Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------------------------------------------------------------------------MEQIRPFPPTDFIDQADDEEATRLTPAPDLMDWVVKNYLTVDGELYNPDHDHIAELIHENEGFLAFAWASQACTVKKQMVSGQCEKVMFNVGG-WRKARQEQQMRDWFGYVPVYLITIDAS-YCEQATDRDFCALIEHELYHIGVERDEDGEPLYSEMTGLPKHYLAG-----HDVEEFVGVVKRWGADENVKRLIEVAKQAPFVSDVNISKCCGTCLIN 2AWI Chain:A ((2-301)) FKIGSVLKQIRQELNYHQIDLYSGIMSKSVYIKVEADSRPISVEELSKFSERLGVNFFEILNRAGMNSVNETGKEKLLISKIFTNPDLFDKNFQRIEPKRLTSLQYFSIYLGYISIAHHYNIEVPTFNKTITSDLKHLYDKRTTFFGIDCEIVSNLLNVLPYEEVSSIIKPMYPIVDSFGKDYDLTIQTVLKNALTISIMNRNLKEAQYYINQFEHLKTIKNISINGYYDLEINYLKQIYQFLTDKNIDSYLNAVNIINIFKIIGKEDIHRSLVEELTKISAKEKFTPPKEVTMYYEN

General information: TITO was launched using: RESULT: Template: 2AWI.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 : 779 -5293 -6.79 -24.85 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.54 3D Compatibility (PKB) : -6.79 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.54 QMean score : 0.128

(partial model without unconserved sides chains): PDB file : Tito_2AWI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2AWI-query.scw PDB file : Tito_Scwrl_2AWI.pdb: