Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPNQQTIHHFDVIIVGSGGAGLSLALSLPGHFNIAVLAKAALTEASTFYAQGGVAAVLD--ETDSIQQHINDTMIAGAHLCEMDAVQHTVEGGRPSVDFLLKQGVQFTLDEDEQLHLTREGGHSQR--------RIIHSADATGKAISTTLVERAKERKNITIFENYIAIDLITSHKLGHTEQTNRAIGLYALDESTEKVHTFLAPFTALACGGAMKAYLYTSNPDIATGDGIAMAYRAGCRVANMEFNQFHPTCLYHPQARSFLITEAMRGEGAYLRLPDGERFMLRFDDRA-ELAPRDIVARTIDHEIKR---LGIR--HVWLDITHKSPEFIKEHFPTLY-ARLLELGIDITKDMIPVVPAAHYTCGGVVVDSNSQT---------DIEGLYAIGETSYTGLHGANRMASNSLLECFVYGMSAAKDIESKFDKNFKLPEV-PTWDDSQVTNPDE----DVVILQNWDEL--RSTMWNYVGIVRTTKRLERALHRIEMLKREITEYYQ-DYRVSKN-----LIELRNLVLVSEMIVRCAMHRKESRGLHYTLDYPETSSEIRKTVLTPPNFAVEQPLVNTSV 1YQ4 Chain:A ((42-554)) -------------------------------FNTACVTKLFPTRSHTVAAQGGINAALGNMEDDNWRWHFYDTVKGSDWLGDQDAIHYMTEQAPAAVIELENYGMPFSRTEEGKIYQRAFGGQSLQFGKGGQAHRCCCVADRTGHSLLHTLYGRSL-RYDTSYFVEYFALDLLM--------ENGECRGVIALCIEDGTIHRFRAKNTVIATGGYGRTYFSCTSAHTSTGDGTAMVTRAGLPCQDLEFVQFHPTGIY---GAGCLITEGCRGEGGILINSQGERFMERYAPVAKDLASRDVVSRSMTIEIREGRGCGPEKDHVYLQLHHLPPQQLATRLPGISETAMIFAGVDVTKEPIPVLPTVHYNMGGIPTNYKGQVITHVNGEDKVVPGLYACGEAASASVHGANRLGANSLLDLVVFGRACALTIAETCKPGEPVPSIKPNAGEESVANLDKLRFADGTIRTSEARLNMQKTMQSHAAVFRTGSILQEGCEKLSQIYRDLAHLKTFDRGIVWNTDLVETLELQNLMLCALQTIYGAEARKESRGAHAREDY----------------------------

General information: TITO was launched using: RESULT: Template: 1YQ4.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 : 2758 -8895 -3.23 -18.77 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -3.23 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.421

(partial model without unconserved sides chains): PDB file : Tito_1YQ4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1YQ4-query.scw PDB file : Tito_Scwrl_1YQ4.pdb: