Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKLATLLLLSTVALAGCSSVQRSLRGDDYVDSSLAAEESSKVAAQSAKELNDALTNENANFPQLSKEVAEDEAEVILHTSQGDIRIKLFPKLAPLAVENFLTHAKEGYYNGITFHRVIDGFMVQTGDPKGDGTGGQSIWHDKDKTKDKGTGFKNEITPYL-YNIRGALAMANTGQPNTNGSQFFINQNSTDTSSKLPTSKYPQKIIEAYKEGGNPSLDGKHPVFGQVIG-GMDVVDKIAKAEKDEKDKPTTAITIDSIEVVKDYDFKS 3BKP Chain:A ((21-192)) ------------------------------------------------------------------------RGKVVLHTSLGDLDVELWARECPLACRNFVQLCLEGYYVNTIFHRVVKDFIVQGGDPTGTGRGGA------DTTFD-GKPFDVETHPRLKFRYRGLVGVANLG---TNGNQFFITLARADV------------------------LNNAYTLFGKVTGHTLYNLMKFNDLEVGKEDRPMTPPFIKSVDVL-------

General information: TITO was launched using: RESULT: Template: 3BKP.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 : 821 -26827 -32.68 -174.20 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -32.68 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.674

(partial model without unconserved sides chains): PDB file : Tito_3BKP.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3BKP-query.scw PDB file : Tito_Scwrl_3BKP.pdb: