Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRQEELTIHKALPADGDWKSLLFQPLPERDHYETAQGLSFSRLAGQILGTP-IDETDYYNELYELSVNDR----ITILSETLDKTIEPETFQKLQHIHSINQKEKGLSVSRFVAFLDGEKLIAKHSNPLMHRHLRKA--LMTLLHTFADSHEKGLNHPDFRRVLLDVSKFSLNHLNPWLEKTDIEREMPKVVWYGDATKSQLYFLYYLMLVGCDVLLFHPAGTDQLALVDPKQELGFTEKLPD-VSELQPFPKEKPDRKSTVAYRSTKEIEHVLNHEESMLYKPWQFRDHTPVSV-TLKTTYDELFLIT-KERAFIRPNFKADKHSIEIPNVFAKIMGVSKDNKEYWNRLHTLADYQETEMVRSFPFTEEIKSNYQFHYSHALDQEGNIDPDKLMASNVWQYKQLPAGVQTAIAKTISRMCRYPRLKALHQEQVKDVQIYLFKQTTNLPANLLKLIQMFDYAQTVPKLVLYHTEMSGGLTRSDAAALLFLNEIGIDIIIYNPPGHQDIEQFIEEDQYDIHWLDDMVFQQDYKEPSLVKRLFRTITQK 5EE0 Chain:A ((16-387)) ------------PILGRFSS---------------------HLKIGIVGLPNVGKSTFFNIVTKLSIPAENFPFCTIDPNEARVYVPDERFDWLCQLYKPKSEVS--------AYLEINDIAGLGLGNAFLSHIRAVDGIFHVLRAFED---KEVTHID--------------------DSVD--------------------------------------PVRDLETIGEELRLKDIEFVQNKIDDLEKSMKRSNDKQLKLEHELCEKVKAHLEDGKDVRFGDWKSADIEILNTFQLLTAKPVVYLVNMSEKDYQR-----------------------KKNK-FLPKIHAWVQEHGGETIIPF--------------SCAFERLLADMPPDEAAKYCAENQ-----IASVIPKIIKTGFAAIHLIYFFTAGPDEVKCWQIRRQTKAPQAAGTI----------------HTDFERGFICAEVMKFDDLKELGSESAVKAAGKYRQEGK-----TYVVQDGDIIFFKFN-----------------

General information: TITO was launched using: RESULT: Template: 5EE0.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 : 1620 -117258 -72.38 -331.24 target 2D structure prediction score : 0.43 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -72.38 2D Compatibility (Sec. Struct. Predict.) : 0.43 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.151

(partial model without unconserved sides chains): PDB file : Tito_5EE0.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5EE0-query.scw PDB file : Tito_Scwrl_5EE0.pdb: