Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MATPVTDPPKIIGRELHLDRLIGSGGFGEVYLAVRTKLATNPKHNFTFPAECVVKVMRRGLCTEEDVAAMNREVATLSSMD-HPYIVAYIGAWVEAARGKFFGCYCLAMKYCEGGDLHGFIAQCIKAHRLPPVDVAVRIMAQVFSALNYSHSRRLIHRDIKPGNVFLTLQKSGVPD--------KAMVGDYGLVRSLEATRQLVKTRVGTPTYISPEIAAGEA-------YSTKTDIFSAGTMFYELLSL-HRPFWKRMMTDQQLFREVLHRDPMPQFRAYTSSVYGTALADVIEACLTKHEANRATAYDALVRLTSPITAYVLKYAIPVYPEKDALTTSPPRPPAASSAPDGHASAADADGDAATARQRLERLFLVRKGTAVGARLTRLLSHNAELLFQVRVLVACRSDNTDHLENGLAELLWA-FPDAEVPFQEVIDLVMSDYRQLAE---- 2RIO Chain:A ((8-434)) ------NFEQSLKNLVVSEKILGYGSSGTVVFQGSFQ-----------GRPVAVKRML-----IDFCDIALMEIKLLTESDDHPNVIRYYCSETTD------RFLYIALELCNLN-----LQDLVESKY-----NPISLLRQIASGVAHLHSLKIIHRDLKPQNILVSTSSRFTADQQTGAENLRILISDFGLCKKLD----------STSGWRAPELLEESNNLQTKRRLTRSIDIFSMGCVFYYILSKGKHPFGDKYSRESNIIRGIF---SLDEMKCLHDRSLIAEATDLISQMIDHDPLKRPTAMKVLRHPLFWPKSKKLEFLLKVSDRLEIENRDPPSALLMKFDAGSDFVIPSGD-----WTVKFDKTFMDRKYH--SSKLMDLLRALRNKYHHFMDLPEDIAELMGPVPDGFYDYFTKRFPNLLIGVYMIVKENLSDDQILREFLYS

General information: TITO was launched using: RESULT: Template: 2RIO.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 : 1825 -33506 -18.36 -89.59 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -18.36 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.321

(partial model without unconserved sides chains): PDB file : Tito_2RIO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2RIO-query.scw PDB file : Tito_Scwrl_2RIO.pdb: