Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTTKNQKISRRHISGVFLLNKPLGLSSNAALQKVRWLYRAQKAGHTGALDPLATGLLPICLGEATKFSHYLLDSTKRYQTTVRLGQTTTTGDVEGDILQERPIPVLSKELIEQTLEKFRGDIQQVPPMYSALKKEGKPLYELARKGIEIEREARPVTIYALELIEFTENSITLDVTCSKGTYIRVLGEDIGEALGCGGHLTMLHRIQTGHFELIP-SYTIEYLESLT--------EEQREALLLPVYAPIYHFLKIQVPEGREKYFCNGLESNIDHS--------AEAEVLVFS-GERCLGLAEITDKKRLVPKRILNL 2AUS Chain:C ((37-304)) ----KRPIELHIQYGVINLDKPPGPTSHEVVAWIKRILNLEKAGHGGTLDPKVSGVLPVALERATRVVQALLPAGKEYVALMHLHG------------------DVPEDKIRAVMKEFEGEIIQR-----------------------------TRKVYYIEILEIDGRDVLFRVGVEAGTYIRSLIHHIGLALGVGAHMAELRRTRSGPFKEDETLVTLHDLVDYYHFWKEDGIEEYIRKAIQPMEKAVEHLPKIWIKDSAVAAVAHGANLTVPGIVKLNAGIKKGDLVAIMTLKDELVALGKAMM------------

General information: TITO was launched using: RESULT: Template: 2AUS.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 1150 -112362 -97.71 -472.11 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain C : 0.70 3D Compatibility (PKB) : -97.71 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.470

(partial model without unconserved sides chains): PDB file : Tito_2AUS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2AUS-query.scw PDB file : Tito_Scwrl_2AUS.pdb: