Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNIVQDKNMLPDDQWIDVCALDDLTPNTGAGALVGGQAVAIFRVGHEKRVYVLSNKDPFSQANVMSRGIIGDLQGERVVASPIYKQHFSLATGRCLEDKDQKLAVYPSKIVDGRVWVNAVPQKTYITNTGVSQDKLRLVLIGNGLAGMRCLEDLLDMVPDRYEVTVIGEEPWGNYNRIMLSPVLSGEKTI-E-DIMLHPPKWYDDKGIKFIAGDKAVKIDRPRKVVYTEKG-----QTVDYDRLILATGSAPFIPPVQGVD-LKGVLTFRDIYDVNTMIEYCG--SKNNAVVIGGGLLGLEAAYGLKQRGMNVTVLHLMDRIMERQLDGRASQLLRHSIEQKGIQIITEANTEALIGDENGHVKQIRLKDGTVLDADLVVFAVGIRPNIALAQSAGLRC--NRGVLVNDTMQTFDPSIYAVGECIEHRGQT------FGLVEPLWGQAFICATHLAEHGSLTFKAPTVPTQLKVSGVDVFSAGNFEPKDDY-----EDIILND--------EKRQIYKRIIIQ--NDRVIGAVLFGDTED---GMWYAELIADQTPVSSFRNKLLFGRDFALKNAG 3ICT Chain:A ((32-458)) ----------------------------------------------------------------------------------------------------------------------------------DRWGSRKIVVVGGVAGGASVAARLRRLSE-EDEIIMVERGEYISFANCGLPYYIGGVITERQKLLVQTVERMSKRFNLDIRVLSEVVKINKEEKTITIKNVTTNETYNEAYDVLILSPGAKPIVPSIPGIEEAKALFTLRNVPDTDRIKAYIDEKKPRHATVIGGGFIGVEMVENLRERGIEVTLVEMANQVMP-PIDYEMAAYVHEHMKNHDVELVFEDGVDALEEN---G-AVVRLKSGSVIQTDMLILAIGVQPESSLAKGAGLALGVRGTIKVNEKFQTSDPHIYAIGDAIEVKDFVTETETMIPLAWPANRQGRMLADIIHGHTDSLYKGTLGTSVAKVFDLTVATTGLNEKILKRLNIPYEVVHVQANSHAGYYPNATPVLIKLIFNKDSGKIYGAQTLGRDGVDKRMDVIATAIKANLTVLDLPDL-------------

General information: TITO was launched using: RESULT: Template: 3ICT.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 : 2127 -24748 -11.64 -63.29 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -11.64 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.541

(partial model without unconserved sides chains): PDB file : Tito_3ICT.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ICT-query.scw PDB file : Tito_Scwrl_3ICT.pdb: