Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLFKLSKEKIELGLSRLSPARRIFLSFALVILLGSLLLSLPFVQVESSRATYFDHLFTAVSAVCVTGLSTLPVAHTYNIWGQIICLLLIQIGGLGLMTFIGVFYIQSKQKLSLRSRATIQDSFSYGETRSLRKFVYSIFLTTFLVESLGAILLSFRLIPQLGWGRGLFSSIFLAISAFCNAGFDNLGSTSLFAFQTDLLVNLVIAGLIIT--GGLGFMVWFDLAGH--VGR--KKKGRLHFHTKLVLLLTIGLLLFGTATTLFLEWNNAGTIGN---L----PVADKVL---VSFFQTVTM-RTAGFSTIDY-T--QA---HPVTLLIYILQMFLGGAPGGTAGGLKITTFFVLLVFARSELLGLPHANVARRTIAPRTVQKSFSVFIIFLMSFLIGLILLGITAK-------------------GN---PPFIHLVFETISALSTVGVTANLTPDLGKLALSVIMPLMFMG---------RIGPLTL-FVSLADYHPEKKDMIHYMKADISIG 5MRW Chain:A ((96-403)) -------------------------------------------------------------------------------------------------------------------------------------------------------------------GLSWDLALNTAVSFVTNTNWRSYS-GE-TTLS--YFSQMAGLTVQNFLSAASGIAVIFALIRAFTRQSMSTLGNAWVDLLRITLWVLVPVALLIALFFIQQGALQ--NFLPYQAVNTVEGAQQLLPMGPVASQEAIKMLGTNGGGFFNANSSHPFENPTALTNFVQMLAIFLIPTALCFAFGEVM---------------GD------RR-----QGR---MLLWAMSVIFVICVGVVMWAEVQGNPHLLALGTDSSINMEGKESRFGVLVSSLFAVVTTAASCGAVIAMHDSFTALGGMVPMWLMQIGEVVFGGVGSGLYGMMLFVLLAVFIAG-LMIGR-TPE------

General information: TITO was launched using: RESULT: Template: 5MRW.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 : 1052 -113985 -108.35 -450.53 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.55 3D Compatibility (PKB) : -108.35 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.55 QMean score : 0.260

(partial model without unconserved sides chains): PDB file : Tito_5MRW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5MRW-query.scw PDB file : Tito_Scwrl_5MRW.pdb: