@TOME V2.3
(Nov 2016)
Ref.
-
-
Doc.
Global output mode :
Sort entries by :
Atome Result
Tools Result
PDB occurence
Core Structure Cluster
Sequence Color type :
Secondary Structure
Hydrophobicity
Disulfide Bonds
TCoffee Identity Score
Uniprot annotation
Core Structure Cluster
Contacts with Ligands
Show alignment :
Atome selection
All alignments
Only Template with Ligand
Column output:
Score:
Atome Rank Value
Tools Score
Hide column
Alignment:
Sequence Identity (%)
Tcoffee Alignment Score
Hide column
3D Common Core:
Tito PKB Score
Verify3D Score
QMean Score
Hide column
Structural Clustering:
Cluster Num
3D-Jury Struct. Score
Hide column
Modeller Result :
Model Rank
QMean Score
Dfire Score
Dope Score
Errat Score
Verify3D Score
Modeller Score
Hide column
Complexes Modeling
Show Ligands of Templates
Complexes Affinity Score
Main Binding Site Identity
Hide column
Templates Information:
Uniprot entry
Cath class
Scop class
Smart class
Prosite class
Pfam class
EC Number
Taxonomy
Experiment Method
Hide column
Sequence & Result Tab:
PDB Template Sequence
Complexes Tab
Values color: [
Good
|
Correct
|
Middling
|
Bad
]
Sequence color :
Mutated
Helix
Strand
Conserved
Query sequence : TTBK2_HUMAN: (2015-10-21 )
MSGGGEQLDILSVGILVKERWKVLRKIGGGGFGEIYDALDMLTRENVALKVESAQQPKQVLKMEVAVLKKLQGKDHVCRFIGCGRNDRFNYVVMQLQGRNLADLRRSQSRGTFTISTTLRLGRQILESIESIHSVGFLHRDIKPSNFAMGRFPSTCRKCYMLDFGLARQFTNSCGDVRPPRAVAGFRGTVRYASINAHRNREMGRHDDLWSLFYMLVEFVVGQLPWRKIKDKEQVGSIKERYDHRLMLKHLPPEFSIFLDHISSLDYFTKPDYQLLTSVFDNSIKTFGVIESDPFDWEKTGNDGSLTTTTTSTTPQLHTRLTPAAIGIANATPIPGDLLRENTDEVFPDEQLSDGENGIPVGVSPDKLPGSLGHPRPQEKDVWEEMDANKNKIKLGICKAATEEENSHGQANGLLNAPSLGSPIRVRSEITQPDRDIPLVRKLRSIHSFELEKRLTLEPKPDTDKFLETCLEKMQKDTSAGKESILPALLHKPCVPAVSRTDHIWHYDEEYLPDASKPASANTPEQADGGGSNGFIAVNLSSCKQEIDSKEWVIVDKEQDLQDFRTNEAVGHKTTGSPSDEEPEVLQVLEASPQDEKLQLGPWAENDHLKKETSGVVLALSAEGPPTAASEQYTDRLELQPGAASQFIAATPTSLMEAQAEGPLTAITIPRPSVASTQSTSGSFHCGQQPEKKDLQPMEPTVELYSPRENFSGLVVTEGEPPSGGSRTDLGLQIDHIGHDMLPNIRESNKSQDLGPKELPDHNRLVVREFENLPGETEEKSILLESDNEDEKLSRGQHCIEISSLPGDLVIVEKDHSATTEPLDVTKTQTFSVVPNQDKNNEIMKLLTVGTSEISSRDIDPHVEGQIGQVAEMQKNKISKDDDIMSEDLPGHQGDLSTFLHQEGKREKITPRNGELFHCVSENEHGAPTRKDMVRSSFVTRHSRIPVLAQEIDSTLESSSPVSAKEKLLQKKAYQPDLVKLLVEKRQFKSFLGDLSSASDKLLEEKLATVPAPFCEEEVLTPFSRLTVDSHLSRSAEDSFLSPIISQSRKSKIPRPVSWVNTDQVNSSTSSQFFPRPPPGKPPTRPGVEARLRRYKVLGSSNSDSDLFSRLAQILQNGSQKPRSTTQCKSPGSPHNPKTPPKSPVVPRRSPSASPRSSSLPRTSSSSPSRAGRPHHDQRSSSPHLGRSKSPPSHSGSSSSRRSCQQEHCKPSKNGLKGSGSLHHHSASTKTPQGKSKPASKLSR
Atome Classification :
(49 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......1160......1170......1180......1190......1200......1210......1220......1230......1240.
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
MSGGG
E
Q
L
D
I
L
S
V
G
I
L
-
V
K
E
R
W
K
V
L
R
K
IGGG
G
F
G
E
I
Y
D
A
L
D
M
L
TRE
N
V
A
L
K
VESAQ
Q
P
K
Q
V
L
K
M
E
V
A
V
L
K
K
LQG
K
D
H
V
C
R
F
IGCGRND
R
F
N
Y
V
V
M
Q
LQGR
N
L
A
D
L
R
RSQSR
G
T
F
T
I
S
T
T
L
R
L
G
R
Q
I
L
E
S
I
E
S
I
H
S
V
G
F
L
HRDIKPSNFAMGRF
P
S
--
T
C
R
K
C
Y
M
L
D
F
G
L
A
R
Q
F
T
N-SCGDVR-PP-
R
A
VAGFRG
T
V
R
Y
A
S
INAHRNREMGRH
D
D
L
W
S
L
F
Y
M
L
V
E
F
V
V
GQL
P
W
R
KIK------
D
K
------
E
Q
V
G
S
I
K
E
R
YD
H
----------
R
L
M
L
K
HLPP
E
F
S
I
F
L
D
H
I
S
SLDYFTKP
D
Y
Q
L
L
T
S
V
F
DNSI
K
T
F
G
V
IESDPFDWEKTGNDG
S
L
T
T
T
TTSTTP
Q
L
H
TRLTPAAIGIANATPI
P
G
D
L
L
RENTDEVFPDEQLSDGENGIPVGV
S
P
DKLPGSLGHPRPQ
E
K
D
V
W
E
E
MDANK
N
K
I
K
L
G
I
C
KAATEEENSHGQANGLLNAPSLGS
P
I
R
V
RSEITQPDRD
I
P
L
V
R
K
L
R
S
I
H
S
F
E
L
E
K
RLTLEPKP
D
T
D
K
F
L
E
T
C
L
E
K
M
Q
K
DTSA
G
K
E
S
I
L
P
A
L
L
HKPCVPAVSRTD
H
I
W
HY
D
E
E
YLPDASKPASANTPEQADGGGSN
G
F
I
A
V
N
L
S
S
C
K
Q
E
IDSKE
W
V
I
VDKEQ
D
L
Q
D
FRTNEAVGHKTTGSPSDE
E
P
E
V
L
Q
V
L
EASPQDE
K
L
QLGPWAENDHLKKETS
G
V
V
L
A
L
SAEGPPTAASEQYT
D
R
L
ELQPGAAS
Q
F
I
AAT
P
T
S
L
M
E
AQAEG
P
L
T
A
I
TIPRPSVASTQSTSGSFHCGQQPEKKDLQPMEPT
V
E
L
YSPRENFS
G
L
V
V
TEGEPPSGGSRT
D
L
G
L
Q
I
DHIG
H
D
MLP
N
I
R
ESNKSQDLGPKELPDHN
R
L
V
V
R
E
F
ENLPGETEE
K
S
I
L
L
ESDNE
D
E
K
L
SRG
Q
H
C
I
E
ISSLPG
D
L
V
I
V
EKDHSATTEP
L
D
VTK
T
Q
T
F
S
VVPNQDKN
N
E
I
M
K
L
L
TVGTSEISSRDIDPHVEGQ
I
G
Q
V
A
E
M
Q
K
NKISKDDDIMSEDLPGHQ
G
D
L
S
T
F
L
H
QEGKREKITPRNG
E
L
F
H
C
VSENEHGAP
T
R
K
D
M
V
R
S
S
F
V
T
RHSRI
P
V
L
A
Q
E
I
D
S
T
LESSSP
V
S
A
K
E
K
L
L
Q
KKAY
Q
P
D
L
V
K
L
L
V
E
K
R
Q
F
K
S
F
L
G
D
L
S
S
A
S
D
K
L
L
E
E
K
L
A
TVPAPF
C
E
E
E
V
L
T
P
F
S
R
L
T
V
D
S
H
LSRSA
E
D
S
F
L
S
P
I
I
S
Q
S
R
KSKIPRP
V
S
WVNTDQVNSSTSSQFFPRPPPGKPPTRP
G
V
E
A
R
L
R
R
Y
KVLGSSNS
D
S
D
L
F
S
R
L
A
Q
I
L
QNGSQKPRSTTQCKSPGSPHNPKTPPKSPVVPRRSPSASPRSSSLPRTSSSSPSRAGRPHHDQRSSSPHLGRSKSPPSHSGSS
S
S
R
R
S
C
Q
Q
EHCKPSKNGLKGSGS
L
H
HHSASTKTPQGKSK
P
A
S
KLSR
2
PsiBlast_PDB
95.62
83%
-93
- C3 -
4NFN
1
TTBK1_HUMAN
A:
[11-303]
--------
D
I
L
P
A
N
Y
V
-
V
K
D
R
W
K
V
L
K
K
I
G
G
G
G
F
G
E
I
Y
E
A
M
D
L
L
T
R
E
N
V
A
L
K
V
E
S
A
Q
Q
P
K
Q
V
L
K
M
E
V
A
V
L
K
K
L
Q
G
K
D
H
V
C
R
F
I
G
C
G
R
N
E
K
F
N
Y
V
V
M
Q
L
Q
G
R
N
L
A
D
L
R
R
S
Q
P
R
G
T
F
T
L
S
T
T
L
R
L
G
K
Q
I
L
E
S
I
E
A
I
H
S
V
G
F
L
H
R
D
I
K
P
S
N
F
A
M
G
R
L
P
S
--
T
Y
R
K
C
Y
M
L
D
F
G
L
A
R
Q
Y
T
N
-
T
T
G
D
V
R
-
P
P
-
R
N
V
A
G
F
R
G
T
V
R
Y
A
S
V
N
A
H
K
N
R
E
M
G
R
H
D
D
L
W
S
L
F
Y
M
L
V
E
F
A
V
G
Q
L
P
W
R
K
I
K
------
D
K
------
E
Q
V
G
M
I
K
E
K
Y
E
H
----------
R
M
L
L
K
H
M
P
S
E
F
H
L
F
L
D
H
I
A
S
L
D
Y
F
T
K
P
D
Y
Q
L
I
M
S
V
F
E
N
S
M
K
E
R
G
I
A
E
N
E
A
F
D
W
E
K
A
G
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
4
PsiBlast_PDB
95.30
84%
-96
- C3 -
4BTK
2
TTBK1_HUMAN
A:
[46-335]
--------
D
I
L
P
A
N
Y
V
-
V
K
D
R
W
K
V
L
K
K
I
G
G
---
G
E
I
Y
E
A
M
D
L
L
T
R
E
N
V
A
L
K
V
E
S
A
Q
Q
P
K
Q
V
L
K
M
E
V
A
V
L
K
K
L
Q
G
K
D
H
V
C
R
F
I
G
C
G
R
N
E
K
F
N
Y
V
V
M
Q
L
Q
G
R
N
L
A
D
L
R
R
S
Q
P
R
G
T
F
T
L
S
T
T
L
R
L
G
K
Q
I
L
E
S
I
E
A
I
H
S
V
G
F
L
H
R
D
I
K
P
S
N
F
A
M
G
R
L
P
S
--
T
Y
R
K
C
Y
M
L
D
F
G
L
A
R
Q
Y
T
N
-
T
T
G
D
V
R
-
P
P
-
R
N
V
A
G
F
R
G
T
V
R
Y
A
S
V
N
A
H
K
N
R
E
M
G
R
H
D
D
L
W
S
L
F
Y
M
L
V
E
F
A
V
G
Q
L
P
W
R
K
I
K
------
D
K
------
E
Q
V
G
M
I
K
E
K
Y
E
H
----------
R
M
L
L
K
H
M
P
S
E
F
H
L
F
L
D
H
I
A
S
L
D
Y
F
T
K
P
D
Y
Q
L
I
M
S
V
F
E
N
S
M
K
E
R
G
I
A
E
N
E
A
F
D
W
E
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
94.88
84%
-92
- C3 -
4BTM
3
TTBK1_HUMAN
B:
[45-337]
-------
A
D
I
L
P
A
N
Y
V
-
V
K
D
R
W
K
V
L
K
K
I
G
G
G
G
F
G
E
I
Y
E
A
M
D
L
L
T
R
E
N
V
A
L
K
V
E
S
A
Q
Q
P
K
Q
V
L
K
M
E
V
A
V
L
K
K
L
Q
G
K
D
H
V
C
R
F
I
G
C
G
R
N
E
K
F
N
Y
V
V
M
Q
L
Q
G
R
N
L
A
D
L
R
R
S
Q
P
R
G
T
F
T
L
S
T
T
L
R
L
G
K
Q
I
L
E
S
I
E
A
I
H
S
V
G
F
L
H
R
D
I
K
P
S
N
F
A
M
G
R
L
P
S
--
T
Y
R
K
C
Y
M
L
D
F
G
L
A
R
Q
Y
T
N
-
T
T
G
D
V
R
-
P
P
-
R
N
V
A
G
F
R
G
T
V
R
Y
A
S
V
N
A
H
K
N
R
E
M
G
R
H
D
D
L
W
S
L
F
Y
M
L
V
E
F
A
V
G
Q
L
P
W
R
K
I
K
------
D
K
------
E
Q
V
G
M
I
K
E
K
Y
E
H
----------
R
M
L
L
K
H
M
P
S
E
F
H
L
F
L
D
H
I
A
S
L
D
Y
F
T
K
P
D
Y
Q
L
I
M
S
V
F
E
N
S
M
K
E
R
G
I
A
E
N
E
A
F
D
W
E
K
A
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
94.63
84%
-93
- C3 -
4BTJ
1
TTBK1_HUMAN
B:
[45-337]
-------
A
D
I
L
P
A
N
Y
V
-
V
K
D
R
W
K
V
L
K
K
I
G
G
G
G
F
G
E
I
Y
E
A
M
D
L
L
T
R
E
N
V
A
L
K
V
E
S
A
Q
Q
P
K
Q
V
L
K
M
E
V
A
V
L
K
K
L
Q
G
K
D
H
V
C
R
F
I
G
C
G
R
N
E
K
F
N
Y
V
V
M
Q
L
Q
G
R
N
L
A
D
L
R
R
S
Q
P
R
G
T
F
T
L
S
T
T
L
R
L
G
K
Q
I
L
E
S
I
E
A
I
H
S
V
G
F
L
H
R
D
I
K
P
S
N
F
A
M
G
R
L
P
S
--
T
Y
R
K
C
Y
M
L
D
F
G
L
A
R
Q
Y
T
N
-
T
T
G
D
V
R
-
P
P
-
R
N
V
A
G
F
R
G
T
V
R
Y
A
S
V
N
A
H
K
N
R
E
M
G
R
H
D
D
L
W
S
L
F
Y
M
L
V
E
F
A
V
G
Q
L
P
W
R
K
I
K
------
D
K
------
E
Q
V
G
M
I
K
E
K
Y
E
H
----------
R
M
L
L
K
H
M
P
S
E
F
H
L
F
L
D
H
I
A
S
L
D
Y
F
T
K
P
D
Y
Q
L
I
M
S
V
F
E
N
S
M
K
E
R
G
I
A
E
N
E
A
F
D
W
E
K
A
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
3
PsiBlast_PDB
94.26
84%
-93
- C3 -
4BTJ
1
TTBK1_HUMAN
A:
[45-336]
-------
A
D
I
L
P
A
N
Y
V
-
V
K
D
R
W
K
V
L
K
K
I
G
G
G
G
F
G
E
I
Y
E
A
M
D
L
L
T
R
E
N
V
A
L
K
V
E
S
A
Q
Q
P
K
Q
V
L
K
M
E
V
A
V
L
K
K
L
Q
G
K
D
H
V
C
R
F
I
G
C
G
R
N
E
K
F
N
Y
V
V
M
Q
L
Q
G
R
N
L
A
D
L
R
R
S
Q
P
R
G
T
F
T
L
S
T
T
L
R
L
G
K
Q
I
L
E
S
I
E
A
I
H
S
V
G
F
L
H
R
D
I
K
P
S
N
F
A
M
G
R
L
P
S
--
T
Y
R
K
C
Y
M
L
D
F
G
L
A
R
Q
Y
T
N
-
T
T
G
D
V
R
-
P
P
-
R
N
V
A
G
F
R
G
T
V
R
Y
A
S
V
N
A
H
K
N
R
E
M
G
R
H
D
D
L
W
S
L
F
Y
M
L
V
E
F
A
V
G
Q
L
P
W
R
K
I
K
------
D
K
------
E
Q
V
G
M
I
K
E
K
Y
E
H
----------
R
M
L
L
K
H
M
P
S
E
F
H
L
F
L
D
H
I
A
S
L
D
Y
F
T
K
P
D
Y
Q
L
I
M
S
V
F
E
N
S
M
K
E
R
G
I
A
E
N
E
A
F
D
W
E
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
93.90
84%
-92
- C3 -
4BTM
1
TTBK1_HUMAN
A:
[45-336]
-------
A
D
I
L
P
A
N
Y
V
-
V
K
D
R
W
K
V
L
K
K
I
G
G
G
G
F
G
E
I
Y
E
A
M
D
L
L
T
R
E
N
V
A
L
K
V
E
S
A
Q
Q
P
K
Q
V
L
K
M
E
V
A
V
L
K
K
L
Q
G
K
D
H
V
C
R
F
I
G
C
G
R
N
E
K
F
N
Y
V
V
M
Q
L
Q
G
R
N
L
A
D
L
R
R
S
Q
P
R
G
T
F
T
L
S
T
T
L
R
L
G
K
Q
I
L
E
S
I
E
A
I
H
S
V
G
F
L
H
R
D
I
K
P
S
N
F
A
M
G
R
L
P
S
--
T
Y
R
K
C
Y
M
L
D
F
G
L
A
R
Q
Y
T
N
-
T
T
G
D
V
R
-
P
P
-
R
N
V
A
G
F
R
G
T
V
R
Y
A
S
V
N
A
H
K
N
R
E
M
G
R
H
D
D
L
W
S
L
F
Y
M
L
V
E
F
A
V
G
Q
L
P
W
R
K
I
K
------
D
K
------
E
Q
V
G
M
I
K
E
K
Y
E
H
----------
R
M
L
L
K
H
M
P
S
E
F
H
L
F
L
D
H
I
A
S
L
D
Y
F
T
K
P
D
Y
Q
L
I
M
S
V
F
E
N
S
M
K
E
R
G
I
A
E
N
E
A
F
D
W
E
K
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
38
PsiBlast_CBE
70.15
36%
-80
- C3 -
4KBA
1
KC1D_HUMAN
B:
[19-304]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
------
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
AAT
K
R
Q
K
Y
------
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
7
PsiBlast_PDB
70.03
36%
-83
- C3 -
3UYT
1
KC1D_HUMAN
A:
[7-292]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
---
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
T
K
R
Q
K
Y
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
68.52
36%
-83
- C3 -
4KBK
1
KC1D_HUMAN
A:
[19-304]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
--
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
------
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
AAT
K
R
Q
K
Y
------
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
PsiBlast_CBE
67.74
36%
-84
- C3 -
4KBK
1
KC1D_HUMAN
C:
[19-304]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
---
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
--------
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
AAT
K
R
Q
K
Y
------
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
41
PsiBlast_CBE
67.71
36%
-79
- C3 -
4KB8
1
KC1D_HUMAN
B:
[19-304]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
------
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
AAT
K
R
Q
K
Y
------
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
35
PsiBlast_CBE
67.68
36%
-82
- C3 -
4KBK
1
KC1D_HUMAN
B:
[19-304]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
--
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
AAT
K
R
Q
K
Y
------
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
PsiBlast_CBE
67.68
36%
-89
- C3 -
4KBK
1
KC1D_HUMAN
D:
[19-304]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
-----
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
-----
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
AAT
K
R
Q
K
Y
------
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
8
PsiBlast_PDB
67.46
36%
-79
- C3 -
3UZP
1
KC1D_HUMAN
A:
[5-292]
--------------
L
R
-
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
T
K
R
Q
K
Y
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
10
PsiBlast_PDB
67.25
36%
-79
- C3 -
4HGT
2
KC1D_HUMAN
A:
[11-292]
---------------------
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
---
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
T
K
R
Q
K
Y
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
37
PsiBlast_CBE
67.11
36%
-80
- C3 -
4KBA
1
KC1D_HUMAN
C:
[21-304]
-------------------
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
------------Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
AAT
K
R
Q
K
Y
------
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
28
PsiBlast_CBE
67.11
36%
-79
- C3 -
3UYT
1
KC1D_HUMAN
B:
[7-292]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
---
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
T
K
R
Q
K
Y
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
69
PsiBlast_CBE
66.88
31%
-70
- C3 -
1EH4
1
CKI1_SCHPO
B:
[7-295]
---------------
V
-
V
G
V
H
Y
K
V
G
R
R
I
G
E
G
S
F
G
V
I
F
E
G
T
N
L
L
N
N
Q
Q
V
A
I
K
F
E
P
R
R
S
D
A
P
Q
L
R
D
E
Y
R
T
Y
K
L
L
A
G
C
T
G
I
P
N
V
Y
Y
F
G
Q
E
G
L
H
N
V
L
V
I
D
L
L
G
P
S
L
E
D
L
L
D
L
C
G
R
-
K
F
S
V
K
T
V
A
M
A
A
K
Q
M
L
A
R
V
Q
S
I
H
E
K
S
L
V
Y
R
D
I
K
P
D
N
F
L
I
G
R
P
N
S
K-
N
A
N
M
I
Y
V
V
D
F
G
M
V
K
F
Y
R
D
-
P
V
T
K
Q
H
I
P
Y
-
R
E
K
K
N
L
S
G
T
A
R
Y
M
S
I
N
T
H
L
G
R
E
Q
S
R
R
D
D
L
E
A
L
G
H
V
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
AATNKQ
K
Y
------
E
R
I
G
E
K
K
Q
S
T
P
L
----------
R
E
L
C
A
G
F
P
E
E
F
Y
K
Y
M
H
Y
A
R
N
L
A
F
D
A
T
P
D
Y
D
Y
L
Q
G
L
F
S
K
V
L
E
R
L
N
T
T
E
D
E
N
F
D
W
N
L
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
71
PsiBlast_CBE
66.75
31%
-71
- C3 -
1CSN
1
CKI1_SCHPO
A:
[7-295]
---------------
V
-
V
G
V
H
Y
K
V
G
R
R
I
G
E
G
S
F
G
V
I
F
E
G
T
N
L
L
N
N
Q
Q
V
A
I
K
F
E
P
R
R
S
D
A
P
Q
L
R
D
E
Y
R
T
Y
K
L
L
A
G
C
T
G
I
P
N
V
Y
Y
F
G
Q
E
G
L
H
N
V
L
V
I
D
L
L
G
P
S
L
E
D
L
L
D
L
C
G
R
-
K
F
S
V
K
T
V
A
M
A
A
K
Q
M
L
A
R
V
Q
S
I
H
E
K
S
L
V
Y
R
D
I
K
P
D
N
F
L
I
G
R
P
N
S
K-
N
A
N
M
I
Y
V
V
D
F
G
M
V
K
F
Y
R
D
-
P
V
T
K
Q
H
I
P
Y
-
R
E
K
K
N
L
S
G
T
A
R
Y
M
S
I
N
T
H
L
G
R
E
Q
S
R
R
D
D
L
E
A
L
G
H
V
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
AAT
N
K
Q
K
Y
------
E
R
I
G
E
K
K
Q
S
T
P
L
----------
R
E
L
C
A
G
F
P
E
E
F
Y
K
Y
M
H
Y
A
R
N
L
A
F
D
A
T
P
D
Y
D
Y
L
Q
G
L
F
S
K
V
L
E
R
L
N
T
T
E
D
E
N
F
D
W
N
L
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
68
PsiBlast_CBE
66.64
31%
-78
* C3 *
2CSN
1
CKI1_SCHPO
A:
[6-294]
---------------
V
-
V
G
V
H
Y
K
V
G
R
R
I
G
E
G
S
F
G
V
I
F
E
G
T
N
L
L
N
N
Q
Q
V
A
I
K
F
E
P
R
R
S
D
A
P
Q
L
R
D
E
Y
R
T
Y
K
L
L
A
G
C
T
G
I
P
N
V
Y
Y
F
G
Q
E
G
L
H
N
V
L
V
I
D
L
L
G
P
S
L
E
D
L
L
D
L
C
G
R
-
K
F
S
V
K
T
V
A
M
A
A
K
Q
M
L
A
R
V
Q
S
I
H
E
K
S
L
V
Y
R
D
I
K
P
D
N
F
L
I
G
R
P
N
S
K-
N
A
N
M
I
Y
V
V
D
F
G
M
V
K
F
Y
R
D
-
P
V
T
K
Q
H
I
P
Y
-
R
E
K
K
N
L
S
G
T
A
R
Y
M
S
I
N
T
H
L
G
R
E
Q
S
R
R
D
D
L
E
A
L
G
H
V
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
AAT
N
K
Q
K
Y
------
E
R
I
G
E
K
K
Q
S
T
P
L
----------
R
E
L
C
A
G
F
P
E
E
F
Y
K
Y
M
H
Y
A
R
N
L
A
F
D
A
T
P
D
Y
D
Y
L
Q
G
L
F
S
K
V
L
E
R
L
N
T
T
E
D
E
N
F
D
W
N
L
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
66.50
36%
-83
- C3 -
3UYT
1
KC1D_HUMAN
D:
[6-292]
---------------
R
-
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
------------------
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
--------Y-----
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
66
PsiBlast_CBE
66.44
32%
-78
- C3 -
2IZS
2
KC1G3_HUMAN
A:
[4-293]
--------------
V
L
M
V
G
P
N
F
R
V
G
K
K
I
G
C
G
N
F
G
E
L
R
L
G
K
N
L
Y
T
N
E
Y
V
A
I
K
L
E
P
M
K
S
R
A
P
Q
L
H
L
E
Y
R
F
Y
K
Q
L
G
S
G
D
G
I
P
Q
V
Y
Y
F
G
P
C
G
K
Y
N
A
M
V
L
E
L
L
G
P
S
L
E
D
L
F
D
L
C
D
R
-
T
F
S
L
K
T
V
L
M
I
A
I
Q
L
I
S
R
M
E
Y
V
H
S
K
N
L
I
Y
R
D
V
K
P
E
N
F
L
I
G
R
-
P
G
NK
T
Q
Q
V
I
H
I
I
D
F
A
L
A
K
E
Y
I
D
P
E
T
K
K
H
I
-
P
Y
-
R
E
H
K
S
L
T
G
T
A
R
Y
M
S
I
N
T
H
L
G
K
E
Q
S
R
R
D
D
L
E
A
L
G
H
M
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
----------------
A
D
T
L
K
E
R
Y
Q
K
I
G
D
T
K
R
A
TP
I
E
V
L
C
E
N
F
-
P
E
M
A
T
Y
L
R
Y
V
R
R
L
D
F
F
E
K
P
D
Y
D
Y
L
R
K
L
F
T
D
L
F
D
R
K
G
Y
M
F
D
Y
E
Y
D
W
I
G
K
Q
L
P
T
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
57
PsiBlast_CBE
66.40
36%
-78
- C3 -
4TW9
3
KC1D_HUMAN
A:
[5-290]
-----------------
V
G
N
R
Y
R
L
G
N
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
KY----
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
K
F
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
9
PsiBlast_PDB
66.33
36%
-79
- C3 -
4HNF
1
KC1D_HUMAN
A:
[5-292]
--------------
L
R
-
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
---
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
T
K
R
Q
K
Y
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
15
PsiBlast_PDB
66.30
36%
-77
- C3 -
4TN6
1
?
A:
[5-290]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
T
K
R
Q
K
Y
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
27
PsiBlast_CBE
66.29
36%
-76
- C3 -
3UYT
1
KC1D_HUMAN
C:
[6-292]
---------------
R
-
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
------
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
T
K
R
Q
KY
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
66.25
36%
-74
- C3 -
4HNF
1
KC1D_HUMAN
B:
[7-292]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
T
K
R
Q
K
Y
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
36
PsiBlast_CBE
66.18
36%
-87
- C3 -
4KBA
1
KC1D_HUMAN
D:
[19-304]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
-----
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
-----
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
--------
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
AAT
K
R
Q
K
Y
------
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
67
PsiBlast_CBE
66.15
32%
-82
- C3 -
2IZR
2
KC1G3_HUMAN
A:
[4-293]
--------------
V
L
M
V
G
P
N
F
R
V
G
K
K
I
G
C
-
N
F
G
E
L
R
L
G
K
N
L
Y
T
N
E
Y
V
A
I
K
L
E
P
M
K
S
R
A
P
Q
L
H
L
E
Y
R
F
Y
K
Q
L
G
S
G
D
G
I
P
Q
V
Y
Y
F
G
P
C
G
K
Y
N
A
M
V
L
E
L
L
G
P
S
L
E
D
L
F
D
L
C
D
R
-
T
F
S
L
K
T
V
L
M
I
A
I
Q
L
I
S
R
M
E
Y
V
H
S
K
N
L
I
Y
R
D
V
K
P
E
N
F
L
I
G
R
-
P
G
NK
T
Q
Q
V
I
H
I
I
D
F
A
L
A
K
E
Y
I
D
P
E
T
K
K
H
I
-
P
Y
-
R
E
H
K
S
L
T
G
T
A
R
Y
M
S
I
N
T
H
L
G
K
E
Q
S
R
R
D
D
L
E
A
L
G
H
M
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
----------------
A
D
T
L
K
E
R
Y
Q
K
I
G
D
T
K
R
A
TP
I
E
V
L
C
E
N
F
-
P
E
M
A
T
Y
L
R
Y
V
R
R
L
D
F
F
E
K
P
D
Y
D
Y
L
R
K
L
F
T
D
L
F
D
R
K
G
Y
M
F
D
Y
E
Y
D
W
I
G
K
Q
L
P
T
P
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
66.15
36%
-85
- C3 -
4KBA
1
KC1D_HUMAN
A:
[19-304]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
--------------------
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
----------------
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
56
PsiBlast_CBE
66.01
36%
-81
- C3 -
4TW9
3
KC1D_HUMAN
B:
[5-290]
-----------------
V
G
N
R
Y
R
L
G
N
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
--------KY----
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
K
F
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
40
PsiBlast_CBE
65.99
36%
-78
- C3 -
4KB8
1
KC1D_HUMAN
C:
[21-304]
-------------------
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
------------Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
AAT
K
R
Q
K
Y
------
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
65
PsiBlast_CBE
65.98
32%
-81
- C3 -
2IZT
1
KC1G3_HUMAN
A:
[5-293]
---------------
L
M
V
G
P
N
F
R
V
G
K
K
I
G
C
--
F
G
E
L
R
L
G
K
N
L
Y
T
N
E
Y
V
A
I
K
L
E
P
M
K
S
R
A
P
Q
L
H
L
E
Y
R
F
Y
K
Q
L
G
S
G
D
G
I
P
Q
V
Y
Y
F
G
P
C
G
K
Y
N
A
M
V
L
E
L
L
G
P
S
L
E
D
L
F
D
L
C
D
R
-
T
F
S
L
K
T
V
L
M
I
A
I
Q
L
I
S
R
M
E
Y
V
H
S
K
N
L
I
Y
R
D
V
K
P
E
N
F
L
I
G
R
-
P
G
NK
T
Q
Q
V
I
H
I
I
D
F
A
L
A
K
E
Y
I
D
P
E
T
K
K
H
I
-
P
Y
-
R
E
H
K
S
L
T
G
T
A
R
Y
M
S
I
N
T
H
L
G
K
E
Q
S
R
R
D
D
L
E
A
L
G
H
M
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
----------------
A
D
T
L
K
E
R
Y
Q
K
I
G
D
T
K
R
A
TP
I
E
V
L
C
E
N
F
-
P
E
M
A
T
Y
L
R
Y
V
R
R
L
D
F
F
E
K
P
D
Y
D
Y
L
R
K
L
F
T
D
L
F
D
R
K
G
Y
M
F
D
Y
E
Y
D
W
I
G
K
Q
L
P
T
P
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
70
PsiBlast_CBE
65.60
31%
-69
- C3 -
1EH4
1
CKI1_SCHPO
A:
[7-295]
---------------
V
-
V
G
V
H
Y
K
V
G
R
R
I
G
E
G
S
F
G
V
I
F
E
G
T
N
L
L
N
N
Q
Q
V
A
I
K
F
E
P
R
R
S
D
A
P
Q
L
R
D
E
Y
R
T
Y
K
L
L
A
G
C
T
G
I
P
N
V
Y
Y
F
G
Q
E
G
L
H
N
V
L
V
I
D
L
L
G
P
S
L
E
D
L
L
D
L
C
G
R
-
K
F
S
V
K
T
V
A
M
A
A
K
Q
M
L
A
R
V
Q
S
I
H
E
K
S
L
V
Y
R
D
I
K
P
D
N
F
L
I
G
R
P
N
S
K-
N
A
N
M
I
Y
V
V
D
F
G
M
V
K
F
Y
R
D
-
P
V
T
K
Q
H
I
P
Y
-
R
E
K
K
N
L
S
G
T
A
R
Y
M
S
I
N
T
H
L
G
R
E
Q
S
R
R
D
D
L
E
A
L
G
H
V
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
AATNKQ
K
Y
------
E
R
I
G
E
K
K
Q
S
T
P
L
----------
R
E
L
C
A
G
F
P
E
E
F
Y
K
Y
M
H
Y
A
R
N
L
A
F
D
A
T
P
D
Y
D
Y
L
Q
G
L
F
S
K
V
L
E
R
L
N
T
T
E
D
E
N
F
D
W
N
L
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
65.37
36%
-82
- C3 -
4KBC
2
KC1D_HUMAN
A:
[5-290]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
S
----
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
T
K
R
Q
K
Y
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
55
PsiBlast_CBE
65.12
36%
-76
- C3 -
4TWC
4
KC1D_HUMAN
A:
[5-290]
-----------------
V
G
N
R
Y
R
L
G
N
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
-------
A
TKR
Q
K
Y
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
K
F
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
59
PsiBlast_CBE
65.06
32%
-80
- C3 -
2CHL
1
KC1G3_HUMAN
A:
[25-314]
--------------
V
L
M
V
G
P
N
F
R
V
G
K
K
I
G
C
G
N
F
G
E
L
R
L
G
K
N
L
Y
T
N
E
Y
V
A
I
K
L
E
P
M
K
S
R
A
P
Q
L
H
L
E
Y
R
F
Y
K
Q
L
G
S
G
D
G
I
P
Q
V
Y
Y
F
G
P
C
G
K
Y
N
A
M
V
L
E
L
L
G
P
S
L
E
D
L
F
D
L
C
D
R
-
T
F
S
L
K
T
V
L
M
I
A
I
Q
L
I
S
R
M
E
Y
V
H
S
K
N
L
I
Y
R
D
V
K
P
E
N
F
L
I
G
R
-
P
G
NK
T
Q
Q
V
I
H
I
I
D
F
A
L
A
K
E
Y
I
D
P
E
T
K
K
H
I
-
P
Y
-
R
E
H
K
S
L
T
G
T
A
R
Y
M
S
I
N
T
H
L
G
K
E
Q
S
R
R
D
D
L
E
A
L
G
H
M
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
----------------
A
D
T
L
K
E
R
Y
Q
K
I
G
D
T
K
R
A
TP
I
E
V
L
C
E
N
F
-
P
E
M
A
T
Y
L
R
Y
V
R
R
L
D
F
F
E
K
P
D
Y
D
Y
L
R
K
L
F
T
D
L
F
D
R
K
G
Y
M
F
D
Y
E
Y
D
W
I
G
K
Q
L
P
T
P
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
53
PsiBlast_CBE
64.76
36%
-79
- C3 -
4HNI
1
KC1E_HUMAN
B:
[3-292]
------------
M
E
L
R
-
V
G
N
K
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
A
N
I
A
S
G
E
E
V
A
I
K
L
E
C
V
---------
E
S
K
F
Y
K
M
M
Q
G
G
V
G
I
P
S
I
K
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
TKRQKY
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
S
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
54
PsiBlast_CBE
64.68
36%
-77
- C3 -
4TWC
6
KC1D_HUMAN
B:
[5-290]
-----------------
V
G
N
R
Y
R
L
G
N
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
-R
Q
K
Y
--
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
K
F
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
39
PsiBlast_CBE
64.36
36%
-85
- C3 -
4KB8
1
KC1D_HUMAN
D:
[19-304]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
-----
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
-----
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
---
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
AAT
K
R
Q
K
Y
------
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
64
PsiBlast_CBE
64.25
32%
-83
- C3 -
2IZU
2
KC1G3_HUMAN
A:
[4-293]
--------------
V
L
M
V
G
P
N
F
R
V
G
K
K
I
G
C
--
F
G
E
L
R
L
G
K
N
L
Y
T
N
E
Y
V
A
I
K
L
E
P
M
K
S
R
A
P
Q
L
H
L
E
Y
R
F
Y
K
Q
L
G
S
G
D
G
I
P
Q
V
Y
Y
F
G
P
C
G
K
Y
N
A
M
V
L
E
L
L
G
P
S
L
E
D
L
F
D
L
C
D
R
-
T
F
S
L
K
T
V
L
M
I
A
I
Q
L
I
S
R
M
E
Y
V
H
S
K
N
L
I
Y
R
D
V
K
P
E
N
F
L
I
G
R
-
P
G
NK
T
Q
Q
V
I
H
I
I
D
F
A
L
A
K
E
Y
I
D
P
E
T
K
K
H
I
-
P
Y
-
R
E
H
K
S
L
T
G
T
A
R
Y
M
S
I
N
T
H
L
G
K
E
Q
S
R
R
D
D
L
E
A
L
G
H
M
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
----------------
A
D
T
L
K
E
R
Y
Q
K
I
G
D
T
K
R
A
TP
I
E
V
L
C
E
N
F
-
P
E
M
A
T
Y
L
R
Y
V
R
R
L
D
F
F
E
K
P
D
Y
D
Y
L
R
K
L
F
T
D
L
F
D
R
K
G
Y
M
F
D
Y
E
Y
D
W
I
G
K
Q
L
P
T
P
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
61
PsiBlast_CBE
64.18
31%
-82
- C3 -
4HGL
1
KC1G3_HUMAN
A:
[5-293]
--------------
L
M
-
V
G
P
N
F
R
V
G
K
K
I
G
C
G
N
F
G
E
L
R
L
G
K
N
L
Y
T
N
E
Y
V
A
I
K
L
E
P
M
K
S
R
A
P
Q
L
H
L
E
Y
R
F
Y
K
Q
L
G
S
G
D
G
I
P
Q
V
Y
Y
F
G
P
C
G
K
Y
N
A
M
V
L
E
L
L
G
P
S
L
E
D
L
F
D
L
C
D
R
-
T
F
S
L
K
T
V
L
M
I
A
I
Q
L
I
S
R
M
E
Y
V
H
S
K
N
L
I
Y
R
D
V
K
P
E
N
F
L
I
G
R
-
P
G
NK
T
Q
Q
V
I
H
I
I
D
F
G
L
A
K
E
Y
I
D
P
E
T
K
K
H
I
-
P
Y
-
R
E
H
K
S
L
T
G
T
A
R
Y
M
S
I
N
T
H
L
G
K
E
Q
S
R
R
D
D
L
E
A
L
G
H
M
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
----------------
A
D
T
L
K
E
R
Y
Q
K
I
G
D
T
K
R
A
TP
I
E
V
L
C
E
N
F
-
P
E
M
A
T
Y
L
R
Y
V
R
R
L
D
F
F
E
K
P
D
Y
D
Y
L
R
K
L
F
T
D
L
F
D
R
K
G
Y
M
F
D
Y
E
Y
D
W
I
G
K
Q
L
P
T
P
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
PsiBlast_CBE
64.02
36%
-83
- C3 -
3UZP
1
KC1D_HUMAN
B:
[5-292]
--------------
L
R
-
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
---
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
-----
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
T
K
R
Q
K
Y
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
K
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
64.01
36%
-72
- C3 -
4HNI
1
KC1E_HUMAN
A:
[5-292]
--------------
L
R
-
V
G
N
K
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
A
N
I
A
S
G
E
E
V
A
I
K
L
E
C
V
-------
H
I
E
S
K
F
Y
K
M
M
Q
G
G
V
G
I
P
S
I
K
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
T
K
R
Q
K
Y
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
S
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
63.80
36%
-85
- C3 -
4KB8
1
KC1D_HUMAN
A:
[19-304]
-----------------
V
G
N
R
Y
R
L
G
R
K
I
G
S
G
S
F
G
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
K
T
K
H
P
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
--------------------
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
--------------
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
L
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
63
PsiBlast_CBE
63.71
31%
-84
- C3 -
4G16
1
KC1G3_HUMAN
A:
[5-293]
--------------
L
M
-
V
G
P
N
F
R
V
G
K
K
I
G
C
G
N
F
G
E
L
R
L
G
K
N
L
Y
T
N
E
Y
V
A
I
K
L
E
P
M
K
S
R
A
P
Q
L
H
L
E
Y
R
F
Y
K
Q
L
G
S
G
D
G
I
P
Q
V
Y
Y
F
G
P
C
G
K
Y
N
A
M
V
L
E
L
L
G
P
S
L
E
D
L
F
D
L
C
D
R
-
T
F
S
L
K
T
V
L
M
I
A
I
Q
L
I
S
R
M
E
Y
V
H
S
K
N
L
I
Y
R
D
V
K
P
E
N
F
L
I
G
R
-
P
G
NK
T
Q
Q
V
I
H
I
I
D
F
G
L
A
K
E
Y
I
D
P
E
T
K
K
H
I
-
P
Y
-
R
E
H
K
S
L
T
G
T
A
R
Y
M
S
I
N
T
H
L
G
K
E
Q
S
R
R
D
D
L
E
A
L
G
H
M
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
----------------
A
D
T
L
K
E
R
Y
Q
K
I
G
D
T
K
R
A
TP
I
E
V
L
C
E
N
F
-
P
E
M
A
T
Y
L
R
Y
V
R
R
L
D
F
F
E
K
P
D
Y
D
Y
L
R
K
L
F
T
D
L
F
D
R
K
G
Y
M
F
D
Y
E
Y
D
W
I
G
K
Q
L
P
T
P
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
62
PsiBlast_CBE
63.71
31%
-82
- C3 -
4G17
1
KC1G3_HUMAN
A:
[5-293]
--------------
L
M
-
V
G
P
N
F
R
V
G
K
K
I
G
C
G
N
F
G
E
L
R
L
G
K
N
L
Y
T
N
E
Y
V
A
I
K
L
E
P
M
K
S
R
A
P
Q
L
H
L
E
Y
R
F
Y
K
Q
L
G
S
G
D
G
I
P
Q
V
Y
Y
F
G
P
C
G
K
Y
N
A
M
V
L
E
L
L
G
P
S
L
E
D
L
F
D
L
C
D
R
-
T
F
S
L
K
T
V
L
M
I
A
I
Q
L
I
S
R
M
E
Y
V
H
S
K
N
L
I
Y
R
D
V
K
P
E
N
F
L
I
G
R
-
P
G
NK
T
Q
Q
V
I
H
I
I
D
F
G
L
A
K
E
Y
I
D
P
E
T
K
K
H
I
-
P
Y
-
R
E
H
K
S
L
T
G
T
A
R
Y
M
S
I
N
T
H
L
G
K
E
Q
S
R
R
D
D
L
E
A
L
G
H
M
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
----------------
A
D
T
L
K
E
R
Y
Q
K
I
G
D
T
K
R
A
TP
I
E
V
L
C
E
N
F
-
P
E
M
A
T
Y
L
R
Y
V
R
R
L
D
F
F
E
K
P
D
Y
D
Y
L
R
K
L
F
T
D
L
F
D
R
K
G
Y
M
F
D
Y
E
Y
D
W
I
G
K
Q
L
P
T
P
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
60
PsiBlast_CBE
63.51
31%
-83
- C3 -
4HGS
1
KC1G3_HUMAN
A:
[5-293]
--------------
L
M
-
V
G
P
N
F
R
V
G
K
K
I
G
C
G
N
F
G
E
L
R
L
G
K
N
L
Y
T
N
E
Y
V
A
I
K
L
E
P
M
K
S
R
A
P
Q
L
H
L
E
Y
R
F
Y
K
Q
L
G
S
G
D
G
I
P
Q
V
Y
Y
F
G
P
C
G
K
Y
N
A
M
V
L
E
L
L
G
P
S
L
E
D
L
F
D
L
C
D
R
-
T
F
S
L
K
T
V
L
M
I
A
I
Q
L
I
S
R
M
E
Y
V
H
S
K
N
L
I
Y
R
D
V
K
P
E
N
F
L
I
G
R
-
P
G
NK
T
Q
Q
V
I
H
I
I
D
F
G
L
A
K
E
Y
I
D
P
E
T
K
K
H
I
-
P
Y
-
R
E
H
K
S
L
T
G
T
A
R
Y
M
S
I
N
T
H
L
G
K
E
Q
S
R
R
D
D
L
E
A
L
G
H
M
F
M
Y
F
L
R
G
S
L
P
W
Q
G
L
K
----------------
A
D
T
L
K
E
R
Y
Q
K
I
G
D
T
K
R
A
TP
I
E
V
L
C
E
N
F
-
P
E
M
A
T
Y
L
R
Y
V
R
R
L
D
F
F
E
K
P
D
Y
D
Y
L
R
K
L
F
T
D
L
F
D
R
K
G
Y
M
F
D
Y
E
Y
D
W
I
G
K
Q
L
P
T
P
V
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
63.33
36%
-89
- C3 -
4HGT
2
KC1D_HUMAN
B:
[4-292]
-------------
E
L
R
-
V
G
N
R
Y
R
L
G
R
K
I
------
D
I
Y
L
G
T
D
I
A
A
G
E
E
V
A
I
K
L
E
C
V
-----
Q
L
H
I
E
S
K
I
Y
K
M
M
Q
G
G
V
G
I
P
T
I
R
W
C
G
A
E
G
D
Y
N
V
M
V
M
E
L
L
G
P
S
L
E
D
L
F
N
F
C
S
R
-
K
F
S
L
K
T
V
L
L
L
A
D
Q
M
I
S
R
I
E
Y
I
H
S
K
N
F
I
H
R
D
V
K
P
D
N
F
L
M
G
-
L
G
K
--
K
G
N
L
V
Y
I
I
D
F
G
L
A
K
K
Y
R
D
-
A
R
T
H
Q
H
-
I
P
Y
R
E
N
K
N
L
T
G
T
A
R
Y
A
S
I
N
T
H
L
G
I
E
Q
S
R
R
D
D
L
E
S
L
G
Y
V
L
M
Y
F
N
L
G
S
L
P
W
Q
G
L
K
------
A
A
T
K
R
Q
K
Y
E
R
I
S
E
K
K
M
S
T
P
I
----------
E
V
L
C
K
G
Y
P
S
E
F
A
T
Y
L
N
F
C
R
S
L
R
F
D
D
K
P
D
Y
S
Y
L
R
Q
L
F
R
N
L
F
H
R
Q
G
F
S
Y
D
Y
V
F
D
W
N
M
---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------