Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTKRVLITGVSSGIGLAQARLFLEKGYQVYGVDQGE---KPLLEGD--FRFLQRDLTLD------LEPIFDWCPQVDVLCNTAGVLDDYKPLLEQTAQDIQEIFEINYIIPVELTRYYLTQMLENKKGIIINMCSIASSLAGGGGHAYTSSKHALAGFTKQLALDYAEAGIQVFGIAPGAVKTAMTAADFEPGGLADWVASETPIKRWIEPEEIAELSLFLASGKASAMQGQILTIDGGWSLK 4NBU Chain:C ((14-247)) --KVAIITGAANGIGLEAARVFMKEGAKVVIADFNEAAGKEAVEANPGVVFIRVDVSDRESVHRLVENVAERFGKIDILINNAGITRD-SMLSKMTVDQFQQVINVNLTGVFHCTQAVLPYMAEQGKGKIINTSSVTGTYGNVGQTNYAAAKAGVIGMTKTWAKELARKGINVNAVAPGFTETAMVAE--VPEKVIEKMKAQVPMGRLGKPEDIANAYLFLASHESDYVNGHVLHVDGG----

General information: TITO was launched using: RESULT: Template: 4NBU.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 1213 -29978 -24.71 -134.43 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain C : 0.79 3D Compatibility (PKB) : -24.71 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.79 QMean score : 0.578

(partial model without unconserved sides chains): PDB file : Tito_4NBU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NBU-query.scw PDB file : Tito_Scwrl_4NBU.pdb: