N
P
K
D
A
H
V
D
R
L
H
D
V
I
R
T
Y
Q
A
K
K
L
F
E
D
W
K
I
T
N
M
P
I
L
R
D
N
N
Q
V
L
C
S
S
N
F
F
Q
K
D
N
L
L
V
I
V
H
E
S
P
R
V
L
G
N
G
T
S
E
T
N
V
L
N
L
N
D
S
L
L
V
D
P
V
S
L
Y
V
E
W
A
M
Q
Q
D
W
G
L
I
D
I
N
I
P
E
V
-
D
I
L
S
E
V
K
E
L
C
L
Y
V
W
D
N
Y
V
E
L
S
I
S
-----------
K
N
I
F
F
I
G
G
G
K
A
V
H
G
L
V
N
L
A
S
S
R
N
V
S
D
R
V
K
C
M
V
N
F
L
GTE
P
L
V
G
L
K
T
A
S
E
E
D
L
P
T
W
Y
Y
R
H
S
L
V
F
V
S
S
S
N
E
C
WKKA
K
R
A
K
R
R
Y
G
R
L
M
Q
S
E
H
T
E
T
S
D
M
M
E
Q
H
Y
R
A
V
T
Q
Y
L
L
H
L
L
Q
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
75
PsiBlast_CBE
54.10
36%
-122
- C4 -
-
1ZZ0
4
HDAH_ALCSD
D:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
73
PsiBlast_CBE
54.09
36%
-126
- C4 -
-
1ZZ1
4
HDAH_ALCSD
B:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
178
Fugue
54.04
27%
21
- C2 -
-
5G0J
9
?
A:
[17-772]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
V
Q
G
K
S
K
A
T
G
T
G
L
V
Y
V
D
A
F
T
R
F
H
C
L
W
D
A
S
HPE
C
P
A
R
V
S
T
V
M
E
M
L
E
T
E
GL
L
G
R
C
V
Q
V
E
A
R
A
V
T
E
D
E
L
L
L
V
H
T
K
E
Y
V
E
L
M
K
S
T
Q
N
-----
M
T
E
E
E
L
K
T
L
A
E
K
Y
D
S
V
Y
L
H
P
G
F
F
S
S
A
C
L
S
V
G
S
V
L
Q
L
V
D
K
V
M
T
S
Q
L
R
N
G
F
S
I
N
R
P
P
G
H
H
----
A
Q
A
D
K
M
N
G
F
C
M
F
N
N
L
A
I
A
A
R
Y
A
Q
K
R
H
R
V
Q
R
V
L
I
V
D
W
D
V
H
H
G
Q
G
I
Q
Y
I
F
E
E
D
P
S
V
L
Y
F
S
V
H
R
Y
EDGS
F
W
P
H
L
K
E
S
D
S
S
S
V
----
G
S
G
A
G
Q
G
Y
N
I
N
L
P
W
N
K
V
G
M
E
S
G
D
Y
I
T
A
F
Q
Q
L
L
L
P
V
A
Y
E
F
Q
-
P
Q
L
V
L
V
A
A
G
FD
A
V
I
G
D
P
K
G
G
M
Q
------
V
S
P
E
C
F
S
I
L
T
H
M
L
K
G
V
A
Q
GR
L
V
L
A
L
E
G
G
Y
N
L
Q
S
T
A
E
G
V
C
A
S
M
R
S
L
L
G
D
P
C
P
H
L
P
S
S
G
A
P
C
E
S
A
L
K
S
I
S
K
T
I
S
D
L
YP
F
W
K
S
L
Q
T
F
E
G
G
P
L
S
E
V
S
P
L
P
A
P
V
C
A
E
V
K
V
S
S
P
I
T
G
L
V
Y
D
Q
R
M
M
L
H
H
N
M
W
D
S
H
H
P
E
L
P
Q
R
I
--
S
R
I
F
S
R
H
E
E
L
R
L
L
S
R
C
H
R
I
P
A
R
L
A
T
E
E
E
L
A
L
C
H
S
S
K
H
I
S
I
I
K
S
S
E
H
M
K
P
R
D
L
N
R
L
G
D
E
Y
N
S
I
F
I
S
N
E
S
Y
T
C
A
L
L
A
A
G
S
C
F
N
S
A
Q
A
I
L
T
G
-----------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
--
Q
S
I
-
T
R
--
E
S
L
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
----------------------------------------
D
G
A
F
F
P
N
S
--
E
--
D
--
A
N
YD
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
K
M
G
----
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
A
----
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
G
---------
D
S
P
P
S
--
L
D
H
L
T
P
L
K
T
S
A
T
V
S
I
N
N
V
L
--
R
A
H
APFWSSLR
V
N
I
-
P
E
S
L
R
L
S
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
61
PsiBlast_CBE
53.88
36%
-124
- C4 -
-
2VCG
5
HDAH_ALCSD
B:
[139-343]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
66
PsiBlast_CBE
53.80
36%
-126
- C4 -
-
2GH6
4
HDAH_ALCSD
A:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
67
PsiBlast_CBE
53.72
36%
-124
- C4 -
-
1ZZ3
4
HDAH_ALCSD
D:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
77
PsiBlast_CBE
53.71
36%
-124
- C4 -
-
1ZZ0
4
HDAH_ALCSD
B:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
60
PsiBlast_CBE
53.43
36%
-122
- C4 -
-
2VCG
7
HDAH_ALCSD
C:
[139-343]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
78
PsiBlast_CBE
53.21
36%
-128
- C4 -
-
1ZZ0
4
HDAH_ALCSD
A:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
157
HHSearch
53.12
40%
-119
- C4 -
-
5JI5
4
?
A:
[97-314]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
H
T
W
T
A
A
L
R
A
A
G
A
A
---
V
A
A
T
D
A
V
I
E
G
R
Y
D
N
A
F
C
S
V
R
P
P
G
H
H
A
E
P
A
R
A
M
G
F
C
F
F
N
N
V
A
I
A
A
R
H
A
--
L
E
V
-
H
K
--
L
E
-
R
V
A
I
I
D
F
D
V
H
H
G
N
G
T
E
A
A
F
S
N
D
A
R
V
L
M
C
S
I
F
Q
H
-------------------------------------------
P
F
Y
P
F
T
--
G
--
A
--
D
N
--------
Q
A
P
N
M
C
N
V
P
I
A
-
A
-
R
-
S
K
----
G
M
V
V
R
E
A
I
D
M
I
W
L
P
R
L
---
D
A
F
K
P
Q
M
L
F
V
S
A
G
F
D
A
H
R
E
D
--
D
L
G
N
M
A
L
V
E
D
D
Y
A
W
I
T
Q
Q
I
R
L
V
A
D
K
Y
A
K
G
R
I
V
S
-
C
L
E
G
G
Y
--
N
L
S
A
L
G
R
S
V
V
A
H
V
R
A
L
A
D
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
70
PsiBlast_CBE
53.11
36%
-122
- C4 -
-
1ZZ3
4
HDAH_ALCSD
A:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
68
PsiBlast_CBE
52.98
36%
-123
- C4 -
-
1ZZ3
4
HDAH_ALCSD
C:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
71
PsiBlast_CBE
52.91
36%
-126
- C4 -
-
1ZZ1
4
HDAH_ALCSD
D:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
63
PsiBlast_CBE
52.91
36%
-124
- C4 -
-
2GH6
4
HDAH_ALCSD
D:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
64
PsiBlast_CBE
52.76
36%
-124
- C4 -
-
2GH6
4
HDAH_ALCSD
C:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
59
PsiBlast_CBE
52.56
36%
-126
- C4 -
-
2VCG
7
HDAH_ALCSD
D:
[139-343]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
74
PsiBlast_CBE
52.51
36%
-124
- C4 -
-
1ZZ1
4
HDAH_ALCSD
A:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
72
PsiBlast_CBE
52.47
36%
-125
- C4 -
-
1ZZ1
4
HDAH_ALCSD
C:
[133-337]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
Y
A
L
V
N
P
P
G
H
H
A
P
H
N
A
A
M
G
F
C
I
F
N
N
T
S
V
A
A
G
Y
A
--
R
A
V
-
L
G
--
M
E
-
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
I
W
W
N
D
P
S
V
L
T
I
S
L
H
Q
---------------
H
L
C
F
P
P
D
S
G
Y
S
---------------------------------
T
--
E
R
G
A
G
N
G
H
G
Y
N
I
N
V
P
L
P
-
P
-
G
-
S
G
----
N
A
A
Y
L
H
A
M
D
Q
V
V
L
P
A
L
---
R
A
Y
R
P
Q
L
I
I
V
G
S
G
F
D
A
S
M
L
D
--
P
L
A
R
M
M
V
T
A
D
G
F
R
Q
M
A
R
R
T
I
D
C
A
A
D
I
C
D
G
R
I
V
F
-
V
Q
E
G
G
Y
--
S
P
H
Y
L
P
F
C
G
L
A
V
I
E
E
L
T
G
-----
V
R
S
L
P
D
P
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
154
HHSearch
52.31
36%
-50
- C4 -
-
5G0G
8
?
A:
[118-379]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
F
F
S
S
A
C
L
S
V
G
S
V
---
L
Q
L
V
D
K
V
M
T
S
Q
L
R
N
G
F
S
I
N
R
P
P
G
H
H
A
Q
A
D
K
M
N
G
F
C
M
F
N
N
L
A
I
A
A
R
Y
A
--
Q
K
R
-
H
R
--
V
Q
-
R
V
L
I
V
D
W
D
V
H
H
G
Q
G
I
Q
Y
I
F
E
E
D
P
S
V
L
Y
F
S
V
H
R
Y
E
D
---------------------------------------
G
-
S
F
W
P
H
L
--
K
ES
D
--
S
S
--
S
V
G
S
G
A
G
Q
G
Y
N
I
N
L
P
W
N
K
V
-
G
-
M
E
----
S
G
D
Y
I
T
A
F
Q
Q
L
L
L
P
V
A
---
Y
E
F
Q
P
Q
L
V
L
V
A
A
G
F
D
A
V
I
G
D
--
P
K
G
G
M
Q
V
S
P
E
C
F
S
I
L
T
H
M
L
K
G
V
A
----
Q
G
R
L
V
L
-
A
L
E
G
G
Y
--
N
L
Q
S
T
A
E
G
V
C
A
S
M
R
S
L
L
G
-----
D
P
C
P
H
L
P
S
S
--
G
A
P
C
E
S
-------
A
L
K
S
I
S
--
K
T
---------
I
S
D
-
L
Y
P
F
W
K
S
L
Q
T
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
153
HHSearch
52.19
36%
-37
- C4 -
-
5G0H
10
?
A:
[500-762]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
S
Y
T
C
A
L
L
A
A
G
S
C
---
F
N
S
A
Q
A
I
L
T
G
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
--
Q
S
I
T
R
E
--
S
L
-
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
--
E
--
D
AN
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
K
M
G
----
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
G
-----
D
S
P
P
S
L
D
H
L
--
T
P
L
---
K
T
----
S
A
T
V
S
I
N
--
N
V
---------
L
R
A
-
H
A
P
F
W
S
S
L
R
V
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
84
PsiBlast_CBE
51.58
34%
-117
- C4 -
-
5JI5
4
?
A:
[118-314]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
G
R
Y
D
N
A
F
C
S
V
R
P
P
G
H
H
A
E
P
A
R
A
M
G
F
C
F
F
N
N
V
A
I
A
A
R
H
A
--
L
E
V
-
H
K
--
L
E
-
R
V
A
I
I
D
F
D
V
H
H
G
N
G
T
E
A
A
F
S
N
D
A
R
V
L
M
C
S
I
F
Q
-------------------
H
P
F
Y
P
F
T
G
A
D
N
Q
A
P
N
M
C
N
V
P
I
A
A
R
S
-------------------------
K
G
M
V
V
R
E
A
I
--------------
D
M
I
W
L
------
P
R
L
---
D
A
F
K
P
Q
M
L
F
V
S
A
G
F
D
A
H
R
E
D
--
D
L
G
N
M
A
L
V
E
D
D
Y
A
W
I
T
Q
Q
I
R
L
V
A
D
K
Y
A
K
G
R
I
V
S
-
C
L
E
G
G
Y
--
N
L
S
A
L
G
R
S
V
V
A
H
V
R
A
L
A
D
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
50.90
36%
-61
- C4 -
-
3C10
4
HDAC7_HUMAN
A:
[176-395]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
D
H
S
T
A
M
G
F
C
F
F
N
S
V
A
I
A
C
R
Q
L
--
Q
Q
Q
-
S
K
--
A
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
T
F
Y
Q
D
P
S
V
L
Y
I
S
L
H
R
H
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
V
D
--
E
V
G
A
G
S
G
E
G
F
N
V
N
V
A
W
A
-
G
-
G
-
L
D
PPMG
D
P
E
Y
L
A
A
F
R
I
V
V
M
P
I
A
---
R
E
F
S
P
D
L
V
L
V
S
A
G
F
D
A
A
E
G
H
PA
P
L
G
G
Y
H
V
S
A
K
C
F
G
Y
M
T
Q
Q
L
M
N
L
A
G
----
G
A
V
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
A
A
L
L
G
N
R
V
D
P
L
S
E
E
G
W
K
Q
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
PsiBlast_CBE
50.28
36%
-63
- C4 -
-
3C0Z
4
HDAC7_HUMAN
B:
[176-395]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
D
H
S
T
A
M
G
F
C
F
F
N
S
V
A
I
A
C
R
Q
L
--
Q
Q
Q
-
S
K
--
A
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
T
F
Y
Q
D
P
S
V
L
Y
I
S
L
H
R
H
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
V
D
--
E
V
G
A
G
S
G
E
G
F
N
V
N
V
A
W
A
-
G
-
G
-
L
D
PPMG
D
P
E
Y
L
A
A
F
R
I
V
V
M
P
I
A
---
R
E
F
S
P
D
L
V
L
V
S
A
G
F
D
A
A
E
G
H
PA
P
L
G
G
Y
H
V
S
A
K
C
F
G
Y
M
T
Q
Q
L
M
N
L
A
G
----
G
A
V
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
A
A
L
L
G
N
R
V
D
P
L
S
E
E
G
W
K
Q
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
39
PsiBlast_CBE
50.16
34%
-60
- C4 -
-
4CBT
2
HDAC4_HUMAN
B:
[145-369]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
S
--
V
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
--
D
P
L
P
E
K
V
L
Q
Q
R
P
N
A
N
A
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
50.07
33%
-41
- C4 -
-
2VQO
5
HDAC4_HUMAN
A:
[145-405]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
S
--
V
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
Y
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
E
L
D
P
L
P
E
K
--
V
L
Q
Q
R
P
N
A
N
A
V
R
S
M
E
K
V
M
E
--
I
H
---------
S
K
Y
W
R
C
L
Q
R
T
T
S
T
A
G
R
S
L
I
E
--
A
Q
T
C
E
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
49.94
33%
-36
- C4 -
-
2VQO
5
B:
[145-405]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
S
--
V
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
Y
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
E
L
D
P
L
P
E
K
--
V
L
Q
Q
R
P
N
A
N
A
V
R
S
M
E
K
V
M
E
--
I
H
---------
S
K
Y
W
R
C
L
Q
R
T
T
S
T
A
G
R
S
L
I
E
--
A
Q
T
C
E
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
49.90
34%
-68
- C4 -
-
4CBT
2
HDAC4_HUMAN
A:
[145-369]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
S
--
V
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
E
L
------L-
Q
Q
R
P
N
A
N
A
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
49.88
32%
-39
- C4 -
-
2VQQ
5
HDAC4_HUMAN
A:
[145-405]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
S
--
V
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
E
L
D
P
L
P
E
K
--
V
L
Q
Q
R
P
N
A
N
A
V
R
S
M
E
K
V
M
E
--
I
H
---------
S
K
Y
W
R
C
L
Q
R
T
T
S
T
A
G
R
S
L
I
E
--
A
Q
T
C
E
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
49.74
36%
-61
- C4 -
-
3C0Z
4
HDAC7_HUMAN
A:
[176-395]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
D
H
S
T
A
M
G
F
C
F
F
N
S
V
A
I
A
C
R
Q
L
--
Q
Q
Q
-
S
K
--
A
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
T
F
Y
Q
D
P
S
V
L
Y
I
S
L
H
R
H
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
V
D
--
E
V
G
A
G
S
G
E
G
F
N
V
N
V
A
W
A
-
G
-
G
-
L
D
PPMG
D
P
E
Y
L
A
A
F
R
I
V
V
M
P
I
A
---
R
E
F
S
P
D
L
V
L
V
S
A
G
F
D
A
A
E
G
H
PA
P
L
G
G
Y
H
V
S
A
K
C
F
G
Y
M
T
Q
Q
L
M
N
L
A
G
----
G
A
V
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
A
A
L
L
G
N
R
V
D
P
L
S
E
E
G
W
K
Q
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
49.62
36%
-60
- C4 -
-
3ZNR
4
HDAC7_HUMAN
A:
[176-395]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
D
H
S
T
A
M
G
F
C
F
F
N
S
V
A
I
A
C
R
Q
L
--
Q
Q
Q
-
S
K
--
A
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
T
F
Y
Q
D
P
S
V
L
Y
I
S
L
H
R
H
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
V
D
--
E
V
G
A
G
S
G
E
G
F
N
V
N
V
A
W
A
-
G
-
G
-
L
D
PPMG
D
P
E
Y
L
A
A
F
R
I
V
V
M
P
I
A
---
R
E
F
S
P
D
L
V
L
V
S
A
G
F
D
A
A
E
G
H
PA
P
L
G
G
Y
H
V
S
A
K
C
F
G
Y
M
T
Q
Q
L
M
N
L
A
G
----
G
A
V
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
A
A
L
L
G
N
R
V
D
P
L
S
E
E
G
W
K
Q
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
49.60
36%
-61
- C4 -
-
3ZNS
4
C:
[176-395]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
D
H
S
T
A
M
G
F
C
F
F
N
S
V
A
I
A
C
R
Q
L
--
Q
Q
Q
-
S
K
--
A
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
T
F
Y
Q
D
P
S
V
L
Y
I
S
L
H
R
H
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
V
D
--
E
V
G
A
G
S
G
E
G
F
N
V
N
V
A
W
A
-
G
-
G
-
L
D
PPMG
D
P
E
Y
L
A
A
F
R
I
V
V
M
P
I
A
---
R
E
F
S
P
D
L
V
L
V
S
A
G
F
D
A
A
E
G
H
PA
P
L
G
G
Y
H
V
S
A
K
C
F
G
Y
M
T
Q
Q
L
M
N
L
A
G
----
G
A
V
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
A
A
L
L
G
N
R
V
D
P
L
S
E
E
G
W
K
Q
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
49.10
36%
-63
- C4 -
-
3ZNS
4
HDAC7_HUMAN
A:
[176-395]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
D
H
S
T
A
M
G
F
C
F
F
N
S
V
A
I
A
C
R
Q
L
--
Q
Q
Q
-
S
K
--
A
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
T
F
Y
Q
D
P
S
V
L
Y
I
S
L
H
R
H
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
V
D
--
E
V
G
A
G
S
G
E
G
F
N
V
N
V
A
W
A
-
G
-
G
-
L
D
PPMG
D
P
E
Y
L
A
A
F
R
I
V
V
M
P
I
A
---
R
E
F
S
P
D
L
V
L
V
S
A
G
F
D
A
A
E
G
H
PA
P
L
G
G
Y
H
V
S
A
K
C
F
G
Y
M
T
Q
Q
L
M
N
L
A
G
----
G
A
V
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
A
A
L
L
G
N
R
V
D
P
L
S
E
E
G
W
K
Q
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
PsiBlast_CBE
48.99
32%
-41
- C4 -
-
2VQQ
5
B:
[145-405]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
S
--
V
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
E
L
D
P
L
P
E
K
--
V
L
Q
Q
R
P
N
A
N
A
V
R
S
M
E
K
V
M
E
--
I
H
---------
S
K
Y
W
R
C
L
Q
R
T
T
S
T
A
G
R
S
L
I
E
--
A
Q
T
C
E
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
27
PsiBlast_CBE
48.95
36%
-63
- C4 -
-
3C10
4
C:
[176-395]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
D
H
S
T
A
M
G
F
C
F
F
N
S
V
A
I
A
C
R
Q
L
--
Q
Q
Q
-
S
K
--
A
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
T
F
Y
Q
D
P
S
V
L
Y
I
S
L
H
R
H
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
V
D
--
E
V
G
A
G
S
G
E
G
F
N
V
N
V
A
W
A
-
G
-
G
-
L
D
PPMG
D
P
E
Y
L
A
A
F
R
I
V
V
M
P
I
A
---
R
E
F
S
P
D
L
V
L
V
S
A
G
F
D
A
A
E
G
H
PA
P
L
G
G
Y
H
V
S
A
K
C
F
G
Y
M
T
Q
Q
L
M
N
L
A
G
----
G
A
V
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
A
A
L
L
G
N
R
V
D
P
L
S
E
E
G
W
K
Q
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
48.81
32%
-38
- C4 -
-
2VQM
4
A:
[145-407]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
S
--
V
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
E
L
D
P
L
P
E
K
--
V
L
Q
Q
R
P
N
A
N
A
V
R
S
M
E
K
V
M
E
--
I
H
---------
S
K
Y
W
R
C
L
Q
R
T
T
S
T
A
G
R
S
L
I
E
--
A
Q
T
C
E
N
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
48.67
32%
-38
- C4 -
-
2VQJ
6
A:
[145-407]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
S
--
V
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
E
L
D
P
L
P
E
K
--
V
L
Q
Q
R
P
N
A
N
A
V
R
S
M
E
K
V
M
E
--
I
H
---------
S
K
Y
W
R
C
L
Q
R
T
T
S
T
A
G
R
S
L
I
E
--
A
Q
T
C
E
N
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
PsiBlast_CBE
48.65
34%
-59
- C4 -
-
5A2S
3
B:
[145-369]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
S
--
V
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
E
L
D
P
L
P
E
K
VL
Q
Q
R
P
N
A
N
A
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
28
PsiBlast_CBE
48.46
36%
-63
- C4 -
-
3C10
4
HDAC7_HUMAN
B:
[176-395]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
D
H
S
T
A
M
G
F
C
F
F
N
S
V
A
I
A
C
R
Q
L
--
Q
Q
Q
-
S
K
--
A
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
T
F
Y
Q
D
P
S
V
L
Y
I
S
L
H
R
H
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
V
D
--
E
V
G
A
G
S
G
E
G
F
N
V
N
V
A
W
A
-
G
-
G
-
L
D
PPMG
D
P
E
Y
L
A
A
F
R
I
V
V
M
P
I
A
---
R
E
F
S
P
D
L
V
L
V
S
A
G
F
D
A
A
E
G
H
PA
P
L
G
G
Y
H
V
S
A
K
C
F
G
Y
M
T
Q
Q
L
M
N
L
A
G
----
G
A
V
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
A
A
L
L
G
N
R
V
D
P
L
S
E
E
G
W
K
Q
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
48.41
36%
-58
- C4 -
-
3ZNS
4
HDAC7_HUMAN
B:
[176-395]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
D
H
S
T
A
M
G
F
C
F
F
N
S
V
A
I
A
C
R
Q
L
--
Q
Q
Q
-
S
K
--
A
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
T
F
Y
Q
D
P
S
V
L
Y
I
S
L
H
R
H
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
V
D
--
E
V
G
A
G
S
G
E
G
F
N
V
N
V
A
W
A
-
G
-
G
-
L
D
PPMG
D
P
E
Y
L
A
A
F
R
I
V
V
M
P
I
A
---
R
E
F
S
P
D
L
V
L
V
S
A
G
F
D
A
A
E
G
H
PA
P
L
G
G
Y
H
V
S
A
K
C
F
G
Y
M
T
Q
Q
L
M
N
L
A
G
----
G
A
V
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
A
A
L
L
G
N
R
V
D
P
L
S
E
E
G
W
K
Q
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
48.09
33%
-40
- C4 -
-
2VQV
6
B:
[145-405]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
S
--
V
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
Y
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
E
L
D
P
L
P
E
K
--
V
L
Q
Q
R
P
N
A
N
A
V
R
S
M
E
K
V
M
E
--
I
H
---------
S
K
Y
W
R
C
L
Q
R
T
T
S
T
A
G
R
S
L
I
E
--
A
Q
T
C
E
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
48
PsiBlast_CBE
48.08
35%
-46
- C4 -
-
5EF8
5
?
A:
[126-328]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
Q
S
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
47.98
33%
-40
- C4 -
-
2VQV
6
HDAC4_HUMAN
A:
[145-405]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
S
--
V
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
Y
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
E
L
D
P
L
P
E
K
--
V
L
Q
Q
R
P
N
A
N
A
V
R
S
M
E
K
V
M
E
--
I
H
---------
S
K
Y
W
R
C
L
Q
R
T
T
S
T
A
G
R
S
L
I
E
--
A
Q
T
C
E
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
47.87
34%
-57
- C4 -
-
5A2S
3
HDAC4_HUMAN
A:
[145-369]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
S
--
V
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
E
L
D
P
L
P
E
K
V
L
Q
Q
R
P
N
A
N
A
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
29
PsiBlast_CBE
47.84
36%
-65
- C4 -
-
3C0Z
4
C:
[176-395]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
D
H
S
T
A
M
G
F
C
F
F
N
S
V
A
I
A
C
R
Q
L
--
Q
Q
Q
-
S
K
--
A
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
T
F
Y
Q
D
P
S
V
L
Y
I
S
L
H
R
H
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
V
D
--
E
V
G
A
G
S
G
E
G
F
N
V
N
V
A
W
A
-
G
-
G
-
L
D
PPMG
D
P
E
Y
L
A
A
F
R
I
V
V
M
P
I
A
---
R
E
F
S
P
D
L
V
L
V
S
A
G
F
D
A
A
E
G
H
PA
P
L
G
G
Y
H
V
S
A
K
C
F
G
Y
M
T
Q
Q
L
M
N
L
A
G
----
G
A
V
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
A
A
L
L
G
N
R
V
D
P
L
S
E
E
G
W
K
Q
K
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
50
PsiBlast_CBE
47.56
35%
-41
- C4 -
-
5EF7
4
?
A:
[126-328]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
Q
S
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
47.48
35%
-46
- C4 -
-
5G0H
9
?
A:
[523-725]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
Q
S
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
47.00
35%
-44
- C4 -
-
5G0J
4
?
A:
[523-725]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
Q
S
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
49
PsiBlast_CBE
46.92
35%
-42
- C4 -
-
5EF7
4
?
B:
[126-330]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
QS
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
79
PsiBlast_CBE
46.86
35%
-42
- C4 -
-
5EFK
7
?
B:
[126-329]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
Q
S
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
F
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
80
PsiBlast_CBE
46.44
35%
-42
- C4 -
-
5EFN
5
?
B:
[126-328]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
A
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
QS
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
81
PsiBlast_CBE
46.29
35%
-43
- C4 -
-
5EFN
5
?
A:
[126-328]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
A
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
Q
S
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
46.25
36%
-86
- C4 -
-
5G0G
7
?
A:
[141-335]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
L
R
N
G
F
S
I
N
R
P
P
G
H
H
A
Q
A
D
K
M
N
G
F
C
M
F
N
N
L
A
I
A
A
R
Y
A
--
Q
K
R
-
H
R
--
V
Q
-
R
V
L
I
V
D
W
D
V
H
H
G
Q
G
I
Q
Y
I
F
E
E
D
P
S
V
L
Y
F
S
V
H
R
Y
E
D
G
S
----------------------
F
W
P
H
L
K
E
S
D
S
S
S
V
G
S
G
A
------------------------
G
Q
G
Y
N
I
N
L
P
W
N
-
K
V
G
-
M
E
----
S
G
D
Y
I
T
A
F
Q
Q
L
L
L
P
V
A
---
Y
E
F
Q
P
Q
L
V
L
V
A
A
G
F
D
A
V
I
G
D
--
P
K
G
G
M
Q
V
S
P
E
C
F
S
I
L
T
H
M
L
K
G
V
A
----
Q
G
R
L
V
L
-
A
L
E
G
G
Y
N
L
Q
S
T
A
E
G
V
C
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
55
PsiBlast_CBE
46.13
35%
-44
- C4 -
-
5EEK
20
?
A:
[126-330]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
Q
S
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
PsiBlast_CBE
46.11
35%
-45
- C4 -
-
5EFH
8
?
A:
[126-328]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
Q
S
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
46
PsiBlast_CBE
45.99
35%
-43
- C4 -
-
5EFB
4
?
D:
[126-330]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
QS
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
42
PsiBlast_CBE
45.90
35%
-43
- C4 -
-
5EFH
6
?
D:
[126-328]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
QS
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
47
PsiBlast_CBE
45.88
35%
-48
- C4 -
-
5EF8
6
?
B:
[126-328]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
QS
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
38
PsiBlast_CBE
45.83
34%
-62
- C4 -
-
4CBT
2
C:
[145-369]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
E
L
K
N
G
F
A
V
V
R
P
P
G
H
H
A
E
E
S
T
P
M
G
F
C
Y
F
N
S
V
A
V
A
A
K
L
L
--
Q
Q
R
-
L
----
S
-
K
I
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
Q
A
F
Y
S
D
P
S
V
L
Y
M
S
L
H
R
Y
D
D
G
N
----------------------------------------
F
F
P
G
S
--
G
--
A
--
P
D
--
E
V
G
T
G
P
G
V
G
F
N
V
N
M
A
F
T
-
G
-
G
-
L
D
PPMG
D
A
E
Y
L
A
A
F
R
T
V
V
M
P
I
A
---
S
E
F
A
P
D
V
V
L
V
S
S
G
F
D
A
V
E
G
H
PT
P
L
G
G
Y
N
L
S
A
R
C
F
G
Y
L
T
K
Q
L
M
G
L
A
G
----
G
R
I
V
L
-
A
L
E
G
G
H
--
D
L
T
A
I
C
D
A
S
E
A
C
V
S
A
L
L
G
-----
N
E
------
K
VL
Q
Q
R
P
N
A
N
A
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
52
PsiBlast_CBE
44.82
35%
-44
- C4 -
-
5EEN
5
?
A:
[126-328]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
Q
S
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
51
PsiBlast_CBE
44.77
35%
-46
- C4 -
-
5EEN
4
?
B:
[126-332]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
QS
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
53
PsiBlast_CBE
44.73
35%
-43
- C4 -
-
5EEM
5
?
B:
[126-331]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Q
V
R
N
A
V
A
I
V
R
P
P
G
H
H
A
E
K
D
T
A
C
G
F
C
F
F
N
T
A
A
L
T
A
R
Y
A
QS
I
T
R
-
E
S
--
L
--
R
V
L
I
V
D
W
D
V
H
H
G
N
G
T
Q
H
I
F
E
E
D
D
S
V
L
Y
I
S
L
H
R
Y
E
D
----------------------------------------
G
A
F
F
P
N
S
ED
A
--
N
--
Y
D
--
K
V
G
L
G
K
G
R
G
Y
N
V
N
I
P
W
N
-
G
-
G
-
K
M
G---
D
P
E
Y
M
A
A
F
H
H
L
V
M
P
I
A
---
R
E
F
A
P
E
L
V
L
V
S
A
G
F
D
A
A
R
G
D
--
P
L
G
G
F
Q
V
T
P
E
G
Y
A
H
L
T
H
Q
L
M
S
L
A
----
A
G
R
V
L
I
-
I
L
E
G
G
Y
--
N
L
T
S
I
S
E
S
M
S
M
C
T
S
M
L
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
57
PsiBlast_CBE
43.99
35%
-77
- C4 -
-
5EEF
6
?
B:
[120-320]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
K
V
M
T
S
Q
L
R
N
G
F
S
I
N
R
P
P
G
H
H
A
Q
A
D
K
M
N
G
F
C
M
F
N
N
L
A
I
A
A
R
Y
A
--
Q
K
R
-
H
R
--
V
Q
-
R
V
L
I
V
D
W
D
V
H
H
G
Q
G
I
Q
Y
I
F
E
E
D
P
S
V
L
Y
F
S
V
H
R
Y
E
D
G
S
----------------------
F
W
P
H
L
K
E
S
D
S
S
S
V
G
S
G
A
------------------------
G
Q
G
Y
N
I
N
L
P
W
N
-
K
V
G
-
M
E
----
S
G
D
Y
I
T
A
F
Q
Q
L
L
L
P
V
A
---
Y
E
F
Q
P
Q
L
V
L
V
A
A
G
F
D
A
V
I
G
D
--
P
K
G
G
M
Q
V
S
P
E
C
F
S
I
L
T
H
M
L
K
G
V
A
----
Q
G
R
L
V
L
-
A
L
E
G
G
Y
N
L
Q
S
T
A
E
G
V
C
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
58
PsiBlast_CBE
43.73
35%
-82
- C4 -
-
5EEF
5
?
A:
[120-320]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
K
V
M
T
S
Q
L
R
N
G
F
S
I
N
R
P
P
G
H
H
A
Q
A
D
K
M
N
G
F
C
M
F
N
N
L
A
I
A
A
R
Y
A
--
Q
K
R
-
H
R
--
V
Q
-
R
V
L
I
V
D
W
D
V
H
H
G
Q
G
I
Q
Y
I
F
E
E
D
P
S
V
L
Y
F
S
V
H
R
Y
E
D
G
S
----------------------
F
W
P
H
L
K
E
S
D
S
S
S
V
G
S
G
A
------------------------
G
Q
G
Y
N
I
N
L
P
W
N
-
K
V
G
-
M
E
----
S
G
D
Y
I
T
A
F
Q
Q
L
L
L
P
V
A
---
Y
E
F
Q
P
Q
L
V
L
V
A
A
G
F
D
A
V
I
G
D
--
P
K
G
G
M
Q
V
S
P
E
C
F
S
I
L
T
H
M
L
K
G
V
A
----
Q
G
R
L
V
L
-
A
L
E
G
G
Y
N
L
Q
S
T
A
E
G
V
C
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
87
PsiBlast_CBE
40.43
32%
-76
- C4 -
-
4ZUQ
5
APHA_MYCRA
B:
[147-323]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
A
A
F
S
L
C
R
P
P
G
H
H
A
G
I
D
M
F
G
G
Y
C
F
I
N
N
A
A
V
A
A
Q
R
L
--
L
D
K
--
G
--
A
K
-
K
I
A
I
L
D
V
D
F
H
H
G
N
G
T
Q
D
I
F
Y
E
R
G
D
V
F
F
A
S
-----------------
L
H
G
D
P
A
-----------------------
E
A
F
P
H
F
L
--
G
--
Y
--
A
E
--
E
T
G
K
G
A
G
A
G
T
T
A
N
Y
P
M
G
-
R
-
G
-
T
P
--------
Y
S
V
W
G
E
A
L
T
D
S
L
KRI
A
A
F
G
A
E
A
I
V
V
S
L
G
V
D
T
F
E
Q
D
--
P
I
S
F
F
K
L
T
S
P
D
Y
I
T
M
G
R
T
------
I
A
A
S
G
V
P
L
L
V
V
M
E
G
G
Y
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
91
PsiBlast_CBE
40.16
32%
-77
- C4 -
-
4ZUO
6
APHA_MYCRA
B:
[147-323]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
A
A
F
S
L
C
R
P
P
G
H
H
A
G
I
D
M
F
G
G
Y
C
F
I
N
N
A
A
V
A
A
Q
R
L
--
L
D
K
--
G
--
A
K
-
K
I
A
I
L
D
V
D
F
H
H
G
N
G
T
Q
D
I
F
Y
E
R
G
D
V
F
F
A
S
-----------------
L
H
G
D
P
A
-----------------------
E
A
F
P
H
F
L
--
G
--
Y
--
A
E
--
E
T
G
K
G
A
G
A
G
T
T
A
N
Y
P
M
G
-
R
-
G
-
T
P
--------
Y
S
V
W
G
E
A
L
T
D
S
L
KRI
A
A
F
G
A
E
A
I
V
V
S
L
G
V
D
T
F
E
Q
D
--
P
I
S
F
F
K
L
T
S
P
D
Y
I
T
M
G
R
T
------
I
A
A
S
G
V
P
L
L
V
V
M
E
G
G
Y
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
90
PsiBlast_CBE
39.66
32%
-76
- C4 -
-
4ZUP
7
APHA_MYCRA
A:
[147-323]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
A
A
F
S
L
C
R
P
P
G
H
H
A
G
I
D
M
F
G
G
Y
C
F
I
N
N
A
A
V
A
A
Q
R
L
--
L
D
K
--
G
--
A
K
-
K
I
A
I
L
D
V
D
F
H
H
G
N
G
T
Q
D
I
F
Y
E
R
G
D
V
F
F
A
S
-----------------
L
H
G
D
P
A
-----------------------
E
A
F
P
H
F
L
--
G
--
Y
--
A
E
--
E
T
G
K
G
A
G
A
G
T
T
A
N
Y
P
M
G
-
R
-
G
-
T
P
--------
Y
S
V
W
G
E
A
L
T
D
S
L
K
R
I
A
A
F
G
A
E
A
I
V
V
S
L
G
V
D
T
F
E
Q
D
--
P
I
S
F
F
K
L
T
S
P
D
Y
I
T
M
G
R
T
------
I
A
A
S
G
V
P
L
L
V
V
M
E
G
G
Y
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
93
PsiBlast_CBE
39.57
32%
-76
- C4 -
-
4ZUN
4
APHA_MYCRA
B:
[147-323]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
A
A
F
S
L
C
R
P
P
G
H
H
A
G
I
D
M
F
G
G
Y
C
F
I
N
N
A
A
V
A
A
Q
R
L
--
L
D
K
--
G
--
A
K
-
K
I
A
I
L
D
V
D
F
H
H
G
N
G
T
Q
D
I
F
Y
E
R
G
D
V
F
F
A
S
-----------------
L
H
G
D
P
A
-----------------------
E
A
F
P
H
F
L
--
G
--
Y
--
A
E
--
E
T
G
K
G
A
G
A
G
T
T
A
N
Y
P
M
G
-
R
-
G
-
T
P
--------
Y
S
V
W
G
E
A
L
T
D
S
L
KRI
A
A
F
G
A
E
A
I
V
V
S
L
G
V
D
T
F
E
Q
D
--
P
I
S
F
F
K
L
T
S
P
D
Y
I
T
M
G
R
T
------
I
A
A
S
G
V
P
L
L
V
V
M
E
G
G
Y
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
89
PsiBlast_CBE
39.36
32%
-77
- C4 -
-
4ZUP
5
APHA_MYCRA
B:
[147-323]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
A
A
F
S
L
C
R
P
P
G
H
H
A
G
I
D
M
F
G
G
Y
C
F
I
N
N
A
A
V
A
A
Q
R
L
--
L
D
K
--
G
--
A
K
-
K
I
A
I
L
D
V
D
F
H
H
G
N
G
T
Q
D
I
F
Y
E
R
G
D
V
F
F
A
S
-----------------
L
H
G
D
P
A
-----------------------
E
A
F
P
H
F
L
--
G
--
Y
--
A
E
--
E
T
G
K
G
A
G
A
G
T
T
A
N
Y
P
M
G
-
R
-
G
-
T
P
--------
Y
S
V
W
G
E
A
L
T
D
S
L
KRI
A
A
F
G
A
E
A
I
V
V
S
L
G
V
D
T
F
E
Q
D
--
P
I
S
F
F
K
L
T
S
P
D
Y
I
T
M
G
R
T
------
I
A
A
S
G
V
P
L
L
V
V
M
E
G
G
Y
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
88
PsiBlast_CBE
39.32
32%
-74
- C4 -
-
4ZUQ
5
APHA_MYCRA
A:
[147-323]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
A
A
F
S
L
C
R
P
P
G
H
H
A
G
I
D
M
F
G
G
Y
C
F
I
N
N
A
A
V
A
A
Q
R
L
--
L
D
K
--
G
--
A
K
-
K
I
A
I
L
D
V
D
F
H
H
G
N
G
T
Q
D
I
F
Y
E
R
G
D
V
F
F
A
S
-----------------
L
H
G
D
P
A
-----------------------
E
A
F
P
H
F
L
--
G
--
Y
--
A
E
--
E
T
G
K
G
A
G
A
G
T
T
A
N
Y
P
M
G
-
R
-
G
-
T
P
--------
Y
S
V
W
G
E
A
L
T
D
S
L
K
R
I
A
A
F
G
A
E
A
I
V
V
S
L
G
V
D
T
F
E
Q
D
--
P
I
S
F
F
K
L
T
S
P
D
Y
I
T
M
G
R
T
------
I
A
A
S
G
V
P
L
L
V
V
M
E
G
G
Y
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
95
PsiBlast_CBE
39.26
32%
-76
- C4 -
-
4ZUM
5
APHA_MYCRA
B:
[147-323]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
A
A
F
S
L
C
R
P
P
G
H
H
A
G
I
D
M
F
G
G
Y
C
F
I
N
N
A
A
V
A
A
Q
R
L
--
L
D
K
--
G
--
A
K
-
K
I
A
I
L
D
V
D
F
H
H
G
N
G
T
Q
D
I
F
Y
E
R
G
D
V
F
F
A
S
-----------------
L
H
G
D
P
A
-----------------------
E
A
F
P
H
F
L
--
G
--
Y
--
A
E
--
E
T
G
K
G
A
G
A
G
T
T
A
N
Y
P
M
G
-
R
-
G
-
T
P
--------
Y
S
V
W
G
E
A
L
T
D
S
L
KRI
A
A
F
G
A
E
A
I
V
V
S
L
G
V
D
T
F
E
Q
D
--
P
I
S
F
F
K
L
T
S
P
D
Y
I
T
M
G
R
T
------
I
A
A
S
G
V
P
L
L
V
V
M
E
G
G
Y
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
96
PsiBlast_CBE
39.12
32%
-78
- C4 -
-
4ZUM
6
APHA_MYCRA
A:
[147-323]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
A
A
F
S
L
C
R
P
P
G
H
H
A
G
I
D
M
F
G
G
Y
C
F
I
N
N
A
A
V
A
A
Q
R
L
--
L
D
K
--
G
--
A
K
-
K
I
A
I
L
D
V
D
F
H
H
G
N
G
T
Q
D
I
F
Y
E
R
G
D
V
F
F
A
S
-----------------
L
H
G
D
P
A
-----------------------
E
A
F
P
H
F
L
--
G
--
Y
--
A
E
--
E
T
G
K
G
A
G
A
G
T
T
A
N
Y
P
M
G
-
R
-
G
-
T
P
--------
Y
S
V
W
G
E
A
L
T
D
S
L
K
R
I
A
A
F
G
A
E
A
I
V
V
S
L
G
V
D
T
F
E
Q
D
--
P
I
S
F
F
K
L
T
S
P
D
Y
I
T
M
G
R
T
------
I
A
A
S
G
V
P
L
L
V
V
M
E
G
G
Y
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
94
PsiBlast_CBE
38.61
32%
-76
- C4 -
-
4ZUN
5
APHA_MYCRA
A:
[147-323]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
A
A
F
S
L
C
R
P
P
G
H
H
A
G
I
D
M
F
G
G
Y
C
F
I
N
N
A
A
V
A
A
Q
R
L
--
L
D
K
--
G
--
A
K
-
K
I
A
I
L
D
V
D
F
H
H
G
N
G
T
Q
D
I
F
Y
E
R
G
D
V
F
F
A
S
-----------------
L
H
G
D
P
A
-----------------------
E
A
F
P
H
F
L
--
G
--
Y
--
A
E
--
E
T
G
K
G
A
G
A
G
T
T
A
N
Y
P
M
G
-
R
-
G
-
T
P
--------
Y
S
V
W
G
E
A
L
T
D
S
L
K
R
I
A
A
F
G
A
E
A
I
V
V
S
L
G
V
D
T
F
E
Q
D
--
P
I
S
F
F
K
L
T
S
P
D
Y
I
T
M
G
R
T
------
I
A
A
S
G
V
P
L
L
V
V
M
E
G
G
Y
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
92
PsiBlast_CBE
38.15
32%
-77
- C4 -
-
4ZUO
5
APHA_MYCRA
A:
[147-323]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
K
A
A
F
S
L
C
R
P
P
G
H
H
A
G
I
D
M
F
G
G
Y
C
F
I
N
N
A
A
V
A
A
Q
R
L
--
L
D
K
--
G
--
A
K
-
K
I
A
I
L
D
V
D
F
H
H
G
N
G
T
Q
D
I
F
Y
E
R
G
D
V
F
F
A
S
-----------------
L
H
G
D
P
A
-----------------------
E
A
F
P
H
F
L
--
G
--
Y
--
A
E
--
E
T
G
K
G
A
G
A
G
T
T
A
N
Y
P
M
G
-
R
-
G
-
T
P
--------
Y
S
V
W
G
E
A
L
T
D
S
L
K
R
I
A
A
F
G
A
E
A
I
V
V
S
L
G
V
D
T
F
E
Q
D
--
P
I
S
F
F
K
L
T
S
P
D
Y
I
T
M
G
R
T
------
I
A
A
S
G
V
P
L
L
V
V
M
E
G
G
Y
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
User Run . : Multi Template Modeling Result:
(2 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
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MARFCGSPPPCSPKERPDDRPSPSSPPSLSSSA
P
L
S
L
R
A
SVSPASPSSRLSFPPIS
D
L
S
Y
YSSRSPSSSSAFSSSSC
A
S
V
A
L
L
I
D
E
E
E
MASPFSHAGPASHPES
P
S
R
I
S
A
I
L
R
T
L
V
RHGWLSRKTGMGVQQSEDASEKPQTEETHPAVSSLSPPTSSACGETQAAHTD
G
R
E
Q
R
R
S
L
LGLATKSNAVPG
V
S
ECPS
L
C
L
YESPSDG
A
S
V
SLSPPGEDGAPPVSSRLPAYSSSEG
R
R
L
R
D
L
CDASVPRESPPAFPFYSTHP
S
L
L
V
L
PCGRLATDE
E
L
C
F
C
HT
A
G
Y
V
S
R
V
E
S
V
F
P
S
L
G
S
S
L
P
R
K
A
A
KAGAAKGRGVPG
E
K
E
K
K
A
L
HASL
P
D
R
F
K
KGRRWSSHNVDTDSKSTSCHSPCAASSADSSLSAQSSASSPSSRASLPRPSSP
S
V
V
S
VSETPPS
P
F
S
RLNAASADSSS
N
A
F
D
C
HLSTHPRSLDGTQPALFPGSCGGEGNSGHPVSRSEALCEPETVASSELHAA
P
L
A
E
V
TRAPGTGFGGAAAA
R
E
E
E
K
S
EKREAVFPCSSP
V
S
L
S
V
LSTAP
S
T
V
A
S
L
EESSDA
R
T
A
C
D
A
Y
A
A
SLEAEPCAVTDAKPSAALPP
A
L
A
V
S
S
S
C
E
S
H
L
S
S
E
V
T
E
E
LGNNGPAS
P
A
L
P
Q
F
V
N
L
FGG
D
T
F
ICPRTP
H
T
A
R
LAA
G
A
A
L
E
L
C
D
L
IYGSP
T
V
E
R
H
K
E
T
R
R
K
R
Q
GLRRKESK
G
E
R
H
A
E
R
H
R
E
R
Q
Q
QGGRQERHLEG
D
D
E
E
L
K
AREGE
T
E
A
R
L
ASGVSDEGGRGACSGVCDGRDKQDSEREDDTPAA
T
E
EHGGEDRRDDTPAA
T
E
EHGGEDRRDDTPAA
T
E
EHGGEDRRDGP
N
E
Q
R
Q
E
N
K
V
KR
G
F
A
IIRPPGHHACSHEAA
G
F
C
I
YN
N
V
A
L
A
A
N
Y
L
L
A
KHGL
S
R
V
A
I
L
D
W
D
VHHGNGT
Q
D
L
F
YNSS
S
V
L
Y
L
S
V
HRFEKAKPVSASHGEALHASPSPGAGAAGPSPESPRASDSPAASGAAFYPGTGSLTETGVSVGR
G
Y
T
I
N
V
PLSRGYTDG
D
M
F
W
V
F
C
G
V
I
A
P
A
L
T
AFRP
Q
A
I
L
V
SAGFDAAAGDPL
G
G
C
L
L
S
P
A
L
F
A
W
M
T
R
Q
V
C
R
L
ADIHCE
G
K
A
L
F
F
L
EGGYQG
D
V
L
G
A
C
V
E
A
C
V
A
A
L
V
N
LSEENKPEERHRPKETADNAEDAGK
G
E
E
K
L
V
K
R
RESPRGARDR
G
R
D
C
V
D
Q
T
V
Q
L
C
Q
K
E
RRSRDE
N
E
A
A
C
S
R
S
L
L
S
G
R
L
G
E
T
L
A
R
L
D
S
G
I
L
Q
G
V
E
EGVELPSTEGPSACGSPPSISL
P
A
S
L
R
V
HANPPGWPP
F
R
V
LSPSSASFPSPAS
P
L
S
S
Y
A
L
P
R
L
L
E
E
P
V
A
A
F
C
P
K
C
R
H
R
V
R
K
RTSLSATSS
A
G
E
A
L
S
R
G
A
S
R
R
A
S
ACN
S
D
L
S
F
F
V
E
KRKEPKFVPEPFPPAE
R
W
V
V
IPP
S
A
V
D
V
A
M
RDAGDVARWAPTATAETPRRKKGRGDRKKKGEK
G
R
S
E
A
R
KSGSRNANCEERDSH
E
D
V
A
L
R
L
Q
G
I
A
S
E
V
ETETGRATPV
S
V
S
E
S
C
L
S
P
C
SNGLLPAFPADSARFG
S
T
L
RIPCPTVRSPGALSQGHGLP
A
V
C
P
QFGSRPSSP
S
T
V
L
S
L
S
P
L
C
K
V
W
ASSPASRPT
E
V
SSACGP
L
S
D
E
V
T
S
L
C
SGFRL
D
A
I
EE
G
S
Q
EM
T
N
S
Q
L
P
Q
V
L
G
A
L
S
A
S
SLAATPGPQCPTSP
A
L
V
C
AACGVPLETAETAFPSSCPASP
T
L
SFSSFSAAAS
P
A
S
FVARPRSGSVSD
R
V
R
VGKTQND
G
G
R
Q
L
Q
K
S
V
V
C
R
QA
T
Y
D
T
L
R
L
V
R
R
V
HAGSPFFLPPLPPLPKTVKTK
S
V
E
A
A
REQTDG
D
A
E
T
A
E
Q
V
S
L
C
L
REGGDFRDQAT
D
Q
Q
S
L
A
RAQPPYSAGDGTETRHSTHGVRGSRASAAPEPRPKTPDLSATPSIAS
P
L
T
S
S
CSGLSSSGPPHTSTTPCGSTSSFSSSL
S
V
S
A
SLL
P
A
S
R
T
L
A
N
V
L
P
A
G
L
L
S
H
V
R
G
RIVGGRARGAR
E
E
S
E
A
A
L
QRNETIEQG
Q
L
V
K
LCNWG
E
A
A
F
Y
T
W
V
Q
M
HSKKGEPEETDSGE
D
V
T
V
T
L
Q
A
L
E
T
L
F
G
R
LHRPGKNSGENS
G
E
L
QRKSKDENPTGS
E
T
L
V
V
H
TTRM
P
R
Q
E
AV
P
S
A
V
LSF
D
P
Q
Q
V
L
D
L
L
RIQPDGVAISEPPSA
S
S
V
A
SDALSPSSV
S
S
D
V
A
T
E
L
A
K
F
M
P
R
C
H
R
V
F
W
THAWALAEPPSTRKTNCEGGRKRCHGDEGRGEKEGESRLPRSPTEPRDA
S
V
A
D
V
D
R
R
S
R
S
ALN
S
S
Q
QSVPQGSSGEASRSSSSSASSSSCLGSSGPESRGAPLAFPASSACGS
R
F
A
C
A
V
A
L
A
D
L
A
Q
F
V
R
P
C
V
M
D
I
K
M
G
I
Q
MYDPSCT
D
A
G
K
I
Q
R
M
Q
E
K
ARGRSVGSH
G
F
F
I
CGVSAGAVDSG
T
A
R
V
S
E
E
ISTEAGKSKVLESET
T
E
D
LCGG
S
E
A
C
D
E
C
NRGAEQ
D
A
G
Q
V
A
A
S
SLR
P
F
V
LSSQE
A
Y
A
VT
Q
D
E
A
F
L
R
V
F
T
N
F
F
CVND
S
T
E
L
A
A
R
L
I
R
K
C
L
G
K
L
A
T
L
Q
R
F
F
E
H
Q
K
Q
V
S
FYG
S
S
L
L
F
V
FDADPAPDRLPVLRDSSDGPPA
L
S
V
R
R
T
QYAGTTQTQRPPVLQQNDRRGGG
N
A
E
R
R
R
D
A
H
RAADV
E
C
A
E
CG
R
K
R
E
A
V
Y
D
A
I
V
E
S
FG
V
Y
M
V
D
F
A
HVNFSRKQHDR
G
Y
L
F
G
L
A
N
L
Q
R
L
F
A
R
V
L
H
S
LGSSPS
P
A
I
A
E
A
AVVS
E
E
E
TRANSSGSGEKKNEAEPKHDREGRP
183
100.00
100%
0
- C- -
0.40
M183
-
A:
[743-1073]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
D
T
P
A
A
T
E
E
H
G
G
E
D
R
R
D
G
P
N
E
Q
R
Q
E
N
K
V
K
R
G
F
A
I
I
R
P
P
G
H
H
A
C
S
H
E
A
A
G
F
C
I
Y
N
N
V
A
L
A
A
N
Y
L
L
A
K
H
G
L
S
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
L
F
Y
N
S
S
S
V
L
Y
L
S
V
H
R
F
E
K
A
K
P
V
S
A
S
H
G
E
A
L
H
A
S
P
S
P
G
A
G
A
A
G
P
S
P
E
S
P
R
A
S
D
S
P
A
A
S
G
A
A
F
Y
P
G
T
G
S
L
T
E
T
G
V
S
V
G
R
G
Y
T
I
N
V
P
L
S
R
G
Y
T
D
G
D
M
F
W
V
F
C
G
V
I
A
P
A
L
T
A
F
R
P
Q
A
I
L
V
S
A
G
F
D
A
A
A
G
D
P
L
G
G
C
L
L
S
P
A
L
F
A
W
M
T
R
Q
V
C
R
L
A
D
I
H
C
E
G
K
A
L
F
F
L
E
G
G
Y
Q
G
D
V
L
G
A
C
V
E
A
C
V
A
A
L
V
N
L
S
E
E
N
K
P
E
E
R
H
R
P
K
E
T
A
D
N
A
E
D
A
G
K
G
E
E
K
L
V
K
R
R
E
S
P
R
G
A
R
D
R
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
S
G
E
K
K
N
E
A
E
P
K
H
D
R
E
G
R
P
184
63.03
100%
-106
- C- -
0.43
M184
-
A:
[773-1019]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
F
A
I
I
R
P
P
G
H
H
A
C
S
H
E
A
A
G
F
C
I
Y
N
N
V
A
L
A
A
N
Y
L
L
A
K
H
G
L
S
R
V
A
I
L
D
W
D
V
H
H
G
N
G
T
Q
D
L
F
Y
N
S
S
S
V
L
Y
L
S
V
H
R
F
E
K
A
K
P
V
S
A
S
H
G
E
A
L
H
A
S
P
S
P
G
A
G
A
A
G
P
S
P
E
S
P
R
A
S
D
S
P
A
A
S
G
A
A
F
Y
P
G
T
G
S
L
T
E
T
G
V
S
V
G
R
G
Y
T
I
N
V
P
L
S
R
G
Y
T
D
G
D
M
F
W
V
F
C
G
V
I
A
P
A
L
T
A
F
R
P
Q
A
I
L
V
S
A
G
F
D
A
A
A
G
D
P
L
G
G
C
L
L
S
P
A
L
F
A
W
M
T
R
Q
V
C
R
L
A
D
I
H
C
E
G
K
A
L
F
F
L
E
G
G
Y
Q
G
D
V
L
G
A
C
V
E
A
C
V
A
A
L
V
N
L
S
E
E
N
K
P
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------