@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 : Rv1687c: (2016-05-04 )
MMISSSDELLRDGADPAVIIDQLRVIRGKRLALQDVSVRVACGTITGLLGPSGSGKTTLIRCIVGSQIIASGSVSVLGQPAGSAELRHRVGYMPQDPTIYNDLRVIDNIRYFAELCGVDRQAADEVIEAVDLRDHRTARCANLSGGQRARVSLACALVGRPDLLVLDEPTIGLDPVLRVELWDRFTALARRGTTLLVSSHVMDEADRCGDLLLLRQGQLLAHTTPHRLRKETGCTSLEEAFLSIVRRTTTVPAAG
Atome Classification :
(27 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...-------------------------------------------------------------------------------------------------
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MMIS
S
S
D
E
L
L
RDGA
D
P
A
V
I
I
D
Q
L
R
V
I
--RG-K-----
R
L
A
L
Q
D
V
S
V
R
V
A
C
G
T
I
T
G
LLGPSGSG
K
T
T
L
I
R
C
IVG
S
Q
I
IASG
S
V
S
V
LGQ------PA---
G
-------
S
------
A
--
E
L
---
R
-----
H
R----VGYMPQDP--
T
I
Y
N
-
D
L
R
V
I
D
N
I
--------
R
Y
----
F
A
E
L
-CGV----
D
----
R
Q
A
A
D
E
V
-------
I
----
E
A
VDLRD--------HRT---AR-----CANLSGG
Q
R
A
R
V
S
L
A
C
A
LVGRP
D
L
L
V
LDEPTIGLD
P
V
L
R
V
E
L
-
W
D
R
F
T
A
L
AR-R-G
T
T
L
L
V
S
S
H
VM
D
E
A
-
D
R-CG
D
-
L
L
L
L
RQGQ
L
L
AHT
T
P
H
R
L
R
KETGC--
T
S
L
E
E
A
F
L
S
I
V
R
R
TTTVPAAG-------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
92.69
30%
-133
- C1 -
1VPL
2
?
A:
[15-251]
----------------
A
V
V
V
K
D
L
R
K
R
--
I
G
-
K
-----
K
E
I
L
K
G
I
S
F
E
I
E
E
G
E
I
F
G
L
I
G
P
N
G
A
G
K
T
T
T
L
R
I
I
S
T
L
I
K
P
S
S
G
I
V
T
V
F
G
K
------
N
V
---
V
-------
E
------
E
P
H
E
V
---
R
-----
K
L
----
I
S
Y
L
P
E
E
A
--
G
A
Y
R
-
N
M
Q
G
I
E
Y
L
--------
R
F
----
V
A
G
F
-
Y
A
S
----
S
----
S
S
E
I
E
E
M
-------
V
E
R
A
T
E
I
A
G
L
G
E
--------
K
I
K
---
D
R
-----
V
S
T
Y
S
K
G
M
V
R
K
L
L
I
A
R
A
L
M
V
N
P
R
L
A
I
L
D
E
P
T
S
G
L
D
V
L
N
A
R
E
V
-
R
K
I
L
K
Q
A
S
Q
-
E
-
G
L
T
I
L
V
S
S
H
N
M
L
E
V
-
E
F
L
C
D
R
-
I
A
L
I
H
N
G
T
I
V
E
T
G
T
V
E
E
L
K
E
R
Y
K
A
--
Q
N
I
E
E
V
F
E
E
V
V
K
----------------------------------------------------------------------------------------------------------
80
Fugue
90.78
29%
-113
- C1 -
3TUZ
3
METN_ECOLI
H:
[23-362]
H
M
I
K
L
S
N
-----------
I
T
K
V
F
H
Q
G
--
T
R
-
T
-----
I
Q
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
ELTTLS
E
S
---
E
-------
L
------
T
--
K
A
---
R
-----
R
Q
----
I
G
M
I
F
Q
H
F
--
N
L
L
S
-
S
R
T
V
F
G
N
V
--------
A
L
----
P
L
E
L
-
D
N
T
----
P
KDEV
K
R
R
V
T
E
L
-------
L
----
S
L
V
G
L
G
D
--------
K
H
D
---
S
Y
-----
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
-
L
E
L
L
K
D
I
N
R
-
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
-
K
R
I
C
D
C
-
V
A
V
I
S
N
G
E
L
I
E
Q
D
T
V
S
E
V
F
S
H
P
K
T
--
P
L
A
Q
K
F
I
Q
S
T
L
H
L
D
I
P
E
D
Y
Q
E
RLQAEPFTDCVPMLRLEFTGQSVDAPLLSETARRFNVNNNIISAQMDYAGGVKFGIMLTEMHGTQQDTQAAIAWLQEHHVKVEV-------------
85
Fugue
90.21
27%
-107
- C1 -
1Z47
1
?
A:
[11-355]
------------
G
S
M
T
I
E
F
V
G
V
E
K
I
Y
--
P
G
-
G
-----
A
R
S
V
R
G
V
S
F
Q
I
R
E
G
E
M
V
G
L
L
G
P
S
G
S
G
K
T
T
I
L
R
L
I
A
G
L
E
R
P
T
K
G
D
V
W
I
G
G
K
------
R
V
---
T
-------
D
------
L
--
P
P
---
Q
-----
K
R
N---
V
G
L
V
F
Q
N
Y
--
A
L
F
Q
-
H
M
T
V
Y
D
N
V
--------
S
F
----
G
L
R
E
-
K
R
V
P
K
D
E
M
----
D
A
R
V
R
E
L
-------
L
----
R
F
M
R
L
E
S
--------
Y
A
N
---
R
F
-----
P
H
E
L
S
G
G
Q
Q
Q
R
V
A
L
A
R
A
L
A
P
R
P
Q
V
L
L
F
D
E
P
F
A
A
I
D
T
Q
I
R
R
E
L
-
R
T
F
V
R
Q
V
H
D
-
E
M
G
V
T
S
V
F
V
T
H
D
Q
E
E
A
-
L
E
-
V
A
D
R
V
L
V
L
H
E
G
N
V
E
Q
F
G
T
P
E
E
V
Y
E
K
P
G
T
--
L
F
V
A
S
F
I
G
E
S
N
V
W
T
R
A
V
Q
N
G
R
I
E
V
AG
A
A
L
P
V
DPAVSEG
S
E
V
A
V
V
V
R
PKD
V
E
L
Q
P
A
S
EREAHAQVV
R
S
A
F
KGS
Y
S
A
C
W
I
R
T
KD
G
E
V
W
E
V
H
V
P
SADRHRWSPG
A
W
V
H
M
N
V
T
R
W
F
I
F
P
R--
68
HHSearch
87.75
30%
-123
- C1 -
3TUI
1
METN_ECOLI
C:
[23-254]
---------------
H
M
I
K
L
S
N
I
T
K
V
--
F
H
-
Q
GTRT-
I
Q
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
------
E
L
---
T
TLSESE-
L
------
T
--
K
A
---
R
-----
R
Q
----
I
G
M
I
F
Q
H
F
--
N
L
L
S
-
S
R
T
V
F
G
N
V
--------
A
L
----
P
L
E
L
-
D
N
T
PKDE
V
----
K
R
R
V
T
E
L
-------
L
----
S
L
V
G
L
G
D
--------
K
H
D
---
S
Y
-----
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
-
L
E
L
L
K
D
I
N
R
-
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
-
K
R
I
C
D
C
-
V
A
V
I
S
N
G
E
L
I
E
Q
D
T
V
S
E
V
F
S
H
---------------------------------------------------------------------------------------------------------------------------
84
Fugue
86.88
29%
-117
- C1 -
1OXS
23
?
C:
[1-352]
--------------
M
V
R
I
I
V
K
N
V
S
K
V
FK
K
G
-
K
-----
V
V
A
L
D
N
V
N
I
N
I
E
N
G
E
R
F
G
I
L
G
P
S
G
A
G
K
T
T
F
M
R
I
I
A
G
L
D
V
P
S
T
G
E
L
Y
F
D
D
R
------
L
V
---
A
-------
S
NGKLIV
P
--
P
E
---
D
-----
R
K
----
I
G
M
V
F
Q
T
W
--
A
L
Y
P
-
N
L
T
A
F
E
N
I
--------
A
F
----
P
L
T
N
-
M
K
M
SKEE
I
----
R
K
R
V
E
E
V
-------
A
----
K
I
L
D
I
H
H
--------
V
L
N
---
H
F
-----
P
R
E
L
S
G
G
Q
Q
Q
R
V
A
L
A
R
A
L
V
K
D
P
S
L
L
L
L
D
E
P
F
S
N
L
D
A
R
M
R
D
S
A
-
R
A
L
V
K
E
V
Q
S
-
R
L
G
V
T
L
L
V
V
S
H
D
P
A
D
I
-
F
A
-
I
A
D
R
V
G
V
L
V
K
G
K
L
V
Q
V
G
K
P
E
D
L
Y
D
N
P
V
S
--
I
Q
V
A
S
L
I
G
E
I
N
E
L
E
G
K
V
T
N
E
G
VVIGSLRFPVSVSSDRAIIGIRPEDVKLSKDVIKDDSWILVGKGKVKVIGYQGGLFRITITPLDSEEEIFTYSDHPIHSGEEVLVYVRKDKIKVFEK
5
PsiBlast_PDB
86.12
28%
-125
- C1 -
4RVC
-
?
A:
[19-241]
----------------------------------------
L
E
D
V
T
F
V
V
D
R
G
E
M
V
A
L
I
G
L
N
G
A
G
K
S
T
T
I
K
H
I
I
G
L
M
E
P
R
R
G
A
I
S
I
N
G
Y
RL----
A
D
---
G
-------
P
------
E
--
T
Y
---
R
-----
R
Q
----
F
A
Y
I
P
E
T
P
--
V
L
Y
E
-
E
L
T
L
E
E
H
L
--------
R
L
----
A
A
M
A
-
Y
G
L
----
S
----
E
A
E
Y
E
R
R
-------
L
----
P
P
L
-
L
R
E
--------
F
R
L
---
E
R
RLSSF
P
A
H
F
S
K
G
M
K
Q
K
V
M
I
V
C
A
F
L
L
E
P
P
L
Y
I
I
D
E
P
F
L
G
L
D
P
L
A
I
H
A
L
-
L
E
R
M
N
E
Q
K
A
-
K
-
G
A
G
I
L
L
S
T
H
I
L
A
T
A
-
E
R
Y
C
D
S
-
F
V
I
L
H
N
G
R
V
K
A
K
G
T
L
D
D
I
R
R
Q
F
G
L
RG
A
S
L
D
E
L
Y
V
E
L
T
K
----------------------------------------------------------------------------------------------------------
63
HHSearch
83.36
31%
-118
- C1 -
3FVQ
3
FBPC_NEIG1
A:
[3-234]
---------------
A
A
L
H
I
G
H
L
S
K
S
--
F
Q
-
N
-----
T
P
V
L
N
D
I
S
L
S
L
D
P
G
E
I
L
F
I
I
G
A
S
G
C
G
K
T
T
L
L
R
C
L
A
G
F
E
Q
P
D
S
G
E
I
S
L
S
G
K
------
T
I
---
F
SKN
T
N
--
L
------
P
--
V
R
---
E
-----
R
R
----
L
G
Y
L
V
Q
E
G
--
V
L
F
P
-
H
L
T
V
Y
R
N
I
--------
A
Y
----
G
L
G
N
-
G
K
G
RT
A
Q
E
----
R
Q
R
I
E
A
M
-------
L
----
E
L
T
G
I
S
E
--------
L
A
G
---
R
Y
-----
P
H
E
L
S
G
G
Q
Q
Q
R
A
A
L
A
R
A
L
A
P
D
P
E
L
I
L
L
D
E
P
F
S
A
L
D
E
Q
L
R
R
Q
I
-
R
E
D
M
I
A
A
L
R
A
N
-
G
K
S
A
V
F
V
S
H
D
R
E
E
A
-
L
Q
Y
A
D
R
-
I
A
V
M
K
Q
G
R
I
L
Q
T
A
S
P
H
E
L
Y
R
Q
---------------------------------------------------------------------------------------------------------------------------
65
HHSearch
83.17
28%
-120
- C1 -
3RLF
3
MALK_ECOLI
A:
[2-226]
---------------
A
S
V
Q
L
Q
N
V
T
K
A
--
W
G
-
E
-----
V
V
V
S
K
D
I
N
L
D
I
H
E
G
E
F
V
V
F
V
G
P
S
G
C
G
K
S
T
L
L
R
M
I
A
G
L
E
T
I
T
S
G
D
L
F
I
G
E
K
------
R
M
---
N
D------
T
------
P
--
P
A
---
E
-----
R
G
----
V
G
M
V
F
Q
S
Y
--
A
L
Y
P
-
H
L
S
V
A
E
N
M
--------
S
F
----
G
L
K
L
-
A
G
A
K
K
E
V
I
----
N
Q
R
V
N
Q
V
-------
A
----
E
V
L
Q
L
A
H
--------
L
L
D
---
R
K
-----
P
K
A
L
S
G
G
Q
R
Q
R
V
A
I
G
R
T
L
V
A
E
P
S
V
F
L
L
D
E
P
L
S
N
L
D
A
A
L
R
V
Q
M
-
R
I
E
I
S
R
L
H
K
-
R
L
G
R
T
M
I
Y
V
T
H
D
Q
V
E
A
-
M
T
L
A
D
K
-
I
V
V
L
D
A
G
R
V
A
Q
V
G
K
P
L
E
L
Y
H
Y
P
A
-------------------------------------------------------------------------------------------------------------------------
77
HHSearch
83.08
30%
-119
- C1 -
4HUQ
-
ECFA2_LACBA
A:
[2-236]
----------------
A
I
A
F
E
H
V
T
Y
T
--
Y
Q
-
A
GTPMA
H
T
A
L
T
D
V
S
L
T
V
P
D
R
G
Y
L
A
I
I
G
H
T
G
S
G
K
S
T
L
I
Q
Q
L
N
A
L
L
K
P
T
S
G
T
I
K
I
D
E
F
------
T
I
---
T
PETTNAA
L
------
K
--
P
L
---
R
-----
Q
H
----
V
G
M
V
F
Q
F
P
EN
Q
L
F
E
--
E
T
V
R
Q
D
I
--------
A
F
----
G
P
K
N
-
F
G
M
A
D
A
D
A
----
L
A
L
A
D
E
M
-------
L
----
T
T
V
G
L
D
Q
S-------
Y
A
E
---
R
S
-----
P
F
E
L
S
G
G
Q
M
R
R
V
A
I
A
G
V
L
A
M
Q
P
K
V
L
V
L
D
E
P
T
A
G
L
D
P
Q
G
R
Q
E
M
-
M
R
L
F
A
R
L
H
Q
E
Q
-
G
L
T
I
V
L
V
T
H
Q
M
E
D
V
-
A
Q
Y
A
E
Q
-
V
A
V
M
H
E
G
R
L
M
K
F
G
T
P
A
D
V
F
S
N
---------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
82.98
31%
-133
- C1 -
4U00
3
?
A:
[3-225]
---------------
P
I
I
R
I
R
N
L
H
K
W
--
F
G
-
P
-----
L
H
V
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
Q
E
G
E
V
V
V
D
G
L
------
S
V
---
K
-------
D
DRA
L
--
R
--
E
I
---
R
-----
R
E
----
V
G
M
V
F
Q
Q
F
--
N
L
F
P
-
H
M
T
V
L
E
N
V
T
L
A
P
M
R
V
R
R
W
----
P
R
E
K
-
A
-----------
E
K
K
A
L
E
L
-------
L
----
E
R
V
G
I
L
D
--------
Q
A
R
---
K
Y
-----
P
A
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
-
L
D
V
M
R
D
L
A
Q
-
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
-
R
E
-
V
A
D
R
V
V
F
M
D
G
G
Q
I
V
E
E
G
R
P
E
E
I
------------------------------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
82.62
31%
-129
- C1 -
4U02
1
?
D:
[2-225]
--------------
E
P
I
I
R
I
R
N
L
H
K
W
--
F
G
-
P
-----
L
H
V
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
Q
E
G
E
V
V
V
D
G
L
------
S
V
---
K
-------
D
DRAL--
R
--
E
I
---
R
-----
R
E
----
V
G
M
V
F
Q
Q
F
--
N
L
F
P
-
H
M
T
V
L
E
N
V
TLAPMRVR
R
W
----
P
R
E
K
-
A
-----------
E
K
K
A
L
E
L
-------
L
----
E
R
V
G
I
L
D
--------
Q
A
R
---
K
Y
-----
P
A
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
-
L
D
V
M
R
D
L
A
Q
-
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
-
R
E
-
V
A
D
R
V
V
F
M
D
G
G
Q
I
V
E
E
G
R
P
E
E
I
------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
82.30
31%
-128
- C1 -
4U02
1
?
A:
[2-225]
--------------
E
P
I
I
R
I
R
N
L
H
K
W
--
F
G
-
P
-----
L
H
V
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
Q
E
G
E
V
V
V
D
G
L
------
S
V
---
K
-------
D
DRA
L
--
R
--
E
I
---
R
-----
R
E
----
V
G
M
V
F
Q
Q
F
--
N
L
F
P
-
H
M
T
V
L
E
N
V
T
LAPMRVR
R
W
----
P
R
E
K
-
A
-----------
E
K
K
A
L
E
L
-------
L
----
E
R
V
G
I
L
D
--------
Q
A
R
---
K
Y
-----
P
A
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
-
L
D
V
M
R
D
L
A
Q
-
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
-
R
E
-
V
A
D
R
V
V
F
M
D
G
G
Q
I
V
E
E
G
R
P
E
E
I
------------------------------------------------------------------------------------------------------------------------------
25
PsiBlast_CBE
82.17
31%
-131
- C1 -
4U02
1
?
C:
[2-225]
--------------
E
P
I
I
R
I
R
N
L
H
K
W
--
F
G
-
P
-----
L
H
V
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
Q
E
G
E
V
V
V
D
G
L
------
S
V
---
K
-------
D
DRAL--
R
--
E
I
---
R
-----
R
E
----
V
G
M
V
F
Q
Q
F
--
N
L
F
P
-
H
M
T
V
L
E
N
V
TLAPMRVR
R
W
----
P
R
E
K
-
A
-----------
E
K
K
A
L
E
L
-------
L
----
E
R
V
G
I
L
D
--------
Q
A
R
---
K
Y
-----
P
A
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
-
L
D
V
M
R
D
L
A
Q
-
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
-
R
E
-
V
A
D
R
V
V
F
M
D
G
G
Q
I
V
E
E
G
R
P
E
E
I
------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
81.56
31%
-127
- C1 -
4U02
1
?
B:
[2-225]
--------------
E
P
I
I
R
I
R
N
L
H
K
W
--
F
G
-
P
-----
L
H
V
L
K
G
I
H
L
E
V
A
P
G
E
K
L
V
I
I
G
P
S
G
S
G
K
S
T
L
I
R
T
I
N
R
L
E
D
F
Q
E
G
E
V
V
V
D
G
L
------
S
V
---
K
-------
D
DRAL--
R
--
E
I
---
R
-----
R
E
----
V
G
M
V
F
Q
Q
F
--
N
L
F
P
-
H
M
T
V
L
E
N
V
TLAPMRVR
R
W
----
P
R
E
K
-
A
-----------
E
K
K
A
L
E
L
-------
L
----
E
R
V
G
I
L
D
--------
Q
A
R
---
K
Y
-----
P
A
Q
L
S
G
G
Q
Q
Q
R
V
A
I
A
R
A
L
A
M
E
P
K
I
M
L
F
D
E
P
T
S
A
L
D
P
E
M
V
G
E
V
-
L
D
V
M
R
D
L
A
Q
-
G
-
G
M
T
M
V
V
V
T
H
E
M
G
F
A
-
R
E
-
V
A
D
R
V
V
F
M
D
G
G
Q
I
V
E
E
G
R
P
E
E
I
------------------------------------------------------------------------------------------------------------------------------
58
HHSearch
80.67
29%
-115
- C1 -
1Z47
1
?
A:
[11-238]
-------------
G
S
M
T
I
E
F
V
G
V
E
K
I
--
Y
P
G
G
-----
A
R
S
V
R
G
V
S
F
Q
I
R
E
G
E
M
V
G
L
L
G
P
S
G
S
G
K
T
T
I
L
R
L
I
A
G
L
E
R
P
T
K
G
D
V
W
I
G
G
K
------
R
V
---
T
D------
L
------
P
--
P
Q
---
K
-----
R
N
----
V
G
L
V
F
Q
N
Y
--
A
L
F
Q
-
H
M
T
V
Y
D
N
V
--------
S
F
----
G
L
R
E
-
K
R
V
P
K
D
E
M
----
D
A
R
V
R
E
L
-------
L
----
R
F
M
R
L
E
S
--------
Y
A
N
---
R
F
-----
P
H
E
L
S
G
G
Q
Q
Q
R
V
A
L
A
R
A
L
A
P
R
P
Q
V
L
L
F
D
E
P
F
A
A
I
D
T
Q
I
R
R
E
L
-
R
T
F
V
R
Q
V
H
D
-
E
M
G
V
T
S
V
F
V
T
H
D
Q
E
E
A
-
L
E
V
A
D
R
-
V
L
V
L
H
E
G
N
V
E
Q
F
G
T
P
E
E
V
Y
E
K
P
G
-------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
80.01
30%
-125
- C1 -
4WBS
1
?
A:
[37-262]
--------------
S
S
S
L
V
V
R
N
L
K
K
R
--
Y
G
-
S
-----
R
T
V
V
K
D
V
S
L
D
V
K
S
G
E
V
V
G
L
L
G
P
N
G
A
G
K
T
T
S
F
Y
M
I
V
G
L
V
P
L
D
A
G
E
I
D
L
D
G
K
------
S
I
---
S
-------
L
------
L
--
P
I
---
H
-----
K
R
A
S
L
G
L
S
Y
L
P
Q
E
A
--
S
V
F
R
-
K
L
S
V
E
E
N
I
--------
R
A
----
V
L
E
L
Q
V
G
D
----
D
GK--
R
L
S
K
D
A
I
A
S
R
T
E
A
L
L
----
D
E
L
Q
I
S
H
--------
L
R
E
---
N
P
-----
A
L
S
L
S
G
G
E
R
R
R
V
E
I
A
R
A
L
A
T
N
P
S
F
I
L
L
D
E
P
F
A
G
V
D
P
I
A
V
L
E
I
-
Q
K
I
V
K
F
L
K
Q
-
R
-
N
I
G
V
L
I
T
D
H
N
V
R
E
T
L
G
I
-
C
D
H
-
A
Y
I
I
S
D
G
S
V
L
A
A
G
A
P
---------------------------------------------------------------------------------------------------------------------------------
69
HHSearch
79.73
29%
-118
- C1 -
1OXX
21
?
K:
[2-232]
---------------
V
R
I
I
V
K
N
V
S
K
V
--
F
K
-
K
GK---
V
V
A
L
D
N
V
N
I
N
I
E
N
G
E
R
F
G
I
L
G
P
S
G
A
G
K
T
T
F
M
R
I
I
A
G
L
D
V
P
S
T
G
E
L
Y
F
D
D
R
------
L
V
---
A
SNGKLI-
V
------
P
--
P
E
---
D
-----
R
K
----
I
G
M
V
F
Q
T
W
--
A
L
Y
P
-
N
L
T
A
F
E
N
I
--------
A
F
----
P
L
T
N
-
M
K
M
SKEE
I
----
R
K
R
V
E
E
V
-------
A
----
K
I
L
D
I
H
H
--------
V
L
N
---
H
F
-----
P
R
E
L
S
G
A
Q
Q
Q
R
V
A
L
A
R
A
L
V
K
D
P
S
L
L
L
L
D
E
P
F
S
N
L
D
A
R
M
R
D
S
A
-
R
A
L
V
K
E
V
Q
S
-
R
L
G
V
T
L
L
V
V
S
H
D
P
A
D
I
-
F
A
I
A
D
R
-
V
G
V
L
V
K
G
K
L
V
Q
V
G
K
P
E
D
L
Y
D
N
P
--------------------------------------------------------------------------------------------------------------------------
38
PsiBlast_CBE
78.88
34%
-121
- C1 -
3TUZ
1
METN_ECOLI
C:
[43-247]
---------------------------------------
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
------
E
L
TTL
S
-------
E
------
S
--
E
L
TKA
R
-----
R
Q
----
I
G
M
I
F
Q
H
F
--
N
L
L
S
-
S
R
T
V
F
G
N
V
--------
A
L
----
P
L
E
L
--------
D
----
N
T
P
K
D
E
V
KRRVTEL
L
----
S
L
V
G
L
G
D
--------
K
H
D
---
S
Y
-----
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
-
L
E
L
L
K
D
I
N
R
-
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
-
K
R
I
C
D
C
-
V
A
V
I
S
N
G
E
L
I
E
Q
D
T
----------------------------------------------------------------------------------------------------------------------------------
36
PsiBlast_CBE
78.59
34%
-118
- C1 -
3TUZ
1
METN_ECOLI
G:
[43-247]
---------------------------------------
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
------
E
L
TTL
S
-------
E
------
S
--
E
L
TKA
R
-----
R
Q
----
I
G
M
I
F
Q
H
F
--
N
L
L
S
-
S
R
T
V
F
G
N
V
--------
A
L
----
P
L
E
L
--------
D
----
N
T
P
K
D
E
V
KRRVTEL
L
----
S
L
V
G
L
G
D
--------
K
H
D
---
S
Y
-----
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
-
L
E
L
L
K
D
I
N
R
-
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
-
K
R
I
C
D
C
-
V
A
V
I
S
N
G
E
L
I
E
Q
D
T
----------------------------------------------------------------------------------------------------------------------------------
40
PsiBlast_CBE
78.47
34%
-120
- C1 -
3TUI
1
METN_ECOLI
G:
[43-247]
---------------------------------------
A
L
N
N
V
S
L
H
V
P
A
G
Q
I
Y
G
V
I
G
A
S
G
A
G
K
S
T
L
I
R
C
V
N
L
L
E
R
P
T
E
G
S
V
L
V
D
G
Q
------
E
L
TTL
S
-------
E
------
S
--
E
L
TKA
R
-----
R
Q
----
I
G
M
I
F
Q
H
F
--
N
L
L
S
-
S
R
T
V
F
G
N
V
--------
A
L
----
P
L
E
L
--------
D
----
N
T
P
K
D
E
V
KRRVTEL
L
----
S
L
V
G
L
G
D
--------
K
H
D
---
S
Y
-----
P
S
N
L
S
G
G
Q
K
Q
R
V
A
I
A
R
A
L
A
S
N
P
K
V
L
L
C
D
Q
A
T
S
A
L
D
P
A
T
T
R
S
I
-
L
E
L
L
K
D
I
N
R
-
R
L
G
L
T
I
L
L
I
T
H
E
M
D
V
V
-
K
R
I
C
D
C
-
V
A
V
I
S
N
G
E
L
I
E
Q
D
T
----------------------------------------------------------------------------------------------------------------------------------
50
PsiBlast_CBE
72.42
32%
-108
- C1 -
3FVQ
3
FBPC_NEIG1
B:
[20-229]
----------------------------------------
L
N
D
I
S
L
S
L
D
P
G
E
I
L
F
I
I
G
A
S
G
C
G
K
T
T
L
L
R
C
L
A
G
F
E
Q
P
D
S
G
E
I
S
L
S
G
K
------
T
I
---
F
-------
S
------
K
--
N
T
---
N
LPVRE
R
R
----
L
G
Y
L
V
Q
E
G
--
V
L
F
P
-
H
L
T
V
Y
R
N
I
--------
A
Y
GLGN
G
K
G
R
-
T
A
Q
----
E
----
R
Q
R
I
E
A
M
-------
L
----
E
L
T
G
I
S
E
--------
L
A
G
---
R
Y
-----
P
H
E
L
S
G
G
Q
Q
Q
R
A
A
L
A
R
A
L
A
P
D
P
E
L
I
L
L
D
E
P
F
S
A
L
D
E
Q
L
R
R
Q
I
R
E
D
M
I
A
A
L
R
A
-
N
-
G
K
S
A
V
F
V
S
H
D
R
E
E
A
-
L
Q
-
Y
A
D
R
I
A
V
M
K
Q
G
R
I
L
Q
T
A
S
P
H
E
L
Y
R
Q
---------------------------------------------------------------------------------------------------------------------------
51
PsiBlast_CBE
72.24
32%
-108
- C1 -
3FVQ
3
FBPC_NEIG1
A:
[20-234]
----------------------------------------
L
N
D
I
S
L
S
L
D
P
G
E
I
L
F
I
I
G
A
S
G
C
G
K
T
T
L
L
R
C
L
A
G
F
E
Q
P
D
S
G
E
I
S
L
S
G
K
------
T
I
---
F
-------
S
------
K
--
N
T
---
N
L
P
VRE
R
R
----
L
G
Y
L
V
Q
E
G
--
V
L
F
P
-
H
L
T
V
Y
R
N
I
--------
A
Y
GLGN
G
K
G
R
-
T
A
Q
----
E
----
R
Q
R
I
E
A
M
-------
L
----
E
L
T
G
I
S
E
--------
L
A
G
---
R
Y
-----
P
H
E
L
S
G
G
Q
Q
Q
R
A
A
L
A
R
A
L
A
P
D
P
E
L
I
L
L
D
E
P
F
S
A
L
D
E
Q
L
R
R
Q
I
R
E
D
M
I
A
A
L
R
A
-
N
-
G
K
S
A
V
F
V
S
H
D
R
E
E
A
-
L
Q
-
Y
A
D
R
I
A
V
M
K
Q
G
R
I
L
Q
T
A
S
P
H
E
L
Y
R
Q
---------------------------------------------------------------------------------------------------------------------------
44
PsiBlast_CBE
67.73
31%
-123
- C1 -
4HLU
2
ECFA1_THEMA
D:
[27-217]
----------------------------------------
L
K
D
V
N
A
E
F
E
T
G
K
I
Y
V
V
V
G
K
N
G
S
G
K
T
T
L
L
K
I
L
A
G
-
L
L
A
A
A
G
E
I
F
L
D
G
S
------
P
A
---
D
-------
P
------
F
--
L
L
---
R
-----
K
N
----
V
G
Y
V
F
Q
N
P
--
S
S
Q
I
I
G
A
T
V
E
E
D
V
--------
A
F
----
S
L
E
I
-
M
G
L
----
D
ESEM
R
K
R
I
K
K
V
-------
L
----
E
L
V
G
L
S
G
--------
L
A
A
---
A
D
-----
P
L
N
L
S
G
G
Q
K
Q
R
L
A
I
A
S
M
L
A
R
D
T
R
F
L
A
L
D
E
P
V
S
M
L
D
P
P
S
Q
R
E
I
-
F
Q
V
L
E
S
L
K
N
-
E
-
G
K
G
I
I
L
V
T
H
E
L
E
Y
L
-
D
D
-
M
D
F
-
I
L
H
I
S
N
G
T
I
---------------------------------------------------------------------------------------------------------------------------------------
45
PsiBlast_CBE
67.08
31%
-123
- C1 -
4HLU
3
ECFA1_THEMA
C:
[27-217]
----------------------------------------
L
K
D
V
N
A
E
F
E
T
G
K
I
Y
V
V
V
G
K
N
G
S
G
K
T
T
L
L
K
I
L
A
G
-
L
L
A
A
A
G
E
I
F
L
D
G
S
------
P
A
---
D
-------
P
------
F
--
L
L
---
R
-----
K
N
----
V
G
Y
V
F
Q
N
P
--
S
S
Q
I
I
G
A
T
V
E
E
D
V
--------
A
F
----
S
L
E
I
-
M
G
L
----
D
E
S
E
M
R
K
R
I
K
K
V
-------
L
----
E
L
V
G
L
S
G
--------
L
A
A
---
A
D
-----
P
L
N
L
S
G
G
Q
K
Q
R
L
A
I
A
S
M
L
A
R
D
T
R
F
L
A
L
D
E
P
V
S
M
L
D
P
P
S
Q
R
E
I
-
F
Q
V
L
E
S
L
K
N
-
E
-
G
K
G
I
I
L
V
T
H
E
L
E
Y
L
-
D
D
-
M
D
F
-
I
L
H
I
S
N
G
T
I
---------------------------------------------------------------------------------------------------------------------------------------
48
PsiBlast_CBE
60.82
31%
-109
- C1 -
3NH9
3
A:
[67-264]
-------------------------------------
R
E
T
L
Q
D
V
S
F
T
V
M
P
G
Q
T
L
A
L
V
G
P
S
G
A
G
K
S
T
I
L
R
L
L
F
R
F
Y
D
I
S
S
G
C
I
R
I
D
G
Q
DIS---
Q
V
---
T
-------
Q
------
A
--
S
L
---
R
-----
S
H
----
I
G
V
V
P
Q
D
T
--
V
L
F
N
-
D
T
-
I
A
D
N
I
--------
R
Y
----
G
R
V
T
-
A
G
N
----
D
----
E
V
E
A
--
A
-------
A
----
Q
A
A
G
I
H
D
A
I
M
A
FPEG
Y
R
T
Q
V
G
E
R
-----
G
L
K
L
S
G
G
E
K
Q
R
V
A
I
A
R
T
I
L
K
A
P
G
I
I
L
L
D
E
A
T
S
A
L
D
T
S
N
E
R
A
I
-
Q
A
S
L
A
K
V
C
A
-
N
-
R
T
T
I
V
V
-
A
H
R
L
S
T
V
-
V
N
-
A
D
Q
-
I
L
V
I
K
D
G
-----------------------------------------------------------------------------------------------------------------------------------------
47
PsiBlast_CBE
60.76
31%
-110
- C1 -
3NHA
4
A:
[67-264]
-------------------------------------
R
E
T
L
Q
D
V
S
F
T
V
M
P
G
Q
T
L
A
L
V
G
P
S
G
A
G
K
S
T
I
L
R
L
L
F
R
F
Y
D
I
S
S
G
C
I
R
I
D
G
Q
DIS---
Q
V
---
T
-------
Q
------
A
--
S
L
---
R
-----
S
H
----
I
G
V
V
P
Q
D
T
--
V
L
F
N
-
D
T
-
I
A
D
N
I
--------
R
Y
----
G
R
V
T
-
A
G
N
----
D
----
E
V
E
A
--
A
-------
A
----
Q
A
A
G
I
H
D
A
I
M
A
FPEG
Y
R
T
QVG
E
R
-----
G
L
K
L
S
G
G
E
K
Q
R
V
A
I
A
R
T
I
L
K
A
P
G
I
I
L
L
D
E
A
T
S
A
L
D
T
S
N
E
R
A
I
-
Q
A
S
L
A
K
V
C
A
-
N
-
R
T
T
I
V
V
-
A
H
R
L
S
T
V
-
V
N
-
A
D
Q
-
I
L
V
I
K
D
G
-----------------------------------------------------------------------------------------------------------------------------------------
46
PsiBlast_CBE
60.40
31%
-109
- C1 -
3NHB
3
A:
[67-264]
-------------------------------------
R
E
T
L
Q
D
V
S
F
T
V
M
P
G
Q
T
L
A
L
V
G
P
S
G
A
G
K
S
T
I
L
R
L
L
F
R
F
Y
D
I
S
S
G
C
I
R
I
D
G
Q
DIS---
Q
V
---
T
-------
Q
------
A
--
S
L
---
R
-----
S
H
----
I
G
V
V
P
Q
D
T
--
V
L
F
N
-
D
T
-
I
A
D
N
I
--------
R
Y
----
G
R
V
T
-
A
G
N
----
D
----
E
V
E
A
--
A
-------
A
----
Q
A
A
G
I
H
D
A
I
M
A
FPEG
Y
R
T
QVG
E
R
-----
G
L
K
L
S
G
G
E
K
Q
R
V
A
I
A
R
T
I
L
K
A
P
G
I
I
L
L
D
E
A
T
S
A
L
D
T
S
N
E
R
A
I
-
Q
A
S
L
A
K
V
C
A
-
N
-
R
T
T
I
V
V
-
A
H
R
L
S
T
V
-
V
N
-
A
D
Q
-
I
L
V
I
K
D
G
-----------------------------------------------------------------------------------------------------------------------------------------