@TOME V2.3
(Nov 2016)
Ref.
-
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Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : PF02898_NOS2_HUMAN: (2014-10-03 )
MACPWKFLFKTKFHQYAMNGEKDINNNVEKAPCATSSPVTQDDLQYHNLSKQQNESPQPLVETGKKSPESLVKLDATPLSSPRHVRIKNWGSGMTFQDTLHHKAKGILTCRSKSCLGSIMTPKSLTRGPRDKPTPPDELLPQAIEFVNQYYGSFKEAKIEEHLARVEAVTKEIETTGTYQLTGDELIFATKQAWRNAPRCIGRIQWSNLQVFDARSCSTAREMFEHICRHVRYSTNNGNIRSAITVFPQRSDGKHDFRVWNAQLIRYAGYQMPDGSIRGDPANVEFTQLCIDLGWKPKYGRFDVVPLVLQANGRDPELFEIPPDLVLEVAMEHPKYEWFRELELKWYALPAVANMLLEVGGLEFPGCPFNGWYMGTEIGVRDFCDVQRYNILEEVGRRMGLETHKLASLWKDQAVVEINIAVLHSFQKQNVTIMDHHSAAESFMKYMQNEYRSRGGCPADWIWLVPPMSGSITPVFHQEMLNYVLSPFYYYQVEAWKTHVWQDEKRRPKRREIPLKVLVKAVLFACMLMRKTMASRVRVTILFATETGKSEALAWDLGALFSCAFNPKVVCMDKYRLSCLEEERLLLVVTSTFGNGDCPGNGEKLKKSLFMLKELNNKFRYAVFGLGSSMYPRFCAFAHDIDQKLSHLGASQLTPMGEGDELSGQEDAFRSWAVQTFKAACETFDVRGKQHIQIPKLYTSNVTWDPHHYRLVQDSQPLDLSKALSSMHAKNVFTMRLKSRQNLQSPTSSRATILVELSCEDGQGLNYLPGEHLGVCPGNQPALVQGILERVVDGPTPHQTVRLEALDESGSYWVSDKRLPPCSLSQALTYFLDITTPPTQLLLQKLAQVATEEPERQRLEALCQPSEYSKWKFTNSPTFLEVLEEFPSLRVSAGFLLSQLPILKPRFYSISSSRDHTPTEIHLTVAVVTYHTRDGQGPLHHGVCSTWLNSLKPQDPVPCFVRNASGFHLPEDPSHPCILIGPGTGIAPFRSFWQQRLHDSQHKGVRGGRMTLVFGCRRPDEDHIYQEEMLEMAQKGVLHAVHTAYSRLPGKPKVYVQDILRQQLASEVLRVLHKEPGHLYVCGDVRMARDVAHTLKQLVAAKLKLNEEQVEDYFFQLKSQKRYHEDIFGAVFPYEAKKDRVAVQPSSLEMSAL
Atome Classification :
(40 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.......710.......720.......730.......740.......750.......760.......770.......780.......790.......800.......810.......820.......830.......840.......850.......860.......870.......880.......890.......900.......910.......920.......930.......940.......950.......960.......970.......980.......990.......1000......1010......1020......1030......1040......1050......1060......1070......1080......1090......1100......1110......1120......1130......1140......1150
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MAC
P
W
K
F
L
F
K
T
K
F
H
Q
YAMNGEKDINNNVEKAPCATSSPV
T
Q
D
D
L
Q
YHNLSKQQNESPQ
P
L
V
E
TGKKS
P
E
S
L
V
K
LDATPLSSP
R
H
V
R
I
KNWGSGM
T
F
Q
D
T
L
H
H
KAK
G
I
L
T
CRSK
S
C
L
G
S
IM
T
P
K
S
LTRGPRDKPT
P
P
D
E
L
L
P
Q
A
I
E
F
V
N
Q
Y
Y
GS
F
K
E
A
K
I
E
E
H
L
A
R
V
E
A
V
T
K
E
IETT
G
T
Y
Q
LTGDE
L
I
F
A
T
K
Q
A
WRNA
P
R
C
I
G
R
I
Q
WS
N
L
Q
V
F
DARSC
S
T
A
R
E
M
F
E
H
I
C
R
H
V
R
YSTNNGN
I
R
S
A
I
T
V
F
PQRSDGKH
D
F
R
V
W
N
A
Q
L
I
R
YAGYQMPDGSIRGDPAN
V
E
F
T
Q
L
C
I
DLGWKPKYGRF
D
V
V
P
L
V
L
QANGRDP
E
L
FEI
P
P
D
L
V
L
E
V
A
M
EHP
K
Y
E
W
F
R
E
L
E
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
VGGLEFPGCPFN
G
W
Y
M
GTEIG
V
R
D
F
C
D
V
Q
R
Y
N
I
L
E
E
V
G
R
RMGL
E
T
H
K
L
A
S
L
WKD
Q
A
V
V
E
I
N
I
A
V
L
H
SFQKQ
N
V
T
I
M
D
H
H
S
A
A
E
S
F
M
K
Y
M
Q
N
E
Y
RSRGGCPA
D
W
I
W
L
VPPMSGSI
T
P
V
F
H
Q
E
M
L
N
Y
V
LSP
F
Y
Y
Y
Q
V
E
A
W
K
T
HVWQDEKRRPKRREI
P
L
K
V
L
V
K
A
V
L
F
A
C
M
L
M
R
K
T
M
ASR
V
R
V
T
I
L
F
A
TETGKS
E
A
L
A
W
D
L
G
A
L
F
S
CAFN
P
K
V
V
C
M
D
K
Y
R
L
S
CLEEE
R
L
L
L
V
V
T
STFGNGDCPG
N
G
E
K
L
K
K
S
L
F
M
L
K
ELNNK
F
R
Y
A
V
F
GLGSSM
Y
P
R
F
C
A
F
A
H
D
I
D
Q
K
L
S
HLG
A
S
QLTPMGEGDELS
G
Q
E
D
A
F
R
S
W
A
V
Q
T
F
K
A
A
C
E
TFDVRG
K
Q
H
I
QIP
K
L
YTSNVTWDPH
H
Y
R
LVQDSQPL
D
L
S
K
A
L
S
S
M
H
AK
N
V
F
T
M
R
LKSRQNLQSPTSS
R
A
T
I
L
V
E
L
SCEDGQGLNYLPGEHLGVCPGN
Q
P
A
L
V
Q
G
I
L
E
R
VVDGPTPH
Q
T
V
R
L
E
A
LDESG
S
Y
WVSDKRLP
P
C
S
L
S
Q
A
L
T
Y
F
L
DITT
P
P
T
Q
L
L
L
Q
K
L
A
Q
V
ATEE
P
E
R
Q
R
L
E
A
LCQPSEYSKWKFTNS
P
T
F
L
E
V
L
E
EFPSLR
V
S
A
G
F
L
L
S
QLPILK
P
R
F
Y
SISSSRDHTP
T
E
I
H
L
T
V
A
V
V
T
Y
HTRDGQG
P
L
H
H
G
V
C
S
T
W
L
N
SLKPQDPV
P
C
F
V
RNASGFHLPEDPSH
P
C
I
L
IGPGTG
I
A
P
F
R
S
F
W
Q
Q
R
LHDSQHKGVRGG
R
M
T
L
V
F
GCRRPDEDH
I
Y
Q
E
E
M
L
E
M
A
Q
K
G
V
L
H
A
V
H
T
A
Y
S
RLPGK
P
K
V
Y
V
Q
D
I
L
R
Q
Q
L
A
S
E
V
L
R
V
L
HKEPG
H
L
Y
V
CG
D
V
R
M
A
R
D
V
A
H
T
L
K
Q
L
V
A
A
K
LKL
N
E
E
Q
V
E
D
Y
F
F
Q
L
K
SQ
K
R
Y
H
E
D
I
F
GAVFPYEAKK
D
R
V
A
VQPSSLEMSAL
10
PsiBlast_PDB
58.74
85%
-94
- C1 -
1M8D
3
NOS2_MOUSE
A:
[13-433]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
-----
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
45
PsiBlast_CBE
57.33
85%
-97
- C1 -
3EBF
3
NOS2_MOUSE
A:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
K
S
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
57
PsiBlast_CBE
57.01
85%
-96
- C1 -
3E65
3
NOS2_MOUSE
B:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
K
S
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
56.24
85%
-95
* C1 *
3EBD
3
NOS2_MOUSE
A:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
K
S
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
56.17
85%
-97
- C1 -
3EAI
3
NOS2_MOUSE
A:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
K
S
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
47
PsiBlast_CBE
55.41
85%
-97
- C1 -
3EAI
3
NOS2_MOUSE
B:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
K
S
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
55.01
85%
-94
- C1 -
3E7M
5
NOS2_MOUSE
A:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
-----
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
44
PsiBlast_CBE
54.55
85%
-94
- C1 -
3EBF
3
NOS2_MOUSE
B:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
K
S
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
49
PsiBlast_CBE
53.29
85%
-95
- C1 -
3E7M
3
NOS2_MOUSE
B:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
K
S
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
46
PsiBlast_CBE
52.95
85%
-95
- C1 -
3EBD
3
NOS2_MOUSE
B:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
K
S
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
PsiBlast_CBE
52.20
85%
-95
- C1 -
3NQS
7
NOS2_MOUSE
A:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
---------
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
41
PsiBlast_CBE
51.39
85%
-94
- C1 -
1M8D
5
NOS2_MOUSE
B:
[13-433]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
--------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
59
PsiBlast_CBE
51.37
85%
-96
- C1 -
2Y37
4
NOS2_MOUSE
A:
[12-431]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
---------
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
42
PsiBlast_CBE
51.06
85%
-94
- C1 -
3NQS
6
NOS2_MOUSE
B:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
---------
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
50.79
85%
-94
- C1 -
1M9T
5
NOS2_MOUSE
A:
[13-433]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
--------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
54
PsiBlast_CBE
48.64
85%
-93
- C1 -
3E6L
4
NOS2_MOUSE
B:
[12-431]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
-------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
14
PsiBlast_PDB
48.61
85%
-92
- C1 -
3E6L
4
NOS2_MOUSE
A:
[12-431]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
-------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
58
PsiBlast_CBE
48.54
85%
-94
- C1 -
2Y37
4
NOS2_MOUSE
B:
[12-431]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
--------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
56
PsiBlast_CBE
46.47
85%
-96
- C1 -
3E67
3
NOS2_MOUSE
B:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
--------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
38
PsiBlast_CBE
46.32
85%
-94
- C1 -
1M8I
3
NOS2_MOUSE
B:
[13-433]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
---------
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
45.83
85%
-94
- C1 -
3E6N
3
NOS2_MOUSE
A:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
--------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
50
PsiBlast_CBE
45.41
85%
-91
- C1 -
3E7I
3
NOS2_MOUSE
B:
[12-431]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
K
S
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
37
PsiBlast_CBE
44.87
85%
-94
- C1 -
1M9T
4
NOS2_MOUSE
B:
[13-433]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
---------
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
53
PsiBlast_CBE
44.27
85%
-92
- C1 -
3E6N
3
NOS2_MOUSE
B:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
--------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
39
PsiBlast_CBE
42.19
85%
-94
- C1 -
1M8H
3
NOS2_MOUSE
B:
[13-433]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
---------
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
41.38
85%
-92
- C1 -
1M8I
3
NOS2_MOUSE
A:
[13-433]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
--------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
40.82
85%
-96
- C1 -
3E67
3
NOS2_MOUSE
A:
[12-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
--------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
60
PsiBlast_CBE
40.24
85%
-98
- C1 -
1R35
3
NOS2_MOUSE
B:
[12-431]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
-------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
40.14
85%
-98
- C1 -
1R35
3
NOS2_MOUSE
A:
[12-431]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
-------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
39.25
85%
-91
- C1 -
1M8H
3
NOS2_MOUSE
A:
[13-433]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
--------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
N
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
36
PsiBlast_CBE
36.02
85%
-96
- C1 -
1QOM
2
NOS2_MOUSE
B:
[13-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
K
S
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
51
PsiBlast_CBE
34.25
85%
-96
- C1 -
3E6T
3
NOS2_MOUSE
B:
[12-430]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
---------
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
6
PsiBlast_PDB
32.07
85%
-97
- C1 -
1QOM
2
NOS2_MOUSE
A:
[13-432]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
K
S
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
30.21
85%
-98
- C1 -
3E7T
3
NOS2_MOUSE
A:
[12-431]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
-------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
52
PsiBlast_CBE
28.96
85%
-97
- C1 -
3E6O
3
NOS2_MOUSE
B:
[12-430]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
---------
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
28.79
85%
-101
- C1 -
1M8E
3
NOS2_MOUSE
A:
[13-431]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
-------
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
55
PsiBlast_CBE
28.13
85%
-98
- C1 -
3E68
7
NOS2_MOUSE
B:
[12-430]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
---------
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
48
PsiBlast_CBE
27.93
85%
-97
- C1 -
3E7T
3
NOS2_MOUSE
B:
[12-431]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
-------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
27.67
85%
-95
- C1 -
3E7I
4
NOS2_MOUSE
A:
[12-431]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
S
D
F
T
C
K
S
K
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
Q
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
40
PsiBlast_CBE
24.55
85%
-100
- C1 -
1M8E
3
NOS2_MOUSE
B:
[13-431]
----------------------------------------------------------------------------------
Q
Y
V
R
I
K
N
W
G
S
G
E
I
L
H
D
T
L
H
H
K
A
T
--------
S
C
L
G
S
I
M
N
P
K
S
L
T
R
G
P
R
D
K
P
T
P
L
E
E
L
L
P
H
A
I
E
F
I
N
Q
Y
Y
G
S
F
K
E
A
K
I
E
E
H
L
A
R
L
E
A
V
T
K
E
I
E
T
T
G
T
Y
Q
L
T
L
D
E
L
I
F
A
T
K
M
A
W
R
N
A
P
R
C
I
G
R
I
Q
W
S
N
L
Q
V
F
D
A
R
N
C
S
T
A
Q
E
M
F
Q
H
I
C
R
H
I
L
Y
A
T
N
N
G
N
I
R
S
A
I
T
V
F
P
Q
R
S
D
G
K
H
D
F
R
L
W
N
S
Q
L
I
R
Y
A
G
Y
Q
M
P
D
G
T
I
R
G
D
A
A
T
L
E
F
T
Q
L
C
I
D
L
G
W
K
P
R
Y
G
R
F
D
V
L
P
L
V
L
Q
A
D
G
Q
D
P
E
V
F
E
I
P
P
D
L
V
L
E
V
T
M
E
H
P
K
Y
E
W
F
Q
E
L
G
L
K
W
Y
A
L
P
A
V
A
N
M
L
L
E
V
G
G
L
E
F
P
A
C
P
F
N
G
W
Y
M
G
T
E
I
G
V
R
D
F
C
D
T
Q
R
Y
N
I
L
E
E
V
G
R
R
M
G
L
E
T
H
T
L
A
S
L
W
K
D
R
A
V
T
E
I
N
V
A
V
L
H
S
F
Q
K
Q
N
V
T
I
M
D
H
H
T
A
S
E
S
F
M
K
H
M
Q
N
E
Y
R
A
R
G
G
C
P
A
D
W
I
W
L
V
P
P
V
S
G
S
I
T
P
V
F
H
Q
E
M
L
N
Y
V
L
S
P
F
Y
Y
Y
Q
I
E
P
W
K
T
H
I
W
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------