Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNNEKIENIFDKFEI--NIKEIKSATNSFNSNVYIITSVDDKRYVLKFCNNE------KKMLNESKYMKYLKP-YIPVADVVGTGDC------DEKYYIIQSFFEGSNKFDEEANELSDEQVRNIGILLAKLHSCELLDES---------SNSWIIYLNGCLEKTVETLEKIFG--KEN---N-KKISDFLSNYINEKLSNNYKNSILHMDFRIGNVMFGK--NDEIGLIDLESMKNGEYVFDFVKVNRL--F--------------NNDKFLKFMEGYNT--IKAVDSNFEERLNFYSLFDSYTSLWWCATKNQLDSEFYKLNYKIVMKYLAKLNKDGVI 4WH3 Chain:A ((6-297)) ---EVLFGIASHFALEGAVTGIEPYGDGHINTTYLVTTDG-PRYILQQMNTSIFPDTVNLMRNVELVTSTLKAQGKETLDIVPTTSGATWAEIDGGAWRVYKFIEHTVSYNLV---PNPDVFREAGSAFGDFQNFLSEFDASQLTETIAHFHDTPHRFEDFKAALAADKLGRAAACQPEIDFYLSHADQYAVVM-DGLRDGSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDEKDLSKVHFSTELFRAYTEGFVGELRGSITAREAELLPFSGN-----------------------------------------

General information: TITO was launched using: RESULT: Template: 4WH3.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 : 1015 39511 38.93 163.27 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : 38.93 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.390

(partial model without unconserved sides chains): PDB file : Tito_4WH3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4wh3-query.scw PDB file : Tito_Scwrl_4WH3.pdb: