Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -MYDTIVIGAGQAGISIGYYLKQSDQK-----FIILDKSHEVGESWKDRY-------------------DSLVLFTSRMYSSLPGMHLEGEKHG--FPSKNEIVAYLKKYVKKFEIPIQLRTEVISVLKIK-----NYFLIKTN-----REEYQTKNLVIATGPFHTPNIPSISKDLSDNINQLHSSQYKNSKQLAYGNVLVVGGGNSGAQIAVELSKE----RVTYLACSNKL------VYFPLMIGKRSIFWWFDKLGVLHASHTSIVGKFIQKKGDPVFGHELKHAIKQKEI--------ILKKRVIAAKQN----EIIFK-----DSSTLEVNNIIWATGFR--NPLCWINIKGVLDQEGRIIHHRGVSPVEGLYFIGLPWQHKRG--SALLQGVGNDAEYIVKQMNGE-- 3S5W Chain:A ((29-448)) VVHDLIGVGFGPSNIALAIALQERAQAQGALEVLFLDKQGDY--RWHGNTLVSQSELQISFLKDLVSLRNPTSPYSFVNYLHKHDRLVDFINLGTFYPCRMEFNDYLRWVASHFQEQSRYGEEVLRIEPMLSAGQVEALRVISRNADGEELVRTTRALVVSPGG--TPRIPQVFRALKGDGRVFHHSQYLEHMA-KPMKIAIIGGGQSAAEAFIDLNDSYPSVQADMILRASALKPADDSPFVNEVFAPKFTDLIYSREHAERERLLREYHNTNYSVVDTDLIERIYGVFYRQKVSGIPRHAFRCMTTVERATATAQGIELALRDAGSGELSVETYDAVILATGYERQLRQLLEPLAEYLGEIGRDYRLQTDERCKVAIYAQGFSQASHGLSDTLLSVLPVRAEEISGSLYQHLK

General information: TITO was launched using: RESULT: Template: 3S5W.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 : 1514 7789 5.14 22.91 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 5.14 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.389

(partial model without unconserved sides chains): PDB file : Tito_3S5W.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3S5W-query.scw PDB file : Tito_Scwrl_3S5W.pdb: