Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNQLIQAQKKLLPDLLLVMQKRFEILQYIRLTEPIGRRSLSASLGISERVLRGEVQFLKEQNLVDIKTNGMTLTEEGYELLSVLEDTMKDVLGLTLLEKTLKERLNLKDAIIVSGDSDQSPWVKKEMGRAAVACMKKRFSGKNIVAVTGGTTIEAVAEMMTPDSKNRELLFVPARGGLGEDVKNQANTICAHMAEKASGTYRLLFVPGQLSQGAY-SSIIEEPSVKEVLNTIKSASMLVHGIGEAKTMAQRRN----TPLEDLKKIDDNDAVTEAFGY-YFNADG---EVVHKVHSVGMQLDDIDAIPDIIAVAGGSSKAEAIEAYFKKPRNTVLVTDEGAAKKLLRDE 3KV1 Chain:A ((12-260)) ------------------------------------------------------------------------------------------------LEQKLVEKFNLKRALI-SLDQPNTNEQRKQVAALVSSYLNNNLQEGMAVAVGQGQNVAAVADHAGIVTQ-RNARFVSAIGGTH--IIN-ADHICRRLAKKYGGSSETLYAPAYVNDPSLRSAFMEHATIKETLSQARKAEFALVGIGDMDENSHMVKLGFFTPKEFVEARLNDGIVGDIGGFDFFKLDGTDADTLMRGRVIGLEMEDLRQIPNVVAMASESRKALSIMGALRTGVIDVLATSVSCAMALL---

General information: TITO was launched using: RESULT: Template: 3KV1.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 : 1404 -56350 -40.13 -238.77 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -40.13 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.469

(partial model without unconserved sides chains): PDB file : Tito_3KV1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3KV1-query.scw PDB file : Tito_Scwrl_3KV1.pdb: