@TOME V2.3
(Nov 2016)
Ref.
-
-
Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : gbs2103: (2015-12-13 )
MTDNSNIRVVVGMSGGVDSSVTALLLKEQGYDVIGVFMKNWDDTDEFGVCTATEDYKDVAAVADQIGIPYYSVNFEKEYWDRVFEYFLAEYRAGRTPNPDVMCNKEIKFKAFLDYAMTLGADYVATGHYAQVTRDENGIVHMLRGADNNKDQTYFLSQLSQEQLQKTLFPLGHLQKPEVRRIAEEAGLATAKKKDSTGICFIGEKNFKDFLGQYLPAQPGRMMTVDGRDMGEHAGLMYYTIGQRGGLGIGGQHGGDNKPWFVVGKDLSKNILYVGQGFYHDSLMSTSLTASEIHFTRDMPNEFKLECTAKFRYRQPDSKVTVYVKGNQARVVFDDLQRAITPGQAVVFYNEQECLGGGMIDQAYRDDKICQYI
Atome Classification :
(20 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.
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
------------------------------------MTDNS
N
I
-----
R
V
V
V
GMSGGV
D
S
S
V
T
A
-
L
L
L
K
EQ-GY
D
-
V
I
G
V
F
M
KNWDD
T
D
EFGVCTAT
E
D
Y
K
D
V
A
A
V
-
A
D
QIGI
P
-
Y
Y
S
V
NF
E
K
E
Y
W
---
D
R
V
F
E
Y
F
L
A
E
--
Y
--RAGRTPNPD
V
M
CNKEI
K
F
K
A
F
L
D
-
Y
A
M
-
T
-LG-A
D
Y
VATG
H
Y
A
Q
V
TRDEN
G
I
V
H
M
L
RGADNNK
D
-
Q
T
Y
F
L
S
Q
L
S
Q
E
Q
L
Q
K
T
L
F
PLGHL-------Q---
K
P
E
V
R
R
I
A
E
E
AGL-ATA---KKKDST
G
I
C
F
IGEK
N
F
K
D
F
L
G
Q
YLP--------------------------AQPG
R
M
M
T
VDGRDMGEHA
G
L
M
-
Y
Y
T
IGQRGGLGIGGQHGGDNK
P
W
F
V
VGKDLSK
N
I
L
Y
V
GQGFYHDSLMSTSLTA
S
E
I
H
F
TRDMPN
E
F
K
L
E
C
T
A
K
F
R
YRQPD
S
K
V
T
V
-
Y
-
V
KG-N
Q
A
R
V
V
F
D
D
L
Q
R
AITPG
Q
A
V
V
F
YN
E
Q
ECLGGG
M
I
D
Q
A
YRDDKICQYI
1
PsiBlast_PDB
91.38
85%
-103
- C1 -
2HMA
2
MNMA_STRPN
A:
[5-376]
-------------------------------------
S
D
N
S
K
T
-----
R
V
V
V
G
M
S
G
G
V
D
S
S
V
T
A
-
L
L
L
K
E
Q
-
G
Y
D
-
V
I
G
I
F
M
K
N
W
D
D
T
D
----
C
T
A
T
E
D
Y
K
D
V
V
A
V
-
A
D
Q
I
G
I
P
-
Y
Y
S
V
N
F
E
K
E
Y
W
---
D
R
V
F
E
Y
F
L
A
E
--
Y
--
R
A
G
R
T
P
N
P
D
V
M
C
N
K
E
I
K
F
K
A
F
L
D
-
Y
A
I
-
T
-
L
G
-
A
D
Y
V
A
T
G
H
Y
A
R
V
A
R
D
E
D
G
T
V
H
M
L
R
G
V
D
N
G
K
D
-
Q
T
Y
F
L
S
Q
L
S
Q
E
Q
L
Q
K
T
M
F
P
L
G
H
L
-------
E
---
K
P
E
V
R
R
L
A
E
E
A
G
L
-
S
T
A
---
K
K
K
D
S
T
G
I
C
F
I
G
E
K
N
F
K
N
F
L
S
N
Y
L
P
--------------------------
A
Q
P
G
R
M
M
T
V
D
G
R
D
M
G
E
H
A
G
L
M
-
Y
Y
T
I
G
Q
R
G
G
L
G
I
G
----
G
D
N
A
P
W
F
V
V
G
K
D
L
S
K
N
I
L
Y
V
G
Q
G
F
Y
H
D
S
L
M
S
T
S
L
E
A
S
Q
V
H
F
T
R
E
M
P
E
E
F
T
L
E
C
T
A
K
F
R
Y
R
Q
P
D
S
K
V
T
V
-
H
-
V
K
G
-
E
K
T
E
V
I
F
A
E
P
Q
R
A
I
T
P
G
Q
A
V
V
F
Y
D
G
E
E
C
L
G
G
G
L
I
D
N
A
Y
R
D
G
Q
V
C
Q
Y
I
31
HHSearch
73.87
57%
-88
* C1 *
2DER
5
MNMA_ECOLI
A:
[17-377]
-----------------------------------------
A
K
-----
K
V
I
V
G
M
S
G
G
V
D
S
S
V
S
A
-
W
L
L
Q
Q
Q
-
G
Y
Q
-
V
E
G
L
F
M
K
N
W
E
E
D
D
G
E
E
Y
C
T
A
A
A
D
L
A
D
A
Q
A
V
-
C
D
K
L
G
I
E
-
L
H
T
V
N
F
A
A
E
Y
W
---
D
N
V
F
E
L
F
L
A
E
--
Y
--
K
A
G
R
T
P
N
P
D
I
L
C
N
K
E
I
K
F
K
A
F
L
E
F
A
A
E
-
D
-
L
G
-
A
D
Y
I
A
T
G
H
Y
V
R
R
A
D
V
D
-
G
K
S
R
L
L
R
G
L
D
S
N
K
D
-
Q
S
Y
F
L
Y
T
L
S
H
E
Q
I
A
Q
S
L
F
P
V
G
E
L
-------
E
---
K
P
Q
V
R
K
I
A
E
D
L
G
L
-
V
-------------------
K
F
R
E
F
L
G
R
Y
L
P
--------------------------
A
Q
P
G
K
I
I
T
V
D
G
D
E
I
G
E
H
Q
G
L
M
-
Y
H
T
L
G
Q
R
K
G
L
G
I
G
G
T
K
E
G
T
E
E
P
W
Y
V
V
D
K
D
V
E
N
N
I
L
V
V
A
Q
G
H
E
H
P
R
L
M
S
V
G
L
I
A
Q
Q
L
H
W
V
D
R
E
P
F
T
G
T
M
R
C
T
V
K
T
R
Y
R
Q
T
D
I
P
C
T
V
-
K
-
A
L
D
D
D
R
I
E
V
I
F
D
E
P
V
A
A
V
T
P
G
Q
S
A
V
F
Y
N
G
E
V
C
L
G
G
G
I
I
E
Q
R
L
P
L
P
V
-----
2
PsiBlast_PDB
73.30
58%
-86
- C1 -
2DER
5
MNMA_ECOLI
A:
[19-374]
------------------------------------------------
K
V
I
V
G
M
S
G
G
V
D
S
S
V
S
A
-
W
L
L
Q
Q
Q
-
G
Y
Q
-
V
E
G
L
F
M
K
N
W
E
E
D
D
G
E
E
Y
C
T
A
A
A
D
L
A
D
A
Q
A
V
-
C
D
K
L
G
I
E
-
L
H
T
V
N
F
A
A
E
Y
W
---
D
N
V
F
E
L
F
L
A
E
--
Y
--
K
A
G
R
T
P
N
P
D
I
L
C
N
K
E
I
K
F
K
A
F
L
E
-
F
A
A
-
E
D
L
G
-
A
D
Y
I
A
T
G
H
Y
V
R
-
R
A
D
V
D
G
K
S
R
L
L
R
G
L
D
S
N
K
D
-
Q
S
Y
F
L
Y
T
L
S
H
E
Q
I
A
Q
S
L
F
P
V
G
E
L
-------
E
---
K
P
Q
V
R
K
I
A
E
D
L
G
L
-
V
-------------------
K
F
R
E
F
L
G
R
Y
L
P
--------------------------
A
Q
P
G
K
I
I
T
V
D
G
D
E
I
G
E
H
Q
G
L
M
-
Y
H
T
L
G
Q
R
K
G
L
G
I
G
G
T
K
E
G
T
E
E
P
W
Y
V
V
D
K
D
V
E
N
N
I
L
V
V
A
Q
G
H
E
H
P
R
L
M
S
V
G
L
I
A
Q
Q
L
H
W
V
D
R
E
P
F
T
G
T
M
R
C
T
V
K
T
R
Y
R
Q
T
D
I
P
C
T
V
K
A
-
L
D
D
-
D
R
I
E
V
I
F
D
E
P
V
A
A
V
T
P
G
Q
S
A
V
F
Y
N
G
E
V
C
L
G
G
G
I
I
E
Q
R
L
P
L
P
V
-----
56
Fugue
72.70
55%
-84
- C1 -
2DER
5
MNMA_ECOLI
A:
[17-380]
-----------------------------------------
A
K
-----
K
V
I
V
G
M
S
G
G
V
D
S
S
V
S
A
-
W
L
L
Q
Q
Q
-
G
Y
Q
-
V
E
G
L
F
M
K
N
W
E
E
D
D
G
E
E
Y
C
T
A
A
A
D
L
A
D
A
Q
A
V
-
C
D
K
L
G
I
E
-
L
H
T
V
N
F
A
A
E
Y
W
---
D
N
V
F
E
L
F
L
A
E
--
Y
--
K
A
G
R
T
P
N
P
D
I
L
C
N
K
E
I
K
F
K
A
F
L
E
-
F
A
A
E
D
-
L
G
-
A
D
Y
I
A
T
G
H
Y
V
R
R
A
D
V
-
D
G
K
S
R
L
L
R
G
L
D
S
N
K
D
-
Q
S
Y
F
L
Y
T
L
S
H
E
Q
I
A
Q
S
L
F
P
V
G
E
L
-------
E
---
K
P
Q
V
R
K
I
A
E
D
--------------------
L
G
L
V
K
F
R
E
F
L
G
R
Y
L
P
--------------------------
A
Q
P
G
K
I
I
T
V
D
G
D
E
I
G
E
H
Q
G
L
M
-
Y
H
T
L
G
Q
R
K
G
L
G
I
G
G
T
K
E
G
T
E
E
P
W
Y
V
V
D
K
D
V
E
N
N
I
L
V
V
A
Q
G
H
E
H
P
R
L
M
S
V
G
L
I
A
Q
Q
L
H
W
V
D
R
E
P
F
T
G
T
M
R
C
T
V
K
T
R
Y
R
Q
T
D
I
P
C
T
V
-
K
A
L
D
D
-
D
R
I
E
V
I
F
D
E
P
V
A
A
V
T
P
G
Q
S
A
V
F
Y
N
G
E
V
C
L
G
G
G
I
I
E
Q
R
L
P
L
P
V
-----
22
PsiBlast_CBE
72.08
58%
-93
- C1 -
2DER
4
MNMA_ECOLI
B:
[19-374]
------------------------------------------------
K
V
I
V
G
M
S
G
G
V
D
S
S
V
S
A
-
W
L
L
Q
Q
Q
-
G
Y
Q
-
V
E
G
L
F
M
K
N
W
E
E
D
D
G
E
E
Y
C
T
A
A
A
D
L
A
D
A
Q
A
V
-
C
D
K
L
G
I
E
-
L
H
T
V
N
F
A
A
E
Y
W
---
D
N
V
F
E
L
F
L
A
E
--
Y
--
K
A
G
R
T
P
N
P
D
I
L
C
N
K
E
I
K
F
K
A
F
L
E
-
F
A
A
-
E
D
L
G
-
A
D
Y
I
A
T
G
H
Y
V
R
-
R
A
D
V
D
G
K
S
R
L
L
R
G
L
D
S
N
K
D
-
Q
S
Y
F
L
Y
T
L
S
H
E
Q
I
A
Q
S
L
F
P
V
G
E
L
-------
E
---
K
P
Q
V
R
K
I
A
E
D
L
G
L
-
V
T
---------
T
G
I
C
F
I
G
E
R
K
F
R
E
F
L
G
R
Y
L
P
--------------------------
A
Q
P
G
K
I
I
T
V
D
G
D
E
I
G
E
H
Q
G
L
M
-
Y
H
T
L
G
Q
R
K
G
L
G
I
G
G
T
K
E
G
T
E
E
P
W
Y
V
V
D
K
D
V
E
N
N
I
L
V
V
A
Q
G
H
E
H
P
R
L
M
S
V
G
L
I
A
Q
Q
L
H
W
V
D
R
E
P
F
T
G
T
M
R
C
T
V
K
T
R
Y
R
Q
T
D
I
P
C
T
V
K
A
-
L
D
D
-
D
R
I
E
V
I
F
D
E
P
V
A
A
V
T
P
G
Q
S
A
V
F
Y
N
G
E
V
C
L
G
G
G
I
I
E
Q
R
L
P
L
P
V
-----
21
PsiBlast_CBE
71.23
58%
-90
- C1 -
2DEU
2
MNMA_ECOLI
B:
[19-374]
------------------------------------------------
K
V
I
V
G
M
S
G
G
V
D
S
S
V
S
A
-
W
L
L
Q
Q
Q
-
G
Y
Q
-
V
E
G
L
F
M
K
N
W
E
E
D
D
G
E
E
Y
C
T
A
A
A
D
L
A
D
A
Q
A
V
-
C
D
K
L
G
I
E
-
L
H
T
V
N
F
A
A
E
Y
W
---
D
N
V
F
E
L
F
L
A
E
--
Y
--
K
A
G
R
T
P
N
P
D
I
L
C
N
K
E
I
K
F
K
A
F
L
E
-
F
A
A
-
E
D
L
G
-
A
D
Y
I
A
T
G
H
Y
V
R
-
R
A
D
V
D
G
K
S
R
L
L
R
G
L
D
S
N
K
D
-
Q
S
Y
F
L
Y
T
L
S
H
E
Q
I
A
Q
S
L
F
P
V
G
E
L
-------
E
---
K
P
Q
V
R
K
I
A
E
D
L
G
L
-
V
T
A
---
K
K
K
D
S
T
G
I
C
F
I
G
E
R
K
F
R
E
F
L
G
R
Y
L
P
--------------------------
A
Q
P
G
K
I
I
T
V
D
G
D
E
I
G
E
H
Q
G
L
M
-
Y
H
T
L
G
Q
R
K
G
L
G
I
G
G
T
K
E
G
T
E
E
P
W
Y
V
V
D
K
D
V
E
N
N
I
L
V
V
A
Q
G
H
E
H
P
R
L
M
S
V
G
L
I
A
Q
Q
L
H
W
V
D
R
E
P
F
T
G
T
M
R
C
T
V
K
T
R
Y
R
Q
T
D
I
P
C
T
V
K
A
-
L
D
D
-
D
R
I
E
V
I
F
D
E
P
V
A
A
V
T
P
G
Q
S
A
V
F
Y
N
G
E
V
C
L
G
G
G
I
I
E
Q
R
L
P
L
P
V
-----
3
PsiBlast_PDB
70.73
58%
-93
- C1 -
2DET
1
MNMA_ECOLI
A:
[19-374]
------------------------------------------------
K
V
I
V
G
M
S
G
G
V
D
S
S
V
S
A
-
W
L
L
Q
Q
Q
-
G
Y
Q
-
V
E
G
L
F
M
K
N
W
E
E
D
D
G
E
E
Y
C
T
A
A
A
D
L
A
D
A
Q
A
V
-
C
D
K
L
G
I
E
-
L
H
T
V
N
F
A
A
E
Y
W
---
D
N
V
F
E
L
F
L
A
E
--
Y
--
K
A
G
R
T
P
N
P
D
I
L
C
N
K
E
I
K
F
K
A
F
L
E
-
F
A
A
-
E
D
L
G
-
A
D
Y
I
A
T
G
H
Y
V
R
-
R
A
D
V
D
G
K
S
R
L
L
R
G
L
D
S
N
K
D
-
Q
S
Y
F
L
Y
T
L
S
H
E
Q
I
A
Q
S
L
F
P
V
G
E
L
-------
E
---
K
P
Q
V
R
K
I
A
E
D
L
G
L
-
V
T
A
---
K
K
K
D
S
T
G
I
C
F
I
G
E
R
K
F
R
E
F
L
G
R
Y
L
P
--------------------------
A
Q
P
G
K
I
I
T
V
D
G
D
E
I
G
E
H
Q
G
L
M
-
Y
H
T
L
G
Q
R
K
G
L
G
I
G
G
T
K
E
G
T
E
E
P
W
Y
V
V
D
K
D
V
E
N
N
I
L
V
V
A
Q
G
H
E
H
P
R
L
M
S
V
G
L
I
A
Q
Q
L
H
W
V
D
R
E
P
F
T
G
T
M
R
C
T
V
K
T
R
Y
R
Q
T
D
I
P
C
T
V
K
A
-
L
D
D
-
D
R
I
E
V
I
F
D
E
P
V
A
A
V
T
P
G
Q
S
A
V
F
Y
N
G
E
V
C
L
G
G
G
I
I
E
Q
R
L
P
L
P
V
-----
4
PsiBlast_PDB
70.59
58%
-90
- C1 -
2DEU
2
MNMA_ECOLI
A:
[19-374]
------------------------------------------------
K
V
I
V
G
M
S
G
G
V
D
S
S
V
S
A
-
W
L
L
Q
Q
Q
-
G
Y
Q
-
V
E
G
L
F
M
K
N
W
E
E
D
D
G
E
E
Y
C
T
A
A
A
D
L
A
D
A
Q
A
V
-
C
D
K
L
G
I
E
-
L
H
T
V
N
F
A
A
E
Y
W
---
D
N
V
F
E
L
F
L
A
E
--
Y
--
K
A
G
R
T
P
N
P
D
I
L
C
N
K
E
I
K
F
K
A
F
L
E
-
F
A
A
-
E
D
L
G
-
A
D
Y
I
A
T
G
H
Y
V
R
-
R
A
D
V
D
G
K
S
R
L
L
R
G
L
D
S
N
K
D
-
Q
S
Y
F
L
Y
T
L
S
H
E
Q
I
A
Q
S
L
F
P
V
G
E
L
-------
E
---
K
P
Q
V
R
K
I
A
E
D
L
G
L
-
V
T
A
---
K
K
K
D
S
T
G
I
C
F
I
G
E
R
K
F
R
E
F
L
G
R
Y
L
P
--------------------------
A
Q
P
G
K
I
I
T
V
D
G
D
E
I
G
E
H
Q
G
L
M
-
Y
H
T
L
G
Q
R
K
G
L
G
I
G
G
T
K
E
G
T
E
E
P
W
Y
V
V
D
K
D
V
E
N
N
I
L
V
V
A
Q
G
H
E
H
P
R
L
M
S
V
G
L
I
A
Q
Q
L
H
W
V
D
R
E
P
F
T
G
T
M
R
C
T
V
K
T
R
Y
R
Q
T
D
I
P
C
T
V
K
A
-
L
D
D
-
D
R
I
E
V
I
F
D
E
P
V
A
A
V
T
P
G
Q
S
A
V
F
Y
N
G
E
V
C
L
G
G
G
I
I
E
Q
R
L
P
L
P
V
-----
48
HHSearch
42.45
25%
-91
- C1 -
2YWB
-
GUAA_THET8
A:
[208-374]
----------------------------------------
G
K
D
-----
R
V
L
L
A
V
S
G
G
V
D
S
S
T
L
A
-
L
L
L
A
K
A
-
G
V
D
-
H
L
A
V
F
V
D
H
G
L
L
--------
R
L
G
E
R
E
E
V
E
G
A
-
L
R
A
L
G
V
N
-
L
L
V
V
D
A
K
E
R
F
L
---
K
A
L
K
G
-------
V
----
E
D
P
E
E
K
R
K
I
I
G
R
E
-
F
V
A
A
F
S
Q
-
V
A
R
-
E
-
R
G
P
F
R
F
L
A
Q
G
T
L
Y
P
D
V
I
E
-----------------------
G
L
P
E
D
L
E
F
E
L
L
E
P
F
R
L
L
-------
F
---
K
D
E
V
R
E
L
A
L
L
L
G
L
-
P
D
T
---
L
R
L
R
H
P
F
P
G
P
G
L
A
V
R
V
L
G
E
V
T
E
E
R
L
--------------------------
E
I
L
R
R
A
D
D
I
F
T
S
L
L
R
E
W
G
L
Y
E
-
K
V
A
Q
A
L
A
V
L
T
P
V
G
Y
V
L
A
L
R
A
V
T
T
E
D
F
M
T
A
D
W
A
R
L
P
L
E
F
L
D
E
A
A
R
R
I
T
R
R
V
P
E
I
G
R
V
V
Y
D
L
T
S
K
P
P
A
T
I
E
W
E
--------------------------------------------------------------------
40
HHSearch
41.86
20%
-95
- C1 -
2NZ2
3
ASSY_HUMAN
A:
[5-198]
-----------------------------------------
K
G
-----
S
V
V
L
A
Y
S
G
G
L
D
T
S
C
I
L
-
V
W
L
K
E
Q
-
G
Y
D
-
V
I
A
Y
L
A
N
I
G
Q
----------
K
E
D
F
E
E
A
R
K
K
-
A
L
K
L
G
A
K
K
V
F
I
E
D
V
S
R
E
F
V
---
E
E
F
I
W
P
A
I
Q
S
--
S
AL
Y
E
D
R
Y
L
L
G
T
S
L
A
R
P
-
C
I
A
R
K
Q
V
E
-
I
A
Q
-
R
-
E
G
-
A
K
Y
V
S
H
G
A
T
G
K
G
N
D
Q
V
--
R
F
E
L
--
S
-----------
C
Y
S
L
A
--
P
Q
I
K
V
I
A
P
W
R
M
P
EFYNRFK----
R
N
D
L
M
E
Y
A
K
Q
H
G
I
-
P
I
P
VTP
K
N
P
W
S
M
D
E
N
L
M
H
I
S
Y
E
A
G
I
L
E
N
P
K
N
--------------------------
Q
A
P
P
G
L
Y
T
K
T
Q
D
P
A
K
A
P
N
T
P
D
-
I
L
E
I
E
F
K
K
G
V
P
V
K
V
T
N
V
K
D
G
T
T
H
Q
T
S
L
E
L
F
M
Y
L
N
E
V
A
G
K
H
G
V
G
R
I
D
I
V
E
N
R
F
I
G
M
K
S
R
G
I
Y
E
T
P
A
G
T
I
L
Y
H
A
H
L
D
I
E
A
F
T
M
D
R
E
V
-
R
-
K
I
K
-
Q
G
L
G
L
K
F
A
E
L
V
Y
T
G
F
W
H
S
P
E
C
E
F
V
R
H
C
I
A
K
S
Q
E
R
V
E
G
K
V
Q
V
S
V
L
K
G
Q
9
PsiBlast_PDB
40.46
32%
-112
- C1 -
2E18
1
NADE_PYRHO
A:
[17-84]
------------------------------------
I
R
E
K
G
N
N
-----
G
V
V
I
G
I
S
G
G
V
D
S
A
T
V
A
Y
L
A
T
K
A
L
-
G
K
E
K
V
L
G
L
I
M
P
Y
F
E
N
----------
K
D
V
E
D
A
K
L
V
-
A
E
K
L
G
I
G
-
Y
K
V
I
N
I
K
P
I
V
D
---
S
F
V
E
N
L
E
L
N
L
--
D
--
R
K
G
L
G
N
I
M
S
R
T
R
M
I
M
L
Y
A
H
A
N
S
L
-
G
R
I
-
V
-
L
G
-
T
S
N
R
S
E
F
L
T
G
Y
F
T
K
W
G
D
G
A
S
D
Y
A
P
I
I
N
L
Y
K
T
-
E
V
W
E
I
A
K
R
I
G
V
P
E
R
I
V
K
K
K
P
S
A
G
-------
L
---
W
E
G
Q
T
D
E
D
E
L
G
I
S
-
Y
N
L
---
L
D
E
I
L
W
R
M
I
D
L
K
I
G
K
E
E
I
A
K
D
L
G
I
P
--------------------------
L
S
L
V
E
R
V
E
E
L
I
K
K
S
E
H
K
R
R
L
P
-
I
G
P
S
F
E
D
L
I
V
G
--------------------------------------------------------------------------------------------------------------------------------
36
HHSearch
40.10
22%
-60
- C1 -
3VRH
1
?
A:
[45-249]
---------------------------------------
T
K
D
E
-----
R
I
L
V
A
V
S
G
G
K
D
S
A
V
T
A
-
Y
V
L
K
K
L
-
G
Y
N
-
I
E
C
L
H
I
N
L
G
I
S
G
------
Y
S
E
K
S
E
E
Y
A
K
K
Q
-
C
K
L
I
G
A
P
-
L
H
I
V
R
I
K
E
I
L
G
---
Y
G
-----
I
G
E
--
V
--
K
--
T
R
R
P
P
C
S
Y
C
G
L
T
-
K
R
Y
I
M
N
K
-
F
A
Y
-
D
-
N
G
-
F
D
A
I
A
T
G
H
N
L
D
D
E
A
S
F
-
L
L
N
N
I
L
H
W
N
T
E
Y
L
A
K
G
G
P
I
L
P
--
Q
Q
G
K
F
I
K
K
V
K
P
L
Y
E
V
-------
T
---
E
R
E
V
V
A
Y
A
L
A
V
G
L
-
E
Y
I
---
V
E
E
C
P
Y
----
T
-
T
L
D
M
K
G
V
L
N
E
L
E
E
--------------------------
K
R
P
G
T
K
F
N
F
V
R
G
Y
L
K
K
K
K
L
F
E
-
P
K
E
C
K
I
C
R
M
P
S
S
G
D
I
C
A
F
C
K
F
W
G
L
K
K
E
I
N
F
K
V
S
S
T
D
E
E
P
F
G
--------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
39.74
46%
-139
- C1 -
2NZ2
-
ASSY_HUMAN
A:
[8-45]
-------------------------------------------------
V
V
L
A
Y
S
G
G
L
D
T
S
C
I
L
-
V
W
L
K
E
Q
-
G
Y
D
-
V
I
A
-
Y
L
A
N
I
G
Q
K
E
D
F
E
E
A
R
K
K
A
L
K
L
G
A
K
K
V
-
F
I
E
D
V
S
R
-
E
F
V
E
E
F
I
W
P
A
I
---
Q
S
S
A
L
Y
E
D
R
Y
--
L
--
L
G
T
S
L
A
R
P
C
I
A
R
K
Q
V
E
I
A
Q
R
E
G
A
-
K
Y
V
-
S
-
H
G
-
A
T
G
K
G
N
D
Q
V
R
F
E
L
S
C
Y
S
L
A
P
Q
I
K
V
I
A
P
W
R
M
P
-
E
F
Y
N
R
F
K
R
N
D
L
M
E
Y
A
K
Q
H
G
I
P
I
P
-------
V
---
T
P
K
N
P
W
S
M
D
E
N
L
M
-
H
I
S
---
Y
E
A
G
I
L
E
N
P
K
N
Q
A
P
P
G
L
Y
T
K
T
Q
D
P
A
--------------------------
K
A
P
N
T
P
D
I
L
E
I
E
F
K
K
G
V
P
V
K
V
-
T
N
V
K
D
G
T
T
H
Q
T
S
L
E
L
F
M
Y
L
N
E
V
A
G
K
H
G
V
G
R
I
D
I
V
E
N
R
F
I
G
M
K
S
R
G
I
Y
E
T
P
A
G
T
I
L
Y
H
A
H
L
D
I
E
A
F
T
M
D
R
E
V
R
K
I
K
Q
G
L
G
L
K
F
A
E
L
-
V
-
Y
T
G
-
F
W
H
S
P
E
C
E
F
V
R
H
C
I
A
K
S
Q
E
R
V
E
G
K
V
Q
V
S
V
L
K
G
Q
V
Y
I
L
G
R
E
S
P
L
S
L
Y
N
33
HHSearch
38.48
20%
-81
- C1 -
1KOR
3
ASSY_THET8
A:
[1-276]
------------------------------------------
M
-----
K
I
V
L
A
Y
S
G
G
L
D
T
S
I
I
L
-
K
W
L
K
E
T
Y
R
A
E
-
V
I
A
F
T
A
D
I
G
Q
G
----------
E
E
V
E
E
A
R
E
K
-
A
L
R
T
G
A
S
K
A
I
A
L
D
L
K
E
E
F
V
---
R
D
F
V
F
P
M
M
R
A
GA
V
--
Y
E
G
Y
Y
L
L
G
T
S
I
A
-
R
P
L
I
A
K
H
L
V
R
-
I
A
E
-
E
-
E
G
-
A
E
A
I
A
H
G
A
T
G
K
G
N
D
Q
V
--
R
F
E
L
--
T
A
-----------
Y
A
L
--
K
P
D
I
K
V
I
A
P
W
R
E
W
-------
S
FQG
R
K
E
M
I
A
Y
A
E
A
H
G
I
-
P
V
P
-----
P
Y
S
M
D
A
N
L
L
H
I
S
Y
E
G
G
V
L
E
D
P
W
A
EPPKGMFRMTQDPEEAPD
A
P
E
Y
V
E
V
E
F
F
E
G
D
P
V
A
V
N
G
E
R
L
S
P
A
A
L
L
Q
R
L
N
E
I
G
G
R
H
G
V
G
R
V
D
I
----
V
E
N
R
F
V
---
G
M
K
S
R
G
V
Y
E
T
P
G
G
T
I
L
Y
H
A
R
R
A
V
E
S
L
T
L
D
R
E
V
L
H
Q
R
D
M
L
S
P
K
Y
A
E
L
V
Y
Y
G
F
W
Y
A
P
E
R
-
E
-
A
L
Q
-
A
Y
F
D
H
V
A
R
S
V
T
G
V
A
R
L
K
L
Y
K
G
N
V
Y
V
V
G
R
K
A
P
K
S
L
Y
R
G
Y
D
Q
K
D
A
E
G
F
I
13
PsiBlast_PDB
38.20
42%
-126
- C1 -
1VL2
-
ASSY_THEMA
A:
[4-42]
------------------------------------------------
K
V
V
L
A
Y
S
G
G
L
D
T
S
V
I
L
-
K
W
L
C
E
K
-
G
F
D
-
V
I
A
-
Y
V
A
N
V
G
Q
K
D
D
F
V
A
I
K
E
K
A
L
K
T
G
A
S
K
V
-
Y
V
E
D
L
R
R
-
E
F
V
T
D
Y
I
F
T
A
L
---
L
G
N
A
M
Y
E
G
R
Y
--
L
--
L
G
T
A
I
A
R
P
L
I
A
K
R
Q
V
E
I
A
E
K
E
G
A
-
Q
Y
V
-
A
-
H
G
-
A
T
G
K
G
N
D
Q
V
R
F
E
L
T
Y
A
A
L
N
P
N
L
K
V
I
S
P
W
K
D
P
-
E
F
L
A
K
F
K
T
D
L
I
N
Y
A
M
E
K
G
I
P
I
K
V
-------
S
---
K
K
R
P
Y
S
E
D
E
N
L
M
H
-
I
S
H
---
E
A
G
K
L
E
D
P
A
H
I
P
D
E
D
V
F
T
W
T
V
S
P
K
D
--------------------------
A
P
D
E
E
T
L
L
E
I
H
F
E
N
G
I
P
V
K
V
V
-
N
L
K
D
G
T
E
K
T
D
P
L
E
L
F
E
Y
L
N
E
V
G
A
K
N
G
V
G
R
L
D
M
V
E
N
R
F
I
G
I
K
S
R
G
V
Y
E
T
P
G
A
T
I
L
W
I
A
H
R
D
L
E
G
I
T
M
D
K
E
V
M
H
L
R
D
M
L
A
P
K
F
A
E
L
I
-
Y
-
N
G
F
-
W
F
S
P
E
M
E
F
L
L
A
A
F
R
K
A
Q
E
N
V
T
G
K
V
T
V
S
I
Y
K
G
N
V
M
P
V
A
R
Y
S
P
Y
S
L
Y
N
P
26
PsiBlast_CBE
38.16
32%
-109
- C1 -
2E18
3
NADE_PYRHO
B:
[17-84]
------------------------------------
I
R
E
K
G
N
N
-----
G
V
V
I
G
I
S
G
G
V
D
S
A
T
V
A
Y
L
A
T
K
A
L
-
G
K
E
K
V
L
G
L
I
M
P
Y
F
E
N
----------
K
D
V
E
D
A
K
L
V
-
A
E
K
L
G
I
G
-
Y
K
V
I
N
I
K
P
I
V
D
---
S
F
V
E
N
L
E
L
N
L
--
D
--
R
K
G
L
G
N
I
M
S
R
T
R
M
I
M
L
Y
A
H
A
N
S
L
-
G
R
I
-
V
-
L
G
-
T
S
N
R
S
E
F
L
T
G
Y
F
T
K
W
G
D
G
A
S
D
Y
A
P
I
I
N
L
Y
K
T
-
E
V
W
E
I
A
K
R
I
G
V
P
E
R
I
V
K
K
K
P
S
A
G
-------
L
---
W
E
G
Q
T
D
E
D
E
L
G
I
S
-
Y
N
L
---
L
D
E
I
L
W
R
M
I
D
L
K
I
G
K
E
E
I
A
K
D
L
G
I
P
--------------------------
L
S
L
V
E
R
V
E
E
L
I
K
K
S
E
H
K
R
R
L
P
-
I
G
P
S
F
E
D
L
I
V
G
--------------------------------------------------------------------------------------------------------------------------------
42
HHSearch
37.46
19%
-69
- C1 -
3K32
-
Y690_METJA
A:
[6-160]
-----------------------------------------
L
M
-----
D
V
H
V
L
F
S
G
G
K
D
S
S
L
S
A
-
V
I
L
K
K
L
-
G
Y
N
-
P
H
L
I
T
I
N
F
G
V
----------
I
P
S
Y
K
L
A
E
E
T
-
A
K
I
L
G
F
K
-
H
K
V
I
T
L
D
R
K
I
V
---
E
K
A
A
D
----
M
--
I
--
I
E
H
K
Y
P
G
P
A
I
Q
Y
V
H
--
K
-
T
V
L
E
I
-
L
A
--
D
--
E
-
Y
S
I
L
A
D
G
T
R
R
D
D
R
V
P
K
-
L
S
Y
S
E
I
--------------
Q
S
L
E
M
R
K
N
I
Q
Y
I
T
P
L
M
G
F
-------
G
---
Y
K
T
L
R
H
L
A
S
E
F
F
I
L
E
E
I
---
K
S
D
Y
E
A
E
I
R
H
I
L
K
E
R
G
E
S
P
E
K
Y
F
P
E
--------------------------
K
Q
T
R
V
V
G
L
K
K
E
I
-----------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
36.64
27%
-105
- C1 -
3VRH
1
?
A:
[49-155]
------------------------------------------------
R
I
L
V
A
V
S
G
G
K
D
S
A
V
T
A
-
Y
V
L
K
K
L
-
G
Y
N
-
I
E
C
L
H
I
-------
N
L
G
I
S
G
Y
S
E
K
S
E
E
Y
A
K
K
Q
C
K
L
I
G
A
P
-
L
H
I
V
R
I
K
E
--------
I
L
G
Y
G
I
G
E
--
V
--
K
T
R
R
P
P
C
S
Y
C
G
L
T
K
R
Y
I
M
N
K
F
----
A
Y
-
D
-
N
G
-
F
D
A
I
A
T
G
H
N
L
D
D
E
A
S
F
L
L
N
N
I
L
H
W
N
T
E
Y
L
A
K
-
G
G
P
I
L
P
Q
Q
G
K
F
I
K
K
V
K
P
L
Y
E
V
T
E
-------
R
---
E
V
V
A
Y
A
L
A
V
G
L
E
Y
-
I
V
E
---
E
C
P
Y
T
T
L
D
M
K
G
V
L
N
E
L
E
E
K
R
P
G
T
K
F
--------------------------
N
F
V
R
G
Y
L
K
K
K
K
L
F
E
P
K
E
C
K
I
C
-
R
M
P
S
S
G
D
I
C
A
F
C
K
F
W
G
L
K
K
E
I
N
F
K
V
S
S
T
D
E
E
P
F
G
---------------------------------------------------------------------------------------------------------
39
HHSearch
36.09
18%
-69
- C1 -
3BL5
2
QUEC_BACSU
A:
[3-178]
-----------------------------------------
K
E
-----
K
A
I
V
V
F
S
G
G
Q
D
S
T
T
C
L
-
L
W
A
L
K
E
-
F
E
E
-
V
E
T
V
T
F
H
Y
N
Q
R
--------
H
S
Q
E
V
E
V
A
K
S
I
-
A
E
K
L
G
V
K
-
N
H
L
L
D
M
S
L
L
N
Q
LAP
N
A
L
T
-----------------
S
T
F
V
P
G
R
N
L
V
F
L
S
F
A
S
I
-
L
A
Y
-
Q
-
I
G
-
A
R
H
I
I
T
G
V
C
E
----
G
Y
----
P
D
--
C
R
D
E
F
V
K
-
S
C
N
V
T
V
N
L
A
M
E
K
P
F
V
I
H
T
P
L
M
W
L
-------
N
---
K
A
E
T
W
K
L
A
D
E
L
G
A
-
L
D
F
---
V
K
N
N
T
L
T
C
Y
N
G
I
I
A
D
G
C
G
E
C
P
A
C
H
L
--------------------------
R
S
K
G
Y
E
E
Y
M
V
M
K
-----------------------------------------------------------------------------------------------------------------------------------------------------
63
Fugue
34.12
20%
-48
- C1 -
3VRH
3
?
A:
[1-309]
MKCKFCSREAYIKIHYP
K
M
Y
L
C
E
E
H
F
K
E
Y
F
E
R
K
V
S
R
T
I
E
R
Y
K
L
LTKDE
R
I
L
V
A
V
S
G
G
K
D
S
A
V
T
A
-
Y
V
L
K
K
L
-
G
Y
N
-
I
E
C
L
H
I
N
L
G
I
S
G
Y
------
S
E
K
S
E
E
Y
A
K
K
Q
-
C
K
L
I
G
A
P
-
L
H
I
V
R
I
K
E
I
L
G
---
Y
G
I
G
E
V
------------
K
T
R
R
P
P
C
S
Y
C
G
L
T
K
R
Y
I
M
N
K
-
F
A
Y
-
D
-
N
G
-
F
D
A
I
A
T
G
H
N
L
D
D
E
A
S
F
L
L
N
N
I
L
H
W
N
T
E
Y
L
A
K
-
G
G
P
I
L
P
--
Q
Q
G
K
F
I
K
K
V
K
P
L
Y
E
V
-------
T
---
E
R
E
V
V
A
Y
A
L
A
V
G
L
-
E
Y
I
---
V
E
E
-----
C
P
Y
T
T
L
D
M
K
G
V
L
N
E
L
E
E
--------------------------
K
R
P
G
-----------------------------------------------------------------------
T
K
F
N
F
V
R
G
Y
L
K
K
K
K
L
F
E
P
K
E
C
K
I
C
R
M
P
S
-----------
S
G
D
I
C
A
F
C
K
F
W
G
L
K
K
E
I
N
F
K
V
S
S
T
D
E
E
P
F
G
-----------------