Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------MIMQIRQFQAQRMQAPRDFTPIENTPICVEIGAGKGKHALLFSGQNPQHTLYAIERTR--EKFLAMQKQHGLEPRDNLI--PVHADALPWVVHALYPAQVEHFFILYPNPEPHNPAQRWLNMPFFEFLLSRLKTGGTITLAGNIPEYIEEAEQQLLNVWKLPYQKEKIAQTSARTHFEIKYLERGELCQQLIMTKPEGYNTRFDEFAPLQGQIHVE---------------------------------------------------------------------------------------------------------------------- 4QPP Chain:A ((48-376)) YYECYSDVSVHEEMIADRVRTDAYRLGILRNWAALRG-KTVLDVGAGTGILSIFCAQAGAR-RVYAVEASAIWQQAREVVRFNGLEDRVHVLPGPVETVELPEQVDAIV-SEWMGYGLLHES----------MLSSVLHARTKWLKEGGLL-LPASAELFIVPISDQMLE-WRLGFWSQVKQHYGVDMSCLEGFATRCLMGHSEIVVQG---LSGEDVLARPQRFAQLELSRAGLEQELEAGVGGRFRCSCYGSAPMHGFAIWFQVTFPGGESEKPLVLSTSPFHPATHWKQALLYLNEPVQVEQDTDVSGEITLLPSRDNPRRLRVLLRYKVGDQEEKTKDFAMED

General information: TITO was launched using: RESULT: Template: 4QPP.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 : 747 -21024 -28.14 -108.37 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -28.14 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.266

(partial model without unconserved sides chains): PDB file : Tito_4QPP.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4QPP-query.scw PDB file : Tito_Scwrl_4QPP.pdb: