Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRSFATQQNGIFKSV-CSLDCPDQCGLLIHKKDGKIVKVQG-------DPDHPVTAGNICNKVRNMTERIYDEKRLTTPLKRTG----------------------------------AKGQAIFEPISWKEAIDTITSRWKQLIDEEGAESILPYSFYG-NMGKLTAEGMDRRFFYRMGSSQLE--RTICSKAGSEGYKYTMG-ISAGIDPEETVHTKLFIFWGINAVSTNMHQITIAQKARKKGAKIVVIDVHKNQTGRLADWFIPIKPGTDSALALGIMHILFKEN------LHDEAFLSEYTVGYEEL-----------------------------------------------------------------------------------------------------------------------------------------------------------REHVKQYDPEKVSTITGVSTEDIYRLAKMYGET-----SPSFIRIGNGPQHHDNGGMIVRTIACLPAITGQWLHTGGGAIKHNSGIL-EYNTNA--------LQRPDL------------------------L-KGR----TP--------------RSFN-------------------MN----QLGRVL------------LETDPPIRSLFIYGTNPAVVAPEANKVRQG------------------------------L-LREDLFTVVHDLFLTETAAYADIVLPATSAFENTDFYTS-YWHHYIQLQQPVIERYGESKSNTEVFRLLAEAMGF--TDQE---------LK--DSD---------EVLIRQA--------------------------LDHPDN-------------------------------------PHL---------------------AEIDYDSLTKH-S-------------F--------------MKAKRE---------KP-L----FPGELPTPSGKIELYSEKMKQ-DGFPALPTYTPLVT--------------DNEHPFMYVPGPNHNFLNSTFSNNE-KHIKLEKT-PKLFINTKDAEKHGIVDGAPVRIWNSRGECELTAAVGEQVLPGVVVSQGLWADEQG---------KKQLVNALTPDRLSDMGGGATF----------------FSGRVQIEKV 1Q16 Chain:A ((38-1228)) ---QRWQHDKIVRSTHGV-NCTGSCSWKIYVKNGLVTWETQQTDYPRTRPDLPNHEPRGCPRGASYSWYLYSANRLKYPMMRKRLMKMWREAKALHSDPVEAWASIIEDADKAKSFKQARGRGGFVRSSWQEVNELIAASNVYTIKNYGPDRVAGFSPIPAMSMVSY--ASGARYLSLIGGTCLSFYDWYCDLPP--ASPQTWGEQTDVPESADWYNSSYIIAWGSNVPQTRTPDAHFFTEVRYKGTKTVAVTPDYAEIAKLCDLWLAPKQGTDAAMALAMGHVMLREFHLDNPSQYFTDYVRRYTDMPMLVMLEERDGYYAAGRMLRAADLVDALGQENNPEWKTVAFNTNGEMVAPNGSIGFRWGEKGKWNLEQRDGKTGEETELQLSLLGSQDEIAEVGFPYFGGDGTEHFNKVELENVLLHKLPVKRLQLADGSTALVTTVYDLTLANYGLERGLNDVNCATSYDDVKAYTPAWAEQITGVSRSQIIRIAREFADNADKTHGRSMIIVGAGLNHWYHLDMNYRGLINMLIFCGCVGQSGGGWAHYVGQEKLRPQTGWQPLAFALDWQRPARHMNSTSYFYNHSSQWRYETVTAEELLSPMADKSRYTGHLIDFNVRAERMGWLPSAPQLGTNPLTIAGEAEKAGMNPVDYTVKSLKEGSIRFAAEQPENGKNHPRNLFIWRSNLLGSSGKGHEFMLKYLLGTEHGIQGKDLGQQGGVKPEEVDWQDNGLEGKLDLVVTLDFRLSSTCLYSDIILPTATWYEKDDMNTSDM-HPFIHPLSAAVDPAWEAKSDWEIYKAIAKKFSEVCVGHLGKETDIVTLPIQHDSAAELAQPLDVKDWKKGECDLIPGKTAPHIMVVERDYPATYERFTSIGPLMEKIGNGGKGIAWNTQSEMDLLRKLNYTKAEGPAKGQPMLNTAIDAAEMILTLAPETNGQVAVKAWAALSEFTGRDHTHLALNKEDEKIRFRDIQAQPRKIISSPTWSGLEDEHVSYNAGYTNVHELIPWRTLSGRQQLYQDHQWMRDFGESLLVYRPPIDTRSVKEVIGQKSNGNQEKALNFLTPHQKWGIHSTYSDNLLMLTLG-RGGPVVWLSEADAKDLGIADNDWIEVFNSNGALTARAVVSQRVPAGMTMMYHAQERIVNLPGSEITQQRGGIHNSVTRITPKPTHMIGGYAHLAYGFNYYGTVGSNRDEFVVVRKM

General information: TITO was launched using: RESULT: Template: 1Q16.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 : 3428 71868 20.96 107.26 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : 20.96 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.415

(partial model without unconserved sides chains): PDB file : Tito_1Q16.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1Q16-query.scw PDB file : Tito_Scwrl_1Q16.pdb: