@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 : bsu17050: (2016-06-27 )
MAKVIQLSDELSNKIAAGEVVERPASVVKELVENAIDADSTVIEIDIEEAGLASIRVLDNGEGMENEDCKRAFRRHATSKIKDENDLFRVRTLGFRGEALPSIASVSHLEITTSTGEGAGTKLVLQGGNIISESRSSSRKGTEIVVSNLFFNTPARLKYMKTVHTELGNITDVVNRIALAHPEVSIRLRHHGKNLLQTNGNGDVRHVLAAIYGTAVAKKMLPLHVSSLDFEVKGYIALPEITRASRNYMSSVVNGRYIKNFPLVKAVHEGYHTLLPIGRHPITFIEITMDPILVDVNVHPSKLEVRLSKETELHDLIRDGIKDVFKQQQLIPSAQVPKKSAPAIKNEQQFITFDEKPPEKKVPEKSTAPSYSPMKLSSVVKEPVDAEEKLPPLQFDAPPIVDQEQTLEVSDVSAEQPETFEQECHEEQPQPASDRVPIMYPIGQMHGTYILAQNENGLYIIDQHAAQERIKYEYFREKVGEVEPEVQEMIVPLTFHYSTNEALIIEQHKQELESVGVFLESFGSNSYIVRCHPAWFPKGEEAELIEEIIQQVLDSKNIDIKKLREEAAIMMSCKGSIKANRHLRNDEIKALLDDLRSTSDPFTCPHGRPIIIHHSTYEMEKMFKRVM
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.......440.......450.......460.......470.......480.......490.......500.......510.......520.......530.......540.......550.......560.......570.......580.......590.......600.......610.......620.....
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
----MA
K
V
I
Q
L
S
D
E
LSNKIAA
G
E
-
V
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
AIDAD-S
T
V
I
E
I
DIEEAG
L
A
S
I
R
V
LDNGEGME
N
E
D
C
K
R
A
F
R
R
HATSKIKDEND
L
F
---
R
V
R
TLGFRGEALPSIA
S
V
S
H
L
E
I
T
T-ST-GEG-A-G
T
K
L
V
L
-QG--G
N
-
I
-ISESRSSS----RK-G
T
E
I
V
V
S
N
LFFNT
P
A
R
L
K
-
Y
M
K
-
T
-
V
H
T
ELG
N
I
T
D
V
V
N
R
I
ALAHP
E
V
S
I
R
L
RH----HG-----K-----
N
--
L
-LQTN---G---N
G
D
V
R
H
V
L
A
A
I
Y
G
T
A
----------------
V
A
K
K
M
L
P
L
-------------
H
V------------------SSL-
D
-----
F
----
E
V
K
G
Y
I
AL
P
E
--
I
--
T
R
-
A
S
R
N
Y
M
S
S
VVN
G
R
Y
IKNF
P
L
V
K
A
V
H
EG
Y
H
T
LLPIGRH--
P
I
T
F
I
E
I
TMD
P
I
L
V
D
V
NVHP
S
K
L
E
V
R
LSKE
T
E
L
H
D
L
I
R
D
G
I
K
D
V
F
K
Q
Q
QLIPSAQVPKKSAPAIKNE
Q
Q
F
I
TFDEKPPEKKVPEKSTAPSYS
P
M
K
L
S
S
V
V
KEPV
D
A
EEKLPPLQFDAPPIVDQEQ
T
L
E
VSDVSAEQ
P
E
T
F
E
Q
E
C
HEEQPQPASDRV
P
I
M
Y
P
IGQM
H
G
T
Y
I
L
A
QNEN
G
L
Y
I
ID
Q
H
A
A
Q
E
R
I
K
Y
E
Y
F
R
E
K
VGEVEP
E
V
Q
E
M
I
V
P
L
T
F
H
YSTN
E
A
L
I
I
E
Q
H
K
Q
E
L
E
S
V
G
V
F
L
E
SFGSN
S
Y
I
V
R
CHPAWFPKG
E
E
A
E
L
I
E
E
I
I
Q
Q
V
L
DSKNI
D
I
K
K
L
R
E
E
A
A
I
M
M
SCKGSIKANRHL
R
N
D
E
I
K
A
L
L
D
D
L
RSTSDPFTCPHG
R
P
I
I
I
HHS
T
Y
E
M
E
K
M
F
K
RVM
36
HHSearch
78.21
100%
-135
- C- -
3KDG
-
MUTL_BACSU
A:
[434-627]
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
D
R
V
P
I
M
Y
P
I
G
Q
M
H
G
T
Y
I
L
A
Q
N
E
N
G
L
Y
I
I
D
Q
H
A
A
Q
E
R
I
K
Y
E
Y
F
R
E
K
V
G
E
V
E
P
E
V
Q
E
M
I
V
P
L
T
F
H
Y
S
T
N
E
A
L
I
I
E
Q
H
K
Q
E
L
E
S
V
G
V
F
L
E
S
F
G
S
N
S
Y
I
V
R
C
H
P
A
W
F
P
K
G
E
E
A
E
L
I
E
E
I
I
Q
Q
V
L
D
S
K
N
I
D
I
K
K
L
R
E
E
A
A
I
M
M
S
C
K
G
----
N
R
H
L
R
N
D
E
I
K
A
L
L
D
D
L
R
S
T
S
D
P
F
T
C
P
H
G
R
P
I
I
I
H
H
S
T
Y
E
M
E
K
M
F
K
R
V
M
22
Fugue
78.09
99%
-135
- C- -
3KDG
-
MUTL_BACSU
A:
[433-627]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
D
R
V
P
I
M
Y
P
I
G
Q
M
H
G
T
Y
I
L
A
Q
N
E
N
G
L
Y
I
I
D
Q
H
A
A
Q
E
R
I
K
Y
E
Y
F
R
E
K
V
G
E
V
E
P
E
V
Q
E
M
I
V
P
L
T
F
H
Y
S
T
N
E
A
L
I
I
E
Q
H
K
Q
E
L
E
S
V
G
V
F
L
E
S
F
G
S
N
S
Y
I
V
R
C
H
P
A
W
F
P
K
G
E
E
A
E
L
I
E
E
I
I
Q
Q
V
L
D
S
K
N
I
D
I
K
K
L
R
E
E
A
A
I
M
M
S
C
K
G
----
N
R
H
L
R
N
D
E
I
K
A
L
L
D
D
L
R
S
T
S
D
P
F
T
C
P
H
G
R
P
I
I
I
H
H
S
T
Y
E
M
E
K
M
F
K
R
V
M
2
PsiBlast_PDB
78.09
99%
-135
- C- -
3KDG
-
MUTL_BACSU
A:
[433-627]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
D
R
V
P
I
M
Y
P
I
G
Q
M
H
G
T
Y
I
L
A
Q
N
E
N
G
L
Y
I
I
D
Q
H
A
A
Q
E
R
I
K
Y
E
Y
F
R
E
K
V
G
E
V
E
P
E
V
Q
E
M
I
V
P
L
T
F
H
Y
S
T
N
E
A
L
I
I
E
Q
H
K
Q
E
L
E
S
V
G
V
F
L
E
S
F
G
S
N
S
Y
I
V
R
C
H
P
A
W
F
P
K
G
E
E
A
E
L
I
E
E
I
I
Q
Q
V
L
D
S
K
N
I
D
I
K
K
L
R
E
E
A
A
I
M
M
S
C
K
G
----
N
R
H
L
R
N
D
E
I
K
A
L
L
D
D
L
R
S
T
S
D
P
F
T
C
P
H
G
R
P
I
I
I
H
H
S
T
Y
E
M
E
K
M
F
K
R
V
M
10
PsiBlast_PDB
76.39
40%
-104
- C3 -
1B63
4
MUTL_ECOLI
A:
[8-333]
----------
L
P
P
Q
L
A
N
Q
I
A
A
G
E
-
V
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
R
I
D
I
D
I
E
R
G
G
A
K
L
I
R
I
R
D
N
G
C
G
I
K
K
D
E
L
A
L
A
L
A
R
H
A
T
S
K
I
A
S
L
D
D
L
E
---
A
I
I
S
L
G
F
R
G
E
A
L
A
S
I
S
S
V
S
R
L
T
L
T
S
-
R
T
-
A
E
Q
-
Q
E
A
W
Q
A
Y
A
-
E
G
--
R
D
-
M
N
V
T
V
K
P
A
A
H
----
P
V
-
G
T
T
L
E
V
L
D
L
F
Y
N
T
P
A
R
R
K
-
F
L
R
-
T
-
E
K
T
E
F
N
H
I
D
E
I
I
R
R
I
A
L
A
R
F
D
V
T
I
N
L
S
H
----
N
G
-----
K
-----
I
--
V
-
R
Q
Y
R
---
A
VPE
G
G
Q
K
E
R
R
L
G
A
I
C
G
T
A
----------------
F
L
E
Q
A
L
A
I
-------------
E
W
------------------
Q
H
G
-
D
-----
L
----
T
L
R
G
W
V
A
D
P
N
H-
T
--
T
P
-
A
L
A
E
I
Q
Y
C
Y
V
N
G
R
M
M
R
D
R
L
I
N
H
A
I
R
Q
A
C
E
D
K
L
G
A
D
Q
Q
--
P
A
F
V
L
Y
L
E
I
D
P
H
Q
V
D
V
N
V
H
P
A
K
H
E
V
R
F
H
Q
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
V
L
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
76.24
40%
-105
- C3 -
1NHJ
3
MUTL_ECOLI
A:
[8-333]
----------
L
P
P
Q
L
A
N
Q
I
A
A
G
E
-
V
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
R
I
D
I
D
I
E
R
G
G
A
K
L
I
R
I
R
D
N
G
C
G
I
K
K
D
E
L
A
L
A
L
A
R
H
A
T
S
K
I
A
S
L
D
D
L
E
---
A
I
I
S
L
G
F
R
G
E
A
L
P
S
I
S
S
V
S
R
L
T
L
T
S
-
R
T
-
A
E
Q
-
Q
E
A
W
Q
A
Y
A
-
E
G
--
R
D
-
M
N
V
T
V
K
P
A
A
H
----
P
V
-
G
T
T
L
E
V
L
D
L
F
Y
N
T
P
A
R
R
K
-
F
L
R
-
T
-
E
K
T
E
F
N
H
I
D
E
I
I
R
R
I
A
L
A
R
F
D
V
T
I
N
L
S
H
----
N
G
-----
K
-----
I
--
V
-
R
Q
Y
R
---
A
VPE
G
G
Q
K
E
R
R
L
G
A
I
C
G
T
A
----------------
F
L
E
Q
A
L
A
I
-------------
E
W
------------------
Q
H
G
-
D
-----
L
----
T
L
R
G
W
V
A
D
P
N
H-
T
--
T
P
-
A
L
A
E
I
Q
Y
C
Y
V
N
G
R
M
M
R
D
R
L
I
N
H
A
I
R
Q
A
C
E
D
K
L
G
A
D
Q
Q
--
P
A
F
V
L
Y
L
E
I
D
P
H
Q
V
D
V
N
V
H
P
A
K
H
E
V
R
F
H
Q
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
V
L
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
76.18
40%
-107
- C3 -
1NHI
5
MUTL_ECOLI
A:
[8-333]
----------
L
P
P
Q
L
A
N
Q
I
A
A
G
E
-
V
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
R
I
D
I
D
I
E
R
G
G
A
K
L
I
R
I
R
D
N
G
C
G
I
K
K
D
E
L
A
L
A
L
A
R
H
A
T
S
K
I
A
S
L
D
D
L
E
---
A
I
I
S
L
G
F
R
G
E
A
L
A
S
I
S
S
V
S
R
L
T
L
T
S
-
R
T
-
A
E
Q
-
Q
E
A
W
Q
A
Y
A
-
E
G
--
R
D
-
M
N
V
T
V
K
P
A
A
H
----
P
V
-
G
T
T
L
E
V
L
D
L
F
Y
N
T
P
A
R
R
K
-
F
L
R
-
T
-
E
K
T
E
F
N
H
I
D
E
I
I
R
R
I
A
L
A
R
F
D
V
T
I
N
L
S
H
----
N
G
-----
K
-----
I
--
V
-
R
Q
Y
R
---
A
V
P
E
G
G
Q
K
E
R
R
L
G
A
I
C
G
T
A
----------------
F
L
E
Q
A
L
A
I
-------------
E
W
------------------
Q
H
G
-
D
-----
L
----
T
L
R
G
W
V
A
D
P
N
H-
T
--
T
P
-
A
L
A
E
I
Q
Y
C
Y
V
N
G
R
M
M
R
D
R
L
I
N
H
A
I
R
Q
A
C
E
D
K
L
G
A
D
Q
Q
--
P
A
F
V
L
Y
L
E
I
D
P
H
Q
V
D
V
N
V
H
P
A
K
H
E
V
R
F
H
Q
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
V
L
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
32
HHSearch
75.68
41%
-104
- C3 -
1B63
4
MUTL_ECOLI
A:
[2-332]
----
H
M
P
I
Q
V
L
P
P
Q
L
A
N
Q
I
A
A
G
E
-
V
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
R
I
D
I
D
I
E
R
G
G
A
K
L
I
R
I
R
D
N
G
C
G
I
K
K
D
E
L
A
L
A
L
A
R
H
A
T
S
K
I
A
S
L
D
D
L
E
---
A
I
I
S
L
G
F
R
G
E
A
L
A
S
I
S
S
V
S
R
L
T
L
T
S
-
R
T
-
A
E
Q
-
Q
E
A
W
Q
A
Y
A
-
E
G
--
R
D
-
M
N
V
T
V
K
P
A
A
H
----
P
V
-
G
T
T
L
E
V
L
D
L
F
Y
N
T
P
A
R
R
K
-
F
L
R
-
T
-
E
K
T
E
F
N
H
I
D
E
I
I
R
R
I
A
L
A
R
F
D
V
T
I
N
L
S
H
----
N
G
-----
K
-----
I
--
V
-
R
Q
Y
R
A
VP
E
---
G
G
Q
K
E
R
R
L
G
A
I
C
G
T
A
----------------
F
L
E
Q
A
L
A
I
-------------
E
W
------------------
Q
H
G
-
D
-----
L
----
T
L
R
G
W
V
A
D
P
N
--
H
T-
T
P
-
A
L
A
E
I
Q
Y
C
Y
V
N
G
R
M
M
R
D
R
L
I
N
H
A
I
R
Q
A
C
E
D
K
L
G
A
D
Q
Q
--
P
A
F
V
L
Y
L
E
I
D
P
H
Q
V
D
V
N
V
H
P
A
K
H
E
V
R
F
H
Q
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
V
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
Fugue
75.33
39%
-109
- C3 -
1B63
4
MUTL_ECOLI
A:
[1-333]
---S
H
M
P
I
Q
V
L
P
P
Q
L
A
N
Q
I
A
A
G
-
E
V
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
R
I
D
I
D
I
E
R
G
G
A
K
L
I
R
I
R
D
N
G
C
G
I
K
K
D
E
L
A
L
A
L
A
R
H
A
T
S
K
I
A
S
L
D
D
L
E
---
A
I
I
S
L
G
F
R
G
E
A
L
A
S
I
S
S
V
S
R
L
T
L
T
S
R
T
A
-
E
Q
Q
-
E
-
A
W
Q
A
Y
A
-
E
G
RD
M
N
-
V
--
T
V
K
P
A
A
H
----
P
V
-
G
T
T
L
E
V
L
D
L
F
Y
N
T
P
A
R
R
K
-
F
L
-R
T
-
E
K
T
E
F
N
H
I
D
E
I
I
R
R
I
A
L
A
R
F
D
V
T
I
N
L
S
H
----
N
-------GKIV
R
Q
--
Y
-
R
A
V
P
---
E
---
G
G
Q
K
E
R
R
L
G
A
I
C
G
T
A
----------------
F
L
E
Q
A
L
A
I
-------------
E
W
------------------
Q
H
-G
D
-----
L
----
T
L
R
G
W
V
A
D
P
N
H-
T
--
T
P
-
A
L
A
E
I
Q
Y
C
Y
V
N
G
R
M
M
R
D
R
L
I
N
H
A
I
R
Q
A
C
E
D
K
L
G
A
D
Q
Q
--
P
A
F
V
L
Y
L
E
I
D
P
H
Q
V
D
V
N
V
H
P
A
K
H
E
V
R
F
H
Q
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
V
L
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
74.86
40%
-104
- C3 -
1NHH
8
MUTL_ECOLI
A:
[8-333]
----------
L
P
P
Q
L
A
N
Q
I
A
A
G
E
-
V
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
R
I
D
I
D
I
E
R
G
G
A
K
L
I
R
I
R
D
N
G
C
G
I
K
K
D
E
L
A
L
A
L
A
R
H
A
T
S
K
I
A
S
L
D
D
L
E
---
A
I
I
S
L
G
F
R
G
E
A
L
A
S
I
S
S
V
S
R
L
T
L
T
S
-
R
T
-
A
E
Q
-
Q
E
A
W
Q
A
Y
A
-
E
G
--
R
D
-
M
N
V
T
V
K
P
A
A
H
----
P
V
-
G
T
T
L
E
V
L
D
L
F
Y
N
T
P
A
R
R
K
-
F
L
R
-
T
-
E
K
T
E
F
N
H
I
D
E
I
I
R
R
I
A
L
A
R
F
D
V
T
I
N
L
S
H
----
N
G
-----
K
-----
I
--
V
-
R
Q
Y
R
---
A
V
P---
Q
K
E
R
R
L
G
A
I
C
G
T
A
----------------
F
L
E
Q
A
L
A
I
-------------
E
W
------------------
Q
H
G
-
D
-----
L
----
T
L
R
G
W
V
A
D
P
N
H-
T
--
T
P
-
A
L
A
E
I
Q
Y
C
Y
V
N
G
R
M
M
R
D
R
L
I
N
H
A
I
R
Q
A
C
E
D
K
L
G
--
Q
Q
--
P
A
F
V
L
Y
L
E
I
D
P
H
Q
V
D
V
N
V
H
P
A
K
H
E
V
R
F
H
Q
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
V
L
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
73.93
99%
-148
- C2 -
3KDK
2
B:
[5-194]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
V
P
I
M
Y
P
I
G
Q
M
H
G
T
Y
I
L
A
Q
N
E
N
G
L
Y
I
I
D
Q
H
A
A
Q
E
R
I
K
Y
E
Y
F
R
E
K
V
G
E
V
E
P
E
V
Q
E
M
I
V
P
L
T
F
H
Y
S
T
N
E
A
L
I
I
E
Q
H
K
Q
E
L
E
S
V
G
V
F
L
E
S
F
G
S
N
S
Y
I
V
R
C
H
P
A
W
F
P
K
G
E
E
A
E
L
I
E
E
I
I
Q
Q
V
L
D
S
K
N
I
D
I
K
K
L
R
E
E
A
A
I
M
M
S
C
K
------
R
H
L
R
N
D
E
I
K
A
L
L
D
D
L
R
S
T
S
D
P
F
T
C
P
H
G
R
P
I
I
I
H
H
S
T
Y
E
M
E
K
M
F
K
---
7
PsiBlast_PDB
73.21
40%
-108
- C3 -
1B62
2
MUTL_ECOLI
A:
[12-338]
----------
L
P
P
Q
L
A
N
Q
I
A
A
G
E
-
V
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
R
I
D
I
D
I
E
R
G
G
A
K
L
I
R
I
R
D
N
G
C
G
I
K
K
D
E
L
A
L
A
L
A
R
H
A
T
S
K
I
A
S
L
D
D
L
E
---
A
I
I
S
L
G
F
R
G
E
A
L
A
S
I
S
S
V
S
R
L
T
L
T
S
-
R
T
-
A
E
Q
-
Q
E
A
W
Q
A
Y
A
-
E
G
--
R
D
-
M
N
V
T
V
K
P
A
A
H
----
P
V
-
G
T
T
L
E
V
L
D
L
F
Y
N
T
P
A
R
R
K
-
F
L
R
-
T
-
E
K
T
E
F
N
H
I
D
E
I
I
R
R
I
A
L
A
R
F
D
V
T
I
N
L
S
H
----
N
G
-----
K
-----
I
--
V
-
R
Q
Y
R
---
A
V
P
E
G
G
Q
K
E
R
R
L
G
A
I
C
G
T
A
----------------
F
L
E
Q
A
L
A
I
-------------
E
W
------------------
Q
H
G
-
D
-----
L
----
T
L
R
G
W
V
A
D
P
N
H-
T
--
T
P
-
A
L
A
E
I
Q
Y
C
Y
V
N
G
R
M
M
R
D
R
L
I
N
H
A
I
R
Q
A
C
E
D
K
L
G
A
D
Q
Q
--
P
A
F
V
L
Y
L
E
I
D
P
H
Q
V
D
V
N
V
H
P
-
K
H
E
V
R
F
H
Q
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
V
L
Q
Q
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
71.98
40%
-131
- C3 -
5AKD
-
MUTL_ECOLI
C:
[40-351]
-------------------------
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
R
I
D
I
D
I
E
R
G
G
A
K
L
I
R
I
R
D
N
G
S
G
I
K
K
D
E
L
A
L
A
L
A
------
I
A
S
L
D
D
L
E
---
A
I
I
S
L
G
F
R
G
E
A
L
A
S
I
S
S
V
S
R
L
T
L
T
S
-
R
T
-
A
E
Q
-
Q
E
A
W
Q
A
Y
A
-----------
V
T
V
K
P
A
A
----
H
P
V
G
T
T
L
E
V
L
D
L
F
Y
N
T
P
A
R
R
K
-
F
L
R
-
T
-
E
K
T
E
F
N
H
I
D
E
I
I
R
R
I
A
L
A
R
F
D
V
T
I
N
L
S
H
----
N
G
-----
K
-----
I
--
V
-
R
Q
Y
R
---
A
VPE
G
G
Q
K
E
R
R
L
G
A
I
L
G
T
A
----------------
F
L
E
Q
A
L
A
I
-------------
E
W
------------------
Q
H
G
-
D
-----
L
----
T
L
R
G
W
V
A
D
P
N
H-
T
--
T
P
-
A
L
A
E
I
Q
Y
F
Y
V
N
G
R
M
M
R
D
R
L
I
N
H
A
I
R
Q
A
Y
E
D
K
L
G
A
D
Q
Q
--
P
A
F
V
L
Y
L
E
I
D
P
H
Q
V
---------------
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
V
L
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
71.39
27%
-138
- C3 -
1H7S
-
PMS2_HUMAN
A:
[29-363]
---------------------
G
Q
-
V
V
---
L
S
L
S
T
A
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
N
I
D
L
K
L
K
D
Y
G
V
D
L
I
E
V
S
D
N
G
C
G
V
E
E
E
N
F
E
G
L
T
L
----------
A
D
L
T
---
Q
V
E
T
F
G
F
R
G
E
A
L
S
S
L
C
A
L
S
D
V
T
I
S
T
-
C
H
-
A
S
A
K
V
-
G
T
R
L
M
F
D
H
N
--
G
K
-
I
-
I
Q
K
T
P
Y
P
R
----
P
R
-
G
T
T
V
S
V
Q
Q
L
F
S
T
L
P
V
R
H
K
E
F
Q
R
-
N
-
I
K
K
E
Y
A
K
M
V
Q
V
L
H
A
Y
C
I
I
S
A
G
I
R
V
S
C
T
N
Q
L
G-
Q
G
-----
K
-----
R
QP
V
-
V
C
T
G
---
G
---
S
P
S
I
K
E
N
I
G
S
V
F
G
Q
K
----------------
Q
L
Q
S
L
I
P
F
V
Q
L
P
PS
D
S
V
C
E
E
Y
G
L
------------------
S
C
S
-
D
ALHNL
F
----
Y
I
S
G
F
I
S
Q
C
T
HG
V
--
G
R
-
S
S
T
D
R
Q
F
F
F
I
N
R
R
P
C
D
P
A
K
V
C
R
L
V
N
E
V
Y
H
M
Y
---
N
R
H
Q
Y
P
F
V
V
L
N
I
S
V
D
S
E
C
V
D
I
N
------
Q
I
L
L
Q
E
E
K
L
L
L
A
V
L
K
T
S
L
I
G
M
F
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
71.24
99%
-142
- C2 -
3GAB
-
MUTL_BACSU
A:
[435-624]
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
R
V
P
I
M
Y
P
I
G
Q
M
H
G
T
Y
I
L
A
Q
N
E
N
G
L
Y
I
I
D
Q
H
A
A
Q
E
R
I
K
Y
E
Y
F
R
E
K
V
G
E
--
P
E
V
Q
E
M
I
V
P
L
T
F
H
Y
S
T
N
E
A
L
I
I
E
Q
H
K
Q
E
L
E
S
V
G
V
F
L
E
S
F
G
S
N
S
Y
I
V
R
C
H
P
A
W
F
P
K
G
E
E
A
E
L
I
E
E
I
I
Q
Q
V
L
D
S
K
N
I
D
I
K
K
L
R
E
E
A
A
I
M
M
S
C
K
-----
N
R
H
L
R
N
D
E
I
K
A
L
L
D
D
L
R
S
T
S
D
P
F
T
C
P
H
G
R
P
I
I
I
H
H
S
T
Y
E
M
E
K
M
F
K
---
3
PsiBlast_PDB
70.94
99%
-142
- C2 -
3KDK
2
MUTL_BACSU
A:
[3-194]
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
M
D
R
V
P
I
M
Y
P
I
G
Q
M
H
G
T
Y
I
L
A
Q
N
E
N
G
L
Y
I
I
D
Q
H
A
A
Q
E
R
I
K
Y
E
Y
F
R
E
K
V
G
E
V
E
P
E
V
Q
E
M
I
V
P
L
T
F
H
Y
S
T
N
E
A
L
I
I
E
Q
H
K
Q
E
L
E
S
V
G
V
F
L
E
S
F
G
S
N
S
Y
I
V
R
C
H
P
A
W
F
P
K
G
E
E
A
E
L
I
E
E
I
I
Q
Q
V
L
D
S
K
N
I
D
I
K
K
L
R
E
E
A
A
I
M
M
S
C
K
------
R
H
L
R
N
D
E
I
K
A
L
L
D
D
L
R
S
T
S
D
P
F
T
C
P
H
G
R
P
I
I
I
H
H
S
T
Y
E
M
E
K
M
F
K
---
5
PsiBlast_PDB
70.69
40%
-119
- C3 -
5AKC
-
MUTL_ECOLI
C:
[40-351]
-------------------------
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
R
I
D
I
D
I
E
R
G
G
A
K
L
I
R
I
R
D
N
G
S
G
I
K
K
D
E
L
A
L
A
L
A
------
I
A
S
L
D
D
L
E
---
A
I
I
S
L
G
F
R
G
E
A
L
A
S
I
S
S
V
S
R
L
T
L
T
S
-
R
T
-
A
E
Q
-
Q
E
A
W
Q
A
Y
A
-----------
V
T
V
K
P
A
A
----
H
P
V
G
T
T
L
E
V
L
D
L
F
Y
N
T
P
A
R
R
K
-
F
L
R
-
T
-
E
K
T
E
F
N
H
I
D
E
I
I
R
R
I
A
L
A
R
F
D
V
T
I
N
L
S
H
----
N
G
-----
K
-----
I
--
V
-
R
Q
Y
R
---
A
VPE
G
G
Q
K
E
R
R
L
G
A
I
L
G
T
A
----------------
F
L
E
Q
A
L
A
I
-------------
E
W
------------------
Q
H
G
-
D
-----
L
----
T
L
R
G
W
V
A
D
P
N
H-
T
--
T
P
-
A
L
A
E
I
Q
Y
F
Y
V
N
G
R
M
M
R
D
R
L
I
N
H
A
I
R
Q
A
Y
E
D
K
L
G
A
D
Q
Q
--
P
A
F
V
L
Y
L
E
I
D
P
H
Q
V
---------------
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
V
L
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
35
HHSearch
70.38
27%
-129
- C3 -
1H7S
-
PMS2_HUMAN
A:
[29-364]
---------------------
G
Q
-
V
V
---
L
S
L
S
T
A
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
N
I
D
L
K
L
K
D
Y
G
V
D
L
I
E
V
S
D
N
G
C
G
V
E
E
E
N
F
E
G
L
T
L
----------
A
D
L
T
---
Q
V
E
T
F
G
F
R
G
E
A
L
S
S
L
C
A
L
S
D
V
T
I
S
T
-
C
H
-
A
S
A
-
K
V
G
T
R
L
M
F
-
D
H
N-
G
K
-
I
-
I
Q
K
T
P
Y
P
R
----
P
R
-
G
T
T
V
S
V
Q
Q
L
F
S
T
L
P
V
R
H
K
-
E
F
Q
R
N
-
I
K
K
E
Y
A
K
M
V
Q
V
L
H
A
Y
C
I
I
S
A
G
I
R
V
S
C
T
N
----
Q
L
GQGKR
Q
-----
P
--
V
-
V
C
T
G
---
G
---
S
P
S
I
K
E
N
I
G
S
V
F
G
Q
K
----------------
Q
L
Q
S
L
I
P
F
-------------
V
Q
L
P
PS
D
S
V
C
E
E
Y
GLSCSDA
L
H
N
-
L
-----
F
----
Y
I
S
G
F
I
S
Q
C
T
HG
V
--
G
R
-
S
S
T
D
R
Q
F
F
F
I
N
R
R
P
C
D
P
A
K
V
C
R
L
V
N
E
V
Y
H
M
Y
-
N
R
H
Q
Y
--
P
F
V
V
L
N
I
S
V
D
S
E
C
V
D
I
N
------
Q
I
L
L
Q
E
E
K
L
L
L
A
V
L
K
T
S
L
I
G
M
F
D
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
69.49
40%
-123
- C3 -
5AKB
-
MUTL_ECOLI
C:
[40-351]
-------------------------
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
R
I
D
I
D
I
E
R
G
G
A
K
L
I
R
I
R
D
N
G
S
G
I
K
K
D
E
L
A
L
A
L
A
------
I
A
S
L
D
D
L
E
---
A
I
I
S
L
G
F
R
G
E
A
L
A
S
I
S
S
V
S
R
L
T
L
T
S
-
R
T
-
A
E
Q
-
Q
E
A
W
Q
A
Y
A
-----------
V
T
V
K
P
A
A
----
H
P
V
G
T
T
L
E
V
L
D
L
F
Y
N
T
P
A
R
R
K
-
F
L
R
-
T
-
E
K
T
E
F
N
H
I
D
E
I
I
R
R
I
A
L
A
R
F
D
V
T
I
N
L
S
H
----
N
G
-----
K
-----
I
--
V
-
R
Q
Y
R
---
A
VPE
G
G
Q
K
E
R
R
L
G
A
I
L
G
T
A
----------------
F
L
E
Q
A
L
A
I
-------------
E
W
------------------
Q
H
G
-
D
-----
L
----
T
L
R
G
W
V
A
D
P
N
H-
T
--
T
P
-
A
L
A
E
I
Q
Y
F
Y
V
N
G
R
M
M
R
D
R
L
I
N
H
A
I
R
Q
A
Y
E
D
K
L
G
A
D
Q
Q
--
P
A
F
V
L
Y
L
E
I
D
P
H
Q
V
---------------
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
V
L
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
HHSearch
69.30
30%
-111
- C3 -
3H4L
2
PMS1_YEAST
A:
[13-363]
--------------
D
V
H
R
I
T
S
G
Q
-
V
I
---
T
D
L
T
T
A
V
K
E
L
V
D
N
S
I
D
A
N
-
A
N
Q
I
E
I
I
F
K
D
Y
G
L
E
S
I
E
C
S
D
N
G
D
G
I
D
P
S
N
Y
E
F
L
A
L
K
H
Y
T
---------
A
---
K
V
Q
T
L
G
F
R
G
E
A
L
S
S
L
C
G
I
A
K
L
S
V
I
T
-
T
T
-
S
P
P
-
K
-
A
D
K
L
E
Y
-
D
M
--
V
G
H
I
-
T
S
K
T
T
T
S
R
----
N
K
-
G
T
T
V
L
V
S
Q
L
F
H
N
L
P
V
R
Q
K
-
E
F
S
-
K
T
F
K
R
Q
F
T
K
C
L
T
V
I
Q
G
Y
A
I
I
N
A
A
I
K
F
S
V
W
N
----
I
T
PK
G
K
K
N
-----
L
--
I
-
L
S
T
M
---
R
---
N
S
S
M
R
K
N
I
S
S
V
F
G
A
G
----------------
G
M
R
G
L
E
E
V
-------------
D
L
V
L
D
LNPFKNRML-------
D
Y
-
K
-----
I
----
R
V
K
G
Y
I
S
Q
N
S
--
F
GC
G
R
-
N
S
K
D
R
Q
F
I
Y
V
N
K
R
P
V
E
Y
S
T
L
L
K
C
C
N
E
V
Y
K
T
F
-
N
N
V
Q
F
--
P
A
V
F
L
N
L
E
L
P
M
S
L
I
D
V
N
V
T
P
D
K
R
V
I
L
L
H
N
E
R
A
V
I
D
I
F
K
T
T
L
S
D
Y
Y
N
R
Q
E
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
69.22
27%
-145
- C3 -
1EA6
2
PMS2_HUMAN
A:
[27-363]
-------------------
C
S
G
Q
-
V
V
---
L
S
L
S
T
A
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
N
I
D
L
K
L
K
D
Y
G
V
D
L
I
E
V
S
D
N
G
C
G
V
E
E
E
N
F
E
G
L
T
L
--------------------------
E
A
L
S
S
L
C
A
L
S
D
V
T
I
S
T
-
C
H
-
A
S
A
K
V
-
G
T
R
L
M
F
D
H
N
--
G
K
-
I
-
I
Q
K
T
P
Y
P
R
----
P
R
-
G
T
T
V
S
V
Q
Q
L
F
S
T
L
P
V
R
H
K
E
F
Q
R
-
N
-
I
K
K
E
Y
A
K
M
V
Q
V
L
H
A
Y
C
I
I
S
A
G
I
R
V
S
C
T
N
Q
L
G-
Q
G
-----
K
-----
R
QP
V
-
V
C
T
G
---
G
---
S
P
S
I
K
E
N
I
G
S
V
F
G
Q
K
----------------
Q
L
Q
S
L
I
P
F
V
Q
L
PPS
D
S
V
C
E
E
Y
G
L
------------------
S
C
S
-
D
ALHNL
F
----
Y
I
S
G
F
I
S
Q
C
T
HG
V
--
G
R
-
S
S
T
D
R
Q
F
F
F
I
N
R
R
P
C
D
P
A
K
V
C
R
L
V
N
E
V
Y
H
M
Y
---
N
R
H
Q
Y
P
F
V
V
L
N
I
S
V
D
S
E
C
V
-----------
L
L
Q
E
E
K
L
L
L
A
V
L
K
T
S
L
I
G
M
F
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
65.36
30%
-102
- C3 -
3H4L
2
PMS1_YEAST
A:
[13-363]
--------------
D
V
H
R
I
T
S
G
Q
-
V
I
---
T
D
L
T
T
A
V
K
E
L
V
D
N
S
I
D
A
N
-
A
N
Q
I
E
I
I
F
K
D
Y
G
L
E
S
I
E
C
S
D
N
G
D
G
I
D
P
S
N
Y
E
F
L
A
L
K
H
Y
T
---------
A
---
K
V
Q
T
L
G
F
R
G
E
A
L
S
S
L
C
G
I
A
K
L
S
V
I
T
-
T
T
-
S
P
P
-
K
-
A
D
K
L
E
Y
-
D
M
V-
G
H
-
I
-
T
S
K
T
T
T
S
R
----
N
K
-
G
T
T
V
L
V
S
Q
L
F
H
N
L
P
V
R
Q
K
E
F
S
K
-
T
-
F
K
R
Q
F
T
K
C
L
T
V
I
Q
G
Y
A
I
I
N
A
A
I
K
F
S
V
W
N
I
T
PK
G
K
-----
K
-----
N
--
L
I
L
S
T
M
---
R
---
N
S
S
M
R
K
N
I
S
S
V
F
G
A
G
GMRG
L
E
E
V
D
L
V
L
D
LNP
F
K
N
R
M
L
----------------------------------------------DY
K
I
R
V
K
G
Y
I
S
Q
N
S
--
F
GC
G
R
-
N
S
K
D
R
Q
F
I
Y
V
N
K
R
P
V
E
Y
S
T
L
L
K
C
C
N
E
V
Y
K
T
F
N
N
V
-
Q
F
--
P
A
V
F
L
N
L
E
L
P
M
S
L
I
D
V
N
V
T
P
D
K
R
V
I
L
L
H
N
E
R
A
V
I
D
I
F
K
T
T
L
S
D
Y
Y
N
R
Q
E
L
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
Fugue
44.54
47%
-80
- C3 -
1B63
4
MUTL_ECOLI
A:
[1-204]
SHMP
I
Q
---
V
L
P
P
Q
L
A
N
Q
I
A
A
G
----
E
V
V
E
R
P
A
S
V
V
K
E
L
V
E
N
S
L
D
A
-G
A
T
R
I
D
I
D
I
E
R
G
G
A
K
L
I
R
I
R
D
N
G
C
G
I
K
K
D
E
L
A
L
A
L
A
R
H
A
T
S
K
I
A
S
L
D
D
L
E
A
II---
S
L
G
F
R
G
E
A
L
A
S
I
S
S
V
S
R
L
T
L
T
S
-
R
T
A
E
Q
Q
-
E
-
A
W
Q
A
Y
A
-
E
G
--
R
D
-
M
-
N
V
-
T
-
V
K
P
A
A
H
P
-
V
-
G
T
T
L
E
V
L
D
L
F
Y
N
T
P
A
R
R
K
-
F
L
-R
T
-
E
K
T
E
F
N
H
I
D
E
I
I
R
R
I
A
L
A
R
F
D
V
T
I
N
L
S
H
N----
G
-----
K
-----
I
--
V
-
R
Q
Y
R
---
A
---
V
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
29
Fugue
43.66
30%
-160
- C3 -
1B63
3
MUTL_ECOLI
A:
[219-333]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
T
A
----------------
F
L
E
Q
A
L
A
I
-------------
E
W
------------------
Q
H
-G
D
-----
L
----
T
L
R
G
W
V
A
D
P
N
H-
T
--
T
P
-
A
L
A
E
I
Q
Y
C
Y
V
N
G
R
M
M
R
D
R
L
I
N
H
A
I
R
Q
A
C
E
D
K
L
G
A
D
Q
Q
--
P
A
F
V
L
Y
L
E
I
D
P
H
Q
V
D
V
N
V
H
P
A
K
H
E
V
R
F
H
Q
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
V
L
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
Fugue
42.60
42%
-74
- C3 -
1B63
4
MUTL_ECOLI
A:
[3-218]
-----
M
P
I
Q
V
L
P
P
Q
L
A
N
Q
I
A
A
G
E
-
V
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
S
L
D
A
G
-
A
T
R
I
D
I
D
I
E
R
G
G
A
K
L
I
R
I
R
D
N
G
C
G
I
K
K
D
E
L
A
L
A
L
A
R
H
A
T
S
K
I
A
S
L
D
D
L
E
---
A
I
I
S
L
G
F
R
G
E
A
L
A
S
I
S
S
V
S
R
L
T
L
T
S
R
T
A
-
E
Q
Q
-
E
-
A
W
Q
A
Y
A
-
E
G
--
R
D
-
M
-
N
V
T
V
K
P
A
A
H
---
P
V
-
G
T
T
L
E
V
L
D
L
F
Y
N
T
P
A
R
R
K
-
F
L
R
-
T
-
E
K
T
E
F
N
H
I
D
E
I
I
R
R
I
A
L
A
R
F
D
V
T
I
N
L
S
H
----
N
G
-----
K
-----
I
--
V
-
R
Q
Y
R
---
A
---
V
P
E
G
G
Q
K
E
R
R
L
G
A
I
C
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
28
Fugue
42.35
30%
-153
- C3 -
1B63
3
MUTL_ECOLI
A:
[219-333]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
G
T
A
----------------
F
L
E
Q
A
L
A
I
-------------
E
W
------------------
Q
H
G
-
D
-----
L
----
T
L
R
G
W
V
A
D
P
N
--
H
--
T
T
P
A
L
A
E
I
Q
Y
C
Y
V
N
G
R
M
M
R
D
R
L
I
N
H
A
I
R
Q
A
C
E
D
K
L
G
A
D
Q
Q
--
P
A
F
V
L
Y
L
E
I
D
P
H
Q
V
D
V
N
V
H
P
A
K
H
E
V
R
F
H
Q
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
V
L
Q
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------