Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKKLLAFALCTGAYAALFAYSVNSEQKTATSEMTDVSRLMPVKIKQTVKGQEEEMLIDTVKEAN-RKNIKISIAGAQHSMGGHTYYEDGIVLDMTGYN-KILSLD-----QEKKTIRVQSGATWNDIQKYV-NPYGLAVKVMQSQNIFTIGGSLSANAHGRD-IRYGSLIDTVKSFRLLKADGMIITVTPK--DDLFTAVIGGYGLFGVILDVTLELTDDELYVMKTEKMNYST---YSDYFSKHVKGNPDVRMHLARISTAKKGFLKDMYVTNYVLANHQDQLSSYSE-LKEDEYTG------------------ATKFALGLSRRYEWGRNWLWDTQQSY-FLSQNGTEISRNNVMRSESKFLEY-ENNDNTDVLQEYFVPVKEYGSYIDDLRQTLSDEDL----NLLNITIRYVQKNEKADLSYAKDDMFSLVL--L--INEGFSKEDQADTARIIRRMTDVAIKHGGSYYLPYMTYQTKAQMRQAY-PKSEAFFQKKRTYDPDERFMNYFYQRYK 2EXR Chain:A ((39-516)) ---------------------EILCGGAAADIAGRDFGGMNCVKPLAVVRPVGPEDIAGAVKAALRSDKLTVAARGNGHSINGQAMAEGGLVVDMSTTAENHFEVGYLSGGDATAFVDVSGGALWEDVLKRCVSEYGLAPRSWTDYLGLTVGGTLSNAGVSGQAFRYGPQTSNVTELDVVTGNGDVVTCSEIENSELFFSVLGGLGQFGIITRARVLLQPAPDMVRW-IRVVYTEFDEFTQDAEWLVSQKNESSFDYVEGFVFVN---GADPVNGWPTVPLHPDHEFDPTRLPQSCGSVLYCLELGLHYRDSDSNSTIDKRVERLIGRLRFNEGLRFEVDLPYVDFLLR---------VKRSEEIAKENGTWETPHPWLNLFVSKRDIGDFNRTVFKELVKNGVNGPMLVYPL-LRSRWDDRTSVVIPEEG-EIFYIVALLRFVPPCAKVSSVEKMVAQNQEIVHWCVKNGIDYKLYLPHYKSQEEWIRHFGNRWSRFVDRKAMFDPMAILSPG------

General information: TITO was launched using: RESULT: Template: 2EXR.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 : 2370 -193507 -81.65 -445.87 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -81.65 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.359

(partial model without unconserved sides chains): PDB file : Tito_2EXR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2EXR-query.scw PDB file : Tito_Scwrl_2EXR.pdb: