Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MANGNKQAGQRISPSLTLLLATACGIIVANLYYAQPLVGL-ISKAIGLSPSGAGLIVTLTQIGYVAGLLFLVPLGDII-ENKKLIVVSLLLSAAALTLTAFVK-HGTLFLAAAFFVGLGS-IAAQVLVPFASYLASDA-ARGRVVGNVMSGLLLGIMLSRPISSLVADI--------WGWNAIFALSAVVSVILAIVLSKVLPARKPTAN--TNYTA-LLGSM---------------------------------------W--KLLRTTPVLRR---RAIYHAFVFGAFSLFWTTVPLLLSGPDFHFS---------QKAIALY-ALVGIAGAVTAPIGGRLADRGLT-RLATGIALGVVVVSLLLPLMIQS---SSPVGITVLVAAAILLDMGVSANLVLSQRAIFSLAPEIRSRLNGLFMAIFFLGGAIGSSIGGWAYASGG----------WSTALWIGIAFPVIALLYFITEK 4TPH Chain:A ((30-477)) --------------------------------GMQALIVYFMVQRLGFDDSRANLVWSACAALIYVSPAIGGWVGDKILGTKRTMLLGAGILSVGYALMTVPTENTWFMFSALGVIVVGNGLFKPNAGNLVRKIYE--SKIDSAFTIYYMAVNVGSTFSMLLTPWIKDYVNAQYGNEFGWHAAFAVCCVGILVGLGNY-ALMHKSLANYGSEPDTRPVNKKSLAIVLALAALSVVASAIILEYEDVARVFVYAAGVAVLGIFFHL----ERAGLIAALILTVQTVFFFIFYQQMSTSLALFALR-NVDWDFQVFGTHLWTWSPAQFQALNPIWIMVLSPVLAW-------IAAKFALGFAVVAIGFFIYGFAGQFAVNGKTSSWVMIWGYASYSLGELLVSGLGLAMIAR--------MMGAYFVASGISQYLGGVVANFASVPQDLVDPLQTLPVYTNLFNKLGVAAVVC--------

General information: TITO was launched using: RESULT: Template: 4TPH.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 : 1549 -243522 -157.21 -733.50 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -157.21 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.267

(partial model without unconserved sides chains): PDB file : Tito_4TPH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4TPH-query.scw PDB file : Tito_Scwrl_4TPH.pdb: