Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------------------------------------------------------------MHVITTQVLFIFCFLLLIHSIETLAYATRLSGARVGFIASALSLFNVMVIVSRMSNMVQQPFTGHLIDDAGKNALAIVGEQFRFLI--FGSTVGTILGI-----ILLPSFVALFSRAIIHLAG-GGGSVFQVFRKGFSK------QGFKNALSYLRLP--------SISYVKGFHMRLIPKRLFVINMLITSIYTIGVLSALYAGLLAPERST--------TAVMASGLINGIATMLLAIFVDPKVSVLADDVAKGKRSYI--------------------YLKWTSVTMVTSRVAGTLLAQLMFIPGAYYIAWLTKWF-------------- 4I6M Chain:B ((3-439)) PFRQDSILIIYPRSQTTLVQFGLNEETFTVPELEIPTQIYRTTRQDGSYTYHSTNKDNKAELIKPIQNGEIIDISAFTQFLRLIFVSILSDRANKNQDAFEAELSNIPLLLITHHSWSQSDLEIITQYVFESLEINNLIQLPASLAATYSMISLQNCCIIDVGTHHTDIIPIVDYAQLDHLVSSIPMGGQSINDSLKKLLPQWDDDQIESLKKSPIFEVLSKNSDLEFNTFWDEKGNEIKVGKQRFQGCNNLIKNISNRVGLTLDNIDDINKAKAVWENIIIVGGTTSISGFKEALLGQLLKDHLIIEPEEEKSKREEEAKSFVPTIEYVQCPTVIKLAKYPDYFPEWKKSGYSEIIFLGAQIVSKQIFTHPKDTFYITREKYNMKGPAALWDVQF

General information: TITO was launched using: RESULT: Template: 4I6M.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 963 -169261 -175.76 -629.22 target 2D structure prediction score : 0.44 Monomeric hydrophicity matching model chain B : 0.60 3D Compatibility (PKB) : -175.76 2D Compatibility (Sec. Struct. Predict.) : 0.44 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.046

(partial model without unconserved sides chains): PDB file : Tito_4I6M.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4I6M-query.scw PDB file : Tito_Scwrl_4I6M.pdb: