Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKLLKKMMQVLLAVFFFGLLATNTVFANTTGGRFVDKDNRKYYVK-D-DHKAIYWHKIDGKTYYFGD-I-GEMVVGWQYLEIPGTGYRDNLFDNQPVNEIGL---QEKWYYFGQDGALLEQTDKQVLEAKTSENTGKVYGEQYPLSAEKRTYYFDNNYAVKTGWIYEDGNWYYLNKLGNFGDDSYNPLPIGEVAKGWTQDFHVTIDIDRSKPAPWYYLDASGKMLTDWQKVNGKWYYFGSSGSMATGWKYVRGKWYYLDNKNGDMKTGWQYL-GNKWYYLRSSG---------AMVTGWYQDGLTWYYLNAGNGDMKTGWFQV-NGKWYYAYSSGALAVNTTVDGYSVNYNGEWVQ 4NP4 Chain:A ((1835-2100)) ---------------------------------LIYINDSLYYFKPPVNNLITGFVTVGDDKYYFNPINGGAASIGET--IIDDKNY---YFNQSGVLQTGVFSTEDGFKYFAPANTLD-----ENLEGEAIDFTG-------KLIIDENIYYFDDNYRGAVEWKELDGEMHYFSPETG------------KAFKGLNQI-----------GDYKYYFNSDGVMQKGFVSINDNKHYFDDSGVMKVGYTEIDGKHFYFAE-NGEMQIGVFNTEDGFKYFAHHNEDLGNEEGEEISYSGILNFNNKIYYF-DDSFTAVVGWKDLEDGSKYYFDEDTAEAYIL---------------

General information: TITO was launched using: RESULT: Template: 4NP4.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 : 1057 10086 9.54 40.67 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : 9.54 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.364

(partial model without unconserved sides chains): PDB file : Tito_4NP4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NP4-query.scw PDB file : Tito_Scwrl_4NP4.pdb: