Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MHGRSRLYRY-LKSGRLSAKAGFDRYPDLRVKQLGGSHNVYLVSDHRSHK-KCIVKSFAGSGPKSVQHMEKEYKR-LRQAGRLVDDRR-WVHVARPLCKSNGEGFFA-EELVSGKALGDYMRDAMANG-RDSELYEKLTMLA-GFLALL-HKKTERPSHVKP-----SNIRDELKKHARQASKGGAFAPHEL-KRI-ESLVDNVTSNDLISQTRRGLVHGDANPSNF-LYDKKR--LNVIDMERSGYRDP-VYDLGMLAGELCHYA-MKYGGNEYKADPFIGHLYWTYAGNFKDQLGTFIRLTGRNP-----IYMANS-LLRIARHPFF---------SPEYKRRLARK-------AYECLKSLKK 3DXP Chain:A ((20-359)) RFDTEALEAWMRQHVE-----GFAGPLSVEQFKGQSNPTFKLVTPGQTYVMR-----------AKPGAIEREYRVMDALAGTDVPVAKMYALCEDE--SVIGRAFYIMEFVS-----GRVLWDQSLPGMSPAE--RTAIYDEMNRVIAAMHTVDYQAIGLGDYGKPGNYFQRQIERWTKQYKLSETESIPA-MDSLMDWLPQHIPQED---ADLTSIVHGDYRLDNLMFHPTEPRVLAVLDWELSTLGHPMG--------DFGYHCMSWHIAPGQFRGIAGLDHAALGIPDEASYRKLYEQRTGRPITGDWNFYLAFSMFRIAGILQGIMKRVVDGTASSAQALDAGKRARPMAEMGWEYAKKAKQ

General information: TITO was launched using: RESULT: Template: 3DXP.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 : 1305 50624 38.79 176.39 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.58 3D Compatibility (PKB) : 38.79 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.275

(partial model without unconserved sides chains): PDB file : Tito_3DXP.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3dxp-query.scw PDB file : Tito_Scwrl_3DXP.pdb: