@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 : TTBK1_HUMAN: (2015-10-21 )
MQCLAAALKDETNMSGGGEQADILPANYVVKDRWKVLKKIGGGGFGEIYEAMDLLTRENVALKVESAQQPKQVLKMEVAVLKKLQGKDHVCRFIGCGRNEKFNYVVMQLQGRNLADLRRSQPRGTFTLSTTLRLGKQILESIEAIHSVGFLHRDIKPSNFAMGRLPSTYRKCYMLDFGLARQYTNTTGDVRPPRNVAGFRGTVRYASVNAHKNREMGRHDDLWSLFYMLVEFAVGQLPWRKIKDKEQVGMIKEKYEHRMLLKHMPSEFHLFLDHIASLDYFTKPDYQLIMSVFENSMKERGIAENEAFDWEKAGTDALLSTSTSTPPQQNTRQTAAMFGVVNVTPVPGDLLRENTEDVLQGEHLSDQENAPPILPGRPSEGLGPSPHLVPHPGGPEAEVWEETDVNRNKLRINIGKSPCVEEEQSRGMGVPSSPVRAPPDSPTTPVRSLRYRRVNSPESERLSTADGRVELPERRSRMDLPGSPSRQACSSQPAQMLSVDTGHADRQASGRMDVSASVEQEALSNAFRSVPLAEEEDFDSKEWVIIDKETELKDFPPGAEPSTSGTTDEEPEELRPLPEEGEERRRLGAEPTVRPRGRSMQALAEEDLQHLPPQPLPPQLSQGDGRSETSQPPTPGSPSHSPLHSGPRPRRRESDPTGPQRQVFSVAPPFEVNGLPRAVPLSLPYQDFKRDLSDYRERARLLNRVRRVGFSHMLLTTPQVPLAPVQPQANGKEEEEEEEEDEEEEEEDEEEEEEEEEEEEEEEEEEEEEEEAAAAVALGEVLGPRSGSSSEGSERSTDRSQEGAPSTLLADDQKESRGRASMADGDLEPEEGSKTLVLVSPGDMKKSPVTAELAPDPDLGTLAALTPQHERPQPTGSQLDVSEPGTLSSVLKSEPKPPGPGAGLGAGTVTTGVGGVAVTSSPFTKVERTFVHIAEKTHLNVMSSGGQALRSEEFSAGGELGLELASDGGAVEEGARAPLENGLALSGLNGAEIEGSALSGAPRETPSEMATNSLPNGPALADGPAPVSPLEPSPEKVATISPRRHAMPGSRPRSRIPVLLSEEDTGSEPSGSLSAKERWSKRARPQQDLARLVMEKRQGRLLLRLASGASSSSSEEQRRASETLSGTGSEEDTPASEPAAALPRKSGRAAATRSRIPRPIGLRMPMPVAAQQPASRSHGAAPALDTAITSRLQLQTPPGSATAADLRPKQPPGRGLGPGRAQAGARPPAPRSPRLPASTSAARNASASPRSQSLSRRESPSPSHQARPGVPPPRGVPPARAQPDGTPSPGGSKKGPRGKLQAQRATTKGRAGGAEGRAGAR
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......1250......1260......1270......1280......1290......1300......1310......1320
(Atome)
(Ident)
(Tito)
(Num)
(Ligand)
(Uniprot)
M
Q
C
L
A
A
A
L
KDETNMSGGGEQ
A
D
ILPANY
V
V
K
D
R
W
K
V
L
K
K
IGGG
G
F
G
E
I
Y
E
A
M
D
L
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
IGCGRN
E
K
F
N
Y
V
V
M
Q
LQGR
N
L
A
D
L
RRSQPR
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
HRDIKPSNFAMGRL
P
S
-
T
Y
R
K
C
Y
M
LDFG
L
A
R
Q
YTN-T-TGDVRPPRNVAGFR
G
T
V
R
Y
A
S
VNAHKNREMGRH
D
D
L
W
S
L
F
Y
M
L
V
E
F
A
VGQL
P
W
R
KIK
D
K
------
E
Q
V
G
M
I
K
E
K
Y
E
H
----------
R
M
L
L
K
HMP
S
E
F
H
L
F
L
D
H
I
A
SLDYFTKP
D
Y
Q
L
I
M
S
V
F
E
N
S
M
K
ERGIAENEAFDWEKAGTD
A
L
LSTSTSTPPQQ
N
T
R
Q
T
A
A
M
F
G
V
V
NVTPV
P
G
D
L
L
REN
T
E
D
V
LQGEHLSDQENAPPILPGRPSEGLGPSPHLVPHPGGPEAEVWEETDVNR
N
K
L
R
I
NIGKSPC
V
E
E
E
Q
SRGMGVPSSPVRAPPDSPTT
P
V
R
S
L
R
Y
RRVNSP
E
S
ERLSTADG
R
V
EL
P
E
R
RSRMDLPGSPS
R
Q
A
C
SSQP
A
Q
M
L
S
VDTGHADRQASGRMDV
S
A
S
V
E
Q
E
A
L
S
N
A
F
RSVPLAEEEDFDSK
E
W
V
I
IDKETELKDFPPGAEPSTSGTTDEE
P
E
E
LRPLPEE
G
E
E
R
R
RLGAEPTVRPRG
R
S
M
Q
A
L
A
E
E
D
L
Q
HLPPQPLPPQLSQGDGRSETSQPPTPGSPSHSPLHSGPRPRRRESDPTGPQR
Q
V
F
SVAPPFEVNGLPRAVPLSL
P
Y
Q
D
F
K
R
D
L
S
D
Y
R
E
R
A
R
L
L
N
R
V
R
R
VGFS
H
M
L
L
TTPQVPLAPVQPQANGKEEEEEEEEDEEEEEEDE
E
E
E
E
E
E
E
E
E
E
E
E
E
E
E
E
E
E
E
E
E
E
A
A
A
A
V
A
L
G
E
V
LGPRSGSSSEGSERSTDRSQEGAPSTLLADD
Q
K
ESRGRASMADGDLEPEEG
S
K
T
L
V
L
VSPGDMKKSPVTAELAPDPDLG
T
L
A
ALTPQHERPQPTGSQLDVSEP
G
T
L
S
S
V
L
KSEPKPPGPGAGLGA
G
T
V
TTGVG
G
V
A
VTSSP
F
T
K
V
E
R
T
F
V
H
I
AE
K
T
H
L
N
V
MSSGGQ
A
L
R
S
EEFSAGGEL
G
L
E
LASDGGAVEEGARAPLENG
L
A
LSGLNGAEIEGSALSGAPRE
T
P
S
E
M
ATNSLPNGPALADGPAPVSPLEPSPE
K
V
A
TISPRRHAMPGSRPRSRI
P
V
L
L
SEEDTGSEPSGS
L
S
A
K
E
R
W
S
KRAR
P
Q
Q
D
L
A
R
L
V
M
E
KRQ
G
R
L
L
L
R
L
ASGASSS
S
S
E
E
Q
R
R
A
S
ETLSGTGSEEDTPASE
P
A
A
ALPRKSGRAAATRSRIPRPIGLRMPMPVAAQQPASRSHGAA
P
A
L
D
T
A
I
TS
R
L
Q
L
QTPPGSATAADLRPKQPPGRGLGPGRAQAGARPPAPRSPRLPASTSAARNASASP
R
S
QSLSRRESPSPSHQARPGVPPPRGVPPARAQPDGTPSPGGSKKGPRG
K
L
Q
A
QRATTKGRAGGAEGRAGAR
3
PsiBlast_PDB
93.51
100%
-97
- C2 -
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
--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
5
PsiBlast_PDB
93.25
99%
-95
- C2 -
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
92.43
100%
-94
- C2 -
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
2
PsiBlast_PDB
92.39
100%
-95
- C2 -
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
22
PsiBlast_CBE
92.38
100%
-95
- C2 -
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
21
PsiBlast_CBE
91.65
100%
-94
- C2 -
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
67
PsiBlast_CBE
72.07
32%
-81
- C2 -
2IZR
2
KC1G3_HUMAN
A:
[6-293]
----------------------------
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
N
K
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
T
P
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
28
PsiBlast_CBE
72.05
37%
-82
- C2 -
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
A
A
------
T
K
----
R
Q
K
Y
E
R
I
S
E
K
K
M
S
TP
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
71.83
37%
-81
- C2 -
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
TP
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
17
PsiBlast_PDB
71.77
37%
-85
- C2 -
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
A
A
------
T
K
----
R
Q
K
Y
E
R
I
S
E
K
K
M
S
TP
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
13
PsiBlast_PDB
71.66
37%
-78
- C2 -
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
TP
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
71.62
37%
-84
- C2 -
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
TP
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
31
PsiBlast_CBE
71.57
37%
-81
- C2 -
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
A
A
------
T
K
----
R
Q
K
Y
E
R
I
S
E
K
K
M
S
TP
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
66
PsiBlast_CBE
71.50
32%
-78
- C2 -
2IZS
2
KC1G3_HUMAN
A:
[6-293]
----------------------------
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
N
K
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
T
P
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
65
PsiBlast_CBE
71.32
32%
-82
- C2 -
2IZT
1
KC1G3_HUMAN
A:
[6-293]
----------------------------
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
N
K
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
T
P
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
42
PsiBlast_CBE
71.30
37%
-78
- C2 -
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
TP
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
24
PsiBlast_CBE
71.28
37%
-86
- C2 -
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
A
A
------
T
K
----
R
Q
K
Y
E
R
I
S
E
K
K
M
S
TP
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
71.25
32%
-80
- C2 -
2CHL
1
KC1G3_HUMAN
A:
[27-314]
----------------------------
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
N
K
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
T
P
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
32
PsiBlast_CBE
71.03
37%
-72
- C2 -
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
TP
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
70.99
37%
-77
- C2 -
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
MS
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
70.83
32%
-82
- C2 -
2IZU
2
KC1G3_HUMAN
A:
[6-293]
----------------------------
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
N
K
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
T
P
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
26
PsiBlast_CBE
70.83
37%
-87
- C2 -
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
A
A
------
T
K
----
R
Q
K
Y
E
R
I
S
E
K
K
M
S
TP
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
30
PsiBlast_CBE
70.78
37%
-79
- C2 -
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
A
A
------
T
K
----
R
Q
K
Y
E
R
I
S
E
K
K
M
S
TP
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
23
PsiBlast_CBE
70.62
37%
-90
- C2 -
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
A
A
------
T
K
----
R
Q
K
Y
E
R
I
S
E
K
K
M
S
TP
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
11
PsiBlast_PDB
70.57
37%
-78
- C2 -
3UZP
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
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
TP
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
20
PsiBlast_PDB
70.50
37%
-76
- C2 -
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
------
T
K
----
R
Q
K
Y
E
R
I
S
E
K
K
M
S
TP
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
18
PsiBlast_PDB
70.48
37%
-77
- C2 -
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
TP
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
62
PsiBlast_CBE
70.34
33%
-82
- C2 -
4G16
1
KC1G3_HUMAN
A:
[6-293]
----------------------------
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
N
K
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
T
P
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
12
PsiBlast_PDB
70.32
37%
-77
- C2 -
4HNF
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
TP
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
61
PsiBlast_CBE
70.31
33%
-79
- C2 -
4G17
1
KC1G3_HUMAN
A:
[6-293]
----------------------------
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
N
K
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
T
P
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
27
PsiBlast_CBE
70.27
37%
-80
- C2 -
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
A
A
------
T
K
----
R
Q
K
Y
E
R
I
S
E
K
K
M
S
TP
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
60
PsiBlast_CBE
70.19
33%
-80
- C2 -
4HGL
1
KC1G3_HUMAN
A:
[6-293]
----------------------------
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
N
K
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
T
P
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
34
PsiBlast_CBE
70.09
37%
-80
- C2 -
3UZP
1
KC1D_HUMAN
B:
[7-292]
-----------------------------
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
TP
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
56
PsiBlast_CBE
70.04
36%
-76
- C2 -
4HNI
1
KC1E_HUMAN
B:
[7-292]
-----------------------------
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
------
T
K
----
R
Q
K
Y
E
R
ISEKKMSTPI
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
36
PsiBlast_CBE
69.93
37%
-77
- C2 -
3UYT
1
KC1D_HUMAN
C:
[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
------
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
-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
43
PsiBlast_CBE
69.84
37%
-82
- C2 -
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
----------------
K
Y
E
R
I
S
E
K
K
M
S
TP
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
29
PsiBlast_CBE
69.74
37%
-86
- C2 -
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
A
A
------
T
K
----
R
Q
K
Y
E
R
I
S
E
K
K
M
S
TP
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
25
PsiBlast_CBE
69.60
37%
-82
- C2 -
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
A
A
------
T
K
----
R
Q
K
Y
E
R
I
S
E
K
K
M
S
TP
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
16
PsiBlast_PDB
69.36
37%
-87
- C2 -
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
TP
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
69.35
37%
-84
- C2 -
3UYT
1
KC1D_HUMAN
D:
[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
-----------------
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
ISEKKMSTPI
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
69.35
37%
-87
- C2 -
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
TP
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
59
PsiBlast_CBE
69.33
33%
-81
- C2 -
4HGS
1
KC1G3_HUMAN
A:
[6-293]
----------------------------
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
N
K
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
T
P
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
19
PsiBlast_PDB
68.59
37%
-82
- C2 -
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
--------------
K
Y
E
R
I
S
E
K
K
M
S
TP
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
----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
57
PsiBlast_CBE
68.57
36%
-71
- C2 -
4HNI
1
KC1E_HUMAN
A:
[7-292]
-----------------------------
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
TP
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
70
PsiBlast_CBE
68.42
32%
-74
- C2 -
1CSN
1
CKI1_SCHPO
A:
[6-295]
---------------------------
N
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
A
A
T
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
71
PsiBlast_CBE
68.23
32%
-80
- C2 -
2CSN
1
CKI1_SCHPO
A:
[5-294]
---------------------------
N
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
A
A
T
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
33
PsiBlast_CBE
67.70
37%
-84
- C2 -
4HGT
2
KC1D_HUMAN
B:
[7-292]
-----------------------------
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
-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
68
PsiBlast_CBE
66.97
32%
-75
- C2 -
1EH4
1
CKI1_SCHPO
B:
[6-295]
---------------------------
N
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
A
A
TNKQKY
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
------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------
69
PsiBlast_CBE
65.49
32%
-74
* C2 *
1EH4
1
CKI1_SCHPO
A:
[6-295]
---------------------------
N
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
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