reset;center {27.186 2.721 35.183}; rotate z 154.56; rotate y 59.75; rotate z -133.81; zoom 1106.89; translate x 1.33; translate y -3.8; set rotationRadius 33.83; Display 57, 195, 252:C.C, 252:C.O, 252:C.CA, 252:C.C, 252, 253, 647; hide add 252:C.N, 252:C.H, 253:C.OG1, 253:C.HG1 select *; label off; set labelAlignment CENTER; set labeloffset 0 0 select 57:F.CE1; label His 57; set labeloffset 120 -10; color label black; font label 20 select 195:G.CB; label Ser 195; set labeloffset -70 -00; color label black; font label 20 select 214:G.C; label Ser 214; set labeloffset 40 20; color label black; font label 20 select 252:C.CB; label Trp 252; set labeloffset 40 -50; color label black; font label 20 select 253:C.CA; label " Thr 253 |(Amine departing)"; set labeloffset 30 110; color label black; font label 20 select 647:C.O; label H2O 647; set labeloffset -10 50; color label black; font label 20 select *; set labelfront select 195:G.OG, 252:C.C, 252:C.O, 252:C.CA, 253:C.N; label %a; color label black; font label 20; set labelfront off select 647; halos # connect (57:F.NE2) (647:C.2H) HBOND radius 0.02 modify connect (57:F.NE2) (647:C.2H) SINGLE; connect (57:F.NE2) (647:C.2H) HBOND connect (252:C.C) (647:C.O) SINGLE; connect (252:C.C) (647:C.O) HBOND connect (647:C.O) (647:C.2H) SINGLE; connect (647:C.O) (647:C.2H) HBOND measure off measure (647:C.2H) (57:F.NE2) measure (647:C.2H) (647:C.O) measure (252:C.C) (647:C.O) frame TITLE " " color background white