Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTTAQIELDELSVGADYEKVANRFRPIFEKIAQGAIQREKERILPFEPIQWLKEAKLGAVRIPRKYGGDGVSLPQLFQLLAELAEADSNIVQALRGHFA---FVEDRLVAHKEHSQEVWFQRFVQGDLVGNAWTEVGNVQIGDVVTRVTKDASGNLVVNGEKYYSTGSIFADWIDLFAYDEVNDRH------VIAAIYRHETGVSVIDDWDGFGQKTTGSGTLKVHQVHL--------PASHLIPFDQ--RFKYQTAFYQVVHLATLTGIARAAVETFSQEIRERKRIFSHGNGDLVRHAPQVLQVVGKASAQAYASEVITLKTAEALQKAYESHFAESEVKEHQFNVDAELESAQGQVVISNLVLDLTSQLFNALGASASSQVKQLDRFWRNARTVSSHNPLIYKEKVIGDWEVNRTDLPFVWQIGASPRAKSA 4NXL Chain:A ((19-407)) -----------------DPVA-VARGLAEKWRATAVERDRAGGSATAEREDLRASGLLSLLVPREYGGWGADWPTAIEVVREIAAADGSLGHLFGYHLTNAPMIE--LIGSQEQEEHLYTQIAQNNWWTGNASSE-NNSHVLDWKVSATPTEDGGYVLNGTKHFCSGAKGSDL--LFVFGVVQDDSPQQGAIIAAAIPTSRAGVTPNDDWAAIGMRQTDSGSTDFHNVKVEPDEVLGAPNAFVLAFIQSERGSLFAPIAQLIFANVYLGIAHGALDAAREYTRTQARPWTPAGIQQATEDPYTIRSYGEFTIALQGADAAAREAAHLLQTVWDKGDALTPEDRGELMVKVSGVKA----LATNAALNISSGVFEVIGARGTHPRYGFDRFWRNVRTHSLHDPVSYKIADVGKHTLN-------------------

General information: TITO was launched using: RESULT: Template: 4NXL.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 : 0 0 NaN 0.00 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : NaN 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.73 QMean score : ?

(partial model without unconserved sides chains): PDB file : Tito_4NXL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NXL-query.scw PDB file : Tito_Scwrl_4NXL.pdb: