@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 : B0VTE6: (2017-12-13 )
MSSASQLNNKQEEAMKYTQGPLLVLAGAGSGKTSVITRKIAYLVQHCRIPAHRITAMTFTNKAAREMKERVTKLLSREEAKGLSVSTFHTFGLNLLRLELKNLPLKANFSILDADDCKRILMDLMHRNNLSGAESKELIAKAMKKISDWKNDLILPEQAHSTCETPEDVQFAHLYQLYERNLRAYNAVDFDDLIVMPTRLLQENAEVRDKWQNRVRYLLVDEYQDTNTAQYILVKLLVGVMGQFTAVGDDDQSIYAWRGAKPENMALLKQDFPNLHIIKLEQNYRSTSRILKAANCVIQNNPHIFDKKLWSDKGHGEVIRIITCRNDDDEAERVVKDLLTHKLMNGKNWKDYAVLYRGNFQARVLETQLRQMQIPYKLSGGTSFFARAEIKDVMSYLRLIINPEDDSAFLRIINMPKRAIGPVTLEKLGLFAQENNLSLLGASSDQRLSMVLPKKAETQLHEFADFISTFTRELLEDDEPVPKVRQMMNEAGYIDYIREQSATPAQEKSKLDNIENLFSSIQNLINRAEDVDEKNIESVIRKLVLLDMLEQQQEEEDTDKVNLLTLHAAKGLEFPYVYIMGLEEELLPHKNSIAAETIEEERRLMYVGITRARQGLTLTLAEQRKNGGQMKQMTPSRFLDELPQDELEWLGRKKKIAANVDPKEQAQQYLANLKALLKR
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.......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.......
(Atome)
(Ident)
(Tito)
(Num)
(QMean)
(Ligand)
(Uniprot)
MS
S
A
S
Q
LN
N
K
Q
E
E
A
M
KYTQG
P
L
L
V
L
A
GAGSG
K
T
S
V
I
T
R
K
I
A
Y
L
V
Q
H
CRIPA
H
R
I
T
A
M
T
F
T
N
K
A
A
R
E
M
K
E
R
V
T
K
L
L
S
R
E
EAKG
L
S
V
S
T
F
H
T
FG
L
N
L
L
R
L
E
L
KNLPLKAN
F
S
I
L
D
A
D
D
C
K
R
I
L
M
D
L
M
HRNNLSG--
A
E
S
K
E
L
I
A
K
A
-
M
K
K
I
S
DWKNDLILPEQAHSTCET-----P
E
D
V
Q
F
A
H
L
Y
Q
L
Y
E
RNLRAYNAVD
F
D
D
L
I
V
M
P
T
R
L
L
QEN
A
E
V
R
D
K
W
Q
NR
V
R
Y
L
L
V
DEYQDT
N
T
A
Q
Y
I
L
V
K
L
L
V
G
V
M
G
QFTAVGDDDQ
S
I
Y
A
WRGAKP
E
N
M
A
L
L
K
QDFPN
L
H
I
I
K
L
E
Q
N
Y
R
S
T
S
R
I
L
K
A
A
N
C
V
IQNNP
H
I
F
D
K
K
LWSDKGH
G
E
V
I
R
I
I
T
CRND
D
D
E
A
E
R
-
V
V
K
D
L
L
T
H
K
LMNGKNW
K
D
Y
A
V
L
Y
RGNF
Q
A
R
V
L
E
T
Q
L
R
QMQI
P
Y
K
LSGGT
S
F
F
A
R
A
E
I
K
D
V
M
S
Y
L
R
L
IINPED
D
S
A
F
L
R
I
INM
P
K
RAIG---
P
V
T
L
E
K
L
G
L
FAQEN
N
L
S
L
LGASSD
Q
R
L
S
M
V-LPK
K
A
E
T
Q
L
H
E
F
A
D
F
I
S
T
F
T
R
E
L
LEDDEP
V
P
-
K
V
R
Q
M
M
N
EAG
Y
I
D
Y
I
REQ-SATP
A
Q
E
K
S
KL
D
N
I
E
N
L
F
S
S
I
Q
N
L
I
N
R
A
EDV
D
E
K
N
I
E
S
V
I
R
K
L
V
----
L
---
L
D
M
L
E
----
Q
-
Q
Q
EEEDT-----D
K
V
N
L
L
T
L
HAAKGLEF
P
Y
V
Y
I
MG
L
E
E
E
LLPHKNS
I
-
A
--
A
E
T
I
E
E
ER
R
L
M
Y
V
G
ITRARQ
G
L
T
L
T
L
A
E
QRKNGGQMKQM
T
P
S
R
F
L
D
ELP
Q
D
E
L
E
W
LGRKKKIAANV
D
P
K
E
Q
A
Q
Q
Y
L
A
N
L
K
A
L
LKR
33
HHSearch
86.46
51%
-59
- C3 -
-
1UAA
1
REP_ECOLI
A:
[2-640]
-----
R
L
N
P
G
Q
Q
Q
A
V
E
F
V
T
G
P
C
L
V
L
A
G
A
G
S
G
K
T
R
V
I
T
N
K
I
A
H
L
I
R
G
C
G
Y
Q
A
R
H
I
A
A
V
T
F
T
N
K
A
A
R
E
M
K
E
R
V
G
Q
T
L
G
R
K
E
A
R
G
L
M
I
S
T
F
H
T
L
G
L
D
I
I
K
R
E
Y
A
A
L
G
M
K
A
N
F
S
L
F
D
D
T
D
Q
L
A
L
L
K
E
L
T
E
G
L
I
E
D
D
--
K
V
--
L
-
L
Q
Q
L
-
I
S
T
I
S
N
W
K
N
D
L
K
T
P
S
Q
A
A
A
S
A
I
G
-----
E
R
D
R
I
F
A
H
C
Y
G
L
Y
D
A
H
L
K
A
C
N
V
L
D
F
D
D
L
I
L
L
P
T
L
L
L
Q
A
N
E
E
V
R
K
R
W
Q
N
K
I
R
Y
L
L
V
D
E
Y
Q
D
T
N
T
S
Q
Y
E
L
V
K
L
L
V
G
S
R
A
R
F
T
V
V
G
D
D
D
Q
S
I
Y
S
W
R
G
A
R
P
Q
N
L
V
L
L
S
Q
D
F
P
A
L
K
V
I
K
L
E
Q
N
Y
R
S
S
G
R
I
L
K
A
A
N
I
L
I
A
N
N
P
H
V
F
E
K
R
L
F
S
E
L
G
Y
G
A
E
L
K
V
L
S
A
N
N
E
E
H
E
A
E
R
-
V
T
G
E
L
I
A
H
H
F
V
N
K
T
Q
Y
K
D
Y
A
I
L
Y
R
G
N
H
Q
S
R
V
F
E
K
F
L
M
Q
N
R
I
P
Y
K
I
S
G
G
T
S
F
F
S
R
P
E
I
K
D
L
L
A
Y
L
R
V
L
T
N
P
D
D
D
S
A
F
L
R
I
V
N
T
P
K
R
E
I
G
---
P
A
T
L
K
K
L
G
E
W
A
M
T
R
N
K
S
M
F
T
A
S
F
D
M
G
L
S
Q
T
-
L
S
G
R
G
Y
E
A
L
T
R
F
T
H
W
L
A
E
I
Q
R
L
--
A
E
R
E
P
I
A
-
A
V
R
D
L
I
H
G
M
D
Y
E
S
W
L
Y
E
T
S
P
S
P
K
A
-
A
E
M
R
M
K
N
V
N
Q
L
F
S
W
M
T
E
M
L
E
G
S
E
L
D
E
P
M
T
L
T
Q
V
V
T
R
F
T
----
L
---
R
D
M
M
E
----
R
----
E
E
E
L
-----
D
Q
V
Q
L
M
T
L
H
A
S
K
G
L
E
F
P
Y
V
Y
M
V
G
M
E
E
G
F
L
P
H
Q
S
S
I
-
D
--
E
D
N
I
D
E
E
R
R
L
A
Y
V
G
I
T
R
A
Q
K
E
L
T
F
T
L
C
K
E
R
R
Q
Y
G
E
L
V
R
P
E
P
S
R
F
L
L
E
L
P
Q
D
D
L
I
W
------------------------------
55
Fugue
84.63
51%
-41
- C3 -
-
1UAA
1
REP_ECOLI
A:
[2-640]
-----
R
L
N
P
G
Q
Q
Q
A
V
E
F
V
T
G
P
C
L
V
L
A
G
A
G
S
G
K
T
R
V
I
T
N
K
I
A
H
L
I
R
G
C
G
Y
Q
A
R
H
I
A
A
V
T
F
T
N
K
A
A
R
E
M
K
E
R
V
G
Q
T
L
G
R
K
E
A
R
G
L
M
I
S
T
F
H
T
L
G
L
D
I
I
K
R
E
Y
A
A
L
G
M
K
A
N
F
S
L
F
D
D
T
D
Q
L
A
L
L
K
E
L
T
E
G
L
I
E
D
-----
D
K
V
L
L
Q
Q
L
-
I
S
T
I
S
N
W
K
N
D
L
K
T
P
S
Q
A
A
A
S
A
I
G
-----
E
R
D
R
I
F
A
H
C
Y
G
L
Y
D
A
H
L
K
A
C
N
V
L
D
F
D
D
L
I
L
L
P
T
L
L
L
Q
A
N
E
E
V
R
K
R
W
Q
N
K
I
R
Y
L
L
V
D
E
Y
Q
D
T
N
T
S
Q
Y
E
L
V
K
L
L
V
G
S
R
A
R
F
T
V
V
G
D
D
D
Q
S
I
Y
S
W
R
G
A
R
P
Q
N
L
V
L
L
S
Q
D
F
P
A
L
K
V
I
K
L
E
Q
N
Y
R
S
S
G
R
I
L
K
A
A
N
I
L
I
A
N
N
P
H
V
F
E
K
R
L
F
S
E
L
G
Y
G
A
E
L
K
V
L
S
A
N
N
E
E
H
E
A
E
R
-
V
T
G
E
L
I
A
H
H
F
V
N
K
T
Q
Y
K
D
Y
A
I
L
Y
R
G
N
H
Q
S
R
V
F
E
K
F
L
M
Q
N
R
I
P
Y
K
I
S
G
G
T
S
F
F
S
R
P
E
I
K
D
L
L
A
Y
L
R
V
L
T
N
P
D
D
D
S
A
F
L
R
I
V
N
T
P
K
R
---EIG
P
A
T
L
K
K
L
G
E
W
A
M
T
R
N
K
S
M
F
T
A
S
F
D
M
G
L
S
Q
T
-
L
S
G
R
G
Y
E
A
L
T
R
F
T
H
W
L
A
E
I
Q
R
L
A
-
E
R
-
E
P
I
A
-
A
V
R
D
L
I
H
G
M
D
Y
E
S
W
L
Y
E
T
-
S
P
S
P
K
A
A
E
M
R
M
K
N
V
N
Q
L
F
S
W
M
T
E
M
L
E
G
S
E
L
D
E
P
M
T
L
T
Q
V
V
T
R
F
T
----
L
---
R
D
-------
M
-
M
E
R
E
E
E
L
-----
D
Q
V
Q
L
M
T
L
H
A
S
K
G
L
E
F
P
Y
V
Y
M
V
G
M
E
E
G
F
L
P
H
Q
S
S
I
-
D
E
-
D
-
N
I
D
E
E
R
R
L
A
Y
V
G
I
T
R
A
Q
K
E
L
T
F
T
L
C
K
E
R
R
Q
Y
G
E
L
V
R
P
E
P
S
R
F
L
L
E
L
P
Q
D
D
L
I
W
------------------------------
5
PsiBlast_PDB
79.62
39%
-55
- C3 -
-
2IS1
4
UVRD_ECOLI
A:
[10-642]
------
L
N
D
K
Q
R
E
A
V
A
A
P
R
S
N
L
L
V
L
A
G
A
G
S
G
K
T
R
V
L
V
H
R
I
A
W
L
M
S
V
E
N
C
S
P
Y
S
I
M
A
V
T
F
T
N
K
A
A
A
E
M
R
H
R
I
G
Q
L
M
G
T
S
Q
G
-
G
M
W
V
G
T
F
H
G
L
A
H
R
L
L
R
A
H
H
M
D
A
N
L
P
Q
D
F
Q
I
L
D
S
E
D
Q
L
R
L
L
K
R
L
I
K
A
M
N
L
D
----
E
K
Q
W
P
P
R
Q
A
-
M
W
Y
I
N
S
Q
K
D
E
G
L
R
P
H
H
I
Q
S
Y
G
-
N
-----
P
V
E
Q
T
W
Q
K
V
Y
Q
A
Y
Q
E
A
C
D
R
A
G
L
V
D
F
A
E
L
L
L
R
A
H
E
L
W
L
N
K
P
H
I
L
Q
H
Y
R
E
R
F
T
N
I
L
V
D
E
F
Q
D
T
N
N
I
Q
Y
A
W
I
R
L
L
A
G
D
T
G
K
V
M
I
V
G
D
D
D
Q
S
I
Y
G
W
R
G
A
Q
V
E
N
I
Q
R
F
L
N
D
F
P
G
A
E
T
I
R
L
E
Q
N
Y
R
S
T
S
N
I
L
S
A
A
N
A
L
I
E
N
N
N
G
R
L
G
K
K
L
W
T
D
G
A
D
G
E
P
I
S
L
Y
C
A
F
N
E
L
D
E
A
R
F
-
V
V
N
R
I
K
T
W
Q
-
D
N
G
G
A
L
A
E
C
A
I
L
Y
R
S
N
A
Q
S
R
V
L
E
E
A
L
L
Q
A
S
M
P
Y
R
I
Y
G
G
M
R
F
F
E
R
Q
E
I
K
D
A
L
S
Y
L
R
L
I
V
N
R
N
D
D
A
A
F
E
R
V
V
N
T
P
T
R
G
I
G
---
D
R
T
L
D
V
V
R
Q
T
S
R
D
R
Q
L
T
L
W
Q
A
C
R
E
L
L
Q
E
K
A
-
L
A
G
R
A
A
S
A
L
Q
R
F
M
E
L
I
D
A
L
A
Q
E
T
A
--
D
M
P
L
H
V
Q
T
D
R
V
I
K
D
S
G
L
R
T
M
Y
E
Q
E
-
K
G
E
K
G
Q
--
T
R
I
E
N
L
E
E
L
V
T
A
T
R
Q
F
S
Y
N
---
E
D
L
M
P
L
Q
A
F
L
S
H
A
A
-----------
L
E
----
A
-
G
E
G
Q
A
D
T
WQ---
D
A
V
Q
L
M
T
L
H
S
A
K
G
L
E
F
P
Q
V
F
I
V
G
M
E
E
G
M
F
P
S
Q
M
S
L
D
E
--
G
G
R
L
E
E
E
R
R
L
A
Y
V
G
V
T
R
A
M
Q
K
L
T
L
T
Y
A
E
T
R
R
L
Y
G
K
E
V
Y
H
R
P
S
R
F
I
G
E
L
P
E
E
C
V
E
-------------------------------
1
PsiBlast_PDB
78.99
50%
20
- C3 -
-
1UAA
1
REP_ECOLI
A:
[2-640]
-----
R
L
N
P
G
Q
Q
Q
A
V
E
F
V
T
G
P
C
L
V
L
A
G
A
G
S
G
K
T
R
V
I
T
N
K
I
A
H
L
I
R
G
C
G
Y
Q
A
R
H
I
A
A
V
T
F
T
N
K
A
A
R
E
M
K
E
R
V
G
Q
T
L
G
R
K
E
A
R
G
L
M
I
S
T
F
H
T
L
G
L
D
I
I
K
R
E
Y
A
A
L
G
M
K
A
N
F
S
L
F
D
D
T
D
Q
L
A
L
L
K
E
L
T
E
-----
G
LI
E
D
D
K
V
L
L
Q
Q
L
-
I
S
T
I
S
N
W
K
N
D
L
K
T
P
S
Q
A
A
A
S
A
I
G
-----
E
R
D
R
I
F
A
H
C
Y
G
L
Y
D
A
H
L
K
A
C
N
V
L
D
F
D
D
L
I
L
L
P
T
L
L
L
Q
A
N
E
E
V
R
K
R
W
Q
N
K
I
R
Y
L
L
V
D
E
Y
Q
D
T
N
T
S
Q
Y
E
L
V
K
L
L
V
G
S
R
A
R
F
T
V
V
G
D
D
D
Q
S
I
Y
S
W
R
G
A
R
P
Q
N
L
V
L
L
S
Q
D
F
P
A
L
K
V
I
K
L
E
Q
N
Y
R
S
S
G
R
I
L
K
A
A
N
I
L
I
A
N
N
P
H
V
F
E
K
R
L
F
S
E
L
G
Y
G
A
E
L
K
V
L
S
A
N
N
E
E
H
E
A
E
R
-
V
T
G
E
L
I
A
H
H
F
V
N
K
T
Q
Y
K
D
Y
A
I
L
Y
R
G
N
H
Q
S
R
V
F
E
K
F
L
M
Q
N
R
I
P
Y
K
I
S
G
G
T
S
F
F
S
R
P
E
I
K
D
L
L
A
Y
L
R
V
L
T
N
P
D
D
D
S
A
F
L
R
I
V
N
T
P
K
R
E
I
G
---
P
A
T
L
K
K
L
G
E
W
A
M
T
R
N
K
S
M
F
T
A
S
F
D
M
G
L
S
Q
T
-
L
S
G
R
G
Y
E
A
L
T
R
F
T
H
W
L
A
E
I
Q
R
--
L
A
E
R
E
P
I
A
-
A
V
R
D
L
I
H
G
M
D
Y
E
S
W
L
Y
E
T
-
S
P
S
P
K
A
A
E
M
R
M
K
N
V
N
Q
L
F
S
W
M
T
E
M
L
E
G
S
E
L
D
E
P
M
T
L
T
Q
V
V
T
R
F
T
----
L
---
R
D
M
M
E
----
R
----
E
E
E
L
-----
D
Q
V
Q
L
M
T
L
H
A
S
K
G
L
E
F
P
Y
V
Y
M
V
G
M
E
E
G
F
L
P
H
Q
S
S
I
-
D
--
E
D
N
I
D
E
E
R
R
L
A
Y
V
G
I
T
R
A
Q
K
E
L
T
F
T
L
C
K
E
R
R
Q
Y
G
E
L
V
R
P
E
P
S
R
F
L
L
E
L
P
Q
D
D
L
I
W
------------------------------
6
PsiBlast_PDB
78.78
39%
-56
- C3 -
-
2IS2
2
UVRD_ECOLI
A:
[10-642]
------
L
N
D
K
Q
R
E
A
V
A
A
P
R
S
N
L
L
V
L
A
G
A
G
S
G
K
T
R
V
L
V
H
R
I
A
W
L
M
S
V
E
N
C
S
P
Y
S
I
M
A
V
T
F
T
N
K
A
A
A
E
M
R
H
R
I
G
Q
L
M
G
T
S
Q
G
-
G
M
W
V
G
T
F
H
G
L
A
H
R
L
L
R
A
H
H
M
D
A
N
L
P
Q
D
F
Q
I
L
D
S
E
D
Q
L
R
L
L
K
R
L
I
K
A
M
N
L
D
----
E
K
Q
W
P
P
R
Q
A
-
M
W
Y
I
N
S
Q
K
D
E
G
L
R
P
H
H
I
Q
S
Y
G
-
N
-----
P
V
E
Q
T
W
Q
K
V
Y
Q
A
Y
Q
E
A
C
D
R
A
G
L
V
D
F
A
E
L
L
L
R
A
H
E
L
W
L
N
K
P
H
I
L
Q
H
Y
R
E
R
F
T
N
I
L
V
D
E
F
Q
D
T
N
N
I
Q
Y
A
W
I
R
L
L
A
G
D
T
G
K
V
M
I
V
G
D
D
D
Q
S
I
Y
G
W
R
G
A
Q
V
E
N
I
Q
R
F
L
N
D
F
P
G
A
E
T
I
R
L
E
Q
N
Y
R
S
T
S
N
I
L
S
A
A
N
A
L
I
E
N
N
N
G
R
L
G
K
K
L
W
T
D
G
A
D
G
E
P
I
S
L
Y
C
A
F
N
E
L
D
E
A
R
F
-
V
V
N
R
I
K
T
W
Q
-
D
N
G
G
A
L
A
E
C
A
I
L
Y
R
S
N
A
Q
S
R
V
L
E
E
A
L
L
Q
A
S
M
P
Y
R
I
Y
G
G
M
R
F
F
E
R
Q
E
I
K
D
A
L
S
Y
L
R
L
I
V
N
R
N
D
D
A
A
F
E
R
V
V
N
T
P
T
R
G
I
G
---
D
R
T
L
D
V
V
R
Q
T
S
R
D
R
Q
L
T
L
W
Q
A
C
R
E
L
L
Q
E
K
A
-
L
A
G
R
A
A
S
A
L
Q
R
F
M
E
L
I
D
A
L
A
Q
E
T
A
--
D
M
P
L
H
V
Q
T
D
R
V
I
K
D
S
G
L
R
T
M
Y
E
Q
E
-
K
G
E
K
G
Q
--
T
R
I
E
N
L
E
E
L
V
T
A
T
R
Q
F
S
Y
---
D
E
D
L
M
P
L
Q
A
F
L
S
H
A
A
-----------
L
E
----
A
-
G
E
G
Q
A
D
T
WQ---
D
A
V
Q
L
M
T
L
H
S
A
K
G
L
E
F
P
Q
V
F
I
V
G
M
E
E
G
M
F
P
S
Q
M
S
L
D
E
--
G
G
R
L
E
E
E
R
R
L
A
Y
V
G
V
T
R
A
M
Q
K
L
T
L
T
Y
A
E
T
R
R
L
Y
G
K
E
V
Y
H
R
P
S
R
F
I
G
E
L
P
E
E
C
V
E
-------------------------------
21
PsiBlast_CBE
78.70
50%
17
- C3 -
-
1UAA
1
REP_ECOLI
B:
[2-642]
-----
R
L
N
P
G
Q
Q
Q
A
V
E
F
V
T
G
P
C
L
V
L
A
G
A
G
S
G
K
T
R
V
I
T
N
K
I
A
H
L
I
R
G
C
G
Y
Q
A
R
H
I
A
A
V
T
F
T
N
K
A
A
R
E
M
K
E
R
V
G
Q
T
L
G
R
K
E
A
R
G
L
M
I
S
T
F
H
T
L
G
L
D
I
I
K
R
E
Y
A
A
L
G
M
K
A
N
F
S
L
F
D
D
T
D
Q
L
A
L
L
K
E
L
T
E
-----
G
LI
E
D
D
K
V
L
L
Q
Q
L
-
I
S
T
I
S
N
W
K
N
D
L
K
T
P
S
Q
A
A
A
S
A
I
G
-----
E
R
D
R
I
F
A
H
C
Y
G
L
Y
D
A
H
L
K
A
C
N
V
L
D
F
D
D
L
I
L
L
P
T
L
L
L
Q
A
N
E
E
V
R
K
R
W
Q
N
K
I
R
Y
L
L
V
D
E
Y
Q
D
T
N
T
S
Q
Y
E
L
V
K
L
L
V
G
S
R
A
R
F
T
V
V
G
D
D
D
Q
S
I
Y
S
W
R
G
A
R
P
Q
N
L
V
L
L
S
Q
D
F
P
A
L
K
V
I
K
L
E
Q
N
Y
R
S
S
G
R
I
L
K
A
A
N
I
L
I
A
N
N
P
H
V
F
E
K
R
L
F
S
E
L
G
Y
G
A
E
L
K
V
L
S
A
N
N
E
E
H
E
A
E
R
-
V
T
G
E
L
I
A
H
H
F
V
N
K
T
Q
Y
K
D
Y
A
I
L
Y
R
G
N
H
Q
S
R
V
F
E
K
F
L
M
Q
N
R
I
P
Y
K
I
S
G
G
T
S
F
F
S
R
P
E
I
K
D
L
L
A
Y
L
R
V
L
T
N
P
D
D
D
S
A
F
L
R
I
V
N
T
P
K
R
E
I
G
---
P
A
T
L
K
K
L
G
E
W
A
M
T
R
N
K
S
M
F
T
A
S
F
D
M
G
L
S
Q
T
-
L
S
G
R
G
Y
E
A
L
T
R
F
T
H
W
L
A
E
I
Q
R
--
L
A
E
R
E
P
I
A
-
A
V
R
D
L
I
H
G
M
D
Y
E
S
W
L
Y
E
T
-
S
P
S
P
K
A
A
E
M
R
M
K
N
V
N
Q
L
F
S
W
M
T
E
M
L
E
G
S
E
L
D
E
P
M
T
L
T
Q
V
V
T
R
F
T
----
L
---
R
D
-------------
E
E
L
-----
D
Q
V
Q
L
M
T
L
H
A
S
K
G
L
E
F
P
Y
V
Y
M
V
G
M
E
E
G
F
L
P
H
Q
S
S
I
-
D
--
E
D
N
I
D
E
E
R
R
L
A
Y
V
G
I
T
R
A
Q
K
E
L
T
F
T
L
C
K
E
R
R
Q
Y
G
E
L
V
R
P
E
P
S
R
F
L
L
E
L
P
Q
D
D
L
I
W
E
Q
----------------------------
22
PsiBlast_CBE
77.04
39%
-58
- C3 -
-
2IS1
4
UVRD_ECOLI
B:
[10-642]
------
L
N
D
K
Q
R
E
A
V
A
A
P
R
S
N
L
L
V
L
A
G
A
G
S
G
K
T
R
V
L
V
H
R
I
A
W
L
M
S
V
E
N
C
S
P
Y
S
I
M
A
V
T
F
T
N
K
A
A
A
E
M
R
H
R
I
G
Q
L
M
G
T
S
Q
G
-
G
M
W
V
G
T
F
H
G
L
A
H
R
L
L
R
A
H
H
M
D
A
N
L
P
Q
D
F
Q
I
L
D
S
E
D
Q
L
R
L
L
K
R
L
I
K
A
M
N
L
D
----
E
K
Q
W
P
P
R
Q
A
-
M
W
Y
I
N
S
Q
K
D
E
G
L
R
P
H
H
I
Q
S
----------
V
E
Q
T
W
Q
K
V
Y
Q
A
Y
Q
E
A
C
D
R
A
G
L
V
D
F
A
E
L
L
L
R
A
H
E
L
W
L
N
K
P
H
I
L
Q
H
Y
R
E
R
F
T
N
I
L
V
D
E
F
Q
D
T
N
N
I
Q
Y
A
W
I
R
L
L
A
G
D
T
G
K
V
M
I
V
G
D
D
D
Q
S
I
Y
G
W
R
G
A
Q
V
E
N
I
Q
R
F
L
N
D
F
P
G
A
E
T
I
R
L
E
Q
N
Y
R
S
T
S
N
I
L
S
A
A
N
A
L
I
E
N
N
N
G
R
L
G
K
K
L
W
T
D
G
A
D
G
E
P
I
S
L
Y
C
A
F
N
E
L
D
E
A
R
F
-
V
V
N
R
I
K
T
W
Q
-
D
N
G
G
A
L
A
E
C
A
I
L
Y
R
S
N
A
Q
S
R
V
L
E
E
A
L
L
Q
A
S
M
P
Y
R
I
Y
G
G
M
R
F
F
E
R
Q
E
I
K
D
A
L
S
Y
L
R
L
I
V
N
R
N
D
D
A
A
F
E
R
V
V
N
T
P
T
R
G
I
G
---
D
R
T
L
D
V
V
R
Q
T
S
R
D
R
Q
L
T
L
W
Q
A
C
R
E
L
L
Q
E
K
A
-
L
A
G
R
A
A
S
A
L
Q
R
F
M
E
L
I
D
A
L
A
Q
E
T
A
--
D
M
P
L
H
V
Q
T
D
R
V
I
K
D
S
G
L
R
T
M
Y
E
Q
E
-
K
G
E
K
G
Q
--
T
R
I
E
N
L
E
E
L
V
T
A
T
R
Q
F
S
Y
---
D
E
D
L
M
P
L
Q
A
F
L
S
H
A
A
-----------
L
E
----
A
-
G
E
G
----Q----
D
A
V
Q
L
M
T
L
H
S
A
K
G
L
E
F
P
Q
V
F
I
V
G
M
E
E
G
M
F
P
S
Q
M
--------
R
L
E
E
E
R
R
L
A
Y
V
G
V
T
R
A
M
Q
K
L
T
L
T
Y
A
E
T
R
R
L
Y
G
K
E
V
Y
H
R
P
S
R
F
I
G
E
L
P
E
E
C
V
E
-------------------------------
7
PsiBlast_PDB
76.81
39%
-45
- C3 -
-
2IS6
5
UVRD_ECOLI
A:
[10-642]
------
L
N
D
K
Q
R
E
A
V
A
A
P
R
S
N
L
L
V
L
A
G
A
G
S
G
K
T
R
V
L
V
H
R
I
A
W
L
M
S
V
E
N
C
S
P
Y
S
I
M
A
V
T
F
T
N
K
A
A
A
E
M
R
H
R
I
G
Q
L
M
G
T
S
Q
G
-
G
M
W
V
G
T
F
H
G
L
A
H
R
L
L
R
A
H
H
M
D
A
N
L
P
Q
D
F
Q
I
L
D
S
E
D
Q
L
R
L
L
K
R
L
I
K
A
M
N
L
D
----
E
K
Q
W
P
P
R
Q
A
-
M
W
Y
I
N
S
Q
K
D
E
G
L
R
P
H
H
I
Q
S
Y
G
-
N
-----
P
V
E
Q
T
W
Q
K
V
Y
Q
A
Y
Q
E
A
C
D
R
A
G
L
V
D
F
A
E
L
L
L
R
A
H
E
L
W
L
N
K
P
H
I
L
Q
H
Y
R
E
R
F
T
N
I
L
V
D
E
F
Q
D
T
N
N
I
Q
Y
A
W
I
R
L
L
A
G
D
T
G
K
V
M
I
V
G
D
D
D
Q
S
I
Y
G
W
R
G
A
Q
V
E
N
I
Q
R
F
L
N
D
F
P
G
A
E
T
I
R
L
E
Q
N
Y
R
S
T
S
N
I
L
S
A
A
N
A
L
I
E
N
N
N
G
R
L
G
K
K
L
W
T
D
G
A
D
G
E
P
I
S
L
Y
C
A
F
N
E
L
D
E
A
R
F
-
V
V
N
R
I
K
T
W
Q
-
D
N
G
G
A
L
A
E
C
A
I
L
Y
R
S
N
A
Q
S
R
V
L
E
E
A
L
L
Q
A
S
M
P
Y
R
I
Y
G
G
M
R
F
F
E
R
Q
E
I
K
D
A
L
S
Y
L
R
L
I
V
N
R
N
D
D
A
A
F
E
R
V
V
N
T
P
T
R
G
I
G
---
D
R
T
L
D
V
V
R
Q
T
S
R
D
R
Q
L
T
L
W
Q
A
C
R
E
L
L
Q
E
K
A
-
L
A
G
R
A
A
S
A
L
Q
R
F
M
E
L
I
D
A
L
A
Q
E
T
A
--
D
M
P
L
H
V
Q
T
D
R
V
I
K
D
S
G
L
R
T
M
Y
E
Q
E
-
K
G
E
K
G
Q
--
T
R
I
E
N
L
E
E
L
V
T
A
T
R
Q
F
S
Y
N
E
E
D
--
L
M
P
L
Q
A
F
L
S
H
A
A
-----------
L
E
----
A
-
G
E
G
Q
A
D
T
W
Q
---
D
A
V
Q
L
M
T
L
H
S
A
K
G
L
E
F
P
Q
V
F
I
V
G
M
E
E
G
M
F
P
S
Q
M
S
L
D
E
--
G
G
R
L
E
E
E
R
R
L
A
Y
V
G
V
T
R
A
M
Q
K
L
T
L
T
Y
A
E
T
R
R
L
Y
G
K
E
V
Y
H
R
P
S
R
F
I
G
E
L
P
E
E
C
V
E
-------------------------------
2
PsiBlast_PDB
75.26
40%
-5
- C3 -
-
3PJR
2
?
A:
[10-652]
----
A
H
L
N
K
E
Q
Q
E
A
V
R
T
T
E
G
P
L
L
I
M
A
G
A
G
S
G
K
T
R
V
L
T
H
R
I
A
Y
L
M
A
E
K
H
V
A
P
W
N
I
L
A
I
T
F
T
N
K
A
A
R
E
M
R
E
R
V
Q
S
L
L
G
-
G
A
A
E
D
V
W
I
S
T
F
H
S
M
C
V
R
I
L
R
R
D
I
D
R
I
G
I
N
R
N
F
S
I
L
D
P
T
D
Q
L
S
V
M
K
T
I
L
K
E
K
N
I
-----
D
P
K
K
F
E
P
R
T
I
L
G
T
I
S
A
A
K
N
E
L
L
P
P
E
Q
F
A
K
R
A
S
T
-----
Y
Y
E
K
V
V
S
D
V
Y
Q
E
Y
Q
Q
R
L
L
R
N
H
S
L
D
F
D
D
L
I
M
T
T
I
Q
L
F
D
R
V
P
D
V
L
H
Y
Y
Q
Y
K
F
Q
Y
I
H
I
D
E
Y
Q
D
T
N
R
A
Q
Y
T
L
V
K
K
L
A
E
R
F
Q
N
I
C
A
V
G
D
A
D
Q
S
I
Y
R
W
R
G
A
D
I
Q
N
I
L
S
F
E
R
D
Y
P
N
A
K
V
I
L
L
E
Q
N
Y
R
S
T
K
R
I
L
Q
A
A
N
E
V
I
E
H
N
V
N
R
K
P
K
R
I
W
T
E
N
P
E
G
K
P
I
L
Y
Y
E
A
M
N
E
A
D
E
A
Q
F
-
V
A
G
R
I
R
E
A
V
E
R
G
E
R
R
Y
R
D
F
A
V
L
Y
R
T
N
A
Q
S
R
V
M
E
E
M
L
L
K
A
N
I
P
Y
Q
I
V
G
G
L
K
F
Y
D
R
K
E
I
K
D
I
L
A
Y
L
R
V
I
A
N
P
D
D
D
L
S
L
L
R
I
I
N
V
P
K
R
G
I
G
---
A
S
T
I
D
K
L
V
R
Y
A
A
D
H
E
L
S
L
F
E
A
L
G
E
--
L
E
M
I
G
L
G
A
K
A
A
G
A
L
A
A
F
R
S
Q
L
E
Q
W
T
-
Q
L
Q
E
Y
V
S
V
T
E
-
L
V
E
E
V
L
D
K
S
G
Y
R
E
M
L
K
A
E
-
R
T
I
E
A
Q
--
S
R
L
E
N
L
D
E
F
L
S
V
T
K
H
F
E
N
V
S
---
D
D
K
S
L
I
A
F
L
T
D
L
A
----
L
ISD
L
D
E
--------
T
E
Q
A
A
E
G
-----
D
A
V
M
L
M
T
L
H
A
A
K
G
L
E
F
P
V
V
F
L
I
G
M
E
E
G
I
F
P
H
N
R
S
L
E
D
--
D
D
E
M
E
E
E
R
R
L
A
Y
V
G
I
T
R
A
E
E
E
L
V
L
T
S
A
Q
M
R
T
L
F
G
N
I
Q
M
D
P
P
S
R
F
L
N
E
I
P
A
H
L
L
E
T
A
S
R
R
--------------------------
25
PsiBlast_CBE
74.27
38%
-20
- C3 -
-
4C30
1
?
F:
[13-648]
------
L
N
P
T
Q
A
Q
A
A
D
H
F
T
G
P
A
L
V
I
A
G
A
G
S
G
K
T
R
T
L
I
Y
R
I
A
H
L
I
G
H
Y
G
V
H
P
G
E
I
L
A
V
T
F
T
N
K
A
A
A
E
M
R
E
R
A
G
H
L
V
P
--
G
A
G
D
L
W
M
S
T
F
H
S
A
G
V
R
I
L
R
T
Y
G
E
H
I
G
L
R
R
G
F
V
I
Y
D
D
D
D
Q
L
D
I
I
K
E
V
M
G
S
I
P
G
I
G
--
A
E
T
Q
P
R
V
I
R
G
-
I
--
I
D
R
A
K
S
N
L
W
T
P
D
D
L
D
R
S
R
E
P
-----
P
R
D
A
A
-
A
E
A
Y
R
R
Y
E
V
R
K
K
G
Q
N
A
I
D
F
G
D
L
I
T
E
T
V
R
L
F
K
E
V
P
G
V
L
D
K
V
Q
N
K
A
K
F
I
H
V
D
E
Y
Q
D
T
N
R
A
Q
Y
E
L
T
R
L
L
A
S
R
D
R
N
L
L
V
V
G
D
P
D
Q
S
I
Y
K
F
R
G
A
D
I
Q
N
I
L
D
F
Q
K
D
Y
P
D
A
K
V
Y
M
L
E
H
N
Y
R
S
S
A
R
V
L
E
A
A
N
K
L
I
E
N
N
T
E
R
L
D
K
T
L
K
P
V
K
E
A
G
Q
P
V
T
F
--
H
R
A
T
D
H
R
A
E
G
D
Y
V
A
D
W
L
T
R
L
H
G
E
G
R
A
W
S
E
M
A
I
L
Y
R
T
N
A
Q
S
R
V
I
E
E
S
L
R
R
V
Q
I
P
A
R
I
V
G
G
V
G
F
Y
D
R
R
E
I
R
D
I
L
A
Y
A
R
L
A
L
N
P
A
D
D
V
A
L
R
R
I
I
G
R
P
R
R
G
I
G
---
D
T
A
L
Q
K
L
M
E
W
A
R
T
H
H
T
S
V
L
T
A
C
A
N
-----------
A
H
-
K
A
T
E
F
A
G
L
M
E
A
M
S
-
E
A
A
D
N
Y
E
P
A
A
-
F
L
R
F
V
M
E
T
S
G
Y
L
D
L
L
R
Q
E
-
G
---
Q
E
G
Q
V
R
L
E
N
L
E
E
L
V
S
A
A
E
E
W
S
Q
-----
D
E
A
-----
I
A
D
F
L
DDAA
L
---
L
S
S
V
D
----
D
-
M
R
T
K
A
E
-PE---
D
A
V
T
L
M
T
L
H
N
A
K
G
L
E
F
P
V
V
F
I
V
G
V
E
Q
G
L
L
P
S
K
G
A
I
-
A
EG
P
S
G
I
E
E
E
R
R
L
F
Y
V
G
I
T
R
A
M
E
R
L
L
M
T
A
A
Q
N
R
M
Q
F
G
K
T
N
A
A
E
D
S
A
F
L
E
D
I
-------------------------------------
10
PsiBlast_PDB
74.08
38%
-25
- C3 -
-
4C30
1
?
A:
[13-648]
------
L
N
P
T
Q
A
Q
A
A
D
H
F
T
G
P
A
L
V
I
A
G
A
G
S
G
K
T
R
T
L
I
Y
R
I
A
H
L
I
G
H
Y
G
V
H
P
G
E
I
L
A
V
T
F
T
N
K
A
A
A
E
M
R
E
R
A
G
H
L
V
P
--
G
A
G
D
L
W
M
S
T
F
H
S
A
G
V
R
I
L
R
T
Y
G
E
H
I
G
L
R
R
G
F
V
I
Y
D
D
D
D
Q
L
D
I
I
K
E
V
M
G
S
I
P
G
I
G
--
A
E
T
Q
P
R
V
I
R
G
-
I
--
I
D
R
A
K
S
N
L
W
T
P
D
D
L
D
R
S
R
E
P
-----
P
R
D
A
A
-
A
E
A
Y
R
R
Y
E
V
R
K
K
G
Q
N
A
I
D
F
G
D
L
I
T
E
T
V
R
L
F
K
E
V
P
G
V
L
D
K
V
Q
N
K
A
K
F
I
H
V
D
E
Y
Q
D
T
N
R
A
Q
Y
E
L
T
R
L
L
A
S
R
D
R
N
L
L
V
V
G
D
P
D
Q
S
I
Y
K
F
R
G
A
D
I
Q
N
I
L
D
F
Q
K
D
Y
P
D
A
K
V
Y
M
L
E
H
N
Y
R
S
S
A
R
V
L
E
A
A
N
K
L
I
E
N
N
T
E
R
L
D
K
T
L
K
P
V
K
E
A
G
Q
P
V
T
F
--
H
R
A
T
D
H
R
A
E
G
D
Y
V
A
D
W
L
T
R
L
H
G
E
G
R
A
W
S
E
M
A
I
L
Y
R
T
N
A
Q
S
R
V
I
E
E
S
L
R
R
V
Q
I
P
A
R
I
V
G
G
V
G
F
Y
D
R
R
E
I
R
D
I
L
A
Y
A
R
L
A
L
N
P
A
D
D
V
A
L
R
R
I
I
G
R
P
R
R
G
I
G
---
D
T
A
L
Q
K
L
M
E
W
A
R
T
H
H
T
S
V
L
T
A
C
A
N
-----------
A
H
-
K
A
T
E
F
A
G
L
M
E
A
M
S
-
E
A
A
D
N
Y
E
P
A
A
-
F
L
R
F
V
M
E
T
S
G
Y
L
D
L
L
R
Q
E
-
G
---
Q
E
G
Q
V
R
L
E
N
L
E
E
L
V
S
A
A
E
E
W
S
Q
-----
D
E
A
-----
I
A
D
F
L
D
D
A
A
L
---
L
S
S
V
D
----
D
-
M
R
T
K
A
E
-PE---
D
A
V
T
L
M
T
L
H
N
A
K
G
L
E
F
P
V
V
F
I
V
G
V
E
Q
G
L
L
P
S
K
G
A
I
-
A
E
G
P
S
G
I
E
E
E
R
R
L
F
Y
V
G
I
T
R
A
M
E
R
L
L
M
T
A
A
Q
N
R
M
Q
F
G
K
T
N
A
A
E
D
S
A
F
L
E
D
I
-------------------------------------
4
PsiBlast_PDB
73.00
40%
4
- C3 -
-
1PJR
-
PCRA_GEOSE
A:
[10-651]
----
A
H
L
N
K
E
Q
Q
E
A
V
R
T
T
E
G
P
L
L
I
M
A
G
A
G
S
G
K
T
R
V
L
T
H
R
I
A
Y
L
M
A
E
K
H
V
A
P
W
N
I
L
A
I
T
F
T
N
K
A
A
R
E
M
R
E
R
V
Q
S
L
L
G
-
G
A
A
E
D
V
W
I
S
T
F
H
S
M
C
V
R
I
L
R
R
D
I
D
R
I
G
I
N
R
N
F
S
I
L
D
P
T
D
Q
L
S
V
M
K
T
I
L
K
E
K
N
I
-----
D
P
K
K
F
E
P
R
T
I
L
G
T
I
S
A
A
K
N
E
L
L
P
P
E
Q
F
A
K
R
--------
Y
Y
E
K
V
V
S
D
V
Y
Q
E
Y
Q
Q
R
L
L
R
N
H
S
L
D
F
D
D
L
I
M
T
T
I
Q
L
F
D
R
V
P
D
V
L
H
Y
Y
Q
Y
K
F
Q
Y
I
H
I
D
E
Y
Q
D
T
N
R
A
Q
Y
T
L
V
K
K
L
A
E
R
F
Q
N
I
C
A
V
G
D
A
D
Q
S
I
Y
R
W
R
G
A
D
I
Q
N
I
L
S
F
E
R
D
Y
P
N
A
K
V
I
L
L
E
Q
N
Y
R
S
T
K
R
I
L
Q
A
A
N
E
V
I
E
H
N
V
N
R
K
P
K
R
I
W
T
E
N
P
E
G
K
P
I
L
Y
Y
E
A
M
N
E
A
D
E
A
Q
F
-
V
A
G
R
I
R
E
A
V
E
R
G
E
R
R
Y
