Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGVDISSTSVKLLELSVKNGKYWVESYALMPLPENSVVEKNILNPEAVAEALERAMNLANPQTTHAAIAVPTSTVIHKTIEMDADMSDDEREVQIRVDAEQYIPFPLDEVSLDFEVLPDRLANPNRVNVLLVATRTENVETRVEVLELADLNPKLADVESYAVERTFSVFADSLPIGANTIGILDIGHTMTTLSVMQNGKIIYTREQVFGGKQLTLEIQSRYGLSLEEASRAKKDRSLPDDYEIEVLDPFLDAVVQQAARSLQFFFSSSQFNEIDHILLAGGNANIPGLAKLLQQKLGYRVTIANPFLQMGFSPQVDVQKIENDASSLMVACGLALRSFD 3H1Q Chain:B ((31-271)) VGVDLGTADIVLVVTDQE-G-IPVAGALKWASV---VKDGLVVDYIGAIQIVRELKAKVERLL-----GSELFQAA---TAIPP------------------------------------------------GTVGRNAEACGHVVAGAGLELVTLVDEPVAAARALGIN---------DGIVVDIGGGTTGIAVIEKGKITATFDEPTGGTHLSLVLAGSYKIPFEEAETIKKDFSRH-REIMRVVRPVIEKMALIVKEVIKNY------DQTLPVYVVGGTAYLTGFSEEFSRFLGKEVQVP-------------------IHPLLVTPLGIALF---

General information: TITO was launched using: RESULT: Template: 3H1Q.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 : 1354 -168670 -124.57 -699.88 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain B : 0.67 3D Compatibility (PKB) : -124.57 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.460

(partial model without unconserved sides chains): PDB file : Tito_3H1Q.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3H1Q-query.scw PDB file : Tito_Scwrl_3H1Q.pdb: