Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKVMQLLPELNSGGVERGTLEIA-----RALVAQGHQSLVVSNGG--RLVSQ--LEAEGSTHLTLPIHKKSLSSLWQIRPL--RQLIEEHQPDIVHVRSR---VPAWLTHFALRKIPANKHPHLISTVHGFYSVN-RYSAIMTQAEKVIAVSDSVVKYITDHYKNCPPQDIVRIYRGIDPAAFPHNYQPSAQWFNQVFNDFPELENKFLLCLPGRITRLKGHESLIELMQKLGEQYPQLHAVVVGGADVKKQTYLSELQNTIQSKGLADKITFVGHRSDIREWLAFSDIVLSLSNQAETFGRTALEALSVGTPVIGWNRGGVAEILSHVYPQGLVEAENEKALVERVKHHIEQPQTVAPVTMFSLKDMCDQTLELYQSVLK 4XSR Chain:B ((7-356)) MKILFLDQSGKPGGAELCLIDIAKPYRDRALVG------LFADGAFKTLLEQHHIPVEVFTNQP----------LGQLAPLVAKVVQTAHEYDLIYANTQKALVVGAIASFIARR-PLVYHLHDILSPEHFSQTNLRVAVNLANRFASLVIANSQASQTAFIQAGGRAELTKVIYNGFDINLYKTSPSDISKLRQQL-----GVANNFVVGHFSRLSPWKGQHILID---ALAQCPPQVTAILVGDALFGEQDYVKELHQQITRLGLENRVKFLGFRADIPQLMAACDLVAHTSTAPEPFGRVIVEAMLCGKPVVAAKAGGAMELVEHGVNGFLTTPGESQELANIINTCIEDTQKTATI---------------------

General information: TITO was launched using: RESULT: Template: 4XSR.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1810 2071 1.14 6.47 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain B : 0.72 3D Compatibility (PKB) : 1.14 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.354

(partial model without unconserved sides chains): PDB file : Tito_4XSR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4XSR-query.scw PDB file : Tito_Scwrl_4XSR.pdb: