Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------MKIKT-ISGAERLSLKRSIDAGTEEQRKTVRSIIEDVKANGDQAVRSYTAKFDCIEIDSP---LVTKEEFEEAYTS------------------LDSRLLQVIRQAIE--NIREYHERQLQSSWFYHRKDGTML-GQKVTALDSAG-VYVPGGTAAYPSSVLMN----VIPALVA------GVERIVLVTPPGKDGLLSPG-----------VLVAAAELGIKDIYKMGGAQAIAALAY--GTET-------IEPVDKITGPGNIYVALAKREVF---GDVDIDMIAGPSEIVVLADETAIP----------SEIAADLLSQAEHD-KLSSCVFVTDSMALAETVSAEVNKQLETL-------------PRREIAEAS----VRDY--GCIYVAETMVEAIETVNTLAPEHLEIITQSPEALLGSI--KHAGAIFLGRYSPEPVGDYFAGPNHV--LPTNGTA----RFSSPLNVTDFQKKSSIISY---SQSAFEEHAESIAAFARLEGLEAHARSIEARERRISK------------------------- 5FNO Chain:A ((38-605)) VVYTLPCEDGNSTARTAEIRLKQATLLYGPSLLGNASYFPGGPLGDAISLRDQTVWEGAAVVQSLRAFTDAAKVAANIKQNGGLNSLDDFKVLYQDGWKGSVPQGIARGQSENYTSDLLFSMERLSVNPYILKRLHPTEDALPFQVDRATVKQLTKTSLKALHAAGRLFVADHSYQRNYTRLANRYSAACTALFYLDPRSNQFLPLAIKTNVGADLTYTPLDTDNNNWLLAKIMFNNNDLFHGQIFHVAYPHAIAEIVHLAALRTMSARHPVLALMERLMYQAYAVRPLGERVLFNKGGLFEQNFAYPQDMVYKFVGDSYPTTGRWRAGYLDTDVRARGLVDADYGPELPHFPFYEDGSRLVEVIRRFVRSFVDATYHESDEMVAKDAELQAWVAEANGPAGVEDFEPGPLDTRERLVEVLTHMAWLTGCAHHVLNQGEPVTASGVLPMHPTAL----YAPVPTSKANTTADLLGYLPSAQKSVDQVTLLARFNRPDVVPTNQTLRYMFAAPQLLLGNGEAYRRANQRFVRAMGRISDEVKARRFDDRGLSQGMPFIWQALDPGNIPFYLSV

General information: TITO was launched using: RESULT: Template: 5FNO.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 : 1930 -21727 -11.26 -51.36 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -11.26 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.235

(partial model without unconserved sides chains): PDB file : Tito_5FNO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5FNO-query.scw PDB file : Tito_Scwrl_5FNO.pdb: