Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSLEPIPPQTFTDYVAYSERKRTRWERFLDKIKPRSAAMRTTILVLLVVLFSLFMSLWFFWRTLYLPEIQQHARYLAVELELVNNPNIRIFHRDSEVDVDTWLRNRVGIEYVTNPKEYPSVRDKIIAEFFTNQVEQKLANEIGAKDVTVYFQFKPSPRIWIQTPEMHGNWVREPLKTYANYSPELLVGWVVGVPLVSAIIILILVRQMNRPLRRLQNAANEYSKSGTAPYLDTNHGPLEIRQVNQAFNRMVYTLEQTERERRIMLAGISHDLRTPLTRIRLTAEML----PDEFLREGLVYDVDDMDAILNQFISYMRDGSDEELKDTNI--NILLQELV--VQF------KPLDVRFNMQDVPIIPARSLSLKRLIANLINNAKRYGAEPIELSAKVENEHILITVADHGEGIPEDQIEELMQPFVRGNSARTIQ--GSGLGLAIVKRIVDIHQGEIQIHNREQGGLEVIISLPIPKPAPDENTTHNPLEKIKQTLSERF 4CB0 Chain:A ((57-296)) ---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------QEFLAAGASFNQMVTALERMMTSQQRLLSDISHELRTPLTRLQLGTALLRRRSGESKELERIETEAQRLDSMINDLLVMSRNQQKNALVSETIKANQLWSEVLDNAAFEAEQMGKSLTVNFPPGPWPLY-GNPNALESALENIVRNALRYSHTKIEVGFAVDKDGITITVDDDGPGVSPEDREQIFRPFYRTDEARDRESGGTGLGLAIVETAIQQHRGWVKAEDSPLGGLRLVIWLPLYK-----------------------

General information: TITO was launched using: RESULT: Template: 4CB0.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 : 786 31550 40.14 140.85 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : 40.14 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.422

(partial model without unconserved sides chains): PDB file : Tito_4CB0.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4CB0-query.scw PDB file : Tito_Scwrl_4CB0.pdb: