@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 : Lmo1952: (2016-03-30 )
VTFERLGTMNVNAEGHLEIGGVDTLKLADKYGTPLYVYDVALIRDRARGFKKTFEELGVKAQVAYASKAFSAVAIYQLMAEEGLSLDVVSGGELFTAIKANFPPERIHFHGNNKSAEEIHMALDYGIGCFVIDNYYEISLLEDILIERNEKASVLIRVTPGIEAHTHDYILTGQDDSKFGFGLTNGQAEKAIKQVLHASASFDLIGLHCHIGSQIFETTGFKLAARRIMDKLVEWHQTLGFDSKVLNLGGGFGVRYTAEDEPLEPSEYVRQIMDEVRDVAESNDIDIPEIWIEPGRSLVGEAGTTLYKVGSRKEVPGIRNYIAVDGGMSDNIRPALYDAHYDAVLAANPEKVAEETVAIAGKCCESGDMLIWDLPLPKSNAGEVLAVFCTGAYGYAMASNYNRIPRPPVVFVENGVDKLIVARETYENLVQNDLSL
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)
V
T
F
E
RLG
T
M
NVNAE
G
H
L
E
IGG
V
D
T
L
K
L
A
D
KYGT
P
L
Y
V
Y
D
V
A
L
I
R
---
D
R
-
A
R
G
F
K
K
T
F
E
EL----GV
K
A
Q
V
A
Y
A
S
K
A
F
S
A
V
A
I
Y
Q
L
M
A
EEGL
S
L
D
V
VSGG
E
L
F
T
A
I
KANFP----
P
E
R
I
H
FHGNNK
S
A
E
E
I
H
M
A
LDYG
I
G
C
F
V
ID-
N
Y
Y
E
I
S
L
L
E
D
I
L
IERNEK
A
S
V
L
I
R
VTPGIEAHT
H
D
Y
I
L
-TGQDDS
K
F
GFGLTN
G
Q
A
--
E
--
K
A
I
K
Q
V
L
H
A--SASF
D
L
I
G
L
H
C
HIG
S
Q
I
F
E
TT
G
F
K
L
A
A
R
R
I
M
D
K
L
V
E
W
H
Q
TLGF----DSK----
V
L
NLGGGF
G
V
R
YTAEDEPL
E
---
P
S
E
Y
V
R
Q
I
M
D
E
V
---
R
D
V
A
ESNDIDI
P
E
I
W
IEP
G
R
S
L
V
GEAG
T
T
L
Y
KVGSRKEV----P----GIR
N
Y
I
A
VDGGMSDNI
R
P
A
L
Y
DA-HY
D
A
V
LAA
N
P
----
E
K
V
A
E
----
E
T
V
A
-
I
A
G
KCCESG
D
M
L
-------
I
W
D-------LPLPK-S-NAG
E
V
L
A
V
F
CTGAYG
Y
A
MASNYNRIPRP
P
V
V
F
V-EN-GVD
K
L
I
V
A
R
E
T
Y
E
N
L
V
Q
N
DLSL
33
HHSearch
96.46
41%
-97
- C2 -
2O0T
1
DCDA_MYCTU
A:
[19-448]
---------
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
EKTA
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
95.29
40%
-99
- C2 -
1HKV
4
DCDA_MYCTU
B:
[22-443]
--------------
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
AQIA
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
-----
2
PsiBlast_PDB
95.26
40%
-99
- C2 -
2O0T
1
DCDA_MYCTU
A:
[24-445]
--------------
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
AQIA
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
-----
22
PsiBlast_CBE
94.82
40%
-101
- C2 -
2O0T
1
DCDA_MYCTU
B:
[24-445]
--------------
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
AQIA
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
-----
24
PsiBlast_CBE
94.54
38%
-102
- C2 -
1TWI
3
DCDA_METJA
C:
[11-428]
-------------
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
INY
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
--
34
HHSearch
94.40
38%
-105
- C2 -
1TWI
3
DCDA_METJA
A:
[7-428]
--------
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
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
--
6
PsiBlast_PDB
94.40
38%
-104
- C2 -
1TUF
2
DCDA_METJA
A:
[11-428]
-------------
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
--
23
PsiBlast_CBE
94.31
38%
-101
- C2 -
1TWI
3
DCDA_METJA
D:
[11-428]
-------------
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
INY
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
--
25
PsiBlast_CBE
94.21
38%
-103
- C2 -
1TWI
3
DCDA_METJA
B:
[11-428]
-------------
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
INY
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
--
4
PsiBlast_PDB
94.18
38%
-102
- C2 -
1TWI
3
DCDA_METJA
A:
[11-428]
-------------
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
--
1
PsiBlast_PDB
93.35
40%
-99
- C2 -
1HKV
4
DCDA_MYCTU
A:
[22-443]
--------------
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
AQIA
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
-----
3
PsiBlast_PDB
92.81
40%
-95
- C2 -
1HKW
1
DCDA_MYCTU
A:
[22-443]
--------------
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
IA
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
-----
8
PsiBlast_PDB
90.44
34%
-116
- C2 -
2QGH
2
DCDA_HELPX
A:
[26-414]
-------------------------
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
-------
9
PsiBlast_PDB
89.39
33%
-111
- C2 -
3C5Q
3
DCDA_HELPX
A:
[26-414]
-------------------------
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
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
-------
38
HHSearch
88.59
37%
-103
- C2 -
2P3E
-
DCDA_AQUAE
A:
[5-419]
--
K
E
Y
N
P
Y
L
E
Y
-
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
D
-
5
PsiBlast_PDB
88.52
37%
-105
- C2 -
2P3E
-
DCDA_AQUAE
A:
[15-420]
-------------
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
D
I
10
PsiBlast_PDB
87.31
32%
-105
- C2 -
2YXX
1
DCDA_THEMA
A:
[6-383]
-------------------------
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
----
27
PsiBlast_CBE
87.16
33%
-108
- C2 -
3N2B
2
DCDA_VIBCH
C:
[28-432]
--------
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
--------
Q
---
P
S
E
Y
A
K
A
L
L
D
R
L
ERH
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
-------
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
-------
37
HHSearch
87.10
33%
-106
- C2 -
3N2B
1
DCDA_VIBCH
A:
[25-438]
-----
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
V
-
7
PsiBlast_PDB
86.73
33%
-106
- C2 -
3N2B
1
DCDA_VIBCH
A:
[28-432]
--------
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
-------
40
HHSearch
86.20
32%
-101
* C2 *
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
--
35
HHSearch
86.14
33%
-101
- C2 -
2YXX
1
DCDA_THEMA
A:
[4-385]
-----------------------
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
V
--
39
HHSearch
80.44
30%
-98
- C2 -
1KNW
5
DCDA_ECOLI
A:
[12-419]
------------------
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
78.51
31%
-84
- C2 -
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
H
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
G
----
R
S
L
E
H
APTV
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
78.47
31%
-82
- C2 -
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
H
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
G
----
R
S
L
E
H
APTV
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
-----------