Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MNNEPVKRGKKNRWELNLPIMTYVVADDWIDKLGRETFTLWLRFHTWVDREDELRDYDRIPRSFENIYKKTLGISKSKFYRLIKPLWEYG-LIDIIEYEESNRNSTKPKNIIVYEYPLHEIERKYKPLEKLRDWDKDYNSVSKELGKTGGRPRKKDSEEEPEKKPEEVTKKKRKYKLKRVIHNGFKNETVEG---------FKNETVEGFKNETVTVSKIKPNNYSN---IFNNLSNIS-TNVSNNLLIDDDEEIENE--PTGRTINRSLLFSQEDIKQAYQFINRFSVIQLRENFSFDKHFEERLVCYLWKAGISTFYTHEISKMIKKIADYEKSKKGRLNPIRDRALYMVNGLVMNRASSQSEHATYKLNQYKKQKEQEKQQQEQQRSRVPFYNWLEEREEQTEGQLPTT--- 4M59 Chain:A ((6-714)) PDAQVLVLAISSHPLPTLAAFLASRRDELLRADITSLLKALELSGHWEWALALLRWAGKEGAADASALEMVVRALGREGQHDAVCALLDETPLPPGSRLDVRAYTTVLHALSRAGRYERALELFAELRRQGVAPTLVTYNVVLDVYGRMGRSWPRIVALLDEMRAAGVEPDGFTASTVIAACSRDGLVDEAVAFFEDLKARGHAPSVVTYNALLQVFGKAGNYTEALRVLGEMEQNGCQPDAVTYNELAGTEEAARCLDTMASPNAFTYNTVMTAYGNVGKVDEALALFDQMKKTGFVPNVNTYNLVLGMLGKKSRFTVMLEMLGEMSRSGC--TPNRVTWNTMLA----VSGKRGMEDY--VTRVLEGMRSSGVELSRDTYNTLIAAYGRCGSRTNAFKMYNEMTSAGFTPCITTYNALLNVLSRQ-------GDWST-AQSIVSKMRTKGFKPN----EQSYSLLLQCYAKGGNVAGIAAIENEVYGSGAVFPSWVILRTLVIANFKCRRLDGMETAFQEVKARGYNPDLVIFNSMLSIYAKNGMYSKATEVFDSIKRSGLSPDLITYNSLMDMYAKCSESWEAEKILNQLKCSQTMKPDVVSYNTVINGFCKQGL----VKEAQRVLSEMVA------DGMAPCAVTYHTLVGGYSSLEMFSEAREVIGYMVQHGL-KPMELTYRRVVESYCRAFEEARGFLSEVKALEAYIEDA

General information: TITO was launched using: RESULT: Template: 4M59.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 : 1600 101049 63.16 276.85 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.57 3D Compatibility (PKB) : 63.16 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.57 QMean score : 0.316

(partial model without unconserved sides chains): PDB file : Tito_4M59.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4M59-query.scw PDB file : Tito_Scwrl_4M59.pdb: