@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
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : Q3XZV9: (2018-01-17 )
MNQIPLKPQNERFTDDQWQAIFDQGDNLLVSASAGSGKTTVLVRRVIEKLKMGFDIDELLIVTFTEAAAREMKERIQEALQEAVNSESDPVRRQHFTKQLVLLPTANISTLHAFCLTVIRRYYYLIDIDPVFRMLTDETETILMKEDVWDELREALYAENDERFFQLTMNFSNDRSDDGLTNLVFSLYEFARANPDPKKWLEQLSDNYRLPEGLAKSRLYQEQIRPLVLADIYQCVQLYEQMTQLAQGEGLEKMHEQVAGEQQQIKNIYEAFSQDRLEEAYAGLEQLTFSTFKSSRKAELKEISNEVKGMRDKAKKLIQQISKSYFPVSPSQMEELTDKALPLVEEMTKVTQSFMDGFSMRKREKGVLDFNDLEHLALQILTEKTKDAWLPSEASKHYRKKFKEVMVDEYQDVNQLQEAILYWLREPDDTKGNMFMVGDVKQSIYSFRLADPSLFIGKYENFSKKEGGRRIVLAENFRSRKEVLSFTNLIFEQLMDPAVGQINYDEAAKLIQGFSDFPENEQFEPEIMIYEKEQEESEIEIPTDDILEDKTEGELFMTGLKIRQLIDSSFMIYDKKSKKSRPIEYKDIVLLTPTKKNNLTILEIFKTLDIPLEMKDAQNYFQATEIRTMISLLQLIDNPYQDIPLAAVLRSPIVGLIEPELASIRLADRAHTYYDAVLAYQASNEDELAAKLEHFGKQLEHWRELARRSSITDLLWDIYYETGYLEYVVGLPAGAQRQANLYALVDRAKAYEQSSFRGLYQFVRFIEKMQEKDKDLAEPVISIEDNAVRVMTIHASKGLEFPVVFLLDMTKEFNLQDLRNRYAFEEKLGAGIRYMDPETRVLYDTLPFQAIKLVKQNKLLSEEMRKLYVGLTRAEQKLFIVGSYKNKEQMIQTWSEAADHEELVFDPALRLKGRSSLMNWIGYGLIRHPEMQKYLEEEISTSLLQHSNAQFSISWMNQQSIIEQRQLLAEKELVNLDQQMKEDETLLADSLQKRLAYEYPYQASSQTTSYQSVSEIKRLFEDPDDTQESRLTLESSQNKAASRQFRYTQEQLAEPKFLQKDRQVSAAAVGTATHALLQLLPLEMPTTESIHQKLQELVRKRLVDEKVAKKVDVSSIIWFFQTELGQQLIANKENVKREQPFSMLLPADEVFQDYPNQEDELLIHGIVDGYLEEKDHLNIYDFKTDFILHPDDPAEIDAIVQKYQGQLRLYQQAMSEALNKPVENVFLILLRVKQIININK
Atome Classification :
(20 SA)
.........10........20........30........40........50--------..---.......60........70........80......------------------..90........100.......110.......120.......130.......140.......150.......160.......170.......180.......190.......200......--------------.-210..--.-....----220......------------.230.......240........250.......260..--.....270.......280...-....290.....-..300.-.......310-----------........320.......330.......340-.........350.....------------..360.......370.......380-....-...390..----..----...400.......410.......420-........430.......440.......450.......460.-..-..-.--.470...-....480.......490.----....---------..500........510.......------..520.......530.......-----------540.......550..-.....560.......570..--.....580.......590.......600.......610.....-...620.......630.......640.......650.......660.......670-........--680.--..-----....690----------------....----...700----......---.710.......720.......730.----.....-...740....-...750.---------.----.....760....-...770..---...--..-780....-..--..790.......800.......810---.......---..820.......-830.......840.......850.......860.......870.......880.......890.......900.......910.......-920.......-930-----------........940-..-.....950.........960.......970...----....980.--.......---------------.990.......1000......1010......1020-----.......1030---------.........1040......1050......1060......1070......1080...-....-1090......1100.-----.....1110......1120....---..1130.......1140.....----.1150--------..-..-.....1160......1170......1180....-----..1190--.---..--....1200......1210......1220.---------.....1230------------------........1240
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MNQIPLKPQNERF
T
D
D
Q
W
Q
A
I
F
DQGD
N
L
L
V
S
ASAGSG
K
T
T
V
L
V
R
R
V
I
E
K
L
---------
K
M---GF
D
I
D
E
L
L
I
V
T
F
T
E
A
A
A
R
E
M
K
E
R
I
Q
E
A
L
Q
E
A
VNSE------------------SD
P
V
R
R
Q
H
FT
K
Q
L
V
L
L
PTA
N
I
S
T
L
H
A
F
C
L
T
V
I
R
R
Y
Y
Y
L
I
D
I
D
P
V
F
R
M
LTDET
E
T
I
L
M
K
E
D
V
W
D
E
L
R
E
A
L
YAEND
E
R
F
F
Q
L
T
M
NFSNDRSD
D
G
L
T
N
L
V
F
S
L
Y
E
F
ARANP
D
P
K
K
W
L
E
Q
L
SDNY--------------R-L
P
E
G
L
--
A
-
K
S
R
L
----
Y
Q
E
QI
R
P
L
V
------------
L
A
D
I
Y
Q
C
V
Q
L
Y
E
-
Q
M
T
Q
L
AQGE
G
L
E
K
M
H
E
Q
VAG
E
Q
Q
Q
--
I
K
N
I
Y
E
A
F
S
Q
D
R
L
E
E
A
Y
A
G
L
E
-
Q
L
T
F
S
T
F
K
S
S
R
K
-
A
E
L
-
K
E
-
I
S
N
E
V
K
G
M
R
------------
D
K
A
K
K
L
I
Q
Q
I
S
K
SYFPV
S
P
S
Q
M
E
E
L
T
D
K
A
---
L
P
L
V
E
E
M
T
K
V
T
Q
S
F
M
D
G
------------
F
S
M
R
K
R
EKGVL
D
F
N
D
L
E
H
L
A
L
Q
I
L
T
-EKTK-DAWL
P
S
E
A
----
S
K
----
H
Y
R
K
K
F
K
E
V
M
V
D
E
Y
Q
D
V
N
Q
L
Q
E
A
I
L
--
Y
W
LREPDDTKG
N
M
F
M
V
G
D
V
K
Q
S
I
Y
S
F
RLADP
S
L
F
I
GKYENFS-KK-EG-G--
R
R
I
V
L
A
E
-
N
F
R
S
R
K
E
V
L
S
F
T
N
L
I
F
E
Q
----LMDP---------AVG-QI
N
Y
D
E
A
A
K
L
--
I
Q
G
F
SDF------PENEQFEP
E
I
M
I
Y
EKEQEESEI-----------EIP
T
D
D
ILEDKTEG
E
-
L
F
M
T
G
L
K
I
R
Q
L
IDS
S
F
M
I
Y
D--KKSKKSRP
I
E
Y
K
D
I
V
L
LTPTKKN
N
L
T
I
L
E
I
F
K
TLDI
P
-
L
E
M
K
D
-
A
Q
N
Y
F
Q
A
T
E
I
R
T
M
I
S
L
L
Q
L
IDNPYQDI
P
L
A
A
V
L
R
SPI
V
G
LIEPEL
A
S
I
R
LAD
R
A
H
--
T
Y
Y
D
A
V
L
A--YQAS--
N
E
-----
D
E
L
A
A
K
L
----------------
E
H
F
G
----
K
Q
L
E
H
W
----
R
E
L
A
R
R---S
S
I
T
D
L
L
W
D
I
Y
YETG
Y
L
E
Y
V
VG--L----PAGAQ-RQ
A
N
L
Y
A
L
V
D
-
R
A
K
A
Y
E
Q
---------
S
----
S
F
R
G
L
Y
Q
F
V
R
F
I
-
E
K
M
Q
E
K
D
K
---
D
L
A--E
P
-
V
-
I
SIED-N
A
--
V
R
V
M
T
I
HASKGLEF
P
V
V
F
L
LD
M
T
-----
K
EF
N
L
Q
D
---
L
R
N
R
Y
A
F
E
E
K
LG-AG
I
R
YMDPE
T
R
V
L
YDTL
P
F
Q
A
I
K
L
V
K
Q
N
K
L
L
S
E
E
M
R
K
L
Y
V
G
LTRA
E
Q
K
L
F
I
V
GSYK
N
K
E
Q
M
I
Q
T
W
S
E
AADHE
E
L
VFDPALRLK
G
R
S
S
L
M
N
-
W
I
G
Y
GLIR
H
P
-
E
-
M
-----------
Q
K
Y
L
E
E
E
I
S
T
S
-
L
L
-QHSNA
Q
--
F
S
I
S
WM
N
Q
Q
S
I
I
E
Q
R
Q
L
L
A
E
K
E
L
V
N
----
L
D
Q
Q
M--K--E
D
E
T
L
L
A
---------------
D
S
L
Q
K
R
L
A
YEYPYQASSQTT
S
Y
Q
S
V
S
E
I
K
R
L
FED------PDDTQE
S
R
------------
L
T
L
ESSQN
K
A
A
S
R
Q
F
R
Y
T
Q
E
QLAE
P
K
F
L
Q
KDRQV
S
A
A
A
V
G
T
A
T
H
A
L
L
Q
LLPL-EMP-
T
T
E
S
-
I
H
Q
K
L
Q
E
L
V
R
K
R
L
V
D
-----
E
K
V
A
K
KV
D
V
S
S
I
I
W
F
F
Q
T
E
L
G
Q
Q
---
L
I
A-NKENVKREQPFSMLL
P
A
D
----
E
V
-----------
F
Q
-DY-PNQED
E
L
L
I
H
G
I
V
D
G
Y
LEEKDH
L
N
I
Y
D
FK
T
D
F
I
-----LHPD
D
---
P
---
A
E
--
I
D
A
I
V
Q
K
Y
Q
G
Q
L
R
L
Y
Q
Q
A
M
S
E
A
LNK
P
V
E
N
---------
V
F
L
I
L
L
R
--------------------
V
K
Q
I
ININK-
46
Fugue
61.43
38%
31
- C2 -
-
3U4Q
-
ADDA_BACSU
A:
[10-1232]
-----------
T
W
T
D
D
Q
W
N
A
I
V
S
T
G
Q
D
I
L
V
A
A
A
A
G
S
G
K
T
A
V
L
V
E
R
M
I
R
K
I
T
AE------
E
N
---
P
I
D
V
D
R
L
L
V
V
T
F
T
N
A
S
A
A
E
M
K
H
R
I
A
E
A
L
E
K
E
L
V
Q
R
------------------
P
G
S
---
L
H
I
R
R
Q
L
S
L
L
N
R
A
S
I
S
T
L
H
S
F
C
L
Q
V
L
K
K
Y
Y
Y
L
I
D
L
D
P
G
F
R
I
-
A
D
Q
T
E
G
E
L
I
G
D
E
V
L
D
E
L
F
E
D
E
Y
A
K
G
E
K
A
F
F
E
L
V
D
R
Y
T
T
D
R
H
D
L
D
L
Q
F
L
V
K
Q
V
Y
E
Y
S
R
S
H
P
N
P
E
A
W
L
E
S
F
V
H
L
Y
--------------
D
-
V
S
E
K
S
--
A
I
E
E
L
P
----
F
Y
Q
Y
V
K
E
D
I
------------
A
M
V
L
N
G
A
K
E
K
L
L
-
R
A
L
E
L
T
---------
D
N
F
L
D
D
L
A
Q
--
I
D
E
L
I
Q
--
H
Q
D
D
F
S
E
L
Y
K
R
V
P
-
A
V
S
D
-------------
P
A
-
L
L
D
E
A
T
D
L
R
------------
N
G
A
K
K
L
L
E
K
L
K
T
D
Y
F
T
R
S
P
E
Q
H
L
K
S
L
A
E
M
---
K
P
V
I
E
T
L
V
Q
L
V
I
S
Y
G
K
R
------------
F
E
A
A
K
Q
E
K
S
I
I
D
F
S
D
L
E
H
Y
C
L
A
I
L
T
-
A
E
N
D
-
R
E
--
P
S
E
A
----
A
R
----
F
Y
Q
E
Q
F
H
E
V
L
V
D
E
Y
Q
D
T
N
L
V
Q
E
S
I
L
--
Q
L
V
T
S
G
P
E
E
T
G
N
L
F
M
V
G
D
V
K
Q
S
I
Y
R
F
R
L
A
E
P
L
L
F
L
S
K
Y
K
R
F
T
-
E
S
-
G
E
-
G
T
G
R
K
I
D
L
N
K
-
N
F
R
S
R
A
D
I
L
D
S
T
N
F
L
F
K
Q
----
L
M
G
G
---------
K
I
G
-
E
V
D
Y
D
E
Q
A
E
L
--
K
L
G
-
A
A
Y
------
P
D
N
D
E
T
E
T
E
L
L
L
I
D
L
---------------------------
E
T
V
Q
F
E
-
A
K
A
I
A
K
E
I
R
K
L
I
S
S
P
F
K
V
Y
K
--
K
T
H
---
R
N
I
Q
Y
R
D
I
V
I
L
L
R
S
M
P
W
A
P
Q
I
M
E
E
L
R
A
Q
G
I
P
-
V
Y
A
N
L
-
T
S
G
Y
F
E
A
V
E
V
A
V
A
L
S
V
L
K
V
I
D
N
P
Y
Q
D
I
P
L
A
S
V
L
R
S
P
I
V
G
A
D
E
N
E
L
S
L
I
R
L
E
N
K
K
A
--
P
Y
Y
E
A
M
K
D
--
Y
L
A
A
--
G
D
RS---
D
E
L
Y
Q
K
L
----------------
N
T
F
Y
----
G
H
L
Q
K
W
----
R
A
F
S
K
N
---
H
S
V
S
E
L
I
W
E
V
Y
R
D
T
K
Y
M
D
Y
V
G
G
--
M
----
P
G
G
K
Q
-
R
Q
A
N
L
R
V
L
Y
D
-
R
A
R
Q
Y
E
S
---------
T
----
A
F
R
G
L
F
R
F
L
R
F
I
-
E
R
M
Q
E
R
G
D
---
Q
-------------
E
-
D
V
--
V
R
L
M
T
I
H
S
S
K
G
L
E
F
P
V
V
F
V
A
G
L
G
-----
R
N
F
N
M
M
D
---
L
N
K
S
Y
L
L
D
K
E
L
G
-
F
G
T
K
Y
I
H
P
Q
L
R
I
S
Y
P
T
L
P
L
I
A
M
K
K
K
M
R
R
E
L
L
S
E
E
L
R
V
L
Y
V
A
L
T
R
A
K
E
K
L
F
L
I
G
S
C
K
D
H
Q
K
Q
L
A
K
W
Q
A
S
A
S
Q
T
D
W
L
L
P
E
F
D
R
Y
Q
A
R
T
-
Y
L
D
-
F
I
G
P
A
L
A
R
H
R
-
H
-
A
-----------
D
I
S
G
H
P
-------------
A
R
--
F
A
V
Q
M
I
H
S
Y
D
S
E
R
L
E
A
I
---------------
R
R
--
G
--
E
P
V
F
A
F
D
---------------
E
K
A
R
E
Q
L
S
W
T
Y
P
H
Q
E
V
T
Q
I
R
T
K
Q
S
V
S
D
E
Y
-------------------------------------------------
S
G
R
Y
R
R
P
A
F
M
M
K
-
K
G
L
T
A
A
E
K
G
T
A
M
H
T
V
M
Q
H
I
P
L
-
S
H
V
P
S
I
E
E
-
A
E
Q
T
V
H
R
L
Y
E
K
E
L
L
T
-----
E
E
Q
K
D
A
I
D
I
E
E
I
V
Q
F
F
H
T
E
I
G
G
Q
---
L
I
--
G
A
K
W
K
D
R
E
I
P
F
S
L
A
L
P
A
K
----
E
I
-----------
Y
P
-
D
A
-
H
E
A
D
E
P
L
L
V
Q
G
I
I
D
C
L
Y
E
T
E
D
G
L
Y
L
L
A
Y
K
S
D
R
I
------
E
G
G
F
---
E
---
G
A
--
A
P
I
L
K
K
R
Y
E
T
Q
I
Q
L
Y
T
K
A
V
E
Q
I
A
K
T
K
V
K
G
---------
C
A
L
Y
F
F
D
--------------------
G
G
H
I
L
T
L
---
3
PsiBlast_PDB
61.29
36%
30
- C2 -
-
4CEJ
1
ADDA_BACSU
A:
[10-1232]
-----------
T
W
T
D
D
Q
W
N
A
I
V
S
T
G
Q
D
I
L
V
A
A
A
A
G
S
G
K
T
A
V
L
V
E
R
M
I
R
K
I
---------
T
A
EE
N
P
I
D
V
D
R
L
L
V
V
T
F
T
N
A
S
A
A
E
M
K
H
R
I
A
E
A
L
E
K
E
L
V
Q
R
------------------
P
G
S
L
---
H
I
R
R
Q
L
S
L
L
N
R
A
S
I
S
T
L
H
S
F
C
L
Q
V
L
K
K
Y
Y
Y
L
I
D
L
D
P
G
F
R
-
I
A
D
Q
T
E
G
E
L
I
G
D
E
V
L
D
E
L
F
E
D
E
Y
A
K
G
E
K
A
F
F
E
L
V
D
R
Y
T
T
D
R
H
D
L
D
L
Q
F
L
V
K
Q
V
Y
E
Y
S
R
S
H
P
N
P
E
A
W
L
E
S
F
V
H
L
Y
--------------
D
-
V
S
E
K
S
--
A
-
I
E
E
L
PFY
Q
Y
V
K
E
D
I
A
M
V
------------
L
N
G
A
K
E
K
L
L
R
A
L
-
E
L
T
K
A
P
G
G
P
A
--
P
R
A
D
N
F
L
D
D
L
A
Q
--
I
D
E
L
I
Q
--
H
Q
D
D
F
S
E
L
Y
K
R
V
P
-
A
V
S
F
K
R
A
K
A
V
K
G
-
D
E
F
D
P
A
-
L
L
D
E
A
T
D
L
R
------------
N
G
A
K
K
L
L
E
K
L
K
T
D
Y
F
T
R
S
P
E
Q
H
L
K
S
L
A
E
M
---
K
P
V
I
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T
L
V
Q
L
V
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S
Y
G
K
R
------------
F
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A
A
K
Q
E
K
S
I
I
D
F
S
D
L
E
H
Y
C
L
A
I
L
T
A
E
N
D
K
-
G
E
R
E
P
S
E
A
----
A
R
----
F
Y
Q
E
Q
F
H
E
V
L
V
D
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Y
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T
N
L
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Q
E
S
I
L
--
Q
L
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P
E
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N
L
F
M
V
G
D
V
K
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S
I
Y
R
F
R
L
A
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P
L
L
F
L
S
K
Y
K
R
F
T
-
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S
G
E
G
T
G
--
R
K
I
D
L
N
K
-
N
F
R
S
R
A
D
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L
D
S
T
N
F
L
F
K
Q
----
L
M
G
G
---------
K
I
G
-
E
V
D
Y
D
E
Q
A
E
L
--
K
L
G
-
A
A
Y
------
P
D
N
D
E
T
E
T
E
L
L
L
I
D
------------------------
E
L
--
E
T
V
Q
F
E
-
A
K
A
I
A
K
E
I
R
K
L
I
S
S
P
F
K
V
Y
D
--
G
K
K
K
T
H
R
N
I
Q
Y
R
D
I
V
I
L
L
R
S
M
P
W
A
P
Q
I
M
E
E
L
R
A
Q
G
I
P
-
V
Y
A
N
L
-
T
S
G
Y
F
E
A
V
E
V
A
V
A
L
S
V
L
K
V
I
D
N
P
Y
Q
D
I
P
L
A
S
V
L
R
S
P
I
V
G
A
D
E
N
E
L
S
L
I
R
L
E
N
K
K
A
--
P
Y
Y
E
A
M
K
D
--
Y
L
A
A
--
G
D
RS---
D
E
L
Y
Q
K
L
----------------
N
T
F
Y
----
G
H
L
Q
K
W
----
R
A
F
S
K
N
---
H
S
V
S
E
L
I
W
E
V
Y
R
D
T
K
Y
M
D
Y
V
G
G
--
M
----
P
G
G
K
Q
-
R
Q
A
N
L
R
V
L
Y
D
-
R
A
R
Q
Y
E
S
---------
T
----
A
F
R
G
L
F
R
F
L
R
F
I
-
E
R
M
Q
E
R
G
D
---
D
L
G
--
T
A
R
G
-
L
S
E
Q
E
-
D
V
--
V
R
L
M
T
I
H
S
S
K
G
L
E
F
P
V
V
F
V
A
G
L
G
-----
R
N
F
N
M
M
D
---
L
N
K
S
Y
L
L
D
K
E
L
G
-
F
G
T
K
Y
I
H
P
Q
L
R
I
S
Y
P
T
L
P
L
I
A
M
K
K
K
M
R
R
E
L
L
S
E
E
L
R
V
L
Y
V
A
L
T
R
A
K
E
K
L
F
L
I
G
S
C
K
D
H
Q
K
Q
L
A
K
W
Q
A
S
A
S
Q
T
D
W
L
L
P
E
F
D
R
Y
Q
A
R
T
Y
L
-
D
-
F
I
G
P
A
L
A
R
H
R
-
D
-
L
-------------------
H
A
D
-
I
S
-
G
H
P
-
A
R
--
F
A
V
Q
M
I
H
S
Y
D
L
L
D
------------------
E
R
M
--
E
--
E
K
S
E
R
L
E
A
I
R
R
GEPVPGSFAF
D
E
K
A
R
E
Q
L
S
W
T
Y
P
H
Q
E
V
T
Q
I
R
T
K
Q
S
V
S
E
I
K
R
-----------------------------------------
Y
R
R
----------
P
A
F
M
M
K
-
K
G
L
T
A
A
E
K
G
T
A
M
H
T
V
M
Q
H
I
P
L
S
H
V
P
-
S
I
E
E
-
A
E
Q
T
V
H
R
L
Y
E
K
E
L
L
T
-----
E
E
Q
K
D
A
I
D
I
E
E
I
V
Q
F
F
H
T
E
I
G
G
Q
---
L
I
G
-
A
K
W
K
-
D
R
E
I
P
F
S
L
A
L
P
A
K
----
E
I
-----------
Y
P
-
D
A
-
H
E
A
D
E
P
L
L
V
Q
G
I
I
D
C
L
Y
E
T
E
D
G
L
Y
L
L
A
Y
K
S
D
R
I
EGK--
F
Q
H
G
F
---
E
---
G
A
--
A
P
I
L
K
K
R
Y
E
T
Q
I
Q
L
Y
T
K
A
V
E
Q
I
A
K
T
K
V
K
G
---------
C
A
L
Y
F
F
D
--------------------
G
G
H
I
L
T
L
---
2
PsiBlast_PDB
60.62
36%
17
- C2 -
-
3U4Q
-
ADDA_BACSU
A:
[10-1232]
-----------
T
W
T
D
D
Q
W
N
A
I
V
S
T
G
Q
D
I
L
V
A
A
A
A
G
S
G
K
T
A
V
L
V
E
R
M
I
R
K
I
---------
T
A
EE
N
P
I
D
V
D
R
L
L
V
V
T
F
T
N
A
S
A
A
E
M
K
H
R
I
A
E
A
L
E
K
E
L
V
Q
R
------------------
P
G
S
L
---
H
I
R
R
Q
L
S
L
L
N
R
A
S
I
S
T
L
H
S
F
C
L
Q
V
L
K
K
Y
Y
Y
L
I
D
L
D
P
G
F
R
-
I
A
D
Q
T
E
G
E
L
I
G
D
E
V
L
D
E
L
F
E
D
E
Y
A
K
G
E
K
A
F
F
E
L
V
D
R
Y
T
T
D
R
H
D
L
D
L
Q
F
L
V
K
Q
V
Y
E
Y
S
R
S
H
P
N
P
E
A
W
L
E
S
F
V
H
L
Y
--------------
D
-
V
S
E
K
S
--
A
-
I
E
E
L
PFY
Q
Y
V
K
E
D
I
A
M
V
------------
L
N
G
A
K
E
K
L
L
R
A
L
-
E
L
T
------------
D
N
F
L
D
D
L
A
Q
--
I
D
E
L
I
Q
--
H
Q
D
D
F
S
E
L
Y
K
R
V
P
-
A
V
S
-------------D
P
A
-
L
L
D
E
A
T
D
L
R
------------
N
G
A
K
K
L
L
E
K
L
K
T
D
Y
F
T
R
S
P
E
Q
H
L
K
S
L
A
E
M
---
K
P
V
I
E
T
L
V
Q
L
V
I
S
Y
G
K
R
------------
F
E
A
A
K
Q
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K
S
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D
L
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Y
C
L
A
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N
D
----
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P
S
E
A
----
A
R
----
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Y
Q
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H
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S
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Y
R
F
R
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P
L
L
F
L
S
K
Y
K
R
F
T
-
E
S
G
E
G
T
G
--
R
K
I
D
L
N
K
-
N
F
R
S
R
A
D
I
L
D
S
T
N
F
L
F
K
Q
----
L
M
G
G
---------
K
I
G
-
E
V
D
Y
D
E
Q
A
E
L
--
K
L
G
-
A
A
Y
------
P
D
N
D
E
T
E
T
E
L
L
L
I
D
-------------------------
L
--
E
T
V
Q
F
E
-
A
K
A
I
A
K
E
I
R
K
L
I
S
S
P
F
K
V
Y
-----
K
K
T
H
R
N
I
Q
Y
R
D
I
V
I
L
L
R
S
M
P
W
A
P
Q
I
M
E
E
L
R
A
Q
G
I
P
-
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Y
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N
L
-
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S
G
Y
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A
V
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V
A
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A
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S
V
L
K
V
I
D
N
P
Y
Q
D
I
P
L
A
S
V
L
R
S
P
I
V
G
A
D
E
N
E
L
S
L
I
R
L
E
N
K
K
A
--
P
Y
Y
E
A
M
K
D
--
Y
L
A
A
--
G
D
RS---
D
E
L
Y
Q
K
L
----------------
N
T
F
Y
----
G
H
L
Q
K
W
----
R
A
F
S
K
N
---
H
S
V
S
E
L
I
W
E
V
Y
R
D
T
K
Y
M
D
Y
V
G
G
--
M
----
P
G
G
K
Q
-
R
Q
A
N
L
R
V
L
Y
D
-
R
A
R
Q
Y
E
S
---------
T
----
A
F
R
G
L
F
R
F
L
R
F
I
-
E
R
M
Q
E
R
G
D
----------------
Q
E
-
D
V
--
V
R
L
M
T
I
H
S
S
K
G
L
E
F
P
V
V
F
V
A
G
L
G
-----
R
N
F
N
M
M
D
---
L
N
K
S
Y
L
L
D
K
E
L
G
-
F
G
T
K
Y
I
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Q
L
R
I
S
Y
P
T
L
P
L
I
A
M
K
K
K
M
R
R
E
L
L
S
E
E
L
R
V
L
Y
V
A
L
T
R
A
K
E
K
L
F
L
I
G
S
C
K
D
H
Q
K
Q
L
A
K
W
Q
A
S
A
S
Q
T
D
W
L
L
P
E
F
D
R
Y
Q
A
R
T
Y
L
-
D
-
F
I
G
P
A
L
A
R
H
R
-----------------------
H
A
D
-
I
S
-
G
H
P
-
A
R
--
F
A
V
Q
M
I
H
S
Y
D
-------------------------------
S
E
R
L
E
A
I
R
RGEPVFAF
D
---
E
K
A
R
E
Q
L
S
W
T
Y
P
H
Q
E
V
T
Q
I
R
T
K
Q
S
V
S
----------------
D
E
Y
S
G
R
-----------------------
Y
R
R
----------
P
A
F
M
M
K
-
K
G
L
T
A
A
E
K
G
T
A
M
H
T
V
M
Q
H
I
P
L
S
H
V
P
-
S
I
E
E
-
A
E
Q
T
V
H
R
L
Y
E
K
E
L
L
T
-----
E
E
Q
K
D
A
I
D
I
E
E
I
V
Q
F
F
H
T
E
I
G
G
Q
---
L
I
G
-
A
K
W
K
-
D
R
E
I
P
F
S
L
A
L
P
A
K
----
E
I
-----------
Y
P
-
D
A
-
H
E
A
D
E
P
L
L
V
Q
G
I
I
D
C
L
Y
E
T
E
D
G
L
Y
L
L
A
Y
K
S
D
R
I
EG------
G
F
---
E
---
G
A
--
A
P
I
L
K
K
R
Y
E
T
Q
I
Q
L
Y
T
K
A
V
E
Q
I
A
K
T
K
V
K
G
---------
C
A
L
Y
F
F
D
--------------------
G
G
H
I
L
T
L
---
1
PsiBlast_PDB
60.60
36%
18
- C2 -
-
3U44
-
ADDA_BACSU
A:
[10-1232]
-----------
T
W
T
D
D
Q
W
N
A
I
V
S
T
G
Q
D
I
L
V
A
A
A
A
G
S
G
K
T
A
V
L
V
E
R
M
I
R
K
I
---------
T
A
EE
N
P
I
D
V
D
R
L
L
V
V
T
F
T
N
A
S
A
A
E
M
K
H
R
I
A
E
A
L
E
K
E
L
V
Q
R
------------------
P
G
S
L
---
H
I
R
R
Q
L
S
L
L
N
R
A
S
I
S
T
L
H
S
F
C
L
Q
V
L
K
K
Y
Y
Y
L
I
D
L
D
P
G
F
R
-
I
A
D
Q
T
E
G
E
L
I
G
D
E
V
L
D
E
L
F
E
D
E
Y
A
K
G
E
K
A
F
F
E
L
V
D
R
Y
T
T
D
R
H
D
L
D
L
Q
F
L
V
K
Q
V
Y
E
Y
S
R
S
H
P
N
P
E
A
W
L
E
S
F
V
H
L
Y
--------------
D
-
V
S
E
K
S
--
A
-
I
E
E
L
PFY
Q
Y
V
K
E
D
I
A
M
V
------------
L
N
G
A
K
E
K
L
L
R
A
L
-
E
L
T
------------
D
N
F
L
D
D
L
A
Q
--
I
D
E
L
I
Q
--
H
Q
D
D
F
S
E
L
Y
K
R
V
P
-
A
V
S
-------------D
P
A
-
L
L
D
E
A
T
D
L
R
------------
N
G
A
K
K
L
L
E
K
L
K
T
D
Y
F
T
R
S
P
E
Q
H
L
K
S
L
A
E
M
---
K
P
V
I
E
T
L
V
Q
L
V
I
S
Y
G
K
R
------------
F
E
A
A
K
Q
E
K
S
I
I
D
F
S
D
L
E
H
Y
C
L
A
I
L
T
A
E
N
D
----
R
E
P
S
E
A
----
A
R
----
F
Y
Q
E
Q
F
H
E
V
L
V
D
E
Y
Q
D
T
N
L
V
Q
E
S
I
L
--
Q
L
V
T
S
G
P
E
E
T
G
N
L
F
M
V
G
D
V
K
Q
S
I
Y
R
F
R
L
A
E
P
L
L
F
L
S
K
Y
K
R
F
T
-
E
S
G
E
G
T
G
--
R
K
I
D
L
N
K
-
N
F
R
S
R
A
D
I
L
D
S
T
N
F
L
F
K
Q
----
L
M
G
G
---------
K
I
G
-
E
V
D
Y
D
E
Q
A
E
L
--
K
L
G
-
A
A
Y
------
P
D
N
D
E
T
E
T
E
L
L
L
I
D
-------------------------
L
--
E
T
V
Q
F
E
-
A
K
A
I
A
K
E
I
R
K
L
I
S
S
P
F
K
V
Y
-----
K
K
T
H
R
N
I
Q
Y
R
D
I
V
I
L
L
R
S
M
P
W
A
P
Q
I
M
E
E
L
R
A
Q
G
I
P
-
V
Y
A
N
L
-
T
S
G
Y
F
E
A
V
E
V
A
V
A
L
S
V
L
K
V
I
D
N
P
Y
Q
D
I
P
L
A
S
V
L
R
S
P
I
V
G
A
D
E
N
E
L
S
L
I
R
L
E
N
K
K
A
--
P
Y
Y
E
A
M
K
D
--
Y
L
A
A
--
G
D
RS---
D
E
L
Y
Q
K
L
----------------
N
T
F
Y
----
G
H
L
Q
K
W
----
R
A
F
S
K
N
---
H
S
V
S
E
L
I
W
E
V
Y
R
D
T
K
Y
M
D
Y
V
G
G
--
M
----
P
G
G
K
Q
-
R
Q
A
N
L
R
V
L
Y
D
-
R
A
R
Q
Y
E
S
---------
T
----
A
F
R
G
L
F
R
F
L
R
F
I
-
E
R
M
Q
E
R
G
D
----------------
Q
E
-
D
V
--
V
R
L
M
T
I
H
S
S
K
G
L
E
F
P
V
V
F
V
A
G
L
G
-----
R
N
F
N
M
M
D
---
L
N
K
S
Y
L
L
D
K
E
L
G
-
F
G
T
K
Y
I
H
P
Q
L
R
I
S
Y
P
T
L
P
L
I
A
M
K
K
K
M
R
R
E
L
L
S
E
E
L
R
V
L
Y
V
A
L
T
R
A
K
E
K
L
F
L
I
G
S
C
K
D
H
Q
K
Q
L
A
K
W
Q
A
S
A
S
Q
T
D
W
L
L
P
E
F
D
R
Y
Q
A
R
T
Y
L
-
D
-
F
I
G
P
A
L
A
R
H
R
-----------------------
H
A
D
-
I
S
-
G
H
P
-
A
R
--
F
A
V
Q
M
I
H
S
Y
D
-------------------------------
S
E
R
L
E
A
I
R
R
GEPVFAF
D
---
E
K
A
R
E
Q
L
S
W
T
Y
P
H
Q
E
V
T
Q
I
R
T
K
Q
S
V
S
----------------
D
E
Y
S
G
R
-----------------------
Y
R
R
----------
P
A
F
M
M
K
-
K
G
L
T
A
A
E
K
G
T
A
M
H
T
V
M
Q
H
I
P
L
S
H
V
P
-
S
I
E
E
-
A
E
Q
T
V
H
R
L
Y
E
K
E
L
L
T
-----
E
E
Q
K
D
A
I
D
I
E
E
I
V
Q
F
F
H
T
E
I
G
G
Q
---
L
I
G
-
A
K
W
K
-
D
R
E
I
P
F
S
L
A
L
P
A
K
----
E
I
-----------
Y
P
-
D
A
-
H
E
A
D
E
P
L
L
V
Q
G
I
I
D
C
L
Y
E
T
E
D
G
L
Y
L
L
A
Y
K
S
D
R
I
EG------
G
F
---
E
---
G
A
--
A
P
I
L
K
K
R
Y
E
T
Q
I
Q
L
Y
T
K
A
V
E
Q
I
A
K
T
K
V
K
G
---------
C
A
L
Y
F
F
D
--------------------
G
G
H
I
L
T
L
---
26
HHSearch
59.50
37%
29
- C2 -
-
4CEJ
1
ADDA_BACSU
A:
[10-1231]
-----------
T
W
T
D
D
Q
W
N
A
I
V
S
T
G
Q
D
I
L
V
A
A
A
A
G
S
G
K
T
A
V
L
V
E
R
M
I
R
K
I
---------
T
A
EE
N
P
I
D
V
D
R
L
L
V
V
T
F
T
N
A
S
A
A
E
M
K
H
R
I
A
E
A
L
E
K
E
L
V
Q
R
---------------------
P
G
S
L
H
I
R
R
Q
L
S
L
L
N
R
A
S
I
S
T
L
H
S
F
C
L
Q
V
L
K
K
Y
Y
Y
L
I
D
L
D
P
G
F
R
I
A
-
D
Q
T
E
G
E
L
I
G
D
E
V
L
D
E
L
F
E
D
E
Y
A
K
G
E
K
A
F
F
E
L
V
D
R
Y
T
T
D
R
H
D
L
D
L
Q
F
L
V
K
Q
V
Y
E
Y
S
R
S
H
P
N
P
E
A
W
L
E
S
F
V
H
L
Y
DVSEKSAIEELPFY
Q
Y
V
K
E
D
I
A
M
V
-
L
N
G
A
----
K
E
K
L
-
L
R
A
L
E
L
T
K
APGGPAPR
A
D
N
F
L
D
D
L
A
Q
I
D
-
E
L
I
Q
H
-
Q
D
-
D
F
S
E
L
Y
K
R
V
P
-
A
V
-
S
--
F
K
R
------
A
K
A
V
K
G
D
--------------------
E
F
-
D
P
A
L
L
D
E
A
T
D
L
R
------------
N
G
A
K
K
L
L
E
K
L
K
T
D
Y
F
T
R
S
P
E
Q
H
L
K
S
L
A
E
M
---
K
P
V
I
E
T
L
V
Q
L
V
I
S
Y
G
K
R
------------
F
E
A
A
K
Q
E
K
S
I
I
D
F
S
D
L
E
H
Y
C
L
A
I
L
T
-
A
E
N
D
K
G
E
R
E
P
S
E
A
----
A
R
----
F
Y
Q
E
Q
F
H
E
V
L
V
D
E
Y
Q
D
T
N
L
V
Q
E
S
I
L
--
Q
L
V
T
S
G
P
E
E
T
G
N
L
F
M
V
G
D
V
K
Q
S
I
Y
R
F
R
L
A
E
P
L
L
F
L
S
K
Y
K
R
F
T
E
S
G
E
G
T
-
G
--
R
K
I
D
L
N
K
-
N
F
R
S
R
A
D
I
L
D
S
T
N
F
L
F
K
Q
----
L
M
G
G
---------
K
I
G
-
E
V
D
Y
D
E
Q
A
E
L
KL
G
A
A
Y
P
---------
D
N
D
E
T
E
T
E
L
L
L
I
D
--------------------------
E
L
E
T
V
Q
F
E
-
A
K
A
I
A
K
E
I
R
K
L
I
S
S
P
F
K
V
Y
D
--
G
K
K
K
T
H
R
N
I
Q
Y
R
D
I
V
I
L
L
R
S
M
P
W
A
P
Q
I
M
E
E
L
R
A
Q
G
I
P
-
V
Y
A
N
L
-
T
S
G
Y
F
E
A
V
E
V
A
V
A
L
S
V
L
K
V
I
D
N
P
Y
Q
D
I
P
L
A
S
V
L
R
S
P
I
V
G
A
D
E
N
E
L
S
L
I
R
L
E
N
K
K
A
--
P
Y
Y
E
A
M
K
D
--
Y
L
A
A
GD
R
S
-----
D
E
L
Y
Q
K
L
----------------
N
T
F
Y
----
G
H
L
Q
K
W
----
R
A
F
S
K
N
---
H
S
V
S
E
L
I
W
E
V
Y
R
D
T
K
Y
M
D
Y
V
G
G
--
M
----
P
G
G
K
Q
-
R
Q
A
N
L
R
V
L
Y
D
-
R
A
R
Q
Y
E
S
---------
T
----
A
F
R
G
L
F
R
F
L
R
F
I
-
E
R
M
Q
E
R
G
D
---
D
L
G
--
T
A
-
R
G
L
S
E
Q
E
-
D
V
--
V
R
L
M
T
I
H
S
S
K
G
L
E
F
P
V
V
F
V
A
G
L
G
-----
R
N
-
F
N
M
M
---
D
L
N
K
S
Y
L
L
D
K
E
L
G
F
G
T
K
Y
I
H
P
Q
L
R
I
S
Y
P
T
L
P
L
I
A
M
K
K
K
M
R
R
E
L
L
S
E
E
L
R
V
L
Y
V
A
L
T
R
A
K
E
K
L
F
L
I
G
S
C
K
D
H
Q
K
Q
L
A
K
W
----------
Q
A
--------
S
A
S
Q
T
D
W
L
L
P
E
F
D
R
Y
Q
A
R
T
Y
L
D
F
I
G
P
A
L
A
RH
R
D
L
------
H
A
-
D
I
----
S
----
G
H
P
A
R
F
A
V
Q
M
I
H
S
Y
D
L
L
D
--
E
R
M
E
E
KS
E
R
L
E
A
I
R
R
G
E
PV
P
G
S
F
A
F
D
---------------
E
K
A
R
E
Q
L
S
W
T
Y
P
H
Q
E
V
T
Q
I
R
T
K
Q
S
V
S
E
I
K
R
--------------------------------
Y
R
R
P
-------------------
A
F
M
M
-
K
K
G
L
T
A
A
E
K
G
T
A
M
H
T
V
M
Q
H
I
P
L
-
S
H
V
-
P
S
I
E
E
A
E
Q
T
V
H
R
L
Y
E
K
E
L
L
T
-----
E
E
Q
K
D
A
I
D
I
E
E
I
V
Q
F
F
H
T
E
I
G
G
Q
---
L
I
--
G
A
K
W
K
D
R
E
I
P
F
S
L
A
L
P
A
K
----
E
I
-----------
Y
P
-
D
A
-
H
E
A
D
E
P
L
L
V
Q
G
I
I
D
C
L
Y
E
T
E
D
G
L
Y
L
L
A
Y
K
S
D
R
I
-----
E
G
K
F
Q
H
G
F
E
---
G
A
--
A
P
I
L
K
K
R
Y
E
T
Q
I
Q
L
Y
T
K
A
V
E
Q
I
A
K
T
K
V
K
G
---------
C
A
L
Y
F
F
D
--------------------
G
G
H
I
L
T
----
25
HHSearch
57.91
37%
36
- C2 -
-
3U4Q
-
ADDA_BACSU
A:
[10-1231]
-----------
T
W
T
D
D
Q
W
N
A
I
V
S
T
G
Q
D
I
L
V
A
A
A
A
G
S
G
K
T
A
V
L
V
E
R
M
I
R
K
I
---------
T
A
EE
N
P
I
D
V
D
R
L
L
V
V
T
F
T
N
A
S
A
A
E
M
K
H
R
I
A
E
A
L
E
K
E
L
V
Q
R
---------------------
P
G
S
L
H
I
R
R
Q
L
S
L
L
N
R
A
S
I
S
T
L
H
S
F
C
L
Q
V
L
K
K
Y
Y
Y
L
I
D
L
D
P
G
F
R
I
A
-
D
Q
T
E
G
E
L
I
G
D
E
V
L
D
E
L
F
E
D
E
Y
A
K
G
E
K
A
F
F
E
L
V
D
R
Y
T
T
D
R
H
D
L
D
L
Q
F
L
V
K
Q
V
Y
E
Y
S
R
S
H
P
N
P
E
A
W
L
E
S
F
V
H
L
Y
DVSEKSAIEELPFY
Q
Y
V
K
E
D
I
A
M
V
-
L
N
G
A
----
K
E
K
L
-
L
R
A
L
E
L
T----------
D
N
F
L
D
D
L
A
Q
I
D
-
E
L
I
Q
H
-
Q
D
-
D
F
S
E
L
Y
K
R
V
P
-
A
V
-
S
-----------------------------------------
D
P
A
L
L
D
E
A
T
D
L
R
------------
N
G
A
K
K
L
L
E
K
L
K
T
D
Y
F
T
R
S
P
E
Q
H
L
K
S
L
A
E
M
---
K
P
V
I
E
T
L
V
Q
L
V
I
S
Y
G
K
R
------------
F
E
A
A
K
Q
E
K
S
I
I
D
F
S
D
L
E
H
Y
C
L
A
I
L
T
-
A
E
N
D
---
R
E
P
S
E
A
----
A
R
----
F
Y
Q
E
Q
F
H
E
V
L
V
D
E
Y
Q
D
T
N
L
V
Q
E
S
I
L
--
Q
L
V
T
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G
P
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E
T
G
N
L
F
M
V
G
D
V
K
Q
S
I
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R
F
R
L
A
E
P
L
L
F
L
S
K
Y
K
R
F
T
E
S
G
E
G
T
-
G
--
R
K
I
D
L
N
K
-
N
F
R
S
R
A
D
I
L
D
S
T
N
F
L
F
K
Q
----
L
M
G
G
---------
K
I
G
-
E
V
D
Y
D
E
Q
A
E
L
KL
G
A
A
Y
P
---------
D
N
D
E
T
E
T
E
L
L
L
I
D
---------------------------
L
E
T
V
Q
F
E
-
A
K
A
I
A
K
E
I
R
K
L
I
S
S
P
F
K
V
Y
-----
K
K
T
H
R
N
I
Q
Y
R
D
I
V
I
L
L
R
S
M
P
W
A
P
Q
I
M
E
E
L
R
A
Q
G
I
P
-
V
Y
A
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L
-
T
S
G
Y
F
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A
V
E
V
A
V
A
L
S
V
L
K
V
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Q
D
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P
L
A
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V
L
R
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A
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L
S
L
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R
L
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N
K
K
A
--
P
Y
Y
E
A
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K
D
--
Y
L
A
A
GD
R
S
-----
D
E
L
Y
Q
K
L
----------------
N
T
F
Y
----
G
H
L
Q
K
W
----
R
A
F
S
K
N
---
H
S
V
S
E
L
I
W
E
V
Y
R
D
T
K
Y
M
D
Y
V
G
G
--
M
----
P
G
G
K
Q
-
R
Q
A
N
L
R
V
L
Y
D
-
R
A
R
Q
Y
E
S
---------
T
----
A
F
R
G
L
F
R
F
L
R
F
I
-
E
R
M
Q
E
R
G
D
----------------
Q
E
-
D
V
--
V
R
L
M
T
I
H
S
S
K
G
L
E
F
P
V
V
F
V
A
G
L
G
-----
R
N
-
F
N
M
M
---
D
L
N
K
S
Y
L
L
D
K
E
L
G
F
G
T
K
Y
I
H
P
Q
L
R
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Y
P
T
L
P
L
I
A
M
K
K
K
M
R
R
E
L
L
S
E
E
L
R
V
L
Y
V
A
L
T
R
A
K
E
K
L
F
L
I
G
S
C
K
D
H
Q
K
Q
L
A
K
W
----------
Q
A
--------
S
A
S
Q
T
D
W
L
L
P
E
F
D
R
Y
Q
A
R
T
Y
L
D
F
I
G
P
A
L
A
R
H
R
--------
H
A
-
D
I
----
S
----
G
H
P
A
R
F
A
V
Q
M
I
H
S
Y
D
----------S
E
R
-
L
E
A
I
R
RG
E
PV---
F
A
F
D
---------------
E
K
A
R
E
Q
L
S
W
T
Y
P
H
Q
E
V
T
Q
I
R
T
K
Q
S
V
S
--------DEYSGR----------------------
Y
R
R
P
-------------------
A
F
M
M
-
K
K
G
L
T
A
A
E
K
G
T
A
M
H
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P
L
-
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-
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A
E
Q
T
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H
R
L
Y
E
K
E
L
L
T
-----
E
E
Q
K
D
A
I
D
I
E
E
I
V
Q
F
F
H
T
E
I
G
G
Q
---
L
I
--
G
A
K
W
K
D
R
E
I
P
F
S
L
A
L
P
A
K
----
E
I
-----------
Y
P
-
D
A
-
H
E
A
D
E
P
L
L
V
Q
G
I
I
D
C
L
Y
E
T
E
D
G
L
Y
L
L
A
Y
K
S
D
R
I
-----
E
G
---GF-
E
---
G
A
--
A
P
I
L
K
K
R
Y
E
T
Q
I
Q
L
Y
T
K
A
V
E
Q
I
A
K
T
K
V
K
G
---------
C
A
L
Y
F
F
D
--------------------
G
G
H
I
L
T
----
32
HHSearch
43.55
24%
18
- C2 -
-
4C2U
2
?
A:
[6-632]
-----
G
P
D
L
L
Q
A
L
N
P
T
Q
A
Q
A
A
D
H
F
T
G
P
A
L
V
I
A
G
A
G
S
G
K
T
R
T
L
I
Y
R
I
A
H
L
I
---------
G
H
Y--
G
V
H
P
G
E
I
L
A
V
T
F
T
N
K
A
A
A
E
M
R
E
R
A
G
H
L
V
P
G
--------------------------------------
A
G
D
L
W
M
S
T
F
H
S
A
G
V
R
I
L
R
T
Y
G
E
H
I
G
L
R
R
G
F
V
I
Y
-
D
D
D
D
Q
L
D
I
I
K
E
V
M
G
S
I
P
G
-----------------------
E
T
Q
P
R
V
I
R
------------------------------------------------------------------------------
G
I
I
D
R
A
--------
K
S
N
L
W
--
T
-------------------------
P
D
D
L
D
R
S
-----------------------------------------------------
R
E
P
------------------------
F
I
S
G
L
P
R
D
A
A
A
E
A
Y
R
R
------------
Y
E
V
R
K
K
G
Q
N
A
I
D
F
G
D
L
I
T
E
T
V
R
L
F
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-
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V
P
--------
G
V
----
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----
K
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Q
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K
A
K
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V
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L
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--
R
L
L
A
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R
---
D
R
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L
L
V
V
G
D
P
D
Q
S
I
Y
K
F
R
G
A
D
I
Q
N
I
L
D
F
Q
K
D
Y
-----
P
D
-
A
--
K
V
Y
M
L
E
H
-
N
Y
R
S
S
A
R
V
L
E
A
A
N
K
L
I
E
N
----
N
T
E
R
---------
L
D
K
-
T
--------
L
--
K
P
V
K
-----------
E
A
G
Q
P
V
T
F
H
R
A
-----------------------------
T
D
H
R
A
E
-
G
D
Y
V
A
D
W
L
T
R
L
H
G
E
---------------
G
R
A
W
S
E
M
A
I
L
Y
R
T
N
A
Q
S
R
V
I
E
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S
L
R
R
V
Q
I
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-
A
R
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V
G
-
G
V
G
F
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A
Y
A
R
L
A
L
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P
A
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D
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A
L
R
R
I
I
G
R
P
R
R
G
I
G
D
T
A
L
Q
K
L
M
E
W
A
R
T
H
HT
S
V
L
T
A
C
A
N
--
A
A
E
Q
N-
I
L
-----
D
R
G
A
H
K
A
----------------
T
E
F
A
----
G
L
M
E
A
M
----
S
E
A
A
D
N
---
Y
E
P
A
A
F
L
R
F
V
M
E
T
S
G
Y
L
D
L
L
R
Q
--
E
G---
Q
E
G
Q
V
-
R
L
E
N
L
E
E
L
V
S
-
A
A
E
E
W
S
Q
---------
D
EAN-
V
G
G
S
I
A
D
F
L
D
D
A
-
A
L
L
S
S
V
D
D
M
R
T
K
A
E
--
N
----
K
G
A
P
E
-
D
A
--
V
T
L
M
T
L
H
N
A
K
G
L
E
F
P
V
V
F
I
V
G
V
E
-----
Q
G
L
L
P
S
K
---
G
A
---
I
-
A
------------------------------
E
G
P
S
G
I
E
E
E
R
R
L
F
Y
V
G
I
T
R
A
M
E
R
L
L
M
T
A
A
Q
N
R
M
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
HHSearch
39.32
24%
15
* C2 *
-
1UAA
1
REP_ECOLI
A:
[2-616]
-----------
R
L
N
P
G
Q
Q
Q
A
V
E
F
V
T
G
P
C
L
V
L
A
G
A
G
S
G
K
T
R
V
I
T
N
K
I
A
H
L
I
---------
R
G
C--
G
Y
Q
A
R
H
I
A
A
V
T
F
T
N
K
A
A
R
E
M
K
E
R
V
G
Q
T
L
G
R
K
E
------------------------------------
A
R
G
L
M
I
S
T
F
H
T
L
G
L
D
I
I
K
R
E
Y
A
A
L
G
M
K
A
N
F
S
L
F
-
D
D
T
D
Q
L
A
L
L
K
E
L
T
E
G
L
I
E
D
D
---------------------
K
V
L
L
Q
Q
------------------------------------------------------------------
L
------------
I
S
T
I
S
N
W
--------------------
K
N
D
------------------
L
K
T
P
S
Q
------------------------------------------------------
A
A
A
------------------------
S
A
I
G
E
R
D
R
I
F
A
H
C
Y
G
L
------------
Y
D
A
H
L
K
A
C
N
V
L
D
F
D
D
L
I
L
L
P
T
L
L
L
Q
-
A
N
E
--------
E
V
----
R
K
----
R
W
Q
N
K
I
R
Y
L
L
V
D
E
Y
Q
D
T
N
T
S
Q
Y
E
L
V
--
K
L
L
V
G
S
---
R
A
R
F
T
V
V
G
D
D
D
Q
S
I
Y
S
W
R
G
A
R
P
Q
N
L
V
L
L
S
Q
D
F
-----
P
A
-
L
--
K
V
I
K
L
E
Q
-
N
Y
R
S
S
G
R
I
L
K
A
A
N
I
L
I
A
N
----
N
P
H
V
---------
F
E
K
---------
R
L
--
F
S
E
L
-----------
G
Y
G
A
E
L
K
V
L
S
A
-----------------------------
N
N
E
E
H
E
-
A
E
R
V
T
G
E
L
I
A
H
H
F
V
--------------
N
K
T
Q
Y
K
D
Y
A
I
L
Y
R
G
N
H
Q
S
R
V
F
E
K
F
L
M
Q
N
R
I
P
-
Y
K
I
S
G
-
G
T
S
F
F
S
R
P
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I
K
D
L
L
A
Y
L
R
V
L
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N
P
D
D
D
S
A
F
L
R
I
V
N
T
P
K
R
E
I
G
P
A
T
L
K
K
L
G
E
W
A
M
T
R
NK
S
M
F
T
A
S
F
D
MG
L
S
Q
T
--
L
S
-----
G
R
G
Y
E
A
L
----------------
T
R
F
T
----
H
W
L
A
E
I
----
Q
R
L
-
A
E
---
R
E
P
I
A
A
V
R
D
L
I
H
G
M
D
Y
E
S
W
L
Y
E
--
T
SPS
P
K
A
A
E
M
-
R
M
K
N
V
N
Q
L
F
S
-
W
M
T
E
M
L
E
---------
G
SELD
E
P
M
T
L
T
Q
V
V
T
R
F
-
T
L
R
D
M
M
E
R
--------------
E
E
E
L
-
D
Q
--
V
Q
L
M
T
L
H
A
S
K
G
L
E
F
P
Y
V
Y
M
V
G
M
E
-----
E
G
F
L
P
H
Q
---
S
S
I
D
------------------------------------
E
D
N
I
D
E
E
R
R
L
A
Y
V
G
I
T
R
A
Q
K
E
L
T
F
T
L
C
K
E
R
R
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
27
HHSearch
37.70
18%
16
- C2 -
-
1W36
-
RECB_ECOLI
B:
[329-1124]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
T
R
A
L
A
E
I
R
E
T
------------
V
A
R
E
K
R
R
R
G
E
L
G
F
D
D
M
L
S
R
L
D
S
A
L
R
-
S
E
S
------
G
E
V
L
----
A
A
----
A
I
R
T
R
F
P
V
A
M
I
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E
F
Q
D
T
D
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Q
Q
Y
R
I
F
--
R
R
I
W
H
H
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-
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A
L
L
L
I
G
D
P
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Q
A
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Y
A
F
R
G
A
D
I
F
T
Y
M
K
A
R
S
E
V
--------
H
--
A
H
Y
T
L
D
T
-
N
W
R
S
A
P
G
M
V
N
S
V
N
K
L
F
S
Q
----
T
D
D
A
---------
F
M
F
R
E
I
P
F
I
P
---
V
--
K
S
A
G
K
N
Q
ALRFVF
K
G
E
T
Q
P
A
M
K
M
W
L
M
E
G
E
-
S
--------------------
C
G
V
G
D
Y
Q
S
T
M
-
A
Q
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C
A
A
Q
I
R
D
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L
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A
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M
N
G
D
D
A
R
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R
A
S
D
I
S
V
L
V
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R
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A
A
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D
A
L
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L
L
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-
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V
Y
L
S
N
R
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L
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A
Q
E
M
L
W
L
L
Q
A
V
M
T
P
E
R
E
N
T
L
R
S
A
L
A
T
S
M
M
G
L
N
A
L
D
I
E
T
L
N
N
D
E
H
-----
A
W
D
-------------------------------------------
V
V
V
----
E
E
F
D
G
Y
----
R
Q
I
W
R
K
---
R
G
V
M
P
M
L
R
A
L
M
S
A
R
N
I
A
E
N
L
L
A
--
T
----
A
G
G
E
R
-
R
L
T
D
I
L
H
I
S
E
-
L
L
Q
E
A
G
T
---------
Q
-----
L
E
S
E
H
A
L
V
R
W
L
-
S
Q
H
I
L
E
P
D
---
S
N
A
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Q
Q
-
M
R
L
E
S
D
K
-
H
L
--
V
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I
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I
H
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S
K
G
L
E
Y
P
L
V
W
L
P
F
I
T
NFRVQ
E
Q
A
F
Y
H
D
---
R
H
S
F
E
A
V
L
D
L
N
A
-
A
P
------------------
E
S
V
D
L
A
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A
E
R
L
A
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D
L
R
L
L
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A
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S
V
W
H
C
S
L
G
V
A
P
L
V
R
R
R
G
D
K
K
G
------
D
T
D
V
H
Q
--------
S
A
L
G
R
-
L
L
Q
K
G
E
P
Q
D
A
-
A
--------------
G
-
L
R
T
C
I
E
A
L
C
D
D
D
I
A
W
Q
T
A
QT
G
D
N
Q
P
W
Q
V
N
-------------------------------
D
V
S
-
T
A
----------------
E
L
--
N
-----
A
K
T
L
Q
R
L
P
G
D
N
W
R
V
T
S
Y
S
G
L
Q
Q
R
------
G
H
G
I
A
Q
D
L
MPRLDVDAAGVA
S
V
V
E
E
P
-------------------
T
L
T
P
-
H
Q
F
P
R
G
A
S
P
G
T
F
L
H
S
L
F
E
D
L
D
F
-
T
Q
P
-
V
D
P
----
N
W
V
R
E
K
L
E
L
G
G
F
E
------
S
Q
W
E
P
V
L
T
E
W
I
T
A
V
L
Q
A
P
L
N
E
T
GVS
L
S
Q
L
S
A
R
N
K
Q
V
E
M
E
F
Y
L
P
I
S
E
P
LIAS
Q
L
DTLIRQFDPLS
A
G
C
P
P
L
E
F
M
Q
V
R
G
M
L
K
G
F
I
D
L
V
F
R
H
E
G
R
Y
Y
L
L
D
Y
K
S
N
W
L
-----
G
E
D
S
S
---
A
YTQ
Q
A
MA
A
A
M
Q
A
H
R
Y
D
L
Q
Y
Q
L
Y
T
L
A
L
H
R
Y
L
R
H
--------------------------------------------------
47
Fugue
35.16
15%
31
- C2 -
-
1W36
-
RECB_ECOLI
B:
[1-1174]
-----
M
S
D
V
A
E
T
L
D
P
L
R
L
P
L
----
Q
G
E
R
L
I
E
A
S
A
G
T
G
K
T
F
T
I
A
A
L
Y
L
R
L
L
LGLGGSAAF
P
R
---
P
L
T
V
E
E
L
L
V
V
T
F
T
E
A
A
T
A
E
L
R
G
R
I
R
S
N
I
H
E
L
R
I
A
C
LRETTDNPLYERLLEEID
D
K
A
Q
A
A
Q
W
L
L
L
A
E
R
Q
M
D
E
A
A
V
F
T
I
H
G
F
C
Q
R
M
L
N
L
N
A
F
E
S
G
M
L
F
E
Q
Q
L
I
E
D
E
---
S
L
L
R
Y
Q
A
C
A
D
F
W
R
R
H
C
Y
P
L
P
R
E
I
A
Q
V
V
F
E
T
W
K
G
------------------
P
Q
A
L
L
R
D
I
N
R
Y
L
Q
G
E
A
--------------
P
-
V
I
K
A
P
--
P
-
P
D
D
E
----
T
L
A
S
R
H
A
Q
I
------------
V
A
R
I
D
T
V
K
Q
Q
W
R
-
D
A
V
G
E
L
D
A
L
I
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S
S
G
I
D
R
R
K
F
N
R
S
N
--
Q
A
K
W
I
D
K
I
S
A
W
A
E
E
E
T
N
S
Y
Q
L
-
P
E
S
L
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K
P
R
H
P
L
F
-
E
A
I
-
D
Q
-
L
L
A
E
P
L
S
I
-----------------------------------------------
R
D
L
V
I
T
R
A
L
A
E
I
R
E
T
------------
V
A
R
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K
R
R
R
G
E
L
G
F
D
D
M
L
S
R
L
D
S
A
L
R
-
S
E
S
------
G
E
V
L
----
A
A
----
A
I
R
T
R
F
P
V
A
M
I
D
E
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D
T
D
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--
R
R
I
W
H
-
H
Q
P
E
T
A
L
L
L
I
G
D
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K
Q
A
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Y
A
F
R
G
A
D
I
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T
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M
K
A
R
S
E
V
H
-
A
---------
H
Y
T
L
D
T
-
N
W
R
S
A
P
G
M
V
N
S
V
N
K
L
F
S
Q
TDDA
F
M
F
R
---------
E
I
P
-
F
I
P
V
K
S
A
G
K
N
--
Q
A
L
R
F
V
F
------
K
G
E
T
Q
P
A
M
K
M
W
L
M
E
G
E
S
C
-----------------
G
V
G
D
Y
Q
S
T
M
A
Q
V
C
-
A
A
Q
I
R
D
W
L
Q
A
G
Q
R
G
E
--
A
L
L
--
M
N
G
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A
R
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M
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T
L
N
N
D
--------------------------------
E
H
A
W
----------------
D
V
V
V
----
E
E
F
D
G
Y
----
R
Q
I
W
R
K
---
R
G
V
M
P
M
L
R
A
L
M
S
A
R
N
I
A
E
N
L
L
A
--
T
----
A
G
G
E
R
-
R
L
T
D
I
L
H
I
S
E
-
L
L
Q
E
A
G
T
---------
Q
LE--
S
E
H
A
L
V
R
W
L
S
Q
H
-
I
L
E
P
D
S
N
A
---
S
S
Q
--
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M
-
R
-
L
E
S
D
K
-
H
L
--
V
Q
I
V
T
I
H
K
S
K
G
L
E
Y
P
L
V
W
L
P
F
I
T
-----
N
F
R
V
Q
E
Q
---
A
--------------
F
Y
H
D
R
H
S
F
E
A
V
L
D
L
N
A
A
P
E
S
V
D
L
A
E
A
E
R
L
A
E
D
L
R
L
L
Y
V
A
L
T
R
S
V
W
H
C
S
L
G
V
A
P
L
V
R
R
R
G
D
K
K
G
D
T
D
V
H
Q
---------------
S
A
L
G
-
R
L
L
Q
K
G
E
P
Q
D
-------------------
A
A
G
L
R
T
C
-
I
E
-
A
L
C
D
D
D
--
I
A
W
Q
T
A
Q
T
G
D
--------------
N
----
Q
P
W
Q
V
--
N
--
D
V
S
T
A
E
L
---------------
N
A
K
T
L
Q
R
L
P
G
D
N
W
R
V
T
S
Y
S
G
L
Q
Q
R
G
H
G
I
A
Q
D
L
M
P
------
R
L
D
V
D
A
A
G
------------
V
A
S
V
V
E
E
P
T
L
T
P
H
Q
F
P
R
G
A
S
P
G
T
F
L
H
S
L
F
E
D
L
D
F
T
Q
P
V
D
P
N
W
V
R
E
K
L
E
L
G
G
F
-
E
S
Q
-
W
E
P
V
-
L
T
E
W
I
T
A
V
L
Q
A
P
L
N
E
TGVSL
S
Q
L
S
A
R
N
K
Q
V
E
M
E
F
Y
L
P
I
S
E
P
L
I
---
A
S
Q
-
L
D
T
L
I
R
Q
F
D
P
L
S
A
G
C
P
----------------------
P
L
-
E
F
M
Q
V
R
G
M
L
K
G
F
I
D
L
V
F
R
H
E
G
R
Y
Y
L
L
D
Y
K
S
N
W
L
GEDSS
A
Y
T
Q
Q
---
A
---
M
A
--
A
A
M
Q
A
H
R
Y
D
L
Q
Y
Q
L
Y
T
L
A
L
H
R
Y
L
R
H
R
I
A
D
YDYEHHFGG
V
I
Y
L
F
L
R
GVDKEHPQQGIYTTRPNAGL
I
A
L
M
D
E
M
F
A
G
7
PsiBlast_PDB
34.82
23%
43
- C2 -
-
4C2U
2
?
A:
[83-636]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
A
G
-
D
L
W
M
S
T
F
H
S
A
G
V
-
R
I
L
-
R
T
-
Y
G
E
H
I
-
G
L
R
RG
F
V
I
Y
D
D
D
D
Q
L
D
I
I
K
E
V
M
G
S
I
P
G
---
E
T
Q
P
R
V
I
R
G
I
I
D
R
A
K
S
N
L
W
T
P
D
D
L
D
R
S
R
E
P
F
I
S
G
LP
R
D
A
A
A
E
A
Y
R
R
Y
E
V
R
K
K
G
Q
N
A
I
D
F
G
D
L
I
T
E
T
V
R
L
F
K
-
E
-------
V
P
G
V
L
----
D
K
-----
V
Q
N
K
A
K
F
I
H
V
D
E
Y
Q
D
T
N
R
A
Q
Y
E
L
T
--
R
L
L
A
S
R
D
R
---
N
L
L
V
V
G
D
P
D
Q
S
I
Y
K
F
R
G
A
D
----
I
Q
N
I
L
D
F
Q
-
K
D
-
Y
P
-
D
--
A
K
V
Y
M
L
E
H
N
Y
R
S
S
A
R
V
L
E
A
A
N
K
L
I
E
N
-----------------------
N
T
E
R
L
D
K
T
--
L
K
-----------
P
V
K
E
A
G
Q
P
-
V
T
F
H
R
A
T
D
H
R
A
E
G
-----------
D
Y
V
A
D
W
L
T
R
L
H
G
E
G
R
-
A
W
-----------
S
E
M
A
I
L
Y
--
R
T
N
A
Q
S
R
V
I
E
------------------
E
S
L
R
R
V
Q
I
P
-
A
R
I
V
G
-
G
V
G
F
Y
D
R
R
E
I
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D
I
L
A
Y
A
R
L
A
L
N
P
A
D
D
V
A
L
R
R
I
I
G
R
P
R
R
G
I
G
D
T
A
L
Q
--
K
L
M
E
W
A
R
--
T
H
H
T
S
V
L
T
--
A
C
A
N
--
A
A
EQNIL
D
R
G
A
H
K
A
----------------
T
E
F
A
----
G
L
M
E
A
M
----
S
E
A
A
D
N
---
Y
E
P
A
A
F
L
R
F
V
M
E
T
S
G
Y
L
D
L
L
R
Q
--
E
----
G
Q
E
G
Q
V
R
L
E
N
L
E
E
L
V
S
-
A
A
E
E
W
S
Q
DEANVGGS
I
A
----
D
F
L
D
D
A
A
L
L
S
S
V
-
D
D
M
R
T
K
A
E
---
N
K
G
--
A
P
-------
E
-
D
A
--
V
T
L
M
T
L
H
N
A
K
G
L
E
F
P
V
V
F
I
V
-----------------------
G
V
E
Q
G
L
------------------
L
P
S
K
G
-
A
I
A
E
G
P
S
G
I
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E
E
R
R
L
F
Y
V
G
I
T
R
A
M
E
R
L
L
M
T
A
A
-
Q
N
R
M
Q
F
G
K
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
33.62
23%
52
- C2 -
-
4C30
1
?
A:
[83-636]
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
A
G
-
D
L
W
M
S
T
F
H
S
A
G
V
-
R
I
L
-
R
T
-
Y
G
E
H
I
-
G
L
R
R
G
F
V
I
Y
D
D
D
D
Q
L
D
I
I
K
E
V
M
G
S
I
P
G
I
G
A
E
T
Q
P
R
V
I
R
G
I
I
D
R
A
K
S
N
L
W
T
P
D
D
L
D
R
S
R
E
P
----P
R
D
A
A
A
E
A
Y
R
R
-
Y
E
V
R
K
K
G
Q
N
A
I
D
F
G
D
L
I
T
E
T
V
R
L
F
K
-
E
-------
V
P
G
V
L
----
D
K
-----
V
Q
N
K
A
K
F
I
H
V
D
E
Y
Q
D
T
N
R
A
Q
Y
E
L
T
--
R
L
L
A
S
R
D
R
---
N
L
L
V
V
G
D
P
D
Q
S
I
Y
K
F
R
G
A
D
----
I
Q
N
I
L
D
F
Q
-
K
D
-
Y
P
-
D
--
A
K
V
Y
M
L
E
H
N
Y
R
S
S
A
R
V
L
E
A
A
N
K
L
I
E
N
-----------------------
N
T
E
R
L
D
K
T
--
L
K
-----------
P
V
K
E
A
G
Q
P
-
V
T
F
H
R
A
T
D
H
R
A
E
G
-----------
D
Y
V
A
D
W
L
T
R
L
H
G
E
G
R
-
A
W
-----------
S
E
M
A
I
L
Y
--
R
T
N
A
Q
S
R
V
I
E
------------------
E
S
L
R
R
V
Q
I
P
-
A
R
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G
-
G
V
G
F
Y
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R
R
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A
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A
L
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A
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D
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R
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G
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A
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--
K
L
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W
A
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--
T
H
H
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S
V
L
T
--
A
C
A
N
------------
A
H
K
A
----------------
T
E
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A
----
G
L
M
E
A
M
----
S
E
A
A
D
N
---
Y
E
P
A
A
F
L
R
F
V
M
E
T
S
G
Y
L
D
L
L
R
Q
--
E
----
G
Q
E
G
Q
V
R
L
E
N
L
E
E
L
V
S
-
A
A
E
E
W
S
Q
D
EAI-----
A
----
D
F
L
D
D
A
A
L
L
S
S
V
-
D
D
M
R
T
K
A
E
---------
P
-------
E
-
D
A
--
V
T
L
M
T
L
H
N
A
K
G
L
E
F
P
V
V
F
I
V
-----------------------
G
V
E
Q
G
L
------------------
L
P
S
K
G
-
A
I
A
E
G
P
S
G
I
E
E
E
R
R
L
F
Y
V
G
I
T
R
A
M
E
R
L
L
M
T
A
A
-
Q
N
R
M
Q
F
G
K
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
33.34
24%
17
- C2 -
-
4C2T
1
?
A:
[184-636]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
Y
E
V
R
K
K
G
Q
N
A
I
D
F
G
D
L
I
T
E
T
V
R
L
F
K
-
E
-------
V
P
G
V
L
----
D
K
-----
V
Q
N
K
A
K
F
I
H
V
D
E
Y
Q
D
T
N
R
A
Q
Y
E
L
T
--
R
L
L
A
S
R
D
R
---
N
L
L
V
V
G
D
P
D
Q
S
I
Y
K
F
R
G
A
D
----
I
Q
N
I
L
D
F
Q
-
K
D
-
Y
P
-
D
--
A
K
V
Y
M
L
E
H
N
Y
R
S
S
A
R
V
L
E
A
A
N
K
L
I
E
N
-----------------------
N
T
E
R
L
D
K
T
--
L
K
-----------
P
V
K
E
A
G
Q
P
-
V
T
F
H
R
A
T
D
H
R
A
E
G
-----------
D
Y
V
A
D
W
L
T
R
L
H
G
E
G
R
-
A
W
-----------
S
E
M
A
I
L
Y
--
R
T
N
A
Q
S
R
V
I
E
------------------
E
S
L
R
R
V
Q
I
P
-
A
R
I
V
G
-
G
V
G
F
Y
D
R
R
E
I
R
D
I
L
A
Y
A
R
L
A
L
N
P
A
D
D
V
A
L
R
R
I
I
G
R
P
R
R
G
I
G
D
T
A
L
Q
--
K
L
M
E
W
A
R
--
T
H
H
T
S
V
L
T
--
A
C
A
N
--
A
A
EQNIL
D
R
G
A
H
K
A
----------------
T
E
F
A
----
G
L
M
E
A
M
----
S
E
A
A
D
N
---
Y
E
P
A
A
F
L
R
F
V
M
E
T
S
G
Y
L
D
L
L
R
Q
E
-
G
----
Q
E
G
Q
V
-
R
L
E
N
L
E
E
L
V
S
-
A
A
E
E
W
S
Q
DEANVGGS
I
A
----
D
F
L
D
D
A
A
L
L
S
S
---
D
M
R
T
K
A
------------------
E
-
D
A
--
V
T
L
M
T
L
H
N
A
K
G
L
E
F
P
V
V
F
I
V
G
V
-----------------------
E
Q
G
L
------------------
L
P
S
K
G
-
A
I
A
E
G
P
S
G
I
E
E
E
R
R
L
F
Y
V
G
I
T
R
A
M
E
R
L
L
M
T
A
A
-
Q
N
R
M
Q
F
G
K
T
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
32.14
22%
37
- C2 -
-
1UAA
1
REP_ECOLI
A:
[25-607]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
S
--
G
-
K
T
R
V
----
I
T
N
K
I
A
H
L
I
------------
R
G
C
G
Y
Q
A
R
H
I
A
A
V
T
F
T
N
K
A
A
R
E
M
K
E
R
V
G
Q
T
L
G
R
K
E
A
R
G
L
M
I
S
T
F
H
T
L
G
L
D
I
I
K
R
E
Y
A
A
L
G
M
K
A
N
F
S
L
F
D
D
T
D
Q
L
A
L
L
-
K
E
-
L
T
---
E
G
L
I
------------
E
D
D
K
V
L
L
Q
Q
L
I
-
S
T
I
S
N
W
K
N
D
L
K
T
P
S
Q
A
A
---
A
S
A
I
G
E
R
D
R
I
F
A
H
C
Y
G
L
------------
Y
D
A
H
L
K
A
C
N
V
L
D
F
D
D
L
I
L
L
P
T
L
L
L
Q
-
A
N
--------
E
E
V
----
R
K
----
R
W
Q
N
K
I
R
Y
L
L
V
D
E
Y
Q
D
T
N
T
S
Q
Y
E
L
V
--
K
L
L
V
---
G
S
R
A
R
F
T
V
V
G
D
D
D
Q
S
I
Y
S
W
R
G
A
R
P
Q
N
L
V
L
L
S
Q
D
F
P
-
A
L
-------
K
V
I
K
L
E
Q
-
N
Y
R
S
S
G
R
I
L
K
A
A
N
I
L
I
A
N
------
N
P
---------
H
V
F
-
E
K
R
L
-----------
F
S
E
L
------
G
----
Y
G
A
E
L
K
V
L
S
A
N
N
E
E
H
E
A
-----------
E
---------
R
V
T
G
E
-----------
L
I
A
H
H
F
V
-----------
N
K
T
Q
Y
K
D
Y
A
I
L
Y
R
G
N
H
Q
S
R
V
F
E
K
F
L
M
Q
N
R
I
P
-
Y
K
I
S
G
-
G
T
S
F
F
S
R
P
E
I
K
D
L
L
A
Y
L
R
V
L
T
N
P
D
D
D
S
A
F
L
R
I
V
N
T
P
K
R
E
I
G
P
A
T
L
K
--
K
L
G
E
W
A
M
--
T
R
N
K
S
M
----
F
T
A
S
--
F
D
-----
M
G
L
S
Q
T
L
----------------
S
G
R
G
Y
E
A
L
T
R
F
T
H
W
L
A
E
I
Q
R
L
A
E
R
E
P
I
A
A
V
R
D
L
I
H
G
M
D
Y
E
S
W
L
Y
E
T
S
P
S
--
P
----
K
A
A
E
M
-
R
M
K
N
V
N
Q
L
F
S
W
M
T
E
M
L
E
G
---------
S
----
E
L
D
E
P
M
T
L
T
Q
V
V
-
T
R
F
T
L
--
R
---
D
M
M
--
E
R
-----
E
E
E
L
D
Q
--
V
Q
L
M
T
L
H
A
S
K
G
L
E
F
P
Y
V
Y
M
V
G
M
E
-----
E
G
F
------------------------------------
L
P
H
Q
S
-
S
I
D
E
D
N
--
I
D
E
E
R
R
L
A
Y
V
G
I
T
R
A
Q
K
E
L
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
29.70
21%
34
- C2 -
-
5MBV
-
?
B:
[329-839]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
T
R
A
L
A
E
I
R
E
T
------------
V
A
R
E
K
R
R
R
G
E
L
G
F
D
D
M
----
L
S
R
L
-------
D
S
A
L
R
S
E
S
----
G
E
V
L
A
A
A
I
R
T
R
F
P
V
A
M
I
D
E
F
Q
D
T
D
P
Q
Q
Y
R
I
F
R
R
I
W
H
H
Q
P
E
T
A
---
L
L
L
I
G
D
P
K
Q
A
I
Y
A
F
R
G
A
D
I
F
T
Y
M
K
-----
A
-
R
S
-
E
V
-
H
--
A
H
Y
T
L
D
T
-
N
W
R
S
A
P
G
M
V
N
S
V
N
K
L
F
S
Q
----
T
D
D
A
FMFRE
I
P
F
I
P
V
K
-
S
A
G
K
N
Q
A
L
R
F
--
V
-----
F
------
K
G
E
T
Q
--
P
A
M
K
M
W
L
M
E
G
E
S
C
G
V
G
D
Y
Q
S
T
M
A
Q
V
C
A
A
Q
I
R
D
W
L
Q
A
G
Q
R
G
E
A
L
L
M
N
G
--------------------
D
D
A
R
P
V
R
A
S
D
I
S
V
L
V
R
S
R
Q
E
A
A
Q
V
R
D
A
L
T
L
L
E
I
P
S
V
Y
L
S
N
-
R
D
S
V
F
E
T
L
E
A
Q
E
M
L
W
L
L
Q
A
V
M
T
P
E
R
E
N
T
L
R
S
A
L
A
T
S
M
M
G
L
N
A
L
D
I
E
T
L
N
N
D
E
H
A
-----
W
D
V
V
V
-----------------------------------------------
E
E
F
D
G
Y
----
R
Q
I
W
R
K
---
R
G
V
M
P
M
L
R
A
L
M
S
A
R
N
I
A
E
N
L
L
A
--
T
----
A
G
G
E
R
-
R
L
T
D
I
L
H
I
S
E
-
L
L
Q
E
-
A
G
---------
T
----
Q
L
E
S
E
H
A
L
V
R
W
L
S
Q
H
I
L
E
P
D
S
---
N
A
S
--
S
Q
-
Q
-
M
R
L
E
S
-
D
K
H
L
V
Q
I
V
T
I
H
K
S
K
G
L
E
Y
P
L
V
W
L
P
F
I
T
-----
N
-
F
R
V
Q
E
Q
A
F
Y
H
D
R
H
S
F
E
A
V
L
D
--------------
L
N
A
A
P
-
E
S
V
D
L
A
E
A
E
R
-
L
A
E
D
L
R
L
L
Y
V
A
L
T
R
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
29.14
21%
27
- C2 -
-
5LD2
1
RECB_ECOLI
B:
[329-775]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
I
T
R
A
L
A
E
I
R
E
T
------------
V
A
R
E
K
R
R
R
G
E
L
G
F
D
D
M
----
L
S
R
L
-------
D
S
A
L
R
S
E
S
GEVL
A
A
----
A
I
R
T
R
F
P
V
A
M
I
D
E
F
Q
D
T
D
P
Q
Q
Y
R
I
F
RR
I
W
H
H
Q
P
E
T
A
---
L
L
L
I
G
D
P
K
Q
A
I
Y
A
F
R
G
A
D
I
F
T
Y
M
K
-----
A
-
R
S
-
E
V
-
H
--
A
H
Y
T
L
D
T
-
N
W
R
S
A
P
G
M
V
N
S
V
N
K
L
F
S
Q
----
T
D
D
A
FMFREIPFI
P
V
K
-
S
A
G
K
N
Q
A
L
R
F
--
V
-----
F
------
K
G
E
T
Q
--
P
A
M
K
M
W
L
M
E
G
E
S
C
G
V
GDYQSTMAQVC
A
A
Q
I
R
D
W
L
Q
A
G
Q
R
G
E
A
L
L
M
N
G
--------------------
D
D
A
R
P
V
R
A
S
D
I
S
V
L
V
R
S
R
Q
E
A
A
Q
V
R
D
A
L
T
L
L
E
I
P
S
V
Y
L
S
N
-
R
D
S
V
F
E
T
L
E
A
Q
E
M
L
W
L
L
Q
A
V
M
T
P
E
R
E
N
T
L
R
S
A
L
A
T
S
M
M
G
L
N
A
L
D
I
E
T
L
N
N
D
E
H
A
-----
W
D
V
V
V
-----------------------------------------------
E
E
F
D
G
Y
----
R
Q
I
W
R
K
---
R
G
V
M
P
M
L
R
A
L
M
S
A
R
N
I
A
E
N
L
L
A
--
T
----
A
G
G
E
R
-
R
L
T
D
I
L
H
I
S
E
-
L
L
Q
E
-
A
G
---------
T
----
Q
L
E
S
E
H
A
L
V
R
W
L
S
Q
H
I
L
E
P
D
S
---
N
A
S
--
S
Q
-
Q
-
M
R
L
E
S
-
D
K
HL
V
Q
I
V
T
I
H
K
S
K
G
L
E
Y
P
L
V
W
L
P
F
I
T
-----
N
-
F
R
V
Q
E
QAF
Y
H
D
R
H
S
F
E
A
V
L
D
--------------
L
N
A
A
P
-
E
S
V
D
L
A
E
A
E
R
-
L
A
E
D
L
R
L
L
Y
V
A
L
T
R
S
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
28.99
25%
-21
- C2 -
-
3PJR
2
?
A:
[190-580]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
D
F
D
D
L
I
M
T
T
I
Q
L
F
--
D
R
V
P
-
D
V
L
----------
H
----
Y
Y
Q
Y
K
F
Q
Y
I
H
I
D
E
Y
Q
D
T
N
R
A
Q
Y
T
L
V
--
K
K
L
A
E
R
F
Q
---
N
I
C
A
V
G
D
A
D
Q
S
I
Y
R
W
R
G
A
D
----
I
Q
N
I
L
S
F
E
-
R
D
-
Y
P
-
N
--
A
K
V
I
L
L
E
Q
N
Y
R
S
T
K
R
I
L
Q
A
A
N
E
V
I
E
H
-----------------------
N
V
N
R
K
P
K
R
--
I
-----
W
------
T
E
N
P
E
G
K
P
-
I
L
Y
Y
E
A
M
N
E
A
D
E
A
-----------
Q
F
V
A
G
R
I
R
E
A
V
E
R
G
E
-
R
------------------------------
R
Y
R
D
F
A
V
L
Y
R
T
N
A
Q
S
R
V
M
E
E
M
L
L
K
A
N
I
P
-
Y
Q
I
V
G
-
G
L
K
F
Y
D
R
K
E
I
K
D
I
L
A
Y
L
R
V
I
A
N
P
D
D
D
L
S
L
L
R
I
I
N
V
P
K
R
G
I
-------------
G
A
--
S
T
I
D
K
L
V
R
--
Y
A
A
D
--
H
E
-----
L
S
L
F
E
A
L
G
E
L
EM
I
G
L
G
A
K
A
A
G
A
L
A
A
F
R
----
S
Q
L
E
Q
W
----
T
Q
L
Q
E
Y
---
V
S
V
T
E
L
V
E
E
V
L
D
K
S
G
Y
R
E
M
L
K
A
ER
T
----
I
E
A
Q
S
-
R
L
E
N
L
D
E
F
L
S
-
V
T
K
H
F
E
N
V--------
S
----
D
D
K
S
L
I
A
F
L
T
D
L
-
A
L
I
S
D
L
D
----
E
-----
T
-
E
-
Q
A
A
E
G
-
D
A
--
V
M
L
M
T
L
H
A
A
K
G
L
E
F
P
V
V
F
L
I
G
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
28.96
25%
-25
- C2 -
-
1QHG
1
PCRA_GEOSE
A:
[190-580]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
D
F
D
D
L
I
M
T
T
I
Q
L
F
--
D
R
V
P
-
D
V
L
----------
H
----
Y
Y
Q
Y
K
F
Q
Y
I
H
I
D
E
Y
Q
D
T
N
R
A
Q
Y
T
L
V
--
K
K
L
A
E
R
F
Q
---
N
I
C
A
V
G
D
A
D
Q
S
I
Y
R
W
R
G
A
D
----
I
Q
N
I
L
S
F
E
-
R
D
-
Y
P
-
N
--
A
K
V
I
L
L
E
Q
N
Y
R
S
T
K
R
I
L
Q
A
A
N
E
V
I
E
H
-----------------------
N
V
N
R
K
P
K
R
--
I
-----
W
------
T
E
N
P
E
G
K
P
-
I
L
Y
Y
E
A
M
N
E
A
D
E
A
-----------
Q
F
V
A
G
R
I
R
E
A
V
E
R
G
E
-
R
------------------------------
R
Y
R
D
F
A
V
L
Y
R
T
N
A
Q
S
R
V
M
E
E
M
L
L
K
A
N
I
P
-
Y
Q
I
V
G
-
G
L
K
F
Y
D
R
K
E
I
K
D
I
L
A
Y
L
R
V
I
A
N
P
D
D
D
L
S
L
L
R
I
I
N
V
P
K
R
G
I
-------------
G
A
--
S
T
I
D
---------------------
L
F
E
A
L
G
E
LEMIGLG
A
K
A
A
G
A
L
A
A
F
R
----
S
Q
L
E
Q
W
----
T
Q
L
Q
E
Y
---
V
S
V
T
E
L
V
E
E
V
L
D
K
S
G
Y
R
E
M
L
K
A
E
R
T
----
I
E
A
Q
S
-
R
L
E
N
L
D
E
F
L
S
-
V
T
K
H
F
E
N
V
--------
S
----
D
D
K
S
L
I
A
F
L
T
D
L
-
A
L
I
S
---------------------
G
-
D
A
--
V
M
L
M
T
L
H
A
A
K
G
L
E
F
P
V
V
F
L
I
G
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
28.79
25%
-24
- C2 -
-
1PJR
-
PCRA_GEOSE
A:
[190-580]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
L
D
F
D
D
L
I
M
T
T
I
Q
L
F
--
D
R
V
P
-
D
V
L
----------
H
----
Y
Y
Q
Y
K
F
Q
Y
I
H
I
D
E
Y
Q
D
T
N
R
A
Q
Y
T
L
V
--
K
K
L
A
E
R
F
Q
---
N
I
C
A
V
G
D
A
D
Q
S
I
Y
R
W
R
G
A
D
----
I
Q
N
I
L
S
F
E
-
R
D
-
Y
P
-
N
--
A
K
V
I
L
L
E
Q
N
Y
R
S
T
K
R
I
L
Q
A
A
N
E
V
I
E
H
-----------------------
N
V
N
R
K
P
K
R
--
I
-----
W
------
T
E
N
P
E
G
K
P
-
I
L
Y
Y
E
A
M
N
E
A
D
E
A
-----------
Q
F
V
A
G
R
I
R
E
A
V
E
R
G
E
-
R
------------------------------
R
Y
R
D
F
A
V
L
Y
R
T
N
A
Q
S
R
V
M
E
E
M
L
L
K
A
N
I
P
-
Y
Q
I
V
G
-
G
L
K
F
Y
D
R
K
E
I
K
D
I
L
A
Y
L
R
V
I
A
N
P
D
D
D
L
S
L
L
R
I
I
N
V
P
K
R
G
I
-------------
G
A
--
S
T
I
D
---------------------
L
F
E
A
L
G
E
LEMIGLG
A
K
A
A
G
A
L
A
A
F
R
----
S
Q
L
E
Q
W
----
T
Q
L
Q
E
Y
---
V
S
V
T
E
L
V
E
E
V
L
D
K
S
G
Y
R
E
M
L
K
A
E
R
T
----
I
E
A
Q
S
-
R
L
E
N
L
D
E
F
L
S
-
V
T
K
H
F
E
N
V
--------
S
----
D
D
K
S
L
I
A
F
L
T
D
L
-
A
L
I
S
---------------------
G
-
D
A
--
V
M
L
M
T
L
H
A
A
K
G
L
E
F
P
V
V
F
L
I
G
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
28.74
70%
-328
- C2 -
-
2PJR
1
?
B:
[2-25]
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
A
--
V
M
L
M
T
L
H
A
A
K
G
L
E
F
P
V
V
F
L
I
G
M
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------