@TOME V2.3
(Nov 2016)
Ref.
-
-
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 : bsu23380: (2016-07-06 )
MFLHGTSRQNQHGHLEIGGVDALYLAEKYGTPLYVYDVALIRERAKSFKQAFISAGLKAQVAYASKAFSSVAMIQLAEEEGLSLDVVSGGELYTAVAAGFPAERIHFHGNNKSREELRMALEHRIGCIVVDNFYEIALLEDLCKETGHSIDVLLRITPGVEAHTHDYITTGQEDSKFGFDLHNGQTERAIEQVLQSEHIQLLGVHCHIGSQIFDTAGFVLAAEKIFKKLDEWRDSYSFVSKVLNLGGGFGIRYTEDDEPLHATEYVEKIIEAVKENASRYGFDIPEIWIEPGRSLVGDAGTTLYTVGSQKEVPGVRQYVAVDGGMNDNIRPALYQAKYEAAAANRIGEAHDKTVSIAGKCCESGDMLIWDIDLPEVKEGDLLAVFCTGAYGYSMANNYNRIPRPAVVFVENGEAHLVVKRETYEDIVKLDLPFKTGVKQ
Atome Classification :
(25 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.......
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MFLHGTSRQNQHG
H
L
E
IGG
V
D
A
L
Y
L
A
E
KYGT
P
L
Y
V
Y
D
V
A
L
I
R
E
R
A
K
S
F
K
Q
A
F
I
----SAGL
K
A
Q
V
A
Y
A
S
K
A
F
S
S
V
A
M
I
Q
L
AEEEG
L
S
L
D
V
VSGG
E
L
Y
T
A
VAAGFP----A
E
R
----
I
H
FHGNNK
S
R
E
E
L
R
M
A
L
E
HRI
G
C
I
V
VDN
F
Y
E
I
A
L
L
E
D
L
C
K
-ETGH
S
I
D
V
L
L
R
ITPGVEAHTHD
Y
I
T-TGQEDS
K
F
G
F
---DLHNG
Q
--
T
E
R
A
I
E
Q
V
L
---
Q
SEH
I
Q
L
L
G
V
H
C
HIG
S
Q
I
F
D
TA
G
F
V
L
A
A
E
K
I
F
K
K
L
----
D
E
W
R
D
S
Y
S
----
F
V
S
K
V
L
NLGGGF
G
I
R
Y-TEDDEPL
H
A
T
E
---
Y
V
E
K
I
I
E
A
V
K
E
N
A
S
RYGFDI
P
E
I
W
IEP
G
R
S
LVGDAG
T
T
L
Y
T
VGSQKEV----P----GV
R
Q
Y
V
A
VDGGMNDN
I
R
P
A
L
Y
Q
A
K
Y
E
--
A
A
A
AN-RI----GEA--HDK
T
V
S
---
I
A
G
KCCESG
D
M
L
-------
I
W
D-------IDLP-E-VKEG
D
L
L
A
V
F
CTGAYGYSMAN-NYNRIPR
P
A
V
V
F
V
-EN-G
E
A
H
L
V
V
KRE
T
Y
E
D
I
V
KLDLPFKTGVKQ
2
PsiBlast_PDB
84.68
42%
-69
- C1 -
2O0T
1
DCDA_MYCTU
A:
[18-448]
------
T
T
R
D
E
V
G
V
V
C
I
A
G
I
P
L
T
Q
L
A
Q
E
Y
G
T
P
L
F
V
I
D
E
D
D
F
R
S
R
C
R
E
T
A
A
A
F
-------
G
S
G
A
N
V
H
Y
A
A
K
A
F
L
C
S
E
V
A
R
W
I
S
E
E
G
L
C
L
D
V
C
T
G
G
E
L
A
V
A
L
H
A
S
F
P
----
P
E
R
----
I
T
L
H
G
N
N
K
S
V
S
E
L
T
A
A
V
K
A
G
V
G
H
I
V
V
D
S
M
T
E
I
E
R
L
D
A
I
A
G
-
E
A
G
I
V
Q
D
V
L
V
R
L
T
V
G
V
E
A
H
T
H
E
F
I
S
-
T
A
H
E
D
Q
K
F
G
L
---
S
V
A
S
G
A
--
A
M
A
A
V
R
R
V
F
---
A
T
D
H
L
R
L
V
G
L
H
S
H
I
G
S
Q
I
F
D
V
D
G
F
E
L
A
A
H
R
V
I
G
L
L
R
D
V
V
G
E
F
G
P
E
K
T
----
A
Q
I
A
T
V
D
L
G
G
G
L
G
I
S
Y
-
L
P
S
D
D
P
P
P
I
A
E
---
L
A
A
K
L
G
T
I
V
S
D
E
S
T
A
V
G
L
P
T
P
K
L
V
V
E
P
G
R
A
I
A
G
P
G
T
I
T
L
Y
E
V
G
T
V
K
D
V
DVSA
T
----
A
H
R
R
Y
V
S
V
D
G
G
M
S
D
N
I
R
T
A
L
Y
G
A
Q
Y
D
--
V
R
L
V
S
-
R
V
----
S
D
A
--
P
P
V
P
A
R
---
L
V
G
K
H
C
E
S
G
D
I
I
-------
V
R
D
-------
T
W
V
P
D
D
-
I
R
P
G
D
L
V
A
V
A
A
T
G
A
Y
C
Y
S
L
S
S
-
R
Y
N
M
V
G
R
P
A
V
V
A
V
-
H
A
-
G
N
A
R
L
V
L
R
R
E
T
V
D
D
L
L
S
L
E
V
--------
22
PsiBlast_CBE
84.38
42%
-72
- C1 -
2O0T
1
DCDA_MYCTU
B:
[18-448]
------
T
T
R
D
E
V
G
V
V
C
I
A
G
I
P
L
T
Q
L
A
Q
E
Y
G
T
P
L
F
V
I
D
E
D
D
F
R
S
R
C
R
E
T
A
A
A
F
-------
G
S
G
A
N
V
H
Y
A
A
K
A
F
L
C
S
E
V
A
R
W
I
S
E
E
G
L
C
L
D
V
C
T
G
G
E
L
A
V
A
L
H
A
S
F
P
----
P
E
R
----
I
T
L
H
G
N
N
K
S
V
S
E
L
T
A
A
V
K
A
G
V
G
H
I
V
V
D
S
M
T
E
I
E
R
L
D
A
I
A
G
-
E
A
G
I
V
Q
D
V
L
V
R
L
T
V
G
V
E
A
H
T
H
E
F
I
S
-
T
A
H
E
D
Q
K
F
G
L
---
S
V
A
S
G
A
--
A
M
A
A
V
R
R
V
F
---
A
T
D
H
L
R
L
V
G
L
H
S
H
I
G
S
Q
I
F
D
V
D
G
F
E
L
A
A
H
R
V
I
G
L
L
RDVV
G
E
F
G
P
E
K
T
----
A
Q
I
A
T
V
D
L
G
G
G
L
G
I
S
Y
-
L
P
S
D
D
P
P
P
I
A
E
---
L
A
A
K
L
G
T
I
V
S
D
E
S
T
A
V
G
L
P
T
P
K
L
V
V
E
P
G
R
A
I
A
G
P
G
T
I
T
L
Y
E
V
G
T
V
K
D
V
DVSA
T
----
A
H
R
R
Y
V
S
V
D
G
G
M
S
D
N
I
R
T
A
L
Y
G
A
Q
Y
D
--
V
R
L
V
S
-
R
V
----
S
D
A
--
P
P
V
P
A
R
---
L
V
G
K
H
C
E
S
G
D
I
I
-------
V
R
D
-------
T
W
V
P
D
D
-
I
R
P
G
D
L
V
A
V
A
A
T
G
A
Y
C
Y
S
L
S
S
-
R
Y
N
M
V
G
R
P
A
V
V
A
V
-
H
A
-
G
N
A
R
L
V
L
R
R
E
T
V
D
D
L
L
S
L
E
V
--------
83
HHSearch
84.00
38%
-124
- C1 -
2P3E
-
DCDA_AQUAE
A:
[16-418]
------------
G
E
L
F
I
E
G
V
S
L
K
E
L
A
Q
T
F
G
T
P
L
Y
V
Y
S
S
N
F
I
K
E
R
F
E
A
Y
R
K
A
F
P
----
D
----
A
L
I
C
Y
A
V
K
A
N
F
N
P
H
L
V
K
L
L
G
E
L
G
A
G
A
D
I
V
S
G
G
E
L
Y
L
A
K
K
A
G
I
P
----
P
E
R
----
I
V
Y
A
G
V
G
K
T
E
K
E
L
T
D
A
V
D
S
E
I
L
M
F
N
V
E
S
R
Q
E
L
D
V
L
N
E
I
A
G
-
K
L
G
K
K
A
R
I
A
I
R
V
N
P
-----------------
S
K
F
G
V
---
D
I
R
E
A
Q
--
K
E
--
Y
E
Y
A
S
---
K
L
E
N
L
E
I
V
G
I
H
C
H
I
G
S
Q
I
L
D
I
S
P
Y
R
E
A
V
E
K
V
V
S
L
Y
----
E
S
L
T
Q
K
-
G
----
F
D
I
K
Y
L
D
I
G
G
G
L
G
I
K
Y
-
K
P
E
D
K
E
P
A
P
Q
D
---
L
A
D
L
L
K
D
L
L
---------
V
K
A
K
I
I
L
E
P
G
R
S
I
M
G
N
A
G
I
L
I
T
Q
V
Q
F
L
K
D
K
---------
G
S
K
H
F
I
I
V
D
A
G
M
N
D
L
I
R
P
S
I
Y
N
A
Y
H
H
--
I
I
P
V
E
-
T
-----
K
E
-----
V
V
A
D
---
I
V
G
P
I
C
E
T
G
D
F
L
-------
A
L
D
-------
R
E
I
E
-
E
-
V
Q
R
G
E
Y
L
A
V
L
S
A
G
A
Y
G
F
A
M
S
S
-
H
Y
N
M
R
P
R
A
A
E
V
L
V
-
E
N
-
G
S
V
K
L
I
R
K
R
E
N
Y
D
Y
I
V
E
P
S
L
--------
3
PsiBlast_PDB
83.40
42%
-72
- C1 -
1HKW
1
DCDA_MYCTU
A:
[16-446]
------
T
T
R
D
E
V
G
V
V
C
I
A
G
I
P
L
T
Q
L
A
Q
E
Y
G
T
P
L
F
V
I
D
E
D
D
F
R
S
R
C
R
E
T
A
A
A
F
-------
G
S
G
A
N
V
H
Y
A
A
K
A
F
L
C
S
E
V
A
R
W
I
S
E
E
G
L
C
L
D
V
C
T
G
G
E
L
A
V
A
L
H
A
S
F
P
----
P
E
R
----
I
T
L
H
G
N
N
K
S
V
S
E
L
T
A
A
V
K
A
G
V
G
H
I
V
V
D
S
M
T
E
I
E
R
L
D
A
I
A
G
-
E
A
G
I
V
Q
D
V
L
V
R
L
T
V
G
V
E
A
H
T
H
E
F
I
S
-
T
A
H
E
D
Q
K
F
G
L
---
S
V
A
S
G
A
--
A
M
A
A
V
R
R
V
F
---
A
T
D
H
L
R
L
V
G
L
H
S
H
I
G
S
Q
I
F
D
V
D
G
F
E
L
A
A
H
R
V
I
G
L
L
R
D
V
V
G
E
F
G
P
E
K
T
----
A
Q
I
A
T
V
D
L
G
G
G
L
G
I
S
Y
-
L
P
S
D
D
P
P
P
I
A
E
---
L
A
A
K
L
G
T
I
V
S
D
E
S
T
A
V
G
L
P
T
P
K
L
V
V
E
P
G
R
A
I
A
G
P
G
T
I
T
L
Y
E
V
G
T
V
K
D
V
D
VSA
T
----
A
H
R
R
Y
V
S
V
D
G
G
M
S
D
N
I
R
T
A
L
Y
G
A
Q
Y
D
--
V
R
L
V
S
-
R
V
----
S
D
A
--
P
P
V
P
A
R
---
L
V
G
K
H
C
E
S
G
D
I
I
-------
V
R
D
-------
T
W
V
P
D
D
-
I
R
P
G
D
L
V
A
V
A
A
T
G
A
Y
C
Y
S
L
S
S
-
R
Y
N
M
V
G
R
P
A
V
V
A
V
-
H
A
-
G
N
A
R
L
V
L
R
R
E
T
V
D
D
L
L
S
L
E
V
--------
21
PsiBlast_CBE
83.06
42%
-68
- C1 -
1HKV
4
DCDA_MYCTU
B:
[16-446]
------
T
T
R
D
E
V
G
V
V
C
I
A
G
I
P
L
T
Q
L
A
Q
E
Y
G
T
P
L
F
V
I
D
E
D
D
F
R
S
R
C
R
E
T
A
A
A
F
-------
G
S
G
A
N
V
H
Y
A
A
K
A
F
L
C
S
E
V
A
R
W
I
S
E
E
G
L
C
L
D
V
C
T
G
G
E
L
A
V
A
L
H
A
S
F
P
----
P
E
R
----
I
T
L
H
G
N
N
K
S
V
S
E
L
T
A
A
V
K
A
G
V
G
H
I
V
V
D
S
M
T
E
I
E
R
L
D
A
I
A
G
-
E
A
G
I
V
Q
D
V
L
V
R
L
T
V
G
V
E
A
H
T
H
E
F
I
S
-
T
A
H
E
D
Q
K
F
G
L
---
S
V
A
S
G
A
--
A
M
A
A
V
R
R
V
F
---
A
T
D
H
L
R
L
V
G
L
H
S
H
I
G
S
Q
I
F
D
V
D
G
F
E
L
A
A
H
R
V
I
G
L
L
RDVV
G
E
F
G
P
E
K
T
----
A
Q
I
A
T
V
D
L
G
G
G
L
G
I
S
Y
-
L
P
S
D
D
P
P
P
I
A
E
---
L
A
A
K
L
G
T
I
V
S
D
E
S
T
A
V
G
L
P
T
P
K
L
V
V
E
P
G
R
A
I
A
G
P
G
T
I
T
L
Y
E
V
G
T
V
K
D
V
DVSA
T
----
A
H
R
R
Y
V
S
V
D
G
G
M
S
D
N
I
R
T
A
L
Y
G
A
Q
Y
D
--
V
R
L
V
S
-
R
V
----
S
D
A
--
P
P
V
P
A
R
---
L
V
G
K
H
C
E
S
G
D
I
I
-------
V
R
D
-------
T
W
V
P
D
D
-
I
R
P
G
D
L
V
A
V
A
A
T
G
A
Y
C
Y
S
L
S
S
-
R
Y
N
M
V
G
R
P
A
V
V
A
V
-
H
A
-
G
N
A
R
L
V
L
R
R
E
T
V
D
D
L
L
S
L
E
V
--------
1
PsiBlast_PDB
82.69
42%
-69
- C1 -
1HKV
4
DCDA_MYCTU
A:
[16-446]
------
T
T
R
D
E
V
G
V
V
C
I
A
G
I
P
L
T
Q
L
A
Q
E
Y
G
T
P
L
F
V
I
D
E
D
D
F
R
S
R
C
R
E
T
A
A
A
F
-------
G
S
G
A
N
V
H
Y
A
A
K
A
F
L
C
S
E
V
A
R
W
I
S
E
E
G
L
C
L
D
V
C
T
G
G
E
L
A
V
A
L
H
A
S
F
P
----
P
E
R
----
I
T
L
H
G
N
N
K
S
V
S
E
L
T
A
A
V
K
A
G
V
G
H
I
V
V
D
S
M
T
E
I
E
R
L
D
A
I
A
G
-
E
A
G
I
V
Q
D
V
L
V
R
L
T
V
G
V
E
A
H
T
H
E
F
I
S
-
T
A
H
E
D
Q
K
F
G
L
---
S
V
A
S
G
A
--
A
M
A
A
V
R
R
V
F
---
A
T
D
H
L
R
L
V
G
L
H
S
H
I
G
S
Q
I
F
D
V
D
G
F
E
L
A
A
H
R
V
I
G
L
L
R
D
V
V
G
E
F
G
P
E
K
T
----
A
Q
I
A
T
V
D
L
G
G
G
L
G
I
S
Y
-
L
P
S
D
D
P
P
P
I
A
E
---
L
A
A
K
L
G
T
I
V
S
D
E
S
T
A
V
G
L
P
T
P
K
L
V
V
E
P
G
R
A
I
A
G
P
G
T
I
T
L
Y
E
V
G
T
V
K
D
V
D
VSA
T
----
A
H
R
R
Y
V
S
V
D
G
G
M
S
D
N
I
R
T
A
L
Y
G
A
Q
Y
D
--
V
R
L
V
S
-
R
V
----
S
D
A
--
P
P
V
P
A
R
---
L
V
G
K
H
C
E
S
G
D
I
I
-------
V
R
D
-------
T
W
V
P
D
D
-
I
R
P
G
D
L
V
A
V
A
A
T
G
A
Y
C
Y
S
L
S
S
-
R
Y
N
M
V
G
R
P
A
V
V
A
V
-
H
A
-
G
N
A
R
L
V
L
R
R
E
T
V
D
D
L
L
S
L
E
V
--------
68
HHSearch
82.65
44%
-46
- C1 -
2O0T
1
DCDA_MYCTU
A:
[21-448]
---------
D
E
V
G
V
V
C
I
A
G
I
P
L
T
Q
L
A
Q
E
Y
G
T
P
L
F
V
I
D
E
D
D
F
R
S
R
C
R
E
T
A
A
A
F
G
----
S
G
---
A
N
V
H
Y
A
A
K
A
F
L
C
S
E
V
A
R
W
I
S
E
E
G
L
C
L
D
V
C
T
G
G
E
L
A
V
A
L
H
A
S
F
P
----
P
E
R
----
I
T
L
H
G
N
N
K
S
V
S
E
L
T
A
A
V
K
A
G
V
G
H
I
V
V
D
S
M
T
E
I
E
R
L
D
A
I
A
G
-
E
A
G
I
V
Q
D
V
L
V
R
L
T
V
G
V
E
A
H
T
H
E
F
I
S
-
T
A
H
E
D
Q
K
F
G
L
---
S
V
A
S
G
A
A
M
A
A
--
V
R
R
V
F
---
A
T
D
H
L
R
L
V
G
L
H
S
H
I
G
S
Q
I
F
D
V
D
G
F
E
L
A
A
H
R
V
I
G
L
L
----
R
D
V
V
G
E
F
G
PEKT
A
Q
I
A
T
V
D
L
G
G
G
L
G
I
S
Y
-
L
P
S
D
D
P
P
P
I
A
E
---
L
A
A
K
L
G
T
I
V
S
D
E
S
T
A
V
G
L
P
T
P
K
L
V
V
E
P
G
R
A
I
A
G
P
G
T
I
T
L
Y
E
V
G
T
V
K
D
V
----
D
VSA
T
A
H
R
R
Y
V
S
V
D
G
G
M
S
D
N
I
R
T
A
L
Y
G
A
Q
Y
D
--
V
R
L
V
S
-
R
V
----
S
D
A
--
P
P
V
P
A
R
---
L
V
G
K
H
C
E
S
G
D
I
I
-------
V
R
D
-------
T
W
V
P
-
D
D
I
R
P
G
D
L
V
A
V
A
A
T
G
A
Y
C
Y
S
L
S
S
-
R
Y
N
M
V
G
R
P
A
V
V
A
V
-
H
A
-
G
N
A
R
L
V
L
R
R
E
T
V
D
D
L
L
S
L
E
V
--------
73
HHSearch
78.62
32%
-110
- C1 -
3N2B
1
DCDA_VIBCH
A:
[23-437]
-
N
A
M
D
Y
F
N
Y
Q
E
D
G
Q
L
W
A
E
Q
V
P
L
A
D
L
A
N
Q
Y
G
T
P
L
Y
V
Y
S
R
A
T
L
E
R
H
W
H
A
F
D
K
S
V
G
----
D
Y
--
P
H
L
I
C
Y
A
V
K
A
N
S
N
L
G
V
L
N
T
L
A
R
L
G
S
G
F
D
I
V
S
V
G
E
L
E
R
V
L
A
A
G
G
D
----
P
S
K
----
V
V
F
S
G
V
G
K
T
E
A
E
M
K
R
A
L
Q
L
K
I
K
C
F
N
V
E
S
E
P
E
L
Q
R
L
N
K
V
A
G
-
E
L
G
V
K
A
P
I
S
L
R
I
N
P
D
V
D
A
K
T
H
P
Y
I
S
-
T
G
L
R
D
N
K
F
G
I
---
T
F
D
R
A
A
--
Q
V
--
Y
R
L
A
H
---
S
L
P
N
L
D
V
H
G
I
D
C
H
I
G
S
Q
L
T
A
L
A
P
F
I
D
A
T
D
R
L
L
A
L
I
----
D
S
L
K
A
E
-
G
----
I
H
I
R
H
L
D
V
G
G
G
L
G
V
V
Y
-------
P
Q
P
S
E
---
Y
A
K
A
L
L
D
R
L
E
R
------
H
R
D
L
E
L
I
F
E
P
G
R
A
I
A
A
N
A
G
V
L
V
T
K
V
E
F
L
K
H
T
-----------
K
N
F
A
I
I
D
A
A
M
N
D
L
I
R
-------
Q
D
--
I
I
P
L
R
-
P
R
-----
Q
G
--
E
A
Q
T
Y
D
---
L
V
G
P
V
C
E
T
S
D
F
L
-------
G
K
D
-------
R
D
L
V
---
L
Q
E
G
D
L
L
A
V
R
S
S
G
A
Y
G
F
T
M
S
S
-
N
Y
N
T
R
P
R
V
A
E
V
M
V
-
D
G
-
N
K
T
Y
L
V
R
Q
R
E
E
L
S
S
L
W
A
L
E
S
--------
25
PsiBlast_CBE
74.76
39%
9
- C1 -
1TWI
3
DCDA_METJA
B:
[10-428]
----------
K
D
G
R
F
F
I
D
G
Y
D
A
I
E
L
A
E
K
F
G
T
P
L
Y
V
M
S
E
E
Q
I
K
I
N
Y
N
R
Y
I
E
A
F
K
RWEE
E
T
G
K
E
F
I
V
A
Y
A
Y
K
A
N
A
N
L
A
I
T
R
L
L
A
K
L
G
C
G
A
D
V
V
S
G
G
E
L
Y
I
A
K
L
S
N
V
P
----
S
K
K
----
I
V
F
N
G
N
C
K
T
K
E
E
I
I
M
G
I
E
A
N
I
R
A
F
N
V
D
S
I
S
E
L
I
L
I
N
E
T
A
K
-
E
L
G
E
T
A
N
V
A
F
R
I
N
P
N
V
N
P
K
T
H
P
K
I
S
-
T
G
L
K
K
N
K
F
G
L
---
D
V
E
S
G
I
--
A
M
K
A
I
K
M
A
L
---
E
M
E
Y
V
N
V
V
G
V
H
C
H
I
G
S
Q
L
T
D
I
S
P
F
I
E
E
T
R
K
V
M
D
F
V
----
V
E
L
K
E
E
G
I
----
E
I
E
D
V
-
N
L
G
G
G
L
G
I
P
Y
-
Y
K
D
K
Q
I
P
T
Q
K
D
---
L
A
D
A
I
I
N
T
M
L
K
Y
K
D
K
--
V
E
M
P
N
L
I
L
E
P
G
R
S
L
V
A
T
A
G
Y
L
L
G
K
V
H
H
I
K
E
T
----
P
-----
V
T
K
W
V
M
I
D
A
G
M
N
D
M
M
R
P
A
M
Y
E
A
Y
H
H
--
I
I
N
C
K
-
V
K
----
N
E
K
----
E
V
V
S
---
I
A
G
G
L
C
E
S
S
D
V
F
-------
G
R
D
-------
R
E
L
D
-
K
-
V
E
V
G
D
V
L
A
I
F
D
V
G
A
Y
G
I
S
M
A
N
-
N
Y
N
A
R
G
R
P
R
M
V
L
T
-
S
K
-
K
G
V
F
L
I
R
E
R
E
T
Y
A
D
L
I
A
K
D
I
--------
81
HHSearch
74.75
32%
-106
- C1 -
2QGH
2
DCDA_HELPX
A:
[23-419]
--------------------
N
Y
E
E
L
F
Q
T
H
K
T
P
F
Y
L
Y
D
F
D
K
I
K
Q
A
F
L
N
Y
K
E
A
F
K
----
G
R
--
K
S
L
I
C
Y
A
L
K
A
N
S
N
L
S
I
L
S
L
L
A
H
L
E
S
G
A
D
C
V
S
I
G
E
I
Q
R
A
L
K
A
G
I
K
----
P
Y
R
----
I
V
F
S
G
V
G
K
S
A
F
E
I
E
Q
A
L
K
L
N
I
L
F
L
N
V
E
S
F
M
E
L
K
T
I
E
T
I
A
Q
-
S
L
G
I
K
A
R
I
S
I
R
I
N
P
N
I
D
A
K
T
H
P
Y
I
S
-
T
G
L
K
E
N
K
F
G
V
---
G
E
K
E
A
L
--
E
M
--
F
L
W
A
K
---
K
S
A
F
L
E
P
V
S
V
H
F
H
I
G
S
Q
L
L
D
L
E
P
I
I
E
A
S
Q
K
V
A
K
I
A
----
K
S
L
I
A
L
-
G
----
I
D
L
R
F
F
D
V
G
G
G
I
G
V
S
Y
-
E
N
E
-
E
T
I
K
L
Y
D
---
Y
A
Q
G
I
L
N
A
L
Q
G
-------
L
D
L
T
I
I
C
E
P
G
R
S
I
V
A
E
S
G
E
L
I
T
Q
V
L
Y
E
K
K
-----------
N
K
R
F
V
I
V
D
A
G
M
N
D
F
L
R
P
S
L
Y
H
A
K
H
A
--
I
R
V
I
T
-
P
S
---------
E
I
S
P
C
D
---
V
V
G
P
V
C
E
S
S
D
T
F
-------
L
K
D
-------
A
H
L
P
-
E
-
L
E
P
G
D
K
I
A
I
E
K
V
G
A
Y
G
S
S
M
A
S
-
Q
Y
N
S
R
P
K
L
L
E
L
A
L
-
E
D
--
K
I
R
V
I
R
K
R
E
A
L
E
D
L
W
R
L
E
E
--------
70
HHSearch
74.55
37%
-108
- C1 -
2YXX
1
DCDA_THEMA
A:
[4-384]
---------------------
L
R
K
V
A
E
I
H
G
T
P
T
Y
V
Y
F
E
E
T
L
R
K
R
S
R
L
V
K
E
V
F
E
----
G
V
--
N
L
L
P
T
F
A
V
K
A
N
N
N
P
V
L
L
K
I
L
R
E
E
G
F
G
M
D
V
V
T
K
G
E
L
L
A
A
K
L
A
G
V
P
----
S
H
T
----
V
V
W
N
G
N
G
K
S
R
D
Q
M
E
H
F
L
R
E
D
V
R
I
V
N
V
D
S
F
E
E
M
E
I
W
R
E
L
N
P
----
E
G
V
E
Y
F
I
R
V
N
P
E
V
D
A
K
T
H
P
H
I
S
-
T
G
L
K
K
H
K
F
G
I
---
P
L
E
D
L
D
--
S
F
--
M
E
R
------
F
R
S
M
N
I
R
G
L
H
V
H
I
G
S
Q
I
T
R
V
E
P
F
V
E
A
F
S
K
V
V
R
A
S
----
E
R
----
Y
G
------
F
E
E
I
N
I
G
G
G
W
G
I
N
Y
-
S
G
--
E
E
L
D
L
S
S
---
Y
R
E
K
V
V
P
D
L
K
--------
R
F
K
R
V
I
V
E
I
G
R
Y
I
V
A
P
S
G
Y
L
L
L
R
V
V
L
V
K
R
R
---------
H
N
K
A
F
V
V
V
D
G
G
M
N
V
L
I
R
P
A
L
Y
S
A
Y
H
R
--
I
F
V
L
G
-
K
------
Q
G
--
K
E
M
R
A
D
---
V
V
G
P
L
C
E
S
G
D
V
I
-------
A
Y
D
-------
R
E
L
P
-
E
-
V
E
P
G
D
I
I
A
V
E
N
A
G
A
Y
G
Y
T
M
S
N
-
N
Y
N
S
T
T
R
P
A
E
V
L
V
-
R
E
N
G
R
I
S
L
I
R
R
R
E
T
E
M
D
I
F
K
D
V
---------
5
PsiBlast_PDB
74.06
38%
11
- C1 -
1TUF
2
DCDA_METJA
A:
[1-428]
-
F
L
G
N
D
T
V
E
I
K
D
G
R
F
F
I
D
G
Y
D
A
I
E
L
A
E
K
F
G
T
P
L
Y
V
M
S
E
E
Q
I
K
I
N
Y
N
R
Y
I
E
A
F
K
RWEE
E
T
G
K
E
F
I
V
A
Y
A
Y
K
A
N
A
N
L
A
I
T
R
L
L
A
K
L
G
C
G
A
D
V
V
S
G
G
E
L
Y
I
A
K
L
S
N
V
P
----
S
K
K
----
I
V
F
N
G
N
C
K
T
K
E
E
I
I
M
G
I
E
A
N
I
R
A
F
N
V
D
S
I
S
E
L
I
L
I
N
E
T
A
K
-
E
L
G
E
T
A
N
V
A
F
R
I
N
P
N
V
N
P
K
T
H
P
K
I
S
-
T
G
L
K
K
N
K
F
G
L
---
D
V
E
S
G
I
--
A
M
K
A
I
K
M
A
L
---
E
M
E
Y
V
N
V
V
G
V
H
C
H
I
G
S
Q
L
T
D
I
S
P
F
I
E
E
T
R
K
V
M
D
F
V
----
V
E
L
K
E
E
G
I
----
E
I
E
D
V
-
N
L
G
G
G
L
G
I
P
Y
-
Y
K
D
K
Q
I
P
T
Q
K
D
---
L
A
D
A
I
I
N
T
M
L
K
Y
K
D
K
--
V
E
M
P
N
L
I
L
E
P
G
R
S
L
V
A
T
A
G
Y
L
L
G
K
V
H
H
I
K
E
T
----
P
-----
V
T
K
W
V
M
I
D
A
G
M
N
D
M
M
R
P
A
M
Y
E
A
Y
H
H
--
I
I
N
C
K
-
V
K
----
N
E
K
----
E
V
V
S
---
I
A
G
G
L
C
E
S
S
D
V
F
-------
G
R
D
-------
R
E
L
D
-
K
-
V
E
V
G
D
V
L
A
I
F
D
V
G
A
Y
G
I
S
M
A
N
-
N
Y
N
A
R
G
R
P
R
M
V
L
T
-
S
K
-
K
G
V
F
L
I
R
E
R
E
T
Y
A
D
L
I
A
K
D
I
--------
6
PsiBlast_PDB
73.97
38%
-85
- C1 -
2P3E
-
DCDA_AQUAE
A:
[14-418]
----------
R
D
G
E
L
F
I
E
G
V
S
L
K
E
L
A
Q
T
F
G
T
P
L
Y
V
Y
S
S
N
F
I
K
E
R
F
E
A
Y
R
K
A
F
P
----
D
A
----
L
I
C
Y
A
V
K
A
N
F
N
P
H
L
V
K
L
L
G
E
L
G
A
G
A
D
I
V
S
G
G
E
L
Y
L
A
K
K
A
G
I
P
----
P
E
R
----
I
V
Y
A
G
V
G
K
T
E
K
E
L
T
D
A
V
D
S
E
I
L
M
F
N
V
E
S
R
Q
E
L
D
V
L
N
E
I
A
G
-
K
L
G
K
K
A
R
I
A
I
R
V
N
P
-----------------
S
K
F
G
V
---
D
I
R
E
A
Q
--
K
E
--
Y
E
Y
A
S
---
K
L
E
N
L
E
I
V
G
I
H
C
H
I
G
S
Q
I
L
D
I
S
P
Y
R
E
A
V
E
K
V
V
-
S
L
----
Y
E
S
L
T
Q
K
G
----
F
D
I
K
Y
L
D
I
G
G
G
L
G
I
K
Y
K
P
E
D
K
E
P
--
A
P
Q
---
D
L
A
D
L
L
K
D
L
L
--
V
K
------
A
K
I
I
L
E
P
G
R
S
I
M
G
N
A
G
I
L
I
T
Q
V
Q
F
L
K
D
-----
K
----
G
S
K
H
F
I
I
V
D
A
G
M
N
D
L
I
R
P
S
I
Y
N
A
-
Y
H
--
H
I
I
P
V
-
E
T
----
K
E
-----
V
V
A
D
---
I
V
G
P
I
C
E
T
G
D
F
L
-------
A
L
D
-------
R
E
I
E
-
E
-
V
Q
R
G
E
Y
L
A
V
L
S
A
G
A
Y
G
F
A
M
S
S
-
H
Y
N
M
R
P
R
A
A
E
V
L
V
-
E
N
-
G
S
V
K
L
I
R
K
R
E
N
Y
D
Y
I
V
E
P
S
L
--------
7
PsiBlast_PDB
73.60
35%
-109
- C1 -
2YXX
1
DCDA_THEMA
A:
[7-382]
------------------------
V
A
E
I
H
G
T
P
T
Y
V
Y
F
E
E
T
L
R
K
R
S
R
L
V
K
E
V
F
------
E
G
V
N
L
L
P
T
F
A
V
K
A
N
N
N
P
V
L
L
K
I
L
R
E
E
G
F
G
M
D
V
V
T
K
G
E
L
L
A
A
K
L
A
G
V
P
----
S
H
T
----
V
V
W
N
G
N
G
K
S
R
D
Q
M
E
H
F
L
R
E
D
V
R
I
V
N
V
D
S
F
E
E
M
E
I
W
R
E
L
N
P
-
E
---
G
V
E
Y
F
I
R
V
N
P
E
V
D
A
K
T
H
P
H
I
S
-
T
G
L
K
K
H
K
F
G
I
---
P
L
E
D
L
D
--
S
---
F
M
E
R
F
---
R
S
M
N
I
R
--
G
L
H
V
H
I
G
S
Q
I
T
R
V
E
P
F
V
E
A
----
F
S
K
V
----
V
R
A
S
E
R
Y
G
----
F
--
E
E
I
N
I
G
G
G
W
G
I
N
Y
-
S
--
G
E
E
L
D
L
S
S
---
Y
R
E
K
V
V
P
D
L
K
R
--------
F
K
R
V
I
V
E
I
G
R
Y
I
V
A
P
S
G
Y
L
L
L
R
V
V
L
V
K
R
R
----
H
----
N
-
K
A
F
V
V
V
D
G
G
M
N
V
L
I
R
P
A
L
Y
S
A
Y
H
R
--
I
F
V
L
G
-
K
Q
----
G
K
----
E
M
R
A
D
---
V
V
G
P
L
C
E
S
G
D
V
I
-------
A
Y
D
-------
R
E
L
P
-
E
-
V
E
P
G
D
I
I
A
V
E
N
A
G
A
Y
G
Y
T
M
S
N
-
N
Y
N
S
T
T
R
P
A
E
V
L
V
R
E
N
-
G
R
I
S
L
I
R
R
R
E
T
E
M
D
I
F
K
-----------
72
HHSearch
73.54
27%
-92
- C1 -
2J66
2
BTRK_BACCI
A:
[5-418]
------------------
Q
A
E
I
T
A
L
T
K
R
F
E
T
P
F
Y
L
Y
D
G
D
F
I
E
A
H
Y
R
Q
L
R
S
R
T
N
----
P
---
A
I
Q
F
Y
L
S
L
K
A
N
N
N
I
H
L
A
K
L
F
R
Q
W
G
L
G
V
E
V
A
S
A
G
E
L
A
L
A
R
H
A
G
F
S
----
A
E
N
----
I
I
F
S
G
P
G
K
K
R
S
E
L
E
I
A
V
Q
S
G
I
Y
C
I
I
A
E
S
V
E
E
L
F
Y
I
E
E
L
A
E
-
K
E
N
K
T
A
R
V
A
I
R
I
N
P
D
K
S
F
--
T
-
A
I
K
-
M
G
G
V
P
R
Q
F
G
M
---
D
E
S
M
L
D
--
A
V
--
M
D
A
V
R
---
S
L
Q
F
T
K
F
I
G
I
H
V
Y
T
G
T
Q
N
L
N
T
D
S
I
I
E
S
M
K
Y
T
V
D
L
G
----
R
N
I
Y
E
R
Y
G
----
I
V
C
E
C
I
N
L
G
G
G
F
G
V
P
Y
-
F
--
E
K
A
L
D
I
G
K
---
I
T
R
T
V
S
D
Y
V
Q
E
A
R
-
D
T
R
F
P
Q
T
T
F
I
I
E
S
G
R
Y
L
L
A
Q
A
A
V
Y
V
T
E
V
L
Y
R
K
A
S
---------
K
G
E
V
F
V
I
V
D
G
G
M
H
H
H
A
A
S
-------
P
M
E
Y
I
P
---------------
L
E
K
V
T
---
I
A
G
P
L
C
T
P
E
D
C
L
-------
G
K
D
-------
V
H
V
P
-
A
-
L
Y
P
G
D
L
V
C
V
L
N
S
G
A
Y
G
L
S
F
S
P
V
H
F
L
G
H
P
T
P
I
E
I
L
K
-
R
N
-
G
S
Y
E
L
I
R
R
K
G
T
A
D
D
I
V
A
T
Q
L
Q
-------
4
PsiBlast_PDB
73.34
39%
9
- C1 -
1TWI
3
DCDA_METJA
A:
[10-428]
----------
K
D
G
R
F
F
I
D
G
Y
D
A
I
E
L
A
E
K
F
G
T
P
L
Y
V
M
S
E
E
Q
I
K
I
N
Y
N
R
Y
I
E
A
F
K
R
W
E
E
E
T
G
K
E
F
I
V
A
Y
A
Y
K
A
N
A
N
L
A
I
T
R
L
L
A
K
L
G
C
G
A
D
V
V
S
G
G
E
L
Y
I
A
K
L
S
N
V
P
----
S
K
K
----
I
V
F
N
G
N
C
K
T
K
E
E
I
I
M
G
I
E
A
N
I
R
A
F
N
V
D
S
I
S
E
L
I
L
I
N
E
T
A
K
-
E
L
G
E
T
A
N
V
A
F
R
I
N
P
N
V
N
P
K
T
H
P
K
I
S
-
T
G
L
K
K
N
K
F
G
L
---
D
V
E
S
G
I
--
A
M
K
A
I
K
M
A
L
---
E
M
E
Y
V
N
V
V
G
V
H
C
H
I
G
S
Q
L
T
D
I
S
P
F
I
E
E
T
R
K
V
M
D
F
V
----
V
E
L
K
E
E
G
I
----
E
I
E
D
V
-
N
L
G
G
G
L
G
I
P
Y
-
Y
K
D
K
Q
I
P
T
Q
K
D
---
L
A
D
A
I
I
N
T
M
L
K
Y
K
D
K
--
V
E
M
P
N
L
I
L
E
P
G
R
S
L
V
A
T
A
G
Y
L
L
G
K
V
H
H
I
K
E
T
----
P
-----
V
T
K
W
V
M
I
D
A
G
M
N
D
M
M
R
P
A
M
Y
E
A
Y
H
H
--
I
I
N
C
K
-
V
K
----
N
E
K
----
E
V
V
S
---
I
A
G
G
L
C
E
S
S
D
V
F
-------
G
R
D
-------
R
E
L
D
-
K
-
V
E
V
G
D
V
L
A
I
F
D
V
G
A
Y
G
I
S
M
A
N
-
N
Y
N
A
R
G
R
P
R
M
V
L
T
-
S
K
-
K
G
V
F
L
I
R
E
R
E
T
Y
A
D
L
I
A
K
D
I
--------
8
PsiBlast_PDB
73.30
33%
-95
- C1 -
3N2B
1
DCDA_VIBCH
A:
[46-436]
------------------------
L
A
N
Q
Y
G
T
P
L
Y
V
Y
S
R
A
T
L
E
R
H
W
H
A
F
D
K
S
V
------
G
D
Y
P
H
L
I
C
Y
A
V
K
A
N
S
N
L
G
V
L
N
T
L
A
R
L
G
S
G
F
D
I
V
S
V
G
E
L
E
R
V
L
A
A
G
G
D
----
P
S
K
----
V
V
F
S
G
V
G
K
T
E
A
E
M
K
R
A
L
Q
L
K
I
K
C
F
N
V
E
S
E
P
E
L
Q
R
L
N
K
V
A
G
-
E
L
G
V
K
A
P
I
S
L
R
I
N
P
D
V
D
A
K
T
H
P
Y
I
S
-
T
G
L
R
D
N
K
F
G
I
---
T
F
D
R
A
A
--
Q
V
Y
R
L
A
H
S
L
-----
P
N
L
D
V
H
G
I
D
C
H
I
G
S
Q
L
T
A
L
A
P
F
I
D
A
T
D
R
L
L
A
L
I
----
D
S
L
K
A
E
G
I
----
H
I
-
R
H
L
D
V
G
G
G
L
G
V
V
Y
-------
P
Q
P
S
E
---
Y
A
K
A
L
L
D
R
L
E
R
H
R
D
L
------
E
L
I
F
E
P
G
R
A
I
A
A
N
A
G
V
L
V
T
K
V
E
F
L
K
H
T
-----------
K
N
F
A
I
I
D
A
A
M
N
D
L
I
R
-------
Q
D
--
I
I
P
L
R
P
R
Q
----
G
E
A
----
Q
T
Y
D
---
L
V
G
P
V
C
E
T
S
D
F
L
-------
G
K
D
-------
R
D
L
--
V
-
L
Q
E
G
D
L
L
A
V
R
S
S
G
A
Y
G
F
T
M
S
S
-
N
Y
N
T
R
P
R
V
A
E
V
M
V
-
D
G
-
N
K
T
Y
L
V
R
Q
R
E
E
L
S
S
L
W
A
L
E
---------
24
PsiBlast_CBE
72.83
39%
8
- C1 -
1TWI
3
DCDA_METJA
C:
[10-428]
----------
K
D
G
R
F
F
I
D
G
Y
D
A
I
E
L
A
E
K
F
G
T
P
L
Y
V
M
S
E
E
Q
I
K
I
N
Y
N
R
Y
I
E
A
F
K
RWEE
E
T
G
K
E
F
I
V
A
Y
A
Y
K
A
N
A
N
L
A
I
T
R
L
L
A
K
L
G
C
G
A
D
V
V
S
G
G
E
L
Y
I
A
K
L
S
N
V
P
----
S
K
K
----
I
V
F
N
G
N
C
K
T
K
E
E
I
I
M
G
I
E
A
N
I
R
A
F
N
V
D
S
I
S
E
L
I
L
I
N
E
T
A
K
-
E
L
G
E
T
A
N
V
A
F
R
I
N
P
N
V
N
P
K
T
H
P
K
I
S
-
T
G
L
K
K
N
K
F
G
L
---
D
V
E
S
G
I
--
A
M
K
A
I
K
M
A
L
---
E
M
E
Y
V
N
V
V
G
V
H
C
H
I
G
S
Q
L
T
D
I
S
P
F
I
E
E
T
R
K
V
M
D
F
V
----
V
E
L
K
E
E
G
I
----
E
I
E
D
V
-
N
L
G
G
G
L
G
I
P
Y
-
Y
K
D
K
Q
I
P
T
Q
K
D
---
L
A
D
A
I
I
N
T
M
L
K
Y
K
D
K
--
V
E
M
P
N
L
I
L
E
P
G
R
S
L
V
A
T
A
G
Y
L
L
G
K
V
H
H
I
K
E
T
----
P
-----
V
T
K
W
V
M
I
D
A
G
M
N
D
M
M
R
P
A
M
Y
E
A
Y
H
H
--
I
I
N
C
K
-
V
K
----
N
E
K
----
E
V
V
S
---
I
A
G
G
L
C
E
S
S
D
V
F
-------
G
R
D
-------
R
E
L
D
-
K
-
V
E
V
G
D
V
L
A
I
F
D
V
G
A
Y
G
I
S
M
A
N
-
N
Y
N
A
R
G
R
P
R
M
V
L
T
-
S
K
-
K
G
V
F
L
I
R
E
R
E
T
Y
A
D
L
I
A
K
D
I
--------
23
PsiBlast_CBE
72.47
39%
8
- C1 -
1TWI
3
DCDA_METJA
D:
[10-428]
----------
K
D
G
R
F
F
I
D
G
Y
D
A
I
E
L
A
E
K
F
G
T
P
L
Y
V
M
S
E
E
Q
I
K
I
N
Y
N
R
Y
I
E
A
F
K
RWEE
E
T
G
K
E
F
I
V
A
Y
A
Y
K
A
N
A
N
L
A
I
T
R
L
L
A
K
L
G
C
G
A
D
V
V
S
G
G
E
L
Y
I
A
K
L
S
N
V
P
----
S
K
K
----
I
V
F
N
G
N
C
K
T
K
E
E
I
I
M
G
I
E
A
N
I
R
A
F
N
V
D
S
I
S
E
L
I
L
I
N
E
T
A
K
-
E
L
G
E
T
A
N
V
A
F
R
I
N
P
N
V
N
P
K
T
H
P
K
I
S
-
T
G
L
K
K
N
K
F
G
L
---
D
V
E
S
G
I
--
A
M
K
A
I
K
M
A
L
---
E
M
E
Y
V
N
V
V
G
V
H
C
H
I
G
S
Q
L
T
D
I
S
P
F
I
E
E
T
R
K
V
M
D
F
V
----
V
E
L
K
E
E
G
I
----
E
I
E
D
V
-
N
L
G
G
G
L
G
I
P
Y
-
Y
K
D
K
Q
I
P
T
Q
K
D
---
L
A
D
A
I
I
N
T
M
L
K
Y
K
D
K
--
V
E
M
P
N
L
I
L
E
P
G
R
S
L
V
A
T
A
G
Y
L
L
G
K
V
H
H
I
K
E
T
----
P
-----
V
T
K
W
V
M
I
D
A
G
M
N
D
M
M
R
P
A
M
Y
E
A
Y
H
H
--
I
I
N
C
K
-
V
K
----
N
E
K
----
E
V
V
S
---
I
A
G
G
L
C
E
S
S
D
V
F
-------
G
R
D
-------
R
E
L
D
-
K
-
V
E
V
G
D
V
L
A
I
F
D
V
G
A
Y
G
I
S
M
A
N
-
N
Y
N
A
R
G
R
P
R
M
V
L
T
-
S
K
-
K
G
V
F
L
I
R
E
R
E
T
Y
A
D
L
I
A
K
D
I
--------
28
PsiBlast_CBE
72.22
33%
-102
- C1 -
3N2B
1
DCDA_VIBCH
B:
[46-436]
------------------------
L
A
N
Q
Y
G
T
P
L
Y
V
Y
S
R
A
T
L
E
R
H
W
H
A
F
D
K
S
V
------
G
D
Y
P
H
L
I
C
Y
A
V
K
A
N
S
N
L
G
V
L
N
T
L
A
R
L
G
S
G
F
D
I
V
S
V
G
E
L
E
R
V
L
A
A
G
G
D
----
P
S
K
----
V
V
F
S
G
V
G
K
T
E
A
E
M
K
R
A
L
Q
L
K
I
K
C
F
N
V
E
S
E
P
E
L
Q
R
L
N
K
V
A
G
-
E
L
G
V
K
A
P
I
S
L
R
I
N
P
D
V
-----------------
F
G
I
---
T
F
D
R
A
A
--
Q
V
Y
R
L
A
H
S
L
-----
P
N
L
D
V
H
G
I
D
C
H
I
G
-----
L
A
P
F
I
D
A
T
D
R
L
L
A
L
I
----
D
S
L
K
A
E
G
I
----
H
I
-
R
H
L
D
V
G
G
G
L
G
V
V
Y
------
P
P
Q
P
S
E
---
Y
A
K
A
L
L
D
R
L
E
R
H
R
D
L
------
E
L
I
F
E
P
G
R
A
I
A
A
N
A
G
V
L
V
T
K
V
E
F
L
K
H
T
----
E
----
H
-
K
N
F
A
I
I
D
A
A
M
N
D
L
I
R
P
A
L
Y
Q
A
W
Q
D
--
I
I
P
L
R
P
R
Q
----
G
E
A
----
Q
T
Y
D
---
L
V
G
P
V
C
E
T
S
D
F
L
-------
G
K
D
-------
R
D
L
--
V
-
L
Q
E
G
D
L
L
A
V
R
S
S
G
A
Y
G
F
T
M
S
S
-
N
Y
N
T
R
P
R
V
A
E
V
M
V
-
D
G
-
N
K
T
Y
L
V
R
Q
R
E
E
L
S
S
L
W
A
L
E
---------
9
PsiBlast_PDB
70.21
33%
-45
- C1 -
2QGH
2
DCDA_HELPX
A:
[27-418]
------------------------
L
F
Q
T
H
K
T
P
F
Y
L
Y
D
F
D
K
I
K
Q
A
F
L
N
Y
K
E
A
F
------
K
G
R
K
S
L
I
C
Y
A
L
K
A
N
S
N
L
S
I
L
S
L
L
A
H
L
E
S
G
A
D
C
V
S
I
G
E
I
Q
R
A
L
K
A
G
I
K
----
P
Y
R
----
I
V
F
S
G
V
G
K
S
A
F
E
I
E
Q
A
L
K
L
N
I
L
F
L
N
V
E
S
F
M
E
L
K
T
I
E
T
I
A
Q
-
S
L
G
I
K
A
R
I
S
I
R
I
N
P
N
I
D
A
K
T
H
P
Y
I
S
-
T
G
L
K
E
N
K
F
G
V
-------
G
E
--
K
E
-
A
L
E
M
F
L
W
A
K
K
S
A
F
L
E
P
V
S
V
H
F
H
I
G
S
Q
L
L
D
L
E
P
I
I
E
A
S
Q
K
V
-
A
K
I
----
A
K
S
L
I
A
L
G
----
I
D
L
R
F
F
D
V
G
G
G
I
G
V
S
Y
--
E
N
E
E
T
I
K
L
Y
D
---
Y
A
Q
G
I
L
N
A
L
Q
------
G
L
D
L
-
T
I
I
C
E
P
G
R
S
I
V
A
E
S
G
E
L
I
T
Q
V
L
Y
E
K
K
----------
N
K
R
-
F
V
I
V
D
A
G
M
N
D
F
L
R
P
S
L
Y
H
A
K
H
-----
A
I
R
-
V
I
----
T
P
S
-----
E
I
S
P
C
D
V
V
G
P
V
C
E
S
S
D
T
F
-------
L
K
D
-------
A
H
L
P
-
E
-
L
E
P
G
D
K
I
A
I
E
K
V
G
A
Y
G
S
S
M
A
S
-
Q
Y
N
S
R
P
K
L
L
E
L
A
L
-
E
D
--
K
I
R
V
I
R
K
R
E
A
L
E
D
L
W
R
L
E
---------
10
PsiBlast_PDB
68.23
33%
-43
- C1 -
3C5Q
3
DCDA_HELPX
A:
[27-418]
------------------------
L
F
Q
T
H
K
T
P
F
Y
L
Y
D
F
D
K
I
K
Q
A
F
L
N
Y
K
E
A
F
------
K
G
R
K
S
L
I
C
Y
A
L
K
A
N
S
N
L
S
I
L
S
L
L
A
H
L
E
S
G
A
D
C
V
S
I
G
E
I
Q
R
A
L
K
A
G
I
K
----
P
Y
R
----
I
V
F
S
G
V
G
K
S
A
F
E
I
E
Q
A
L
K
L
N
I
L
F
L
N
V
E
S
F
M
E
L
K
T
I
E
T
I
A
Q
-
S
L
G
I
K
A
R
I
S
I
R
I
N
P
N
I
D
A
K
T
H
P
Y
L
S
-
T
G
L
K
E
N
K
F
G
V
-------
G
E
--
K
E
-
A
L
E
M
F
L
W
A
K
K
S
A
F
L
E
P
V
S
V
H
F
H
I
G
S
Q
L
L
D
L
E
P
I
I
E
A
S
Q
K
V
-
A
K
I
----
A
K
S
L
I
A
L
G
----
I
D
L
R
F
F
D
V
G
G
G
I
G
V
S
Y
--
E
N
E
E
T
I
K
L
Y
D
---
Y
A
Q
G
I
L
N
A
L
Q
------
G
L
D
L
-
T
I
I
C
E
P
G
R
S
I
V
A
E
S
G
E
L
I
T
Q
V
L
Y
E
K
K
----------
N
K
R
-
F
V
I
V
D
A
G
M
N
D
F
L
R
P
S
L
Y
H
A
K
H
-----
A
I
R
-
V
I
----
T
P
S
-----
E
I
S
P
C
D
V
V
G
P
V
C
E
S
S
D
T
F
-------
L
K
D
-------
A
H
L
P
-
E
-
L
E
P
G
D
K
I
A
I
E
K
V
G
A
Y
G
S
S
M
A
S
-
Q
Y
N
S
R
P
K
L
L
E
L
A
L
-
E
D
--
K
I
R
V
I
R
K
R
E
A
L
E
D
L
W
R
L
E
---------
76
HHSearch
63.65
32%
-23
- C1 -
1KNW
5
DCDA_ECOLI
A:
[11-419]
---------------
D
L
T
A
E
N
L
L
R
L
P
A
E
F
G
C
P
V
W
V
Y
D
A
Q
I
I
R
R
Q
I
A
A
L
K
Q
-
F
D
----------
V
V
R
F
A
Q
K
A
C
S
N
I
H
I
L
R
L
M
R
E
Q
G
V
K
V
D
S
V
S
L
G
E
I
E
R
A
L
A
A
G
Y
N
PQTH
P
D
D
----
I
V
F
T
A
D
V
I
D
Q
A
T
L
E
R
V
S
E
L
Q
I
-
P
V
N
A
G
S
V
D
M
L
D
Q
L
G
Q
V
S
-----
P
G
H
R
V
W
L
R
V
N
P
G
F
G
H
G
H
S
Q
K
T
N
-
T
G
G
E
N
S
K
H
G
I
---
W
Y
T
D
L
P
--
A
A
--
L
D
V
I
Q
----
R
H
H
L
Q
L
V
G
I
H
M
H
I
G
S
G
V
-
D
Y
A
H
L
E
Q
V
C
G
A
M
V
R
-------
Q
V
I
E
-
F
G
----
Q
D
L
Q
A
I
S
A
G
G
G
L
S
V
P
Y
-
Q
Q
G
E
E
A
V
D
T
E
H
Y
Y
G
L
W
N
A
A
R
E
Q
I
A
R
----
H
L
G
H
P
V
K
L
E
I
E
P
G
R
F
L
V
A
Q
S
G
V
L
I
T
Q
V
R
S
V
K
Q
M
---------
G
S
R
H
F
V
L
V
D
A
G
F
N
D
L
M
R
P
A
M
Y
G
S
Y
H
H
--
I
S
A
L
A
-
A
D
GRSL
E
H
A
--
P
T
V
E
T
V
---
V
A
G
P
L
C
E
S
G
D
V
F
-------
T
Q
Q
EG
G
N
V
E
T
R
A
L
P
-
E
-
V
K
A
G
D
Y
L
V
L
H
D
T
G
A
Y
G
A
S
M
S
S
-
N
Y
N
S
R
P
L
L
P
E
V
L
F
-
D
N
-
G
Q
A
R
L
I
R
R
R
Q
T
I
E
E
L
L
A
L
E
L
--------
13
PsiBlast_PDB
63.22
33%
-9
- C1 -
1KO0
2
DCDA_ECOLI
A:
[16-410]
--------------------
N
L
L
R
L
P
A
E
F
G
C
P
V
W
V
Y
D
A
Q
I
I
R
R
Q
I
A
A
L
K
Q
F
D
V
-----------
V
R
F
A
Q
K
A
C
S
N
I
H
I
L
R
L
M
R
E
Q
G
V
K
V
D
S
V
S
L
G
E
I
E
R
A
L
A
A
G
Y
N
----
P
Q
T
HPDD
I
V
F
T
A
D
V
I
D
Q
A
T
L
E
R
V
S
E
L
Q
I
P
V
----
N
A
G
S
V
D
M
L
D
Q
L
G
Q
V
S
P
G
H
R
--
V
W
L
R
V
N
P
G
F
-
G
H
G
H
S
Q
K
T
N
T
G
G
E
N
S
K
H
G
I
WYT
D
L
--------
P
A
A
L
D
V
I
---
Q
R
H
H
L
Q
L
V
G
I
H
M
H
I
G
S
G
V
-
D
Y
A
H
L
E
Q
V
C
G
A
M
V
R
Q
V
----
I
E
F
G
Q
D
L
Q
----
A
I
S
A
----
G
G
G
L
S
V
P
Y
-
Q
Q
G
E
E
A
V
D
-
T
E
---
H
Y
Y
G
L
W
N
A
A
R
E
Q
I
A
R
H
L
G
H
P
V
K
L
E
I
E
P
G
R
F
L
V
A
Q
S
G
V
L
I
T
Q
V
R
S
V
K
Q
M
---------
G
S
R
H
F
V
L
V
D
A
G
F
N
D
L
M
R
P
A
M
Y
G
S
Y
H
H
--
I
S
A
L
A
-
A
D
----
G
R
S
LE
H
A
P
T
V
E
T
V
-
V
A
G
P
L
C
E
S
G
D
V
F
TQQEG
G
N
V
E
T
-------
R
A
L
P
-
E
-
V
K
A
G
D
Y
L
V
L
H
D
T
G
A
Y
G
A
S
M
S
S
-
N
Y
N
S
R
P
L
L
P
E
V
L
F
-
D
N
-
G
Q
A
R
L
I
R
R
R
Q
T
-----------------
12
PsiBlast_PDB
61.85
33%
-8
- C1 -
1KNW
5
DCDA_ECOLI
A:
[16-410]
--------------------
N
L
L
R
L
P
A
E
F
G
C
P
V
W
V
Y
D
A
Q
I
I
R
R
Q
I
A
A
L
K
Q
F
D
V
-----------
V
R
F
A
Q
K
A
C
S
N
I
H
I
L
R
L
M
R
E
Q
G
V
K
V
D
S
V
S
L
G
E
I
E
R
A
L
A
A
G
Y
N
----
P
Q
T
HPDD
I
V
F
T
A
D
V
I
D
Q
A
T
L
E
R
V
S
E
L
Q
I
P
V
----
N
A
G
S
V
D
M
L
D
Q
L
G
Q
V
S
P
G
H
R
--
V
W
L
R
V
N
P
G
F
-
G
H
G
H
S
Q
K
T
N
T
G
G
E
N
S
K
H
G
I
WYT
D
L
--------
P
A
A
L
D
V
I
---
Q
R
H
H
L
Q
L
V
G
I
H
M
H
I
G
S
G
V
-
D
Y
A
H
L
E
Q
V
C
G
A
M
V
R
Q
V
----
I
E
F
G
Q
D
L
Q
----
A
I
S
A
----
G
G
G
L
S
V
P
Y
-
Q
Q
G
E
E
A
V
D
-
T
E
---
H
Y
Y
G
L
W
N
A
A
R
E
Q
I
A
R
H
L
G
H
P
V
K
L
E
I
E
P
G
R
F
L
V
A
Q
S
G
V
L
I
T
Q
V
R
S
V
K
Q
M
---------
G
S
R
H
F
V
L
V
D
A
G
F
N
D
L
M
R
P
A
M
Y
G
S
Y
H
H
--
I
S
A
L
A
-
A
D
----
G
R
S
LE
H
A
P
T
V
E
T
V
-
V
A
G
P
L
C
E
S
G
D
V
F
TQQEG
G
N
V
E
T
-------
R
A
L
P
-
E
-
V
K
A
G
D
Y
L
V
L
H
D
T
G
A
Y
G
A
S
M
S
S
-
N
Y
N
S
R
P
L
L
P
E
V
L
F
-
D
N
-
G
Q
A
R
L
I
R
R
R
Q
T
-----------------