Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKIVKYSSLAALGLVAAGVLAACSGGAKKEGEAASKKEIIVATNGSPRPFIY-EE-NGELTGYEIEVVRAIFKDSDKYDVKFEKTEWSGVFAGLDADRYNMAVNNLSYTKERAEKYLYAAPIAQNPNVLVVKKDDSSIKSLDDIGGKSTEVVQATTSAKQLEAYNAEHTDNPTILNYTKADFQQIMVRLSDGQFDYKIFDKIGVETVIKNQGLD------NLKVIELPSD-QQPYVYPLLAQGQDELKSFVDKRIKELYKDGTLEKLSKQFFGDTYLPAEADIK 3KZG Chain:B ((18-245)) ------------------------------------SLNLTIGTSKFNPPFEVWSGNNSSLYGFDIDLMQEICRRL-HATCTFEAYIFDDLFPALKNREVDLVIASMIITDERKKHFIFSLPYMESNSQYITTVD-SKISTFDDLHGKKIGVRKGTPYARQVLSE---NRN--NQVIFYEL-IQDMLLGLSNNQVDASLMDYEAAKYWMASEPYAYKLIGKKYKLIGKKISIGEG-YSIMANPDQFVLIKKINKILLEMEADGTYLRLYSEYF------------

General information: TITO was launched using: RESULT: Template: 3KZG.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 : 1121 35816 31.95 163.54 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain B : 0.69 3D Compatibility (PKB) : 31.95 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.446

(partial model without unconserved sides chains): PDB file : Tito_3KZG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3KZG-query.scw PDB file : Tito_Scwrl_3KZG.pdb: