Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTQHLSKHRHISFTAHYTGYIWYQMGISHEALATSKGKSLAYLVHPLESWAEKYVGGSMRTTLKQRHTMLDHDLEKLIQENPDLQVLEIACGLSPRGWWFRQHYPSISYRELDLPDMAQAKQNALQQIE-KNAPEVLSVDLFTEAFAQAFEVFDSNRPLVVISEGLINYFDKDLLKQLIQSIAHYGASFKKLHYLT-DLYPEPVKNKLASIIWNSSKLLKLMSRSSFSFHFKTPLEVKDFFKDAGFSQVNVEQPQIFFGQVSKDSDEEHLGDLVWTIHAQLK 3MCZ Chain:B ((179-336)) ---------------------------------------------------------------------------------RARTVIDLAGGHGTYLAQVLRRHPQLTGQIWDLPTTRDAARKTIHAHDLGGRVEFFEKNLLDAR------NFEGGAADVVMLNDCLHYFDAREAREVIGHAAGLVK--PGGALLILTMTMNDDRVTPA-LS-ADFSLH-MMVN-TNHGELHPTPWIAGVVRDAGLAVGER-------------------------------

General information: TITO was launched using: RESULT: Template: 3MCZ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 737 -17759 -24.10 -113.84 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain B : 0.62 3D Compatibility (PKB) : -24.10 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.463

(partial model without unconserved sides chains): PDB file : Tito_3MCZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3MCZ-query.scw PDB file : Tito_Scwrl_3MCZ.pdb: