Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------------MMNLSKVCKGVRQLKKYGPFLAIFFIALAFLMPHLFTHKLILGADAPFHYNRFYDAAQQIKYGDFHYFPSLYGFQQSGRIVNAVYGPFFAYLQGLIVLLAGSWFHYQILSNFI-LYLISGFSMLILLRYVNVRNWVSVPVAVLFMSTYSIQYWSINQ-GFTSWGTCFYPLCMIPIADF-VLHKKFPVIKVAVSVGLMTQIHLLSSIMLALMYIPFYLYYFFNQTEKG----KALLQLIKSVLLYFVLTANIWAGLAIVYS-------GNKILP----PFVNREMSQKAIDLDGSYWLHYPKAFPILILSGFLLFIFF-QQKNTLFQKIVLYTSLVFFFLSTSLIP--------WTTLIEKNVPFISL---IQFPFRFF---------VPFTLLLLLYLALSLNQWSEQKWFRLLSIFGILIFSAQTIQNLYQ--HLEKWENE-TFVSRHTYLFDTPEEARKTFF-SKDMSTSLFVF-----------QKTTPDYLPIYKETKDN---KYDRYNEEILENETTFIKTHPGGLL--TIKWKNTGDKTVHIPVIVYDRTVLQQNGKTLTDYEVTDIGTPIVKQQKGINELTLHYQTPIYFYFILSLTLIGWFTLLCLFIYHRYKLLRA----- 5C37 Chain:A ((1-655)) EQQVPILEKFCFTPHTEEGCLSERAALQEELQLCKGLVQALQTKAQIPRDPSQQELPRLLSAACRLQLNGNLQLELAQVLAQERPKLPED-PLLSGLLDSPALKACLDTAVENMPSLKMKVVEVLAGHGHLYSRIPGLLSPHPLLQLSYTATDRH---PQALEAAQAELQQHDVAQGQWDPADPAPSALGSADLLVCNCAVAALGDPASALSNMVAALREGGFLLLHTL------LRGHPLGDIVAFLTSGQGILSQDAWESLFSRVSLRLVGLKKSFYGSTLFLCRRPTPQDSPIFLPVDDTSFRWVESLKGILADEDSSRPVWLKAINCATSGVVGLVNCLRREPGGNRLRCVLLSNL----SSTSHVPEVDPGSAELQKVLQGDLVMNVYRDGAWGAFRHFLLEEDSKTGCPAHKSYIIAGGLGGFGLELAQWLIQRGVQKLVLTSRSGIRTGYQAKQVRRWRRQGVQVQVSTSNISSLEGARGLIAEAAQLGPVGGVFNLAVVLRDGLLENQTPEFFQDVCKPKYSGTLNLDRVTREACPELDYFVVFSSVSCGRGNAGQSNYGFANSAMERICEKRRHEGLPGLAVQWGAIGDVG--ILVETMSTNDTIVSGTLP--------QRMASCLEVLDLFLNQPHMVLSSFVLAE

General information: TITO was launched using: RESULT: Template: 5C37.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 : 2806 -136672 -48.71 -252.16 target 2D structure prediction score : 0.44 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -48.71 2D Compatibility (Sec. Struct. Predict.) : 0.44 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.158

(partial model without unconserved sides chains): PDB file : Tito_5C37.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5C37-query.scw PDB file : Tito_Scwrl_5C37.pdb: