@TOME V2.3
(Mar 2018)
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 : spr0160: (2017-12-16 )
MSHIIELPEMLANQIAAGEVIERPASVVKELVENAIDAGSSQIIIEIEEAGLKKVQITDNGHGIAHDEVELALRRHATSKIKNQADLFRIRTLGFRGEALPSIASVSVLTLLTAVDGASHGTKLVARGGEVEEVIPATSPVGTKVCVEDLFFNTPARLKYMKSQQAELSHIIDIVNRLGLAHPEISFSLISDGKEMTRTAGTGQLRQAIAGIYGLVSAKKMIEIENSDLDFEISGFVSLPELTRANRNYISLFINGRYIKNFLLNRAILDGFGSKLMVGRFPLAVIHIHIDPYLADVNVHPTKQEVRISKEKELMTLVSEAIANSLKEQTLIPDALENLAKSTVRNREKVEQTILPLKENTLYYEKTEPSRPSQTEVADYQVELTDEGQDLTLFAKETLDRLTKPAKLHFAERKPANYDQLDHPELDLASIDKAYDKLEREEASSFPELEFFGQMHGTYLFAQGRDGLYIIDQHAAQERVKYEEYRESIGNVDQSQQQLLVPYIFEFPADDALRLKERMPLLEEVGVFLAEYGENQFILREHPIWMAEEEIESGIYEMCDMLLLTKEVSIKKYRAELAIMMSCKRSIKANHRIDDHSARQLLYQLSQCDNPYNCPHGRPVLVHFTKSDMEKMFRRIQENHTSLRELGKY
Atome Classification :
(21 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.......
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
----M
S
H
I
I
E
L
P
E
M
L
A
N
Q
IAA
G
E
-
V
I
---
E
R
P
A
S
V
V
K
E
L
V
E
N
A
I
DAGS
S
Q
I
I
I
E
I
E
EAG
L
K
K
V
Q
I
TDNGHGI
A
H
D
E
V
E
L
A
L
R
R
H
A
T
S
K
IKN
Q
A
D
L
F
---
R
I
R
TLGFRGEALP
S
I
A
S
V
S
V
L
T
L
L
T
AVDGASHG
T
K
L
-
V
-AR-G--G
E
-
V
-
E
-
E
VI-PATS----PVG
T
K
V
C
V
E
D
L
FFN
T
P
A
R
L
K
-
Y
M
-
K
-
S
Q
Q
A
E
L
S
H
I
-
I
D
I
V
N
R
LGLAHPE
I
S
F
S
L
---IS---D
G
-----
K
-----
E
--
M
TRTA---G
T
---
G
Q
L
R
Q
A
I
A
G
I
Y
G
---
L
V
S
A
K
K
M
I
E
I
EN------------------S-----------DL------------------
D
F
E
I--SGFVS
L
P
E
--
L
--
T
RANR
N
Y
I
S
-
L
F
-IN------
G
R
Y
I
K
N
---
F
L
L
N
R
A
I
L
D
GFGSK-
L
M
VG---------RF
P
L
A
V
I
H
I
H
ID
P
Y
L
ADVNVHP
T
K
Q
E
V
R
I
S
K
E
K
E
L
M
T
L
V
S
E
A
I
A
N
-
S
L
K
EQTL
I
P
D
A
L
E
N
L
A
K
S
T
VR
N
R
E
K
V
E
Q
T
ILPLKEN
T
L
Y
Y
EKTEPSRPSQT
E
V
A
D
Y
Q
V
E
L
TDEGQ
D
L
T
L
F
A
K
E
T
L
D
R
LTKP
A
K
L
H
F
AERKPANYDQLDHPE
L
D
L
A
S
I
D
K
A
Y
D
K
L
E
R
E
E
ASSFP
E
L
E
F
F
G
QMH
G
T
Y
L
F
A
QGRD
G
L
Y
I
I
D
Q
H
A
A
Q
E
R
V
K
Y
E
E
Y
R
E
SIGNV
D
Q
S
Q
Q
Q
L
L
V
P
Y
I
FEFPA
D
D
A
L
R
L
K
E
RM
P
L
L
E
E
V
G
V
F
L
A
EYGEN
Q
F
I
L
REHPI
W
M
A
E
E
E
I
E
S
G
I
Y
E
M
C
D
M
L
L
L
TKEV
S
I
K
K
Y
R
A
E
L
A
I
M
M
S
C
K
R
S
IKANHRID
D
H
S
A
R
Q
L
L
Y
Q
L
S
QCDNPYNCPHG
R
P
V
L
V
H
F
T
K
S
D
M
E
K
M
F
R
R
I
Q
E
N
H
T
S
L
R
E
LGKY
21
HHSearch
83.07
42%
-41
- C1 -
-
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
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
82.34
42%
-34
- C1 -
-
1NHJ
1
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
V
PEG
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
81.23
41%
-41
- C1 -
-
1B63
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
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
PEG
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
80.96
41%
-36
- C1 -
-
1B62
1
MUTL_ECOLI
A:
[12-337]
----------
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
EG
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
79.49
41%
-40
- C1 -
-
1NHI
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
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
EG
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
Fugue
77.60
42%
19
* C1 *
-
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
---HT
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
75.86
41%
-27
- C1 -
-
1NHH
6
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
72.55
41%
-88
- C1 -
-
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
V
PEG
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
69.59
41%
-81
- C1 -
-
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
V
PEG
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
68.62
41%
-80
- C1 -
-
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
V
PEG
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
HHSearch
66.95
27%
-39
- C1 -
-
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
66.44
46%
-140
- C2 -
-
3GAB
-
MUTL_BACSU
A:
[437-624]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
---------------
24
HHSearch
65.99
26%
-21
- C1 -
-
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
65.64
41%
-47
- C1 -
-
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
-----
K
-----
I
--
V
R
Q
Y
R
---
A
V
P
EG
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
45
Fugue
63.55
26%
-38
- C1 -
-
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
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
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
63.17
46%
-138
- C2 -
-
3KDK
-
MUTL_BACSU
A:
[7-194]
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
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
---------------
16
PsiBlast_PDB
61.92
24%
-18
- C1 -
-
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
P
K
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
55.05
28%
-42
- C1 -
-
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
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
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
QCTHGV
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
YNRH
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
53.04
28%
-45
- C1 -
-
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
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
YNRH
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
44
Fugue
52.95
47%
-33
- C1 -
-
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
47
Fugue
45.45
48%
44
- C1 -
-
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------