Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFRLLVLMGFTFFFYHLHASGNLTKYINMKYAYLSFIAIFLLAILTAVQAYLFIKSPEKSGHHHDHDCGCGHDHEHDHEQNKPFYQRYLIYVVFLFPLVSGIFFPIATLDSSIVKTKGFSFKAMESGDHYSQTQYLRPDASLYYAQDSYDKQMKQLFNKYSSKKEISLTDDDFLKGMETIYNYPGEFLGRTIEFHGFAYKGNAINKNQLFVLRFGIIHCIADSGVYGMLVEFPKD--M-DIKDDEWIHIKGTLASEYYQPFKSTLPVVKVTDWNTIKKPDDPYVYRGF 3KF6 Chain:B ((514-573)) ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DCKDGQKLRFLGCVQSYK----NGILRL----ID---G--SSSVTCDVTVVLPDVSIQKHEWLNIVGRKRQDG-------------------------------

General information: TITO was launched using: RESULT: Template: 3KF6.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 : 171 -28259 -165.26 -495.77 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain B : 0.50 3D Compatibility (PKB) : -165.26 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.50 QMean score : 0.509

(partial model without unconserved sides chains): PDB file : Tito_3KF6.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3KF6-query.scw PDB file : Tito_Scwrl_3KF6.pdb: