Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKIVKYSSLAALGLVAAGVLAACSGGAKKEGEAASKKEIIVATNGSPRPFIYEENGELTGYEIEVVRAIFKDSDKYDVKFEKTEWSGVFAGLDADRYNMAVNNLSYTKERAEKYLYAAPIAQNPNVLVVKKDDSSIKSLDDIGGKSTEVVQATTSAKQLEAYNAEHTDNPTILNYTKADFQQIMVRLSDGQFDYKIFDKIGVETVIKNQGLDNLKVI--ELPSDQQPYVYPLLAQGQDELKSFVDKRIKELYKDGTLEKLSKQFFGDTYLPAEADIK 1GGG Chain:A ((5-222)) ---------------------------------------LVVATDTAFVPFEFKQGDLYVGFDVDLWAAIAKEL-KLDYELKPMDFSGIIPALQTKNVDLALAGITITDERKKAIDFSDGYYKSGLLVMVKANNNDVKSVKDLDGKVVAVKSGTGSVDYAKA-NIKTKDLRQFPNIDNA-----YMELGTNRADAVLHDTPNILYFIKTAGNGQFKAVGDSLEAQQYGIAFP---KGSDELRDKVNGALKTLRENGTYNEIYKKWFG-----------

General information: TITO was launched using: RESULT: Template: 1GGG.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 : 1025 -34854 -34.00 -161.36 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.74 3D Compatibility (PKB) : -34.00 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.407

(partial model without unconserved sides chains): PDB file : Tito_1GGG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1GGG-query.scw PDB file : Tito_Scwrl_1GGG.pdb: