Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKRRRREITKMKRWIALSKIEFLLTKRQLIYYLLSVGMPTAFYLFFSGIYQDTPGELANFMRDYLISMTAFSMMSTAIFSFPVVLHT---DKINNWQKTLRHSPVNMVEYYLSKITSMLVDYLVS---ILVVFSVGHFVRGVDMSLGNWIGAALLLIVGSIAFVALGLTLTLLPTSQLMSVVGNLLYLGLAVLGGLWMPISLFPDWMQVVGKCLPTY----------------------QLMELLKTFLNEGGINLSATVYLLVFSVVLFG-LTIYLQGHKENA 5XJY Chain:A ((653-1117)) -----------------------------------------------------------FLRVMSRSMPLF-MTLAWIYSVAVIIKGIVYEKEARLKETMRIMGLDNSILWFSWFISSLIPLLVSAGLLVVILKLGNLLPYSDPS----VVFVFLSVFAVVTILQCFLISTLFSRANLAAACGGIIYFTL------YLPYVLCVAWQDYVGFTLKIFASLLSPVAFGFGCEYFALFEEQ-------------GFNLTTSVSMMLFDTFLYGVMTWYIEA-----

General information: TITO was launched using: RESULT: Template: 5XJY.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 : 564 -105812 -187.61 -633.60 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -187.61 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.248

(partial model without unconserved sides chains): PDB file : Tito_5XJY.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5XJY-query.scw PDB file : Tito_Scwrl_5XJY.pdb: