Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence VCRALIPELQDADDSDFDVCRINGGITNISDGRFLSFAVAKVSKKDQSVVVRVFGPATEGVIDRDREIQATCHLSRAGFCPELKGVFKNGIIQTFVTARTLTPEDFLDDAVVAKVAKELRRLHQQEVPGEKES-MVWTEINRYFELASAVTKFESPEDQRKLEAVSFDELRQEINTLKEIGARLKGPVVYAHNDLLPGNVMVDAQGDKCYYFIDFEYSGYNYRGFDIGTHF---------NEYAGFDCDFCAYPSKDRQLNFLRHYL-RPDDPEKATHEEL----EELFVEANFYALAAHITWSAWAIVQATSSAAIDFDYMSYFFKRMKMYREQKAKFLPVVRGFLAGKSK 2IG7 Chain:A ((74-396)) ---------------ELRVYPVSGGLSNLLFRCSLPDHLPSVGEEPREVLLRLYGAILQGVDSLVLESVMFAILAERSLGPQLYGVFPEGRLEQYIPSRPLKTQELREPVLSAAIATKMAQFHGMEMPFTKEPHWLFGTMERYLKQIQDLP------MNL-LEMYS---LKDEMGNLRKLLESTPSPVVFCHNDIQEGNILLLS-----LMLVDFEYSSYNYRGFDIGNHFCEWVYDYTHEEWPFYKARPTDYPTQEQQLHFIRHYLAEAKKGETLSQEEQRKLEEDLLVEVSRYALASHFFWGLWSILQASMS-TIEFGYLDYAQSRFQFYFQQKGQLTS-----------

General information: TITO was launched using: RESULT: Template: 2IG7.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 : 1345 -26117 -19.42 -88.53 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.79 3D Compatibility (PKB) : -19.42 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.79 QMean score : 0.448

(partial model without unconserved sides chains): PDB file : Tito_2IG7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2ig7-query.scw PDB file : Tito_Scwrl_2IG7.pdb: