4pj5 A 2.0 BS01 30W A 1 Y7 R9 K43 Y62 W69 R94 I96 W156 Y7 R9 K43 Y62 W69 R94 I96 W156 ? Q95460 25049336 600 RTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKETFPGVTALFCKAHGFYPPEIYMTWMKNGEEIVQEIDYGDILPSGDGTYQAWASIELLYSCHVEHSGVHMVLQV 4pj5 C 2.0 BS01 30W C 1 Y7 R9 K43 Y62 W69 R94 I96 W156 Y7 R9 K43 Y62 W69 R94 I96 W156 ? Q95460 25049336 600 RTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKALFCKAHGFYPPEIYMTWMKNGEEIDYGDILPSGDGTYQAWASIELDPQSSNLYSCHVEHSGVHMVLQV 4pje A 1.95 BS01 30W A 1 Y7 R9 K43 Y62 W69 R94 I96 W156 Y7 R9 K41 Y60 W67 R92 I94 W154 ? Q95460 25049336 306 RTHSLRYFRLGVSDPIVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKETFPGVTALFCKAHGFYPPEIYMTWMKNGEEIVQEIDYGDILPSGDGTYQAWASIELLYSCHVEHSGVHMVLQV 4pje C 1.95 BS01 30W C 1 Y7 R9 K43 Y62 W69 R94 I96 W156 Y7 R9 K43 Y62 W69 R94 I96 W156 ? Q95460 25049336 302 RTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRALFCKAHGFYPPEIYMTWMKNGEEIDYGDILPSGDGTYQAWASIELNLYSCHVEHSGVHMVLQV 4pjf A 2.45 BS01 30W A 1 Y7 K43 Y62 W69 R94 I96 Y152 W156 Y7 K43 Y62 W69 R94 I96 Y152 W156 ? Q95460 25049336 301 RTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKETFPGVTALFCKAHGFYPPEIYMTWMKNGEEIVQEIDYGDILPSGDGTYQAWASIELLYSCHVEHSGVHMVLQV 4pjf C 2.45 BS01 30W C 1 Y7 R9 K43 Y62 W69 R94 I96 Y152 W156 Y7 R9 K43 Y62 W69 R94 I96 Y152 W156 ? Q95460 25049336 301 RTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKETALFCKAHGFYPPEIYMTWMKNGEEIDYGDILPSGDGTYQAWASIELDPNLYSCHVEHSGVHMVLQV 4pjg A 2.4 BS01 30W A 1 Y7 R9 K43 Y62 W69 R94 I96 Y152 W156 Y7 R9 K43 Y62 W69 R94 I96 Y152 W156 ? Q95460 25049336 301 RTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKETFPGVTALFCKAHGFYPPEIYMTWMKNGEEIVQEIDYGDILPSGDGTYQAWASIELDLYSCHVEHSGVHMVLQV 4pjg C 2.4 BS01 30W C 1 Y7 R9 K43 Y62 W69 R94 I96 Y152 W156 Y7 R9 K43 Y62 W69 R94 I96 Y152 W156 ? Q95460 25049336 301 RTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKLFCKAHGFYPPEIYMTWMKNQEIDYGDILPSGDGTYQAWASINLYSCHVEHSGVHMVLQV 4pjh A 2.0 BS01 30W A 1 Y7 R9 K43 Y62 W69 R94 I96 W156 Y7 R9 K42 Y61 W68 R93 I95 W155 ? Q95460 25049336 303 RTHSLRYFRLGVSDPIHVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKETFPGVTALFCKAHGFYPPEIYMTWMKNGEEIVQEIDYGDILPSGDGTYQAWASIELLYSCHVEHSGVHMVLQV 4pjh C 2.0 BS01 30W C 1 Y7 R9 K43 Y62 W69 R94 I96 Y152 W156 Y7 R9 K43 Y62 W69 R94 I96 Y152 W156 ? Q95460 25049336 303 RTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKETALFCKAHGFYPPEIYMTWMKNGEEIQEIDYGDILPSGDGTYQAWASIELSCHVEHSGVHMVLQV 4pji A 2.5 BS01 30W A 1 Y7 R9 K43 Y62 W69 R94 I96 W156 Y7 R9 K42 Y61 W68 R93 I95 W155 ? -logKd/Ki=3.70, Kd>200uM Q95460 25049336 301 RTHSLRYFRLGVSDPIGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKETFPGVTALFCKAHGFYPPEIYMTWMKNGEEIVQEIDYGDILPSGDGTYQAWASIELLYSCHVEHSGVHMVLQV 4pji C 2.5 BS01 30W C 1 Y7 R9 K43 Y62 W69 R94 I96 Y152 W156 Y7 R9 K43 Y62 W69 R94 I96 Y152 W156 ? Q95460 25049336 301 RTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNALFCKAHGFYPPEIYMTWMKNGEEEIDYGDILPSGDGTYQAWASIELLYSCHVEHSGVHMVLQV 4pjx A 2.25 BS01 30W A 1 Y7 R9 K43 Y62 W69 R94 I96 Y152 W156 Y8 R10 K42 Y61 W68 R93 I95 Y151 W155 ? Q95460 25049336 301 MRTHSLRYFRLGVSDPIVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKETFPGVTALFCKAHGFYPPEIYMTWMKNGEEIVQEIDYGDILPSGDGTYQAWASIELLYSCHVEHSGVHMVLQV 4pjx C 2.25 BS01 30W C 1 Y7 R9 K43 Y62 W69 R94 I96 Y152 W156 Y8 R10 K44 Y63 W70 R95 I97 Y153 W157 ? Q95460 25049336 301 MRTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRALFCKAHGFYPPEIYMTWMKNIDYGDILPSGDGTYQAWASIELNLYSCHVEHSGVHMVLQV 5d7i A 2.0 BS02 30W A 1 Y7 R9 K43 Y62 W69 R94 I96 W156 Y7 R9 K43 Y62 W69 R94 I96 W156 ? Q95460 26795251 302 RTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKETFPGVTALFCKAHGFYPPEIYMTWMKNGEEIVQEIDYGDILPSGDGTYQAWASIELLYSCHVEHSGVHMVLQV 5d7i C 2.0 BS01 30W C 1 Y7 R9 K43 Y62 W69 R94 I96 W156 Y7 R9 K43 Y62 W69 R94 I96 W156 ? Q95460 26795251 302 RTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKETFPGVTALFCKAHGFYPPEIYMTWMKNGEEIVQEIDYGDILPSGDGTYQAWASIELDPQSSNLYSCHVEHSGVHMVLQV 7llj C 3.15 BS01 30W C 1 Y7 K43 Y62 W69 R94 I96 W156 Y8 K44 Y63 W70 R95 I97 W157 ? Q95460 34845016 301 MRTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKPGVTALFCKAHGFYPPEIYMTWMKNGEEIVQEIDYGDILPSGDGTYQAWASIQSSNLYSCHVEHSGVHMVLQV 7llj E 3.15 BS01 30W E 1 Y7 R9 K43 Y62 W69 R94 I96 W156 Y8 R10 K44 Y63 W70 R95 I97 W157 ? Q95460 34845016 301 MRTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKPGVTALFCKAHGFYPPEIYMTWMKNGEEIVQEIDYGDILPSGDGTYQAWASIEPQSSNLYSCHVEHSGVHMVLQV 7rno A -1.00 BS01 30W A 1 Y8 K44 W70 W157 E161 Y5 K41 W67 W154 E158 ? C1ITJ8,Q95460 35725941 301 HSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPKVRVNHKETFPGITTLYCRAYGFYPPEISINWMKNGEEIFQDTDYGGILPSGDGTYQTWVSVELDPQNGDIYSCHVEHGGVHMVLQGF 7umg A 2.4 BS01 30W A 1 Y7 K43 Y62 W69 R94 I96 W156 Y8 K44 Y63 W70 R95 I97 W157 ? Q95460 36018322 301 MRTHSLRYFRLGVSDPIHGVPEFISVGYVDSHPITTYDSVTRQKEPRAPWMAENLAPDHWERYTQLLRGWQQMFKVELKRLQRHYNHSGSHTYQRMIGCELLEDGSTTGFLQYAYDGQDFLIFNKDTLSWLAVDNVAHTIKQAWEANQHELLYQKNWLEEECIAWLKRFLEYGKDTLQRTEPPLVRVNRKETFPGVTALFCKAHGFYPPEIYMTWMKNGEEIVQEIDYGDILPSGDGTYQAWASIELDPQSSNLYSCHVEHSGVHM