Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRFYSLYLHDDACKNRQNLSSCRTYSVSLEFESRRDNMSNENQKPTSPTEQAQSSDKVSPFLSSPLPQGTPQGQQQSLQQTLTDTPVSGSVPKYNLPRGAGNTGNVGETTHFGYSTVRTEDKAQKVAEVFHSVASKYDLMNDLMSFGIHRLWKRFAINMSGVRRGQHVLDIAGGTGDLAKVFSREVGPQGHVVLSDINESMLNVGRDRLIDAGCTNVDFVLANAETLEPFADNSFDLVTISFGLRNVTDKDAALASMFRVLKPGGRLLVLEFSKPVFEPFSKLYDLYSFTALPIMGKLVANDSESYKYLAESIRMHPDQRTLKGMMENAGFQNCDYHNLTGGIVAVHRGFKL 4KRI Chain:B ((220-373)) -----------------------------------------------------------------------------------------------------------------------------------------------------------------MKTGQRMLDIGVGIGGGARQAASEF--GLQVHGVDLSTNMLAVALERVHKEKDARVTYAVCDACEY-EFEPNSFDYVFSRDCIQHIKDTDKLFSRIYRALKPGGKVLITMYGVGHGTL-SESFKEY---------------------VSQRQYYLKNLEQIEEIAKKTGFIDIEVENMT------------

General information: TITO was launched using: RESULT: Template: 4KRI.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 : 689 -86442 -125.46 -561.31 target 2D structure prediction score : 0.75 Monomeric hydrophicity matching model chain B : 0.63 3D Compatibility (PKB) : -125.46 2D Compatibility (Sec. Struct. Predict.) : 0.75 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.557

(partial model without unconserved sides chains): PDB file : Tito_4KRI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4KRI-query.scw PDB file : Tito_Scwrl_4KRI.pdb: