Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVTMQYSCGKININIPDGYGDIKDIVFSAHIIVRYNNGHCGGIDPHIIGLCKKQIRRMSLYPILIIVSRDSKV-IDDYKNL-------DIAYVDCTQCSNNFETALHVKNILKLLKIQLIHCHGYSTNYFLYMLKKLDKNGFGKVKTVITCHGWVEYNLKKKFLTYFDFWTYSMGDAFI-CVSETMKKRLESIIKNKKIVAINNGINVSNSDLDVV---GVQDFKKEFCIPNNKKIICYVGRLDPEKRPDRFLEFAEKLFLVREDVIFIMAGNGSM---------WAALKEKICHLKCRDNFRLLGEIYPAT--IVYQISDLLYIPSDTEGIPMCVLESMSQGTSVLASNVGGLSEIIEHRVDGFLFEKEDVEGVCACANFLLNDSEYLKYIGENSKSKIRKHFSVQKMFVETMRVYDELLEKSSHG 2XMP Chain:A ((37-414)) ------------------KLKGRSFVHVNS------TSFGGGVAEILHSLVPLLRSIG--IEARWFVIEGPTEFFNVTKTFHNALQGNESLKLTEEMKELYLNVNRENSKFIDLSSFDYVLVHDPQPAALIE---FY----EKKSPWLWRCHIDLSSPN-RE-FWEFLRRFVEKYDRYIFHLPEYVQPELD----RNKAVIMPPSIDPLSEKNVELKQTEILRILERFDVDPEKPIITQVSRFDPWKGIFDVIEIYRKVKEKIPGVQLLLVGVMAHDDPEGWIYFEKTLRKIGEDYDVKVLTNLIG-VHAREVNAFQRASDVILQMSIRAGFGLTVTEAMWKGKPVIGRAVGGIKFQIVDGETGFLVR--DANEAVEVVLYLLKHPEVSKEMGAKAKERVRKNFIITKHMERYLDILNSL-------

General information: TITO was launched using: RESULT: Template: 2XMP.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 : 1826 -2989 -1.64 -8.42 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -1.64 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.430

(partial model without unconserved sides chains): PDB file : Tito_2XMP.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2XMP-query.scw PDB file : Tito_Scwrl_2XMP.pdb: