@TOME V2.3
(Mar 2018)
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 : Q3XXL8: (2018-01-04 )
MAKIQELSERLANQIAAGEVVERPASVVKELVENAIDAGSTQIDILVEEAGLRTIQVIDNGEGILADDVENAFKRHATSKIHNRDDLFRIRTLGFRGEALPSIASVSEMTLETANQEEKQGTYLSLKGGEVIEHRPAPLRQGTKITVSNLFFNTPARLKYVKTLHTELANIGDIVNRLALSHPSIAFRLVHDGNKMLATAGNGDLKQTIAGIYGLSTAKKMLKIEGKDLDFELFGYVSLPEVTRASRNYLSTIINGRFIKNFSLNKAIVAGYGSKLMVGRFPIAVLEIKMDPLLVDVNVHPTKQEVRLSKEKELTELISNAIQKALSQENLIPSAADNLRFKKKVPDQPKTEQIEIDLSYAFEEEKPKKPSSLNFDRETGTFFVEELKNTFVDRIVDKSVENVENYSGFSEENTTYPEKTAKTVDKFGENVDNFVEKTVEKSEKKEFPIVDNMEKTNEEQADKSVEEDEKIYEEELTLHPEFDFTQGNDKTLEQAIKKLETEKPVQRFPQLEYFGQMHGTYLFAQSSDGLYIIDQHAAQERIKYEYFREKIGEVSDDLQELLVPFVLDYPNSDALKLKEQKHLLEDAGIYLEEFGQNSFIVRAHPTWYPNGEEESIIREMIDMLLTTGSVSVKKFREATAIMMSCKRSIKANHYLNEAQARVLLKDLARCENPFNCPHGRPVLIHFTNSDMERMFKRIQDPH
Atome Classification :
(22 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.......630.......640.......650.......660.......670.......680.......690.......700
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
----MA
K
I
Q
E
L
S
E
R
L
A
N
Q
IAA
G
E
-
V
V
---
E
R
P
A
S
V
V
K
E
L
V
E
N
AIDAGS
T
Q
I
D
I
L
V
EEAG
L
R
T
I
Q
V
IDNGEGI
L
A
D
D
V
E
N
A
F
K
R
H
A
T
SKIHNRD
D
L
F
---
R
I
R
TLGFRGEALP
S
I
A
S
V
S
E
-
M
T
L
ETANQEEKQG
T
Y
L
-
S
L-K-G--G-
E
-
V
-IEHRPAPLRQ----G
T
K
I
T
V
S
N
L
FFNT
P
A
R
L
K
-
Y
V
-
K
-
T
L
H
T
E
L
A
N
I
-
G
D
I
V
N
R
L
ALSHP
S
I
A
F
R
L
V
H-----DG-----
N
-----
K
-----
M
L
A
T---AGN
G
D
L
K
Q
T
I
A
G
I
YG---
L
S
T
A
K
K
M
L
K
---------------IE-------------G------------------KDL------------------
D
F
E
L
F
---
G
Y
VS
L
P
-
E
--
V
--
T
R
-
A
S
R
N
--
Y
L
S
T
I
-IN------
G
R
--------
F
I
KNFSL
N
K
A
I
V
AGYGS
K
-
L
--
M
VGR--F
P
I
A
V
L
E
I
KMD
P
L
L
V
D
V
NVHP
T
K
Q
E
V
RL
S
K
E
K
E
L
T
E
L
I
S
N
A
I
Q
K
-
A
L
S
QENLIPSAADN
L
R
F
KKKVPDQPKT
E
Q
I
E
I
D
L
S
Y
AFEEEKPKKPSSLNFDRET
G
T
F
F
V
E
E
L
K
N
T
F
V
D
R
I
V
D
K
S
V
E
N
V
E
NYSGFSEENTTYP
E
K
T
A
K
T
V
D
K
F
G
E
N
V
D
N
F
V
E
K
T
V
E
K
S
EKKEFPIVD
N
M
E
KT
N
E
E
Q
ADKS
V
E
E
D
E
K
I
Y
E
E
ELTLHPEFDFTQGN
D
K
T
L
E
Q
A
I
K
KLET
E
K
P
V
Q
RFP
Q
L
E
Y
F
G
QMH
G
T
Y
L
F
A
QSSD
G
L
Y
I
I
D
Q
H
A
A
Q
E
R
I
K
Y
E
Y
F
R
E
K
I
G
E
V
S
D
D
L
Q
E
L
L
V
P
F
V
LDYPNS
D
A
L
K
L
K
E
Q
K
H
L
L
E
D
A
G
I
Y
L
E
E
FGQN
S
F
I
V
RAHPTWYPNG
E
E
E
S
I
I
R
E
M
I
D
M
L
LTTGS
V
S
V
K
K
F
R
E
A
T
A
I
M
M
S
C
K
R
SIKANHY
L
N
E
A
Q
A
R
V
L
L
K
D
L
A
RCENPFNCPHG
R
P
V
L
I
H
FTN
S
D
M
E
R
M
F
K
R
IQDPH
6
PsiBlast_PDB
80.95
41%
-17
- C2 -
-
1NHJ
1
MUTL_ECOLI
A:
[5-332]
-------
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
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
KIV--
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
80.92
41%
-21
- C2 -
-
1B63
3
MUTL_ECOLI
A:
[5-332]
-------
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
KIV--
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
HHSearch
80.54
41%
-20
- C2 -
-
1B63
3
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
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
79.22
40%
-19
- C2 -
-
1B62
1
MUTL_ECOLI
A:
[9-337]
-------
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
KIV--
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
--
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
78.90
41%
-20
- C2 -
-
1NHI
3
MUTL_ECOLI
A:
[5-332]
-------
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
KIV--
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
57
Fugue
75.82
42%
32
- C2 -
-
1B63
3
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
71.62
40%
-77
- C2 -
-
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
KIV--
R
-----
Q
-----
Y
R
A
V
---
P
E
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
71.04
40%
-72
- C2 -
-
1BKN
-
MUTL_ECOLI
A:
[20-331]
-------------------------
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
------
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
----------------
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
KIV--
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
---------------
S
R
L
V
H
D
F
I
Y
Q
G
V
L
S
-
V
L
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
69.85
40%
-68
- C2 -
-
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
KIV--
R
-----
Q
-----
Y
R
A
V
---
P
E
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
1
PsiBlast_PDB
69.43
40%
-69
- C2 -
-
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
KIV--
R
-----
Q
-----
Y
R
A
V
---
P
E
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
68.56
53%
-143
- C3 -
-
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
------
11
PsiBlast_PDB
68.55
53%
-144
- C3 -
-
3KDK
-
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
------
36
HHSearch
66.70
29%
-20
- C2 -
-
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
--
H
GV
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
64.30
26%
-21
- C2 -
-
3H4L
1
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
FG
C
--
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
37
HHSearch
63.45
27%
-5
- C2 -
-
3H4L
2
PMS1_YEAST
B:
[8-362]
---------
Q
I
N
D
I
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
S
K
I
A
K
F
Q
D
V
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
PKGKK
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
DLNPFKNRMLLD----
L
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
----
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
62.70
28%
-16
- C2 -
-
1H7S
-
PMS2_HUMAN
A:
[29-359]
---------------------
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
GKRQP
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
A
------------------
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
60
Fugue
62.53
28%
-15
- C2 -
-
1H7S
-
PMS2_HUMAN
A:
[29-365]
---------------------
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
QGKRQ
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
P
S
D
S
V
C
E
E
Y
GLSCSDALHN
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
S
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
56.67
29%
-17
- C2 -
-
1H7U
1
PMS2_HUMAN
A:
[31-359]
------------------------
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
K
------------------------
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
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
-------------
P
------------------
S
D
S
------------------
V
C
E
E
Y
---
G
L
-----
S
--
C
--
S
D
-
A
L
H
N
L
F
Y
I
S
G
F
-
I
S
Q
CTHGV
G
R
SSTDR
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
HQ
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
56.65
29%
-24
- C2 -
-
1EA6
1
PMS2_HUMAN
A:
[27-359]
-------------------
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
GKRQP
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
-------------
P
------------------
S
D
S
------------------
V
C
E
E
Y
---
G
L
-----
S
--
C
--
S
D
-
A
L
H
N
L
F
Y
I
S
G
F
-
I
S
Q
CTHGV
G
R
SSTD
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
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
58
Fugue
55.84
45%
-15
- C2 -
-
1B63
3
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
61
Fugue
47.28
46%
40
* C2 *
-
1B63
3
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
62
Fugue
44.39
32%
-40
- C2 -
-
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
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