Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTASLSSSPVRHPSVDNAAIPAASHHIPPPLNGYAFLEHRRSALSHDTFIARDVRQQQHPEQQDNDQAKVIIRVYALEYLRRDEECRFALERECLAARLVVHPHLLPLGSPFASKTDLFVVEKYCAGGDLYELMVSLAKEGPIASETGAAKGEAPPRSSTGLPISTVKRFMRELLSAVQYLHRTCGLVHRNIKLETLFIDEEQHLRLGSFGLCAVLPPPSVATGDREGALDAPEDKASSSHAPLRLCCGSKHYAAPELVQGHPYQGEGVDAWACGVVLFALLTGCFPFDSDDGDEALFRLLCGDVESHLAQHPAMAAIEDPQACDLVRNLLRPNPNARYTVSEALEHPYLWEV 4QFR Chain:A ((63-401)) -----------------------------------------------------------------------------------------IRREIQNLKLFRHPHIIKLYQVISTPSDIFMVMEYVSGGELFDY---ICKNGRLDEKES-------------------RRLFQQILSGVDYCHRHM-VVHRDLKPENVLLDAHMNAKIADFGLSNMM----------------------SDGEFLRTSCGSPNYAAPEVISGRLYAGPEVDIWSSGVILYALLCGTLPFD-DDHVPTLFKKICDGI-FYTPQYL------NPSVISLLKHMLQVDPMKRATIKDIREHEWF---

General information: TITO was launched using: RESULT: Template: 4QFR.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 : 1002 -148542 -148.25 -714.14 target 2D structure prediction score : 0.72 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : -148.25 2D Compatibility (Sec. Struct. Predict.) : 0.72 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.496

(partial model without unconserved sides chains): PDB file : Tito_4QFR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4QFR-query.scw PDB file : Tito_Scwrl_4QFR.pdb: