Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLKEIKRRNRMKNKRLIGIIAALAVLVAGSLIYSSMNKSEAQNNKDEKKITKIGVLQFV-SHPSLDLIYKGIQDGLAEEGYKDDQVKIDFMNSEGDQSKVATMSKQLVANGNDLVVGIATPA--AQGLASA--TKDLPVIMAAITDPIGANLVKDLKKPGGNVTGVSDHNPAQQQVELIKALTP--NVK--TIGALYSS--SEDNSKTQVEEFKAYAEKAGLT---VETFAV--PSTNEIASTVTVMT---SK--VDAIWVPIDNTIASGFPTVVSSNQS-SKKPIYPSATAM-----VEVGGL----ASVVIDQHDLGVATGKMIVQVLKGAKPADTPVNVFSIGKSVINKKIAQELGITIPESVLKEAGQVIE 4KZK Chain:A ((37-310)) --------------------------------------------------VKIGFVVKQPDDPWFQDEWRFAEQAAKDKHF-----TLVKIAA-PSGEKVSTALDSLAAQKAQGVIICAPDVKLGPGIAAKAKRYGMKLMSVDDQLVDGRGA--P--LADVPHMGISAYRIGRQVGDAIAAEAKRRGWNPAEVGVLRLAYDQLPTARERTTGAVDALKAAGFAAANVVDAPEMTADTEGAFNAANIAFTKHRNFRHWVAFGSNDDTTVGAVRAGEGRGIGTDDMIAVGINGSQVALNEFAKPKPTGFFGSILLNPRLHGYDTSVNMYDWITQNR-----------------------------------------

General information: TITO was launched using: RESULT: Template: 4KZK.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 : 1272 34946 27.47 143.81 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : 27.47 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.420

(partial model without unconserved sides chains): PDB file : Tito_4KZK.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4KZK-query.scw PDB file : Tito_Scwrl_4KZK.pdb: