Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTVLWVAAVIALACLNVIQFIMKKKRDGNLAYTADQLSYMLSRDSAGQILLPTDDHALKDLLVNINLIVENRQQISAQFAKTEQSMKRMLTNMSHDLKTPLTVILGYIEAIQSDPNMPDEERERLLGKLRQKTNELIQMINSFFDLAKLESEDKEIPITKVHMNDICKRNILHYYDAVQSK---GFQAAIDIPDTPVYAQANEEALDRILQNLLSNAIQYGAAG--------KLIGLTLSYDERNIAITVWDRGKGISETDQQRVFERLYTLEESRNKAFQGSGLGLTITKRLTEKMGGIISVQSKPYERTAFTITLKRMTY 4E01 Chain:A ((148-403)) ----------------------------------------------------------------------------------EAQYCQLVRQLLDDHKDVVTLLAEGLRESRKHIE-DEKLVRYFLDKTLTSRLGIRMLATHHLALHEDKPDFVGIICTRLSPKKIIEKWVDFARRLCEHKYGNAPRVRINGH-VAARFPFIPMPLDYILPELLKNAMRATMESHLDTPYNVPDVVITIANNDVDLIIRISDRGGGIAHKDLDRVMDYHFTTA--------GFGFGLPTSRAYAEYLGGSLQLQSLQGIGTDVYLRLRHI--

General information: TITO was launched using: RESULT: Template: 4E01.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 : 933 -111344 -119.34 -513.11 target 2D structure prediction score : 0.76 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -119.34 2D Compatibility (Sec. Struct. Predict.) : 0.76 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.426

(partial model without unconserved sides chains): PDB file : Tito_4E01.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4E01-query.scw PDB file : Tito_Scwrl_4E01.pdb: