Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------------------------------------------------------------------------------------------MEFVFNGFYTLISAVIVLLLGRFLVNRID-------FLERYNIPEPVAGGLVAA-----VVSLLVHTFWGYSIVFSSELQTSFMLVFFASIGLSANFMKLKEGGTALVIFLICVASFIVVQNAVGMSLATLLGLDPLIGLIAGSITLTGGHGTAGAWGEILESQHGIQGALALGMASAT-------------FGLIMCVIGGPLAKLLIN--RYSLAQAKTNAEIQQRDTHVEQNSDDLAPFENPHQVRLITADNAITTLGMFA---ACLAFAEFMTGFSKGTWFELPTFVWALGGGVILRNILESVLKVDI-FDRAIDVFGNASLSLYLAMALLSLKLWQLADLAGPLVVILVAQTLTMAL-----YAAFVTFRVMGKNYDAAVLAASHCGFGMGATPTAVANMQAITNMYGPSHK-------AFLIVPLCGAFFVDLINATVIQLMLKFIA--- 4WBD Chain:A ((2-541)) HMQLTELSIKNQNVFVQHYIDGKEEMSSFFDYSIHHKDMWRERLEDLSSRFFAREELAAYLTSYHNKFGSSAMQSAIEKLKDPSSAAVVGGQQAGLLTGPLYTIHKIISIIVLAKQQEKELQVPVIPIFWVAGEDHDLDEINFVHTSEENGPVKKKLPQSYWKKSSAASTSLDQEKCAAWIDDVFAA--FEETDHTNTLLDNVKRCLRESVTFTDFFELLIADLFQEEGLVLLNSGDPGIK--KLETAMFQKILRENDELARAVSDQQAFMRQAGYKPIIESGKEQANLFYEYEDERFLIEKDNGRFVIKELDLGWTRDELHTHMEEHPER---FSNNVVTRPLMQEFLIPTLAFIAGPGEINYWGELKQAFAV-MGFKMPPVMPRLNITILERHIEKKLAERNISLQDAIERGTENQRETYFERQI-PEEFTAVMDQAKSQIEAIHKTVRQEALKVDQSLEPLLLKNAAFIQDQLQFLERTVMKRIEEKEGYVLKDYERIQNSIKPLLAPQERIWNIMYYLNRYGPKFFTTFKNLPFSFQNQHQVVKL

General information: TITO was launched using: RESULT: Template: 4WBD.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 : 1963 -105791 -53.89 -263.82 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -53.89 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.156

(partial model without unconserved sides chains): PDB file : Tito_4WBD.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WBD-query.scw PDB file : Tito_Scwrl_4WBD.pdb: