Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEITKKTSKNNRKEVLSLKMVNVVGAGLAGSEAAWQIAQAGVPVRLYEMRPVKSTEAHHTSNFAELVCSNSLRGNSLANAVGLLKEEMRRLNSVVITSADETAV------------PAGGALAVDRDSFSETITRKVKEHPLVTVI------------------NEEITEIPEGITVVATGPLTSH--------------------PLAESIKAFNGSDGFYFYDAAAPIVDKATIDMDKVYLKSRYDKG-----------------EAAYLNCPMTEEEFKAFHEALINAEVAELKSFEKEKYFEGCMPIEVMAQRGFKTMLFGPMKPVGLEDPKTGKRPYAVIQLRQDNAAASLYNIVGFQTHLKWGEQKRVFRMIPGLENAEFVRYGVMHRNSFMNSPELLKPTYQSTKREDLFFAGQMTGVEGYVESAASGLLAGINAARLAKEMEPVEFPQE-TAIGSMAYYITHA-----------------------EGKHFQPMNANYGLFPELPE-RIRDKKARYEAIAQRALKANEAIKTELEKTAIPNE 2ZXI Chain:D ((22-506)) ------------AWVVDEFDVVVIGGGHAGIEAALAAARMGAKTAMFVLNADT---------IGQMSCNPAIGGI----AKGIVVREIDALGGEMGKAIDQTGIQFKMLNTRKGKAVQSPRAQADKKRYREYMKKVCENQENLYIKQEEVVDIIVKNNQVVGVRTNLGVEYKTKAVVVTTGTFLNGVIYIGDKMIPGGRLGEPRSEGLSDFYRR-FDFPLIRFKTGTPARLDKRTIDFSALEVAPGDDPPPKFSFWTEPVGSYWFPKGKEQVNCWITY--TTPKTHEIIRKNLHR-----------YCPSIED------KIVKFPD-------------KERHQIFLEPEGLDTIEIYPNGLSTSLPEEVQWEMYRSIPGLENVVLIRPAYAIEYDVVPPT-ELYPTLETKKIRGLFHAGNFNGTTGYEEAAGQGIVAGINAALRAFGKEPIYLRRDESYIGVMIDDLTTKGVTEPYRLFTSRSEYRLYIRQDNAILRLAKLGRELGLLSEEQYKLVKELEREIEKWKEF--------------------

General information: TITO was launched using: RESULT: Template: 2ZXI.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 2292 11626 5.07 30.68 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain D : 0.66 3D Compatibility (PKB) : 5.07 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.403

(partial model without unconserved sides chains): PDB file : Tito_2ZXI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2ZXI-query.scw PDB file : Tito_Scwrl_2ZXI.pdb: