Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----MLTHDLHEK------TKHYISIY---AELKTKLKWKVSHDQILMLISSA-YIVNKREFDFQRFYDLSSYIKSNIG-------SFSTLNSHHRF--TVASILDIHFQHEAKQTFQTF-IDVYNEM--VKLGYKRD-------MFTYLSALILLTGKSETTNQKEQ------------------MNMGLAVYQQMKKNHYFLTSTQNVPLAVLLGENGKGLQALQK--------------AETCYQLLAANGFKKGQ---YLHQV-----SHILALQSEKEPEML---VSACKQIYQSITESVKKTKDYHYPDLALLTFLEEPDIKTVLCITDELNQEKAFKWQKEMNFKIAVSLY----------LSEHMEKNLLMESGLYTAIETVIQAQQAAATAAIISSTAASHTHDGN--------- 4J1Q Chain:A ((20-445)) HMERLMLEPVWEKQNEELSYTEHIIVLFETERSVTDSIASHMKDARVITLNEAVGHIAERYQCYMQNIFELLQSKVRKLSAGRIIIQAIVPLEKEKQLFAGVSGLFKTAEIEFSKLTAQVIEIEKPEEMIDLHLKLKDDSRRPFDKQIRYEAGYRFVKGWREMVDTLHMPWRDEGVYLITGGAGSLGLLFAKEIANRTGRSTIVLTGRS-----VLSEDKENELEALRSIGAEVVYREADVSDQHAVRHLLEEIKERYGTLNGIIHGAGSSKDRFIIHKTNEEFQEVLQPKVSGLLHVDECSKDFPLDFFIFFSSVSGCLGNAGQADYAAANSFMDAFAEYRRSLAASKKRFGSTISFNWPLWEEGGMQVGAEDEKRMLKTTGMVPMP---TDSGLKAFYQGIVSDKPQVFVMEGQLQKMKQKLL

General information: TITO was launched using: RESULT: Template: 4J1Q.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 : 1388 -126490 -91.13 -394.05 target 2D structure prediction score : 0.41 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -91.13 2D Compatibility (Sec. Struct. Predict.) : 0.41 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.101

(partial model without unconserved sides chains): PDB file : Tito_4J1Q.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4J1Q-query.scw PDB file : Tito_Scwrl_4J1Q.pdb: