Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequence---------MNMTFIVAVQLKDSIVVAVDNKYLTLKDKEKDHFEEHFSSKLYAWHSGIITGTGEHYVIDKAVRLFINSADADIEKLPLCLNISRQIREMEVGQHEQIQSSKLLYSQYSEN-GAKLFAIEPTEETGKYQRTE-------------FKENDLIIWLFN------------PNIQSISGNLKTLYSNPRPKVSFDRIEDWLD-YYIS--AIAEIYEKQSCIDSWMS-------GSFDIFFQTE----------GEYFYKHIQ---------NNPTVHLE---------------
3G8Q Chain:A ((1-278))MKVSLAGQTVDVKKILNEIPKRTVTAALLEGGEIVAVEEAD--DEHAERKLVRRHD--VEGK----------VVFVTA--------RPCLYCARELAEAGVAGVVYLGRGRGLGPYYLARSGVEVVEVHPDEPLG-YDPVDRLDVLLTFGGNPYLTEEDVAARVYCLLTGRGFDADIAPAPENLSGRVEIMVTRGDPDEAVELLKEELPVFRIRRFLISGEFDRDELRERILEDIEPRILDPFAVRARIARAGAFSSSREAEVFIGDVLTSVGREVNLNDPRTVVTVDVLGPRVSVGVEKR


General information:
TITO was launched using:
RESULT:

Template: 3G8Q.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1064 10969 10.31 55.12
target 2D structure prediction score : 0.55
Monomeric hydrophicity matching model chain A : 0.64

3D Compatibility (PKB) : 10.31
2D Compatibility (Sec. Struct. Predict.) : 0.55
1D Compatibility (Hydrophobicity) : 0.64
QMean score : 0.235

(partial model without unconserved sides chains):
PDB file : Tito_3G8Q.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3G8Q-query.scw
PDB file : Tito_Scwrl_3G8Q.pdb: