Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKIGIDRLSFFIPNLYLDMTELAESRGDDPAKYHIGIGQDQMAVNRANEDIITLGANAASKIV---TEKDRELIDMVIVGTESGIDHSKASAVIIHHLLKIQSFARSFEVKEACYGGTAALHMAKEYV--KNHPERKVLVIASDIARYGLASGGEV--------TQGVGAVAMMITQNPRILSIE-DDSVFLTEDIYDFWRPDYSEFPVVDGPLSNSTYIESFQKVWNRHKELSGRGL---EDYQAIAFHIPYTKMGKKALQSVLDQTDEENQERLMARYEESIR----YSRRIGNLYTGSLYLGLTSLLENSKSLQPGDRIGLFSYGSGAVSEFFTGYLEENYQEYLFAQSHQEMLDSRTRITVDEYETIFSETLPEHGECAEYTSDVPFSITKIENDIRYYKI 5KP8 Chain:A ((27-395)) -QVGIEALSVYGGAAQLELRKLAQARQLDISRFD-NLMMKEKAVSLPYEDPVSYAVNAAKPIIDRLSDADKQRIEMVITCSESGIDFGKSMSTYIQEYLGLSRNCRMFELKQASYSGTAGLQMAINLILSQTFPGAKALVIATDISRFLV------YDWSFAEPSSGAGAVALLVSDTPHIFQIDVGCNGYYGYEVMDTCRPN-PDSEAGDADLSLLSYLDCCENAY-RHYQNRVEGVDYRESFDYLSFHTPFGGMVKGAHRNMMRRLKRAKPAEIEADFQRRVMPGLVYCQQVGNIMGATLFLSLASTIDNGDFSTP-RRIGMFSYGSGCCSEFYSGVVTPEGAAIAAQQGISAQLADRYSLSMEEYEQLL---------------------------------

General information: TITO was launched using: RESULT: Template: 5KP8.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 : 2132 -3298 -1.55 -9.70 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.77 3D Compatibility (PKB) : -1.55 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.469

(partial model without unconserved sides chains): PDB file : Tito_5KP8.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5KP8-query.scw PDB file : Tito_Scwrl_5KP8.pdb: