Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSQHETPLYTGLKKHASRQPVQFHIPGHKKGAGMDPEFRQFIGENALSIDLINIEPLDDLHAPKGIIKQAQDLAAEAFGAD---HTFFSVQGTSGAIMTMVMAVCGPGDKIIIP-RNVHKSIM-TAIVFSGAVPIFIHPEIDNELGISHGITLESAKRALTEHPDAKGLLVINP-TYFGVAADLKSIVELAHSFDVPVLVDEAHGVHIHFHDELPLSAMQAGADIAATSVHKLGGSLTQSSILNMREGLVSKDRVQSIL-----------------SMLTTTSTSYLLLASLDVARKRLATE-G-RQLAEETLKLANQTRDRLNQIEGIYCVGSEILGSKAAYSYDPTKLIISVKSL-GLTGHDVEKWLRESFNIEVELSD---LYNILCIFTPGDSQNDADRLVEALTEIAQQMSEQDVTHQQTEVLLPEIPLLAMTPRDAFYANTEVIPLKEASGRIIAEFVMVYPPGIPIFIPGEIITEENISYIFKNLDAGLPVQGPEDSTLHMIRVIKEQKAIQ 1M32 Chain:A ((36-364)) ---------------------------------------------------------------IGVVEQIRQQLTALATASEGYTSVLLQGSGSYAVEAVLGSALGPQDKVLIVSNGAYGARMVEMAGLMGIAHHAYDCGEV------ARPDVQAIDAILNADPTISHIAMVHSETTTGMLNPIDEVGALAHRYGKTYIVDAMSSFGGI-PM---DI-AALHIDYLISSANKCIQGVPGFAFVIAREQKL--AACKGHSRSLSLDLYAQWRCMEDNHGKWRFTSPTHTVLAFAQALKELAKEGGVAARHQRYQQNQRSLVAGMRAL-GFNTLLDDEL-------HSPIITAFYSPEDPQYRFSEFYRRLKE-QGFVIYPGKVSQSDCFRIGNIGEVYAADITALLTAIRTAMYW---------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1M32.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 : 1559 -212349 -136.21 -707.83 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : -136.21 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.549

(partial model without unconserved sides chains): PDB file : Tito_1M32.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1M32-query.scw PDB file : Tito_Scwrl_1M32.pdb: