@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 : gbs0792: (2015-12-03 )
MTLQDEIKKRRTFAIISHPDAGKTTITEQLLYFGGEIREAGTVKGKKSGTFAKSDWMDIEKQRGISVTSSVMQFDYAGKRVNILDTPGHEDFSEDTYRTLMAVDAAVMVVDSAKGIEAQTKKLFEVVKHRNIPVFTFINKLDRDGREPLDLLEELEEVLGIASYPMNWPIGMGKSFEGLYDLHNKRLELYKGDERFASIEDGDQLFANNPFYEQVKEDIELLQEAGNDFSEQAILDGDLTPVFFGSALTNFGVQTFLDTFLEFAPEPHGHKTTEGNVIDPLAKDFSGFVFKIQANMDPRHRDRIAFVRIVSGEFERGMGVNLTRTGKGAKLSNVTQFMAESRENVTNAVAGDIIGVYDTGTYQVGDTLTVGKNKFEFEPLPTFTPELFMKVSAKNVMKQKSFHKGIEQLVQEGAIQLYKNYQTGEYMLGAVGQLQFEVFKHRMEGEYNAEVVMTPMGKKTVRWINSDDLDERMSSSRNILAKDRFDQPVFLFENDFALRWFADKYPDVKLEEKM
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..-----------------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
-M
T
L
Q
D
E
I
KKR
R
T
F
A
I
I
SHPDAG
K
T
T
I
T
E
Q
L
L
Y
FGGEIREAGTVKGKKSGTFAKS
D
W
M
D
I
E
K
QRGI
S
V
T
S
S
V
M
Q
FDYAG
K
R
V
N
I
L
DTPGHEDF
S
E
D
T
Y
R
T
L
M
A
V
D
A
A
V
M
V
VDSAKG
I
E
A
Q
T
K
K
L
F
E
V
V
K
HRNI
P
V
F
T
F
I
N
K
LDRDGR
E
P
L
D
L
L
E
E
L
E
E
V
LGIASYPMNWPIGMGK
S
F
E
G
L
Y
D
L
H
N
K
R
L
ELYK--GDER--FA-----SIED--GD---------QLF-ANNP---------
F
Y
--------
E
-------
Q
V
K
E
--------
D
I
E
L
L
Q
E
AGNDF
S
E
Q----------------------AIL----------------------DGDL
T
P
V
F
F
G
S
A
L
T
NF
G
V
Q
T
F
L
D
T
F
L
E
FAP-----EPH-----GHKTTEGNVI----
D
P
L
A
K
D---FS
G
F
V
F
K
I
QANMDPRHR
D
R
I
A
F
V
R
I
VSGEFERGMGV
N
L
TRTGKGA
K
L
S
N
V
T
Q
F
M
A
E
S
R
E
N
V
T
N
AVAG
D
I
I
G
V
Y
DTG
T
Y
Q
VG
D
T
L
T
VGKN--KFEFEPLPTF
T
P
E
L
F
M
K
V
S
A
K
N
V
M
K
Q
K
S
F
H
K
G
I
E
Q
L
V
Q
E
-
G
A
-
I
Q
L
Y
KNYQTG
E
Y
M
L
G
A
V
G
Q
L
Q
F
E
V
F
K
H
R
M---------------------------EGEYN-----------
A
E
V
V
M-----TPM----GK
K
-
T
V
R
WI---
N
S
-----
D
---
D
---
L
-
D
E
R
M
S
--SSRNILAKDRFDQ
P
V
F
L
F
E-ND
F
A
L
R
W
F
ADKYPD
V
K
LEEKM-----------------------------------------------------------------------------------------------------------
25
PsiBlast_CBE
96.25
48%
-87
- C2 -
3VQT
1
RF3_DESVM
D:
[33-541]
------------
T
F
A
I
I
S
H
P
D
A
G
K
T
T
L
T
E
K
L
L
L
F
G
G
A
I
Q
M
A
G
------------------------
S
V
T
T
S
V
M
Q
F
P
Y
R
D
R
V
V
N
L
L
D
T
P
G
H
Q
D
F
S
E
D
T
Y
R
V
L
T
A
V
D
S
A
L
V
V
I
D
A
A
K
G
V
E
A
Q
T
R
K
L
M
D
V
C
R
M
R
A
T
P
V
M
T
F
V
N
K
M
D
R
E
A
L
H
P
L
D
V
M
A
D
I
E
Q
H
L
Q
I
E
C
A
P
M
T
W
P
I
G
M
G
S
S
F
K
G
T
Y
D
L
L
H
K
Q
L
H
L
F
S
---------------
R
I
Q
S
--
G
I
---------
V
I
H
G
A
D
D
P
---------
Q
L
D
E
Y
LGDQ
A
E
-------
Q
L
R
M
--------
D
L
A
L
L
E
E
A
G
T
P
F
D
E
E
----------------------
R
Y
L
----------------------
K
G
E
L
T
P
V
F
F
G
S
A
I
N
N
F
G
V
R
E
M
L
D
M
F
V
E
F
A
P
-----
G
P
Q
-----
P
-
R
P
A
A
T
R
V
V
----
E
P
G
E
E
A
---
F
T
G
V
V
F
K
I
Q
A
N
----
H
R
D
R
M
A
F
L
R
I
C
S
G
T
F
T
R
G
M
R
L
K
H
H
R
T
G
K
D
V
T
V
A
N
A
T
I
F
M
A
Q
D
R
T
G
V
E
E
A
F
P
G
D
I
I
G
I
P
N
H
G
T
I
K
I
G
D
T
F
T
E
S
K
E
--
V
L
K
F
V
G
I
P
N
F
A
P
E
H
F
R
R
V
R
L
K
N
P
L
K
A
K
Q
L
Q
K
G
L
E
Q
L
A
E
E
-
G
A
-
V
Q
L
F
R
P
L
V
N
N
D
Y
I
L
G
A
V
G
V
L
Q
F
D
V
I
V
A
R
L
---------------------------
A
D
E
Y
G
-----------
V
D
A
V
Y
-----
E
G
V
----
S
T
H
-
T
A
R
W
V
---
Y
C
-----
E
---
D
K
K
I
F
-
A
D
F
Q
D
--
Y
H
R
G
E
L
A
V
D
A
E
G
A
L
A
Y
L
A
P
-
N
P
W
R
L
E
S
A
M
E
R
Y
P
K
V
E
F
R
T
T
R
-----------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
96.03
48%
-88
- C2 -
3VQT
1
RF3_DESVM
A:
[33-541]
------------
T
F
A
I
I
S
H
P
D
A
G
K
T
T
L
T
E
K
L
L
L
F
G
G
A
I
Q
M
A
G
S
V
K
A
R
--------------------
V
T
T
S
V
M
Q
F
P
Y
R
D
R
V
V
N
L
L
D
T
P
G
H
Q
D
F
S
E
D
T
Y
R
V
L
T
A
V
D
S
A
L
V
V
I
D
A
A
K
G
V
E
A
Q
T
R
K
L
M
D
V
C
R
M
R
A
T
P
V
M
T
F
V
N
K
M
D
R
E
A
L
H
P
L
D
V
M
A
D
I
E
Q
H
L
Q
I
E
C
A
P
M
T
W
P
I
G
M
G
S
S
F
K
G
T
Y
D
L
L
H
K
Q
L
H
L
F
S
-----------------
Q
S
--
G
I
---------
V
I
H
G
A
D
D
P
---------
Q
L
D
E
Y
LGDQ
A
E
-------
Q
L
R
M
--------
D
L
A
L
L
E
E
A
G
T
P
F
D
E
E
----------------------
R
Y
L
----------------------
K
G
E
L
T
P
V
F
F
G
S
A
I
N
N
F
G
V
R
E
M
L
D
M
F
V
E
F
A
P
-----
G
P
Q
-----
P
-
R
P
A
A
T
R
V
V
----
E
P
G
E
E
A
---
F
T
G
V
V
F
K
I
Q
A
N
-------
R
M
A
F
L
R
I
C
S
G
T
F
T
R
G
M
R
L
K
H
H
R
T
G
K
D
V
T
V
A
N
A
T
I
F
M
A
Q
D
R
T
G
V
E
E
A
F
P
G
D
I
I
G
I
P
N
H
G
T
I
K
I
G
D
T
F
T
E
S
K
E
--
V
L
K
F
V
G
I
P
N
F
A
P
E
H
F
R
R
V
R
L
K
N
P
L
K
A
K
Q
L
Q
K
G
L
E
Q
L
A
E
E
-
G
A
-
V
Q
L
F
R
P
L
V
N
N
D
Y
I
L
G
A
V
G
V
L
Q
F
D
V
I
V
A
R
L
---------------------------
A
D
E
Y
G
-----------
V
D
A
V
Y
-----
E
G
V
----
S
T
H
-
T
A
R
W
V
---
Y
C
-----
E
---
D
K
K
I
F
-
A
D
F
Q
D
--
Y
H
R
G
E
L
A
V
D
A
E
G
A
L
A
Y
L
A
P
-
N
P
W
R
L
E
S
A
M
E
R
Y
P
K
V
E
F
R
T
T
R
-----------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
94.94
48%
-82
- C2 -
3VR1
1
RF3_DESVM
B:
[33-541]
------------
T
F
A
I
I
S
H
P
D
A
G
K
T
T
L
T
E
K
L
L
L
F
G
G
A
I
Q
M
A
G
S
V
K
A
R
K
A
A
R
H
A
T
S
D
W
M
A
M
E
R
E
R
G
I
S
V
T
T
S
V
M
Q
F
P
Y
R
D
R
V
V
N
L
L
D
T
P
G
H
Q
D
F
S
E
D
T
Y
R
V
L
T
A
V
D
S
A
L
V
V
I
D
A
A
K
G
V
E
A
Q
T
R
K
L
M
D
V
C
R
M
R
A
T
P
V
M
T
F
V
N
K
M
D
R
E
A
L
H
P
L
D
V
M
A
D
I
E
Q
H
L
Q
I
E
C
A
P
M
T
W
P
I
G
M
G
S
S
F
K
G
T
Y
D
L
L
H
K
Q
L
H
L
F
S
--
A
-------------
I
Q
S
--
G
I
---------
V
I
H
G
A
D
D
P
---------
Q
L
DEYLGDQA
E
-------
Q
L
R
M
--------
D
L
A
L
L
E
E
A
G
T
P
F
D
E
E
----------------------
R
Y
L
----------------------
K
G
E
L
T
P
V
F
F
G
S
A
I
N
N
F
G
V
R
E
M
L
D
M
F
V
E
F
A
P
-----
G
P
Q
-----
P
-
R
P
A
A
T
R
V
V
----
E
P
G
E
E
A
---
F
T
G
V
V
F
K
I
Q
A
--------
R
M
A
F
L
R
I
C
S
G
T
F
T
R
G
M
R
L
K
H
H
R
T
G
K
D
V
T
V
A
N
A
T
I
F
M
A
Q
D
R
T
G
V
E
E
A
F
P
G
D
I
I
G
I
P
N
H
G
T
I
K
I
G
D
T
F
T
E
S
K
E
--
V
L
K
F
V
G
I
P
N
F
A
P
E
H
F
R
R
V
R
L
K
N
P
L
K
A
K
Q
L
Q
K
G
L
E
Q
L
A
E
E
-
G
A
-
V
Q
L
F
R
P
L
V
N
N
D
Y
I
L
G
A
V
G
V
L
Q
F
D
V
I
V
A
R
L
---------------------------
A
D
E
Y
G
-----------
V
D
A
V
Y
-----
E
G
V
----
S
T
H
-
T
A
R
W
V
---
Y
C
-----
E
---
D
KKI
F
-
A
D
F
Q
D
--
Y
H
R
G
E
L
A
V
D
A
E
G
A
L
A
Y
L
A
P
-
N
P
W
R
L
E
S
A
M
E
R
Y
P
K
V
E
F
R
T
T
R
-----------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
94.92
46%
-73
- C2 -
3TR5
2
RF3_COXBU
A:
[6-524]
---
V
E
K
Q
T
A
M
R
R
T
F
A
I
I
S
H
P
D
A
G
K
T
T
L
T
E
K
L
L
L
F
G
G
A
I
Q
L
A
G
T
I
K
S
R
----
H
A
T
S
D
W
M
E
L
E
K
Q
R
G
I
S
V
T
T
S
V
M
Q
F
P
Y
K
D
Y
L
I
N
L
L
D
T
P
G
H
A
D
F
T
E
D
T
Y
R
T
L
T
A
V
D
S
A
L
M
V
I
D
A
A
K
G
V
E
P
R
T
I
K
L
M
E
V
C
R
L
R
H
T
P
I
M
T
F
I
N
K
M
D
R
D
T
R
P
S
I
E
L
L
D
E
I
E
S
I
L
R
I
H
C
A
P
V
T
W
P
I
G
M
G
K
Y
F
K
G
I
Y
H
L
I
E
D
A
I
Y
L
Y
Q
P
G
K
H
E
R
--
V
G
-----
E
S
E
R
--
I
E
---------
G
I
---
N
N
P
E
L
D
K
K
L
G
D
-
L
A
--------
S
-------
E
L
R
N
--------
E
I
E
L
V
K
G
A
S
H
P
F
E
R
E
----------------------
G
Y
L
----------------------
K
G
E
L
T
P
I
F
F
G
S
A
I
N
N
F
G
V
G
E
L
L
D
A
F
V
K
E
A
P
-----
P
P
Q
-----
G
-
R
E
T
N
S
R
L
V
----
K
P
E
E
E
K
---
F
S
G
F
V
F
K
I
Q
A
N
M
D
-
G
H
R
D
R
I
A
F
L
R
I
A
S
G
Q
Y
Q
K
G
M
K
A
Y
H
V
R
L
K
K
E
I
Q
I
N
N
A
L
T
F
M
A
G
K
R
E
N
A
E
E
A
W
P
G
D
I
I
G
L
H
N
H
G
T
I
Q
I
G
D
T
F
T
Q
G
E
---
R
F
K
F
T
G
I
P
N
F
A
S
E
L
F
R
L
V
R
L
K
D
P
L
K
Q
K
A
L
L
K
G
L
T
Q
L
S
E
E
-
G
A
-
T
Q
L
F
R
P
L
D
S
N
E
L
I
L
G
A
V
G
L
L
Q
F
D
V
V
A
Y
R
L
---------------------------
E
N
E
Y
N
-----------
V
K
C
V
Y
-----
E
S
V
----
N
V
V
-
T
A
R
W
V
---
I
C
-----
D
---
D
K
A
-
V
-
L
E
R
F
N
Q
E
Q
S
R
N
-
L
A
Y
D
G
G
G
H
L
T
Y
L
A
P
-
S
R
V
N
L
E
I
T
M
E
K
W
P
E
I
Q
F
S
E
T
R
-----------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
94.67
48%
-87
- C2 -
3VQT
1
RF3_DESVM
B:
[33-541]
------------
T
F
A
I
I
S
H
P
D
A
G
K
T
T
L
T
E
K
L
L
L
F
G
G
A
I
Q
M
A
G
S
V
K
A
----------------------
T
T
S
V
M
Q
F
P
Y
R
D
R
V
V
N
L
L
D
T
P
G
H
Q
D
F
S
E
D
T
Y
R
V
L
T
A
V
D
S
A
L
V
V
I
D
A
A
K
G
V
E
A
Q
T
R
K
L
M
D
V
C
R
M
R
A
T
P
V
M
T
F
V
N
K
M
D
R
E
A
L
H
P
L
D
V
M
A
D
I
E
Q
H
L
Q
I
E
C
A
P
M
T
W
P
I
G
M
G
S
S
F
K
G
T
Y
D
L
L
H
K
Q
L
H
L
F
-----------------
I
Q
S
--
G
I
---------
V
I
H
G
A
D
D
P
---------
Q
L
D
E
Y
LGDQ
A
E
-------
Q
L
R
M
--------
D
L
A
L
L
E
E
A
G
T
P
F
D
E
E
----------------------
R
Y
L
----------------------
K
G
E
L
T
P
V
F
F
G
S
A
I
N
N
F
G
V
R
E
M
L
D
M
F
V
E
F
A
P
-----
G
P
Q
-----
P
-
R
P
A
A
T
R
V
V
----
E
P
G
E
E
A
---
F
T
G
V
V
F
K
I
Q
A
--------
R
M
A
F
L
R
I
C
S
G
T
F
T
R
G
M
R
L
K
H
H
R
T
G
K
D
V
T
V
A
N
A
T
I
F
M
A
Q
D
R
T
G
V
E
E
A
F
P
G
D
I
I
G
I
P
N
H
G
T
I
K
I
G
D
T
F
T
E
S
K
E
--
V
L
K
F
V
G
I
P
N
F
A
P
E
H
F
R
R
V
R
L
K
N
P
L
K
A
K
Q
L
Q
K
G
L
E
Q
L
A
E
E
-
G
A
-
V
Q
L
F
R
P
L
V
N
N
D
Y
I
L
G
A
V
G
V
L
Q
F
D
V
I
V
A
R
L
---------------------------
A
D
E
Y
G
-----------
V
D
A
V
Y
-----
E
G
V
----
S
T
H
-
T
A
R
W
V
---
Y
C
-----
E
---
D
K
K
I
F
-
A
D
F
Q
D
--
Y
H
R
G
E
L
A
V
D
A
E
G
A
L
A
Y
L
A
P
-
N
P
W
R
L
E
S
A
M
E
R
Y
P
K
V
E
F
R
T
T
R
-----------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
94.40
48%
-84
- C2 -
3VR1
1
RF3_DESVM
A:
[33-541]
------------
T
F
A
I
I
S
H
P
D
A
G
K
T
T
L
T
E
K
L
L
L
F
G
G
A
I
Q
M
A
G
S
V
K
A
R
K
A
A
R
H
A
T
S
D
W
M
A
M
E
R
E
R
G
I
S
V
T
T
S
V
M
Q
F
P
Y
R
D
R
V
V
N
L
L
D
T
P
G
H
Q
D
F
S
E
D
T
Y
R
V
L
T
A
V
D
S
A
L
V
V
I
D
A
A
K
G
V
E
A
Q
T
R
K
L
M
D
V
C
R
M
R
A
T
P
V
M
T
F
V
N
K
M
D
R
E
A
L
H
P
L
D
V
M
A
D
I
E
Q
H
L
Q
I
E
C
A
P
M
T
W
P
I
G
M
G
S
S
F
K
G
T
Y
D
L
L
H
K
Q
L
H
L
F
S
--
A
-------------
I
Q
S
--
G
I
---------
V
I
H
G
A
D
D
P
---------
Q
L
D
E
Y
LGDQ
A
E
-------
Q
L
R
M
--------
D
L
A
L
L
E
E
A
G
T
P
F
D
E
E
----------------------
R
Y
L
----------------------
K
G
E
L
T
P
V
F
F
G
S
A
I
N
N
F
G
V
R
E
M
L
D
M
F
V
E
F
A
P
-----
G
P
Q
-----
P
-
R
P
A
A
T
R
V
V
----
E
P
G
E
E
A
---
F
T
G
V
V
F
K
I
Q
A
--------
R
M
A
F
L
R
I
C
S
G
T
F
T
R
G
M
R
L
K
H
H
R
T
G
K
D
V
T
V
A
N
A
T
I
F
M
A
Q
D
R
T
G
V
E
E
A
F
P
G
D
I
I
G
I
P
N
H
G
T
I
K
I
G
D
T
F
T
E
S
K
E
--
V
L
K
F
V
G
I
P
N
F
A
P
E
H
F
R
R
V
R
L
K
N
P
L
K
A
K
Q
L
Q
K
G
L
E
Q
L
A
E
E
-
G
A
-
V
Q
L
F
R
P
L
V
N
N
D
Y
I
L
G
A
V
G
V
L
Q
F
D
V
I
V
A
R
L
---------------------------
A
D
E
Y
G
-----------
V
D
A
V
Y
-----
E
G
V
----
S
T
H
-
T
A
R
W
V
---
Y
C
-----
E
---
D
K
K
I
F
-
A
D
F
Q
D
--
Y
H
R
G
E
L
A
V
D
A
E
G
A
L
A
Y
L
A
P
-
N
P
W
R
L
E
S
A
M
E
R
Y
P
K
V
E
F
R
T
T
R
-----------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
94.39
48%
-84
- C2 -
3VR1
1
RF3_DESVM
C:
[33-541]
------------
T
F
A
I
I
S
H
P
D
A
G
K
T
T
L
T
E
K
L
L
L
F
G
G
A
I
Q
M
A
G
S
V
K
A
R
K
A
A
R
H
A
T
S
D
W
M
A
M
E
R
E
R
G
I
S
V
T
T
S
V
M
Q
F
P
Y
R
D
R
V
V
N
L
L
D
T
P
G
H
Q
D
F
S
E
D
T
Y
R
V
L
T
A
V
D
S
A
L
V
V
I
D
A
A
K
G
V
E
A
Q
T
R
K
L
M
D
V
C
R
M
R
A
T
P
V
M
T
F
V
N
K
M
D
R
E
A
L
H
P
L
D
V
M
A
D
I
E
Q
H
L
Q
I
E
C
A
P
M
T
W
P
I
G
M
G
S
S
F
K
G
T
Y
D
L
L
H
K
Q
L
H
L
F
S
--
A
-------------
I
Q
S
--
G
I
---------
V
I
H
G
A
D
D
P
---------
Q
L
DEYLGDQA
E
-------
Q
L
R
M
--------
D
L
A
L
L
E
E
A
G
T
P
F
D
E
E
----------------------
R
Y
L
----------------------
K
G
E
L
T
P
V
F
F
G
S
A
I
N
N
F
G
V
R
E
M
L
D
M
F
V
E
F
A
P
-----
G
P
Q
-----
P
-
R
P
A
A
T
R
V
V
----
E
P
G
E
E
A
---
F
T
G
V
V
F
K
I
Q
A
--------
R
M
A
F
L
R
I
C
S
G
T
F
T
R
G
M
R
L
K
H
H
R
T
G
K
D
V
T
V
A
N
A
T
I
F
M
A
Q
D
R
T
G
V
E
E
A
F
P
G
D
I
I
G
I
P
N
H
G
T
I
K
I
G
D
T
F
T
E
S
K
E
--
V
L
K
F
V
G
I
P
N
F
A
P
E
H
F
R
R
V
R
L
K
N
P
L
K
A
K
Q
L
Q
K
G
L
E
Q
L
A
E
E
-
G
A
-
V
Q
L
F
R
P
L
V
N
N
D
Y
I
L
G
A
V
G
V
L
Q
F
D
V
I
V
A
R
L
---------------------------
A
D
E
Y
G
-----------
V
D
A
V
Y
-----
E
G
V
----
S
T
H
-
T
A
R
W
V
---
Y
C
-----
E
---
D
KKI
F
-
A
D
F
Q
D
--
Y
H
R
G
E
L
A
V
D
A
E
G
A
L
A
Y
L
A
P
-
N
P
W
R
L
E
S
A
M
E
R
Y
P
K
V
E
F
R
T
T
R
-----------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
94.37
47%
-84
- C2 -
2H5E
1
RF3_ECOLI
B:
[9-525]
------
E
V
A
K
R
R
T
F
A
I
I
S
H
P
D
A
G
K
T
T
I
T
E
K
V
L
L
F
G
Q
--------------------------------
T
T
S
V
M
Q
F
P
Y
H
D
C
L
V
N
L
L
D
T
P
G
H
E
D
F
S
E
D
T
Y
R
T
L
T
A
V
D
C
C
L
M
V
I
D
A
A
K
G
V
E
D
R
T
R
K
L
M
E
V
T
R
L
R
D
T
P
I
L
T
F
M
N
K
L
D
R
D
I
R
D
P
M
E
L
L
D
E
V
E
N
E
L
K
I
G
C
A
P
I
T
W
P
I
G
C
G
K
L
F
K
G
V
Y
H
L
Y
K
D
E
T
Y
L
Y
Q
--
S
G
K
G
--
H
T
-----
I
Q
E
V
--
R
I
---------
V
K
G
-
L
N
N
P
D
L
D
A
A
VG
E
D
L
A
--------
Q
-------
Q
L
R
D
--------
E
L
E
L
V
K
G
A
S
N
E
F
D
K
E
----------------------
L
F
L
----------------------
A
G
E
I
T
P
V
F
F
G
T
A
L
G
N
F
G
V
D
H
M
L
D
G
L
V
E
W
A
P
-----
A
P
M
-----
P
-
R
Q
T
D
T
R
T
V
----
E
A
S
E
D
K
---
F
T
G
F
V
F
K
I
Q
A
--------
R
V
A
F
M
R
V
V
S
G
K
Y
E
K
G
M
K
L
R
Q
V
R
T
A
K
D
V
V
I
S
D
A
L
T
F
M
A
-----
V
E
E
A
Y
P
G
D
I
L
G
L
H
N
H
G
T
I
Q
I
G
D
T
F
T
Q
G
E
---
M
M
K
F
T
G
I
P
N
F
A
P
E
L
F
R
R
I
R
L
K
D
----
K
Q
L
L
K
G
L
V
Q
L
S
E
E
-
G
A
-
V
Q
V
F
R
P
I
S
N
N
D
L
I
V
G
A
V
G
V
L
Q
F
D
V
V
V
A
R
L
---------------------------
K
S
E
Y
N
-----------
V
E
A
V
Y
-----
E
S
V
----
N
V
A
-
T
A
R
W
V
---
E
C
-----
A
---
D
A
K
K
F
-
E
E
F
K
R
--
K
N
E
S
Q
L
A
L
D
G
G
D
N
L
A
Y
I
A
T
-
S
M
V
N
L
R
L
A
Q
E
R
Y
P
D
V
Q
F
H
Q
T
R
-----------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
94.23
48%
-83
- C2 -
3VR1
1
RF3_DESVM
D:
[33-541]
------------
T
F
A
I
I
S
H
P
D
A
G
K
T
T
L
T
E
K
L
L
L
F
G
G
A
I
Q
M
A
G
S
V
K
A
R
K
A
A
R
H
A
T
S
D
W
M
A
M
E
R
E
R
G
I
S
V
T
T
S
V
M
Q
F
P
Y
R
D
R
V
V
N
L
L
D
T
P
G
H
Q
D
F
S
E
D
T
Y
R
V
L
T
A
V
D
S
A
L
V
V
I
D
A
A
K
G
V
E
A
Q
T
R
K
L
M
D
V
C
R
M
R
A
T
P
V
M
T
F
V
N
K
M
D
R
E
A
L
H
P
L
D
V
M
A
D
I
E
Q
H
L
Q
I
E
C
A
P
M
T
W
P
I
G
M
G
S
S
F
K
G
T
Y
D
L
L
H
K
Q
L
H
L
F
S
--
A
-------------
I
Q
S
--
G
I
---------
V
I
H
G
A
D
D
P
---------
Q
L
DEYLGDQA
E
-------
Q
L
R
M
--------
D
L
A
L
L
E
E
A
G
T
P
F
D
E
E
----------------------
R
Y
L
----------------------
K
G
E
L
T
P
V
F
F
G
S
A
I
N
N
F
G
V
R
E
M
L
D
M
F
V
E
F
A
P
-----
G
P
Q
-----
P
-
R
P
A
A
T
R
V
V
----
E
P
G
E
E
A
---
F
T
G
V
V
F
K
I
Q
A
--------
R
M
A
F
L
R
I
C
S
G
T
F
T
R
G
M
R
L
K
H
H
R
T
G
K
D
V
T
V
A
N
A
T
I
F
M
A
Q
D
R
T
G
V
E
E
A
F
P
G
D
I
I
G
I
P
N
H
G
T
I
K
I
G
D
T
F
T
E
S
K
E
--
V
L
K
F
V
G
I
P
N
F
A
P
E
H
F
R
R
V
R
L
K
N
P
L
K
A
K
Q
L
Q
K
G
L
E
Q
L
A
E
E
-
G
A
-
V
Q
L
F
R
P
L
V
N
N
D
Y
I
L
G
A
V
G
V
L
Q
F
D
V
I
V
A
R
L
---------------------------
A
D
E
Y
G
-----------
V
D
A
V
Y
-----
E
G
V
----
S
T
H
-
T
A
R
W
V
---
Y
C
-----
E
---
D
KKI
F
-
A
D
F
Q
D
--
Y
H
R
G
E
L
A
V
D
A
E
G
A
L
A
Y
L
A
P
-
N
P
W
R
L
E
S
A
M
E
R
Y
P
K
V
E
F
R
T
T
R
-----------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
93.80
47%
-85
- C2 -
2H5E
1
RF3_ECOLI
A:
[9-525]
------
E
V
A
K
R
R
T
F
A
I
I
S
H
P
D
A
G
K
T
T
I
T
E
K
V
L
L
F
G
Q
-------------------------------
I
T
T
S
V
M
Q
F
P
Y
H
D
C
L
V
N
L
L
D
T
P
G
H
E
D
F
S
E
D
T
Y
R
T
L
T
A
V
D
C
C
L
M
V
I
D
A
A
K
G
V
E
D
R
T
R
K
L
M
E
V
T
R
L
R
D
T
P
I
L
T
F
M
N
K
L
D
R
D
I
R
D
P
M
E
L
L
D
E
V
E
N
E
L
K
I
G
C
A
P
I
T
W
P
I
G
C
G
K
L
F
K
G
V
Y
H
L
Y
K
D
E
T
Y
L
Y
Q
--
S
G
K
G
--
H
T
-----
I
Q
E
V
--
R
I
---------
V
K
G
-
L
N
N
P
D
L
D
A
A
VG
E
D
L
A
--------
Q
-------
Q
L
R
D
--------
E
L
E
L
V
K
G
A
S
N
E
F
D
K
E
----------------------
L
F
L
----------------------
A
G
E
I
T
P
V
F
F
G
T
A
L
G
N
F
G
V
D
H
M
L
D
G
L
V
E
W
A
P
-----
A
P
M
-----
P
-
R
Q
T
D
T
R
T
V
----
E
A
S
E
D
K
---
F
T
G
F
V
F
K
I
Q
A
N
M
D
P
K
H
R
D
R
V
A
F
M
R
V
V
S
G
K
Y
E
K
G
M
K
L
R
Q
V
R
T
A
K
D
V
V
I
S
D
A
L
T
F
M
A
-----
V
E
E
A
Y
P
G
D
I
L
G
L
H
N
H
G
T
I
Q
I
G
D
T
F
T
Q
G
E
---
M
M
K
F
T
G
I
P
N
F
A
P
E
L
F
R
R
I
R
L
K
D
P
---
K
Q
L
L
K
G
L
V
Q
L
S
E
E
-
G
A
-
V
Q
V
F
R
P
I
S
N
N
D
L
I
V
G
A
V
G
V
L
Q
F
D
V
V
V
A
R
L
---------------------------
K
S
E
Y
N
-----------
V
E
A
V
Y
-----
E
S
V
----
N
V
A
-
T
A
R
W
V
---
E
C
-----
A
---
D
A
K
K
F
-
E
E
F
K
R
--
K
N
E
S
Q
L
A
L
D
G
G
D
N
L
A
Y
I
A
T
-
S
M
V
N
L
R
L
A
Q
E
R
Y
P
D
V
Q
F
H
Q
T
R
-----------------------------------------------------------------------------------------------------------
52
HHSearch
93.57
47%
-86
- C2 -
2H5E
1
RF3_ECOLI
A:
[6-527]
---
Y
L
Q
E
V
A
K
R
R
T
F
A
I
I
S
H
P
D
A
G
K
T
T
I
T
E
K
V
L
L
F
G
Q
-------------------------------
I
T
T
S
V
M
Q
F
P
Y
H
D
C
L
V
N
L
L
D
T
P
G
H
E
D
F
S
E
D
T
Y
R
T
L
T
A
V
D
C
C
L
M
V
I
D
A
A
K
G
V
E
D
R
T
R
K
L
M
E
V
T
R
L
R
D
T
P
I
L
T
F
M
N
K
L
D
R
D
I
R
D
P
M
E
L
L
D
E
V
E
N
E
L
K
I
G
C
A
P
I
T
W
P
I
G
C
G
K
L
F
K
G
V
Y
H
L
Y
K
D
E
T
Y
L
Y
Q
--
S
G
K
G
HT
I
Q
E
V
R
I
V
K
G
L
N
N
P
D
L
---------
D
A
A
-
V
G
E
D
---------
L
A
--------
Q
-------
Q
L
R
D
--------
E
L
E
L
V
K
G
A
S
N
E
F
D
K
E
----------------------
L
F
L
----------------------
A
G
E
I
T
P
V
F
F
G
T
A
L
G
N
F
G
V
D
H
M
L
D
G
L
V
E
W
A
P
-----
A
P
M
-----
P
R
Q
T
D
T
-
R
T
V
----
E
A
S
E
D
K
---
F
T
G
F
V
F
K
I
Q
A
N
M
D
P
K
H
R
D
R
V
A
F
M
R
V
V
S
G
K
Y
E
K
G
M
K
L
R
Q
V
R
T
A
K
D
V
V
I
S
D
A
L
T
F
M
A
-----
V
E
E
A
Y
P
G
D
I
L
G
L
H
N
H
G
T
I
Q
I
G
D
T
F
T
Q
G
E
---
M
M
K
F
T
G
I
P
N
F
A
P
E
L
F
R
R
I
R
L
K
D
P
---
K
Q
L
L
K
G
L
V
Q
L
S
E
E
-
G
A
-
V
Q
V
F
R
P
I
S
N
N
D
L
I
V
G
A
V
G
V
L
Q
F
D
V
V
V
A
R
L
---------------------------
K
S
E
Y
N
-----------
V
E
A
V
Y
-----
E
S
V
----
N
V
A
-
T
A
R
W
V
---
E
C
-----
A
D
A
K
K
---
F
-
E
E
F
K
R
--
K
N
E
S
Q
L
A
L
D
G
G
D
N
L
A
Y
I
A
T
-
S
M
V
N
L
R
L
A
Q
E
R
Y
P
D
V
Q
F
H
Q
T
R
-----------------------------------------------------------------------------------------------------------
51
HHSearch
93.10
47%
-73
- C2 -
3TR5
2
RF3_COXBU
A:
[6-526]
---
V
E
K
Q
T
A
M
R
R
T
F
A
I
I
S
H
P
D
A
G
K
T
T
L
T
E
K
L
L
L
F
G
G
A
I
Q
L
A
G
T
I
K
S
R
----
H
A
T
S
D
W
M
E
L
E
K
Q
R
G
I
S
V
T
T
S
V
M
Q
F
P
Y
K
D
Y
L
I
N
L
L
D
T
P
G
H
A
D
F
T
E
D
T
Y
R
T
L
T
A
V
D
S
A
L
M
V
I
D
A
A
K
G
V
E
P
R
T
I
K
L
M
E
V
C
R
L
R
H
T
P
I
M
T
F
I
N
K
M
D
R
D
T
R
P
S
I
E
L
L
D
E
I
E
S
I
L
R
I
H
C
A
P
V
T
W
P
I
G
M
G
K
Y
F
K
G
I
Y
H
L
I
E
D
A
I
Y
L
Y
Q
--
P
G
K
H
ER
V
G
-----
E
-
S
E
--
R
I
---------
E
G
I
-
N
N
P
E
---------
L
D
--------
K
K
L
G
D
L
A
S
E
L
R
N
--------
E
I
E
L
V
K
G
A
S
H
P
F
E
R
E
----------------------
G
Y
L
----------------------
K
G
E
L
T
P
I
F
F
G
S
A
I
N
N
F
G
V
G
E
L
L
D
A
F
V
K
E
A
P
-----
P
P
Q
-----
G
R
E
T
N
-
S
R
L
V
----
K
P
E
E
E
K
---
F
S
G
F
V
F
K
I
Q
A
N
M
D
-
G
H
R
D
R
I
A
F
L
R
I
A
S
G
Q
Y
Q
K
G
M
K
A
Y
H
V
R
L
K
K
E
I
Q
I
N
N
A
L
T
F
M
A
G
K
R
E
N
A
E
E
A
W
P
G
D
I
I
G
L
H
N
H
G
T
I
Q
I
G
D
T
F
T
Q
G
E
---
R
F
K
F
T
G
I
P
N
F
A
S
E
L
F
R
L
V
R
L
K
D
P
L
K
Q
K
A
L
L
K
G
L
T
Q
L
S
E
E
-
G
A
-
T
Q
L
F
R
P
L
D
S
N
E
L
I
L
G
A
V
G
L
L
Q
F
D
V
V
A
Y
R
L
---------------------------
E
N
E
Y
N
-----------
V
K
C
V
Y
-----
E
S
V
----
N
V
V
T
A
R
W
V
I
---
C
D
D
K
A
V
L
E
---
R
---
F
-
N
Q
E
----
Q
S
R
N
L
A
Y
-
D
G
G
G
H
L
T
Y
L
A
P
-
S
R
V
N
L
E
I
T
M
E
K
W
P
E
I
Q
F
S
E
T
R
-----------------------------------------------------------------------------------------------------------
41
Fugue
92.59
45%
-87
- C2 -
2H5E
1
RF3_ECOLI
A:
[3-529]
L
S
P
Y
L
Q
E
V
A
K
R
R
T
F
A
I
I
S
H
P
D
A
G
K
T
T
I
T
E
K
V
L
L
F
G
-------------------------------
Q
I
T
T
S
V
M
Q
F
P
Y
H
D
C
L
V
N
L
L
D
T
P
G
H
E
D
F
S
E
D
T
Y
R
T
L
T
A
V
D
C
C
L
M
V
I
D
A
A
K
G
V
E
D
R
T
R
K
L
M
E
V
T
R
L
R
D
T
P
I
L
T
F
M
N
K
L
D
R
D
I
R
D
P
M
E
L
L
D
E
V
E
N
E
L
K
I
G
C
A
P
I
T
W
P
I
G
C
G
K
L
F
K
G
V
Y
H
L
Y
K
D
E
T
Y
L
Y
Q
--
S
G
K
G
--
H
T
-----
I
Q
E
V
--
R
I
V
K
G
LNN
P
D
L
D
A
A
-
V
G
E
D
---------
L
A
--------
Q
-------
Q
L
R
D
--------
E
L
E
L
V
K
G
A
S
N
E
F
D
K
E
----------------------
L
F
L
----------------------
A
G
E
I
T
P
V
F
F
G
T
A
L
G
N
F
G
V
D
H
M
L
D
G
L
V
E
W
A
P
-----
A
P
M
-----
P
R
Q
T
D
T
R
-
T
V
----
E
A
S
E
D
K
---
F
T
G
F
V
F
K
I
Q
A
N
M
D
P
K
H
R
D
R
V
A
F
M
R
V
V
S
G
K
Y
E
K
G
M
K
L
R
Q
V
R
T
A
K
D
V
V
I
S
D
A
L
T
F
M
A
-----
V
E
E
A
Y
P
G
D
I
L
G
L
H
N
H
G
T
I
Q
I
G
D
T
F
T
Q
G
E
---
M
M
K
F
T
G
I
P
N
F
A
P
E
L
F
R
R
I
R
L
K
D
---
P
K
Q
L
L
K
G
L
V
Q
L
S
E
E
-
G
A
-
V
Q
V
F
R
P
I
S
N
N
D
L
I
V
G
A
V
G
V
L
Q
F
D
V
V
V
A
R
L
---------------------------
K
S
E
Y
N
-----------
V
E
A
V
Y
-----
E
S
V
----
N
V
A
-
T
A
R
W
V
E
C
A
D
A
-----
K
---
K
---
F
-
E
E
F
K
R
--
K
N
E
S
Q
L
A
L
D
G
G
D
N
L
A
Y
I
A
T
-
S
M
V
N
L
R
L
A
Q
E
R
Y
P
D
V
Q
F
H
Q
T
R
EH---------------------------------------------------------------------------------------------------------
53
HHSearch
92.44
48%
-80
- C2 -
3VQT
1
RF3_DESVM
A:
[24-545]
---
L
E
R
E
A
A
R
R
R
T
F
A
I
I
S
H
P
D
A
G
K
T
T
L
T
E
K
L
L
L
F
G
G
A
I
Q
M
A
G
S
V
K
A
R
--------------------
V
T
T
S
V
M
Q
F
P
Y
R
D
R
V
V
N
L
L
D
T
P
G
H
Q
D
F
S
E
D
T
Y
R
V
L
T
A
V
D
S
A
L
V
V
I
D
A
A
K
G
V
E
A
Q
T
R
K
L
M
D
V
C
R
M
R
A
T
P
V
M
T
F
V
N
K
M
D
R
E
A
L
H
P
L
D
V
M
A
D
I
E
Q
H
L
Q
I
E
C
A
P
M
T
W
P
I
G
M
G
S
S
F
K
G
T
Y
D
L
L
H
K
Q
L
H
L
F
S
--------
Q
S
-----
G
I
V
I
--------------
H
G
-
A
D
D
P
---------
Q
L
--------
D
-------
E
Y
L
G
DQ
A
E
Q
L
R
M
D
L
A
L
L
E
E
A
G
T
P
F
D
E
E
----------------------
R
Y
L
----------------------
K
G
E
L
T
P
V
F
F
G
S
A
I
N
N
F
G
V
R
E
M
L
D
M
F
V
E
F
A
P
-----
G
P
Q
-----
P
R
P
A
A
-
T
R
V
V
----
E
P
G
E
E
A
---
F
T
G
V
V
F
K
I
Q
A
N
-------
R
M
A
F
L
R
I
C
S
G
T
F
T
R
G
M
R
L
K
H
H
R
T
G
K
D
V
T
V
A
N
A
T
I
F
M
A
Q
D
R
T
G
V
E
E
A
F
P
G
D
I
I
G
I
P
N
H
G
T
I
K
I
G
D
T
F
T
E
S
K
E
--
V
L
K
F
V
G
I
P
N
F
A
P
E
H
F
R
R
V
R
L
K
N
P
L
K
A
K
Q
L
Q
K
G
L
E
Q
L
A
E
E
-
G
A
-
V
Q
L
F
R
P
L
V
N
N
D
Y
I
L
G
A
V
G
V
L
Q
F
D
V
I
V
A
R
L
---------------------------
A
D
E
Y
G
-----------
V
D
A
V
Y
E
G
V
ST
H
T
A
----
R
W
V
-
Y
C
E
D
K
---
K
I
-------------
F
-
A
D
F
Q
D
--
Y
H
R
G
E
L
A
V
D
A
E
G
A
L
A
Y
L
A
P
-
N
P
W
R
L
E
S
A
M
E
R
Y
P
K
V
E
F
R
T
T
R
-----------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
77.63
29%
-76
- C2 -
2OM7
-
?
L:
[8-473]
------
D
L
K
R
L
R
N
I
G
I
A
A
H
I
D
A
G
K
T
T
T
T
E
R
I
L
Y
Y
T
G
R
I
--------------------------------
A
V
T
T
C
F
W
K
D
H
R
I
N
I
I
D
T
P
G
H
V
D
F
T
I
E
V
E
R
S
M
R
V
L
D
G
A
I
V
V
F
D
S
S
Q
G
V
E
P
Q
S
E
T
V
W
R
Q
A
E
K
Y
K
V
P
R
I
A
F
A
N
K
M
D
K
T
G
A
D
L
W
L
V
I
R
T
M
Q
E
R
L
G
A
R
P
V
V
M
Q
L
P
I
G
R
E
D
T
F
S
G
I
I
D
V
L
R
M
K
A
Y
T
Y
G
--
N
D
L
G
-----------
T
D
--
I
R
---------
E
I
P
-
I
P
E
E
---------
Y
L
--------
D
-------
Q
A
R
E
--------
Y
H
E
K
L
V
E
V
A
A
D
F
D
E
N
----------------------
I
M
L
KYLEGEEPTEEELVAAIRKGTI
D
L
K
I
T
P
V
F
L
G
S
A
L
K
N
K
G
V
Q
L
L
L
D
A
V
V
D
Y
L
P
-----
S
P
L
DIPPI
K
G
T
T
P
E
G
E
V
V
EIHP
D
P
N
G
P
----
L
A
A
L
A
F
K
I
M
A
--
D
P
-
Y
V
G
R
L
T
F
I
R
V
Y
S
G
T
L
T
S
G
S
Y
V
Y
N
T
T
K
G
R
K
E
R
V
A
R
L
L
R
M
H
A
N
H
R
E
E
V
E
E
L
K
A
G
D
L
G
A
V
V
G
L
K
E
T
I
T
G
D
T
L
-
V
G
E
D
AP
R
V
I
L
E
S
I
E
V
P
E
P
V
I
D
V
A
I
E
P
K
T
K
A
D
Q
E
K
L
S
Q
A
L
A
R
L
A
E
E
D
P
T
-
F
R
V
S
T
H
P
E
T
G
Q
T
I
I
S
G
M
G
E
L
H
L
E
I
I
V
D
R
L
---------------------------
K
R
E
F
K
-----------
V
D
A
N
V
-----
G
K
P
----
Q
V
A
-
Y
R
E
T
I
---
T
K
-----
P
---
V
---
D
-
V
E
G
K
F
--
I
R
Q
T
G
G
R
G
Q
Y
G
H
V
K
I
K
V
E
P
-
L
P
R
G
S
G
F
E
F
V
N
A
I
V
G
G
V
I
P
K
E
-----------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
77.15
29%
-81
- C2 -
4M1K
2
?
A:
[8-473]
------
D
L
K
R
L
R
N
I
G
I
A
A
H
I
D
A
G
K
T
T
T
T
E
R
I
L
Y
Y
T
G
R
I
-------------------------------
A
A
V
T
T
C
F
W
K
D
H
R
I
N
I
I
D
T
P
G
H
V
D
F
T
I
E
V
E
R
S
M
R
V
L
D
G
A
I
V
V
F
D
S
S
Q
G
V
E
P
Q
S
E
T
V
W
R
Q
A
E
K
Y
K
V
P
R
I
A
F
A
N
K
M
D
K
T
G
A
D
L
W
L
V
I
R
T
M
Q
E
R
L
G
A
R
P
V
V
M
Q
L
P
I
G
R
E
D
T
F
S
G
I
I
D
V
L
R
M
K
A
Y
T
Y
G
--
N
D
L
G
-----------
T
D
--
I
R
---------
E
I
P
-
I
P
E
E
---------
Y
L
--------
D
-------
Q
A
R
E
--------
Y
H
E
K
L
V
E
V
A
A
D
F
D
E
N
----------------------
I
M
L
K
Y
L
E
G
E
E
P
T
E
E
E
L
V
A
A
I
R
K
G
T
I
D
L
K
I
T
P
V
F
L
G
S
A
L
K
N
K
G
V
Q
L
L
L
D
A
V
V
D
Y
L
P
-----
S
P
L
D
I
P
P
I
K
G
T
T
P
E
G
E
V
V
E
I
H
P
D
P
N
G
P
----
L
A
A
L
A
F
K
I
M
A
--
D
P
-
Y
V
G
R
L
T
F
I
R
V
Y
S
G
T
L
T
S
G
S
Y
V
Y
N
T
T
K
G
R
K
E
R
V
A
R
L
L
R
M
H
A
N
H
R
E
E
V
E
E
L
K
A
G
D
L
G
A
V
V
G
L
K
E
T
I
T
G
D
T
L
-
V
G
E
D
AP
R
V
I
L
E
S
I
E
V
P
E
P
V
I
D
V
A
I
E
P
K
T
K
A
D
Q
E
K
L
S
Q
A
L
A
R
L
A
E
E
D
P
T
-
F
R
V
S
T
H
P
E
T
G
Q
T
I
I
S
G
M
G
E
L
H
L
E
I
I
V
D
R
L
---------------------------
K
R
E
F
K
-----------
V
D
A
N
V
-----
G
K
P
----
Q
V
A
-
Y
R
E
T
I
---
T
K
-----
P
---
V
---
D
-
V
E
G
K
F
--
I
R
L
T
G
G
R
G
Q
Y
G
H
V
K
I
K
V
E
P
-
L
P
R
G
S
G
F
E
F
V
N
A
I
V
G
G
V
I
P
K
E
-----------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
77.09
29%
-78
- C2 -
1FNM
2
EFG_THETH
A:
[8-473]
------
D
L
K
R
L
R
N
I
G
I
A
A
H
I
D
A
G
K
T
T
T
T
E
R
I
L
Y
Y
T
G
R
I
--------------------------------
A
V
T
T
C
F
W
K
D
H
R
I
N
I
I
D
T
P
G
H
V
D
F
T
I
E
V
E
R
S
M
R
V
L
D
G
A
I
V
V
F
D
S
S
Q
G
V
E
P
Q
S
E
T
V
W
R
Q
A
E
K
Y
K
V
P
R
I
A
F
A
N
K
M
D
K
T
G
A
D
L
W
L
V
I
R
T
M
Q
E
R
L
G
A
R
P
V
V
M
Q
L
P
I
G
R
E
D
T
F
S
G
I
I
D
V
L
R
M
K
A
Y
T
Y
G
--
N
D
L
G
-----------
T
D
--
I
R
---------
E
I
P
-
I
P
E
E
---------
Y
L
--------
D
-------
Q
A
R
E
--------
Y
H
E
K
L
V
E
V
A
A
D
F
D
E
N
----------------------
I
M
L
K
Y
L
E
G
E
E
P
T
E
E
E
L
V
A
A
I
R
K
G
T
I
D
L
K
I
T
P
V
F
L
G
S
A
L
K
N
K
G
V
Q
L
L
L
D
A
V
V
D
Y
L
P
-----
S
P
L
DIP
P
I
K
G
T
T
P
E
G
E
V
V
E
I
H
P
D
P
N
G
P
----
L
A
A
L
A
F
K
I
M
A
--
D
P
-
Y
V
G
R
L
T
F
I
R
V
Y
S
G
T
L
T
S
G
S
Y
V
Y
N
T
T
K
G
R
K
E
R
V
A
R
L
L
R
M
H
A
N
H
R
E
E
V
E
E
L
K
A
G
D
L
G
A
V
V
G
L
K
E
T
I
T
G
D
T
L
-
V
G
E
D
AP
R
V
I
L
E
S
I
E
V
P
E
P
V
I
D
V
A
I
E
P
K
T
K
A
D
Q
E
K
L
S
Q
A
L
A
R
L
A
E
E
D
P
T
-
F
R
V
S
T
H
P
E
T
G
Q
T
I
I
S
G
M
G
E
L
H
L
E
I
I
V
D
R
L
---------------------------
K
R
E
F
K
-----------
V
D
A
N
V
-----
G
K
P
----
Q
V
A
-
Y
R
E
T
I
---
T
K
-----
P
---
V
---
D
-
V
E
G
K
F
--
I
R
Q
T
G
G
R
G
Q
Y
G
H
V
K
I
K
V
E
P
-
L
P
R
G
S
G
F
E
F
V
N
A
I
V
G
G
V
I
P
K
E
-----------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
76.76
28%
-78
- C2 -
2J7K
2
EFG_THETH
A:
[8-473]
------
D
L
K
R
L
R
N
I
G
I
A
A
H
I
D
A
G
K
T
T
T
T
E
R
I
L
Y
Y
T
G
R
I
H
----------------------------
I
T
A
A
V
T
T
C
F
W
K
D
H
R
I
N
I
I
D
A
P
G
H
V
D
F
T
I
E
V
E
R
S
M
R
V
L
D
G
A
I
V
V
F
D
S
S
Q
G
V
E
P
Q
S
E
T
V
W
R
Q
A
E
K
Y
K
V
P
R
I
A
F
A
N
K
M
D
K
T
G
A
D
L
W
L
V
I
R
T
M
Q
E
R
L
G
A
R
P
V
V
M
Q
L
P
I
G
R
E
D
T
F
S
G
I
I
D
V
L
R
M
K
A
Y
T
Y
G
--
N
D
L
G
-----------
T
D
--
I
R
---------
E
I
P
-
I
P
E
E
---------
Y
L
--------
D
-------
Q
A
R
E
--------
Y
H
E
K
L
V
E
V
A
A
D
F
D
E
N
----------------------
I
M
L
K
Y
L
E
G
E
E
P
T
E
E
E
L
V
A
A
I
R
K
G
T
I
D
L
K
I
T
P
V
F
L
G
S
A
L
K
N
K
G
V
Q
L
L
L
D
A
V
V
D
Y
L
P
-----
S
P
L
DIP
P
I
K
G
T
T
P
E
G
E
V
V
EIHP
D
P
N
G
P
----
L
A
A
L
A
F
K
I
M
A
--
D
P
-
Y
V
G
R
L
T
F
I
R
V
Y
S
G
T
L
T
S
G
S
Y
V
Y
N
T
T
K
G
R
K
E
R
V
A
R
L
L
R
M
H
A
N
H
R
E
E
V
E
E
L
K
A
G
D
L
G
A
V
V
G
L
K
E
T
I
T
G
D
T
L
-
V
G
E
D
AP
R
V
I
L
E
S
I
E
V
P
E
P
V
I
D
V
A
I
E
P
K
T
K
A
D
Q
E
K
L
S
Q
A
L
A
R
L
A
E
E
D
P
T
-
F
R
V
S
T
H
P
E
T
G
Q
T
I
I
S
G
M
G
E
L
H
L
E
I
I
V
D
R
L
---------------------------
K
R
E
F
K
-----------
V
D
A
N
V
-----
G
K
P
----
Q
V
A
-
Y
R
E
T
I
---
T
K
-----
P
---
V
---
D
-
V
E
G
K
F
--
I
R
Q
T
G
G
R
G
Q
Y
G
H
V
K
I
K
V
E
P
-
L
P
R
G
S
G
F
E
F
V
N
A
I
V
G
G
V
I
P
K
E
-----------------------------------------------------------------------------------------------------------
44
Fugue
76.59
28%
-76
- C2 -
4M1K
2
?
A:
[6-688]
----
E
Y
D
L
K
R
L
R
N
I
G
I
A
A
H
I
D
A
G
K
T
T
T
T
E
R
I
L
Y
Y
T
G
R
I
-------------------------------
A
A
V
T
T
C
F
W
K
D
H
R
I
N
I
I
D
T
P
G
H
V
D
F
T
I
E
V
E
R
S
M
R
V
L
D
G
A
I
V
V
F
D
S
S
Q
G
V
E
P
Q
S
E
T
V
W
R
Q
A
E
K
Y
K
V
P
R
I
A
F
A
N
K
M
D
K
T
G
A
D
L
W
L
V
I
R
T
M
Q
E
R
L
G
A
R
P
V
V
M
Q
L
P
I
G
R
E
D
T
F
S
G
I
I
D
V
L
R
M
K
A
Y
T
Y
G
--
N
D
L
G
-----------
T
D
--
I
R
---------
E
I
P
-
I
P
E
E
---------
Y
L
--------
D
-------
Q
A
R
E
--------
Y
H
E
K
L
V
E
V
A
A
D
F
D
E
N
I
M
L
K
Y
L
E
G
E
E
P
T
E
E
E
L
V
A
A
I
R
K
G
T
I
----------------------
D
L
K
I
T
P
V
F
L
G
S
A
L
K
N
K
G
V
Q
L
L
L
D
A
V
V
D
Y
L
P
SPLD
I
P
P
I
-----
K
G
T
T
P
E
G
E
V
V
----
E
I
H
P
D
P
NG
P
L
A
A
L
A
F
K
I
M
A
D
---
P
Y
V
G
R
L
T
F
I
R
V
Y
S
G
T
L
T
S
G
S
Y
V
Y
N
T
T
K
G
R
K
E
R
V
A
R
L
L
R
M
H
A
N
H
R
E
E
V
E
E
L
K
A
G
D
L
G
A
V
V
G
L
K
E
T
I
T
G
D
T
L
V
G
E
D
A
P-
R
V
I
L
E
S
I
E
V
P
E
P
V
I
D
V
A
I
E
P
K
T
K
A
D
Q
E
K
L
S
Q
A
L
A
R
L
A
E
E
-
D
P
T
F
R
V
S
T
H
P
E
T
G
Q
T
I
I
S
G
M
G
E
L
H
L
E
I
I
V
D
R
L
K
REFKVDANVGKPQVA
Y
R
E
T
I
T
K
P
V
D
V
E
G
K
F
I
R
L
TGG
R
G
Q
Y
G
H
V
K
I
K
V
-----
E
P
L
P
RGS
G
F
E
-
F
V
N
A
I
---
V
G
-----
G
---
V
---
I
P
K
E
Y
I
P
--
A
V
Q
K
G
I
E
E
A
M
Q
S
G
P
L
I
G
F
P
V
V
D
I
K
V
T
L
Y
D
G
S
Y
H
E
V
D
S
S
E
M
A
F
K
I
A
G
S
M
A
I
K
E
A
V
Q
K
GD
P
V
I
L
E
P
I
M
R
V
E
V
T
T
PEEY
M
G
D
V
I
G
D
L
N
A
R
RGQIL
G
M
E
P
R
GN
A
Q
V
I
R
A
F
V
P
LAEMFG
Y
A
T
D
L
R
S
K
T
Q
GR
G
S
F
V
M
F
F
D
H
Y
Q
E
V
P
K
Q
V
Q
E
K
LI
6
PsiBlast_PDB
76.21
29%
-79
- C2 -
4MYU
2
EFG_THETH
A:
[8-473]
------
D
L
K
R
L
R
N
I
G
I
A
A
H
I
D
A
G
K
T
T
T
T
E
R
I
L
Y
Y
T
G
R
I
--------------------------------
A
V
T
T
C
F
W
K
D
H
R
I
N
I
I
D
T
P
G
H
V
D
F
T
I
E
V
E
R
S
M
R
V
L
D
G
A
I
V
V
F
D
S
S
Q
G
V
E
P
Q
S
E
T
V
W
R
Q
A
E
K
Y
K
V
P
R
I
A
F
A
N
K
M
D
K
T
G
A
D
L
W
L
V
I
R
T
M
Q
E
R
L
G
A
R
P
V
V
M
Q
L
P
I
G
R
E
D
T
F
S
G
I
I
D
V
L
R
M
K
A
Y
T
Y
G
--
N
D
L
G
-----------
T
D
--
I
R
---------
E
I
P
-
I
P
E
E
---------
Y
L
--------
D
-------
Q
A
R
E
--------
Y
H
E
K
L
V
E
V
A
A
D
F
D
E
N
----------------------
I
M
L
K
Y
L
E
GEEPT
E
E
E
L
V
A
A
I
R
K
G
T
I
D
L
K
I
T
P
V
F
L
G
S
A
L
K
N
K
G
V
Q
L
L
L
D
A
V
V
D
Y
L
P
-----
S
P
L
DI
P
P
I
K
G
T
T
P
E
G
E
V
V
E
I
H
P
D
P
N
G
P
----
L
A
A
L
A
F
K
I
M
A
--
D
P
-
Y
V
G
R
L
T
F
I
R
V
Y
S
G
T
L
T
S
G
S
Y
V
Y
N
T
T
K
G
R
K
E
R
V
A
R
L
L
R
M
H
A
N
H
R
E
E
V
E
E
L
K
A
G
D
L
G
A
V
V
G
L
K
E
T
I
T
G
D
T
L
-
V
G
E
D
A
P
R
V
I
L
E
S
I
E
V
P
E
P
V
I
D
V
A
I
E
P
K
T
K
A
D
Q
E
K
L
S
Q
A
L
A
R
L
A
E
E
D
P
T
-
F
R
V
S
T
H
P
E
T
G
Q
T
I
I
S
G
M
G
E
L
H
L
E
I
I
V
D
R
L
---------------------------
K
R
E
F
K
-----------
V
D
A
N
V
-----
G
K
P
----
Q
V
A
-
Y
R
E
T
I
---
T
K
-----
P
---
V
---
D
-
V
E
G
K
F
--
I
R
Q
T
G
G
R
G
Q
Y
G
H
V
K
I
K
V
E
P
-
L
P
R
G
S
G
F
E
F
V
N
A
I
V
G
G
V
I
P
K
E
-----------------------------------------------------------------------------------------------------------