R
D
F
A
V
L
Y
R
T
N
A
Q
S
R
V
M
E
E
M
L
L
K
A
N
I
P
Y
Q
I
V
G
G
L
K
F
Y
D
R
K
E
I
K
D
I
L
A
Y
L
R
V
I
A
N
P
D
D
D
L
S
L
L
R
I
I
N
V
P
K
R
G
I
G
---
A
S
T
I
D
------------
L
F
E
A
L
G
E
--
L
E
M
I
G
L
G
A
K
A
A
G
A
L
A
A
F
R
S
Q
L
E
Q
W
T
-
Q
L
Q
E
Y
V
S
V
T
E
-
L
V
E
E
V
L
D
K
S
G
Y
R
E
M
L
K
A
E
-
R
T
I
E
A
Q
--
S
R
L
E
N
L
D
E
F
L
S
V
T
K
H
F
E
N
V
S
---
D
D
K
S
L
I
A
F
L
T
D
L
A
----
L
I
S------------------
G
-----
D
A
V
M
L
M
T
L
H
A
A
K
G
L
E
F
P
V
V
F
L
I
G
M
E
E
G
I
F
P
H
N
R
S
L
E
D
--
D
D
E
M
E
E
E
R
R
L
A
Y
V
G
I
T
R
A
E
E
E
L
V
L
T
S
A
Q
M
R
T
L
F
G
N
I
Q
M
D
P
P
S
R
F
L
N
E
I
P
A
H
L
L
E
T
A
S
R
---------------------------
3
PsiBlast_PDB
72.65
40%
3
- C3 -
-
1QHG
1
PCRA_GEOSE
A:
[10-651]
----
A
H
L
N
K
E
Q
Q
E
A
V
R
T
T
E
G
P
L
L
I
M
A
G
A
G
S
G
K
T
R
V
L
T
H
R
I
A
Y
L
M
A
E
K
H
V
A
P
-
N
I
L
A
I
T
F
T
N
K
A
A
R
E
M
R
E
R
V
Q
S
L
L
G
-
G
A
A
E
D
V
W
I
S
T
F
H
S
M
C
V
R
I
L
R
R
D
I
D
R
I
G
I
N
R
N
F
S
I
L
D
P
T
D
Q
L
S
V
M
K
T
I
L
K
E
K
N
I
-----
D
P
K
K
F
E
P
R
T
I
L
G
T
I
S
A
A
K
N
E
L
L
P
P
E
Q
F
A
K
R
--------
Y
Y
E
K
V
V
S
D
V
Y
Q
E
Y
Q
Q
R
L
L
R
N
H
S
L
D
F
D
D
L
I
M
T
T
I
Q
L
F
D
R
V
P
D
V
L
H
Y
Y
Q
Y
K
F
Q
Y
I
H
I
D
E
Y
Q
D
T
N
R
A
Q
Y
T
L
V
K
K
L
A
E
R
F
Q
N
I
C
A
V
G
D
A
D
Q
S
I
Y
R
W
R
G
A
D
I
Q
N
I
L
S
F
E
R
D
Y
P
N
A
K
V
I
L
L
E
Q
N
Y
R
S
T
K
R
I
L
Q
A
A
N
E
V
I
E
H
N
V
N
R
K
P
K
R
I
W
T
E
N
P
E
G
K
P
I
L
Y
Y
E
A
M
N
E
A
D
E
A
Q
F
-
V
A
G
R
I
R
E
A
V
E
R
G
E
R
R
Y
R
D
F
A
V
L
Y
R
T
N
A
Q
S
R
V
M
E
E
M
L
L
K
A
N
I
P
Y
Q
I
V
G
G
L
K
F
Y
D
R
K
E
I
K
D
I
L
A
Y
L
R
V
I
A
N
P
D
D
D
L
S
L
L
R
I
I
N
V
P
K
R
G
I
G
---
A
S
T
I
D
------------
L
F
E
A
L
G
E
--
L
E
M
I
G
L
G
A
K
A
A
G
A
L
A
A
F
R
S
Q
L
E
Q
W
T
-
Q
L
Q
E
Y
V
S
V
T
E
-
L
V
E
E
V
L
D
K
S
G
Y
R
E
M
L
K
A
E
-
R
T
I
E
A
Q
--
S
R
L
E
N
L
D
E
F
L
S
V
T
K
H
F
E
N
V
S
---
D
D
K
S
L
I
A
F
L
T
D
L
A
----
L
I
S------------------
G
-----
D
A
V
M
L
M
T
L
H
A
A
K
G
L
E
F
P
V
V
F
L
I
G
M
E
E
G
I
F
P
H
N
R
S
L
E
D
--
D
D
E
M
E
E
E
R
R
L
A
Y
V
G
I
T
R
A
E
E
E
L
V
L
T
S
A
Q
M
R
T
L
F
G
N
I
Q
M
D
P
P
S
R
F
L
N
E
I
P
A
H
L
L
E
T
A
S
R
---------------------------
37
HHSearch
72.05
37%
11
- C3 -
-
4C2U
2
?
A:
[9-654]
--
L
L
Q
A
L
N
P
T
Q
A
Q
A
A
D
H
F
T
G
P
A
L
V
I
A
G
A
G
S
G
K
T
R
T
L
I
Y
R
I
A
H
L
I
G
H
Y
G
V
H
P
G
E
I
L
A
V
T
F
T
N
K
A
A
A
E
M
R
E
R
A
G
H
L
V
P
--
G
A
G
D
L
W
M
S
T
F
H
S
A
G
V
R
I
L
R
T
Y
G
E
H
I
G
L
R
R
G
F
V
I
Y
D
D
D
D
Q
L
D
I
I
K
E
V
M
G
S
I
P
G
------
E
T
Q
-
P
R
V
I
-
R
G
I
I
D
R
A
K
S
N
L
W
T
P
D
D
L
D
R
S
R
E
P
FISG-
L
P
R
D
A
A
A
E
A
Y
R
R
Y
E
V
R
K
K
G
Q
N
A
I
D
F
G
D
L
I
T
E
T
V
R
L
F
K
E
V
P
G
V
L
D
K
V
Q
N
K
A
K
F
I
H
V
D
E
Y
Q
D
T
N
R
A
Q
Y
E
L
T
R
L
L
A
S
R
D
R
N
L
L
V
V
G
D
P
D
Q
S
I
Y
K
F
R
G
A
D
I
Q
N
I
L
D
F
Q
K
D
Y
P
D
A
K
V
Y
M
L
E
H
N
Y
R
S
S
A
R
V
L
E
A
A
N
K
L
I
E
N
N
T
E
R
L
D
K
T
L
K
P
V
K
E
A
G
Q
P
V
T
F
H
R
A
T
D
H
R
A
E
G
D
Y
-
V
A
D
W
L
T
R
L
H
G
-
E
G
R
A
W
S
E
M
A
I
L
Y
R
T
N
A
Q
S
R
V
I
E
E
S
L
R
R
V
Q
I
P
A
R
I
V
G
G
V
G
F
Y
D
R
R
E
I
R
D
I
L
A
Y
A
R
L
A
L
N
P
A
D
D
V
A
L
R
R
I
I
G
R
P
R
R
G
I
G
---
D
T
A
L
Q
K
L
M
E
W
A
R
T
H
H
T
S
V
L
T
A
C
A
N
A
A
E
-
Q
N
-
I
L
D
R
G
A
H
K
A
T
E
F
A
G
L
M
E
A
M
S
E
A
-
A
D
N
Y
E
P
A
A
-
F
L
R
F
V
M
E
T
S
G
Y
L
D
L
L
R
Q
--
E
G
Q
-
E
-
G
Q
V
R
L
E
N
L
E
E
L
V
S
A
A
E
E
W
S
Q
D
E
A
-
N
V
G
G
S
I
A
D
F
L
D
D
A
A
----
L
---
L
S
S
V
D
D
M
R
T
K
A
E
N
K
G
A
P
E
-----
D
A
V
T
L
M
T
L
H
N
A
K
G
L
E
F
P
V
V
F
I
V
G
V
E
Q
G
L
L
P
S
K
G
A
I
-
A
E
G
P
S
G
I
E
E
E
R
R
L
F
Y
V
G
I
T
R
A
M
E
R
L
L
M
T
A
A
Q
N
R
M
Q
F
G
K
T
N
A
A
E
D
S
A
F
L
E
D
I
E
G
L
F
D
T
-------------------------------
27
PsiBlast_CBE
71.48
38%
26
- C3 -
-
4C2U
2
?
D:
[13-648]
------
L
N
P
T
Q
A
Q
A
A
D
H
F
T
G
P
A
L
V
I
A
G
A
G
S
G
K
T
R
T
L
I
Y
R
I
A
H
L
I
G
H
Y
G
V
H
P
G
E
I
L
A
V
T
F
T
N
K
A
A
A
E
M
R
E
R
A
G
H
L
V
P
--
G
A
G
D
L
W
M
S
T
F
H
S
A
G
V
R
I
L
R
T
Y
G
E
H
I
G
L
R
R
G
F
V
I
Y
D
D
D
D
Q
L
D
I
I
K
E
V
M
G
S
I
P
G
-----
E
T
Q
P
R
V
I
R
G
-
I
--
I
D
R
A
K
S
N
L
W
T
P
D
D
L
D
R
S
R
E
P
FISGL
P
R
D
A
A
-
A
E
A
Y
R
R
Y
E
V
R
K
K
G
Q
N
A
I
D
F
G
D
L
I
T
E
T
V
R
L
F
K
E
V
P
G
V
L
D
K
V
Q
N
K
A
K
F
I
H
V
D
E
Y
Q
D
T
N
R
A
Q
Y
E
L
T
R
L
L
A
S
R
D
R
N
L
L
V
V
G
D
P
D
Q
S
I
Y
K
F
R
G
A
D
I
Q
N
I
L
D
F
Q
K
D
Y
P
D
A
K
V
Y
M
L
E
H
N
Y
R
S
S
A
R
V
L
E
A
A
N
K
L
I
E
N
N
T
E
R
L
D
K
T
L
K
P
V
K
E
A
G
Q
P
V
T
F
--
H
R
A
T
D
H
R
A
E
G
D
Y
V
A
D
W
L
T
R
L
H
G
E
G
R
A
W
S
E
M
A
I
L
Y
R
T
N
A
Q
S
R
V
I
E
E
S
L
R
R
V
Q
I
P
A
R
I
V
G
G
V
G
F
Y
D
R
R
E
I
R
D
I
L
A
Y
A
R
L
A
L
N
P
A
D
D
V
A
L
R
R
I
I
G
R
P
R
R
G
I
G
---
D
T
A
L
Q
K
L
M
E
W
A
R
T
H
H
T
S
V
L
T
A
C
A
N
A
A
E
Q
N
I
-
L
D
R
G
A
H
-
K
A
T
E
F
A
G
L
M
E
A
M
S
-
E
A
A
D
N
Y
E
P
A
A
-
F
L
R
F
V
M
E
T
S
G
Y
L
D
L
L
R
Q
E
-
G
---
Q
E
G
Q
V
R
L
E
N
L
E
E
L
V
S
A
A
E
E
W
S
Q
-----
D
E
A
N
V
G
G
S
I
A
D
F
L
DDAA
L
---
L
S
S
V
D
----
D
-
M
R
T
K
A
E
N
KGAPE
D
A
V
T
L
M
T
L
H
N
A
K
G
L
E
F
P
V
V
F
I
V
G
V
E
Q
G
L
L
P
S
K
G
A
I
-
A
EG
P
S
G
I
E
E
E
R
R
L
F
Y
V
G
I
T
R
A
M
E
R
L
L
M
T
A
A
Q
N
R
M
Q
F
G
K
T
N
A
A
E
D
S
A
F
L
E
D
I
-------------------------------------
9
PsiBlast_PDB
71.33
38%
23
- C3 -
-
4C2U
2
?
A:
[13-648]
------
L
N
P
T
Q
A
Q
A
A
D
H
F
T
G
P
A
L
V
I
A
G
A
G
S
G
K
T
R
T
L
I
Y
R
I
A
H
L
I
G
H
Y
G
V
H
P
G
E
I
L
A
V
T
F
T
N
K
A
A
A
E
M
R
E
R
A
G
H
L
V
P
--
G
A
G
D
L
W
M
S
T
F
H
S
A
G
V
R
I
L
R
T
Y
G
E
H
I
G
L
R
R
G
F
V
I
Y
D
D
D
D
Q
L
D
I
I
K
E
V
M
G
S
I
P
G
-----
E
T
Q
P
R
V
I
R
G
-
I
--
I
D
R
A
K
S
N
L
W
T
P
D
D
L
D
R
S
R
E
P
FISGL
P
R
D
A
A
-
A
E
A
Y
R
R
Y
E
V
R
K
K
G
Q
N
A
I
D
F
G
D
L
I
T
E
T
V
R
L
F
K
E
V
P
G
V
L
D
K
V
Q
N
K
A
K
F
I
H
V
D
E
Y
Q
D
T
N
R
A
Q
Y
E
L
T
R
L
L
A
S
R
D
R
N
L
L
V
V
G
D
P
D
Q
S
I
Y
K
F
R
G
A
D
I
Q
N
I
L
D
F
Q
K
D
Y
P
D
A
K
V
Y
M
L
E
H
N
Y
R
S
S
A
R
V
L
E
A
A
N
K
L
I
E
N
N
T
E
R
L
D
K
T
L
K
P
V
K
E
A
G
Q
P
V
T
F
--
H
R
A
T
D
H
R
A
E
G
D
Y
V
A
D
W
L
T
R
L
H
G
E
G
R
A
W
S
E
M
A
I
L
Y
R
T
N
A
Q
S
R
V
I
E
E
S
L
R
R
V
Q
I
P
A
R
I
V
G
G
V
G
F
Y
D
R
R
E
I
R
D
I
L
A
Y
A
R
L
A
L
N
P
A
D
D
V
A
L
R
R
I
I
G
R
P
R
R
G
I
G
---
D
T
A
L
Q
K
L
M
E
W
A
R
T
H
H
T
S
V
L
T
A
C
A
N
A
A
E
Q
N
I
-
L
D
R
G
A
H
-
K
A
T
E
F
A
G
L
M
E
A
M
S
-
E
A
A
D
N
Y
E
P
A
A
-
F
L
R
F
V
M
E
T
S
G
Y
L
D
L
L
R
Q
E
-
G
---
Q
E
G
Q
V
R
L
E
N
L
E
E
L
V
S
A
A
E
E
W
S
Q
-----
D
E
A
N
V
G
G
S
I
A
D
F
L
D
D
A
A
L
---
L
S
S
V
D
----
D
-
M
R
T
K
A
E
N
KGAPE
D
A
V
T
L
M
T
L
H
N
A
K
G
L
E
F
P
V
V
F
I
V
G
V
E
Q
G
L
L
P
S
K
G
A
I
-
A
E
G
P
S
G
I
E
E
E
R
R
L
F
Y
V
G
I
T
R
A
M
E
R
L
L
M
T
A
A
Q
N
R
M
Q
F
G
K
T
N
A
A
E
D
S
A
F
L
E
D
I
-------------------------------------
11
PsiBlast_PDB
71.13
38%
-64
- C3 -
-
2PJR
1
?
A:
[10-546]
----
A
H
L
N
K
E
Q
Q
E
A
V
R
T
T
E
G
P
L
L
I
M
A
G
A
G
S
G
K
T
R
V
L
T
H
R
I
A
Y
L
M
A
E
K
H
V
A
P
W
N
I
L
A
I
T
F
T
N
K
A
A
R
E
M
R
E
R
V
Q
S
L
L
G
-
G
A
A
E
D
V
W
I
S
T
F
H
S
M
C
V
R
I
L
R
R
D
I
D
R
I
G
I
N
R
N
F
S
I
L
D
P
T
D
Q
L
S
V
M
K
T
I
L
K
E
K
N
I
D
P
--
K
K
F
E
P
--
R
T
I
-
L
G
T
I
S
A
A
K
N
E
L
L
P
P
E
Q
F
A
K
R
A
S
T
-----
Y
Y
E
K
V
V
S
D
V
Y
Q
E
Y
Q
Q
R
L
L
R
N
H
S
L
D
F
D
D
L
I
M
T
T
I
Q
L
F
D
R
V
P
D
V
L
H
Y
Y
Q
Y
K
F
Q
Y
I
H
I
D
E
Y
Q
D
T
N
R
A
Q
Y
T
L
V
K
K
L
A
E
R
F
Q
N
I
C
A
V
G
D
A
D
Q
S
I
Y
R
W
R
G
A
D
I
Q
N
I
L
S
F
E
R
D
Y
P
N
A
K
V
I
L
L
E
Q
N
Y
R
S
T
K
R
I
L
Q
A
A
N
E
V
I
E
H
N
V
N
R
K
P
K
R
I
W
T
E
N
P
E
G
K
P
I
L
Y
Y
E
A
M
N
E
A
D
E
A
Q
F
-
V
A
G
R
I
R
E
A
V
E
R
G
E
R
R
Y
R
D
F
A
V
L
Y
R
T
N
A
Q
S
R
V
M
E
E
M
L
L
K
A
N
I
P
Y
Q
I
V
G
G
L
K
F
Y
D
R
K
E
I
K
D
I
L
A
Y
L
R
V
I
A
N
P
D
D
D
L
S
L
L
R
I
I
N
V
P
K
R
G
I
G
---
A
S
T
I
D
K
L
V
R
Y
A
A
D
H
E
L
S
L
F
E
A
L
G
E
--
L
E
M
I
G
L
G
A
K
A
A
G
A
L
A
A
F
R
S
Q
L
E
Q
W
T
-
Q
L
Q
E
Y
V
S
V
T
E
-
L
V
E
E
V
L
D
K
S
G
Y
R
E
M
L
K
A
E
-
R
T
I
E
A
Q
--
S
R
L
E
N
L
D
E
F
L
S
V
T
K
H
F
E
N
V
S
---
D
D
K
S
L
I
A
F
L
T
D
L
A
----
L
---
I
S
D
L
D
----
E
-----------------------------------------------------------------------------------------------------------------------------------------
28
PsiBlast_CBE
71.10
38%
-61
- C3 -
-
2PJR
2
?
F:
[10-546]
----
A
H
L
N
K
E
Q
Q
E
A
V
R
T
T
E
G
P
L
L
I
M
A
G
A
G
S
G
K
T
R
V
L
T
H
R
I
A
Y
L
M
A
E
K
H
V
A
P
W
N
I
L
A
I
T
F
T
N
K
A
A
R
E
M
R
E
R
V
Q
S
L
L
G
-
G
A
A
E
D
V
W
I
S
T
F
H
S
M
C
V
R
I
L
R
R
D
I
D
R
I
G
I
N
R
N
F
S
I
L
D
P
T
D
Q
L
S
V
M
K
T
I
L
K
E
K
N
I
D
P
--
K
K
F
E
P
--
R
T
I
-
L
G
T
I
S
A
A
K
N
E
L
L
P
P
E
Q
F
A
K
R
A
S
T
-----
Y
Y
E
K
V
V
S
D
V
Y
Q
E
Y
Q
Q
R
L
L
R
N
H
S
L
D
F
D
D
L
I
M
T
T
I
Q
L
F
D
R
V
P
D
V
L
H
Y
Y
Q
Y
K
F
Q
Y
I
H
I
D
E
Y
Q
D
T
N
R
A
Q
Y
T
L
V
K
K
L
A
E
R
F
Q
N
I
C
A
V
G
D
A
D
Q
S
I
Y
R
W
R
G
A
D
I
Q
N
I
L
S
F
E
R
D
Y
P
N
A
K
V
I
L
L
E
Q
N
Y
R
S
T
K
R
I
L
Q
A
A
N
E
V
I
E
H
N
V
N
R
K
P
K
R
I
W
T
E
N
P
E
G
K
P
I
L
Y
Y
E
A
M
N
E
A
D
E
A
Q
F
-
V
A
G
R
I
R
E
A
V
E
R
G
E
R
R
Y
R
D
F
A
V
L
Y
R
T
N
A
Q
S
R
V
M
E
E
M
L
L
K
A
N
I
P
Y
Q
I
V
G
G
L
K
F
Y
D
R
K
E
I
K
D
I
L
A
Y
L
R
V
I
A
N
P
D
D
D
L
S
L
L
R
I
I
N
V
P
K
R
G
I
G
---
A
S
T
I
D
K
L
V
R
Y
A
A
D
H
E
L
S
L
F
E
A
L
G
E
--
L
E
M
I
G
L
G
A
K
A
A
G
A
L
A
A
F
R
S
Q
L
E
Q
W
T
-
Q
L
Q
E
Y
V
S
V
T
E
-
L
V
E
E
V
L
D
K
S
G
Y
R
E
M
L
K
A
E
-
R
T
I
E
A
Q
--
S
R
L
E
N
L
D
E
F
L
S
V
T
K
H
F
E
N
V
S
---
D
D
K
S
L
I
A
F
L
T
D
L
A
----
L
---
I
S
D
L
D
----
E
-----------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
70.93
37%
31
- C3 -
-
4C2T
1
?
A:
[13-662]
------
L
N
P
T
Q
A
Q
A
A
D
H
F
T
G
P
A
L
V
I
A
G
A
G
S
G
K
T
R
T
L
I
Y
R
I
A
H
L
I
G
H
Y
G
V
H
P
G
E
I
L
A
V
T
F
T
N
K
A
A
A
E
M
R
E
R
A
G
H
L
V
P
--
G
A
G
D
L
W
M
S
T
F
H
S
A
G
V
R
I
L
R
T
Y
G
E
H
I
G
L
R
R
G
F
V
I
Y
D
D
D
D
Q
L
D
I
I
K
E
V
M
G
S
I
P
G
I
G
--
A
E
T
Q
P
R
V
I
R
G
-
I
--
I
D
R
A
K
S
N
L
W
T
P
D
D
L
D
R
S
R
E
P
FISGL
P
R
D
A
A
-
A
E
A
Y
R
R
Y
E
V
R
K
K
G
Q
N
A
I
D
F
G
D
L
I
T
E
T
V
R
L
F
K
E
V
P
G
V
L
D
K
V
Q
N
K
A
K
F
I
H
V
D
E
Y
Q
D
T
N
R
A
Q
Y
E
L
T
R
L
L
A
S
R
D
R
N
L
L
V
V
G
D
P
D
Q
S
I
Y
K
F
R
G
A
D
I
Q
N
I
L
D
F
Q
K
D
Y
P
D
A
K
V
Y
M
L
E
H
N
Y
R
S
S
A
R
V
L
E
A
A
N
K
L
I
E
N
N
T
E
R
L
D
K
T
L
K
P
V
K
E
A
G
Q
P
V
T
F
--
H
R
A
T
D
H
R
A
E
G
D
Y
V
A
D
W
L
T
R
L
H
G
E
G
R
A
W
S
E
M
A
I
L
Y
R
T
N
A
Q
S
R
V
I
E
E
S
L
R
R
V
Q
I
P
A
R
I
V
G
G
V
G
F
Y
D
R
R
E
I
R
D
I
L
A
Y
A
R
L
A
L
N
P
A
D
D
V
A
L
R
R
I
I
G
R
P
R
R
G
I
G
---
D
T
A
L
Q
K
L
M
E
W
A
R
T
H
H
T
S
V
L
T
A
C
A
N
A
A
E
Q
N
I
-
L
D
R
G
A
H
-
K
A
T
E
F
A
G
L
M
E
A
M
S
-
E
A
A
D
N
Y
E
P
A
A
-
F
L
R
F
V
M
E
T
S
G
Y
L
D
L
L
R
Q
E
-
G
---
Q
E
G
Q
V
R
L
E
N
L
E
E
L
V
S
A
A
E
E
W
S
Q
-----
D
E
A
N
V
G
G
S
I
A
D
F
L
D
D
A
A
L
---
L
S
S
------
D
-
M
R
T
K
A
--E----
D
A
V
T
L
M
T
L
H
N
A
K
G
L
E
F
P
V
V
F
I
V
G
V
E
Q
G
L
L
P
S
K
G
A
I
-
A
E
G
P
S
G
I
E
E
E
R
R
L
F
Y
V
G
I
T
R
A
M
E
R
L
L
M
T
A
A
Q
N
R
M
Q
F
G
K
T
N
A
A
E
D
S
A
F
L
E
D
I
-----------
E
G
L
F
D
T
V
D
P
Y
G
Q
P
I
------------
23
PsiBlast_CBE
70.44
37%
34
- C3 -
-
4C2T
1
?
C:
[13-662]
------
L
N
P
T
Q
A
Q
A
A
D
H
F
T
G
P
A
L
V
I
A
G
A
G
S
G
K
T
R
T
L
I
Y
R
I
A
H
L
I
G
H
Y
G
V
H
P
G
E
I
L
A
V
T
F
T
N
K
A
A
A
E
M
R
E
R
A
G
H
L
V
P
--
G
A
G
D
L
W
M
S
T
F
H
S
A
G
V
R
I
L
R
T
Y
G
E
H
I
G
L
R
R
G
F
V
I
Y
D
D
D
D
Q
L
D
I
I
K
E
V
M
G
S
I
P
G
I
G
--
A
E
T
Q
P
R
V
I
R
G
-
I
--
I
D
R
A
K
S
N
L
W
T
P
D
D
L
D
R
S
R
E
P
FISGL
P
R
D
A
A
-
A
E
A
Y
R
R
Y
E
V
R
K
K
G
Q
N
A
I
D
F
G
D
L
I
T
E
T
V
R
L
F
K
E
V
P
G
V
L
D
K
V
Q
N
K
A
K
F
I
H
V
D
E
Y
Q
D
T
N
R
A
Q
Y
E
L
T
R
L
L
A
S
R
D
R
N
L
L
V
V
G
D
P
D
Q
S
I
Y
K
F
R
G
A
D
I
Q
N
I
L
D
F
Q
K
D
Y
P
D
A
K
V
Y
M
L
E
H
N
Y
R
S
S
A
R
V
L
E
A
A
N
K
L
I
E
N
N
T
E
R
L
D
K
T
L
K
P
V
K
E
A
G
Q
P
V
T
F
--
H
R
A
T
D
H
R
A
E
G
D
Y
V
A
D
W
L
T
R
L
H
G
E
G
R
A
W
S
E
M
A
I
L
Y
R
T
N
A
Q
S
R
V
I
E
E
S
L
R
R
V
Q
I
P
-
R
I
V
G
G
V
G
F
Y
D
R
R
E
I
R
D
I
L
A
Y
A
R
L
A
L
N
P
A
D
D
V
A
L
R
R
I
I
G
R
P
R
R
G
I
G
---
D
T
A
L
Q
K
L
M
E
W
A
R
T
H
H
T
S
V
L
T
A
C
A
N
A
A
E
Q
N
I
-
L
D
R
G
A
H
-
K
A
T
E
F
A
G
L
M
E
A
M
S
-
E
A
A
D
N
Y
E
P
A
A
-
F
L
R
F
V
M
E
T
S
G
Y
L
D
L
L
R
Q
E
------
E
G
Q
V
R
L
E
N
L
E
E
L
V
S
A
A
E
E
W
S
Q
-----
D
E
A
N
---
S
I
A
D
F
L
D
D
A
A
L
---
L
S
S
V
D
----
D
-
M
R
T
K
A
E
-PE---
D
A
V
T
L
M
T
L
H
N
A
K
G
L
E
F
P
V
V
F
I
V
G
V
E
Q
G
L
L
P
S
K
G
A
I
-
A
E
G
P
S
G
I
E
E
E
R
R
L
F
Y
V
G
I
T
R
A
M
E
R
L
L
M
T
A
A
Q
N
R
M
Q
F
G
K
T
N
A
A
E
D
S
A
F
L
E
D
I
-----------
E
G
L
F
D
T
V
D
P
Y
G
Q
P
I
------------