Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSVVAFKQVDVFTSQAFKGNPVAVIMDASTLTSEQMQAIANWTNLSETTFVLPAIDSQADYQVRIFTPQSELPFAGHPTIGTAYALLEAGLVKAKEGQLVQQCAAGLVTLTVNDSNH----ISFELPKPKITPLDALQTQKLAEILKCK--INTQWNAALVDVGARWVVLQAVNAKAVLASQPDLNALKQFSLEMKVTGSTIYGFYEESNEQKRIEVRSFAPAYGVNEDPVCGSGNGSVASFIRYHSILPAQNDVMLSSQGQALGR--------EGQLQLELHQDKILVGGAAVTCIDGTIKL 1U1W Chain:B ((27-298)) --------IDAFASVPLEGNPVAVFFDADDLPPAQMQRIAREMNLSESTFVLKPRNG-GDALIRIFTPVNELPFAGHPLLGTAIAL----GAHTDNHRLYLETQMGTIAFELERQNGSVIAASMDQPIPTWTALG-----RDAELLKALGISDSTFPIEIYHNGPRHVFVGLPSIDALSALHPDHRALSNFH-DMAINCFAGAG--------RRWRSRMFSPAYGVVEDAATGSAAGPLAIHLARHGQIEFGQPVEI-LQGVEIGRPSLMFAKAEGRAE---QLTRVEVSGNGVTFGRGTIVL

General information: TITO was launched using: RESULT: Template: 1U1W.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 : 1596 -71667 -44.90 -277.78 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain B : 0.75 3D Compatibility (PKB) : -44.90 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.490

(partial model without unconserved sides chains): PDB file : Tito_1U1W.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1U1W-query.scw PDB file : Tito_Scwrl_1U1W.pdb: