@TOME V2.3
(Nov 2016)
Ref.
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Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : PA4117: (2016-02-23 )
MTSITPVTLANCEDEPIHVPGAIQPHGALVTLRADGMVLAASENIQALLGFVASPGSYLTQEQVGPEVLRMLEEGLTGNGPWSNSVETRIGEHLFDVIGHSYKEVFYLEFEIRTADTLSITSFTLNAQRIIAQVQLHNDTASLLSNVTDELRRMTGYDRVMAYRFRHDDSGEVVAESRREDLESYLGQRYPASDIPAQARRLYIQNPIRLIADVAYTPMRVFPALNPETNESFDLSYSVLRSVSPIHCEYLTNMGVRASMSISIVVGGKLWGLFSCHHMSPKLIPYPVRMSFQIFSQVCSAIVERLEQGRIAELLRVSTERRLALARRARDADDLFGALAHPDDGIAALIPCDGALVMLGGRTLSIRGDFERQAGNVLQRLQRDPERDIYHTDNWPQPSEDSPDGGDCCGVLAIRFHRQESGWIFWFRHEEVHRIRWGGKPEKLLTIGPSGPRLTPRGSFEAWEEVVRGHSTPWSETDLAIAEKLRLDLMELCLNHAAEVDRMRQRLIAVLGHDLRNPLQSISMAAALLSSSDTRTTELRQHISASSSRMERLVSQILDMSRLQSGIGLTVNPVDTDVSQLVRQIVCETDVAYPGLVIEIAIDPQVRAVVDPDRYAQVAANLLSNARHHGLPGRPVLVTLTRQGDEVCLSVLNETSGLSEAQLANLFEPFKRESADNQRNRNGLGIGLYISQAIAQAHQGRIDVDCRDDVITFCLRLPVRQAETGSSS
Atome Classification :
(43 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......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
--------MTSIT
P
V
T
LANCEDEPIHVPGAIQPH
G
A
L
-
V
T
L
RA-D-
G
M
-
V
L
AA-SE
N
I
Q
A
L
L
-----
G
-----
F
VA------SP--------G
S
Y
L
T
Q
E
Q-V-
G
P
E
V
L
R
M
L
E
EGLTG-NGP----WS-N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
IGH
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
TA
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
LHN
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
MT
G
Y
D
R
V
-
M
A
Y
R
FRHDDS
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
LGQRYPASDI
P
A
Q
A
R
R
L
Y
IQ
N
P
I
R
L
I
A
D
VAYT
P
M
R
V
FPALNPETNESF
D
L
S
Y
S
V
L
R
SVSP-
I
-
H
C
E
Y
L
TNMGV
R
A
S
M
S
I
S
I
V
VGG
K
L
W
G
L
F
S
CHHMSPKLIPY
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
EQ
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
RAR
D
A
D
D
---
L
F
G
ALAHPDD
G
I
A
A
L
IPCD
G
-
A
L
V
M
LGG
R
T
L
S
I-RG
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q----RDPERDIYHTDN----WPQPSEDSPDGG
D
----
C
C
-
G
V
L
A
I
R
F
H
RQES
G
W
I
-
F
W
F
RHE
E
V
H
R
I
RWGGKP
E
K
L
L
--
T
IGPSGPRLTPRG
S
F
E
A
W
E
E
V
V
RGHSTPWS
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
A
A
E
V
D
R
M
R
Q
R
L
I
A
V
L
G
H
D
L
R
N
P
L
Q
S
I
S
M
A
A
A
L
LSSSDT
R
T
T
E
L
R
Q
H
I
S
A
S
S
S
R
M
E
R
L
V
S
Q
I
L
D
M
S
R
L
Q
SGI
G
L
T
VNPVD
T
D
V
S
Q
L
V
R
Q
I
V
CETDVAYP
G
L
V
I
E
I
AIDPQ
V
R
A
V
V
D
P
D
R
Y
A
Q
V
A
A
N
L
L
S
NARHHGLPGR
P
V
L
V
T
L
TRQG
D
E
V
C
L
S
V
L
N
ETSGL
S
E
A
Q
L
A
N
L
F
E
P
F
K
RESADNQRNRNGL
G
I
G
L
Y
I
S
Q
A
I
A
Q
A
HQG
R
I
D
V
DC
R
D
D
V
I
T
F
C
L
RLPVRQAETGSSS
2
PsiBlast_PDB
97.36
99%
-123
- C4 -
3NHQ
1
BPHY_PSEAE
A:
[5-494]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
-----------
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
PsiBlast_CBE
96.98
99%
-124
- C4 -
3NHQ
1
BPHY_PSEAE
D:
[5-496]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
-----------
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
-
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
96.55
99%
-123
- C4 -
3NHQ
1
BPHY_PSEAE
H:
[5-496]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
-----------
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
96.48
99%
-124
- C4 -
3NHQ
1
BPHY_PSEAE
E:
[5-495]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
----------------
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
46
HHSearch
96.34
99%
-120
- C4 -
3NHQ
1
BPHY_PSEAE
A:
[5-494]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
----------
P
G
S
Y
L
T
Q
E
Q
V
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
-----------
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
32
PsiBlast_CBE
96.32
99%
-124
- C4 -
3C2W
1
BPHY_PSEAE
D:
[5-496]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
-----------
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
---
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
95.86
99%
-119
- C4 -
3NHQ
1
BPHY_PSEAE
G:
[5-497]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
-----------
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
95.57
99%
-117
- C4 -
3NHQ
1
BPHY_PSEAE
C:
[5-496]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
----------
G
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
70
Fugue
95.47
100%
-124
- C4 -
3C2W
1
BPHY_PSEAE
A:
[5-494]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
----------------
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
95.27
99%
-124
- C4 -
3C2W
1
BPHY_PSEAE
A:
[5-494]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
----------------
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
94.99
99%
-117
- C4 -
3NOP
1
BPHY_PSEAE
C:
[4-496]
-----------
I
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
----------
G
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
94.91
99%
-117
- C4 -
3NOT
1
BPHY_PSEAE
C:
[4-496]
-----------
I
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
----------
G
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
94.78
99%
-117
- C4 -
3NOU
1
BPHY_PSEAE
C:
[4-496]
-----------
I
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
----------
G
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
31
PsiBlast_CBE
94.73
99%
-129
- C4 -
3C2W
1
BPHY_PSEAE
E:
[5-495]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
--
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
----------------
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
--------
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
PsiBlast_CBE
94.69
99%
-120
- C4 -
3C2W
1
BPHY_PSEAE
C:
[5-496]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
----------
G
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
29
PsiBlast_CBE
94.48
99%
-122
- C4 -
3C2W
1
BPHY_PSEAE
G:
[5-497]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
-----------
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
28
PsiBlast_CBE
94.31
99%
-121
- C4 -
3C2W
1
BPHY_PSEAE
H:
[5-496]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
----------------
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
H
R
I
R
W
G
G
K
P
E
K
L
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
93.70
99%
-117
- C4 -
3NHQ
1
BPHY_PSEAE
F:
[5-498]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
-----------
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
------------
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
A
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
27
PsiBlast_CBE
93.60
99%
-120
- C4 -
3NHQ
1
BPHY_PSEAE
B:
[5-497]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
A
D
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
-----------
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
------------
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
PsiBlast_CBE
91.30
99%
-116
- C4 -
3C2W
1
BPHY_PSEAE
F:
[5-498]
------------
T
P
V
T
L
A
N
C
E
D
E
P
I
H
V
P
G
A
I
Q
P
H
G
A
L
-
V
T
L
R
A
-
D
-
G
M
-
V
L
A
A
-
S
E
N
I
Q
A
L
L
-----
G
-----
F
V
A
------
S
P
--------
G
S
Y
L
T
Q
E
Q
-
V
-
G
P
E
V
L
R
M
L
E
E
G
L
T
G
-
N
G
P
----
W
S
-
N
S
-----
V
E
T
R
I
G
E
H
--
L
F
D
V
I
G
H
S
Y
K
E
-
V
F
Y
L
E
F
E
-
I
R
T
--
T
L
S
I
T
S
F
T
L
N
A
Q
R
I
I
-
A
Q
V
Q
L
H
N
D
T
A
S
L
L
S
N
V
T
D
E
L
R
R
M
T
G
Y
D
R
V
-
M
A
Y
R
F
R
H
D
D
S
G
E
V
V
A
E
S
R
R
E
D
L
E
S
Y
L
G
Q
R
Y
P
A
S
D
I
P
A
Q
A
R
R
L
Y
I
Q
N
P
I
R
L
I
A
D
V
A
Y
T
P
M
R
V
F
P
A
L
N
P
E
T
N
E
S
F
D
L
S
Y
S
V
L
R
S
V
S
P
-
I
-
H
C
E
Y
L
T
N
M
G
V
R
A
S
M
S
I
S
I
V
V
G
G
K
L
W
G
L
F
S
C
H
H
M
S
P
K
L
I
P
Y
P
V
R
M
S
F
Q
I
F
S
Q
V
C
S
A
I
V
E
R
L
E
Q
G
R
I
A
E
L
L
R
V
S
T
E
R
R
L
A
L
A
R
R
A
R
D
A
D
D
---
L
F
G
A
L
A
H
P
D
D
G
I
A
A
L
I
P
C
D
G
-
A
L
V
M
L
G
G
R
T
L
S
I
-
R
G
D
F
E
R
Q
A
G
N
V
L
Q
R
L
Q
----
R
D
P
E
R
D
I
Y
H
T
D
N
----
W
-----------
D
----
C
C
-
G
V
L
A
I
R
F
H
R
Q
E
S
G
W
I
-
F
W
F
R
H
E
E
V
------------
L
--
T
I
G
P
S
G
P
R
L
T
P
R
G
S
F
E
A
W
E
E
V
V
R
G
H
S
T
P
W
S
E
T
D
L
A
I
A
E
K
L
R
L
D
L
M
E
L
C
L
N
H
A
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
PsiBlast_CBE
66.28
35%
-88
- C4 -
4R70
1
?
B:
[25-521]
----------------
L
T
E
C
D
R
E
P
I
H
I
P
G
A
I
Q
P
H
G
Y
L
F
V
V
S
E
T
-
D
-
L
R
-
I
A
S
V
-
S
A
N
V
E
D
L
L
RQPPA
S
-----
L
L
N
------
V
P
I-------
A
H
Y
L
T
A
A
S
-
A
-
A
-----
R
L
T
H
A
L
H
G
-
G
D
P
----
A
A
-
I
N
P
I
R
L
D
V
V
T
P
D
G
E
R
--
A
F
N
G
I
L
H
R
H
D
S
-
I
V
I
L
E
L
E
-
P
R
-----
Y
T
N
E
F
F
R
S
V
R
V
A
I
-
R
R
L
Q
T
A
A
D
L
P
T
A
C
W
I
A
A
S
E
V
R
R
I
T
G
F
D
R
I
-
K
V
Y
Q
F
A
A
D
W
S
G
Q
V
I
A
E
D
R
D
S
G
I
P
S
L
L
D
F
H
F
P
S
S
D
I
P
A
Q
S
R
A
L
Y
T
I
N
P
V
R
I
I
P
D
I
G
Y
R
P
S
P
L
V
P
D
I
N
P
R
L
G
G
P
I
D
L
S
F
S
V
L
R
S
V
S
P
-
T
-
H
L
E
Y
M
V
N
M
G
M
H
A
A
M
S
I
S
I
V
R
D
N
R
L
W
G
M
I
S
C
H
N
L
T
P
R
F
V
S
Y
E
V
R
Q
A
C
E
L
I
A
Q
V
L
T
W
Q
I
G
V
L
E
E
---
A
E
I
V
R
H
S
V
R
M
R
A
I
Q
N
R
L
L
H
E
L
G
D
EQG
L
T
A
G
L
S
R
V
S
E
E
M
L
A
L
M
G
A
S
G
F
A
L
C
S
F
D
G
V
A
A
F
G
-
R
T
P
S
D
D
E
I
Q
A
L
A
S
W
L
S
----
H
R
E
S
R
G
I
F
Q
T
Q
Q
----
L
S
A
S
F
P
E
A
E
V
Y
S
D
I---
A
S
-
G
L
L
A
V
P
L
G
R
A
S
T
T
L
M
-
L
W
F
R
P
E
V
A
Q
T
V
T
W
G
G
D
P
H
K
P
V
---------
R
L
Q
T
R
A
S
F
E
A
W
R
E
E
V
R
D
R
S
R
P
W
R
S
H
E
I
V
A
A
E
E
I
R
D
L
V
V
D
V
I
L
G
R
A
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
66.07
35%
-87
- C4 -
4R70
1
?
A:
[25-522]
----------------
L
T
E
C
D
R
E
P
I
H
I
P
G
A
I
Q
P
H
G
Y
L
F
V
V
S
E
T
-
D
-
L
R
-
I
A
S
V
-
S
A
N
V
E
D
L
L
RQPPA
S
-----
L
L
N
------
V
P
I-------
A
H
Y
L
T
A
A
S
-
A
-
A
-----
R
L
T
H
A
L
H
G
-
G
D
P
----
A
A
-
I
N
PIR
L
D
V
V
T
P
D
G
E
R
--
A
F
N
G
I
L
H
R
H
D
S
-
I
V
I
L
E
L
E
-
P
R
D
-
E
S
R
Y
T
N
E
F
F
R
S
V
R
V
A
I
-
R
R
L
Q
T
A
A
D
L
P
T
A
C
W
I
A
A
S
E
V
R
R
I
T
G
F
D
R
I
-
K
V
Y
Q
F
A
A
D
W
S
G
Q
V
I
A
E
D
R
D
S
G
I
P
S
L
L
D
F
H
F
P
S
S
D
I
P
A
Q
S
R
A
L
Y
T
I
N
P
V
R
I
I
P
D
I
G
Y
R
P
S
P
L
V
P
D
I
N
P
R
L
G
G
P
I
D
L
S
F
S
V
L
R
S
V
S
P
-
T
-
H
L
E
Y
M
V
N
M
G
M
H
A
A
M
S
I
S
I
V
R
D
N
R
L
W
G
M
I
S
C
H
N
L
T
P
R
F
V
S
Y
E
V
R
Q
A
C
E
L
I
A
Q
V
L
T
W
Q
I
G
V
L
E
E
---
A
E
I
V
R
H
S
V
R
M
R
A
I
Q
N
R
L
L
H
E
L
G
D
EQG
L
T
A
G
L
S
R
V
S
E
E
M
L
A
L
M
G
A
S
G
F
A
L
C
S
F
D
G
V
A
A
F
G
-
R
T
P
S
D
D
E
I
Q
A
L
A
S
W
L
S
----
H
R
E
S
R
G
I
F
Q
T
Q
Q
----
L
S
A
S
F
P
E
A
E
V
Y
S
D
I---
A
S
-
G
L
L
A
V
P
L
G
R
A
S
T
T
L
M
-
L
W
F
R
P
E
V
A
Q
T
V
T
W
G
G
D
P
H
K
P
V
--
Q
I
G
P
R
G
R
R
L
Q
T
R
A
S
F
E
A
W
R
E
E
V
R
D
R
S
R
P
W
R
S
H
E
I
V
A
A
E
E
I
R
D
L
V
V
D
V
I
L
G
R
A
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
65.53
32%
-92
- C4 -
3ZQ5
10
PHY1_SYNY3
A:
[11-514]
---------------
S
L
R
Q
L
E
T
L
A
I
H
T
A
H
L
I
Q
P
H
G
L
V
-
V
V
L
Q
E
-
P
-
D
L
-
T
I
S
Q
I
S
A
N
C
T
G
I
L
-----
G
-------
R
------
S
P
EDLLGRTL
G
E
V
F
D
S
F
Q
-
I
-
D
P
I
Q
S
R
L
T
A
G
Q
I
S
S
-
L
N
P
-----
S
-
K
L
-----
W
A
R
V
M
G
D
D
F
V
I
F
D
G
V
F
H
R
N
S
D
G
L
L
V
C
E
L
E
P
A
Y
T
S
D
N
L
P
F
L
G
F
Y
H
M
A
N
A
A
L
-
N
R
L
R
Q
Q
A
N
L
R
D
F
Y
D
V
I
V
E
E
V
R
R
M
T
G
F
D
R
V
-
M
L
Y
R
F
D
E
N
N
H
G
D
V
I
A
E
D
K
R
D
D
M
E
P
Y
L
G
L
H
Y
P
E
S
D
I
P
Q
P
A
R
R
L
F
I
H
N
P
I
R
V
I
P
D
V
Y
G
V
A
V
P
L
T
P
A
V
N
P
S
T
N
R
A
V
D
L
T
E
S
I
L
R
S
A
Y
H
-
C
-
H
L
T
F
L
K
N
M
G
V
G
A
S
L
T
I
S
L
I
K
D
G
H
L
W
G
L
I
A
C
H
H
Q
T
P
K
V
I
P
F
E
L
R
K
A
C
E
F
F
G
R
V
V
F
S
N
I
S
A
Q
E
D
T
E
T
F
D
Y
R
V
Q
L
A
E
H
E
A
V
L
L
D
K
M
T
T
A
A
D
---
F
V
E
G
L
T
N
H
P
D
R
L
L
G
L
T
G
S
Q
G
-
A
A
I
C
F
G
E
K
L
I
L
V
G
E
T
P
D
E
K
A
V
Q
Y
L
L
Q
W
L
E
----
N
R
E
V
Q
D
V
F
F
T
S
S
----
L
S
Q
I
Y
P
D
A
V
N
F
K
S
----
V
A
S
G
L
L
A
I
P
I
A
R
H
--
N
F
L
-
L
W
F
R
P
E
V
L
Q
T
V
N
W
G
G
D
P
N
H
A
Y
E
A
T
Q
E
D
G
K
I
E
L
H
P
R
Q
S
F
D
L
W
K
E
I
V
R
L
Q
S
L
P
W
Q
S
V
E
I
Q
S
A
L
A
L
K
K
A
I
V
N
L
I
L
R
Q
A
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
65.29
32%
-93
- C4 -
2VEA
1
PHY1_SYNY3
A:
[11-514]
---------------
S
L
R
Q
L
E
T
L
A
I
H
T
A
H
L
I
Q
P
H
G
L
V
-
V
V
L
Q
E
-
P
-
D
L
-
T
I
S
Q
I
S
A
N
C
T
G
I
L
-----
G
-------
R
------
S
P
EDLLGRTL
G
E
V
F
D
S
F
----------
L
T
A
G
Q
I
S
S
-
L
N
P
-----
S
-
K
L
-----
W
A
R
V
M
--
D
F
V
I
F
D
G
V
F
H
R
N
S
D
G
L
L
V
C
E
L
E
P
A
Y
T
S
D
N
L
P
F
L
G
F
Y
H
M
A
N
A
A
L
-
N
R
L
----
N
L
R
D
F
Y
D
V
I
V
E
E
V
R
R
M
T
G
F
D
R
V
-
M
L
Y
R
F
D
E
N
N
H
G
D
V
I
A
E
D
K
R
D
D
M
E
P
Y
L
G
L
H
Y
P
E
S
D
I
P
Q
P
A
R
R
L
F
I
H
N
P
I
R
V
I
P
D
V
Y
G
V
A
V
P
L
T
P
A
V
N
P
S
T
N
R
A
V
D
L
T
E
S
I
L
R
S
A
Y
H
-
C
-
H
L
T
Y
L
K
N
M
G
V
G
A
S
L
T
I
S
L
I
K
D
G
H
L
W
G
L
I
A
C
H
H
Q
T
P
K
V
I
P
F
E
L
R
K
A
C
E
F
F
G
R
V
V
F
S
N
I
S
A
Q
E
D
T
E
T
F
D
Y
R
V
Q
L
A
E
H
E
A
V
L
L
D
K
M
T
T
A
A
D
---
F
V
E
G
L
T
N
H
P
D
R
L
L
G
L
T
G
S
Q
G
-
A
A
I
C
F
G
E
K
L
I
L
V
G
E
T
P
D
E
K
A
V
Q
Y
L
L
Q
W
L
E
----
N
R
E
V
Q
D
V
F
F
T
S
S
----
L
S
Q
I
Y
P
D
A
V
N
F
K
S
----
V
A
S
G
L
L
A
I
P
I
A
R
H
--
N
F
L
-
L
W
F
R
P
E
V
L
Q
T
V
N
W
G
G
D
P
N
H
A
Y
E
A
T
Q
---
K
I
E
L
H
P
R
Q
S
F
D
L
W
K
E
I
V
R
L
Q
S
L
P
W
Q
S
V
E
I
Q
S
A
L
A
L
K
K
A
I
V
N
L
I
L
R
Q
A
E
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
64.30
33%
-86
- C4 -
4Q0J
1
BPHY_DEIRA
A:
[34-510]
--------------
I
T
T
E
N
C
E
R
E
P
I
H
I
P
G
S
I
Q
P
H
G
A
L
-
L
T
A
D
G
H
S
-
G
E
-
V
L
Q
M
-
S
L
N
A
A
T
F
L
-----
G
-----
Q
E
P
------
T
V
--------
L
R
G
Q
T
L
A
A
-
L
-
L
P
E
Q
W
P
A
L
Q
A
A
L
P
P
-
G
C
P
DA
L
Q
Y
R
-
A
T
-----
L
D
W
P
--
G
H
--
L
S
L
T
V
-
H
R
V
G
E
-
L
L
I
L
E
F
E
-
P
T
E
----
T
G
P
H
A
L
R
N
A
M
F
A
L
-
E
S
A
---
P
N
L
R
A
L
A
E
V
A
T
Q
T
V
R
E
L
T
G
F
D
R
V
-
M
L
Y
K
F
A
P
D
A
T
G
E
V
I
A
E
A
R
R
E
G
L
H
A
F
L
G
H
R
F
P
A
S
D
I
P
A
Q
A
R
A
L
Y
T
R
H
L
L
R
L
T
A
D
T
R
A
A
A
V
P
L
D
P
V
L
N
P
Q
T
N
A
P
T
P
L
G
G
A
V
L
R
A
T
S
P
-
M
-
H
M
Q
Y
L
R
N
M
G
V
G
S
S
L
S
V
S
V
V
V
G
G
Q
L
W
G
L
I
A
C
H
H
Q
T
P
Y
V
L
P
P
D
L
R
T
T
L
E
Y
L
G
R
L
L
S
L
Q
V
Q
V
K
E
A
A
D
V
A
A
F
R
Q
S
L
R
E
H
H
A
R
V
A
L
A
A
A
H
S
L
S
---
P
H
D
T
L
S
D
P
A
L
D
L
L
G
L
M
R
A
G
G
-
L
I
L
R
F
E
G
R
W
Q
T
L
-
G
E
V
P
P
A
P
A
V
D
A
L
L
A
W
L
----
E
T
Q
P
G
A
L
V
Q
T
D
A
LGQL
W
P
A
G
A
D
L
A
P
---
S
----
A
A
-
G
L
L
A
I
S
V
--
G
W
S
E
C
L
-
V
W
L
R
P
E
L
R
L
E
V
A
W
G
G
A
-------
T
P
D
Q
A
K
D
D
L
G
P
R
H
S
F
D
T
Y
L
E
E
K
R
G
Y
A
E
P
W
H
P
G
E
I
E
E
A
Q
D
L
R
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
62.68
33%
-94
- C4 -
4S21
1
?
A:
[33-523]
-----------------
S
T
C
D
D
E
P
I
H
I
P
G
A
I
Q
P
H
G
L
L
-
L
A
L
A
A
-
D
-
M
T
-
I
V
A
G
-
S
D
N
L
P
E
L
T
-----
G
-----
L
A
I
GALIGR
S
A
--------
A
D
V
F
D
S
E
T
-
H
-
N
R
L
T
I
A
L
A
E
P
-----
G
A
P
----
I
A
-
V
G
-----
F
T
----
D
A
--
G
F
V
G
S
W
H
R
H
D
Q
-
L
V
F
L
E
L
E
-
P
P
------
P
Q
A
F
F
R
R
T
N
S
A
I
-
R
R
L
Q
A
A
E
T
L
E
S
A
C
A
A
A
A
Q
E
V
R
E
I
T
G
F
D
R
V
-
M
I
Y
R
F
A
S
D
F
S
G
E
V
I
A
E
D
R
C
A
E
V
E
S
Y
L
G
L
H
F
P
A
S
D
I
P
A
Q
A
R
R
L
Y
T
I
N
P
V
R
I
I
P
D
I
N
Y
R
P
V
P
V
T
P
D
L
N
P
V
T
G
R
P
I
D
L
S
F
A
I
L
R
S
V
S
P
-
V
-
H
L
E
Y
M
R
N
I
G
M
H
G
T
M
S
I
S
I
L
R
G
E
R
L
W
G
L
I
A
C
H
H
R
K
P
N
Y
V
D
L
D
G
R
Q
A
C
E
L
V
A
Q
V
L
A
W
Q
I
G
V
M
E
E
Q
A
I
T
R
Q
T
L
K
G
Q
A
I
Q
R
S
L
I
N
D
I
E
Q
L
H
D
---
H
R
A
G
L
A
R
N
S
E
A
L
L
E
L
M
G
A
S
G
-
L
C
L
H
S
R
E
G
V
I
T
I
-
G
---
Q
T
P
P
G
P
I
I
D
Q
L
A
QLAG
R
S
G
G
S
E
L
F
Q
T
D
R
----
L
---
S
T
I
I
P
E
A
G
A
FAEV
A
S
-
G
V
L
A
V
P
L
S
R
T
P
P
R
R
V
M
L
W
F
R
P
E
V
A
Q
T
V
Y
W
A
G
N
P
D
K
--------
S
G
-
R
L
R
P
R
T
S
F
A
A
W
T
E
Q
T
H
G
R
A
I
A
W
Q
P
H
E
V
A
A
A
V
E
I
R
D
L
I
I
D
V
I
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
62.53
33%
-96
- C4 -
4R6L
1
?
A:
[13-503]
-----------------
S
T
C
D
D
E
P
I
H
I
P
G
A
I
Q
P
H
G
L
L
-
L
A
L
A
A
-
D
-
M
T
-
I
V
A
G
-
S
D
N
L
P
E
L
T
-----
G
-----
L
A
I
GALIGR
S
A
--------
A
D
V
F
D
S
E
T
-
H
-
N
R
L
T
I
A
L
A
E
P
-----
G
A
P
----
I
A
-
V
G
-----
F
T
----
D
A
--
G
F
V
G
S
W
H
R
H
D
Q
-
L
V
F
L
E
L
E
-
P
P
------
P
Q
A
F
F
R
R
T
N
S
A
I
-
R
R
L
Q
A
A
E
T
L
E
S
A
C
A
A
A
A
Q
E
V
R
E
I
T
G
F
D
R
V
-
M
I
Y
R
F
A
S
D
F
S
G
E
V
I
A
E
D
R
C
A
E
V
E
S
Y
L
G
L
H
F
P
A
S
D
I
P
A
Q
A
R
R
L
Y
T
I
N
P
V
R
I
I
P
D
I
N
Y
R
P
V
P
V
T
P
D
L
N
P
V
T
G
R
P
I
D
L
S
F
A
I
L
R
S
V
S
P
-
V
-
H
L
E
Y
M
R
N
I
G
M
H
G
T
M
S
I
S
I
L
R
G
E
R
L
W
G
L
I
A
C
H
H
R
K
P
N
Y
V
D
L
D
G
R
Q
A
C
E
L
V
A
Q
V
L
A
W
Q
I
G
V
M
E
E
Q
A
I
T
R
Q
T
L
K
G
Q
A
I
Q
R
S
L
I
N
D
I
E
Q
L
H
D
---
H
R
A
G
L
A
R
N
S
E
A
L
L
E
L
M
G
A
S
G
-
L
C
L
H
S
R
E
G
V
I
T
I
-
G
---
Q
T
P
P
G
P
I
I
D
Q
L
A
QLAG
R
S
G
G
S
E
L
F
Q
T
D
R
----
L
---
S
T
I
I
P
E
A
G
A
FAEV
A
S
-
G
V
L
A
V
P
L
S
R
T
P
P
R
R
V
M
L
W
F
R
P
E
V
A
Q
T
V
Y
W
A
G
N
P
D
K
--------
S
G
-
R
L
R
P
R
T
S
F
A
A
W
T
E
Q
T
H
G
R
A
I
A
W
Q
P
H
E
V
A
A
A
V
E
I
R
D
L
I
I
D
V
I
L
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
60.71
33%
-86
- C4 -
4O0P
1
BPHY_DEIRA
A:
[33-509]
--------------
I
T
T
E
N
C
E
R
E
P
I
H
I
P
G
S
I
Q
P
H
G
A
L
-
L
T
A
D
G
H
S
-
G
E
-
V
L
Q
M
-
S
L
N
A
A
T
F
L
-----
G
-----
Q
E
P
------
T
V
--------
L
R
G
Q
T
L
A
A
-
L
-
L
P
E
Q
W
P
A
L
Q
A
A
L
P
P
-
G
C
P
DA
L
Q
Y
R
-
A
T
-----
L
D
W
P
---
H
--
L
S
L
T
V
-
H
R
V
G
E
-
L
L
I
L
E
F
E
-
P
T
E
A
------
H
A
L
R
N
A
M
F
A
L
-
E
S
A
---
P
N
L
R
A
L
A
E
V
A
T
Q
T
V
R
E
L
T
G
F
D
R
V
-
M
L
Y
K
F
A
P
D
A
T
G
E
V
I
A
E
A
R
R
E
G
L
H
A
F
L
G
H
R
F
P
A
S
D
I
P
A
Q
A
R
A
L
Y
T
R
H
L
L
R
L
T
A
D
T
R
A
A
A
V
P
L
D
P
V
L
N
P
Q
T
N
A
P
T
P
L
G
G
A
V
L
R
A
T
S
P
-
M
-
H
M
Q
Y
L
R
N
M
G
V
G
S
S
L
S
V
S
V
V
V
G
G
Q
L
W
G
L
I
A
C
H
H
Q
T
P
Y
V
L
P
P
D
L
R
T
T
L
E
Y
L
G
R
L
L
S
L
Q
V
Q
V
K
E
A
A
D
V
A
A
F
R
Q
S
L
R
E
H
H
A
R
V
A
L
A
A
A
H
S
L
S
---
P
H
D
T
L
S
D
P
A
L
D
L
L
G
L
M
R
A
G
G
-
L
I
L
R
F
E
G
R
W
Q
T
L
-
G
E
V
P
P
A
P
A
V
D
A
L
L
A
W
L
----
E
T
Q
P
G
-
L
V
Q
T
D
A
LGQL
W
P
A
G
A
D
L
A
P
---
S
----
A
A
-
G
L
L
A
I
S
V
---
W
S
E
C
L
-
V
W
L
R
P
E
L
R
L
E
V
A
W
G
G
A
-------
T
P
-----
D
L
G
P
R
H
S
F
D
T
Y
L
E
E
K
R
G
Y
A
E
P
W
H
P
G
E
I
E
E
A
Q
D
L
R
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
36
PsiBlast_CBE
58.82
33%
-86
- C4 -
4O0P
1
BPHY_DEIRA
B:
[33-509]
--------------
I
T
T
E
N
C
E
R
E
P
I
H
I
P
G
S
I
Q
P
H
G
A
L
-
L
T
A
D
G
H
S
-
G
E
-
V
L
Q
M
-
S
L
N
A
A
T
F
L
-----
G
-----
Q
E
P
------
T
V
--------
L
R
G
Q
T
L
A
A
-
L
-
L
P
E
Q
W
P
A
L
Q
A
A
L
P
P
-
G
C
P
DA
L
Q
Y
R
-
A
T
-----
L
D
W
P
---
H
--
L
S
L
T
V
-
H
R
V
G
E
-
L
L
I
L
E
F
E
-
P
T
E
-------
H
A
L
R
N
A
M
F
A
L
-
E
S
A
---
P
N
L
R
A
L
A
E
V
A
T
Q
T
V
R
E
L
T
G
F
D
R
V
-
M
L
Y
K
F
A
P
D
A
T
G
E
V
I
A
E
A
R
R
E
G
L
H
A
F
L
G
H
R
F
P
A
S
D
I
P
A
Q
A
R
A
L
Y
T
R
H
L
L
R
L
T
A
D
T
R
A
A
A
V
P
L
D
P
V
L
N
P
Q
T
N
A
P
T
P
L
G
G
A
V
L
R
A
T
S
P
-
M
-
H
M
Q
Y
L
R
N
M
G
V
G
S
S
L
S
V
S
V
V
V
G
G
Q
L
W
G
L
I
A
C
H
H
Q
T
P
Y
V
L
P
P
D
L
R
T
T
L
E
Y
L
G
R
L
L
S
L
Q
V
Q
V
K
E
A
A
D
V
A
A
F
R
Q
S
L
R
E
H
H
A
R
V
A
L
A
A
A
H
S
L
S
---
P
H
D
T
L
S
D
P
A
L
D
L
L
G
L
M
R
A
G
G
-
L
I
L
R
F
E
G
R
W
Q
T
L
-
G
E
V
P
P
A
P
A
V
D
A
L
L
A
W
L
----
E
T
Q
P
G
-
L
V
Q
T
D
A
LGQL
W
P
A
G
A
D
L
A
P
---
S
----
A
A
-
G
L
L
A
I
S
V
G
E
G
W
S
E
C
L
-
V
W
L
R
P
E
L
R
L
E
V
A
W
G
G
A
-------
T
P
-----
D
L
G
P
R
H
S
F
D
T
Y
L
E
E
K
R
G
Y
A
E
P
W
H
P
G
E
I
E
E
A
Q
D
L
R
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
39
PsiBlast_CBE
57.39
38%
-93
- C4 -
2OOL
1
?
B:
[27-332]
------------------
E
C
D
R
E
P
I
H
I
P
G
A
I
Q
P
H
G
Y
L
F
V
V
S
E
T
-
D
-
L
R
-
I
A
S
V
-
S
A
N
V
E
D
L
L
RQPPA
S
-----
L
L
N
------
V
P
I-------
A
H
Y
L
T
A
A
S
-
A
-
A
-----
R
L
T
H
A
L
H
G
---------
A
-
I
N
P
I
R
L
D
V
V
T
P
D
G
E
R
--
A
F
N
G
I
L
H
R
H
D
S
-
I
V
I
L
E
L
E
-
P
R
D
-
E
----
N
E
F
F
R
S
V
R
V
A
I
-
R
R
L
Q
T
A
A
D
L
P
T
A
C
W
I
A
A
S
E
V
R
R
I
T
G
F
D
R
I
-
K
V
Y
Q
F
A
A
D
W
S
G
Q
V
I
A
E
D
R
D
S
G
I
P
S
L
L
D
F
H
F
P
S
S
D
I
P
A
Q
S
R
A
L
Y
T
I
N
P
V
R
I
I
P
D
I
G
Y
R
P
S
P
L
V
P
D
I
N
P
R
L
G
G
P
I
D
L
S
F
S
V
L
R
S
V
S
P
-
T
-
H
L
E
Y
M
V
N
M
G
M
H
A
A
M
S
I
S
I
V
R
D
N
R
L
W
G
M
I
S
C
H
N
L
T
P
R
F
V
S
Y
E
V
R
Q
A
C
E
L
I
A
Q
V
L
T
W
Q
I
G
V
L
E
E
A
E
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
55.78
38%
-94
- C4 -
2OOL
1
?
A:
[26-333]
-----------------
T
E
C
D
R
E
P
I
H
I
P
G
A
I
Q
P
H
G
Y
L
F
V
V
S
E
T
-
D
-
L
R
-
I
A
S
V
-
S
A
N
V
E
D
L
L
RQPPA
S
-----
L
L
N
------
V
P
I-------
A
H
Y
L
T
A
A
S
-
A
-
A
-----
R
L
T
H
A
L
H
G
---------
A
-
I
N
P
I
R
L
D
V
V
T
P
D
G
E
R
--
A
F
N
G
I
L
H
R
H
D
S
-
I
V
I
L
E
L
E
-
P
R
D
-
E
S
R
Y
T
N
E
F
F
R
S
V
R
V
A
I
-
R
R
L
Q
T
A
A
D
L
P
T
A
C
W
I
A
A
S
E
V
R
R
I
T
G
F
D
R
I
-
K
V
Y
Q
F
A
A
D
W
S
G
Q
V
I
A
E
D
R
D
S
G
I
P
S
L
L
D
F
H
F
P
S
S
D
I
P
A
Q
S
R
A
L
Y
T
I
N
P
V
R
I
I
P
D
I
G
Y
R
P
S
P
L
V
P
D
I
N
P
R
L
G
G
P
I
D
L
S
F
S
V
L
R
S
V
S
P
-
T
-
H
L
E
Y
M
V
N
M
G
M
H
A
A
M
S
I
S
I
V
R
D
N
R
L
W
G
M
I
S
C
H
N
L
T
P
R
F
V
S
Y
E
V
R
Q
A
C
E
L
I
A
Q
V
L
T
W
Q
I
G
V
L
E
E
A
E
I
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
47
HHSearch
55.05
38%
-91
- C4 -
2OOL
1
?
A:
[26-328]
-----------------
T
E
C
D
R
E
P
I
H
I
P
G
A
I
Q
P
H
G
Y
L
-
F
V
V
S
E
-
T
D
L
R
-
I
A
S
V
-
S
A
N
V
E
D
L
L
-----
R
-----
Q
P
P
------
A
S
--------
L
L
N
V
P
I
A
H
-
Y
L
T
A
A
S
A
A
R
L
T
H
A
L
H
G
A
I
N
P
----
I
R
-
L
D
-----
V
V
T
P
D
G
E
R
--
A
F
N
G
I
L
H
R
H
D
S
-
I
V
I
L
E
L
E
-
P
R
D
E
S
R
Y
-
T
N
E
F
F
R
S
V
R
V
A
I
-
R
R
L
Q
T
A
A
D
L
P
T
A
C
W
I
A
A
S
E
V
R
R
I
T
G
F
D
R
I
-
K
V
Y
Q
F
A
A
D
W
S
G
Q
V
I
A
E
D
R
D
S
G
I
P
S
L
L
D
F
H
F
P
S
S
D
I
P
A
Q
S
R
A
L
Y
T
I
N
P
V
R
I
I
P
D
I
G
Y
R
P
S
P
L
V
P
D
I
N
P
R
L
G
G
P
I
D
L
S
F
S
V
L
R
S
V
S
P
-
T
-
H
L
E
Y
M
V
N
M
G
M
H
A
A
M
S
I
S
I
V
R
D
N
R
L
W
G
M
I
S
C
H
N
L
T
P
R
F
V
S
Y
E
V
R
Q
A
C
E
L
I
A
Q
V
L
T
W
Q
I
G
V
L
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
52.70
39%
-88
- C4 -
2O9B
1
BPHY_DEIRA
A:
[34-332]
--------------
I
T
T
E
N
C
E
R
E
P
I
H
I
P
G
S
I
Q
P
H
G
A
L
-
L
T
A
D
G
H
S
-
G
E
-
V
L
Q
M
-
S
L
N
A
A
T
F
L
-----
G
-----
Q
E
P
------
T
V
--------
L
R
G
Q
T
L
A
A
-
L
-
L
P
E
Q
W
P
A
L
Q
A
A
L
P
P
-
G
C
P
DA
L
Q
Y
R
-
A
T
-----
L
D
W
P
A
A
G
H
--
L
S
L
T
V
-
H
R
V
G
E
-
L
L
I
L
E
F
E
-
P
T
E
----
T
G
P
H
A
L
R
N
A
M
F
A
L
-
E
S
A
P
---
N
L
R
A
L
A
E
V
A
T
Q
T
V
R
E
L
T
G
F
D
R
V
-
M
L
Y
K
F
A
P
D
A
T
G
E
V
I
A
E
A
R
R
E
G
L
H
A
F
L
G
H
R
F
P
A
S
D
I
P
A
Q
A
R
A
L
Y
T
R
H
L
L
R
L
T
A
D
T
R
A
A
A
V
P
L
D
P
V
L
N
P
Q
T
N
A
P
T
P
L
G
G
A
V
L
R
A
T
S
P
-
M
-
H
M
Q
Y
L
R
N
M
G
V
G
S
S
L
S
V
S
V
V
V
G
G
Q
L
W
G
L
I
A
C
H
H
Q
T
P
Y
V
L
P
P
D
L
R
T
T
L
E
S
L
G
R
L
L
S
L
Q
V
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
42
PsiBlast_CBE
52.35
38%
-93
- C4 -
4O8G
1
BPHY_DEIRA
A:
[19-320]
--------------
I
T
T
E
N
C
E
R
E
P
I
H
I
P
G
S
I
Q
P
H
G
A
L
-
L
T
A
D
G
H
S
-
G
E
-
V
L
Q
V
-
S
L
N
A
A
T
F
L
-----
G
-----
Q
E
P
------
T
V
--------
L
R
G
Q
T
L
A
A
-
L
-
L
P
E
Q
W
P
A
L
Q
A
A
L
P
P
-
G
C
P
DA
L
Q
Y
R
-
A
T
-----
L
D
W
P
--
G
H
--
L
S
L
T
V
-
H
R
V
A
E
-
L
L
I
L
E
F
E
-
P
T
E
------
H
A
L
----
R
N
A
M
-
F
A
L
E
S
A
P
N
L
R
A
L
A
E
V
A
T
Q
T
V
R
E
L
T
G
F
D
R
V
-
M
L
Y
K
F
A
P
D
A
T
G
E
M
I
A
E
A
R
R
E
G
M
Q
A
F
L
G
H
R
F
P
A
S
H
T
P
A
Q
A
R
A
L
Y
T
R
H
L
L
R
L
T
A
D
T
R
A
A
A
V
P
L
D
P
V
L
N
P
Q
T
N
A
P
T
P
L
G
G
A
V
L
R
A
T
S
P
-
M
-
H
M
Q
Y
L
R
N
M
G
V
G
S
S
L
S
V
S
V
V
V
G
G
Q
L
W
G
L
I
V
C
H
H
Q
T
P
Y
V
L
P
P
D
L
R
T
T
L
E
E
L
G
R
K
L
S
G
Q
V
Q
R
K
E
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
51.97
39%
-88
- C4 -
2O9C
1
BPHY_DEIRA
A:
[34-332]
--------------
I
T
T
E
N
C
E
R
E
P
I
H
I
P
G
S
I
Q
P
H
G
A
L
-
L
T
A
D
G
H
S
-
G
E
-
V
L
Q
M
-
S
L
N
A
A
T
F
L
-----
G
-----
Q
E
P
------
T
V
--------
L
R
G
Q
T
L
A
A
-
L
-
L
P
E
Q
W
P
A
L
Q
A
A
L
P
P
-
G
C
P
DA
L
Q
Y
R
-
A
T
-----
L
D
W
P
A
A
G
H
--
L
S
L
T
V
-
H
R
V
G
E
-
L
L
I
L
E
F
E
-
P
T
E
A
W
D
S
T
G
P
H
A
L
R
N
A
M
F
A
L
-
E
S
A
P
---
N
L
R
A
L
A
E
V
A
T
Q
T
V
R
E
L
T
G
F
D
R
V
-
M
L
Y
K
F
A
P
D
A
T
G
E
V
I
A
E
A
R
R
E
G
L
H
A
F
L
G
H
R
F
P
A
S
D
I
P
A
Q
A
R
A
L
Y
T
R
H
L
L
R
L
T
A
D
T
R
A
A
A
V
P
L
D
P
V
L
N
P
Q
T
N
A
P
T
P
L
G
G
A
V
L
R
A
T
S
P
-
M
-
H
M
Q
Y
L
R
N
M
G
V
G
S
S
L
S
V
S
V
V
V
G
G
Q
L
W
G
L
I
A
C
H
H
Q
T
P
Y
V
L
P
P
D
L
R
T
T
L
E
S
L
G
R
L
L
S
L
Q
V
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
51.57
39%
-88
- C4 -
4Y3I
1
BPHY_DEIRA
A:
[16-314]
--------------
I
T
T
E
N
C
E
R
E
P
I
H
I
P
G
S
I
Q
P
H
G
A
L
-
L
T
A
D
G
H
S
-
G
E
-
V
L
Q
M
-
S
L
N
A
A
T
F
L
-----
G
-----
Q
E
P
------
T
V
--------
L
R
G
Q
T
L
A
A
-
L
-
L
P
E
Q
W
P
A
L
Q
A
A
L
P
P
-
G
C
P
DA
L
Q
Y
R
-
A
T
-----
L
D
W
P
A
A
G
H
--
L
S
L
T
V
-
H
R
V
G
E
-
L
L
I
L
E
F
E
-
P
T
E
A
W
D
S
T
G
P
H
A
L
R
N
A
M
F
A
L
-
E
S
A
P
---
N
L
R
A
L
A
E
V
A
T
Q
T
V
R
E
L
T
G
F
D
R
V
-
M
L
Y
K
F
A
P
D
A
T
G
E
V
I
A
E
A
R
R
E
G
L
H
A
F
L
G
H
R
F
P
A
S
D
I
P
A
Q
A
R
A
L
Y
T
R
H
L
L
R
L
T
A
D
T
R
A
A
A
V
P
L
D
P
V
L
N
P
Q
T
N
A
P
T
P
L
G
G
A
V
L
R
A
T
S
P
-
M
-
H
M
Q
Y
L
R
N
M
G
V
G
S
S
L
S
V
S
V
V
V
G
G
Q
L
W
G
L
I
A
C
H
H
Q
T
P
Y
V
L
P
P
D
L
R
T
T
L
E
S
L
G
R
L
L
S
L
Q
V
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
PsiBlast_CBE
51.45
37%
-89
- C4 -
4CQH
2
BPHY_DEIRA
A:
[19-320]
--------------
I
T
T
E
N
C
E
R
E
P
I
H
I
P
G
S
I
Q
P
H
G
A
L
-
L
T
A
D
G
H
S
-
G
E
-
V
L
Q
V
-
S
L
N
A
A
T
F
L
-----
G
QEPTV
L
R
G
------
Q
T
--------
L
A
A
L
L
P
D
Q
---
W
P
A
L
Q
T
A
L
P
P
G
C
Q
D
-
A
L
Q
----
Y
R
-
A
T
-----
L
D
W
P
A
A
G
H
--
L
-
S
L
T
V
H
R
V
A
E
-
L
L
I
L
E
F
E
-
P
T
-------
H
A
L
----
R
N
A
M
-
F
A
L
E
S
A
P
N
L
R
A
L
A
E
V
A
T
Q
T
V
R
E
L
S
G
F
D
R
V
-
M
L
Y
K
F
A
P
D
A
T
G
E
V
I
A
E
A
R
R
E
G
M
Q
A
Y
L
G
H
R
F
P
A
S
T
T
P
A
Q
A
R
A
L
Y
T
R
H
L
L
R
L
T
A
D
T
R
A
A
A
V
P
L
D
P
V
L
N
P
Q
T
N
A
P
T
P
L
G
G
A
V
L
R
A
T
S
P
-
M
-
H
M
Q
Y
L
R
N
M
G
V
G
S
S
L
S
V
S
V
V
V
G
G
Q
L
W
G
L
I
V
C
H
H
Q
T
P
Y
V
L
P
P
D
L
R
T
T
L
E
Y
L
G
R
L
L
S
L
Q
V
Q
R
K
E
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
40
PsiBlast_CBE
51.17
39%
-87
- C4 -
4Y5F
1
BPHY_DEIRA
A:
[16-314]
--------------
I
T
T
E
N
C
E
R
E
P
I
H
I
P
G
S
I
Q
P
H
G
A
L
-
L
T
A
D
G
H
S
-
G
E
-
V
L
Q
M
-
S
L
N
A
A
T
F
L
-----
G
-----
Q
E
P
------
T
V
--------
L
R
G
Q
T
L
A
A
-
L
-
L
P
E
Q
W
P
A
L
Q
A
A
L
P
P
-
G
C
P
DA
L
Q
Y
R
-
A
T
-----
L
D
W
P
A
A
G
H
--
L
S
L
T
V
-
H
R
V
G
E
-
L
L
I
L
E
F
E
-
P
T
E
A
W
D
S
T
G
P
H
A
L
R
N
A
M
F
A
L
-
E
S
A
P
---
N
L
R
A
L
A
E
V
A
T
Q
T
V
R
E
L
T
G
F
D
R
V
-
M
L
Y
K
F
A
P
D
A
T
G
E
V
I
A
E
A
R
R
E
G
L
H
A
F
L
G
H
R
F
P
A
S
D
I
P
A
Q
A
R
A
L
Y
T
R
H
L
L
R
L
T
A
D
T
R
A
A
A
V
P
L
D
P
V
L
N
P
Q
T
N
A
P
T
P
L
G
G
A
V
L
R
A
T
S
P
-
M
-
H
M
Q
Y
L
R
N
M
G
V
G
S
S
L
S
V
S
V
V
V
G
G
Q
L
W
G
L
I
A
C
H
H
Q
T
P
Y
V
L
P
P
D
L
R
T
T
L
E
S
L
G
R
L
L
S
L
Q
V
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
50.66
39%
-93
- C4 -
4IJG
5
BPHY_DEIRA
A:
[31-329]
--------------
I
T
T
E
N
C
E
R
E
P
I
H
I
P
G
S
I
Q
P
H
G
A
L
-
L
T
A
D
G
H
S
-
G
E
-
V
L
Q
M
-
S
L
N
A
A
T
F
L
-----
G
-----
Q
E
P
------
T
V
--------
L
R
G
Q
T
L
A
A
-
L
-
L
P
E
Q
W
P
A
L
Q
A
A
L
P
P
-
G
C
P
DA
L
Q
Y
R
-
A
T
-----
L
D
W
P
A
A
G
H
--
L
S
L
T
V
-
H
R
V
G
E
-
L
L
I
L
E
F
E
-
P
T
E
------
P
H
A
L
R
N
A
---
M
-
S
A
L
E
S
A
P
N
L
R
A
L
A
E
V
A
T
Q
T
V
R
E
L
T
G
F
D
R
V
-
M
L
Y
K
F
A
P
D
A
T
G
E
V
I
A
E
A
R
R
E
G
L
H
A
F
L
G
H
R
F
P
A
S
D
I
P
A
Q
A
R
A
L
Y
T
R
H
L
L
R
L
T
A
D
T
R
A
A
A
V
P
L
D
P
V
L
N
P
Q
T
N
A
P
T
P
L
G
G
A
V
L
R
A
T
S
P
-
M
-
H
M
Q
Y
L
R
N
M
G
V
G
S
S
L
S
V
S
V
V
V
G
G
Q
L
W
G
L
I
A
C
H
H
Q
T
P
Y
V
L
P
P
D
L
R
T
T
L
E
Y
L
G
R
E
L
S
E
Q
V
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
50.54
40%
-81
- C4 -
4E04
1
?
A:
[13-317]
-----------------
S
T
C
D
D
E
P
I
H
I
P
G
A
I
Q
P
H
G
L
L
-
L
A
L
A
A
-
D
-
M
T
-
I
V
A
G
-
S
D
N
L
P
E
L
T
-----
G
-----
L
A
I
GALIGR
S
A
--------
A
D
V
F
D
S
E
T
-
H
-
N
R
L
T
I
A
L
A
E
P
G
A
A
V
-
G
A
P
----
I
A
-
V
G
-----
F
T
M
P
D
G
E
R
--
A
F
N
G
S
W
H
R
H
D
Q
-
L
V
F
L
E
L
E
-
P
P
Q
R
D
V
R
Y
P
Q
A
F
F
R
S
V
R
S
A
I
-
R
R
L
Q
A
A
E
T
L
E
S
A
C
A
A
A
A
Q
E
V
R
E
I
T
G
F
D
R
V
-
M
I
Y
R
F
A
S
D
F
S
G
E
V
I
A
E
D
R
C
A
E
V
E
S
Y
L
G
L
H
F
P
A
S
D
I
P
A
Q
A
R
R
L
Y
T
I
N
P
V
R
I
I
P
D
I
N
Y
R
P
V
P
V
T
P
D
L
N
P
R
T
G
R
P
I
D
L
S
F
A
I
L
R
S
V
S
P
-
V
-
H
L
E
Y
M
R
N
I
G
M
H
G
T
M
S
I
S
I
L
R
G
E
R
L
W
G
L
I
A
C
H
H
R
K
P
N
Y
V
D
L
E
V
R
Q
A
C
E
L
V
A
Q
V
L
A
W
Q
I
G
V
M
E
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
41
PsiBlast_CBE
50.22
39%
-90
- C4 -
4Q0I
3
BPHY_DEIRA
A:
[34-332]
--------------
I
T
T
E
N
C
E
R
E
P
I
H
I
P
G
S
I
Q
P
H
G
A
L
-
L
T
A
D
G
H
S
-
G
E
-
V
L
Q
M
-
S
L
N
A
A
T
F
L
-----
G
-----
Q
E
P
------
T
V
--------
L
R
G
Q
T
L
A
A
-
L
-
L
P
E
Q
W
P
A
L
Q
A
A
L
P
P
-
G
C
P
DA
L
Q
Y
R
-
A
T
-----
L
D
W
P
A
A
G
H
--
L
S
L
T
V
-
H
R
V
G
E
-
L
L
I
L
E
F
E
-
P
T
E
------
P
H
A
L
R
N
A
M
F
A
L
-
E
S
A
P
---
N
L
R
A
L
A
E
V
A
T
Q
T
V
R
E
L
T
G
F
D
R
V
-
M
L
Y
K
F
A
P
D
A
T
G
E
V
I
A
E
A
R
R
E
G
L
H
A
F
L
G
H
R
F
P
A
S
A
I
P
A
Q
A
R
A
L
Y
T
R
H
L
L
R
L
T
A
D
T
R
A
A
A
V
P
L
D
P
V
L
N
P
Q
T
N
A
P
T
P
L
G
G
A
V
L
R
A
T
S
P
-
M
-
H
M
Q
Y
L
R
N
M
G
V
G
S
S
L
S
V
S
V
V
V
G
G
Q
L
W
G
L
I
A
C
H
H
Q
T
P
Y
V
L
P
P
D
L
R
T
T
L
E
S
L
G
R
L
L
S
L
Q
V
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
35
PsiBlast_CBE
49.88
40%
-79
- C4 -
4E04
1
?
B:
[12-317]
----------------
L
S
T
C
D
D
E
P
I
H
I
P
G
A
I
Q
P
H
G
L
L
-
L
A
L
A
A
-
D
-
M
T
-
I
V
A
G
-
S
D
N
L
P
E
L
T
-----
G
-----
L
A
I
GALIGR
S
A
--------
A
D
V
F
D
S
E
T
-
H
-
N
R
L
T
I
A
L
A
E
P
G
A
A
V
-
G
A
P
----
I
A
-
V
G
-----
F
T
M
P
D
G
E
R
--
A
F
N
G
S
W
H
R
H
D
Q
-
L
V
F
L
E
L
E
-
P
P
Q
R
D
V
R
Y
P
Q
A
F
F
R
S
V
R
S
A
I
-
R
R
L
Q
A
A
E
T
L
E
S
A
C
A
A
A
A
Q
E
V
R
E
I
T
G
F
D
R
V
-
M
I
Y
R
F
A
S
D
F
S
G
E
V
I
A
E
D
R
C
A
E
V
E
S
Y
L
G
L
H
F
P
A
S
D
I
P
A
Q
A
R
R
L
Y
T
I
N
P
V
R
I
I
P
D
I
N
Y
R
P
V
P
V
T
P
D
L
N
P
R
T
G
R
P
I
D
L
S
F
A
I
L
R
S
V
S
P
-
V
-
H
L
E
Y
M
R
N
I
G
M
H
G
T
M
S
I
S
I
L
R
G
E
R
L
W
G
L
I
A
C
H
H
R
K
P
N
Y
V
D
L
E
V
R
Q
A
C
E
L
V
A
Q
V
L
A
W
Q
I
G
V
M
E
E
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
73
Fugue
47.77
38%
-84
* C4 *
1ZTU
1
BPHY_DEIRA
A:
[19-339]
PLPFFPPL
Y
L
G
G
P
E
I
T
T
E
N
C
E
R
E
P
I
H
I
P
G
S
I
Q
P
H
G
A
L
-
L
T
A
D
G
-
H
-
S
G
E
V
L
Q
M
-
S
L
N
A
A
T
F
L
-----
G
-----
Q
E
P
------
T
V
--------
L
R
G
Q
T
L
A
A
-
L
-
L
P
E
Q
W
P
A
L
Q
A
A
L
P
P
-
G
C
P
----
D
A
L
Q
Y
-----
R
A
T
L
D
W
P
G
--
H
L
S
L
T
V
H
R
V
G
E
-
L
L
I
L
E
F
E
-
P
T
E
P
----------
H
A
L
R
N
A
M
F
A
L
E
S
A
P
N
L
R
A
L
A
E
V
A
T
Q
T
V
R
E
L
T
G
F
D
R
V
M
L
-
Y
K
F
A
P
D
A
T
G
E
V
I
A
E
A
R
R
E
G
L
H
A
F
L
G
H
R
F
P
A
S
D
I
P
A
Q
A
R
A
L
Y
T
R
H
L
L
R
L
T
A
D
T
R
A
A
A
V
P
L
D
P
V
L
N
T
Q
T
N
A
P
T
P
L
G
G
A
V
L
R
A
T
S
P
M
H
M
Q
--
Y
L
R
N
M
G
V
G
S
S
L
S
V
S
V
V
V
G
G
Q
L
W
G
L
I
A
C
H
H
Q
T
P
Y
V
L
P
P
D
L
R
T
T
L
E
Y
L
G
R
L
L
S
L
Q
V
Q
V
K
E
A
H
H
H
H
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------