Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSMSFDLKVSLQQRSEP-----SAQQKKLNRLIDKIEQQKVSLSTWQNA-QAEIQQHMRQKLMPVYN-----DLHTVLFQQLEQLWNILHSHEFSKADIQQLDEKIAQLAQMLKRSKMLSAEQLELVKQIDTFYQQHAGESVKKNKKVQPIKSEYEESVDQRAELEEEFEKYAAEQQQAREQAKQQRQQQKREQAEQMAAQSLKTVYLKIAAMIHPDGEQDETKKYEKNELFQQASQAYEKQDLFYLLKLQLQLEQNKGLGAKELSAEQLRFYKLALDAQSQQLESQIAEILDSFQLAKNIKAEHVHISDVYKAIDADCAELKQQLKWERERLKHMKKVSVVEMLLGHGVL---- 2W18 Chain:A ((24-356)) ---NLQLVSELKNPSGSCSVDVSAMFWEKEPCIITACEDVVSLWKALDAWQWEKLYTWHFAEVPVLQIVPVPDVYNLVCVALGNL-EIREIRALFCEKQVLLKSGNIKAVLGLTKRRLVSSSGTLSDQQVEVMTFAEDG-GGKENQFLMPP----EETILTFAEVQGMQEALLGTTIM-----------------NNIVIWNLKTGQLLKKMHIDDAS---------------VCHKAYSEMGLLFIVLSPV--FQLIVINPKTTLSVGVMLYCLPPGQAGRFLEGDVKD----HCAAAILTSGTIAIWDLL--LGQCTALLPPVQHWSFVKWSGTDSHLLAGQKDGNIFVYHYS

General information: TITO was launched using: RESULT: Template: 2W18.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 : 1612 10415 6.46 35.79 target 2D structure prediction score : 0.16 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : 6.46 2D Compatibility (Sec. Struct. Predict.) : 0.16 1D Compatibility (Hydrophobicity) : 0.64 QMean score : -0.118

(partial model without unconserved sides chains): PDB file : Tito_2W18.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2W18-query.scw PDB file : Tito_Scwrl_2W18.pdb: