Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------------------------------------------MKIKRSFISISVLMV---IFGLMISVQFNSLKHPKVR---DTRDMWDIREE--------LTSEQKKQEKLLAEINKYDK---LLNSYSQTKEMTKETALNNTLQSLKKTAGMTDITGSGIVITISPLFSESLTGEPIENPPPDLLKKLINELNSYGAEHISI------------------------NERRVVNHTVIRD--INGTTKIDGYALDDYPLTVKVLAKDPDMLHSRVKGSGLEDLFASENLALKAGKSESK----------LTLKAYDRPLDVQQLKLLKD 3QS7 Chain:E ((56-411)) AAVEVDVSASITLQVLVDAPGNISCLWVFKHSSLNCQPHFGVVSMVILKMTETQAGEYLLFIQSTNYTILFTVSIRTLRRPYFRKMENQDALVCISESVPEPIVEWVLCVVKKEEKVLHELFGTDIRCCARNELGRECTRLFTIDLNQTPQTTLPQLFLK--VGEPLWIRCKAVHVNHGFGLTWELENKALEEGNYFEMSTYSTNRTMIRILFAFVSSVARNDTGYYTCSSSKHPSQSALVTIVEKGFINATEDYEIDQYEEFCFSVRFKAYPQIRCTWTFSRKSFPC----EQKGLDNGYSISKFCNHKHQPGEYIFHAENDDAQFTKMFTLN-

General information: TITO was launched using: RESULT: Template: 3QS7.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain E - contact count / total energy / energy per contact / energy per residue : 795 -29596 -37.23 -129.81 target 2D structure prediction score : 0.30 Monomeric hydrophicity matching model chain E : 0.63 3D Compatibility (PKB) : -37.23 2D Compatibility (Sec. Struct. Predict.) : 0.30 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.043

(partial model without unconserved sides chains): PDB file : Tito_3QS7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3QS7-query.scw PDB file : Tito_Scwrl_3QS7.pdb: