Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKIIVTTCLLATGFLLTACGESQSSNESQQTTIQFMHSSVEQERLSVINELVADFEKENPDIKIKQVPVEESAFN---TKIVTLARSGKLPEVMEVS-QDFAKVMDKDELIDQTAV----QNVIEEAGEDNYYDGAKNLVRSEDGKSYIAAPISGWVQGIWYDKEKLSEAGFSEPE---NWDDILKIAQHFTDKENKQYGIAMPTAEGTMSEQAFSQFALSNGANVLD-DEGEVTIDTEKMREALSFYQN--LSQYTMPGSNDVTE--IKDAFMNGTAPMAIYSTYILPSVYEAGNSENIGF-AIPTQKDQAVYGTVSGLTISSGLDEKQKEAAEAFTAFLSQPKNMEKWVLMSPGGAQPVNKQVVELDGYKENEVIKSFGELPSEIASAFDEVQVFGLVGEKNFTKMGDITSSGVIGKAVNQVTVGNEDVDQALADAQKNTK 5F7V Chain:A ((28-305)) -----------------------------------------------ALDEMVKEFEKQNPDIKVN---VQTIAFNDYFTKLQTQIAGGDAPDAFELNYETFMQYAEKGVLADLTSYIEKDKDFDPSTLNKQAYDAFK-----YDGKQYGMVESFSNVVTI-YNKDLFDKAGVEYPTADWTWKDEEAAAKKLTDAKNKVWGTSQPV---TMNE--FYKVAAQNGGSIFNEDLTETTINSPENVEALTHLTNEVTDSKVAPSPADLSGQLPEDLFMNGQIAMLHTGIWLFDMFQDAPFKWDVQVEAGNTQK--ATHFFANGIGVSK--DSDKKEAAFKFASFMS-----------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5F7V.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 : 1093 44426 40.65 170.21 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : 40.65 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.472

(partial model without unconserved sides chains): PDB file : Tito_5F7V.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5F7V-query.scw PDB file : Tito_Scwrl_5F7V.pdb: