Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKAVAYQKAGPITLPEALVDIELDTPVAKGHDLLIRVQAVSVNPVDTKIRKNVSAEQSGWKVLGWDAVGTVEAIGDKVTQFKIGDVVWYAGAL-----NRQGSNSELQLVDERIVGHKPKTLEATEAAALPLTAITAWEMLFDRLQV------------PKTAPANTTILVIGGAGGVGSITIQLLKQLTNLTIIATASRPETKEWVEQLGADYVLDHRQ-SLAAQIKLLGLSAPLYVFSTTETDQHLSDIVELI-APQGHFGLIDDPDQLDI--------KP----FKSKSVSVHWEFMFTRSMFQTEDMEKQSALLNEVSKLVDEGKIKTTV--TQVLSPINAENLTRVHEQIESGSTKG-KIVLHGF 3GQV Chain:A ((12-360)) QTALTVNDHDEV-----TVWNAAPCPMLPRDQVYVRVEAVAINPSDTS------A--TPWAFLGTDYAGTVVAVGSDVTHIQVGDRVYGAQNEMCPRTPDQGAFSQYTVTRGRVWAKIPKGLSFEQAAALPAGISTAGLAMKLLGLPLPSPSADQPPTHS---K-PVYVLVYGGSTATATVTMQMLRLSG-YIPIATC-SPHNFDLAKSRGAEEVFDYRAPNLAQTIRTYTKNNLRYALDCITNVESTTFCFAAIGRAGGHYVSLNPFPE---TRKMVTTDWTLGPTIFGEGSTWPAPYGRP---GSEEERQFGEDLWRIAGQLVEDGRLVHHPLRVVQG-GF--DHIKQGMELVRKGELSGEKLVVRL-

General information: TITO was launched using: RESULT: Template: 3GQV.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 : 1781 -18310 -10.28 -59.64 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -10.28 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.440

(partial model without unconserved sides chains): PDB file : Tito_3GQV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3GQV-query.scw PDB file : Tito_Scwrl_3GQV.pdb: