Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRHKLGLLSSLGLSFISTLTWGEETSTVLETIRIQAESTREDVSQNSSATKFTHDVLDVPFNRAYLSKQIMEQQDVQR-IDDALTLVSGVFHQNSF---GGGFWDNYSFRGFSTDPNLGAAMIRNGLSVNRGISAPK------DVVNIESLEFLKGPMAALYGRGETGGLLNLNSKKPQWESESELNLRANTQ---EQYHISLEHTAPINDELAYRLAVAHEDNQSFRDHV--SSERWFFSPQLTWKISDQTQLDFDSEFTEHKGTFDRGVSTVNHQFVMDP------KTFTGEPDDGDLKIKDYFYQLHLSHEFNPDWKLNSAVSYKDAKMV-----------------GFATEPRRMQADGRALERQRRYRDYTSEDVLAQTELLGKIDTSWARHEILLSTELGQLDYKQNQLRRNHSTSSTNTIDIYQPEYGKY-----LPNLTPFTDTKERQRYFALNVQDQIFFNDQWSVLLGNRFDQVEQDFKNHIKQTEDNQTLHQNSPRFGVNFKASDQWAFYTNYGRSF--------AMNSGMNRNGQTF---APEKGESYEVGTKYKIND-QSVLSLALFKMKKQNVLTTDP-IDKDFQTAAGEVSSKGVEFDLNSQITDRWFINANYSYTDAQIEKDQDLAKGARLSNVPKHQGSVSTNYEFLQDGARKAGVGANLTYVGERSGHNLDNGFNLPSYTLVNLNGYYAPS----DRLRYQLNVNNLFDKTYYVSSYSDLWVQP------CEPLNASISAQWKF 1BY5 Chain:A ((18-714)) ----------------------QESAW--------GPAATIAARQSATGTKTDTPIQKVPQSISVVTAEEMALHQP-KSVKEALSYTPGVSV---GTRGASNTYDHLIIRGFAAEGQS-QNNYLNGLKLQGNF----YNDAVIDPYMLERAEIMRGPVSVLYGKSSPGGLLNMVSKRPTTEPLKEVQFKAGT-DSLFQTGFDFSDSLDDDGVYSYRLTGLARSANAQQK--GSEEQRYAIAPAFTWRPDDKTNFTFLSYFQNEPETGYYGWLPKEGTVEPLPNGKRLPTDFNEGAKNNTYSRNEKMVGYSFDHEFNDTFTVRQNLRFAENKTSQNSVYGYGVCSDPANAYSKQCAALAPADKGHYLARKYVVDDEKLQNFSVDTQLQSKFATGDIDHTLLTGVDFMRMRNDINAWFGY--DDSVPLLNLYNPVNTDFDFNAKDPANSGPYRILNKQKQTGVYVQDQAQW-DKVLVTLGGRYDWADQESLNRVAGTTDKRDDKQFTWRGGVNYLFDNGVTPYFSYSESFEPSSQVGKD--------G---NIFAPSKGKQYEVGVKYVPEDRPIVVTGAVYNLTKTNNLMADPE-GSFFSVEGGEIRARGVEIEAKRPLSASVNVVGSYTYTDAEYTTDTT-YKGNTPAQVPKHMASLWADYTFFDGPLSGLTLGTGGRYTGSSYGDP-ANSFKVGSYTVVDALVRYDLARVGMAGSNVALHVNNLFDREY-VASCFNT----YGCFWG-AERQVVATATFRF

General information: TITO was launched using: RESULT: Template: 1BY5.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 : 3951 228695 57.88 362.43 target 2D structure prediction score : 0.45 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : 57.88 2D Compatibility (Sec. Struct. Predict.) : 0.45 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.118

(partial model without unconserved sides chains): PDB file : Tito_1BY5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1BY5-query.scw PDB file : Tito_Scwrl_1BY5.pdb: