Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSVYTQLTDDQFSAFCQRFGVSFACAIPITQGIKNSNWFIQTTDDVDGAHSYVFTLFEERPLE-DIEKMAVILNQLDGKLPVAAPLSLVDSAE-KCYVIRYDNKAITLVPCLAGSHPQ----QTTQAMCHEIGTALAMLHETLQALQPSEQYGVPLYPWSDVR-------DRERQFMPADEAKLMSDIWQSYTDLPLATLP--KGLCHLDMFADNTLWNLSLNNSQKGEESLTGLLDFTEVSVEHYVMDIAITINDFCTTWGDAEQGESVNFDRSKMAAFLQGYESKRSLGADEKRALPVMLAKAAVIFWLLRLNVIHYNRTEGRTGDNIMVKNPDLMKRLAAYHWSHVEKAKNTVFVLLDNLLASQKDIQIVGVFSNITQAEQARDKLSNSSEFAIKEYTVDQLS 5IGI Chain:A ((2-233)) -TVVTTADTSQLYALAARHGLKLHGPLTVNELGLDYRIVIATVDD---GRRWVLRIPRRAEVSAKVEPEARVLAMLKNRLPFAVPDWRVANAELVAYPMLEDSTA-VIQP--GSSTPDWVVPQDSEVFAESFATALAALHAV--PISAAVDAGMLIRTPTQARQKVADDVDRVRREFVVNDKRLHR--WQRWLD-DDSSWPDFSVVVHGDLYVGHVL----IDNT----ERVSGMIDWSEARVDDPAIDMA-----------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5IGI.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 : 770 -43322 -56.26 -200.56 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -56.26 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.173

(partial model without unconserved sides chains): PDB file : Tito_5IGI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5igi-query.scw PDB file : Tito_Scwrl_5IGI.pdb: