Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFARDALSTAVETACDPDPAVDTISTIEAGNN-HTYRVTLAD-GTDLFLKVGTRFPDAFPAEPATMRRVRAETDLP-VPRVHGTGTDP-----LEYPYAVYEYVPDCEAEWAGDLSHEAAERLCREAGRHLCELHQITFPQFGRIGLDTDASADDTLVADAPDADALTVVDPTPFDDLLRQSLDRQVT-----ELA---DSPF---DTRRDSLEAFGTDLIDRSDFADVTPALVHGDYRLGNLCVDPSAEQITAAVLDWELPTALDPLWDAVMAQSLLTAGHRLDPDSRQTLRRAFWEAYGTSTAD-TPRRRCYELLARIRLARHLDTECRGLSEAARRARITDHHEAFDALLVDR 3I1A Chain:B ((6-297)) --IQAQQLIELLKVHYG-IDIHTAQFIQGGADTNAFAYQADSESKSYFIKLKYGY--HDEINLSIIRLLHD-SGIKEIIFPIHTLEAKLFQQLKHFKIIAYPFIHAPNGFTQ-----NLTGKQWKQLGKVLRQIHETSVPISIQQQLRKE-------------------IYSPKWREIVRSFYNQIEFDNSDDKLTAAFKSFFNQNSAAIHRLVDTSEKLSKKIQPDLDKYVLCHSDIHAGNVLVGN---EESIYIIDWDEPMLAPKERDLMFIGGGVGNVWN-----KPHEIQYFYEGY-GEINVDKTILSYYRHERIVEDIAVYGQDLL-------------------------

General information: TITO was launched using: RESULT: Template: 3I1A.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 : 1099 -32355 -29.44 -118.95 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain B : 0.65 3D Compatibility (PKB) : -29.44 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.318

(partial model without unconserved sides chains): PDB file : Tito_3I1A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3i1a-query.scw PDB file : Tito_Scwrl_3I1A.pdb: