Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKRMIVRMTLPLLIVCLAFSSFSASARAASEEKYWDHWIERHAQPLD--ASNASNKDLRFLKKVLKGKRIVQLGETTHGAGEINATKVRMIKYLHEELGYDVLAFESGFPDTNASYLNMDQL--TPKSTMKNSIYAVWHTEDVVELFDYMKEQKEK---GDPLILTGFDIQSMKNSFNVAATQWVKAVDPEKAELLSQSENDFSTLVTDSNTFD-EFSQKKEKLVKNYQKLIKFTKTHASELKENLPKEPKAYEMFMHSLQLRIDVMETYMLEEMKEKLEEYPENIEDFSFFMRDRMMAEQFQWVADTLYPKKKIIVWGHNYHLRKQNTKMIKDWVQLNGPNMGDYLPERLKKQTYTIGIYAYSGASLDSS-DN--KTVKPVTSPPPSGSLEALLKAADRPAVFVDFLHTKNKKGTSWMYTPRTALYWGYME--------EQMILKEQYDGVIWLEHITPSVIIK 3B55 Chain:A ((36-442)) ----------------------------PYNTNQIAKWLEAHAKPLKTTNPTASLNDLKPLKNMVGSASIVGLGEATHGAHEVFTMKHRIVKYLVSEKGFTNLVLEEGWDRALELDRYVLTGKGNPSQHL----TPVFKTKEMLDLLDWIRQYNANPKHKSKVRVIGMDIQSVNENVYNNIIEYIKANNSKLLPRVEEKIKGLIPVTKDMNTFESLTKEEKEKYVLDAKTISALLE---EN-KSYLNGKSKEFAWIKQNARIIE-QFTTML--------ATPPDKP-ADFYLKHDIAMYENAKWTEEHL---GKTIVWGHNGHVSKTNMLSF-----IYPKVAGQHLAEYYGKRYVSIGTSVYEGQYNVKNSDGEFGPYGTLKSDDPN-SYNYIFGQVKKDQFFIDLRKANG-VTKTWLNEQHP-IFAGITTEGPDIPKTVDISLGKAFDILVQIQKVSPSQVH-

General information: TITO was launched using: RESULT: Template: 3B55.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 : 2158 -154124 -71.42 -397.23 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -71.42 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.426

(partial model without unconserved sides chains): PDB file : Tito_3B55.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3B55-query.scw PDB file : Tito_Scwrl_3B55.pdb: