Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MREELKGIFASVFGEK-EGLRFFFAPGRVNLIGEHTDYNGGHVFPCALTMGTYAAVAERNDGLVRMYSDNFRNAGIKECSLDDIRYQKEDDWANYPKGVIYEFQQRGYAVPHGFDIVFSGNIPNGAGLSSSASIELLMGVVLQSYFHPEVDALELVKMAQHAENHFIGVNCGIMDQFAIGMGKKHHAMLLNCDTLDYEYSKLNVSGLALVIANTNKKRTLADSSYNTRRQECNDALLDLKKGLDIAALGDIKPSDFDAHSSLIQNETNRRRAKHAVYENHRAIKTAHMFKENNIDEIGQLMKESHLSLKDDYEVTCPELDELVFAAWDHEGVIGSRMTGAGFGGCTISIVKDEFVDDFIQKVGDRYQEKTGLRADFYVADIG-EGARELKGE 4HAC Chain:A ((10-320)) --------HSSGLVPRGSHMVSCSAPGKIYLFGEHAVVYGETAIACAVELRTRVRAELNDS--ITIQSQ-IGR-----TGL-------DFEKHPYVSAVIEKMRKSI--PINGVFLTVDSDIPVGSGLGSSAAVTIASIGALNELFGFGLSLQEIAKLGHEIEIKVQGAA-SPTDTYVSTFGGV---VTIPERR------KLKTPDCGIVIGDTGVFSSTKE--LV-------ANVRQLR---------ESYPDLI-------------EPLMTSIGKI--SRIGEQLVLSGDYASIGRLMNVNQGLLDA-LGVNILELSQLIYSARA-AGAFGAKITGAGGGGCMVALTAPEKCNQVAEAVAGA-------GGKVTITKPTEQGLKV----

General information: TITO was launched using: RESULT: Template: 4HAC.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 : 1865 -31783 -17.04 -102.86 target 2D structure prediction score : 0.03 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -17.04 2D Compatibility (Sec. Struct. Predict.) : 0.03 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.542

(partial model without unconserved sides chains): PDB file : Tito_4HAC.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4HAC-query.scw PDB file : Tito_Scwrl_4HAC.pdb: