Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEAYFLQGILLMKKTLIALLSLLFSVDTLISASIIDPDVYTILEQSFPSIPKEQWMIQVLKGGLSGTALYKIETP--TQQYVLRLHQSTQ-LSSQDEREHFALIEAAKLGIAPHVAYVSSDNRAILMEFVNHKTLTLEKAKLPENIVKIACAIRKAHEIVGHPHVG--------------ESLLSNAHRCHEKVLKDGL-----------GT--E-ENINGALELIKRYREQLSAYACPQVNVHGDLNPRNIFLTD-DNGVLLIDWAESSLEDPFYDLTYFALKH---------DYDEVQEALLLKTYLQRQPT---VEETSRFTLQKKIHQAFWSLTNLYLADVQLRKHPQQKIDPQASLKSWSTYQKTYADSMEELPAQYFYELSRLNYQLAL 2QG7 Chain:D ((109-452)) ----------------------------------------------------DSLEFQIINGG-TN-ILIKVKDMSKQAKYLIRLYGPKTD---NREREKKISCILYNKNIAKKIYVFFTN--GRIEEFMDGYALSREDIKNPKFQKLIAKNLKLLHDIKLNENLYKELQVTQKVPGTRPSFLWNTIWKYFHLLNEERKKICSFDAKANILKLIDFDVLRD---SIVEVESLCKRENSPIVLCHCDLLSSNIINTVG-DSISFIDFEYSCPMERAYDIANHFNEYAGFNCDWDLTPSKEEEYHFIMHYLGTDDEELINQLIREIQPFYICSHINWGLWSLLQGMHS---S-D--FD-------FINYGMTRLTASCLP-----------------

General information: TITO was launched using: RESULT: Template: 2QG7.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 1010 14321 14.18 55.51 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain D : 0.58 3D Compatibility (PKB) : 14.18 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.382

(partial model without unconserved sides chains): PDB file : Tito_2QG7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2qg7-query.scw PDB file : Tito_Scwrl_2QG7.pdb: