*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 4 1a30_c00 HIV-1 PROTEASE user 1 4 # 1 A 25 ASP A 32 ASP.? 10.92 O ACY A 402 A 26 THR A 55 THR.? 13.99 O ACY A 402 B 25 ASP A 56 ASP~? 17.92 O ACY A 402 B 26 THR A 59 THR~? 14.19 O ACY A 402 coo 16.19 28.53 6.78 15.21 26.90 5.90 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 15.74 30.96 2.61 17.31 31.07 1.15 0.90 9.48 -19.14 2.18 8.78 -20.76 coo 15.69 25.44 0.11 15.17 25.11 2.13 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 19.75 27.40 1.82 20.01 29.54 2.05 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 1a30_c00 HIV-1 PROTEASE user 2 4 # 2 A 25 ASP A 56 ASP~? 17.92 O ACY A 402 A 26 THR A 59 THR~? 14.19 O ACY A 402 B 25 ASP A 32 ASP.? 10.92 O ACY A 402 B 26 THR A 55 THR.? 13.99 O ACY A 402 coo 16.19 28.53 6.78 15.21 26.90 5.90 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 15.74 30.96 2.61 17.31 31.07 1.15 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 15.69 25.44 0.11 15.17 25.11 2.13 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 19.75 27.40 1.82 20.01 29.54 2.05 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 1a30_c00 HIV-1 PROTEASE user 3 4 # 3 A 25 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 26 THR B 55 THR.? 17.12 OXT ACY B 401 B 25 ASP B 56 ASP~? 21.60 OXT ACY B 401 B 26 THR B 59 THR~? 17.71 OXT ACY B 401 coo 16.19 28.53 6.78 15.21 26.90 5.90 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 15.74 30.96 2.61 17.31 31.07 1.15 32.20 8.69 -5.88 30.77 8.33 -4.30 coo 15.69 25.44 0.11 15.17 25.11 2.13 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 19.75 27.40 1.82 20.01 29.54 2.05 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 1a30_c00 HIV-1 PROTEASE user 4 4 # 4 A 25 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 26 THR B 59 THR~? 17.71 OXT ACY B 401 B 25 ASP B 32 ASP.? 15.94 OXT ACY B 401 B 26 THR B 55 THR.? 17.12 OXT ACY B 401 coo 16.19 28.53 6.78 15.21 26.90 5.90 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 15.74 30.96 2.61 17.31 31.07 1.15 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 15.69 25.44 0.11 15.17 25.11 2.13 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 19.75 27.40 1.82 20.01 29.54 2.05 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 1a30_c00 HIV-1 PROTEASE user 5 4 # 5 A 25 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 26 THR C 55 THR.? 17.79 O3 GOL A 501 B 25 ASP C 56 ASP~? 22.04 O3 GOL A 501 B 26 THR C 59 THR~? 18.08 O3 GOL A 501 coo 16.19 28.53 6.78 15.21 26.90 5.90 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 15.74 30.96 2.61 17.31 31.07 1.15 32.26 29.93 -21.97 30.77 30.39 -23.54 coo 15.69 25.44 0.11 15.17 25.11 2.13 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 19.75 27.40 1.82 20.01 29.54 2.05 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 1a30_c00 HIV-1 PROTEASE user 6 4 # 6 A 25 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 26 THR C 59 THR~? 18.08 O3 GOL A 501 B 25 ASP C 32 ASP.? 15.02 O1 PO4 A 302 B 26 THR C 55 THR.? 17.79 O3 GOL A 501 coo 16.19 28.53 6.78 15.21 26.90 5.90 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 15.74 30.96 2.61 17.31 31.07 1.15 29.94 33.15 -27.01 30.78 31.19 -27.05 coo 15.69 25.44 0.11 15.17 25.11 2.13 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 19.75 27.40 1.82 20.01 29.54 2.05 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 4 1a30_c00 HIV-1 PROTEASE user 7 4 # 7 A 25 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 26 THR D 55 THR.? 15.68 CH3 ACY B 403 B 25 ASP D 56 ASP~? 19.96 CH3 ACY B 403 B 26 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 16.19 28.53 6.78 15.21 26.90 5.90 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 15.74 30.96 2.61 17.31 31.07 1.15 2.98 31.79 -5.06 4.48 32.25 -3.56 coo 15.69 25.44 0.11 15.17 25.11 2.13 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 19.75 27.40 1.82 20.01 29.54 2.05 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 1a30_c00 HIV-1 PROTEASE user 8 4 # 8 A 25 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 26 THR D 59 THR~? 16.58 CH3 ACY B 403 B 25 ASP D 32 ASP.? 14.33 CH3 ACY B 403 B 26 THR D 55 THR.? 15.68 CH3 ACY B 403 coo 16.19 28.53 6.78 15.21 26.90 5.90 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 15.74 30.96 2.61 17.31 31.07 1.15 5.37 35.06 -0.11 4.54 33.06 0.04 coo 15.69 25.44 0.11 15.17 25.11 2.13 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 19.75 27.40 1.82 20.01 29.54 2.05 2.98 31.79 -5.06 4.48 32.25 -3.56 1a30_c00 source 1a30 HIV-1 PROTEASE : 8 hits 1a30_c00 naa= 4 ULMN 4 1am5_c03 PEPSIN user 1 4 # 1 32 ASP A 32 ASP.? 10.92 O ACY A 402 33 THR A 55 THR.? 13.99 O ACY A 402 215 ASP A 56 ASP~? 17.92 O ACY A 402 216 THR A 59 THR~? 14.19 O ACY A 402 coo -7.18 8.92 145.10 -8.77 8.81 143.59 3.75 12.55 -21.98 2.34 11.90 -23.40 coo -7.95 13.74 144.22 -6.52 14.95 143.16 0.90 9.48 -19.14 2.18 8.78 -20.76 coo -8.20 12.64 138.30 -8.86 10.97 139.38 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -4.16 12.12 140.59 -3.78 13.08 142.45 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 1am5_c03 PEPSIN user 2 4 # 2 32 ASP A 56 ASP~? 17.92 O ACY A 402 33 THR A 59 THR~? 14.19 O ACY A 402 215 ASP A 32 ASP.? 10.92 O ACY A 402 216 THR A 55 THR.? 13.99 O ACY A 402 coo -7.18 8.92 145.10 -8.77 8.81 143.59 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -7.95 13.74 144.22 -6.52 14.95 143.16 2.48 5.35 -23.92 1.78 7.38 -24.24 coo -8.20 12.64 138.30 -8.86 10.97 139.38 3.75 12.55 -21.98 2.34 11.90 -23.40 coo -4.16 12.12 140.59 -3.78 13.08 142.45 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 1am5_c03 PEPSIN user 3 4 # 3 32 ASP B 32 ASP.? 15.94 OXT ACY B 401 33 THR B 55 THR.? 17.12 OXT ACY B 401 215 ASP B 56 ASP~? 21.60 OXT ACY B 401 216 THR B 59 THR~? 17.71 OXT ACY B 401 coo -7.18 8.92 145.10 -8.77 8.81 143.59 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -7.95 13.74 144.22 -6.52 14.95 143.16 32.20 8.69 -5.88 30.77 8.33 -4.30 coo -8.20 12.64 138.30 -8.86 10.97 139.38 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -4.16 12.12 140.59 -3.78 13.08 142.45 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 1am5_c03 PEPSIN user 4 4 # 4 32 ASP B 56 ASP~? 21.60 OXT ACY B 401 33 THR B 59 THR~? 17.71 OXT ACY B 401 215 ASP B 32 ASP.? 15.94 OXT ACY B 401 216 THR B 55 THR.? 17.12 OXT ACY B 401 coo -7.18 8.92 145.10 -8.77 8.81 143.59 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -7.95 13.74 144.22 -6.52 14.95 143.16 30.30 5.71 -0.52 31.18 7.66 -0.59 coo -8.20 12.64 138.30 -8.86 10.97 139.38 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -4.16 12.12 140.59 -3.78 13.08 142.45 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 1am5_c03 PEPSIN user 5 4 # 5 32 ASP C 32 ASP.? 15.02 O1 PO4 A 302 33 THR C 55 THR.? 17.79 O3 GOL A 501 215 ASP C 56 ASP~? 22.04 O3 GOL A 501 216 THR C 59 THR~? 18.08 O3 GOL A 501 coo -7.18 8.92 145.10 -8.77 8.81 143.59 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -7.95 13.74 144.22 -6.52 14.95 143.16 32.26 29.93 -21.97 30.77 30.39 -23.54 coo -8.20 12.64 138.30 -8.86 10.97 139.38 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -4.16 12.12 140.59 -3.78 13.08 142.45 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 1am5_c03 PEPSIN user 6 4 # 6 32 ASP C 56 ASP~? 22.04 O3 GOL A 501 33 THR C 59 THR~? 18.08 O3 GOL A 501 215 ASP C 32 ASP.? 15.02 O1 PO4 A 302 216 THR C 55 THR.? 17.79 O3 GOL A 501 coo -7.18 8.92 145.10 -8.77 8.81 143.59 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -7.95 13.74 144.22 -6.52 14.95 143.16 29.94 33.15 -27.01 30.78 31.19 -27.05 coo -8.20 12.64 138.30 -8.86 10.97 139.38 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -4.16 12.12 140.59 -3.78 13.08 142.45 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 4 1am5_c03 PEPSIN user 7 4 # 7 32 ASP D 32 ASP.? 14.33 CH3 ACY B 403 33 THR D 55 THR.? 15.68 CH3 ACY B 403 215 ASP D 56 ASP~? 19.96 CH3 ACY B 403 216 THR D 59 THR~? 16.58 CH3 ACY B 403 coo -7.18 8.92 145.10 -8.77 8.81 143.59 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -7.95 13.74 144.22 -6.52 14.95 143.16 2.98 31.79 -5.06 4.48 32.25 -3.56 coo -8.20 12.64 138.30 -8.86 10.97 139.38 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -4.16 12.12 140.59 -3.78 13.08 142.45 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 1am5_c03 PEPSIN user 8 4 # 8 32 ASP D 56 ASP~? 19.96 CH3 ACY B 403 33 THR D 59 THR~? 16.58 CH3 ACY B 403 215 ASP D 32 ASP.? 14.33 CH3 ACY B 403 216 THR D 55 THR.? 15.68 CH3 ACY B 403 coo -7.18 8.92 145.10 -8.77 8.81 143.59 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -7.95 13.74 144.22 -6.52 14.95 143.16 5.37 35.06 -0.11 4.54 33.06 0.04 coo -8.20 12.64 138.30 -8.86 10.97 139.38 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -4.16 12.12 140.59 -3.78 13.08 142.45 2.98 31.79 -5.06 4.48 32.25 -3.56 1am5_c03 source 1am5 PEPSIN : 8 hits 1am5_c03 naa= 4 ULMN 4 1apt_c03 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 1 4 # 1 E 33 ASP A 32 ASP.? 10.92 O ACY A 402 E 34 THR A 55 THR.? 13.99 O ACY A 402 E 213 ASP A 56 ASP~? 17.92 O ACY A 402 E 214 THR A 59 THR~? 14.19 O ACY A 402 coo 26.30 12.96 16.78 25.46 12.99 18.72 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 25.06 17.67 17.27 23.51 18.60 16.07 0.90 9.48 -19.14 2.18 8.78 -20.76 coo 20.15 16.04 19.79 21.65 14.49 19.86 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 20.70 15.28 14.97 22.26 16.39 13.96 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 1apt_c03 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 2 4 # 2 E 33 ASP A 56 ASP~? 17.92 O ACY A 402 E 34 THR A 59 THR~? 14.19 O ACY A 402 E 213 ASP A 32 ASP.? 10.92 O ACY A 402 E 214 THR A 55 THR.? 13.99 O ACY A 402 coo 26.30 12.96 16.78 25.46 12.99 18.72 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 25.06 17.67 17.27 23.51 18.60 16.07 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 20.15 16.04 19.79 21.65 14.49 19.86 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 20.70 15.28 14.97 22.26 16.39 13.96 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 1apt_c03 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 3 4 # 3 E 33 ASP B 32 ASP.? 15.94 OXT ACY B 401 E 34 THR B 55 THR.? 17.12 OXT ACY B 401 E 213 ASP B 56 ASP~? 21.60 OXT ACY B 401 E 214 THR B 59 THR~? 17.71 OXT ACY B 401 coo 26.30 12.96 16.78 25.46 12.99 18.72 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 25.06 17.67 17.27 23.51 18.60 16.07 32.20 8.69 -5.88 30.77 8.33 -4.30 coo 20.15 16.04 19.79 21.65 14.49 19.86 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 20.70 15.28 14.97 22.26 16.39 13.96 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 1apt_c03 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 4 4 # 4 E 33 ASP B 56 ASP~? 21.60 OXT ACY B 401 E 34 THR B 59 THR~? 17.71 OXT ACY B 401 E 213 ASP B 32 ASP.? 15.94 OXT ACY B 401 E 214 THR B 55 THR.? 17.12 OXT ACY B 401 coo 26.30 12.96 16.78 25.46 12.99 18.72 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 25.06 17.67 17.27 23.51 18.60 16.07 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 20.15 16.04 19.79 21.65 14.49 19.86 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 20.70 15.28 14.97 22.26 16.39 13.96 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 1apt_c03 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 5 4 # 5 E 33 ASP C 32 ASP.? 15.02 O1 PO4 A 302 E 34 THR C 55 THR.? 17.79 O3 GOL A 501 E 213 ASP C 56 ASP~? 22.04 O3 GOL A 501 E 214 THR C 59 THR~? 18.08 O3 GOL A 501 coo 26.30 12.96 16.78 25.46 12.99 18.72 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 25.06 17.67 17.27 23.51 18.60 16.07 32.26 29.93 -21.97 30.77 30.39 -23.54 coo 20.15 16.04 19.79 21.65 14.49 19.86 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 20.70 15.28 14.97 22.26 16.39 13.96 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 1apt_c03 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 6 4 # 6 E 33 ASP C 56 ASP~? 22.04 O3 GOL A 501 E 34 THR C 59 THR~? 18.08 O3 GOL A 501 E 213 ASP C 32 ASP.? 15.02 O1 PO4 A 302 E 214 THR C 55 THR.? 17.79 O3 GOL A 501 coo 26.30 12.96 16.78 25.46 12.99 18.72 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 25.06 17.67 17.27 23.51 18.60 16.07 29.94 33.15 -27.01 30.78 31.19 -27.05 coo 20.15 16.04 19.79 21.65 14.49 19.86 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 20.70 15.28 14.97 22.26 16.39 13.96 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 4 1apt_c03 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 7 4 # 7 E 33 ASP D 32 ASP.? 14.33 CH3 ACY B 403 E 34 THR D 55 THR.? 15.68 CH3 ACY B 403 E 213 ASP D 56 ASP~? 19.96 CH3 ACY B 403 E 214 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 26.30 12.96 16.78 25.46 12.99 18.72 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 25.06 17.67 17.27 23.51 18.60 16.07 2.98 31.79 -5.06 4.48 32.25 -3.56 coo 20.15 16.04 19.79 21.65 14.49 19.86 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 20.70 15.28 14.97 22.26 16.39 13.96 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 1apt_c03 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 8 4 # 8 E 33 ASP D 56 ASP~? 19.96 CH3 ACY B 403 E 34 THR D 59 THR~? 16.58 CH3 ACY B 403 E 213 ASP D 32 ASP.? 14.33 CH3 ACY B 403 E 214 THR D 55 THR.? 15.68 CH3 ACY B 403 coo 26.30 12.96 16.78 25.46 12.99 18.72 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 25.06 17.67 17.27 23.51 18.60 16.07 5.37 35.06 -0.11 4.54 33.06 0.04 coo 20.15 16.04 19.79 21.65 14.49 19.86 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 20.70 15.28 14.97 22.26 16.39 13.96 2.98 31.79 -5.06 4.48 32.25 -3.56 1apt_c03 source 1apt ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET (LYSTA IS : 8 hits 1apt_c03 naa= 4 ULMN 4 1avf_c02 GASTRICSIN user 1 4 # 1 A 32 ASP A 32 ASP.? 10.92 O ACY A 402 A 33 THR A 55 THR.? 13.99 O ACY A 402 A 217 ASP A 56 ASP~? 17.92 O ACY A 402 A 218 THR A 59 THR~? 14.19 O ACY A 402 coo -10.06 2.54 49.69 -8.83 3.73 50.96 3.75 12.55 -21.98 2.34 11.90 -23.40 coo -10.81 0.28 53.82 -9.79 -1.53 54.36 0.90 9.48 -19.14 2.18 8.78 -20.76 coo -5.22 1.43 56.08 -5.36 2.84 54.49 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -5.86 -1.53 52.32 -7.81 -2.38 51.94 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 1avf_c02 GASTRICSIN user 2 4 # 2 A 32 ASP A 56 ASP~? 17.92 O ACY A 402 A 33 THR A 59 THR~? 14.19 O ACY A 402 A 217 ASP A 32 ASP.? 10.92 O ACY A 402 A 218 THR A 55 THR.? 13.99 O ACY A 402 coo -10.06 2.54 49.69 -8.83 3.73 50.96 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -10.81 0.28 53.82 -9.79 -1.53 54.36 2.48 5.35 -23.92 1.78 7.38 -24.24 coo -5.22 1.43 56.08 -5.36 2.84 54.49 3.75 12.55 -21.98 2.34 11.90 -23.40 coo -5.86 -1.53 52.32 -7.81 -2.38 51.94 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 1avf_c02 GASTRICSIN user 3 4 # 3 A 32 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 33 THR B 55 THR.? 17.12 OXT ACY B 401 A 217 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 218 THR B 59 THR~? 17.71 OXT ACY B 401 coo -10.06 2.54 49.69 -8.83 3.73 50.96 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -10.81 0.28 53.82 -9.79 -1.53 54.36 32.20 8.69 -5.88 30.77 8.33 -4.30 coo -5.22 1.43 56.08 -5.36 2.84 54.49 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -5.86 -1.53 52.32 -7.81 -2.38 51.94 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 1avf_c02 GASTRICSIN user 4 4 # 4 A 32 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 33 THR B 59 THR~? 17.71 OXT ACY B 401 A 217 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 218 THR B 55 THR.? 17.12 OXT ACY B 401 coo -10.06 2.54 49.69 -8.83 3.73 50.96 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -10.81 0.28 53.82 -9.79 -1.53 54.36 30.30 5.71 -0.52 31.18 7.66 -0.59 coo -5.22 1.43 56.08 -5.36 2.84 54.49 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -5.86 -1.53 52.32 -7.81 -2.38 51.94 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 1avf_c02 GASTRICSIN user 5 4 # 5 A 32 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 33 THR C 55 THR.? 17.79 O3 GOL A 501 A 217 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 218 THR C 59 THR~? 18.08 O3 GOL A 501 coo -10.06 2.54 49.69 -8.83 3.73 50.96 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -10.81 0.28 53.82 -9.79 -1.53 54.36 32.26 29.93 -21.97 30.77 30.39 -23.54 coo -5.22 1.43 56.08 -5.36 2.84 54.49 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -5.86 -1.53 52.32 -7.81 -2.38 51.94 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 1avf_c02 GASTRICSIN user 6 4 # 6 A 32 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 33 THR C 59 THR~? 18.08 O3 GOL A 501 A 217 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 218 THR C 55 THR.? 17.79 O3 GOL A 501 coo -10.06 2.54 49.69 -8.83 3.73 50.96 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -10.81 0.28 53.82 -9.79 -1.53 54.36 29.94 33.15 -27.01 30.78 31.19 -27.05 coo -5.22 1.43 56.08 -5.36 2.84 54.49 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -5.86 -1.53 52.32 -7.81 -2.38 51.94 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 4 1avf_c02 GASTRICSIN user 7 4 # 7 A 32 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 33 THR D 55 THR.? 15.68 CH3 ACY B 403 A 217 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 218 THR D 59 THR~? 16.58 CH3 ACY B 403 coo -10.06 2.54 49.69 -8.83 3.73 50.96 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -10.81 0.28 53.82 -9.79 -1.53 54.36 2.98 31.79 -5.06 4.48 32.25 -3.56 coo -5.22 1.43 56.08 -5.36 2.84 54.49 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -5.86 -1.53 52.32 -7.81 -2.38 51.94 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 1avf_c02 GASTRICSIN user 8 4 # 8 A 32 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 33 THR D 59 THR~? 16.58 CH3 ACY B 403 A 217 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 218 THR D 55 THR.? 15.68 CH3 ACY B 403 coo -10.06 2.54 49.69 -8.83 3.73 50.96 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -10.81 0.28 53.82 -9.79 -1.53 54.36 5.37 35.06 -0.11 4.54 33.06 0.04 coo -5.22 1.43 56.08 -5.36 2.84 54.49 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -5.86 -1.53 52.32 -7.81 -2.38 51.94 2.98 31.79 -5.06 4.48 32.25 -3.56 1avf_c02 source 1avf GASTRICSIN : 8 hits 1avf_c02 naa= 4 ULMN 4 1avf_c03 GASTRICSIN user 1 4 # 1 J 32 ASP A 32 ASP.? 10.92 O ACY A 402 J 33 THR A 55 THR.? 13.99 O ACY A 402 J 217 ASP A 56 ASP~? 17.92 O ACY A 402 J 218 THR A 59 THR~? 14.19 O ACY A 402 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 3.75 12.55 -21.98 2.34 11.90 -23.40 coo -41.87 -15.43 20.67 -42.27 -13.53 19.66 0.90 9.48 -19.14 2.18 8.78 -20.76 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -39.45 -13.42 16.23 -39.52 -12.66 18.27 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 1avf_c03 GASTRICSIN user 2 4 # 2 J 32 ASP A 56 ASP~? 17.92 O ACY A 402 J 33 THR A 59 THR~? 14.19 O ACY A 402 J 217 ASP A 32 ASP.? 10.92 O ACY A 402 J 218 THR A 55 THR.? 13.99 O ACY A 402 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -41.87 -15.43 20.67 -42.27 -13.53 19.66 2.48 5.35 -23.92 1.78 7.38 -24.24 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 3.75 12.55 -21.98 2.34 11.90 -23.40 coo -39.45 -13.42 16.23 -39.52 -12.66 18.27 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 1avf_c03 GASTRICSIN user 3 4 # 3 J 32 ASP B 32 ASP.? 15.94 OXT ACY B 401 J 33 THR B 55 THR.? 17.12 OXT ACY B 401 J 217 ASP B 56 ASP~? 21.60 OXT ACY B 401 J 218 THR B 59 THR~? 17.71 OXT ACY B 401 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -41.87 -15.43 20.67 -42.27 -13.53 19.66 32.20 8.69 -5.88 30.77 8.33 -4.30 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -39.45 -13.42 16.23 -39.52 -12.66 18.27 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 1avf_c03 GASTRICSIN user 4 4 # 4 J 32 ASP B 56 ASP~? 21.60 OXT ACY B 401 J 33 THR B 59 THR~? 17.71 OXT ACY B 401 J 217 ASP B 32 ASP.? 15.94 OXT ACY B 401 J 218 THR B 55 THR.? 17.12 OXT ACY B 401 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -41.87 -15.43 20.67 -42.27 -13.53 19.66 30.30 5.71 -0.52 31.18 7.66 -0.59 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -39.45 -13.42 16.23 -39.52 -12.66 18.27 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 1avf_c03 GASTRICSIN user 5 4 # 5 J 32 ASP C 32 ASP.? 15.02 O1 PO4 A 302 J 33 THR C 55 THR.? 17.79 O3 GOL A 501 J 217 ASP C 56 ASP~? 22.04 O3 GOL A 501 J 218 THR C 59 THR~? 18.08 O3 GOL A 501 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -41.87 -15.43 20.67 -42.27 -13.53 19.66 32.26 29.93 -21.97 30.77 30.39 -23.54 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -39.45 -13.42 16.23 -39.52 -12.66 18.27 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 1avf_c03 GASTRICSIN user 6 4 # 6 J 32 ASP C 56 ASP~? 22.04 O3 GOL A 501 J 33 THR C 59 THR~? 18.08 O3 GOL A 501 J 217 ASP C 32 ASP.? 15.02 O1 PO4 A 302 J 218 THR C 55 THR.? 17.79 O3 GOL A 501 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -41.87 -15.43 20.67 -42.27 -13.53 19.66 29.94 33.15 -27.01 30.78 31.19 -27.05 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -39.45 -13.42 16.23 -39.52 -12.66 18.27 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 4 1avf_c03 GASTRICSIN user 7 4 # 7 J 32 ASP D 32 ASP.? 14.33 CH3 ACY B 403 J 33 THR D 55 THR.? 15.68 CH3 ACY B 403 J 217 ASP D 56 ASP~? 19.96 CH3 ACY B 403 J 218 THR D 59 THR~? 16.58 CH3 ACY B 403 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -41.87 -15.43 20.67 -42.27 -13.53 19.66 2.98 31.79 -5.06 4.48 32.25 -3.56 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -39.45 -13.42 16.23 -39.52 -12.66 18.27 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 1avf_c03 GASTRICSIN user 8 4 # 8 J 32 ASP D 56 ASP~? 19.96 CH3 ACY B 403 J 33 THR D 59 THR~? 16.58 CH3 ACY B 403 J 217 ASP D 32 ASP.? 14.33 CH3 ACY B 403 J 218 THR D 55 THR.? 15.68 CH3 ACY B 403 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -41.87 -15.43 20.67 -42.27 -13.53 19.66 5.37 35.06 -0.11 4.54 33.06 0.04 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -39.45 -13.42 16.23 -39.52 -12.66 18.27 2.98 31.79 -5.06 4.48 32.25 -3.56 1avf_c03 source 1avf GASTRICSIN : 8 hits 1avf_c03 naa= 4 ULMN 4 1bbs_c04 RENIN user 1 4 # 1 32 ASP A 32 ASP.? 10.92 O ACY A 402 33 THR A 55 THR.? 13.99 O ACY A 402 215 ASP A 56 ASP~? 17.92 O ACY A 402 216 THR A 59 THR~? 14.19 O ACY A 402 coo 61.19 45.85 78.73 62.86 45.48 77.48 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 62.61 41.50 79.97 61.55 39.62 79.92 0.90 9.48 -19.14 2.18 8.78 -20.76 coo 63.61 40.10 74.06 64.05 42.07 74.70 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 59.26 40.01 76.00 58.92 39.80 78.11 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 1bbs_c04 RENIN user 2 4 # 2 32 ASP A 56 ASP~? 17.92 O ACY A 402 33 THR A 59 THR~? 14.19 O ACY A 402 215 ASP A 32 ASP.? 10.92 O ACY A 402 216 THR A 55 THR.? 13.99 O ACY A 402 coo 61.19 45.85 78.73 62.86 45.48 77.48 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 62.61 41.50 79.97 61.55 39.62 79.92 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 63.61 40.10 74.06 64.05 42.07 74.70 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 59.26 40.01 76.00 58.92 39.80 78.11 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 1bbs_c04 RENIN user 3 4 # 3 32 ASP B 32 ASP.? 15.94 OXT ACY B 401 33 THR B 55 THR.? 17.12 OXT ACY B 401 215 ASP B 56 ASP~? 21.60 OXT ACY B 401 216 THR B 59 THR~? 17.71 OXT ACY B 401 coo 61.19 45.85 78.73 62.86 45.48 77.48 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 62.61 41.50 79.97 61.55 39.62 79.92 32.20 8.69 -5.88 30.77 8.33 -4.30 coo 63.61 40.10 74.06 64.05 42.07 74.70 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 59.26 40.01 76.00 58.92 39.80 78.11 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 1bbs_c04 RENIN user 4 4 # 4 32 ASP B 56 ASP~? 21.60 OXT ACY B 401 33 THR B 59 THR~? 17.71 OXT ACY B 401 215 ASP B 32 ASP.? 15.94 OXT ACY B 401 216 THR B 55 THR.? 17.12 OXT ACY B 401 coo 61.19 45.85 78.73 62.86 45.48 77.48 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 62.61 41.50 79.97 61.55 39.62 79.92 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 63.61 40.10 74.06 64.05 42.07 74.70 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 59.26 40.01 76.00 58.92 39.80 78.11 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 1bbs_c04 RENIN user 5 4 # 5 32 ASP C 32 ASP.? 15.02 O1 PO4 A 302 33 THR C 55 THR.? 17.79 O3 GOL A 501 215 ASP C 56 ASP~? 22.04 O3 GOL A 501 216 THR C 59 THR~? 18.08 O3 GOL A 501 coo 61.19 45.85 78.73 62.86 45.48 77.48 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 62.61 41.50 79.97 61.55 39.62 79.92 32.26 29.93 -21.97 30.77 30.39 -23.54 coo 63.61 40.10 74.06 64.05 42.07 74.70 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 59.26 40.01 76.00 58.92 39.80 78.11 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 1bbs_c04 RENIN user 6 4 # 6 32 ASP D 32 ASP.? 14.33 CH3 ACY B 403 33 THR D 55 THR.? 15.68 CH3 ACY B 403 215 ASP D 56 ASP~? 19.96 CH3 ACY B 403 216 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 61.19 45.85 78.73 62.86 45.48 77.48 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 62.61 41.50 79.97 61.55 39.62 79.92 2.98 31.79 -5.06 4.48 32.25 -3.56 coo 63.61 40.10 74.06 64.05 42.07 74.70 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 59.26 40.01 76.00 58.92 39.80 78.11 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 1bbs_c04 RENIN user 7 4 # 7 32 ASP D 56 ASP~? 19.96 CH3 ACY B 403 33 THR D 59 THR~? 16.58 CH3 ACY B 403 215 ASP D 32 ASP.? 14.33 CH3 ACY B 403 216 THR D 55 THR.? 15.68 CH3 ACY B 403 coo 61.19 45.85 78.73 62.86 45.48 77.48 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 62.61 41.50 79.97 61.55 39.62 79.92 5.37 35.06 -0.11 4.54 33.06 0.04 coo 63.61 40.10 74.06 64.05 42.07 74.70 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 59.26 40.01 76.00 58.92 39.80 78.11 2.98 31.79 -5.06 4.48 32.25 -3.56 1bbs_c04 source 1bbs RENIN : 7 hits 1bbs_c04 naa= 4 ULMN 4 1bbs_c05 RENIN user 1 4 # 1 32 ASP A 32 ASP.? 10.92 O ACY A 402 33 THR A 55 THR.? 13.99 O ACY A 402 215 ASP A 56 ASP~? 17.92 O ACY A 402 216 THR A 59 THR~? 14.19 O ACY A 402 coo 61.19 45.85 78.73 62.86 45.48 77.48 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 62.61 41.50 79.97 61.55 39.62 79.92 0.90 9.48 -19.14 2.18 8.78 -20.76 coo 63.61 40.10 74.06 64.05 42.07 74.70 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 59.26 40.01 76.00 58.92 39.80 78.11 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 1bbs_c05 RENIN user 2 4 # 2 32 ASP A 56 ASP~? 17.92 O ACY A 402 33 THR A 59 THR~? 14.19 O ACY A 402 215 ASP A 32 ASP.? 10.92 O ACY A 402 216 THR A 55 THR.? 13.99 O ACY A 402 coo 61.19 45.85 78.73 62.86 45.48 77.48 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 62.61 41.50 79.97 61.55 39.62 79.92 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 63.61 40.10 74.06 64.05 42.07 74.70 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 59.26 40.01 76.00 58.92 39.80 78.11 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 1bbs_c05 RENIN user 3 4 # 3 32 ASP B 32 ASP.? 15.94 OXT ACY B 401 33 THR B 55 THR.? 17.12 OXT ACY B 401 215 ASP B 56 ASP~? 21.60 OXT ACY B 401 216 THR B 59 THR~? 17.71 OXT ACY B 401 coo 61.19 45.85 78.73 62.86 45.48 77.48 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 62.61 41.50 79.97 61.55 39.62 79.92 32.20 8.69 -5.88 30.77 8.33 -4.30 coo 63.61 40.10 74.06 64.05 42.07 74.70 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 59.26 40.01 76.00 58.92 39.80 78.11 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 1bbs_c05 RENIN user 4 4 # 4 32 ASP B 56 ASP~? 21.60 OXT ACY B 401 33 THR B 59 THR~? 17.71 OXT ACY B 401 215 ASP B 32 ASP.? 15.94 OXT ACY B 401 216 THR B 55 THR.? 17.12 OXT ACY B 401 coo 61.19 45.85 78.73 62.86 45.48 77.48 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 62.61 41.50 79.97 61.55 39.62 79.92 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 63.61 40.10 74.06 64.05 42.07 74.70 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 59.26 40.01 76.00 58.92 39.80 78.11 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 1bbs_c05 RENIN user 5 4 # 5 32 ASP C 32 ASP.? 15.02 O1 PO4 A 302 33 THR C 55 THR.? 17.79 O3 GOL A 501 215 ASP C 56 ASP~? 22.04 O3 GOL A 501 216 THR C 59 THR~? 18.08 O3 GOL A 501 coo 61.19 45.85 78.73 62.86 45.48 77.48 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 62.61 41.50 79.97 61.55 39.62 79.92 32.26 29.93 -21.97 30.77 30.39 -23.54 coo 63.61 40.10 74.06 64.05 42.07 74.70 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 59.26 40.01 76.00 58.92 39.80 78.11 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 1bbs_c05 RENIN user 6 4 # 6 32 ASP D 32 ASP.? 14.33 CH3 ACY B 403 33 THR D 55 THR.? 15.68 CH3 ACY B 403 215 ASP D 56 ASP~? 19.96 CH3 ACY B 403 216 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 61.19 45.85 78.73 62.86 45.48 77.48 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 62.61 41.50 79.97 61.55 39.62 79.92 2.98 31.79 -5.06 4.48 32.25 -3.56 coo 63.61 40.10 74.06 64.05 42.07 74.70 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 59.26 40.01 76.00 58.92 39.80 78.11 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 1bbs_c05 RENIN user 7 4 # 7 32 ASP D 56 ASP~? 19.96 CH3 ACY B 403 33 THR D 59 THR~? 16.58 CH3 ACY B 403 215 ASP D 32 ASP.? 14.33 CH3 ACY B 403 216 THR D 55 THR.? 15.68 CH3 ACY B 403 coo 61.19 45.85 78.73 62.86 45.48 77.48 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 62.61 41.50 79.97 61.55 39.62 79.92 5.37 35.06 -0.11 4.54 33.06 0.04 coo 63.61 40.10 74.06 64.05 42.07 74.70 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 59.26 40.01 76.00 58.92 39.80 78.11 2.98 31.79 -5.06 4.48 32.25 -3.56 1bbs_c05 source 1bbs RENIN : 7 hits 1bbs_c05 naa= 4 ULMN 4 1c17_c11 ATP SYNTHASE SUBUNIT C user 1 4 # 1 A 61 ASP A 14 ASP.? 7.78 O4 PO4 A 302 M 206 SER B 30 SER.? 9.89 OXT ACY B 401 M 210 ARG D 42 ARG~? 11.96 OXT ACY B 401 M 214 ASN D 45 ASN.? 18.79 OXT ACY B 401 coo 2.15 -17.14 -6.89 2.91 -15.59 -8.10 28.88 11.61 -26.71 29.05 13.35 -27.94 coo -2.55 -23.32 19.81 -3.48 -21.59 18.38 27.11 16.51 -0.32 27.88 17.99 1.39 coo 1.98 -17.11 17.69 1.79 -15.15 15.33 32.58 20.13 -5.26 29.93 18.65 -5.63 coo 8.13 -16.73 20.92 6.75 -15.93 19.51 34.52 27.70 -3.27 36.36 26.60 -3.23 ULMN 4 1c17_c11 ATP SYNTHASE SUBUNIT C user 2 4 # 2 A 61 ASP B 14 ASP.? 10.32 CH3 ACY B 403 M 206 SER A 30 SER.? -4.23 CH3 ACY A 402s M 210 ARG C 42 ARG~? 8.34 CH3 ACY A 402 M 214 ASN C 45 ASN.? 12.65 O ACY C 404 coo 2.15 -17.14 -6.89 2.91 -15.59 -8.10 4.45 14.77 1.64 4.87 15.68 -0.19 coo -2.55 -23.32 19.81 -3.48 -21.59 18.38 6.58 16.18 -25.41 6.11 17.58 -27.30 coo 1.98 -17.11 17.69 1.79 -15.15 15.33 1.71 20.80 -20.88 4.34 19.24 -20.78 coo 8.13 -16.73 20.92 6.75 -15.93 19.51 0.39 28.73 -23.35 -1.25 27.48 -23.64 ULMN 4 1c17_c11 ATP SYNTHASE SUBUNIT C user 3 4 # 3 A 61 ASP C 14 ASP.? 7.62 O ACY C 404 M 206 SER D 30 SER.? 8.07 CH3 ACY B 403 M 210 ARG B 42 ARG~? 8.81 CH3 ACY B 403 M 214 ASN B 45 ASN.? 15.97 CH3 ACY B 403 coo 2.15 -17.14 -6.89 2.91 -15.59 -8.10 3.61 26.88 -25.47 3.45 24.89 -26.21 coo -2.55 -23.32 19.81 -3.48 -21.59 18.38 8.81 24.50 0.42 8.52 22.82 2.10 coo 1.98 -17.11 17.69 1.79 -15.15 15.33 2.83 20.50 -3.25 5.45 21.98 -3.93 coo 8.13 -16.73 20.92 6.75 -15.93 19.51 0.86 13.33 -0.64 -0.92 14.50 -0.39 1c17_c11 source 1c17 ATP SYNTHASE SUBUNIT C : 3 hits 1c17_c11 naa= 4 ULMN 4 1cms_c03 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 1 4 # 1 34 ASP A 32 ASP.? 10.92 O ACY A 402 35 THR A 55 THR.? 13.99 O ACY A 402 216 ASP A 56 ASP~? 17.92 O ACY A 402 217 THR A 59 THR~? 14.19 O ACY A 402 coo 16.90 26.20 29.49 16.22 24.50 28.41 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 13.84 28.82 26.85 14.18 30.39 25.32 0.90 9.48 -19.14 2.18 8.78 -20.76 coo 13.93 25.52 22.10 14.75 24.44 23.75 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 17.81 28.25 23.25 17.55 29.87 24.67 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 1cms_c03 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 2 4 # 2 34 ASP A 56 ASP~? 17.92 O ACY A 402 35 THR A 59 THR~? 14.19 O ACY A 402 216 ASP A 32 ASP.? 10.92 O ACY A 402 217 THR A 55 THR.? 13.99 O ACY A 402 coo 16.90 26.20 29.49 16.22 24.50 28.41 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 13.84 28.82 26.85 14.18 30.39 25.32 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 13.93 25.52 22.10 14.75 24.44 23.75 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 17.81 28.25 23.25 17.55 29.87 24.67 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 1cms_c03 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 3 4 # 3 34 ASP B 32 ASP.? 15.94 OXT ACY B 401 35 THR B 55 THR.? 17.12 OXT ACY B 401 216 ASP B 56 ASP~? 21.60 OXT ACY B 401 217 THR B 59 THR~? 17.71 OXT ACY B 401 coo 16.90 26.20 29.49 16.22 24.50 28.41 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 13.84 28.82 26.85 14.18 30.39 25.32 32.20 8.69 -5.88 30.77 8.33 -4.30 coo 13.93 25.52 22.10 14.75 24.44 23.75 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 17.81 28.25 23.25 17.55 29.87 24.67 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 1cms_c03 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 4 4 # 4 34 ASP B 56 ASP~? 21.60 OXT ACY B 401 35 THR B 59 THR~? 17.71 OXT ACY B 401 216 ASP B 32 ASP.? 15.94 OXT ACY B 401 217 THR B 55 THR.? 17.12 OXT ACY B 401 coo 16.90 26.20 29.49 16.22 24.50 28.41 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 13.84 28.82 26.85 14.18 30.39 25.32 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 13.93 25.52 22.10 14.75 24.44 23.75 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 17.81 28.25 23.25 17.55 29.87 24.67 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 1cms_c03 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 5 4 # 5 34 ASP C 32 ASP.? 15.02 O1 PO4 A 302 35 THR C 55 THR.? 17.79 O3 GOL A 501 216 ASP C 56 ASP~? 22.04 O3 GOL A 501 217 THR C 59 THR~? 18.08 O3 GOL A 501 coo 16.90 26.20 29.49 16.22 24.50 28.41 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 13.84 28.82 26.85 14.18 30.39 25.32 32.26 29.93 -21.97 30.77 30.39 -23.54 coo 13.93 25.52 22.10 14.75 24.44 23.75 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 17.81 28.25 23.25 17.55 29.87 24.67 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 1cms_c03 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 6 4 # 6 34 ASP C 56 ASP~? 22.04 O3 GOL A 501 35 THR C 59 THR~? 18.08 O3 GOL A 501 216 ASP C 32 ASP.? 15.02 O1 PO4 A 302 217 THR C 55 THR.? 17.79 O3 GOL A 501 coo 16.90 26.20 29.49 16.22 24.50 28.41 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 13.84 28.82 26.85 14.18 30.39 25.32 29.94 33.15 -27.01 30.78 31.19 -27.05 coo 13.93 25.52 22.10 14.75 24.44 23.75 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 17.81 28.25 23.25 17.55 29.87 24.67 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 4 1cms_c03 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 7 4 # 7 34 ASP D 32 ASP.? 14.33 CH3 ACY B 403 35 THR D 55 THR.? 15.68 CH3 ACY B 403 216 ASP D 56 ASP~? 19.96 CH3 ACY B 403 217 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 16.90 26.20 29.49 16.22 24.50 28.41 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 13.84 28.82 26.85 14.18 30.39 25.32 2.98 31.79 -5.06 4.48 32.25 -3.56 coo 13.93 25.52 22.10 14.75 24.44 23.75 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 17.81 28.25 23.25 17.55 29.87 24.67 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 1cms_c03 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 8 4 # 8 34 ASP D 56 ASP~? 19.96 CH3 ACY B 403 35 THR D 59 THR~? 16.58 CH3 ACY B 403 216 ASP D 32 ASP.? 14.33 CH3 ACY B 403 217 THR D 55 THR.? 15.68 CH3 ACY B 403 coo 16.90 26.20 29.49 16.22 24.50 28.41 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 13.84 28.82 26.85 14.18 30.39 25.32 5.37 35.06 -0.11 4.54 33.06 0.04 coo 13.93 25.52 22.10 14.75 24.44 23.75 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 17.81 28.25 23.25 17.55 29.87 24.67 2.98 31.79 -5.06 4.48 32.25 -3.56 1cms_c03 source 1cms CHYMOSIN B (FORMERLY KNOWN AS RENNIN) (E.C.3.4: 8 hits 1cms_c03 naa= 4 ULMN 4 1ecl_c00 MOLECULE: ESCHERICHIA COLI TOPOISOMEuser 1 4 # 1 9 GLU A 13 GLU^? 12.48 O4 PO4 A 302 111 ASP A 14 ASP.? 7.78 O4 PO4 A 302 319 TYR A 19 TYR~? -3.51 O4 PO4 A 302s 365 HIS C 27 HIS~? 7.34 O1 PO4 A 302 coo 40.90 33.12 50.07 39.32 31.72 50.03 27.35 5.02 -24.86 28.03 3.18 -25.64 coo 38.20 29.86 46.47 38.01 31.94 46.26 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 35.52 29.82 41.60 37.98 29.12 42.65 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 32.44 22.36 39.83 33.57 21.39 41.30 22.05 20.86 -32.07 23.10 19.40 -33.17 ULMN 4 1ecl_c00 MOLECULE: ESCHERICHIA COLI TOPOISOMEuser 2 4 # 2 9 GLU B 13 GLU^? 15.77 O ACY B 403 111 ASP B 14 ASP.? 10.32 CH3 ACY B 403 319 TYR B 19 TYR~? 7.66 CH3 ACY B 403 365 HIS D 27 HIS~? 8.84 CH3 ACY B 401 coo 40.90 33.12 50.07 39.32 31.72 50.03 4.71 8.41 0.32 2.63 9.02 0.18 coo 38.20 29.86 46.47 38.01 31.94 46.26 4.45 14.77 1.64 4.87 15.68 -0.19 coo 35.52 29.82 41.60 37.98 29.12 42.65 10.24 15.60 3.03 8.77 16.10 0.69 coo 32.44 22.36 39.83 33.57 21.39 41.30 12.53 22.86 5.89 11.39 21.93 7.39 ULMN 4 1ecl_c00 MOLECULE: ESCHERICHIA COLI TOPOISOMEuser 3 4 # 3 9 GLU C 13 GLU^? 12.93 O ACY C 404 111 ASP C 14 ASP.? 7.62 O ACY C 404 319 TYR C 19 TYR~? -3.65 O ACY C 404s 365 HIS A 27 HIS~? -3.83 OXT ACY A 402s coo 40.90 33.12 50.07 39.32 31.72 50.03 5.05 33.44 -24.76 4.47 35.34 -25.49 coo 38.20 29.86 46.47 38.01 31.94 46.26 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 35.52 29.82 41.60 37.98 29.12 42.65 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 32.44 22.36 39.83 33.57 21.39 41.30 9.52 16.92 -31.25 8.29 18.47 -31.94 ULMN 4 1ecl_c00 MOLECULE: ESCHERICHIA COLI TOPOISOMEuser 4 4 # 4 9 GLU D 13 GLU^? 19.04 OXT ACY B 401 111 ASP D 14 ASP.? 10.51 OXT ACY B 401 319 TYR D 19 TYR~? 6.50 OXT ACY B 401 365 HIS B 27 HIS~? 8.91 CH3 ACY B 401 coo 40.90 33.12 50.07 39.32 31.72 50.03 29.88 33.09 -1.63 31.17 34.65 -1.02 coo 38.20 29.86 46.47 38.01 31.94 46.26 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 35.52 29.82 41.60 37.98 29.12 42.65 24.45 24.76 1.05 22.95 23.32 -0.81 coo 32.44 22.36 39.83 33.57 21.39 41.30 24.22 18.07 5.55 25.63 19.33 6.45 1ecl_c00 source 1ecl MOLECULE: ESCHERICHIA COLI TOPOISOMERASE I : 4 hits 1ecl_c00 naa= 4 ULMN 4 1eed_c03 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 1 4 # 1 P 32 ASP A 32 ASP.? 10.92 O ACY A 402 P 33 THR A 55 THR.? 13.99 O ACY A 402 P 215 ASP A 56 ASP~? 17.92 O ACY A 402 P 216 THR A 59 THR~? 14.19 O ACY A 402 coo 10.15 33.41 11.98 7.98 33.66 12.07 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 9.02 32.64 7.26 9.13 30.80 6.21 0.90 9.48 -19.14 2.18 8.78 -20.76 coo 4.04 29.97 8.82 4.78 31.15 10.46 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 8.39 27.75 9.42 10.09 28.44 8.32 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 1eed_c03 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 2 4 # 2 P 32 ASP A 56 ASP~? 17.92 O ACY A 402 P 33 THR A 59 THR~? 14.19 O ACY A 402 P 215 ASP A 32 ASP.? 10.92 O ACY A 402 P 216 THR A 55 THR.? 13.99 O ACY A 402 coo 10.15 33.41 11.98 7.98 33.66 12.07 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 9.02 32.64 7.26 9.13 30.80 6.21 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 4.04 29.97 8.82 4.78 31.15 10.46 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 8.39 27.75 9.42 10.09 28.44 8.32 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 1eed_c03 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 3 4 # 3 P 32 ASP B 32 ASP.? 15.94 OXT ACY B 401 P 33 THR B 55 THR.? 17.12 OXT ACY B 401 P 215 ASP B 56 ASP~? 21.60 OXT ACY B 401 P 216 THR B 59 THR~? 17.71 OXT ACY B 401 coo 10.15 33.41 11.98 7.98 33.66 12.07 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 9.02 32.64 7.26 9.13 30.80 6.21 32.20 8.69 -5.88 30.77 8.33 -4.30 coo 4.04 29.97 8.82 4.78 31.15 10.46 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 8.39 27.75 9.42 10.09 28.44 8.32 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 1eed_c03 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 4 4 # 4 P 32 ASP B 56 ASP~? 21.60 OXT ACY B 401 P 33 THR B 59 THR~? 17.71 OXT ACY B 401 P 215 ASP B 32 ASP.? 15.94 OXT ACY B 401 P 216 THR B 55 THR.? 17.12 OXT ACY B 401 coo 10.15 33.41 11.98 7.98 33.66 12.07 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 9.02 32.64 7.26 9.13 30.80 6.21 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 4.04 29.97 8.82 4.78 31.15 10.46 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 8.39 27.75 9.42 10.09 28.44 8.32 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 1eed_c03 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 5 4 # 5 P 32 ASP C 32 ASP.? 15.02 O1 PO4 A 302 P 33 THR C 55 THR.? 17.79 O3 GOL A 501 P 215 ASP C 56 ASP~? 22.04 O3 GOL A 501 P 216 THR C 59 THR~? 18.08 O3 GOL A 501 coo 10.15 33.41 11.98 7.98 33.66 12.07 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 9.02 32.64 7.26 9.13 30.80 6.21 32.26 29.93 -21.97 30.77 30.39 -23.54 coo 4.04 29.97 8.82 4.78 31.15 10.46 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 8.39 27.75 9.42 10.09 28.44 8.32 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 1eed_c03 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 6 4 # 6 P 32 ASP C 56 ASP~? 22.04 O3 GOL A 501 P 33 THR C 59 THR~? 18.08 O3 GOL A 501 P 215 ASP C 32 ASP.? 15.02 O1 PO4 A 302 P 216 THR C 55 THR.? 17.79 O3 GOL A 501 coo 10.15 33.41 11.98 7.98 33.66 12.07 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 9.02 32.64 7.26 9.13 30.80 6.21 29.94 33.15 -27.01 30.78 31.19 -27.05 coo 4.04 29.97 8.82 4.78 31.15 10.46 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 8.39 27.75 9.42 10.09 28.44 8.32 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 4 1eed_c03 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 7 4 # 7 P 32 ASP D 32 ASP.? 14.33 CH3 ACY B 403 P 33 THR D 55 THR.? 15.68 CH3 ACY B 403 P 215 ASP D 56 ASP~? 19.96 CH3 ACY B 403 P 216 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 10.15 33.41 11.98 7.98 33.66 12.07 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 9.02 32.64 7.26 9.13 30.80 6.21 2.98 31.79 -5.06 4.48 32.25 -3.56 coo 4.04 29.97 8.82 4.78 31.15 10.46 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 8.39 27.75 9.42 10.09 28.44 8.32 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 1eed_c03 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 8 4 # 8 P 32 ASP D 56 ASP~? 19.96 CH3 ACY B 403 P 33 THR D 59 THR~? 16.58 CH3 ACY B 403 P 215 ASP D 32 ASP.? 14.33 CH3 ACY B 403 P 216 THR D 55 THR.? 15.68 CH3 ACY B 403 coo 10.15 33.41 11.98 7.98 33.66 12.07 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 9.02 32.64 7.26 9.13 30.80 6.21 5.37 35.06 -0.11 4.54 33.06 0.04 coo 4.04 29.97 8.82 4.78 31.15 10.46 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 8.39 27.75 9.42 10.09 28.44 8.32 2.98 31.79 -5.06 4.48 32.25 -3.56 1eed_c03 source 1eed ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLEX WITH TH: 8 hits 1eed_c03 naa= 4 ULMN 4 1hiv_c00 HIV-1 PROTEASE (HIV-1 PR) COMPLEX WIuser 1 4 # 1 A 25 ASP A 32 ASP.? 10.92 O ACY A 402 A 26 THR A 55 THR.? 13.99 O ACY A 402 B 25 ASP A 56 ASP~? 17.92 O ACY A 402 B 26 THR A 59 THR~? 14.19 O ACY A 402 coo 1.46 1.38 19.19 2.92 0.53 17.93 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 4.01 5.49 19.73 5.03 5.84 21.56 0.90 9.48 -19.14 2.18 8.78 -20.76 coo 8.70 2.26 18.89 7.00 1.20 18.15 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 6.29 1.66 22.97 5.06 3.28 23.79 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 1hiv_c00 HIV-1 PROTEASE (HIV-1 PR) COMPLEX WIuser 2 4 # 2 A 25 ASP A 56 ASP~? 17.92 O ACY A 402 A 26 THR A 59 THR~? 14.19 O ACY A 402 B 25 ASP A 32 ASP.? 10.92 O ACY A 402 B 26 THR A 55 THR.? 13.99 O ACY A 402 coo 1.46 1.38 19.19 2.92 0.53 17.93 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 4.01 5.49 19.73 5.03 5.84 21.56 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 8.70 2.26 18.89 7.00 1.20 18.15 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 6.29 1.66 22.97 5.06 3.28 23.79 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 1hiv_c00 HIV-1 PROTEASE (HIV-1 PR) COMPLEX WIuser 3 4 # 3 A 25 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 26 THR B 55 THR.? 17.12 OXT ACY B 401 B 25 ASP B 56 ASP~? 21.60 OXT ACY B 401 B 26 THR B 59 THR~? 17.71 OXT ACY B 401 coo 1.46 1.38 19.19 2.92 0.53 17.93 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 4.01 5.49 19.73 5.03 5.84 21.56 32.20 8.69 -5.88 30.77 8.33 -4.30 coo 8.70 2.26 18.89 7.00 1.20 18.15 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 6.29 1.66 22.97 5.06 3.28 23.79 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 1hiv_c00 HIV-1 PROTEASE (HIV-1 PR) COMPLEX WIuser 4 4 # 4 A 25 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 26 THR B 59 THR~? 17.71 OXT ACY B 401 B 25 ASP B 32 ASP.? 15.94 OXT ACY B 401 B 26 THR B 55 THR.? 17.12 OXT ACY B 401 coo 1.46 1.38 19.19 2.92 0.53 17.93 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 4.01 5.49 19.73 5.03 5.84 21.56 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 8.70 2.26 18.89 7.00 1.20 18.15 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 6.29 1.66 22.97 5.06 3.28 23.79 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 1hiv_c00 HIV-1 PROTEASE (HIV-1 PR) COMPLEX WIuser 5 4 # 5 A 25 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 26 THR C 55 THR.? 17.79 O3 GOL A 501 B 25 ASP C 56 ASP~? 22.04 O3 GOL A 501 B 26 THR C 59 THR~? 18.08 O3 GOL A 501 coo 1.46 1.38 19.19 2.92 0.53 17.93 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 4.01 5.49 19.73 5.03 5.84 21.56 32.26 29.93 -21.97 30.77 30.39 -23.54 coo 8.70 2.26 18.89 7.00 1.20 18.15 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 6.29 1.66 22.97 5.06 3.28 23.79 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 1hiv_c00 HIV-1 PROTEASE (HIV-1 PR) COMPLEX WIuser 6 4 # 6 A 25 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 26 THR C 59 THR~? 18.08 O3 GOL A 501 B 25 ASP C 32 ASP.? 15.02 O1 PO4 A 302 B 26 THR C 55 THR.? 17.79 O3 GOL A 501 coo 1.46 1.38 19.19 2.92 0.53 17.93 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 4.01 5.49 19.73 5.03 5.84 21.56 29.94 33.15 -27.01 30.78 31.19 -27.05 coo 8.70 2.26 18.89 7.00 1.20 18.15 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 6.29 1.66 22.97 5.06 3.28 23.79 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 4 1hiv_c00 HIV-1 PROTEASE (HIV-1 PR) COMPLEX WIuser 7 4 # 7 A 25 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 26 THR D 55 THR.? 15.68 CH3 ACY B 403 B 25 ASP D 56 ASP~? 19.96 CH3 ACY B 403 B 26 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 1.46 1.38 19.19 2.92 0.53 17.93 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 4.01 5.49 19.73 5.03 5.84 21.56 2.98 31.79 -5.06 4.48 32.25 -3.56 coo 8.70 2.26 18.89 7.00 1.20 18.15 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 6.29 1.66 22.97 5.06 3.28 23.79 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 1hiv_c00 HIV-1 PROTEASE (HIV-1 PR) COMPLEX WIuser 8 4 # 8 A 25 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 26 THR D 59 THR~? 16.58 CH3 ACY B 403 B 25 ASP D 32 ASP.? 14.33 CH3 ACY B 403 B 26 THR D 55 THR.? 15.68 CH3 ACY B 403 coo 1.46 1.38 19.19 2.92 0.53 17.93 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 4.01 5.49 19.73 5.03 5.84 21.56 5.37 35.06 -0.11 4.54 33.06 0.04 coo 8.70 2.26 18.89 7.00 1.20 18.15 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 6.29 1.66 22.97 5.06 3.28 23.79 2.98 31.79 -5.06 4.48 32.25 -3.56 1hiv_c00 source 1hiv HIV-1 PROTEASE (HIV-1 PR) COMPLEX WITH U75875 : 8 hits 1hiv_c00 naa= 4 ULMN 4 1mpp_c03 PEPSIN (RENIN) (E.C.3.4.23.23) user 1 4 # 1 32 ASP A 32 ASP.? 10.92 O ACY A 402 33 THR A 55 THR.? 13.99 O ACY A 402 215 ASP A 56 ASP~? 17.92 O ACY A 402 216 THR A 59 THR~? 14.19 O ACY A 402 coo 20.97 14.47 32.28 19.66 15.96 31.62 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 20.74 16.43 36.65 22.27 17.66 37.53 0.90 9.48 -19.14 2.18 8.78 -20.76 coo 20.65 22.00 33.80 20.06 20.56 32.39 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 24.75 19.33 34.08 24.97 17.76 35.56 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 1mpp_c03 PEPSIN (RENIN) (E.C.3.4.23.23) user 2 4 # 2 32 ASP A 56 ASP~? 17.92 O ACY A 402 33 THR A 59 THR~? 14.19 O ACY A 402 215 ASP A 32 ASP.? 10.92 O ACY A 402 216 THR A 55 THR.? 13.99 O ACY A 402 coo 20.97 14.47 32.28 19.66 15.96 31.62 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 20.74 16.43 36.65 22.27 17.66 37.53 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 20.65 22.00 33.80 20.06 20.56 32.39 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 24.75 19.33 34.08 24.97 17.76 35.56 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 1mpp_c03 PEPSIN (RENIN) (E.C.3.4.23.23) user 3 4 # 3 32 ASP B 32 ASP.? 15.94 OXT ACY B 401 33 THR B 55 THR.? 17.12 OXT ACY B 401 215 ASP B 56 ASP~? 21.60 OXT ACY B 401 216 THR B 59 THR~? 17.71 OXT ACY B 401 coo 20.97 14.47 32.28 19.66 15.96 31.62 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 20.74 16.43 36.65 22.27 17.66 37.53 32.20 8.69 -5.88 30.77 8.33 -4.30 coo 20.65 22.00 33.80 20.06 20.56 32.39 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 24.75 19.33 34.08 24.97 17.76 35.56 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 1mpp_c03 PEPSIN (RENIN) (E.C.3.4.23.23) user 4 4 # 4 32 ASP B 56 ASP~? 21.60 OXT ACY B 401 33 THR B 59 THR~? 17.71 OXT ACY B 401 215 ASP B 32 ASP.? 15.94 OXT ACY B 401 216 THR B 55 THR.? 17.12 OXT ACY B 401 coo 20.97 14.47 32.28 19.66 15.96 31.62 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 20.74 16.43 36.65 22.27 17.66 37.53 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 20.65 22.00 33.80 20.06 20.56 32.39 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 24.75 19.33 34.08 24.97 17.76 35.56 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 1mpp_c03 PEPSIN (RENIN) (E.C.3.4.23.23) user 5 4 # 5 32 ASP C 32 ASP.? 15.02 O1 PO4 A 302 33 THR C 55 THR.? 17.79 O3 GOL A 501 215 ASP C 56 ASP~? 22.04 O3 GOL A 501 216 THR C 59 THR~? 18.08 O3 GOL A 501 coo 20.97 14.47 32.28 19.66 15.96 31.62 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 20.74 16.43 36.65 22.27 17.66 37.53 32.26 29.93 -21.97 30.77 30.39 -23.54 coo 20.65 22.00 33.80 20.06 20.56 32.39 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 24.75 19.33 34.08 24.97 17.76 35.56 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 1mpp_c03 PEPSIN (RENIN) (E.C.3.4.23.23) user 6 4 # 6 32 ASP C 56 ASP~? 22.04 O3 GOL A 501 33 THR C 59 THR~? 18.08 O3 GOL A 501 215 ASP C 32 ASP.? 15.02 O1 PO4 A 302 216 THR C 55 THR.? 17.79 O3 GOL A 501 coo 20.97 14.47 32.28 19.66 15.96 31.62 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 20.74 16.43 36.65 22.27 17.66 37.53 29.94 33.15 -27.01 30.78 31.19 -27.05 coo 20.65 22.00 33.80 20.06 20.56 32.39 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 24.75 19.33 34.08 24.97 17.76 35.56 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 4 1mpp_c03 PEPSIN (RENIN) (E.C.3.4.23.23) user 7 4 # 7 32 ASP D 32 ASP.? 14.33 CH3 ACY B 403 33 THR D 55 THR.? 15.68 CH3 ACY B 403 215 ASP D 56 ASP~? 19.96 CH3 ACY B 403 216 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 20.97 14.47 32.28 19.66 15.96 31.62 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 20.74 16.43 36.65 22.27 17.66 37.53 2.98 31.79 -5.06 4.48 32.25 -3.56 coo 20.65 22.00 33.80 20.06 20.56 32.39 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 24.75 19.33 34.08 24.97 17.76 35.56 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 1mpp_c03 PEPSIN (RENIN) (E.C.3.4.23.23) user 8 4 # 8 32 ASP D 56 ASP~? 19.96 CH3 ACY B 403 33 THR D 59 THR~? 16.58 CH3 ACY B 403 215 ASP D 32 ASP.? 14.33 CH3 ACY B 403 216 THR D 55 THR.? 15.68 CH3 ACY B 403 coo 20.97 14.47 32.28 19.66 15.96 31.62 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 20.74 16.43 36.65 22.27 17.66 37.53 5.37 35.06 -0.11 4.54 33.06 0.04 coo 20.65 22.00 33.80 20.06 20.56 32.39 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 24.75 19.33 34.08 24.97 17.76 35.56 2.98 31.79 -5.06 4.48 32.25 -3.56 1mpp_c03 source 1mpp PEPSIN (RENIN) (E.C.3.4.23.23) : 8 hits 1mpp_c03 naa= 4 ULMN 4 1oba_c00 ENDOLYSIN user 1 4 # 1 A 10 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 92 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 94 GLU B 31 GLU.? 14.62 OXT ACY B 401 A 182 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 16.84 44.60 22.54 17.52 46.59 22.35 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 15.90 47.65 31.20 16.27 49.40 30.09 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 16.57 52.97 31.35 16.60 52.99 29.25 33.31 16.38 -0.70 33.25 18.46 -1.14 coo 17.78 48.19 20.08 17.00 49.80 21.19 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 4 1oba_c00 ENDOLYSIN user 2 4 # 2 A 10 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 92 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 94 GLU C 31 GLU.? 14.58 O1 PO4 A 302 A 182 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo 16.84 44.60 22.54 17.52 46.59 22.35 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 15.90 47.65 31.20 16.27 49.40 30.09 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 16.57 52.97 31.35 16.60 52.99 29.25 31.25 23.87 -27.43 32.95 24.08 -28.66 coo 17.78 48.19 20.08 17.00 49.80 21.19 32.89 35.88 -28.31 34.37 37.32 -28.69 ULMN 4 1oba_c00 ENDOLYSIN user 3 4 # 3 A 10 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 92 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 94 GLU D 31 GLU.? 15.11 CH3 ACY B 403 A 182 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 16.84 44.60 22.54 17.52 46.59 22.35 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 15.90 47.65 31.20 16.27 49.40 30.09 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 16.57 52.97 31.35 16.60 52.99 29.25 2.56 25.26 0.73 1.39 26.46 2.05 coo 17.78 48.19 20.08 17.00 49.80 21.19 2.43 37.89 1.30 0.84 39.23 1.50 1oba_c00 source 1oba ENDOLYSIN : 3 hits 1oba_c00 naa= 4 ULMN 4 1rne_c03 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 4 # 1 32 ASP A 32 ASP.? 10.92 O ACY A 402 33 THR A 55 THR.? 13.99 O ACY A 402 215 ASP A 56 ASP~? 17.92 O ACY A 402 216 THR A 59 THR~? 14.19 O ACY A 402 coo 11.85 17.24 72.81 11.09 15.37 72.36 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 8.33 16.80 75.95 6.64 18.11 76.07 0.90 9.48 -19.14 2.18 8.78 -20.76 coo 5.22 15.03 71.43 7.19 14.88 70.83 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 6.39 19.66 71.72 6.69 20.58 73.70 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 1rne_c03 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 2 4 # 2 32 ASP A 56 ASP~? 17.92 O ACY A 402 33 THR A 59 THR~? 14.19 O ACY A 402 215 ASP A 32 ASP.? 10.92 O ACY A 402 216 THR A 55 THR.? 13.99 O ACY A 402 coo 11.85 17.24 72.81 11.09 15.37 72.36 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 8.33 16.80 75.95 6.64 18.11 76.07 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 5.22 15.03 71.43 7.19 14.88 70.83 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 6.39 19.66 71.72 6.69 20.58 73.70 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 1rne_c03 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 3 4 # 3 32 ASP B 32 ASP.? 15.94 OXT ACY B 401 33 THR B 55 THR.? 17.12 OXT ACY B 401 215 ASP B 56 ASP~? 21.60 OXT ACY B 401 216 THR B 59 THR~? 17.71 OXT ACY B 401 coo 11.85 17.24 72.81 11.09 15.37 72.36 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 8.33 16.80 75.95 6.64 18.11 76.07 32.20 8.69 -5.88 30.77 8.33 -4.30 coo 5.22 15.03 71.43 7.19 14.88 70.83 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 6.39 19.66 71.72 6.69 20.58 73.70 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 1rne_c03 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 4 4 # 4 32 ASP B 56 ASP~? 21.60 OXT ACY B 401 33 THR B 59 THR~? 17.71 OXT ACY B 401 215 ASP B 32 ASP.? 15.94 OXT ACY B 401 216 THR B 55 THR.? 17.12 OXT ACY B 401 coo 11.85 17.24 72.81 11.09 15.37 72.36 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 8.33 16.80 75.95 6.64 18.11 76.07 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 5.22 15.03 71.43 7.19 14.88 70.83 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 6.39 19.66 71.72 6.69 20.58 73.70 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 1rne_c03 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 5 4 # 5 32 ASP C 32 ASP.? 15.02 O1 PO4 A 302 33 THR C 55 THR.? 17.79 O3 GOL A 501 215 ASP C 56 ASP~? 22.04 O3 GOL A 501 216 THR C 59 THR~? 18.08 O3 GOL A 501 coo 11.85 17.24 72.81 11.09 15.37 72.36 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 8.33 16.80 75.95 6.64 18.11 76.07 32.26 29.93 -21.97 30.77 30.39 -23.54 coo 5.22 15.03 71.43 7.19 14.88 70.83 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 6.39 19.66 71.72 6.69 20.58 73.70 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 1rne_c03 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 6 4 # 6 32 ASP C 56 ASP~? 22.04 O3 GOL A 501 33 THR C 59 THR~? 18.08 O3 GOL A 501 215 ASP C 32 ASP.? 15.02 O1 PO4 A 302 216 THR C 55 THR.? 17.79 O3 GOL A 501 coo 11.85 17.24 72.81 11.09 15.37 72.36 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 8.33 16.80 75.95 6.64 18.11 76.07 29.94 33.15 -27.01 30.78 31.19 -27.05 coo 5.22 15.03 71.43 7.19 14.88 70.83 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 6.39 19.66 71.72 6.69 20.58 73.70 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 4 1rne_c03 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 7 4 # 7 32 ASP D 32 ASP.? 14.33 CH3 ACY B 403 33 THR D 55 THR.? 15.68 CH3 ACY B 403 215 ASP D 56 ASP~? 19.96 CH3 ACY B 403 216 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 11.85 17.24 72.81 11.09 15.37 72.36 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 8.33 16.80 75.95 6.64 18.11 76.07 2.98 31.79 -5.06 4.48 32.25 -3.56 coo 5.22 15.03 71.43 7.19 14.88 70.83 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 6.39 19.66 71.72 6.69 20.58 73.70 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 1rne_c03 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 8 4 # 8 32 ASP D 56 ASP~? 19.96 CH3 ACY B 403 33 THR D 59 THR~? 16.58 CH3 ACY B 403 215 ASP D 32 ASP.? 14.33 CH3 ACY B 403 216 THR D 55 THR.? 15.68 CH3 ACY B 403 coo 11.85 17.24 72.81 11.09 15.37 72.36 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 8.33 16.80 75.95 6.64 18.11 76.07 5.37 35.06 -0.11 4.54 33.06 0.04 coo 5.22 15.03 71.43 7.19 14.88 70.83 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 6.39 19.66 71.72 6.69 20.58 73.70 2.98 31.79 -5.06 4.48 32.25 -3.56 1rne_c03 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 8 hits 1rne_c03 naa= 4 ULMN 4 2apr_c03 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 1 4 # 1 35 ASP A 32 ASP.? 10.92 O ACY A 402 36 THR A 55 THR.? 13.99 O ACY A 402 218 ASP A 56 ASP~? 17.92 O ACY A 402 219 THR A 59 THR~? 14.19 O ACY A 402 coo 41.14 58.72 105.19 42.39 59.85 103.92 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 41.22 55.69 101.49 39.49 55.36 100.22 0.90 9.48 -19.14 2.18 8.78 -20.76 coo 41.33 60.20 97.63 42.00 60.96 99.49 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 37.29 59.30 100.22 37.00 57.33 101.12 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 2apr_c03 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 2 4 # 2 35 ASP A 56 ASP~? 17.92 O ACY A 402 36 THR A 59 THR~? 14.19 O ACY A 402 218 ASP A 32 ASP.? 10.92 O ACY A 402 219 THR A 55 THR.? 13.99 O ACY A 402 coo 41.14 58.72 105.19 42.39 59.85 103.92 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 41.22 55.69 101.49 39.49 55.36 100.22 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 41.33 60.20 97.63 42.00 60.96 99.49 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 37.29 59.30 100.22 37.00 57.33 101.12 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 2apr_c03 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 3 4 # 3 35 ASP B 32 ASP.? 15.94 OXT ACY B 401 36 THR B 55 THR.? 17.12 OXT ACY B 401 218 ASP B 56 ASP~? 21.60 OXT ACY B 401 219 THR B 59 THR~? 17.71 OXT ACY B 401 coo 41.14 58.72 105.19 42.39 59.85 103.92 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 41.22 55.69 101.49 39.49 55.36 100.22 32.20 8.69 -5.88 30.77 8.33 -4.30 coo 41.33 60.20 97.63 42.00 60.96 99.49 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 37.29 59.30 100.22 37.00 57.33 101.12 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 2apr_c03 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 4 4 # 4 35 ASP B 56 ASP~? 21.60 OXT ACY B 401 36 THR B 59 THR~? 17.71 OXT ACY B 401 218 ASP B 32 ASP.? 15.94 OXT ACY B 401 219 THR B 55 THR.? 17.12 OXT ACY B 401 coo 41.14 58.72 105.19 42.39 59.85 103.92 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 41.22 55.69 101.49 39.49 55.36 100.22 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 41.33 60.20 97.63 42.00 60.96 99.49 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 37.29 59.30 100.22 37.00 57.33 101.12 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 2apr_c03 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 5 4 # 5 35 ASP C 32 ASP.? 15.02 O1 PO4 A 302 36 THR C 55 THR.? 17.79 O3 GOL A 501 218 ASP C 56 ASP~? 22.04 O3 GOL A 501 219 THR C 59 THR~? 18.08 O3 GOL A 501 coo 41.14 58.72 105.19 42.39 59.85 103.92 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 41.22 55.69 101.49 39.49 55.36 100.22 32.26 29.93 -21.97 30.77 30.39 -23.54 coo 41.33 60.20 97.63 42.00 60.96 99.49 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 37.29 59.30 100.22 37.00 57.33 101.12 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 2apr_c03 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 6 4 # 6 35 ASP C 56 ASP~? 22.04 O3 GOL A 501 36 THR C 59 THR~? 18.08 O3 GOL A 501 218 ASP C 32 ASP.? 15.02 O1 PO4 A 302 219 THR C 55 THR.? 17.79 O3 GOL A 501 coo 41.14 58.72 105.19 42.39 59.85 103.92 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 41.22 55.69 101.49 39.49 55.36 100.22 29.94 33.15 -27.01 30.78 31.19 -27.05 coo 41.33 60.20 97.63 42.00 60.96 99.49 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 37.29 59.30 100.22 37.00 57.33 101.12 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 4 2apr_c03 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 7 4 # 7 35 ASP D 32 ASP.? 14.33 CH3 ACY B 403 36 THR D 55 THR.? 15.68 CH3 ACY B 403 218 ASP D 56 ASP~? 19.96 CH3 ACY B 403 219 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 41.14 58.72 105.19 42.39 59.85 103.92 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 41.22 55.69 101.49 39.49 55.36 100.22 2.98 31.79 -5.06 4.48 32.25 -3.56 coo 41.33 60.20 97.63 42.00 60.96 99.49 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 37.29 59.30 100.22 37.00 57.33 101.12 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 2apr_c03 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 8 4 # 8 35 ASP D 56 ASP~? 19.96 CH3 ACY B 403 36 THR D 59 THR~? 16.58 CH3 ACY B 403 218 ASP D 32 ASP.? 14.33 CH3 ACY B 403 219 THR D 55 THR.? 15.68 CH3 ACY B 403 coo 41.14 58.72 105.19 42.39 59.85 103.92 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 41.22 55.69 101.49 39.49 55.36 100.22 5.37 35.06 -0.11 4.54 33.06 0.04 coo 41.33 60.20 97.63 42.00 60.96 99.49 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 37.29 59.30 100.22 37.00 57.33 101.12 2.98 31.79 -5.06 4.48 32.25 -3.56 2apr_c03 source 2apr ACID PROTEINASE (RHIZOPUSPEPSIN) (E.C.3.4.23.6: 8 hits 2apr_c03 naa= 4 ULMN 4 2jxr_c03 LIGAND CP-081282 user 1 4 # 1 A 32 ASP A 32 ASP.? 10.92 O ACY A 402 A 33 THR A 55 THR.? 13.99 O ACY A 402 A 215 ASP A 56 ASP~? 17.92 O ACY A 402 A 216 THR A 59 THR~? 14.19 O ACY A 402 coo -14.00 61.45 43.99 -14.19 63.14 42.84 3.75 12.55 -21.98 2.34 11.90 -23.40 coo -9.45 62.69 43.21 -8.10 61.71 41.85 0.90 9.48 -19.14 2.18 8.78 -20.76 coo -10.72 64.19 37.77 -12.20 64.43 39.15 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -10.69 59.56 38.85 -9.70 58.81 40.64 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 4 2jxr_c03 LIGAND CP-081282 user 2 4 # 2 A 32 ASP A 56 ASP~? 17.92 O ACY A 402 A 33 THR A 59 THR~? 14.19 O ACY A 402 A 215 ASP A 32 ASP.? 10.92 O ACY A 402 A 216 THR A 55 THR.? 13.99 O ACY A 402 coo -14.00 61.45 43.99 -14.19 63.14 42.84 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -9.45 62.69 43.21 -8.10 61.71 41.85 2.48 5.35 -23.92 1.78 7.38 -24.24 coo -10.72 64.19 37.77 -12.20 64.43 39.15 3.75 12.55 -21.98 2.34 11.90 -23.40 coo -10.69 59.56 38.85 -9.70 58.81 40.64 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 4 2jxr_c03 LIGAND CP-081282 user 3 4 # 3 A 32 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 33 THR B 55 THR.? 17.12 OXT ACY B 401 A 215 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 216 THR B 59 THR~? 17.71 OXT ACY B 401 coo -14.00 61.45 43.99 -14.19 63.14 42.84 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -9.45 62.69 43.21 -8.10 61.71 41.85 32.20 8.69 -5.88 30.77 8.33 -4.30 coo -10.72 64.19 37.77 -12.20 64.43 39.15 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -10.69 59.56 38.85 -9.70 58.81 40.64 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 4 2jxr_c03 LIGAND CP-081282 user 4 4 # 4 A 32 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 33 THR B 59 THR~? 17.71 OXT ACY B 401 A 215 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 216 THR B 55 THR.? 17.12 OXT ACY B 401 coo -14.00 61.45 43.99 -14.19 63.14 42.84 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -9.45 62.69 43.21 -8.10 61.71 41.85 30.30 5.71 -0.52 31.18 7.66 -0.59 coo -10.72 64.19 37.77 -12.20 64.43 39.15 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -10.69 59.56 38.85 -9.70 58.81 40.64 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 4 2jxr_c03 LIGAND CP-081282 user 5 4 # 5 A 32 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 33 THR C 55 THR.? 17.79 O3 GOL A 501 A 215 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 216 THR C 59 THR~? 18.08 O3 GOL A 501 coo -14.00 61.45 43.99 -14.19 63.14 42.84 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -9.45 62.69 43.21 -8.10 61.71 41.85 32.26 29.93 -21.97 30.77 30.39 -23.54 coo -10.72 64.19 37.77 -12.20 64.43 39.15 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -10.69 59.56 38.85 -9.70 58.81 40.64 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 4 2jxr_c03 LIGAND CP-081282 user 6 4 # 6 A 32 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 33 THR C 59 THR~? 18.08 O3 GOL A 501 A 215 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 216 THR C 55 THR.? 17.79 O3 GOL A 501 coo -14.00 61.45 43.99 -14.19 63.14 42.84 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -9.45 62.69 43.21 -8.10 61.71 41.85 29.94 33.15 -27.01 30.78 31.19 -27.05 coo -10.72 64.19 37.77 -12.20 64.43 39.15 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -10.69 59.56 38.85 -9.70 58.81 40.64 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 4 2jxr_c03 LIGAND CP-081282 user 7 4 # 7 A 32 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 33 THR D 55 THR.? 15.68 CH3 ACY B 403 A 215 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 216 THR D 59 THR~? 16.58 CH3 ACY B 403 coo -14.00 61.45 43.99 -14.19 63.14 42.84 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -9.45 62.69 43.21 -8.10 61.71 41.85 2.98 31.79 -5.06 4.48 32.25 -3.56 coo -10.72 64.19 37.77 -12.20 64.43 39.15 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -10.69 59.56 38.85 -9.70 58.81 40.64 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 4 2jxr_c03 LIGAND CP-081282 user 8 4 # 8 A 32 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 33 THR D 59 THR~? 16.58 CH3 ACY B 403 A 215 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 216 THR D 55 THR.? 15.68 CH3 ACY B 403 coo -14.00 61.45 43.99 -14.19 63.14 42.84 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -9.45 62.69 43.21 -8.10 61.71 41.85 5.37 35.06 -0.11 4.54 33.06 0.04 coo -10.72 64.19 37.77 -12.20 64.43 39.15 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -10.69 59.56 38.85 -9.70 58.81 40.64 2.98 31.79 -5.06 4.48 32.25 -3.56 2jxr_c03 source 2jxr LIGAND CP-081282 : 8 hits 2jxr_c03 naa= 4 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 140 TYR A 6 TYR^? 17.89 O ACY A 402 B 190 LYS A 3 LYS.? 16.38 O ACY A 402 B 222 ASP A 32 ASP.? 10.92 O ACY A 402 coo 7.17 16.59 41.26 8.01 19.20 40.73 5.36 6.34 -15.79 3.13 4.70 -15.92 coo 13.38 20.00 35.06 11.43 22.49 39.53 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 9.76 26.58 38.10 11.63 25.78 38.76 3.75 12.55 -21.98 2.34 11.90 -23.40 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 # 2 A 140 TYR B 6 TYR^? 19.40 O ACY B 403 B 190 LYS B 3 LYS.? 19.35 OXT ACY B 401 B 222 ASP B 32 ASP.? 15.94 OXT ACY B 401 coo 7.17 16.59 41.26 8.01 19.20 40.73 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 13.38 20.00 35.06 11.43 22.49 39.53 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 9.76 26.58 38.10 11.63 25.78 38.76 30.64 12.55 -3.88 32.46 12.19 -2.91 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 3 3 # 3 A 140 TYR C 6 TYR^? 20.74 O2 GOL A 501 B 190 LYS C 3 LYS.? 18.92 O1 PO4 A 302 B 222 ASP C 32 ASP.? 15.02 O1 PO4 A 302 coo 7.17 16.59 41.26 8.01 19.20 40.73 28.12 33.29 -18.50 30.13 35.12 -19.15 coo 13.38 20.00 35.06 11.43 22.49 39.53 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 9.76 26.58 38.10 11.63 25.78 38.76 29.38 26.56 -24.17 30.67 26.95 -25.70 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 4 3 # 4 A 140 TYR D 6 TYR^? 18.56 CH3 ACY B 403 B 190 LYS D 3 LYS.? 18.33 CH3 ACY B 403 B 222 ASP D 32 ASP.? 14.33 CH3 ACY B 403 coo 7.17 16.59 41.26 8.01 19.20 40.73 7.30 34.85 -8.71 5.25 36.67 -8.19 coo 13.38 20.00 35.06 11.43 22.49 39.53 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 9.76 26.58 38.10 11.63 25.78 38.76 4.73 28.33 -3.00 2.76 28.70 -2.23 1a05_c00 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 4 hits 1a05_c00 naa= 3 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 190 LYS A 3 LYS.? 16.38 O ACY A 402 A 222 ASP A 32 ASP.? 10.92 O ACY A 402 B 140 TYR A 6 TYR^? 17.89 O ACY A 402 coo -4.61 20.12 30.34 -2.74 22.65 25.95 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo -1.04 26.60 27.37 -2.94 25.93 26.69 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 1.51 16.60 24.17 0.82 19.23 24.79 5.36 6.34 -15.79 3.13 4.70 -15.92 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 # 2 A 190 LYS B 3 LYS.? 19.35 OXT ACY B 401 A 222 ASP B 32 ASP.? 15.94 OXT ACY B 401 B 140 TYR B 6 TYR^? 19.40 O ACY B 403 coo -4.61 20.12 30.34 -2.74 22.65 25.95 35.65 7.25 -8.40 36.12 12.24 -4.67 coo -1.04 26.60 27.37 -2.94 25.93 26.69 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 1.51 16.60 24.17 0.82 19.23 24.79 27.43 5.57 -8.88 29.53 3.76 -8.64 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 3 3 # 3 A 190 LYS C 3 LYS.? 18.92 O1 PO4 A 302 A 222 ASP C 32 ASP.? 15.02 O1 PO4 A 302 B 140 TYR C 6 TYR^? 20.74 O2 GOL A 501 coo -4.61 20.12 30.34 -2.74 22.65 25.95 35.92 31.10 -19.94 35.74 27.15 -23.97 coo -1.04 26.60 27.37 -2.94 25.93 26.69 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 1.51 16.60 24.17 0.82 19.23 24.79 28.12 33.29 -18.50 30.13 35.12 -19.15 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 4 3 # 4 A 190 LYS D 3 LYS.? 18.33 CH3 ACY B 403 A 222 ASP D 32 ASP.? 14.33 CH3 ACY B 403 B 140 TYR D 6 TYR^? 18.56 CH3 ACY B 403 coo -4.61 20.12 30.34 -2.74 22.65 25.95 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo -1.04 26.60 27.37 -2.94 25.93 26.69 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 1.51 16.60 24.17 0.82 19.23 24.79 7.30 34.85 -8.71 5.25 36.67 -8.19 1a05_c01 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 4 hits 1a05_c01 naa= 3 ULMN 3 1ab4_c00 GYRASE A user 1 3 # 1 32 ARG A 20 ARG~? 11.30 O1 PO4 A 302 78 HIS C 27 HIS~? 7.34 O1 PO4 A 302 122 TYR D 39 TYR^? 13.45 OXT ACY B 401 coo 48.32 72.26 30.89 48.69 69.28 31.53 19.43 13.50 -36.40 19.41 10.58 -37.42 coo 53.63 68.24 34.99 53.08 69.10 33.16 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 75.01 61.87 32.93 75.34 59.26 31.96 25.37 22.88 -11.59 27.59 22.45 -13.28 ULMN 3 1ab4_c00 GYRASE A user 2 3 # 2 32 ARG B 20 ARG~? 14.42 CH3 ACY B 401 78 HIS D 27 HIS~? 8.84 CH3 ACY B 401 122 TYR C 39 TYR^? 11.15 O ACY C 404 coo 48.32 72.26 30.89 48.69 69.28 31.53 14.16 15.78 11.00 13.60 12.97 12.19 coo 53.63 68.24 34.99 53.08 69.10 33.16 12.53 22.86 5.89 11.39 21.93 7.39 coo 75.01 61.87 32.93 75.34 59.26 31.96 9.18 23.50 -14.87 7.01 23.51 -13.16 ULMN 3 1ab4_c00 GYRASE A user 3 3 # 3 32 ARG C 20 ARG~? 11.83 CH3 ACY C 404 78 HIS A 27 HIS~? -3.83 OXT ACY A 402s 122 TYR B 39 TYR^? 10.21 CH3 ACY B 403 coo 48.32 72.26 30.89 48.69 69.28 31.53 11.69 24.38 -36.69 11.38 27.15 -38.05 coo 53.63 68.24 34.99 53.08 69.10 33.16 9.52 16.92 -31.25 8.29 18.47 -31.94 coo 75.01 61.87 32.93 75.34 59.26 31.96 9.18 17.36 -10.32 6.76 17.67 -11.73 ULMN 3 1ab4_c00 GYRASE A user 4 3 # 4 32 ARG D 20 ARG~? 14.11 CH3 ACY B 401 78 HIS B 27 HIS~? 8.91 CH3 ACY B 401 122 TYR A 39 TYR^? 11.39 O4 PO4 A 302 coo 48.32 72.26 30.89 48.69 69.28 31.53 23.40 25.12 9.78 26.24 26.16 10.42 coo 53.63 68.24 34.99 53.08 69.10 33.16 24.22 18.07 5.55 25.63 19.33 6.45 coo 75.01 61.87 32.93 75.34 59.26 31.96 24.81 16.29 -15.55 27.22 16.47 -14.15 1ab4_c00 source 1ab4 GYRASE A : 4 hits 1ab4_c00 naa= 3 ULMN 3 1ald_c00 ALDOLASE A (E.C.4.1.2.13) user 1 3 # 1 33 ASP B 14 ASP.? 10.32 CH3 ACY B 403 187 GLU B 44 GLU~? 18.30 CH3 ACY B 403 229 LYS A 81 LYS.? 21.98 O ACY B 403 coo -52.57 56.60 47.75 -51.52 54.87 46.95 4.45 14.77 1.64 4.87 15.68 -0.19 coo -45.08 48.37 46.81 -46.53 49.74 45.96 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo -47.40 44.36 48.48 -50.80 49.18 46.20 3.08 5.09 -7.58 2.00 0.68 -7.21 1ald_c00 source 1ald ALDOLASE A (E.C.4.1.2.13) : 1 hits 1ald_c00 naa= 3 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 56 ASP~? 17.92 O ACY A 402 214 ASP A 14 ASP.? 7.78 O4 PO4 A 302 289 ASP A 32 ASP.? 10.92 O ACY A 402 coo -0.62 65.95 29.97 0.31 67.47 31.05 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 26.86 59.76 46.36 25.42 58.23 45.92 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 9.42 68.07 30.27 7.35 68.27 30.10 3.75 12.55 -21.98 2.34 11.90 -23.40 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 58 ASP~? 21.11 O ACY A 402 214 ASP A 14 ASP.? 7.78 O4 PO4 A 302 289 ASP A 32 ASP.? 10.92 O ACY A 402 coo -0.62 65.95 29.97 0.31 67.47 31.05 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 26.86 59.76 46.36 25.42 58.23 45.92 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 9.42 68.07 30.27 7.35 68.27 30.10 3.75 12.55 -21.98 2.34 11.90 -23.40 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP A 58 ASP~? 21.11 O ACY A 402 214 ASP D 32 ASP.? 14.33 CH3 ACY B 403 289 ASP A 32 ASP.? 10.92 O ACY A 402 coo -0.62 65.95 29.97 0.31 67.47 31.05 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 26.86 59.76 46.36 25.42 58.23 45.92 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 9.42 68.07 30.27 7.35 68.27 30.10 3.75 12.55 -21.98 2.34 11.90 -23.40 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 4 3 # 4 179 ASP B 56 ASP~? 21.60 OXT ACY B 401 214 ASP B 14 ASP.? 10.32 CH3 ACY B 403 289 ASP B 32 ASP.? 15.94 OXT ACY B 401 coo -0.62 65.95 29.97 0.31 67.47 31.05 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 26.86 59.76 46.36 25.42 58.23 45.92 4.45 14.77 1.64 4.87 15.68 -0.19 coo 9.42 68.07 30.27 7.35 68.27 30.10 30.64 12.55 -3.88 32.46 12.19 -2.91 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 5 3 # 5 179 ASP B 58 ASP~? 24.69 OXT ACY B 401 214 ASP B 14 ASP.? 10.32 CH3 ACY B 403 289 ASP B 32 ASP.? 15.94 OXT ACY B 401 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.22 2.96 0.74 34.69 1.59 1.17 coo 26.86 59.76 46.36 25.42 58.23 45.92 4.45 14.77 1.64 4.87 15.68 -0.19 coo 9.42 68.07 30.27 7.35 68.27 30.10 30.64 12.55 -3.88 32.46 12.19 -2.91 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 6 3 # 6 179 ASP B 58 ASP~? 24.69 OXT ACY B 401 214 ASP C 32 ASP.? 15.02 O1 PO4 A 302 289 ASP B 32 ASP.? 15.94 OXT ACY B 401 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.22 2.96 0.74 34.69 1.59 1.17 coo 26.86 59.76 46.36 25.42 58.23 45.92 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 9.42 68.07 30.27 7.35 68.27 30.10 30.64 12.55 -3.88 32.46 12.19 -2.91 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 7 3 # 7 179 ASP C 56 ASP~? 22.04 O3 GOL A 501 214 ASP C 14 ASP.? 7.62 O ACY C 404 289 ASP C 32 ASP.? 15.02 O1 PO4 A 302 coo -0.62 65.95 29.97 0.31 67.47 31.05 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 26.86 59.76 46.36 25.42 58.23 45.92 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 9.42 68.07 30.27 7.35 68.27 30.10 29.38 26.56 -24.17 30.67 26.95 -25.70 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 8 3 # 8 179 ASP C 58 ASP~? 25.07 O3 GOL A 501 214 ASP B 32 ASP.? 15.94 OXT ACY B 401 289 ASP C 32 ASP.? 15.02 O1 PO4 A 302 coo -0.62 65.95 29.97 0.31 67.47 31.05 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 26.86 59.76 46.36 25.42 58.23 45.92 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 9.42 68.07 30.27 7.35 68.27 30.10 29.38 26.56 -24.17 30.67 26.95 -25.70 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 9 3 # 9 179 ASP C 58 ASP~? 25.07 O3 GOL A 501 214 ASP C 14 ASP.? 7.62 O ACY C 404 289 ASP C 32 ASP.? 15.02 O1 PO4 A 302 coo -0.62 65.95 29.97 0.31 67.47 31.05 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 26.86 59.76 46.36 25.42 58.23 45.92 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 9.42 68.07 30.27 7.35 68.27 30.10 29.38 26.56 -24.17 30.67 26.95 -25.70 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 10 3 # 10 179 ASP D 58 ASP~? 23.91 CH3 ACY B 403 214 ASP A 32 ASP.? 10.92 O ACY A 402 289 ASP D 32 ASP.? 14.33 CH3 ACY B 403 coo -0.62 65.95 29.97 0.31 67.47 31.05 2.43 37.89 1.30 0.84 39.23 1.50 coo 26.86 59.76 46.36 25.42 58.23 45.92 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 9.42 68.07 30.27 7.35 68.27 30.10 4.73 28.33 -3.00 2.76 28.70 -2.23 1amy_c01 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 10 hits 1amy_c01 naa= 3 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 32 ASP.? 10.92 O ACY A 402 227 GLU B 44 GLU~? 18.30 CH3 ACY B 403 289 ASP A 58 ASP~? 21.11 O ACY A 402 coo -0.62 65.95 29.97 0.31 67.47 31.05 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 3.96 55.76 41.24 4.83 57.69 41.17 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 9.42 68.07 30.27 7.35 68.27 30.10 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP C 32 ASP.? 15.02 O1 PO4 A 302 227 GLU C 24 GLU~? 11.35 C3 GOL A 501 289 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo -0.62 65.95 29.97 0.31 67.47 31.05 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 3.96 55.76 41.24 4.83 57.69 41.17 18.84 25.84 -35.18 19.75 24.32 -36.38 coo 9.42 68.07 30.27 7.35 68.27 30.10 32.89 35.88 -28.31 34.37 37.32 -28.69 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP C 32 ASP.? 15.02 O1 PO4 A 302 227 GLU D 44 GLU~? 21.69 OXT ACY B 401 289 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo -0.62 65.95 29.97 0.31 67.47 31.05 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 3.96 55.76 41.24 4.83 57.69 41.17 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 9.42 68.07 30.27 7.35 68.27 30.10 32.89 35.88 -28.31 34.37 37.32 -28.69 1amy_c06 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 3 hits 1amy_c06 naa= 3 ULMN 3 1ax4_c04 TRYPTOPHANASE user 1 3 # 1 A 130 PHE A 5 PHE^? 16.17 CH3 ACY B 403 A 223 ASP A 32 ASP.? 10.92 O ACY A 402 A 265 LYS A 66 LYS~? 16.67 O ACY A 402 coo 39.74 52.86 65.74 41.15 55.14 66.52 2.94 11.68 -11.76 1.35 13.95 -11.61 coo 30.70 47.50 67.53 29.83 49.47 67.39 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 19.99 54.53 64.11 20.55 58.78 68.33 11.69 2.61 -28.49 7.34 2.61 -31.70 ULMN 3 1ax4_c04 TRYPTOPHANASE user 2 3 # 2 A 130 PHE A 29 PHE~? 10.35 O ACY A 402 A 223 ASP A 56 ASP~? 17.92 O ACY A 402 A 265 LYS A 81 LYS.? 21.98 O ACY B 403 coo 39.74 52.86 65.74 41.15 55.14 66.52 6.52 10.08 -26.44 5.88 7.60 -27.67 coo 30.70 47.50 67.53 29.83 49.47 67.39 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 19.99 54.53 64.11 20.55 58.78 68.33 3.08 5.09 -7.58 2.00 0.68 -7.21 ULMN 3 1ax4_c04 TRYPTOPHANASE user 3 3 # 3 A 130 PHE B 5 PHE^? 15.02 O4 PO4 A 302 A 223 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 265 LYS B 66 LYS~? 18.61 CH3 ACY B 401 coo 39.74 52.86 65.74 41.15 55.14 66.52 30.24 10.18 -13.46 31.99 12.32 -13.93 coo 30.70 47.50 67.53 29.83 49.47 67.39 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 19.99 54.53 64.11 20.55 58.78 68.33 20.89 3.87 3.84 24.86 4.42 7.52 ULMN 3 1ax4_c04 TRYPTOPHANASE user 4 3 # 4 A 130 PHE B 29 PHE~? 13.95 OXT ACY B 401 A 223 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 265 LYS B 81 LYS.? 16.99 O4 PO4 A 302 coo 39.74 52.86 65.74 41.15 55.14 66.52 26.40 10.51 1.39 26.72 8.16 2.92 coo 30.70 47.50 67.53 29.83 49.47 67.39 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 19.99 54.53 64.11 20.55 58.78 68.33 29.08 3.04 -17.20 34.50 4.57 -18.92 ULMN 3 1ax4_c04 TRYPTOPHANASE user 5 3 # 5 A 130 PHE C 5 PHE^? 19.41 OXT ACY B 401 A 223 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 265 LYS C 66 LYS~? 17.26 CH3 ACY C 404 coo 39.74 52.86 65.74 41.15 55.14 66.52 31.13 28.40 -14.21 32.73 26.13 -13.97 coo 30.70 47.50 67.53 29.83 49.47 67.39 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 19.99 54.53 64.11 20.55 58.78 68.33 20.24 35.37 -30.72 23.66 34.59 -34.92 ULMN 3 1ax4_c04 TRYPTOPHANASE user 6 3 # 6 A 130 PHE C 29 PHE~? 13.92 O3 GOL A 501 A 223 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 265 LYS C 81 LYS.? 25.54 OXT ACY B 401 coo 39.74 52.86 65.74 41.15 55.14 66.52 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 30.70 47.50 67.53 29.83 49.47 67.39 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 19.99 54.53 64.11 20.55 58.78 68.33 31.22 35.67 -10.67 31.64 40.37 -10.68 ULMN 3 1ax4_c04 TRYPTOPHANASE user 7 3 # 7 A 130 PHE D 5 PHE^? 15.02 O ACY C 404 A 223 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 265 LYS D 66 LYS~? 18.65 CH3 ACY B 401 coo 39.74 52.86 65.74 41.15 55.14 66.52 4.10 29.83 -12.63 2.45 27.56 -12.72 coo 30.70 47.50 67.53 29.83 49.47 67.39 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 19.99 54.53 64.11 20.55 58.78 68.33 15.33 36.81 3.59 11.66 36.34 7.56 ULMN 3 1ax4_c04 TRYPTOPHANASE user 8 3 # 8 A 130 PHE D 29 PHE~? 13.75 O ACY B 401 A 223 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 265 LYS D 81 LYS.? 19.75 O ACY C 404 coo 39.74 52.86 65.74 41.15 55.14 66.52 9.63 30.41 1.98 9.49 32.86 3.31 coo 30.70 47.50 67.53 29.83 49.47 67.39 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 19.99 54.53 64.11 20.55 58.78 68.33 4.59 37.20 -16.29 4.16 41.27 -17.63 1ax4_c04 source 1ax4 TRYPTOPHANASE : 8 hits 1ax4_c04 naa= 3 ULMN 3 1ax4_c05 TRYPTOPHANASE user 1 3 # 1 B 130 PHE A 5 PHE^? 16.17 CH3 ACY B 403 B 223 ASP A 32 ASP.? 10.92 O ACY A 402 B 265 LYS A 66 LYS~? 16.67 O ACY A 402 coo 7.48 54.94 99.62 7.67 52.27 100.42 2.94 11.68 -11.76 1.35 13.95 -11.61 coo 10.43 61.66 91.81 9.80 60.04 90.61 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 5.43 58.06 80.08 8.57 53.00 79.37 11.69 2.61 -28.49 7.34 2.61 -31.70 ULMN 3 1ax4_c05 TRYPTOPHANASE user 2 3 # 2 B 130 PHE A 29 PHE~? 10.35 O ACY A 402 B 223 ASP A 56 ASP~? 17.92 O ACY A 402 B 265 LYS A 81 LYS.? 21.98 O ACY B 403 coo 7.48 54.94 99.62 7.67 52.27 100.42 6.52 10.08 -26.44 5.88 7.60 -27.67 coo 10.43 61.66 91.81 9.80 60.04 90.61 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 5.43 58.06 80.08 8.57 53.00 79.37 3.08 5.09 -7.58 2.00 0.68 -7.21 ULMN 3 1ax4_c05 TRYPTOPHANASE user 3 3 # 3 B 130 PHE B 5 PHE^? 15.02 O4 PO4 A 302 B 223 ASP B 32 ASP.? 15.94 OXT ACY B 401 B 265 LYS B 66 LYS~? 18.61 CH3 ACY B 401 coo 7.48 54.94 99.62 7.67 52.27 100.42 30.24 10.18 -13.46 31.99 12.32 -13.93 coo 10.43 61.66 91.81 9.80 60.04 90.61 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 5.43 58.06 80.08 8.57 53.00 79.37 20.89 3.87 3.84 24.86 4.42 7.52 ULMN 3 1ax4_c05 TRYPTOPHANASE user 4 3 # 4 B 130 PHE B 29 PHE~? 13.95 OXT ACY B 401 B 223 ASP B 56 ASP~? 21.60 OXT ACY B 401 B 265 LYS B 81 LYS.? 16.99 O4 PO4 A 302 coo 7.48 54.94 99.62 7.67 52.27 100.42 26.40 10.51 1.39 26.72 8.16 2.92 coo 10.43 61.66 91.81 9.80 60.04 90.61 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 5.43 58.06 80.08 8.57 53.00 79.37 29.08 3.04 -17.20 34.50 4.57 -18.92 ULMN 3 1ax4_c05 TRYPTOPHANASE user 5 3 # 5 B 130 PHE C 5 PHE^? 19.41 OXT ACY B 401 B 223 ASP C 32 ASP.? 15.02 O1 PO4 A 302 B 265 LYS C 66 LYS~? 17.26 CH3 ACY C 404 coo 7.48 54.94 99.62 7.67 52.27 100.42 31.13 28.40 -14.21 32.73 26.13 -13.97 coo 10.43 61.66 91.81 9.80 60.04 90.61 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 5.43 58.06 80.08 8.57 53.00 79.37 20.24 35.37 -30.72 23.66 34.59 -34.92 ULMN 3 1ax4_c05 TRYPTOPHANASE user 6 3 # 6 B 130 PHE C 29 PHE~? 13.92 O3 GOL A 501 B 223 ASP C 56 ASP~? 22.04 O3 GOL A 501 B 265 LYS C 81 LYS.? 25.54 OXT ACY B 401 coo 7.48 54.94 99.62 7.67 52.27 100.42 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 10.43 61.66 91.81 9.80 60.04 90.61 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 5.43 58.06 80.08 8.57 53.00 79.37 31.22 35.67 -10.67 31.64 40.37 -10.68 ULMN 3 1ax4_c05 TRYPTOPHANASE user 7 3 # 7 B 130 PHE D 5 PHE^? 15.02 O ACY C 404 B 223 ASP D 32 ASP.? 14.33 CH3 ACY B 403 B 265 LYS D 66 LYS~? 18.65 CH3 ACY B 401 coo 7.48 54.94 99.62 7.67 52.27 100.42 4.10 29.83 -12.63 2.45 27.56 -12.72 coo 10.43 61.66 91.81 9.80 60.04 90.61 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 5.43 58.06 80.08 8.57 53.00 79.37 15.33 36.81 3.59 11.66 36.34 7.56 ULMN 3 1ax4_c05 TRYPTOPHANASE user 8 3 # 8 B 130 PHE D 29 PHE~? 13.75 O ACY B 401 B 223 ASP D 56 ASP~? 19.96 CH3 ACY B 403 B 265 LYS D 81 LYS.? 19.75 O ACY C 404 coo 7.48 54.94 99.62 7.67 52.27 100.42 9.63 30.41 1.98 9.49 32.86 3.31 coo 10.43 61.66 91.81 9.80 60.04 90.61 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 5.43 58.06 80.08 8.57 53.00 79.37 4.59 37.20 -16.29 4.16 41.27 -17.63 1ax4_c05 source 1ax4 TRYPTOPHANASE : 8 hits 1ax4_c05 naa= 3 ULMN 3 1ax4_c06 TRYPTOPHANASE user 1 3 # 1 C 130 PHE A 5 PHE^? 16.17 CH3 ACY B 403 C 223 ASP A 32 ASP.? 10.92 O ACY A 402 C 265 LYS A 66 LYS~? 16.67 O ACY A 402 coo -6.55 73.45 23.60 -6.77 71.48 21.66 2.94 11.68 -11.76 1.35 13.95 -11.61 coo -9.52 75.74 33.62 -8.85 73.74 33.93 3.75 12.55 -21.98 2.34 11.90 -23.40 coo -4.44 67.20 42.32 -7.50 62.41 40.49 11.69 2.61 -28.49 7.34 2.61 -31.70 ULMN 3 1ax4_c06 TRYPTOPHANASE user 2 3 # 2 C 130 PHE A 29 PHE~? 10.35 O ACY A 402 C 223 ASP A 56 ASP~? 17.92 O ACY A 402 C 265 LYS A 81 LYS.? 21.98 O ACY B 403 coo -6.55 73.45 23.60 -6.77 71.48 21.66 6.52 10.08 -26.44 5.88 7.60 -27.67 coo -9.52 75.74 33.62 -8.85 73.74 33.93 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -4.44 67.20 42.32 -7.50 62.41 40.49 3.08 5.09 -7.58 2.00 0.68 -7.21 ULMN 3 1ax4_c06 TRYPTOPHANASE user 3 3 # 3 C 130 PHE B 5 PHE^? 15.02 O4 PO4 A 302 C 223 ASP B 32 ASP.? 15.94 OXT ACY B 401 C 265 LYS B 66 LYS~? 18.61 CH3 ACY B 401 coo -6.55 73.45 23.60 -6.77 71.48 21.66 30.24 10.18 -13.46 31.99 12.32 -13.93 coo -9.52 75.74 33.62 -8.85 73.74 33.93 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -4.44 67.20 42.32 -7.50 62.41 40.49 20.89 3.87 3.84 24.86 4.42 7.52 ULMN 3 1ax4_c06 TRYPTOPHANASE user 4 3 # 4 C 130 PHE B 29 PHE~? 13.95 OXT ACY B 401 C 223 ASP B 56 ASP~? 21.60 OXT ACY B 401 C 265 LYS B 81 LYS.? 16.99 O4 PO4 A 302 coo -6.55 73.45 23.60 -6.77 71.48 21.66 26.40 10.51 1.39 26.72 8.16 2.92 coo -9.52 75.74 33.62 -8.85 73.74 33.93 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -4.44 67.20 42.32 -7.50 62.41 40.49 29.08 3.04 -17.20 34.50 4.57 -18.92 ULMN 3 1ax4_c06 TRYPTOPHANASE user 5 3 # 5 C 130 PHE C 5 PHE^? 19.41 OXT ACY B 401 C 223 ASP C 32 ASP.? 15.02 O1 PO4 A 302 C 265 LYS C 66 LYS~? 17.26 CH3 ACY C 404 coo -6.55 73.45 23.60 -6.77 71.48 21.66 31.13 28.40 -14.21 32.73 26.13 -13.97 coo -9.52 75.74 33.62 -8.85 73.74 33.93 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -4.44 67.20 42.32 -7.50 62.41 40.49 20.24 35.37 -30.72 23.66 34.59 -34.92 ULMN 3 1ax4_c06 TRYPTOPHANASE user 6 3 # 6 C 130 PHE C 29 PHE~? 13.92 O3 GOL A 501 C 223 ASP C 56 ASP~? 22.04 O3 GOL A 501 C 265 LYS C 81 LYS.? 25.54 OXT ACY B 401 coo -6.55 73.45 23.60 -6.77 71.48 21.66 25.57 28.47 -28.89 26.01 30.76 -30.46 coo -9.52 75.74 33.62 -8.85 73.74 33.93 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -4.44 67.20 42.32 -7.50 62.41 40.49 31.22 35.67 -10.67 31.64 40.37 -10.68 ULMN 3 1ax4_c06 TRYPTOPHANASE user 7 3 # 7 C 130 PHE D 5 PHE^? 15.02 O ACY C 404 C 223 ASP D 32 ASP.? 14.33 CH3 ACY B 403 C 265 LYS D 66 LYS~? 18.65 CH3 ACY B 401 coo -6.55 73.45 23.60 -6.77 71.48 21.66 4.10 29.83 -12.63 2.45 27.56 -12.72 coo -9.52 75.74 33.62 -8.85 73.74 33.93 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -4.44 67.20 42.32 -7.50 62.41 40.49 15.33 36.81 3.59 11.66 36.34 7.56 ULMN 3 1ax4_c06 TRYPTOPHANASE user 8 3 # 8 C 130 PHE D 29 PHE~? 13.75 O ACY B 401 C 223 ASP D 56 ASP~? 19.96 CH3 ACY B 403 C 265 LYS D 81 LYS.? 19.75 O ACY C 404 coo -6.55 73.45 23.60 -6.77 71.48 21.66 9.63 30.41 1.98 9.49 32.86 3.31 coo -9.52 75.74 33.62 -8.85 73.74 33.93 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -4.44 67.20 42.32 -7.50 62.41 40.49 4.59 37.20 -16.29 4.16 41.27 -17.63 1ax4_c06 source 1ax4 TRYPTOPHANASE : 8 hits 1ax4_c06 naa= 3 ULMN 3 1ax4_c07 TRYPTOPHANASE user 1 3 # 1 D 130 PHE A 5 PHE^? 16.17 CH3 ACY B 403 D 223 ASP A 32 ASP.? 10.92 O ACY A 402 D 265 LYS A 66 LYS~? 16.67 O ACY A 402 coo -38.60 55.38 52.70 -40.06 57.72 53.04 2.94 11.68 -11.76 1.35 13.95 -11.61 coo -29.46 51.67 48.51 -28.63 53.31 49.56 3.75 12.55 -21.98 2.34 11.90 -23.40 coo -18.87 56.53 54.79 -19.47 62.22 53.03 11.69 2.61 -28.49 7.34 2.61 -31.70 ULMN 3 1ax4_c07 TRYPTOPHANASE user 2 3 # 2 D 130 PHE A 29 PHE~? 10.35 O ACY A 402 D 223 ASP A 56 ASP~? 17.92 O ACY A 402 D 265 LYS A 81 LYS.? 21.98 O ACY B 403 coo -38.60 55.38 52.70 -40.06 57.72 53.04 6.52 10.08 -26.44 5.88 7.60 -27.67 coo -29.46 51.67 48.51 -28.63 53.31 49.56 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -18.87 56.53 54.79 -19.47 62.22 53.03 3.08 5.09 -7.58 2.00 0.68 -7.21 ULMN 3 1ax4_c07 TRYPTOPHANASE user 3 3 # 3 D 130 PHE B 5 PHE^? 15.02 O4 PO4 A 302 D 223 ASP B 32 ASP.? 15.94 OXT ACY B 401 D 265 LYS B 66 LYS~? 18.61 CH3 ACY B 401 coo -38.60 55.38 52.70 -40.06 57.72 53.04 30.24 10.18 -13.46 31.99 12.32 -13.93 coo -29.46 51.67 48.51 -28.63 53.31 49.56 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -18.87 56.53 54.79 -19.47 62.22 53.03 20.89 3.87 3.84 24.86 4.42 7.52 ULMN 3 1ax4_c07 TRYPTOPHANASE user 4 3 # 4 D 130 PHE B 29 PHE~? 13.95 OXT ACY B 401 D 223 ASP B 56 ASP~? 21.60 OXT ACY B 401 D 265 LYS B 81 LYS.? 16.99 O4 PO4 A 302 coo -38.60 55.38 52.70 -40.06 57.72 53.04 26.40 10.51 1.39 26.72 8.16 2.92 coo -29.46 51.67 48.51 -28.63 53.31 49.56 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -18.87 56.53 54.79 -19.47 62.22 53.03 29.08 3.04 -17.20 34.50 4.57 -18.92 ULMN 3 1ax4_c07 TRYPTOPHANASE user 5 3 # 5 D 130 PHE C 5 PHE^? 19.41 OXT ACY B 401 D 223 ASP C 32 ASP.? 15.02 O1 PO4 A 302 D 265 LYS C 66 LYS~? 17.26 CH3 ACY C 404 coo -38.60 55.38 52.70 -40.06 57.72 53.04 31.13 28.40 -14.21 32.73 26.13 -13.97 coo -29.46 51.67 48.51 -28.63 53.31 49.56 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -18.87 56.53 54.79 -19.47 62.22 53.03 20.24 35.37 -30.72 23.66 34.59 -34.92 ULMN 3 1ax4_c07 TRYPTOPHANASE user 6 3 # 6 D 130 PHE C 29 PHE~? 13.92 O3 GOL A 501 D 223 ASP C 56 ASP~? 22.04 O3 GOL A 501 D 265 LYS C 81 LYS.? 25.54 OXT ACY B 401 coo -38.60 55.38 52.70 -40.06 57.72 53.04 25.57 28.47 -28.89 26.01 30.76 -30.46 coo -29.46 51.67 48.51 -28.63 53.31 49.56 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -18.87 56.53 54.79 -19.47 62.22 53.03 31.22 35.67 -10.67 31.64 40.37 -10.68 ULMN 3 1ax4_c07 TRYPTOPHANASE user 7 3 # 7 D 130 PHE D 5 PHE^? 15.02 O ACY C 404 D 223 ASP D 32 ASP.? 14.33 CH3 ACY B 403 D 265 LYS D 66 LYS~? 18.65 CH3 ACY B 401 coo -38.60 55.38 52.70 -40.06 57.72 53.04 4.10 29.83 -12.63 2.45 27.56 -12.72 coo -29.46 51.67 48.51 -28.63 53.31 49.56 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -18.87 56.53 54.79 -19.47 62.22 53.03 15.33 36.81 3.59 11.66 36.34 7.56 ULMN 3 1ax4_c07 TRYPTOPHANASE user 8 3 # 8 D 130 PHE D 29 PHE~? 13.75 O ACY B 401 D 223 ASP D 56 ASP~? 19.96 CH3 ACY B 403 D 265 LYS D 81 LYS.? 19.75 O ACY C 404 coo -38.60 55.38 52.70 -40.06 57.72 53.04 9.63 30.41 1.98 9.49 32.86 3.31 coo -29.46 51.67 48.51 -28.63 53.31 49.56 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -18.87 56.53 54.79 -19.47 62.22 53.03 4.59 37.20 -16.29 4.16 41.27 -17.63 1ax4_c07 source 1ax4 TRYPTOPHANASE : 8 hits 1ax4_c07 naa= 3 ULMN 3 1b2m_c01 5'-R(*GP*(CH2)U)-3' user 1 3 # 1 B 40 HIS B 27 HIS~? 8.91 CH3 ACY B 401 B 58 GLU B 24 GLU~? 12.08 CH3 ACY B 401 B 92 HIS D 27 HIS~? 8.84 CH3 ACY B 401 coo 10.74 36.24 16.20 9.81 34.52 16.97 24.22 18.07 5.55 25.63 19.33 6.45 coo 5.02 36.40 17.74 5.55 34.41 17.37 18.70 14.65 8.90 18.04 13.62 10.65 coo 0.68 29.04 20.43 2.46 29.56 19.46 12.53 22.86 5.89 11.39 21.93 7.39 ULMN 3 1b2m_c01 5'-R(*GP*(CH2)U)-3' user 2 3 # 2 B 40 HIS D 27 HIS~? 8.84 CH3 ACY B 401 B 58 GLU D 24 GLU~? 11.43 CH3 ACY B 401 B 92 HIS B 27 HIS~? 8.91 CH3 ACY B 401 coo 10.74 36.24 16.20 9.81 34.52 16.97 12.53 22.86 5.89 11.39 21.93 7.39 coo 5.02 36.40 17.74 5.55 34.41 17.37 18.15 25.86 8.28 19.10 26.69 9.97 coo 0.68 29.04 20.43 2.46 29.56 19.46 24.22 18.07 5.55 25.63 19.33 6.45 1b2m_c01 source 1b2m 5'-R(*GP*(CH2)U)-3' : 2 hits 1b2m_c01 naa= 3 ULMN 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 # 1 A 109 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 182 GLU C 2 GLU.? 25.10 O1 PO4 A 302 A 286 ASN C 57 ASN~? 25.85 CH3 ACY C 404 coo 26.03 44.66 108.90 25.67 42.61 108.82 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 18.06 44.02 105.38 18.08 45.37 107.03 40.20 31.59 -19.52 40.69 30.01 -20.87 coo 25.47 38.28 112.06 27.26 39.30 111.54 32.80 38.18 -23.48 33.37 38.78 -21.52 ULMN 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 2 3 # 2 A 109 ASP D 14 ASP.? 10.51 OXT ACY B 401 A 182 GLU B 31 GLU.? 14.62 OXT ACY B 401 A 286 ASN D 45 ASN.? 18.79 OXT ACY B 401 coo 26.03 44.66 108.90 25.67 42.61 108.82 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 18.06 44.02 105.38 18.08 45.37 107.03 33.31 16.38 -0.70 33.25 18.46 -1.14 coo 25.47 38.28 112.06 27.26 39.30 111.54 34.52 27.70 -3.27 36.36 26.60 -3.23 ULMN 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 3 3 # 3 A 109 ASP D 14 ASP.? 10.51 OXT ACY B 401 A 182 GLU D 16 GLU~? 15.82 CH3 ACY B 401 A 286 ASN D 45 ASN.? 18.79 OXT ACY B 401 coo 26.03 44.66 108.90 25.67 42.61 108.82 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 18.06 44.02 105.38 18.08 45.37 107.03 29.82 25.98 8.07 29.78 25.08 10.01 coo 25.47 38.28 112.06 27.26 39.30 111.54 34.52 27.70 -3.27 36.36 26.60 -3.23 ULMN 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 4 3 # 4 A 109 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 182 GLU D 2 GLU.? 23.79 O ACY C 404 A 286 ASN D 57 ASN~? 23.97 CH3 ACY B 403 coo 26.03 44.66 108.90 25.67 42.61 108.82 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 18.06 44.02 105.38 18.08 45.37 107.03 -6.17 33.52 -9.55 -6.78 32.15 -11.04 coo 25.47 38.28 112.06 27.26 39.30 111.54 2.35 39.89 -3.73 2.59 40.70 -5.67 1b57_c00 source 1b57 FRUCTOSE-BISPHOSPHATE ALDOLASE II : 4 hits 1b57_c00 naa= 3 ULMN 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 # 1 B 109 ASP C 56 ASP~? 22.04 O3 GOL A 501 B 182 GLU C 2 GLU.? 25.10 O1 PO4 A 302 B 286 ASN C 57 ASN~? 25.85 CH3 ACY C 404 coo 13.82 69.26 132.27 11.87 70.14 132.51 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 8.74 63.05 136.42 9.87 62.19 134.79 40.20 31.59 -19.52 40.69 30.01 -20.87 coo 8.26 72.60 129.22 10.14 73.45 129.80 32.80 38.18 -23.48 33.37 38.78 -21.52 1b57_c01 source 1b57 FRUCTOSE-BISPHOSPHATE ALDOLASE II : 1 hits 1b57_c01 naa= 3 ULMN 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 1 3 # 1 A 18 HIS C 27 HIS~? 7.34 O1 PO4 A 302 A 91 ARG C 36 ARG^? -3.18 C2 GOL A 501s A 129 SER C 30 SER.? 7.40 O1 PO4 A 302 coo 24.39 47.01 49.70 26.42 47.04 49.21 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 25.98 44.20 42.23 28.53 42.98 43.43 18.67 22.17 -22.86 17.03 22.41 -25.46 coo 30.00 49.76 45.68 28.73 48.72 47.47 25.81 22.61 -26.89 26.10 20.85 -28.49 ULMN 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 2 3 # 2 A 18 HIS D 27 HIS~? 8.84 CH3 ACY B 401 A 91 ARG D 36 ARG^? 3.12 O ACY B 401s A 129 SER D 30 SER.? 8.07 CH3 ACY B 403 coo 24.39 47.01 49.70 26.42 47.04 49.21 12.53 22.86 5.89 11.39 21.93 7.39 coo 25.98 44.20 42.23 28.53 42.98 43.43 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 30.00 49.76 45.68 28.73 48.72 47.47 8.81 24.50 0.42 8.52 22.82 2.10 1b6t_c00 source 1b6t PHOSPHOPANTETHEINE ADENYLYLTRANSFERASE : 2 hits 1b6t_c00 naa= 3 ULMN 3 1b6t_c01 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 1 3 # 1 B 18 HIS A 27 HIS~? -3.83 OXT ACY A 402s B 91 ARG A 36 ARG^? 3.17 O2 GOL A 501s B 129 SER A 30 SER.? -4.23 CH3 ACY A 402s coo 18.19 17.03 40.71 18.55 17.18 38.64 9.52 16.92 -31.25 8.29 18.47 -31.94 coo 25.60 21.10 38.54 23.57 20.93 36.25 14.40 16.71 -22.33 15.78 16.00 -25.01 coo 21.33 14.29 34.62 19.25 14.88 35.71 6.58 16.18 -25.41 6.11 17.58 -27.30 ULMN 3 1b6t_c01 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 2 3 # 2 B 18 HIS B 27 HIS~? 8.91 CH3 ACY B 401 B 91 ARG B 36 ARG^? 3.17 C ACY B 401s B 129 SER B 30 SER.? 9.89 OXT ACY B 401 coo 18.19 17.03 40.71 18.55 17.18 38.64 24.22 18.07 5.55 25.63 19.33 6.45 coo 25.60 21.10 38.54 23.57 20.93 36.25 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 21.33 14.29 34.62 19.25 14.88 35.71 27.11 16.51 -0.32 27.88 17.99 1.39 ULMN 3 1b6t_c01 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 3 3 # 3 B 18 HIS C 27 HIS~? 7.34 O1 PO4 A 302 B 91 ARG C 36 ARG^? -3.18 C2 GOL A 501s B 129 SER C 30 SER.? 7.40 O1 PO4 A 302 coo 18.19 17.03 40.71 18.55 17.18 38.64 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 25.60 21.10 38.54 23.57 20.93 36.25 18.67 22.17 -22.86 17.03 22.41 -25.46 coo 21.33 14.29 34.62 19.25 14.88 35.71 25.81 22.61 -26.89 26.10 20.85 -28.49 ULMN 3 1b6t_c01 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 4 3 # 4 B 18 HIS D 27 HIS~? 8.84 CH3 ACY B 401 B 91 ARG D 36 ARG^? 3.12 O ACY B 401s B 129 SER D 30 SER.? 8.07 CH3 ACY B 403 coo 18.19 17.03 40.71 18.55 17.18 38.64 12.53 22.86 5.89 11.39 21.93 7.39 coo 25.60 21.10 38.54 23.57 20.93 36.25 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 21.33 14.29 34.62 19.25 14.88 35.71 8.81 24.50 0.42 8.52 22.82 2.10 1b6t_c01 source 1b6t PHOSPHOPANTETHEINE ADENYLYLTRANSFERASE : 4 hits 1b6t_c01 naa= 3 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 1 3 # 1 A 88 PHE A 29 PHE~? 10.35 O ACY A 402 A 159 ASP A 58 ASP~? 21.11 O ACY A 402 A 188 LYS A 54 LYS.? 19.07 O ACY A 402 coo 13.91 34.58 14.67 12.95 36.00 12.47 6.52 10.08 -26.44 5.88 7.60 -27.67 coo 20.97 28.40 16.26 20.19 30.15 15.34 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 22.55 41.65 15.60 18.92 37.20 14.63 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 2 3 # 2 A 88 PHE A 29 PHE~? 10.35 O ACY A 402 A 159 ASP A 58 ASP~? 21.11 O ACY A 402 A 188 LYS A 66 LYS~? 16.67 O ACY A 402 coo 13.91 34.58 14.67 12.95 36.00 12.47 6.52 10.08 -26.44 5.88 7.60 -27.67 coo 20.97 28.40 16.26 20.19 30.15 15.34 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 22.55 41.65 15.60 18.92 37.20 14.63 11.69 2.61 -28.49 7.34 2.61 -31.70 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 3 3 # 3 A 88 PHE B 29 PHE~? 13.95 OXT ACY B 401 A 159 ASP B 58 ASP~? 24.69 OXT ACY B 401 A 188 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo 13.91 34.58 14.67 12.95 36.00 12.47 26.40 10.51 1.39 26.72 8.16 2.92 coo 20.97 28.40 16.26 20.19 30.15 15.34 33.22 2.96 0.74 34.69 1.59 1.17 coo 22.55 41.65 15.60 18.92 37.20 14.63 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 4 3 # 4 A 88 PHE C 29 PHE~? 13.92 O3 GOL A 501 A 159 ASP C 58 ASP~? 25.07 O3 GOL A 501 A 188 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo 13.91 34.58 14.67 12.95 36.00 12.47 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 20.97 28.40 16.26 20.19 30.15 15.34 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 22.55 41.65 15.60 18.92 37.20 14.63 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 5 3 # 5 A 88 PHE D 29 PHE~? 13.75 O ACY B 401 A 159 ASP D 58 ASP~? 23.91 CH3 ACY B 403 A 188 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 13.91 34.58 14.67 12.95 36.00 12.47 9.63 30.41 1.98 9.49 32.86 3.31 coo 20.97 28.40 16.26 20.19 30.15 15.34 2.43 37.89 1.30 0.84 39.23 1.50 coo 22.55 41.65 15.60 18.92 37.20 14.63 3.89 29.44 -7.86 -1.70 27.89 -10.01 1b9h_c02 source 1b9h 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHASE : 5 hits 1b9h_c02 naa= 3 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 1 3 # 1 A 382 ARG B 42 ARG~? 8.81 CH3 ACY B 403 A 451 GLU B 44 GLU~? 18.30 CH3 ACY B 403 A 540 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo 79.04 80.20 80.81 79.58 81.40 83.63 2.83 20.50 -3.25 5.45 21.98 -3.93 coo 81.34 87.29 87.22 82.36 86.09 88.61 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 79.94 80.46 88.84 81.11 81.36 87.27 -1.81 16.10 -9.11 -1.93 15.47 -11.12 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 2 3 # 2 A 382 ARG B 74 ARG^? 16.09 O ACY B 403 A 451 GLU B 44 GLU~? 18.30 CH3 ACY B 403 A 540 GLU B 13 GLU^? 15.77 O ACY B 403 coo 79.04 80.20 80.81 79.58 81.40 83.63 8.52 3.16 -3.88 8.54 3.61 -6.93 coo 81.34 87.29 87.22 82.36 86.09 88.61 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 79.94 80.46 88.84 81.11 81.36 87.27 4.71 8.41 0.32 2.63 9.02 0.18 1bhg_c04 source 1bhg BETA-GLUCURONIDASE : 2 hits 1bhg_c04 naa= 3 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 1 3 # 1 B 382 ARG B 42 ARG~? 8.81 CH3 ACY B 403 B 451 GLU B 44 GLU~? 18.30 CH3 ACY B 403 B 540 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo 82.21 41.07 119.14 83.95 40.66 116.59 2.83 20.50 -3.25 5.45 21.98 -3.93 coo 86.52 35.28 112.74 87.08 36.38 110.99 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 83.38 41.19 112.55 85.47 40.59 112.72 -1.81 16.10 -9.11 -1.93 15.47 -11.12 1bhg_c05 source 1bhg BETA-GLUCURONIDASE : 1 hits 1bhg_c05 naa= 3 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 1 3 # 1 A 109 PHE A 50 PHE.? 12.01 O4 PO4 A 302 A 205 ASP A 14 ASP.? 7.78 O4 PO4 A 302 A 236 LYS B 81 LYS.? 16.99 O4 PO4 A 302 coo 4.14 2.10 36.34 6.69 3.08 36.92 17.64 12.86 -14.35 19.94 12.07 -12.91 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 29.08 3.04 -17.20 34.50 4.57 -18.92 1bs0_c01 source 1bs0 8-AMINO-7-OXONANOATE SYNTHASE : 1 hits 1bs0_c01 naa= 3 ULMN 3 1bvz_c08 ALPHA-AMYLASE II user 1 3 # 1 A 325 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 354 GLU B 31 GLU.? 14.62 OXT ACY B 401 A 421 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 31.05 49.37 64.51 31.97 51.11 63.85 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 29.07 50.42 58.36 29.02 52.18 59.49 33.31 16.38 -0.70 33.25 18.46 -1.14 coo 30.82 59.76 58.47 31.12 59.02 60.40 29.91 25.87 -1.90 28.44 24.29 -2.10 1bvz_c08 source 1bvz ALPHA-AMYLASE II : 1 hits 1bvz_c08 naa= 3 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 1 3 # 1 B 325 ASP B 32 ASP.? 15.94 OXT ACY B 401 B 354 GLU B 31 GLU.? 14.62 OXT ACY B 401 B 421 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 25.90 8.19 53.87 25.36 6.97 52.29 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 27.87 10.66 47.95 27.82 8.60 48.27 33.31 16.38 -0.70 33.25 18.46 -1.14 coo 26.02 1.87 43.38 25.90 1.97 45.49 29.91 25.87 -1.90 28.44 24.29 -2.10 1bvz_c09 source 1bvz ALPHA-AMYLASE II : 1 hits 1bvz_c09 naa= 3 ULMN 3 1bwl_c01 NADPH DEHYDROGENASE 1 user 1 3 # 1 191 ASN B 23 ASN~? 4.38 CH3 ACY B 401 194 HIS D 27 HIS~? 8.84 CH3 ACY B 401 196 TYR B 19 TYR~? 7.66 CH3 ACY B 403 coo 40.94 71.26 25.74 40.29 70.59 23.82 16.95 16.62 4.13 15.59 17.22 2.56 coo 38.86 67.47 19.31 37.78 65.73 19.79 12.53 22.86 5.89 11.39 21.93 7.39 coo 41.10 73.64 20.13 38.52 73.39 19.02 10.24 15.60 3.03 8.77 16.10 0.69 ULMN 3 1bwl_c01 NADPH DEHYDROGENASE 1 user 2 3 # 2 191 ASN D 23 ASN~? 4.18 CH3 ACY B 401 194 HIS B 27 HIS~? 8.91 CH3 ACY B 401 196 TYR D 19 TYR~? 6.50 OXT ACY B 401 coo 40.94 71.26 25.74 40.29 70.59 23.82 19.37 24.14 3.44 20.48 23.43 1.80 coo 38.86 67.47 19.31 37.78 65.73 19.79 24.22 18.07 5.55 25.63 19.33 6.45 coo 41.10 73.64 20.13 38.52 73.39 19.02 24.45 24.76 1.05 22.95 23.32 -0.81 1bwl_c01 source 1bwl NADPH DEHYDROGENASE 1 : 2 hits 1bwl_c01 naa= 3 ULMN 3 1c54_c00 RIBONUCLEASE SA user 1 3 # 1 A 54 GLU A 16 GLU~? 11.52 O1 PO4 A 302 A 65 ARG A 20 ARG~? 11.30 O1 PO4 A 302 A 85 HIS C 27 HIS~? 7.34 O1 PO4 A 302 coo -3.75 5.08 -16.45 -4.49 7.03 -16.67 27.41 13.54 -34.49 28.46 13.63 -36.35 coo -11.31 0.89 -21.51 -13.74 2.37 -20.15 19.43 13.50 -36.40 19.41 10.58 -37.42 coo -11.98 -0.40 -12.41 -12.65 1.37 -13.15 22.05 20.86 -32.07 23.10 19.40 -33.17 1c54_c00 source 1c54 RIBONUCLEASE SA : 1 hits 1c54_c00 naa= 3 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 1 3 # 1 71 ARG B 36 ARG^? 3.17 C ACY B 401s 127 ARG D 36 ARG^? 3.12 O ACY B 401s 270 GLU D 24 GLU~? 11.43 CH3 ACY B 401 coo -0.83 25.63 1.57 0.97 28.05 0.90 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 15.90 23.27 -3.56 17.50 23.47 -0.92 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 18.15 25.86 8.28 19.10 26.69 9.97 1cbx_c01 source 1cbx CARBOXYPEPTIDASE A (E.C.3.4.17.1) COMPLEX WITH: 1 hits 1cbx_c01 naa= 3 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP A 58 ASP~? 21.11 O ACY A 402 264 GLU B 43 GLU~? 18.31 CH3 ACY B 403 328 ASP A 32 ASP.? 10.92 O ACY A 402 coo 45.62 80.42 43.69 45.65 82.01 45.07 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 59.69 92.71 39.85 58.53 92.03 41.47 -1.81 16.10 -9.11 -1.93 15.47 -11.12 coo 45.39 90.72 40.63 45.07 89.14 41.90 3.75 12.55 -21.98 2.34 11.90 -23.40 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 # 2 229 ASP A 58 ASP~? 21.11 O ACY A 402 264 GLU B 44 GLU~? 18.30 CH3 ACY B 403 328 ASP A 32 ASP.? 10.92 O ACY A 402 coo 45.62 80.42 43.69 45.65 82.01 45.07 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 59.69 92.71 39.85 58.53 92.03 41.47 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 45.39 90.72 40.63 45.07 89.14 41.90 3.75 12.55 -21.98 2.34 11.90 -23.40 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 # 3 229 ASP B 58 ASP~? 24.69 OXT ACY B 401 264 GLU A 43 GLU~? 17.21 O4 PO4 A 302 328 ASP B 32 ASP.? 15.94 OXT ACY B 401 coo 45.62 80.42 43.69 45.65 82.01 45.07 33.22 2.96 0.74 34.69 1.59 1.17 coo 59.69 92.71 39.85 58.53 92.03 41.47 34.86 12.61 -16.78 35.59 13.22 -14.90 coo 45.39 90.72 40.63 45.07 89.14 41.90 30.64 12.55 -3.88 32.46 12.19 -2.91 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 4 3 # 4 229 ASP B 58 ASP~? 24.69 OXT ACY B 401 264 GLU A 44 GLU~? 15.81 O4 PO4 A 302 328 ASP B 32 ASP.? 15.94 OXT ACY B 401 coo 45.62 80.42 43.69 45.65 82.01 45.07 33.22 2.96 0.74 34.69 1.59 1.17 coo 59.69 92.71 39.85 58.53 92.03 41.47 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 45.39 90.72 40.63 45.07 89.14 41.90 30.64 12.55 -3.88 32.46 12.19 -2.91 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 5 3 # 5 229 ASP C 56 ASP~? 22.04 O3 GOL A 501 264 GLU C 24 GLU~? 11.35 C3 GOL A 501 328 ASP C 32 ASP.? 15.02 O1 PO4 A 302 coo 45.62 80.42 43.69 45.65 82.01 45.07 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 59.69 92.71 39.85 58.53 92.03 41.47 18.84 25.84 -35.18 19.75 24.32 -36.38 coo 45.39 90.72 40.63 45.07 89.14 41.90 29.38 26.56 -24.17 30.67 26.95 -25.70 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 6 3 # 6 229 ASP C 58 ASP~? 25.07 O3 GOL A 501 264 GLU C 24 GLU~? 11.35 C3 GOL A 501 328 ASP C 32 ASP.? 15.02 O1 PO4 A 302 coo 45.62 80.42 43.69 45.65 82.01 45.07 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 59.69 92.71 39.85 58.53 92.03 41.47 18.84 25.84 -35.18 19.75 24.32 -36.38 coo 45.39 90.72 40.63 45.07 89.14 41.90 29.38 26.56 -24.17 30.67 26.95 -25.70 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 7 3 # 7 229 ASP C 58 ASP~? 25.07 O3 GOL A 501 264 GLU D 43 GLU~? 22.18 O4 PO4 A 302 328 ASP C 32 ASP.? 15.02 O1 PO4 A 302 coo 45.62 80.42 43.69 45.65 82.01 45.07 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 59.69 92.71 39.85 58.53 92.03 41.47 36.87 25.85 -11.48 36.80 25.51 -13.56 coo 45.39 90.72 40.63 45.07 89.14 41.90 29.38 26.56 -24.17 30.67 26.95 -25.70 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 8 3 # 8 229 ASP C 58 ASP~? 25.07 O3 GOL A 501 264 GLU D 44 GLU~? 21.69 OXT ACY B 401 328 ASP C 32 ASP.? 15.02 O1 PO4 A 302 coo 45.62 80.42 43.69 45.65 82.01 45.07 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 59.69 92.71 39.85 58.53 92.03 41.47 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 45.39 90.72 40.63 45.07 89.14 41.90 29.38 26.56 -24.17 30.67 26.95 -25.70 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 9 3 # 9 229 ASP D 58 ASP~? 23.91 CH3 ACY B 403 264 GLU C 43 GLU~? 17.47 O ACY C 404 328 ASP D 32 ASP.? 14.33 CH3 ACY B 403 coo 45.62 80.42 43.69 45.65 82.01 45.07 2.43 37.89 1.30 0.84 39.23 1.50 coo 59.69 92.71 39.85 58.53 92.03 41.47 -1.82 27.43 -15.06 -1.58 27.20 -12.95 coo 45.39 90.72 40.63 45.07 89.14 41.90 4.73 28.33 -3.00 2.76 28.70 -2.23 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 10 3 # 10 229 ASP D 58 ASP~? 23.91 CH3 ACY B 403 264 GLU C 44 GLU~? 16.01 O ACY C 404 328 ASP D 32 ASP.? 14.33 CH3 ACY B 403 coo 45.62 80.42 43.69 45.65 82.01 45.07 2.43 37.89 1.30 0.84 39.23 1.50 coo 59.69 92.71 39.85 58.53 92.03 41.47 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 45.39 90.72 40.63 45.07 89.14 41.90 4.73 28.33 -3.00 2.76 28.70 -2.23 1cdg_c00 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 10 hits 1cdg_c00 naa= 3 ULMN 3 1cns_c00 CHITINASE user 1 3 # 1 A 67 GLU D 16 GLU~? 15.82 CH3 ACY B 401 A 89 GLU D 13 GLU^? 19.04 OXT ACY B 401 A 120 SER D 71 SER.? 19.92 CH3 ACY B 401 coo -24.35 9.53 67.64 -25.07 11.29 68.60 29.82 25.98 8.07 29.78 25.08 10.01 coo -31.18 6.91 75.60 -32.39 8.51 74.91 29.88 33.09 -1.63 31.17 34.65 -1.02 coo -34.73 8.57 68.21 -33.63 9.08 70.28 25.95 36.51 3.79 28.23 36.90 4.60 1cns_c00 source 1cns CHITINASE : 1 hits 1cns_c00 naa= 3 ULMN 3 1cns_c01 CHITINASE user 1 3 # 1 B 67 GLU D 16 GLU~? 15.82 CH3 ACY B 401 B 89 GLU D 13 GLU^? 19.04 OXT ACY B 401 B 120 SER D 71 SER.? 19.92 CH3 ACY B 401 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 29.82 25.98 8.07 29.78 25.08 10.01 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 29.88 33.09 -1.63 31.17 34.65 -1.02 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 25.95 36.51 3.79 28.23 36.90 4.60 1cns_c01 source 1cns CHITINASE : 1 hits 1cns_c01 naa= 3 ULMN 3 1coy_c00 CHOLESTEROL OXIDASE (E.C.1.1.3.6) COuser 1 3 # 1 361 GLU C 31 GLU.? 14.58 O1 PO4 A 302 447 HIS C 27 HIS~? 7.34 O1 PO4 A 302 485 ASN C 28 ASN~? 11.75 O3 GOL A 501 coo -7.99 19.51 30.67 -8.74 17.98 29.42 31.25 23.87 -27.43 32.95 24.08 -28.66 coo -15.81 17.12 25.99 -13.91 16.92 26.88 22.05 20.86 -32.07 23.10 19.40 -33.17 coo -13.17 13.85 30.36 -11.76 15.41 30.53 24.24 26.01 -32.95 22.97 25.58 -34.62 1coy_c00 source 1coy CHOLESTEROL OXIDASE (E.C.1.1.3.6) COMPLEX WITH: 1 hits 1coy_c00 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR A 19 TYR~? -3.51 O4 PO4 A 302s A 173 ASP A 14 ASP.? 7.78 O4 PO4 A 302 C 48 ARG A 20 ARG~? 11.30 O1 PO4 A 302 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 24.35 4.55 25.11 25.94 3.23 25.53 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 19.43 13.50 -36.40 19.41 10.58 -37.42 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 101 TYR A 19 TYR~? -3.51 O4 PO4 A 302s A 173 ASP A 14 ASP.? 7.78 O4 PO4 A 302 C 48 ARG A 36 ARG^? 3.17 O2 GOL A 501s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 24.35 4.55 25.11 25.94 3.23 25.53 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 14.40 16.71 -22.33 15.78 16.00 -25.01 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 101 TYR A 19 TYR~? -3.51 O4 PO4 A 302s A 173 ASP A 14 ASP.? 7.78 O4 PO4 A 302 C 48 ARG C 36 ARG^? -3.18 C2 GOL A 501s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 24.35 4.55 25.11 25.94 3.23 25.53 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 18.67 22.17 -22.86 17.03 22.41 -25.46 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 101 TYR B 19 TYR~? 7.66 CH3 ACY B 403 A 173 ASP B 14 ASP.? 10.32 CH3 ACY B 403 C 48 ARG B 20 ARG~? 14.42 CH3 ACY B 401 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 10.24 15.60 3.03 8.77 16.10 0.69 coo 24.35 4.55 25.11 25.94 3.23 25.53 4.45 14.77 1.64 4.87 15.68 -0.19 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 14.16 15.78 11.00 13.60 12.97 12.19 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 101 TYR B 19 TYR~? 7.66 CH3 ACY B 403 A 173 ASP B 14 ASP.? 10.32 CH3 ACY B 403 C 48 ARG B 36 ARG^? 3.17 C ACY B 401s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 10.24 15.60 3.03 8.77 16.10 0.69 coo 24.35 4.55 25.11 25.94 3.23 25.53 4.45 14.77 1.64 4.87 15.68 -0.19 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 A 101 TYR B 19 TYR~? 7.66 CH3 ACY B 403 A 173 ASP B 14 ASP.? 10.32 CH3 ACY B 403 C 48 ARG D 36 ARG^? 3.12 O ACY B 401s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 10.24 15.60 3.03 8.77 16.10 0.69 coo 24.35 4.55 25.11 25.94 3.23 25.53 4.45 14.77 1.64 4.87 15.68 -0.19 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 15.90 23.27 -3.56 17.50 23.47 -0.92 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 7 3 # 7 A 101 TYR C 19 TYR~? -3.65 O ACY C 404s A 173 ASP C 14 ASP.? 7.62 O ACY C 404 C 48 ARG A 36 ARG^? 3.17 O2 GOL A 501s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 24.35 4.55 25.11 25.94 3.23 25.53 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 14.40 16.71 -22.33 15.78 16.00 -25.01 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 8 3 # 8 A 101 TYR C 19 TYR~? -3.65 O ACY C 404s A 173 ASP C 14 ASP.? 7.62 O ACY C 404 C 48 ARG C 20 ARG~? 11.83 CH3 ACY C 404 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 24.35 4.55 25.11 25.94 3.23 25.53 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 11.69 24.38 -36.69 11.38 27.15 -38.05 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 # 9 A 101 TYR C 19 TYR~? -3.65 O ACY C 404s A 173 ASP C 14 ASP.? 7.62 O ACY C 404 C 48 ARG C 36 ARG^? -3.18 C2 GOL A 501s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 24.35 4.55 25.11 25.94 3.23 25.53 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 18.67 22.17 -22.86 17.03 22.41 -25.46 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 10 3 # 10 A 101 TYR D 19 TYR~? 6.50 OXT ACY B 401 A 173 ASP D 14 ASP.? 10.51 OXT ACY B 401 C 48 ARG B 36 ARG^? 3.17 C ACY B 401s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 24.45 24.76 1.05 22.95 23.32 -0.81 coo 24.35 4.55 25.11 25.94 3.23 25.53 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 11 3 # 11 A 101 TYR D 19 TYR~? 6.50 OXT ACY B 401 A 173 ASP D 14 ASP.? 10.51 OXT ACY B 401 C 48 ARG D 20 ARG~? 14.11 CH3 ACY B 401 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 24.45 24.76 1.05 22.95 23.32 -0.81 coo 24.35 4.55 25.11 25.94 3.23 25.53 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 23.40 25.12 9.78 26.24 26.16 10.42 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 12 3 # 12 A 101 TYR D 19 TYR~? 6.50 OXT ACY B 401 A 173 ASP D 14 ASP.? 10.51 OXT ACY B 401 C 48 ARG D 36 ARG^? 3.12 O ACY B 401s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 24.45 24.76 1.05 22.95 23.32 -0.81 coo 24.35 4.55 25.11 25.94 3.23 25.53 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 15.90 23.27 -3.56 17.50 23.47 -0.92 1cs1_c00 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 12 hits 1cs1_c00 naa= 3 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 48 ARG A 20 ARG~? 11.30 O1 PO4 A 302 C 101 TYR A 19 TYR~? -3.51 O4 PO4 A 302s C 173 ASP A 14 ASP.? 7.78 O4 PO4 A 302 coo 32.27 5.62 48.15 31.93 6.48 51.06 19.43 13.50 -36.40 19.41 10.58 -37.42 coo 29.64 3.64 57.39 31.22 5.14 55.65 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 28.88 11.61 -26.71 29.05 13.35 -27.94 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 48 ARG A 36 ARG^? 3.17 O2 GOL A 501s C 101 TYR A 19 TYR~? -3.51 O4 PO4 A 302s C 173 ASP A 14 ASP.? 7.78 O4 PO4 A 302 coo 32.27 5.62 48.15 31.93 6.48 51.06 14.40 16.71 -22.33 15.78 16.00 -25.01 coo 29.64 3.64 57.39 31.22 5.14 55.65 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 28.88 11.61 -26.71 29.05 13.35 -27.94 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 48 ARG A 36 ARG^? 3.17 O2 GOL A 501s C 101 TYR C 19 TYR~? -3.65 O ACY C 404s C 173 ASP C 14 ASP.? 7.62 O ACY C 404 coo 32.27 5.62 48.15 31.93 6.48 51.06 14.40 16.71 -22.33 15.78 16.00 -25.01 coo 29.64 3.64 57.39 31.22 5.14 55.65 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 3.61 26.88 -25.47 3.45 24.89 -26.21 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 48 ARG B 20 ARG~? 14.42 CH3 ACY B 401 C 101 TYR B 19 TYR~? 7.66 CH3 ACY B 403 C 173 ASP B 14 ASP.? 10.32 CH3 ACY B 403 coo 32.27 5.62 48.15 31.93 6.48 51.06 14.16 15.78 11.00 13.60 12.97 12.19 coo 29.64 3.64 57.39 31.22 5.14 55.65 10.24 15.60 3.03 8.77 16.10 0.69 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 4.45 14.77 1.64 4.87 15.68 -0.19 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 48 ARG B 36 ARG^? 3.17 C ACY B 401s C 101 TYR B 19 TYR~? 7.66 CH3 ACY B 403 C 173 ASP B 14 ASP.? 10.32 CH3 ACY B 403 coo 32.27 5.62 48.15 31.93 6.48 51.06 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 29.64 3.64 57.39 31.22 5.14 55.65 10.24 15.60 3.03 8.77 16.10 0.69 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 4.45 14.77 1.64 4.87 15.68 -0.19 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 A 48 ARG B 36 ARG^? 3.17 C ACY B 401s C 101 TYR D 19 TYR~? 6.50 OXT ACY B 401 C 173 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 32.27 5.62 48.15 31.93 6.48 51.06 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 29.64 3.64 57.39 31.22 5.14 55.65 24.45 24.76 1.05 22.95 23.32 -0.81 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 29.91 25.87 -1.90 28.44 24.29 -2.10 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 7 3 # 7 A 48 ARG C 20 ARG~? 11.83 CH3 ACY C 404 C 101 TYR C 19 TYR~? -3.65 O ACY C 404s C 173 ASP C 14 ASP.? 7.62 O ACY C 404 coo 32.27 5.62 48.15 31.93 6.48 51.06 11.69 24.38 -36.69 11.38 27.15 -38.05 coo 29.64 3.64 57.39 31.22 5.14 55.65 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 3.61 26.88 -25.47 3.45 24.89 -26.21 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 8 3 # 8 A 48 ARG C 36 ARG^? -3.18 C2 GOL A 501s C 101 TYR A 19 TYR~? -3.51 O4 PO4 A 302s C 173 ASP A 14 ASP.? 7.78 O4 PO4 A 302 coo 32.27 5.62 48.15 31.93 6.48 51.06 18.67 22.17 -22.86 17.03 22.41 -25.46 coo 29.64 3.64 57.39 31.22 5.14 55.65 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 28.88 11.61 -26.71 29.05 13.35 -27.94 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 # 9 A 48 ARG C 36 ARG^? -3.18 C2 GOL A 501s C 101 TYR C 19 TYR~? -3.65 O ACY C 404s C 173 ASP C 14 ASP.? 7.62 O ACY C 404 coo 32.27 5.62 48.15 31.93 6.48 51.06 18.67 22.17 -22.86 17.03 22.41 -25.46 coo 29.64 3.64 57.39 31.22 5.14 55.65 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 3.61 26.88 -25.47 3.45 24.89 -26.21 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 10 3 # 10 A 48 ARG D 20 ARG~? 14.11 CH3 ACY B 401 C 101 TYR D 19 TYR~? 6.50 OXT ACY B 401 C 173 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 32.27 5.62 48.15 31.93 6.48 51.06 23.40 25.12 9.78 26.24 26.16 10.42 coo 29.64 3.64 57.39 31.22 5.14 55.65 24.45 24.76 1.05 22.95 23.32 -0.81 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 29.91 25.87 -1.90 28.44 24.29 -2.10 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 11 3 # 11 A 48 ARG D 36 ARG^? 3.12 O ACY B 401s C 101 TYR B 19 TYR~? 7.66 CH3 ACY B 403 C 173 ASP B 14 ASP.? 10.32 CH3 ACY B 403 coo 32.27 5.62 48.15 31.93 6.48 51.06 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 29.64 3.64 57.39 31.22 5.14 55.65 10.24 15.60 3.03 8.77 16.10 0.69 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 4.45 14.77 1.64 4.87 15.68 -0.19 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 12 3 # 12 A 48 ARG D 36 ARG^? 3.12 O ACY B 401s C 101 TYR D 19 TYR~? 6.50 OXT ACY B 401 C 173 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 32.27 5.62 48.15 31.93 6.48 51.06 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 29.64 3.64 57.39 31.22 5.14 55.65 24.45 24.76 1.05 22.95 23.32 -0.81 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 29.91 25.87 -1.90 28.44 24.29 -2.10 1cs1_c01 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 12 hits 1cs1_c01 naa= 3 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 48 ARG A 20 ARG~? 11.30 O1 PO4 A 302 D 101 TYR A 19 TYR~? -3.51 O4 PO4 A 302s D 173 ASP A 14 ASP.? 7.78 O4 PO4 A 302 coo 69.08 8.58 32.60 69.70 10.81 30.58 19.43 13.50 -36.40 19.41 10.58 -37.42 coo 71.77 11.86 24.26 70.23 12.22 26.56 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 71.60 6.14 19.25 70.26 6.87 20.69 28.88 11.61 -26.71 29.05 13.35 -27.94 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 48 ARG B 20 ARG~? 14.42 CH3 ACY B 401 D 101 TYR B 19 TYR~? 7.66 CH3 ACY B 403 D 173 ASP B 14 ASP.? 10.32 CH3 ACY B 403 coo 69.08 8.58 32.60 69.70 10.81 30.58 14.16 15.78 11.00 13.60 12.97 12.19 coo 71.77 11.86 24.26 70.23 12.22 26.56 10.24 15.60 3.03 8.77 16.10 0.69 coo 71.60 6.14 19.25 70.26 6.87 20.69 4.45 14.77 1.64 4.87 15.68 -0.19 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 48 ARG B 36 ARG^? 3.17 C ACY B 401s D 101 TYR D 19 TYR~? 6.50 OXT ACY B 401 D 173 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 69.08 8.58 32.60 69.70 10.81 30.58 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 71.77 11.86 24.26 70.23 12.22 26.56 24.45 24.76 1.05 22.95 23.32 -0.81 coo 71.60 6.14 19.25 70.26 6.87 20.69 29.91 25.87 -1.90 28.44 24.29 -2.10 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 48 ARG C 20 ARG~? 11.83 CH3 ACY C 404 D 101 TYR C 19 TYR~? -3.65 O ACY C 404s D 173 ASP C 14 ASP.? 7.62 O ACY C 404 coo 69.08 8.58 32.60 69.70 10.81 30.58 11.69 24.38 -36.69 11.38 27.15 -38.05 coo 71.77 11.86 24.26 70.23 12.22 26.56 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 71.60 6.14 19.25 70.26 6.87 20.69 3.61 26.88 -25.47 3.45 24.89 -26.21 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 48 ARG D 20 ARG~? 14.11 CH3 ACY B 401 D 101 TYR D 19 TYR~? 6.50 OXT ACY B 401 D 173 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 69.08 8.58 32.60 69.70 10.81 30.58 23.40 25.12 9.78 26.24 26.16 10.42 coo 71.77 11.86 24.26 70.23 12.22 26.56 24.45 24.76 1.05 22.95 23.32 -0.81 coo 71.60 6.14 19.25 70.26 6.87 20.69 29.91 25.87 -1.90 28.44 24.29 -2.10 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 B 48 ARG D 36 ARG^? 3.12 O ACY B 401s D 101 TYR D 19 TYR~? 6.50 OXT ACY B 401 D 173 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 69.08 8.58 32.60 69.70 10.81 30.58 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 71.77 11.86 24.26 70.23 12.22 26.56 24.45 24.76 1.05 22.95 23.32 -0.81 coo 71.60 6.14 19.25 70.26 6.87 20.69 29.91 25.87 -1.90 28.44 24.29 -2.10 1cs1_c02 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1cs1_c02 naa= 3 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 101 TYR A 19 TYR~? -3.51 O4 PO4 A 302s B 173 ASP A 14 ASP.? 7.78 O4 PO4 A 302 D 48 ARG A 20 ARG~? 11.30 O1 PO4 A 302 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 19.43 13.50 -36.40 19.41 10.58 -37.42 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 101 TYR A 19 TYR~? -3.51 O4 PO4 A 302s B 173 ASP A 14 ASP.? 7.78 O4 PO4 A 302 D 48 ARG A 36 ARG^? 3.17 O2 GOL A 501s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 14.40 16.71 -22.33 15.78 16.00 -25.01 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 101 TYR A 19 TYR~? -3.51 O4 PO4 A 302s B 173 ASP A 14 ASP.? 7.78 O4 PO4 A 302 D 48 ARG C 36 ARG^? -3.18 C2 GOL A 501s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 18.67 22.17 -22.86 17.03 22.41 -25.46 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 101 TYR B 19 TYR~? 7.66 CH3 ACY B 403 B 173 ASP B 14 ASP.? 10.32 CH3 ACY B 403 D 48 ARG B 20 ARG~? 14.42 CH3 ACY B 401 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 10.24 15.60 3.03 8.77 16.10 0.69 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 4.45 14.77 1.64 4.87 15.68 -0.19 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 14.16 15.78 11.00 13.60 12.97 12.19 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 101 TYR B 19 TYR~? 7.66 CH3 ACY B 403 B 173 ASP B 14 ASP.? 10.32 CH3 ACY B 403 D 48 ARG B 36 ARG^? 3.17 C ACY B 401s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 10.24 15.60 3.03 8.77 16.10 0.69 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 4.45 14.77 1.64 4.87 15.68 -0.19 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 B 101 TYR B 19 TYR~? 7.66 CH3 ACY B 403 B 173 ASP B 14 ASP.? 10.32 CH3 ACY B 403 D 48 ARG D 36 ARG^? 3.12 O ACY B 401s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 10.24 15.60 3.03 8.77 16.10 0.69 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 4.45 14.77 1.64 4.87 15.68 -0.19 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 15.90 23.27 -3.56 17.50 23.47 -0.92 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 7 3 # 7 B 101 TYR C 19 TYR~? -3.65 O ACY C 404s B 173 ASP C 14 ASP.? 7.62 O ACY C 404 D 48 ARG A 36 ARG^? 3.17 O2 GOL A 501s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 14.40 16.71 -22.33 15.78 16.00 -25.01 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 8 3 # 8 B 101 TYR C 19 TYR~? -3.65 O ACY C 404s B 173 ASP C 14 ASP.? 7.62 O ACY C 404 D 48 ARG C 20 ARG~? 11.83 CH3 ACY C 404 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 11.69 24.38 -36.69 11.38 27.15 -38.05 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 # 9 B 101 TYR C 19 TYR~? -3.65 O ACY C 404s B 173 ASP C 14 ASP.? 7.62 O ACY C 404 D 48 ARG C 36 ARG^? -3.18 C2 GOL A 501s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 18.67 22.17 -22.86 17.03 22.41 -25.46 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 10 3 # 10 B 101 TYR D 19 TYR~? 6.50 OXT ACY B 401 B 173 ASP D 14 ASP.? 10.51 OXT ACY B 401 D 48 ARG B 36 ARG^? 3.17 C ACY B 401s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 24.45 24.76 1.05 22.95 23.32 -0.81 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 11 3 # 11 B 101 TYR D 19 TYR~? 6.50 OXT ACY B 401 B 173 ASP D 14 ASP.? 10.51 OXT ACY B 401 D 48 ARG D 20 ARG~? 14.11 CH3 ACY B 401 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 24.45 24.76 1.05 22.95 23.32 -0.81 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 23.40 25.12 9.78 26.24 26.16 10.42 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 12 3 # 12 B 101 TYR D 19 TYR~? 6.50 OXT ACY B 401 B 173 ASP D 14 ASP.? 10.51 OXT ACY B 401 D 48 ARG D 36 ARG^? 3.12 O ACY B 401s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 24.45 24.76 1.05 22.95 23.32 -0.81 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 15.90 23.27 -3.56 17.50 23.47 -0.92 1cs1_c03 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 12 hits 1cs1_c03 naa= 3 ULMN 3 1cwy_c00 AMYLOMALTASE user 1 3 # 1 A 293 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 340 GLU C 31 GLU.? 14.58 O1 PO4 A 302 A 395 ASP C 56 ASP~? 22.04 O3 GOL A 501 coo -48.00 -26.48 6.86 -46.51 -25.94 5.49 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -43.58 -29.03 7.13 -42.45 -27.34 7.75 31.25 23.87 -27.43 32.95 24.08 -28.66 coo -42.28 -26.47 -1.32 -44.06 -25.60 -0.58 34.87 33.34 -23.80 34.50 32.98 -25.83 ULMN 3 1cwy_c00 AMYLOMALTASE user 2 3 # 2 A 293 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 340 GLU D 31 GLU.? 15.11 CH3 ACY B 403 A 395 ASP D 56 ASP~? 19.96 CH3 ACY B 403 coo -48.00 -26.48 6.86 -46.51 -25.94 5.49 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -43.58 -29.03 7.13 -42.45 -27.34 7.75 2.56 25.26 0.73 1.39 26.46 2.05 coo -42.28 -26.47 -1.32 -44.06 -25.60 -0.58 0.36 35.17 -3.02 0.83 34.67 -1.05 1cwy_c00 source 1cwy AMYLOMALTASE : 2 hits 1cwy_c00 naa= 3 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 # 1 A 37 ASP A 32 ASP.? 10.92 O ACY A 402 A 56 ILE A 7 ILE^? 13.11 O ACY B 403 A 82 TYR A 6 TYR^? 17.89 O ACY A 402 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 10.96 8.75 -12.74 11.31 9.18 -11.55 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 5.36 6.34 -15.79 3.13 4.70 -15.92 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 # 2 A 37 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 56 ILE B 7 ILE^? 13.52 O4 PO4 A 302 A 82 TYR B 6 TYR^? 19.40 O ACY B 403 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 22.03 7.99 -12.37 22.12 9.24 -13.14 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 27.43 5.57 -8.88 29.53 3.76 -8.64 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 3 3 # 3 A 37 ASP C 14 ASP.? 7.62 O ACY C 404 A 56 ILE C 48 ILE.? 9.21 O ACY C 404 A 82 TYR C 39 TYR^? 11.15 O ACY C 404 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 10.95 27.87 -17.13 10.80 28.54 -15.92 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 9.18 23.50 -14.87 7.01 23.51 -13.16 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 4 3 # 4 A 37 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 56 ILE C 7 ILE^? 16.60 OXT ACY B 403 A 82 TYR C 6 TYR^? 20.74 O2 GOL A 501 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 23.06 31.41 -14.35 22.93 31.20 -13.14 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 28.12 33.29 -18.50 30.13 35.12 -19.15 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 5 3 # 5 A 37 ASP D 14 ASP.? 10.51 OXT ACY B 401 A 56 ILE D 48 ILE.? 12.59 OXT ACY B 401 A 82 TYR D 39 TYR^? 13.45 OXT ACY B 401 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 23.98 27.48 -9.67 24.23 27.94 -10.93 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 25.37 22.88 -11.59 27.59 22.45 -13.28 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 6 3 # 6 A 37 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 56 ILE D 7 ILE^? 14.04 O ACY C 404 A 82 TYR D 6 TYR^? 18.56 CH3 ACY B 403 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 12.28 32.19 -12.69 12.41 31.90 -13.86 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 7.30 34.85 -8.71 5.25 36.67 -8.19 1d6o_c00 source 1d6o FK506-BINDING PROTEIN : 6 hits 1d6o_c00 naa= 3 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 # 1 B 37 ASP A 32 ASP.? 10.92 O ACY A 402 B 56 ILE A 7 ILE^? 13.11 O ACY B 403 B 82 TYR A 6 TYR^? 17.89 O ACY A 402 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 10.96 8.75 -12.74 11.31 9.18 -11.55 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 5.36 6.34 -15.79 3.13 4.70 -15.92 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 # 2 B 37 ASP B 32 ASP.? 15.94 OXT ACY B 401 B 56 ILE B 7 ILE^? 13.52 O4 PO4 A 302 B 82 TYR B 6 TYR^? 19.40 O ACY B 403 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 22.03 7.99 -12.37 22.12 9.24 -13.14 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 27.43 5.57 -8.88 29.53 3.76 -8.64 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 3 3 # 3 B 37 ASP C 14 ASP.? 7.62 O ACY C 404 B 56 ILE C 48 ILE.? 9.21 O ACY C 404 B 82 TYR C 39 TYR^? 11.15 O ACY C 404 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 10.95 27.87 -17.13 10.80 28.54 -15.92 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 9.18 23.50 -14.87 7.01 23.51 -13.16 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 4 3 # 4 B 37 ASP C 32 ASP.? 15.02 O1 PO4 A 302 B 56 ILE C 7 ILE^? 16.60 OXT ACY B 403 B 82 TYR C 6 TYR^? 20.74 O2 GOL A 501 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 23.06 31.41 -14.35 22.93 31.20 -13.14 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 28.12 33.29 -18.50 30.13 35.12 -19.15 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 5 3 # 5 B 37 ASP D 14 ASP.? 10.51 OXT ACY B 401 B 56 ILE D 48 ILE.? 12.59 OXT ACY B 401 B 82 TYR D 39 TYR^? 13.45 OXT ACY B 401 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 23.98 27.48 -9.67 24.23 27.94 -10.93 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 25.37 22.88 -11.59 27.59 22.45 -13.28 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 6 3 # 6 B 37 ASP D 32 ASP.? 14.33 CH3 ACY B 403 B 56 ILE D 7 ILE^? 14.04 O ACY C 404 B 82 TYR D 6 TYR^? 18.56 CH3 ACY B 403 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 12.28 32.19 -12.69 12.41 31.90 -13.86 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 7.30 34.85 -8.71 5.25 36.67 -8.19 1d6o_c01 source 1d6o FK506-BINDING PROTEIN : 6 hits 1d6o_c01 naa= 3 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 1 3 # 1 A 173 TYR A 6 TYR^? 17.89 O ACY A 402 A 243 ASP C 14 ASP.? 7.62 O ACY C 404 A 272 LYS C 17 LYS~? 14.11 CH3 ACY C 404 coo 2.03 68.31 21.46 0.66 68.36 23.90 5.36 6.34 -15.79 3.13 4.70 -15.92 coo 16.93 55.67 9.65 17.16 54.23 11.19 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 14.13 45.79 13.40 14.25 49.41 18.30 8.25 27.86 -34.26 8.79 32.54 -37.59 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 2 3 # 2 A 173 TYR A 39 TYR^? 11.39 O4 PO4 A 302 A 243 ASP A 32 ASP.? 10.92 O ACY A 402 A 272 LYS A 3 LYS.? 16.38 O ACY A 402 coo 2.03 68.31 21.46 0.66 68.36 23.90 24.81 16.29 -15.55 27.22 16.47 -14.15 coo 16.93 55.67 9.65 17.16 54.23 11.19 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 14.13 45.79 13.40 14.25 49.41 18.30 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 3 3 # 3 A 173 TYR A 39 TYR^? 11.39 O4 PO4 A 302 A 243 ASP C 58 ASP~? 25.07 O3 GOL A 501 A 272 LYS C 66 LYS~? 17.26 CH3 ACY C 404 coo 2.03 68.31 21.46 0.66 68.36 23.90 24.81 16.29 -15.55 27.22 16.47 -14.15 coo 16.93 55.67 9.65 17.16 54.23 11.19 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 14.13 45.79 13.40 14.25 49.41 18.30 20.24 35.37 -30.72 23.66 34.59 -34.92 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 4 3 # 4 A 173 TYR B 6 TYR^? 19.40 O ACY B 403 A 243 ASP D 14 ASP.? 10.51 OXT ACY B 401 A 272 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo 2.03 68.31 21.46 0.66 68.36 23.90 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 16.93 55.67 9.65 17.16 54.23 11.19 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 14.13 45.79 13.40 14.25 49.41 18.30 26.90 28.52 7.20 25.78 33.34 9.99 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 5 3 # 5 A 173 TYR B 39 TYR^? 10.21 CH3 ACY B 403 A 243 ASP D 14 ASP.? 10.51 OXT ACY B 401 A 272 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo 2.03 68.31 21.46 0.66 68.36 23.90 9.18 17.36 -10.32 6.76 17.67 -11.73 coo 16.93 55.67 9.65 17.16 54.23 11.19 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 14.13 45.79 13.40 14.25 49.41 18.30 26.90 28.52 7.20 25.78 33.34 9.99 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 6 3 # 6 A 173 TYR C 39 TYR^? 11.15 O ACY C 404 A 243 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 272 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 2.03 68.31 21.46 0.66 68.36 23.90 9.18 23.50 -14.87 7.01 23.51 -13.16 coo 16.93 55.67 9.65 17.16 54.23 11.19 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 14.13 45.79 13.40 14.25 49.41 18.30 35.92 31.10 -19.94 35.74 27.15 -23.97 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 7 3 # 7 A 173 TYR C 39 TYR^? 11.15 O ACY C 404 A 243 ASP D 14 ASP.? 10.51 OXT ACY B 401 A 272 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo 2.03 68.31 21.46 0.66 68.36 23.90 9.18 23.50 -14.87 7.01 23.51 -13.16 coo 16.93 55.67 9.65 17.16 54.23 11.19 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 14.13 45.79 13.40 14.25 49.41 18.30 26.90 28.52 7.20 25.78 33.34 9.99 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 8 3 # 8 A 173 TYR D 39 TYR^? 13.45 OXT ACY B 401 A 243 ASP B 58 ASP~? 24.69 OXT ACY B 401 A 272 LYS B 66 LYS~? 18.61 CH3 ACY B 401 coo 2.03 68.31 21.46 0.66 68.36 23.90 25.37 22.88 -11.59 27.59 22.45 -13.28 coo 16.93 55.67 9.65 17.16 54.23 11.19 33.22 2.96 0.74 34.69 1.59 1.17 coo 14.13 45.79 13.40 14.25 49.41 18.30 20.89 3.87 3.84 24.86 4.42 7.52 1d7r_c02 source 1d7r 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYRUVATE) : 8 hits 1d7r_c02 naa= 3 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 A 145 LYS A 66 LYS~? 16.67 O ACY A 402 A 177 GLU A 24 GLU~? 10.37 O3 PO4 A 302 A 201 LEU A 25 LEU~? 10.05 O3 PO4 A 302 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 11.69 2.61 -28.49 7.34 2.61 -31.70 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 14.49 13.16 -34.47 15.70 12.18 -35.93 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 12.29 9.11 -29.44 11.43 7.16 -29.44 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 2 3 # 2 A 145 LYS B 66 LYS~? 18.61 CH3 ACY B 401 A 177 GLU B 24 GLU~? 12.08 CH3 ACY B 401 A 201 LEU B 25 LEU~? 11.76 CH3 ACY B 401 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 20.89 3.87 3.84 24.86 4.42 7.52 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 18.70 14.65 8.90 18.04 13.62 10.65 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 20.66 10.55 4.19 21.13 8.45 4.43 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 3 3 # 3 A 145 LYS C 66 LYS~? 17.26 CH3 ACY C 404 A 177 GLU C 24 GLU~? 11.35 C3 GOL A 501 A 201 LEU C 25 LEU~? 10.16 CH3 ACY C 404 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 20.24 35.37 -30.72 23.66 34.59 -34.92 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 18.84 25.84 -35.18 19.75 24.32 -36.38 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 19.69 28.80 -30.60 20.13 30.82 -31.25 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 4 3 # 4 A 145 LYS D 66 LYS~? 18.65 CH3 ACY B 401 A 177 GLU D 24 GLU~? 11.43 CH3 ACY B 401 A 201 LEU D 25 LEU~? 11.82 CH3 ACY B 401 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 15.33 36.81 3.59 11.66 36.34 7.56 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 18.15 25.86 8.28 19.10 26.69 9.97 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 15.59 30.25 3.78 15.06 32.26 4.26 1daa_c00 source 1daa D-AMINO ACID AMINOTRANSFERASE : 4 hits 1daa_c00 naa= 3 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 B 145 LYS A 66 LYS~? 16.67 O ACY A 402 B 177 GLU A 24 GLU~? 10.37 O3 PO4 A 302 B 201 LEU A 25 LEU~? 10.05 O3 PO4 A 302 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 11.69 2.61 -28.49 7.34 2.61 -31.70 coo 27.00 6.35 51.01 26.30 4.53 50.18 14.49 13.16 -34.47 15.70 12.18 -35.93 coo 23.74 1.68 49.50 22.87 -0.24 49.97 12.29 9.11 -29.44 11.43 7.16 -29.44 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 2 3 # 2 B 145 LYS B 66 LYS~? 18.61 CH3 ACY B 401 B 177 GLU B 24 GLU~? 12.08 CH3 ACY B 401 B 201 LEU B 25 LEU~? 11.76 CH3 ACY B 401 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 20.89 3.87 3.84 24.86 4.42 7.52 coo 27.00 6.35 51.01 26.30 4.53 50.18 18.70 14.65 8.90 18.04 13.62 10.65 coo 23.74 1.68 49.50 22.87 -0.24 49.97 20.66 10.55 4.19 21.13 8.45 4.43 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 3 3 # 3 B 145 LYS C 66 LYS~? 17.26 CH3 ACY C 404 B 177 GLU C 24 GLU~? 11.35 C3 GOL A 501 B 201 LEU C 25 LEU~? 10.16 CH3 ACY C 404 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 20.24 35.37 -30.72 23.66 34.59 -34.92 coo 27.00 6.35 51.01 26.30 4.53 50.18 18.84 25.84 -35.18 19.75 24.32 -36.38 coo 23.74 1.68 49.50 22.87 -0.24 49.97 19.69 28.80 -30.60 20.13 30.82 -31.25 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 4 3 # 4 B 145 LYS D 66 LYS~? 18.65 CH3 ACY B 401 B 177 GLU D 24 GLU~? 11.43 CH3 ACY B 401 B 201 LEU D 25 LEU~? 11.82 CH3 ACY B 401 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 15.33 36.81 3.59 11.66 36.34 7.56 coo 27.00 6.35 51.01 26.30 4.53 50.18 18.15 25.86 8.28 19.10 26.69 9.97 coo 23.74 1.68 49.50 22.87 -0.24 49.97 15.59 30.25 3.78 15.06 32.26 4.26 1daa_c01 source 1daa D-AMINO ACID AMINOTRANSFERASE : 4 hits 1daa_c01 naa= 3 ULMN 3 1db3_c01 GDP-MANNOSE 4,6-DEHYDRATASE user 1 3 # 1 A 132 THR C 59 THR~? 18.08 O3 GOL A 501 A 156 TYR C 6 TYR^? 20.74 O2 GOL A 501 A 160 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 10.50 56.87 17.73 11.24 57.93 19.43 29.94 33.15 -27.01 30.78 31.19 -27.05 coo 11.64 63.07 23.95 11.76 62.47 21.20 28.12 33.29 -18.50 30.13 35.12 -19.15 coo 5.78 61.30 21.65 8.04 62.89 17.54 35.92 31.10 -19.94 35.74 27.15 -23.97 1db3_c01 source 1db3 GDP-MANNOSE 4,6-DEHYDRATASE : 1 hits 1db3_c01 naa= 3 ULMN 3 1de3_c00 RIBONUCLEASE ALPHA-SARCIN user 1 3 # 1 A 50 HIS D 27 HIS~? 8.84 CH3 ACY B 401 A 96 GLU D 24 GLU~? 11.43 CH3 ACY B 401 A 137 HIS B 27 HIS~? 8.91 CH3 ACY B 401 coo 1.83 2.95 4.76 1.26 0.98 4.81 12.53 22.86 5.89 11.39 21.93 7.39 coo 2.09 -1.43 1.72 1.90 -3.41 2.37 18.15 25.86 8.28 19.10 26.69 9.97 coo -3.67 -7.38 4.26 -2.89 -5.51 4.56 24.22 18.07 5.55 25.63 19.33 6.45 1de3_c00 source 1de3 RIBONUCLEASE ALPHA-SARCIN : 1 hits 1de3_c00 naa= 3 ULMN 3 1dfo_c04 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 A 57 GLU A 31 GLU.? 11.52 CH3 ACY A 402 A 226 THR C 9 THR^? 12.89 O ACY C 404 A 229 LYS C 76 LYS^? 21.01 CH3 ACY C 404 coo 9.66 102.78 70.07 9.79 101.18 71.42 0.44 16.93 -24.63 -1.32 16.41 -25.67 coo 7.24 97.46 49.60 8.11 95.69 48.80 17.19 31.64 -17.89 16.28 31.87 -15.98 coo 10.53 97.56 43.71 9.33 93.71 47.17 18.27 36.67 -18.82 19.78 40.82 -15.57 1dfo_c04 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c04 naa= 3 ULMN 3 1dfo_c05 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 B 57 GLU A 31 GLU.? 11.52 CH3 ACY A 402 B 226 THR C 9 THR^? 12.89 O ACY C 404 B 229 LYS C 76 LYS^? 21.01 CH3 ACY C 404 coo 15.90 87.61 49.61 13.92 86.96 49.36 0.44 16.93 -24.63 -1.32 16.41 -25.67 coo 20.74 95.78 68.68 19.29 96.84 69.83 17.19 31.64 -17.89 16.28 31.87 -15.98 coo 22.32 101.61 71.64 17.89 98.63 71.55 18.27 36.67 -18.82 19.78 40.82 -15.57 1dfo_c05 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c05 naa= 3 ULMN 3 1dfo_c06 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 C 57 GLU A 31 GLU.? 11.52 CH3 ACY A 402 C 226 THR C 9 THR^? 12.89 O ACY C 404 C 229 LYS C 76 LYS^? 21.01 CH3 ACY C 404 coo 5.43 40.40 61.63 4.27 41.99 60.90 0.44 16.93 -24.63 -1.32 16.41 -25.67 coo 22.16 45.88 73.63 23.23 47.70 73.25 17.19 31.64 -17.89 16.28 31.87 -15.98 coo 28.90 45.91 73.55 25.22 49.72 72.97 18.27 36.67 -18.82 19.78 40.82 -15.57 1dfo_c06 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c06 naa= 3 ULMN 3 1dfo_c07 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 D 57 GLU A 31 GLU.? 11.52 CH3 ACY A 402 D 226 THR C 9 THR^? 12.89 O ACY C 404 D 229 LYS C 76 LYS^? 21.01 CH3 ACY C 404 coo 26.07 55.89 66.14 25.33 56.50 68.01 0.44 16.93 -24.63 -1.32 16.41 -25.67 coo 11.79 47.62 52.67 10.10 46.51 53.39 17.19 31.64 -17.89 16.28 31.87 -15.98 coo 10.05 41.79 49.80 7.94 44.71 53.76 18.27 36.67 -18.82 19.78 40.82 -15.57 1dfo_c07 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c07 naa= 3 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 1 3 # 1 146 TYR A 19 TYR~? -3.51 O4 PO4 A 302s 150 LYS A 17 LYS~? 14.12 O3 PO4 A 302 186 ASN C 28 ASN~? 11.75 O3 GOL A 501 coo 32.88 50.55 24.33 31.89 51.78 26.65 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 27.04 52.42 22.30 26.88 49.99 27.00 22.94 9.69 -34.22 22.50 4.31 -36.79 coo 36.98 50.30 37.29 35.85 50.29 35.50 24.24 26.01 -32.95 22.97 25.58 -34.62 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 2 3 # 2 146 TYR B 19 TYR~? 7.66 CH3 ACY B 403 150 LYS B 17 LYS~? 19.82 CH3 ACY B 401 186 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo 32.88 50.55 24.33 31.89 51.78 26.65 10.24 15.60 3.03 8.77 16.10 0.69 coo 27.04 52.42 22.30 26.88 49.99 27.00 10.28 12.10 9.11 8.33 8.93 13.61 coo 36.98 50.30 37.29 35.85 50.29 35.50 19.37 24.14 3.44 20.48 23.43 1.80 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 3 3 # 3 146 TYR B 19 TYR~? 7.66 CH3 ACY B 403 150 LYS B 17 LYS~? 19.82 CH3 ACY B 401 186 ASN D 28 ASN~? 12.25 CH3 ACY B 401 coo 32.88 50.55 24.33 31.89 51.78 26.65 10.24 15.60 3.03 8.77 16.10 0.69 coo 27.04 52.42 22.30 26.88 49.99 27.00 10.28 12.10 9.11 8.33 8.93 13.61 coo 36.98 50.30 37.29 35.85 50.29 35.50 10.83 28.19 6.10 11.90 27.91 7.93 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 4 3 # 4 146 TYR C 19 TYR~? -3.65 O ACY C 404s 150 LYS C 17 LYS~? 14.11 CH3 ACY C 404 186 ASN A 28 ASN~? 9.25 OXT ACY A 402 coo 32.88 50.55 24.33 31.89 51.78 26.65 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 27.04 52.42 22.30 26.88 49.99 27.00 8.25 27.86 -34.26 8.79 32.54 -37.59 coo 36.98 50.30 37.29 35.85 50.29 35.50 7.12 11.54 -30.87 7.65 11.60 -32.93 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 5 3 # 5 146 TYR D 19 TYR~? 6.50 OXT ACY B 401 150 LYS D 17 LYS~? 17.87 CH3 ACY B 401 186 ASN D 28 ASN~? 12.25 CH3 ACY B 401 coo 32.88 50.55 24.33 31.89 51.78 26.65 24.45 24.76 1.05 22.95 23.32 -0.81 coo 27.04 52.42 22.30 26.88 49.99 27.00 26.90 28.52 7.20 25.78 33.34 9.99 coo 36.98 50.30 37.29 35.85 50.29 35.50 10.83 28.19 6.10 11.90 27.91 7.93 1dhr_c00 source 1dhr DIHYDROPTERIDINE REDUCTASE (DHPR) (E.C.1.6.99.: 5 hits 1dhr_c00 naa= 3 ULMN 3 1do8_c00 MALIC ENZYME user 1 3 # 1 A 112 TYR A 6 TYR^? 17.89 O ACY A 402 A 183 LYS A 3 LYS.? 16.38 O ACY A 402 A 278 ASP A 58 ASP~? 21.11 O ACY A 402 coo 19.43 18.53 42.32 17.66 18.80 40.15 5.36 6.34 -15.79 3.13 4.70 -15.92 coo 21.92 15.80 36.19 17.64 19.44 36.35 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 15.46 19.03 31.40 15.01 18.25 33.31 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1do8_c00 MALIC ENZYME user 2 3 # 2 A 112 TYR B 6 TYR^? 19.40 O ACY B 403 A 183 LYS B 3 LYS.? 19.35 OXT ACY B 401 A 278 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 19.43 18.53 42.32 17.66 18.80 40.15 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 21.92 15.80 36.19 17.64 19.44 36.35 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 15.46 19.03 31.40 15.01 18.25 33.31 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 1do8_c00 MALIC ENZYME user 3 3 # 3 A 112 TYR C 6 TYR^? 20.74 O2 GOL A 501 A 183 LYS C 3 LYS.? 18.92 O1 PO4 A 302 A 278 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo 19.43 18.53 42.32 17.66 18.80 40.15 28.12 33.29 -18.50 30.13 35.12 -19.15 coo 21.92 15.80 36.19 17.64 19.44 36.35 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 15.46 19.03 31.40 15.01 18.25 33.31 32.89 35.88 -28.31 34.37 37.32 -28.69 ULMN 3 1do8_c00 MALIC ENZYME user 4 3 # 4 A 112 TYR D 6 TYR^? 18.56 CH3 ACY B 403 A 183 LYS D 3 LYS.? 18.33 CH3 ACY B 403 A 278 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 19.43 18.53 42.32 17.66 18.80 40.15 7.30 34.85 -8.71 5.25 36.67 -8.19 coo 21.92 15.80 36.19 17.64 19.44 36.35 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 15.46 19.03 31.40 15.01 18.25 33.31 2.43 37.89 1.30 0.84 39.23 1.50 1do8_c00 source 1do8 MALIC ENZYME : 4 hits 1do8_c00 naa= 3 ULMN 3 1do8_c01 MALIC ENZYME user 1 3 # 1 B 112 TYR A 6 TYR^? 17.89 O ACY A 402 B 183 LYS A 3 LYS.? 16.38 O ACY A 402 B 278 ASP A 58 ASP~? 21.11 O ACY A 402 coo 58.62 15.99 58.34 60.98 14.60 58.93 5.36 6.34 -15.79 3.13 4.70 -15.92 coo 60.11 10.60 53.63 62.59 10.74 58.67 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 66.50 7.32 58.45 66.26 9.42 58.23 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1do8_c01 MALIC ENZYME user 2 3 # 2 B 112 TYR B 6 TYR^? 19.40 O ACY B 403 B 183 LYS B 3 LYS.? 19.35 OXT ACY B 401 B 278 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 58.62 15.99 58.34 60.98 14.60 58.93 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 60.11 10.60 53.63 62.59 10.74 58.67 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 66.50 7.32 58.45 66.26 9.42 58.23 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 1do8_c01 MALIC ENZYME user 3 3 # 3 B 112 TYR C 6 TYR^? 20.74 O2 GOL A 501 B 183 LYS C 3 LYS.? 18.92 O1 PO4 A 302 B 278 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo 58.62 15.99 58.34 60.98 14.60 58.93 28.12 33.29 -18.50 30.13 35.12 -19.15 coo 60.11 10.60 53.63 62.59 10.74 58.67 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 66.50 7.32 58.45 66.26 9.42 58.23 32.89 35.88 -28.31 34.37 37.32 -28.69 ULMN 3 1do8_c01 MALIC ENZYME user 4 3 # 4 B 112 TYR D 6 TYR^? 18.56 CH3 ACY B 403 B 183 LYS D 3 LYS.? 18.33 CH3 ACY B 403 B 278 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 58.62 15.99 58.34 60.98 14.60 58.93 7.30 34.85 -8.71 5.25 36.67 -8.19 coo 60.11 10.60 53.63 62.59 10.74 58.67 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 66.50 7.32 58.45 66.26 9.42 58.23 2.43 37.89 1.30 0.84 39.23 1.50 1do8_c01 source 1do8 MALIC ENZYME : 4 hits 1do8_c01 naa= 3 ULMN 3 1do8_c02 MALIC ENZYME user 1 3 # 1 C 112 TYR A 6 TYR^? 17.89 O ACY A 402 C 183 LYS A 3 LYS.? 16.38 O ACY A 402 C 278 ASP A 58 ASP~? 21.11 O ACY A 402 coo 76.02 -16.57 8.89 78.24 -15.17 9.87 5.36 6.34 -15.79 3.13 4.70 -15.92 coo 74.18 -11.17 13.22 79.08 -11.19 10.47 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 82.27 -7.93 13.54 81.93 -10.04 13.72 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1do8_c02 MALIC ENZYME user 2 3 # 2 C 112 TYR B 6 TYR^? 19.40 O ACY B 403 C 183 LYS B 3 LYS.? 19.35 OXT ACY B 401 C 278 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 76.02 -16.57 8.89 78.24 -15.17 9.87 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 74.18 -11.17 13.22 79.08 -11.19 10.47 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 82.27 -7.93 13.54 81.93 -10.04 13.72 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 1do8_c02 MALIC ENZYME user 3 3 # 3 C 112 TYR C 6 TYR^? 20.74 O2 GOL A 501 C 183 LYS C 3 LYS.? 18.92 O1 PO4 A 302 C 278 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo 76.02 -16.57 8.89 78.24 -15.17 9.87 28.12 33.29 -18.50 30.13 35.12 -19.15 coo 74.18 -11.17 13.22 79.08 -11.19 10.47 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 82.27 -7.93 13.54 81.93 -10.04 13.72 32.89 35.88 -28.31 34.37 37.32 -28.69 ULMN 3 1do8_c02 MALIC ENZYME user 4 3 # 4 C 112 TYR D 6 TYR^? 18.56 CH3 ACY B 403 C 183 LYS D 3 LYS.? 18.33 CH3 ACY B 403 C 278 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 76.02 -16.57 8.89 78.24 -15.17 9.87 7.30 34.85 -8.71 5.25 36.67 -8.19 coo 74.18 -11.17 13.22 79.08 -11.19 10.47 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 82.27 -7.93 13.54 81.93 -10.04 13.72 2.43 37.89 1.30 0.84 39.23 1.50 1do8_c02 source 1do8 MALIC ENZYME : 4 hits 1do8_c02 naa= 3 ULMN 3 1do8_c03 MALIC ENZYME user 1 3 # 1 D 112 TYR A 6 TYR^? 17.89 O ACY A 402 D 183 LYS A 3 LYS.? 16.38 O ACY A 402 D 278 ASP A 58 ASP~? 21.11 O ACY A 402 coo 35.64 -19.32 -3.24 32.92 -19.55 -2.64 5.36 6.34 -15.79 3.13 4.70 -15.92 coo 33.51 -16.63 3.10 30.11 -20.23 0.26 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 25.62 -19.94 2.86 26.44 -19.16 1.09 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1do8_c03 MALIC ENZYME user 2 3 # 2 D 112 TYR B 6 TYR^? 19.40 O ACY B 403 D 183 LYS B 3 LYS.? 19.35 OXT ACY B 401 D 278 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 35.64 -19.32 -3.24 32.92 -19.55 -2.64 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 33.51 -16.63 3.10 30.11 -20.23 0.26 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 25.62 -19.94 2.86 26.44 -19.16 1.09 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 1do8_c03 MALIC ENZYME user 3 3 # 3 D 112 TYR C 6 TYR^? 20.74 O2 GOL A 501 D 183 LYS C 3 LYS.? 18.92 O1 PO4 A 302 D 278 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo 35.64 -19.32 -3.24 32.92 -19.55 -2.64 28.12 33.29 -18.50 30.13 35.12 -19.15 coo 33.51 -16.63 3.10 30.11 -20.23 0.26 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 25.62 -19.94 2.86 26.44 -19.16 1.09 32.89 35.88 -28.31 34.37 37.32 -28.69 ULMN 3 1do8_c03 MALIC ENZYME user 4 3 # 4 D 112 TYR D 6 TYR^? 18.56 CH3 ACY B 403 D 183 LYS D 3 LYS.? 18.33 CH3 ACY B 403 D 278 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 35.64 -19.32 -3.24 32.92 -19.55 -2.64 7.30 34.85 -8.71 5.25 36.67 -8.19 coo 33.51 -16.63 3.10 30.11 -20.23 0.26 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 25.62 -19.94 2.86 26.44 -19.16 1.09 2.43 37.89 1.30 0.84 39.23 1.50 1do8_c03 source 1do8 MALIC ENZYME : 4 hits 1do8_c03 naa= 3 ULMN 3 1e19_c00 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 1 3 # 1 A 131 LYS A 81 LYS.? 21.98 O ACY B 403 A 215 LYS B 76 LYS^? 19.88 O ACY B 403 A 277 LYS A 76 LYS^? 19.05 O4 PO4 A 302 coo 0.50 24.09 51.68 1.51 29.34 52.35 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 13.06 30.79 51.73 11.40 35.76 53.48 17.16 3.18 -7.74 14.10 -1.32 -8.74 coo 13.04 31.88 60.72 10.57 35.34 57.49 15.29 2.83 -16.82 18.24 -1.47 -14.60 ULMN 3 1e19_c00 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 2 3 # 2 A 131 LYS C 81 LYS.? 25.54 OXT ACY B 401 A 215 LYS D 76 LYS^? 21.99 O ACY C 404 A 277 LYS C 76 LYS^? 21.01 CH3 ACY C 404 coo 0.50 24.09 51.68 1.51 29.34 52.35 31.22 35.67 -10.67 31.64 40.37 -10.68 coo 13.06 30.79 51.73 11.40 35.76 53.48 17.64 37.25 -8.68 17.76 41.25 -12.78 coo 13.04 31.88 60.72 10.57 35.34 57.49 18.27 36.67 -18.82 19.78 40.82 -15.57 1e19_c00 source 1e19 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPHATE SYNTH: 2 hits 1e19_c00 naa= 3 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 1 3 # 1 B 131 LYS A 81 LYS.? 21.98 O ACY B 403 B 215 LYS B 76 LYS^? 19.88 O ACY B 403 B 277 LYS A 76 LYS^? 19.05 O4 PO4 A 302 coo 6.78 45.91 16.15 7.82 40.81 15.84 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 17.88 38.77 19.81 16.38 34.23 17.24 17.16 3.18 -7.74 14.10 -1.32 -8.74 coo 20.33 37.78 11.20 16.77 34.53 13.47 15.29 2.83 -16.82 18.24 -1.47 -14.60 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 2 3 # 2 B 131 LYS B 81 LYS.? 16.99 O4 PO4 A 302 B 215 LYS A 76 LYS^? 19.05 O4 PO4 A 302 B 277 LYS B 76 LYS^? 19.88 O ACY B 403 coo 6.78 45.91 16.15 7.82 40.81 15.84 29.08 3.04 -17.20 34.50 4.57 -18.92 coo 17.88 38.77 19.81 16.38 34.23 17.24 15.29 2.83 -16.82 18.24 -1.47 -14.60 coo 20.33 37.78 11.20 16.77 34.53 13.47 17.16 3.18 -7.74 14.10 -1.32 -8.74 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 3 3 # 3 B 131 LYS C 81 LYS.? 25.54 OXT ACY B 401 B 215 LYS D 76 LYS^? 21.99 O ACY C 404 B 277 LYS C 76 LYS^? 21.01 CH3 ACY C 404 coo 6.78 45.91 16.15 7.82 40.81 15.84 31.22 35.67 -10.67 31.64 40.37 -10.68 coo 17.88 38.77 19.81 16.38 34.23 17.24 17.64 37.25 -8.68 17.76 41.25 -12.78 coo 20.33 37.78 11.20 16.77 34.53 13.47 18.27 36.67 -18.82 19.78 40.82 -15.57 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 4 3 # 4 B 131 LYS D 81 LYS.? 19.75 O ACY C 404 B 215 LYS C 76 LYS^? 21.01 CH3 ACY C 404 B 277 LYS D 76 LYS^? 21.99 O ACY C 404 coo 6.78 45.91 16.15 7.82 40.81 15.84 4.59 37.20 -16.29 4.16 41.27 -17.63 coo 17.88 38.77 19.81 16.38 34.23 17.24 18.27 36.67 -18.82 19.78 40.82 -15.57 coo 20.33 37.78 11.20 16.77 34.53 13.47 17.64 37.25 -8.68 17.76 41.25 -12.78 1e19_c01 source 1e19 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPHATE SYNTH: 4 hits 1e19_c01 naa= 3 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 38 THR A 59 THR~? 14.19 O ACY A 402 A 159 LYS A 3 LYS.? 16.38 O ACY A 402 A 193 GLU B 44 GLU~? 18.30 CH3 ACY B 403 coo -2.58 16.31 54.79 -4.02 14.93 55.64 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 2.10 10.68 61.44 -2.14 13.16 60.61 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo -5.33 11.71 69.72 -4.62 11.92 67.73 0.81 11.28 -7.46 -1.17 10.55 -7.79 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 2 3 # 2 A 38 THR A 59 THR~? 14.19 O ACY A 402 A 159 LYS A 54 LYS.? 19.07 O ACY A 402 A 193 GLU B 44 GLU~? 18.30 CH3 ACY B 403 coo -2.58 16.31 54.79 -4.02 14.93 55.64 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 2.10 10.68 61.44 -2.14 13.16 60.61 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo -5.33 11.71 69.72 -4.62 11.92 67.73 0.81 11.28 -7.46 -1.17 10.55 -7.79 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 3 3 # 3 A 38 THR A 59 THR~? 14.19 O ACY A 402 A 159 LYS A 66 LYS~? 16.67 O ACY A 402 A 193 GLU A 24 GLU~? 10.37 O3 PO4 A 302 coo -2.58 16.31 54.79 -4.02 14.93 55.64 2.48 5.35 -23.92 1.78 7.38 -24.24 coo 2.10 10.68 61.44 -2.14 13.16 60.61 11.69 2.61 -28.49 7.34 2.61 -31.70 coo -5.33 11.71 69.72 -4.62 11.92 67.73 14.49 13.16 -34.47 15.70 12.18 -35.93 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 4 3 # 4 A 38 THR B 59 THR~? 17.71 OXT ACY B 401 A 159 LYS B 3 LYS.? 19.35 OXT ACY B 401 A 193 GLU A 44 GLU~? 15.81 O4 PO4 A 302 coo -2.58 16.31 54.79 -4.02 14.93 55.64 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 2.10 10.68 61.44 -2.14 13.16 60.61 35.65 7.25 -8.40 36.12 12.24 -4.67 coo -5.33 11.71 69.72 -4.62 11.92 67.73 32.63 9.21 -17.75 34.50 8.25 -17.69 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 5 3 # 5 A 38 THR B 59 THR~? 17.71 OXT ACY B 401 A 159 LYS B 54 LYS.? 19.51 O4 PO4 A 302 A 193 GLU A 44 GLU~? 15.81 O4 PO4 A 302 coo -2.58 16.31 54.79 -4.02 14.93 55.64 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 2.10 10.68 61.44 -2.14 13.16 60.61 31.00 10.85 -8.70 36.11 12.09 -12.03 coo -5.33 11.71 69.72 -4.62 11.92 67.73 32.63 9.21 -17.75 34.50 8.25 -17.69 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 6 3 # 6 A 38 THR B 59 THR~? 17.71 OXT ACY B 401 A 159 LYS B 66 LYS~? 18.61 CH3 ACY B 401 A 193 GLU B 24 GLU~? 12.08 CH3 ACY B 401 coo -2.58 16.31 54.79 -4.02 14.93 55.64 30.30 5.71 -0.52 31.18 7.66 -0.59 coo 2.10 10.68 61.44 -2.14 13.16 60.61 20.89 3.87 3.84 24.86 4.42 7.52 coo -5.33 11.71 69.72 -4.62 11.92 67.73 18.70 14.65 8.90 18.04 13.62 10.65 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 7 3 # 7 A 38 THR C 59 THR~? 18.08 O3 GOL A 501 A 159 LYS C 3 LYS.? 18.92 O1 PO4 A 302 A 193 GLU D 44 GLU~? 21.69 OXT ACY B 401 coo -2.58 16.31 54.79 -4.02 14.93 55.64 29.94 33.15 -27.01 30.78 31.19 -27.05 coo 2.10 10.68 61.44 -2.14 13.16 60.61 35.92 31.10 -19.94 35.74 27.15 -23.97 coo -5.33 11.71 69.72 -4.62 11.92 67.73 34.05 29.14 -10.19 35.86 30.19 -10.55 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 8 3 # 8 A 38 THR C 59 THR~? 18.08 O3 GOL A 501 A 159 LYS C 54 LYS.? 21.14 O4 PO4 A 302 A 193 GLU D 44 GLU~? 21.69 OXT ACY B 401 coo -2.58 16.31 54.79 -4.02 14.93 55.64 29.94 33.15 -27.01 30.78 31.19 -27.05 coo 2.10 10.68 61.44 -2.14 13.16 60.61 31.19 27.76 -19.03 36.53 26.17 -16.12 coo -5.33 11.71 69.72 -4.62 11.92 67.73 34.05 29.14 -10.19 35.86 30.19 -10.55 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 9 3 # 9 A 38 THR C 59 THR~? 18.08 O3 GOL A 501 A 159 LYS C 66 LYS~? 17.26 CH3 ACY C 404 A 193 GLU C 24 GLU~? 11.35 C3 GOL A 501 coo -2.58 16.31 54.79 -4.02 14.93 55.64 29.94 33.15 -27.01 30.78 31.19 -27.05 coo 2.10 10.68 61.44 -2.14 13.16 60.61 20.24 35.37 -30.72 23.66 34.59 -34.92 coo -5.33 11.71 69.72 -4.62 11.92 67.73 18.84 25.84 -35.18 19.75 24.32 -36.38 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 10 3 # 10 A 38 THR D 59 THR~? 16.58 CH3 ACY B 403 A 159 LYS D 3 LYS.? 18.33 CH3 ACY B 403 A 193 GLU C 44 GLU~? 16.01 O ACY C 404 coo -2.58 16.31 54.79 -4.02 14.93 55.64 5.37 35.06 -0.11 4.54 33.06 0.04 coo 2.10 10.68 61.44 -2.14 13.16 60.61 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo -5.33 11.71 69.72 -4.62 11.92 67.73 1.25 30.44 -16.59 -0.63 31.35 -16.34 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 11 3 # 11 A 38 THR D 59 THR~? 16.58 CH3 ACY B 403 A 159 LYS D 54 LYS.? 18.95 CH3 ACY B 403 A 193 GLU D 2 GLU.? 23.79 O ACY C 404 coo -2.58 16.31 54.79 -4.02 14.93 55.64 5.37 35.06 -0.11 4.54 33.06 0.04 coo 2.10 10.68 61.44 -2.14 13.16 60.61 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo -5.33 11.71 69.72 -4.62 11.92 67.73 -6.17 33.52 -9.55 -6.78 32.15 -11.04 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 12 3 # 12 A 38 THR D 59 THR~? 16.58 CH3 ACY B 403 A 159 LYS D 66 LYS~? 18.65 CH3 ACY B 401 A 193 GLU D 24 GLU~? 11.43 CH3 ACY B 401 coo -2.58 16.31 54.79 -4.02 14.93 55.64 5.37 35.06 -0.11 4.54 33.06 0.04 coo 2.10 10.68 61.44 -2.14 13.16 60.61 15.33 36.81 3.59 11.66 36.34 7.56 coo -5.33 11.71 69.72 -4.62 11.92 67.73 18.15 25.86 8.28 19.10 26.69 9.97 1et0_c02 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 12 hits 1et0_c02 naa= 3 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 1 3 # 1 A 34 GLU A 2 GLU.? 21.82 O ACY A 402 A 260 ARG C 42 ARG~? 8.34 CH3 ACY A 402 A 270 LYS A 54 LYS.? 19.07 O ACY A 402 coo 50.99 29.43 12.86 52.11 29.45 14.65 -6.06 7.32 -19.37 -7.28 7.04 -21.11 coo 39.80 27.50 22.98 42.20 26.56 21.34 1.71 20.80 -20.88 4.34 19.24 -20.78 coo 48.83 21.70 19.50 47.44 24.99 15.25 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 2 3 # 2 A 34 GLU A 43 GLU~? 17.21 O4 PO4 A 302 A 260 ARG D 42 ARG~? 11.96 OXT ACY B 401 A 270 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo 50.99 29.43 12.86 52.11 29.45 14.65 34.86 12.61 -16.78 35.59 13.22 -14.90 coo 39.80 27.50 22.98 42.20 26.56 21.34 32.58 20.13 -5.26 29.93 18.65 -5.63 coo 48.83 21.70 19.50 47.44 24.99 15.25 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 3 3 # 3 A 34 GLU A 44 GLU~? 15.81 O4 PO4 A 302 A 260 ARG D 42 ARG~? 11.96 OXT ACY B 401 A 270 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo 50.99 29.43 12.86 52.11 29.45 14.65 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 39.80 27.50 22.98 42.20 26.56 21.34 32.58 20.13 -5.26 29.93 18.65 -5.63 coo 48.83 21.70 19.50 47.44 24.99 15.25 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 4 3 # 4 A 34 GLU B 44 GLU~? 18.30 CH3 ACY B 403 A 260 ARG C 42 ARG~? 8.34 CH3 ACY A 402 A 270 LYS A 54 LYS.? 19.07 O ACY A 402 coo 50.99 29.43 12.86 52.11 29.45 14.65 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 39.80 27.50 22.98 42.20 26.56 21.34 1.71 20.80 -20.88 4.34 19.24 -20.78 coo 48.83 21.70 19.50 47.44 24.99 15.25 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 5 3 # 5 A 34 GLU C 2 GLU.? 25.10 O1 PO4 A 302 A 260 ARG A 42 ARG~? 9.50 O4 PO4 A 302 A 270 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo 50.99 29.43 12.86 52.11 29.45 14.65 40.20 31.59 -19.52 40.69 30.01 -20.87 coo 39.80 27.50 22.98 42.20 26.56 21.34 31.60 18.55 -22.55 28.82 19.89 -22.65 coo 48.83 21.70 19.50 47.44 24.99 15.25 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 6 3 # 6 A 34 GLU C 43 GLU~? 17.47 O ACY C 404 A 260 ARG B 42 ARG~? 8.81 CH3 ACY B 403 A 270 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 50.99 29.43 12.86 52.11 29.45 14.65 -1.82 27.43 -15.06 -1.58 27.20 -12.95 coo 39.80 27.50 22.98 42.20 26.56 21.34 2.83 20.50 -3.25 5.45 21.98 -3.93 coo 48.83 21.70 19.50 47.44 24.99 15.25 3.89 29.44 -7.86 -1.70 27.89 -10.01 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 7 3 # 7 A 34 GLU C 44 GLU~? 16.01 O ACY C 404 A 260 ARG B 42 ARG~? 8.81 CH3 ACY B 403 A 270 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 50.99 29.43 12.86 52.11 29.45 14.65 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 39.80 27.50 22.98 42.20 26.56 21.34 2.83 20.50 -3.25 5.45 21.98 -3.93 coo 48.83 21.70 19.50 47.44 24.99 15.25 3.89 29.44 -7.86 -1.70 27.89 -10.01 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 8 3 # 8 A 34 GLU D 2 GLU.? 23.79 O ACY C 404 A 260 ARG B 42 ARG~? 8.81 CH3 ACY B 403 A 270 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 50.99 29.43 12.86 52.11 29.45 14.65 -6.17 33.52 -9.55 -6.78 32.15 -11.04 coo 39.80 27.50 22.98 42.20 26.56 21.34 2.83 20.50 -3.25 5.45 21.98 -3.93 coo 48.83 21.70 19.50 47.44 24.99 15.25 3.89 29.44 -7.86 -1.70 27.89 -10.01 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 9 3 # 9 A 34 GLU D 43 GLU~? 22.18 O4 PO4 A 302 A 260 ARG A 42 ARG~? 9.50 O4 PO4 A 302 A 270 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo 50.99 29.43 12.86 52.11 29.45 14.65 36.87 25.85 -11.48 36.80 25.51 -13.56 coo 39.80 27.50 22.98 42.20 26.56 21.34 31.60 18.55 -22.55 28.82 19.89 -22.65 coo 48.83 21.70 19.50 47.44 24.99 15.25 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 10 3 # 10 A 34 GLU D 44 GLU~? 21.69 OXT ACY B 401 A 260 ARG A 42 ARG~? 9.50 O4 PO4 A 302 A 270 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo 50.99 29.43 12.86 52.11 29.45 14.65 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 39.80 27.50 22.98 42.20 26.56 21.34 31.60 18.55 -22.55 28.82 19.89 -22.65 coo 48.83 21.70 19.50 47.44 24.99 15.25 31.19 27.76 -19.03 36.53 26.17 -16.12 1euy_c00 source 1euy GLUTAMINYL-TRNA SYNTHETASE : 10 hits 1euy_c00 naa= 3 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 A 137 TYR A 6 TYR^? 17.89 O ACY A 402 A 142 LEU A 8 LEU^? 12.59 O3 PO4 A 302 A 165 LYS A 54 LYS.? 19.07 O ACY A 402 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 12.36 8.18 -18.40 10.67 7.43 -19.49 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 137 TYR A 6 TYR^? 17.89 O ACY A 402 A 142 LEU A 63 LEU~? 11.25 O ACY A 402 A 165 LYS A 54 LYS.? 19.07 O ACY A 402 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 8.22 6.46 -24.49 9.39 8.22 -24.37 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 A 137 TYR B 6 TYR^? 19.40 O ACY B 403 A 142 LEU B 8 LEU^? 11.94 O ACY B 403 A 165 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 20.45 8.27 -6.75 22.05 7.43 -5.62 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 A 137 TYR B 6 TYR^? 19.40 O ACY B 403 A 142 LEU B 63 LEU~? 13.38 OXT ACY B 401 A 165 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 24.65 7.08 -0.67 23.48 8.88 -1.06 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 5 3 # 5 A 137 TYR C 6 TYR^? 20.74 O2 GOL A 501 A 142 LEU C 63 LEU~? 13.02 CH3 ACY C 404 A 165 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 24.25 31.90 -26.84 23.13 30.15 -26.38 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 6 3 # 6 A 137 TYR D 6 TYR^? 18.56 CH3 ACY B 403 A 142 LEU D 8 LEU^? 13.41 CH3 ACY B 403 A 165 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 14.22 32.15 -7.19 12.95 33.21 -5.89 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 3.89 29.44 -7.86 -1.70 27.89 -10.01 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 7 3 # 7 A 137 TYR D 6 TYR^? 18.56 CH3 ACY B 403 A 142 LEU D 63 LEU~? 13.28 O ACY B 401 A 165 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 11.10 33.76 -0.50 12.13 31.84 -0.88 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 3.89 29.44 -7.86 -1.70 27.89 -10.01 1fdy_c00 source 1fdy N-ACETYLNEURAMINATE LYASE : 7 hits 1fdy_c00 naa= 3 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 B 137 TYR A 6 TYR^? 17.89 O ACY A 402 B 142 LEU A 63 LEU~? 11.25 O ACY A 402 B 165 LYS A 54 LYS.? 19.07 O ACY A 402 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 8.22 6.46 -24.49 9.39 8.22 -24.37 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 B 137 TYR B 6 TYR^? 19.40 O ACY B 403 B 142 LEU B 8 LEU^? 11.94 O ACY B 403 B 165 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 20.45 8.27 -6.75 22.05 7.43 -5.62 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 B 137 TYR C 6 TYR^? 20.74 O2 GOL A 501 B 142 LEU C 63 LEU~? 13.02 CH3 ACY C 404 B 165 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 24.25 31.90 -26.84 23.13 30.15 -26.38 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 B 137 TYR D 6 TYR^? 18.56 CH3 ACY B 403 B 142 LEU D 63 LEU~? 13.28 O ACY B 401 B 165 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 11.10 33.76 -0.50 12.13 31.84 -0.88 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 3.89 29.44 -7.86 -1.70 27.89 -10.01 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 5 3 # 5 B 137 TYR D 19 TYR~? 6.50 OXT ACY B 401 B 142 LEU D 25 LEU~? 11.82 CH3 ACY B 401 B 165 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 24.45 24.76 1.05 22.95 23.32 -0.81 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 15.59 30.25 3.78 15.06 32.26 4.26 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 26.90 28.52 7.20 25.78 33.34 9.99 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 6 3 # 6 B 137 TYR D 19 TYR~? 6.50 OXT ACY B 401 B 142 LEU D 26 LEU~? 6.85 O ACY B 401 B 165 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 24.45 24.76 1.05 22.95 23.32 -0.81 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 14.83 26.47 0.35 15.65 27.85 -1.15 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 26.90 28.52 7.20 25.78 33.34 9.99 1fdy_c01 source 1fdy N-ACETYLNEURAMINATE LYASE : 6 hits 1fdy_c01 naa= 3 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 C 137 TYR A 6 TYR^? 17.89 O ACY A 402 C 142 LEU A 63 LEU~? 11.25 O ACY A 402 C 165 LYS A 54 LYS.? 19.07 O ACY A 402 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 8.22 6.46 -24.49 9.39 8.22 -24.37 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 C 137 TYR C 6 TYR^? 20.74 O2 GOL A 501 C 142 LEU C 63 LEU~? 13.02 CH3 ACY C 404 C 165 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 24.25 31.90 -26.84 23.13 30.15 -26.38 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 C 137 TYR D 6 TYR^? 18.56 CH3 ACY B 403 C 142 LEU D 63 LEU~? 13.28 O ACY B 401 C 165 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 11.10 33.76 -0.50 12.13 31.84 -0.88 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 3.89 29.44 -7.86 -1.70 27.89 -10.01 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 C 137 TYR D 19 TYR~? 6.50 OXT ACY B 401 C 142 LEU D 25 LEU~? 11.82 CH3 ACY B 401 C 165 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 24.45 24.76 1.05 22.95 23.32 -0.81 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 15.59 30.25 3.78 15.06 32.26 4.26 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 26.90 28.52 7.20 25.78 33.34 9.99 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 5 3 # 5 C 137 TYR D 19 TYR~? 6.50 OXT ACY B 401 C 142 LEU D 26 LEU~? 6.85 O ACY B 401 C 165 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 24.45 24.76 1.05 22.95 23.32 -0.81 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 14.83 26.47 0.35 15.65 27.85 -1.15 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 26.90 28.52 7.20 25.78 33.34 9.99 1fdy_c02 source 1fdy N-ACETYLNEURAMINATE LYASE : 5 hits 1fdy_c02 naa= 3 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 D 137 TYR A 6 TYR^? 17.89 O ACY A 402 D 142 LEU A 63 LEU~? 11.25 O ACY A 402 D 165 LYS A 54 LYS.? 19.07 O ACY A 402 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 8.22 6.46 -24.49 9.39 8.22 -24.37 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 D 137 TYR B 6 TYR^? 19.40 O ACY B 403 D 142 LEU B 8 LEU^? 11.94 O ACY B 403 D 165 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 20.45 8.27 -6.75 22.05 7.43 -5.62 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 D 137 TYR C 6 TYR^? 20.74 O2 GOL A 501 D 142 LEU C 63 LEU~? 13.02 CH3 ACY C 404 D 165 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 24.25 31.90 -26.84 23.13 30.15 -26.38 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 D 137 TYR D 6 TYR^? 18.56 CH3 ACY B 403 D 142 LEU D 63 LEU~? 13.28 O ACY B 401 D 165 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 11.10 33.76 -0.50 12.13 31.84 -0.88 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 3.89 29.44 -7.86 -1.70 27.89 -10.01 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 5 3 # 5 D 137 TYR D 19 TYR~? 6.50 OXT ACY B 401 D 142 LEU D 25 LEU~? 11.82 CH3 ACY B 401 D 165 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 24.45 24.76 1.05 22.95 23.32 -0.81 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 15.59 30.25 3.78 15.06 32.26 4.26 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 26.90 28.52 7.20 25.78 33.34 9.99 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 6 3 # 6 D 137 TYR D 19 TYR~? 6.50 OXT ACY B 401 D 142 LEU D 26 LEU~? 6.85 O ACY B 401 D 165 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 24.45 24.76 1.05 22.95 23.32 -0.81 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 14.83 26.47 0.35 15.65 27.85 -1.15 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 26.90 28.52 7.20 25.78 33.34 9.99 1fdy_c03 source 1fdy N-ACETYLNEURAMINATE LYASE : 6 hits 1fdy_c03 naa= 3 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 B 317 GLU B 13 GLU^? 15.77 O ACY B 403 B 319 ASP B 14 ASP.? 10.32 CH3 ACY B 403 B 359 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo 10.77 13.13 40.94 11.03 14.73 39.51 4.71 8.41 0.32 2.63 9.02 0.18 coo 3.77 12.64 38.21 3.35 14.53 37.39 4.45 14.77 1.64 4.87 15.68 -0.19 coo -1.16 15.32 35.60 -3.32 13.56 36.98 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 # 2 B 317 GLU B 16 GLU~? 16.20 CH3 ACY B 401 B 319 ASP B 14 ASP.? 10.32 CH3 ACY B 403 B 359 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo 10.77 13.13 40.94 11.03 14.73 39.51 6.77 16.82 9.46 6.30 17.54 11.41 coo 3.77 12.64 38.21 3.35 14.53 37.39 4.45 14.77 1.64 4.87 15.68 -0.19 coo -1.16 15.32 35.60 -3.32 13.56 36.98 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 3 3 # 3 B 317 GLU C 13 GLU^? 12.93 O ACY C 404 B 319 ASP C 14 ASP.? 7.62 O ACY C 404 B 359 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo 10.77 13.13 40.94 11.03 14.73 39.51 5.05 33.44 -24.76 4.47 35.34 -25.49 coo 3.77 12.64 38.21 3.35 14.53 37.39 3.61 26.88 -25.47 3.45 24.89 -26.21 coo -1.16 15.32 35.60 -3.32 13.56 36.98 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 4 3 # 4 B 317 GLU D 13 GLU^? 19.04 OXT ACY B 401 B 319 ASP D 14 ASP.? 10.51 OXT ACY B 401 B 359 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo 10.77 13.13 40.94 11.03 14.73 39.51 29.88 33.09 -1.63 31.17 34.65 -1.02 coo 3.77 12.64 38.21 3.35 14.53 37.39 29.91 25.87 -1.90 28.44 24.29 -2.10 coo -1.16 15.32 35.60 -3.32 13.56 36.98 32.58 20.13 -5.26 29.93 18.65 -5.63 1fr8_c01 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 4 hits 1fr8_c01 naa= 3 ULMN 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 # 1 B 106 ASN A 23 ASN~? 3.23 O3 PO4 A 302s B 108 HIS C 27 HIS~? 7.34 O1 PO4 A 302 B 144 ASP A 14 ASP.? 7.78 O4 PO4 A 302 coo 36.64 101.02 13.15 38.55 101.84 12.78 16.56 14.98 -29.71 17.96 15.58 -28.25 coo 41.00 107.18 12.86 42.70 107.82 11.96 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 31.60 110.69 6.14 29.69 109.74 5.94 28.88 11.61 -26.71 29.05 13.35 -27.94 ULMN 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 2 3 # 2 B 106 ASN B 23 ASN~? 4.38 CH3 ACY B 401 B 108 HIS D 27 HIS~? 8.84 CH3 ACY B 401 B 144 ASP B 14 ASP.? 10.32 CH3 ACY B 403 coo 36.64 101.02 13.15 38.55 101.84 12.78 16.95 16.62 4.13 15.59 17.22 2.56 coo 41.00 107.18 12.86 42.70 107.82 11.96 12.53 22.86 5.89 11.39 21.93 7.39 coo 31.60 110.69 6.14 29.69 109.74 5.94 4.45 14.77 1.64 4.87 15.68 -0.19 ULMN 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 3 3 # 3 B 106 ASN C 23 ASN~? 3.34 CH3 ACY C 404s B 108 HIS A 27 HIS~? -3.83 OXT ACY A 402s B 144 ASP C 14 ASP.? 7.62 O ACY C 404 coo 36.64 101.02 13.15 38.55 101.84 12.78 15.33 22.92 -30.05 14.25 22.35 -28.34 coo 41.00 107.18 12.86 42.70 107.82 11.96 9.52 16.92 -31.25 8.29 18.47 -31.94 coo 31.60 110.69 6.14 29.69 109.74 5.94 3.61 26.88 -25.47 3.45 24.89 -26.21 ULMN 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 4 3 # 4 B 106 ASN D 23 ASN~? 4.18 CH3 ACY B 401 B 108 HIS B 27 HIS~? 8.91 CH3 ACY B 401 B 144 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 36.64 101.02 13.15 38.55 101.84 12.78 19.37 24.14 3.44 20.48 23.43 1.80 coo 41.00 107.18 12.86 42.70 107.82 11.96 24.22 18.07 5.55 25.63 19.33 6.45 coo 31.60 110.69 6.14 29.69 109.74 5.94 29.91 25.87 -1.90 28.44 24.29 -2.10 1grc_c03 source 1grc GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMYLASE (E.C: 4 hits 1grc_c03 naa= 3 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 1 3 # 1 160 LYS A 17 LYS~? 14.12 O3 PO4 A 302 210 ARG C 36 ARG^? -3.18 C2 GOL A 501s 225 ARG A 36 ARG^? 3.17 O2 GOL A 501s coo 17.51 28.50 73.42 17.24 23.02 75.86 22.94 9.69 -34.22 22.50 4.31 -36.79 coo 24.74 11.56 73.05 25.29 14.32 71.80 18.67 22.17 -22.86 17.03 22.41 -25.46 coo 27.81 15.44 77.10 25.66 16.50 75.19 14.40 16.71 -22.33 15.78 16.00 -25.01 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 2 3 # 2 160 LYS B 17 LYS~? 19.82 CH3 ACY B 401 210 ARG B 36 ARG^? 3.17 C ACY B 401s 225 ARG D 36 ARG^? 3.12 O ACY B 401s coo 17.51 28.50 73.42 17.24 23.02 75.86 10.28 12.10 9.11 8.33 8.93 13.61 coo 24.74 11.56 73.05 25.29 14.32 71.80 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 27.81 15.44 77.10 25.66 16.50 75.19 15.90 23.27 -3.56 17.50 23.47 -0.92 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 3 3 # 3 160 LYS B 17 LYS~? 19.82 CH3 ACY B 401 210 ARG D 36 ARG^? 3.12 O ACY B 401s 225 ARG B 36 ARG^? 3.17 C ACY B 401s coo 17.51 28.50 73.42 17.24 23.02 75.86 10.28 12.10 9.11 8.33 8.93 13.61 coo 24.74 11.56 73.05 25.29 14.32 71.80 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 27.81 15.44 77.10 25.66 16.50 75.19 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 4 3 # 4 160 LYS C 17 LYS~? 14.11 CH3 ACY C 404 210 ARG A 36 ARG^? 3.17 O2 GOL A 501s 225 ARG C 36 ARG^? -3.18 C2 GOL A 501s coo 17.51 28.50 73.42 17.24 23.02 75.86 8.25 27.86 -34.26 8.79 32.54 -37.59 coo 24.74 11.56 73.05 25.29 14.32 71.80 14.40 16.71 -22.33 15.78 16.00 -25.01 coo 27.81 15.44 77.10 25.66 16.50 75.19 18.67 22.17 -22.86 17.03 22.41 -25.46 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 5 3 # 5 160 LYS C 17 LYS~? 14.11 CH3 ACY C 404 210 ARG C 36 ARG^? -3.18 C2 GOL A 501s 225 ARG A 36 ARG^? 3.17 O2 GOL A 501s coo 17.51 28.50 73.42 17.24 23.02 75.86 8.25 27.86 -34.26 8.79 32.54 -37.59 coo 24.74 11.56 73.05 25.29 14.32 71.80 18.67 22.17 -22.86 17.03 22.41 -25.46 coo 27.81 15.44 77.10 25.66 16.50 75.19 14.40 16.71 -22.33 15.78 16.00 -25.01 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 6 3 # 6 160 LYS D 17 LYS~? 17.87 CH3 ACY B 401 210 ARG B 36 ARG^? 3.17 C ACY B 401s 225 ARG D 36 ARG^? 3.12 O ACY B 401s coo 17.51 28.50 73.42 17.24 23.02 75.86 26.90 28.52 7.20 25.78 33.34 9.99 coo 24.74 11.56 73.05 25.29 14.32 71.80 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 27.81 15.44 77.10 25.66 16.50 75.19 15.90 23.27 -3.56 17.50 23.47 -0.92 1gsa_c00 source 1gsa GLUTATHIONE SYNTHETASE : 6 hits 1gsa_c00 naa= 3 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 A 189 PHE B 29 PHE~? 13.95 OXT ACY B 401 A 298 ASP B 58 ASP~? 24.69 OXT ACY B 401 A 329 LYS B 3 LYS.? 19.35 OXT ACY B 401 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 26.40 10.51 1.39 26.72 8.16 2.92 coo 2.59 0.29 25.55 4.65 0.18 25.07 33.22 2.96 0.74 34.69 1.59 1.17 coo 12.42 6.10 23.27 9.95 1.57 20.16 35.65 7.25 -8.40 36.12 12.24 -4.67 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 A 189 PHE B 29 PHE~? 13.95 OXT ACY B 401 A 298 ASP B 58 ASP~? 24.69 OXT ACY B 401 A 329 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 26.40 10.51 1.39 26.72 8.16 2.92 coo 2.59 0.29 25.55 4.65 0.18 25.07 33.22 2.96 0.74 34.69 1.59 1.17 coo 12.42 6.10 23.27 9.95 1.57 20.16 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 A 189 PHE C 29 PHE~? 13.92 O3 GOL A 501 A 298 ASP C 58 ASP~? 25.07 O3 GOL A 501 A 329 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 2.59 0.29 25.55 4.65 0.18 25.07 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 12.42 6.10 23.27 9.95 1.57 20.16 35.92 31.10 -19.94 35.74 27.15 -23.97 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 4 3 # 4 A 189 PHE C 29 PHE~? 13.92 O3 GOL A 501 A 298 ASP C 58 ASP~? 25.07 O3 GOL A 501 A 329 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 2.59 0.29 25.55 4.65 0.18 25.07 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 12.42 6.10 23.27 9.95 1.57 20.16 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 5 3 # 5 A 189 PHE D 29 PHE~? 13.75 O ACY B 401 A 298 ASP D 58 ASP~? 23.91 CH3 ACY B 403 A 329 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 9.63 30.41 1.98 9.49 32.86 3.31 coo 2.59 0.29 25.55 4.65 0.18 25.07 2.43 37.89 1.30 0.84 39.23 1.50 coo 12.42 6.10 23.27 9.95 1.57 20.16 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 6 3 # 6 A 189 PHE D 29 PHE~? 13.75 O ACY B 401 A 298 ASP D 58 ASP~? 23.91 CH3 ACY B 403 A 329 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 9.63 30.41 1.98 9.49 32.86 3.31 coo 2.59 0.29 25.55 4.65 0.18 25.07 2.43 37.89 1.30 0.84 39.23 1.50 coo 12.42 6.10 23.27 9.95 1.57 20.16 3.89 29.44 -7.86 -1.70 27.89 -10.01 1gtx_c00 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 6 hits 1gtx_c00 naa= 3 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 B 189 PHE B 29 PHE~? 13.95 OXT ACY B 401 B 298 ASP B 58 ASP~? 24.69 OXT ACY B 401 B 329 LYS B 3 LYS.? 19.35 OXT ACY B 401 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 26.40 10.51 1.39 26.72 8.16 2.92 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 33.22 2.96 0.74 34.69 1.59 1.17 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 35.65 7.25 -8.40 36.12 12.24 -4.67 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 B 189 PHE B 29 PHE~? 13.95 OXT ACY B 401 B 298 ASP B 58 ASP~? 24.69 OXT ACY B 401 B 329 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 26.40 10.51 1.39 26.72 8.16 2.92 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 33.22 2.96 0.74 34.69 1.59 1.17 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 B 189 PHE C 29 PHE~? 13.92 O3 GOL A 501 B 298 ASP C 58 ASP~? 25.07 O3 GOL A 501 B 329 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 35.92 31.10 -19.94 35.74 27.15 -23.97 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 4 3 # 4 B 189 PHE C 29 PHE~? 13.92 O3 GOL A 501 B 298 ASP C 58 ASP~? 25.07 O3 GOL A 501 B 329 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 5 3 # 5 B 189 PHE D 29 PHE~? 13.75 O ACY B 401 B 298 ASP D 58 ASP~? 23.91 CH3 ACY B 403 B 329 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 9.63 30.41 1.98 9.49 32.86 3.31 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 2.43 37.89 1.30 0.84 39.23 1.50 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 6 3 # 6 B 189 PHE D 29 PHE~? 13.75 O ACY B 401 B 298 ASP D 58 ASP~? 23.91 CH3 ACY B 403 B 329 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 9.63 30.41 1.98 9.49 32.86 3.31 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 2.43 37.89 1.30 0.84 39.23 1.50 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 3.89 29.44 -7.86 -1.70 27.89 -10.01 1gtx_c01 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 6 hits 1gtx_c01 naa= 3 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 C 189 PHE B 29 PHE~? 13.95 OXT ACY B 401 C 298 ASP B 58 ASP~? 24.69 OXT ACY B 401 C 329 LYS B 3 LYS.? 19.35 OXT ACY B 401 coo 17.41 60.57 64.39 18.40 58.12 65.34 26.40 10.51 1.39 26.72 8.16 2.92 coo 24.10 66.43 63.33 24.18 64.30 63.40 33.22 2.96 0.74 34.69 1.59 1.17 coo 27.64 56.61 58.17 22.18 57.92 60.36 35.65 7.25 -8.40 36.12 12.24 -4.67 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 C 189 PHE B 29 PHE~? 13.95 OXT ACY B 401 C 298 ASP B 58 ASP~? 24.69 OXT ACY B 401 C 329 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo 17.41 60.57 64.39 18.40 58.12 65.34 26.40 10.51 1.39 26.72 8.16 2.92 coo 24.10 66.43 63.33 24.18 64.30 63.40 33.22 2.96 0.74 34.69 1.59 1.17 coo 27.64 56.61 58.17 22.18 57.92 60.36 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 C 189 PHE C 29 PHE~? 13.92 O3 GOL A 501 C 298 ASP C 58 ASP~? 25.07 O3 GOL A 501 C 329 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 17.41 60.57 64.39 18.40 58.12 65.34 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 24.10 66.43 63.33 24.18 64.30 63.40 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 27.64 56.61 58.17 22.18 57.92 60.36 35.92 31.10 -19.94 35.74 27.15 -23.97 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 4 3 # 4 C 189 PHE C 29 PHE~? 13.92 O3 GOL A 501 C 298 ASP C 58 ASP~? 25.07 O3 GOL A 501 C 329 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo 17.41 60.57 64.39 18.40 58.12 65.34 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 24.10 66.43 63.33 24.18 64.30 63.40 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 27.64 56.61 58.17 22.18 57.92 60.36 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 5 3 # 5 C 189 PHE D 29 PHE~? 13.75 O ACY B 401 C 298 ASP D 58 ASP~? 23.91 CH3 ACY B 403 C 329 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo 17.41 60.57 64.39 18.40 58.12 65.34 9.63 30.41 1.98 9.49 32.86 3.31 coo 24.10 66.43 63.33 24.18 64.30 63.40 2.43 37.89 1.30 0.84 39.23 1.50 coo 27.64 56.61 58.17 22.18 57.92 60.36 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 6 3 # 6 C 189 PHE D 29 PHE~? 13.75 O ACY B 401 C 298 ASP D 58 ASP~? 23.91 CH3 ACY B 403 C 329 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 17.41 60.57 64.39 18.40 58.12 65.34 9.63 30.41 1.98 9.49 32.86 3.31 coo 24.10 66.43 63.33 24.18 64.30 63.40 2.43 37.89 1.30 0.84 39.23 1.50 coo 27.64 56.61 58.17 22.18 57.92 60.36 3.89 29.44 -7.86 -1.70 27.89 -10.01 1gtx_c02 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 6 hits 1gtx_c02 naa= 3 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 D 189 PHE B 29 PHE~? 13.95 OXT ACY B 401 D 298 ASP B 58 ASP~? 24.69 OXT ACY B 401 D 329 LYS B 3 LYS.? 19.35 OXT ACY B 401 coo 35.44 53.35 83.81 35.65 54.53 81.28 26.40 10.51 1.39 26.72 8.16 2.92 coo 29.72 46.46 83.60 30.79 47.36 81.99 33.22 2.96 0.74 34.69 1.59 1.17 coo 36.89 44.91 74.55 37.33 48.94 79.01 35.65 7.25 -8.40 36.12 12.24 -4.67 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 D 189 PHE B 29 PHE~? 13.95 OXT ACY B 401 D 298 ASP B 58 ASP~? 24.69 OXT ACY B 401 D 329 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo 35.44 53.35 83.81 35.65 54.53 81.28 26.40 10.51 1.39 26.72 8.16 2.92 coo 29.72 46.46 83.60 30.79 47.36 81.99 33.22 2.96 0.74 34.69 1.59 1.17 coo 36.89 44.91 74.55 37.33 48.94 79.01 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 D 189 PHE C 29 PHE~? 13.92 O3 GOL A 501 D 298 ASP C 58 ASP~? 25.07 O3 GOL A 501 D 329 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 35.44 53.35 83.81 35.65 54.53 81.28 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 29.72 46.46 83.60 30.79 47.36 81.99 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 36.89 44.91 74.55 37.33 48.94 79.01 35.92 31.10 -19.94 35.74 27.15 -23.97 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 4 3 # 4 D 189 PHE C 29 PHE~? 13.92 O3 GOL A 501 D 298 ASP C 58 ASP~? 25.07 O3 GOL A 501 D 329 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo 35.44 53.35 83.81 35.65 54.53 81.28 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 29.72 46.46 83.60 30.79 47.36 81.99 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 36.89 44.91 74.55 37.33 48.94 79.01 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 5 3 # 5 D 189 PHE D 29 PHE~? 13.75 O ACY B 401 D 298 ASP D 58 ASP~? 23.91 CH3 ACY B 403 D 329 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo 35.44 53.35 83.81 35.65 54.53 81.28 9.63 30.41 1.98 9.49 32.86 3.31 coo 29.72 46.46 83.60 30.79 47.36 81.99 2.43 37.89 1.30 0.84 39.23 1.50 coo 36.89 44.91 74.55 37.33 48.94 79.01 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 6 3 # 6 D 189 PHE D 29 PHE~? 13.75 O ACY B 401 D 298 ASP D 58 ASP~? 23.91 CH3 ACY B 403 D 329 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 35.44 53.35 83.81 35.65 54.53 81.28 9.63 30.41 1.98 9.49 32.86 3.31 coo 29.72 46.46 83.60 30.79 47.36 81.99 2.43 37.89 1.30 0.84 39.23 1.50 coo 36.89 44.91 74.55 37.33 48.94 79.01 3.89 29.44 -7.86 -1.70 27.89 -10.01 1gtx_c03 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 6 hits 1gtx_c03 naa= 3 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 1 3 # 1 A 50 ASP A 56 ASP~? 17.92 O ACY A 402 A 327 GLU C 2 GLU.? 25.10 O1 PO4 A 302 A 339 ARG C 4 ARG^? 26.01 O3 GOL A 501 coo 85.81 57.99 116.01 86.03 55.86 115.89 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 75.11 41.01 160.30 76.65 40.06 161.41 40.20 31.59 -19.52 40.69 30.01 -20.87 coo 82.23 40.35 159.87 85.09 40.67 161.01 32.96 35.53 -16.77 35.10 36.37 -18.83 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 2 3 # 2 A 50 ASP A 56 ASP~? 17.92 O ACY A 402 A 327 GLU D 16 GLU~? 15.82 CH3 ACY B 401 A 339 ARG D 15 ARG~? 18.11 CH3 ACY B 401 coo 85.81 57.99 116.01 86.03 55.86 115.89 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 75.11 41.01 160.30 76.65 40.06 161.41 29.82 25.98 8.07 29.78 25.08 10.01 coo 82.23 40.35 159.87 85.09 40.67 161.01 31.29 30.80 4.15 30.20 33.45 3.07 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 3 3 # 3 A 50 ASP A 58 ASP~? 21.11 O ACY A 402 A 327 GLU C 2 GLU.? 25.10 O1 PO4 A 302 A 339 ARG C 4 ARG^? 26.01 O3 GOL A 501 coo 85.81 57.99 116.01 86.03 55.86 115.89 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 75.11 41.01 160.30 76.65 40.06 161.41 40.20 31.59 -19.52 40.69 30.01 -20.87 coo 82.23 40.35 159.87 85.09 40.67 161.01 32.96 35.53 -16.77 35.10 36.37 -18.83 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 4 3 # 4 A 50 ASP A 58 ASP~? 21.11 O ACY A 402 A 327 GLU D 13 GLU^? 19.04 OXT ACY B 401 A 339 ARG D 74 ARG^? 19.24 OXT ACY B 401 coo 85.81 57.99 116.01 86.03 55.86 115.89 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 75.11 41.01 160.30 76.65 40.06 161.41 29.88 33.09 -1.63 31.17 34.65 -1.02 coo 82.23 40.35 159.87 85.09 40.67 161.01 25.93 38.34 -6.34 26.99 36.29 -8.39 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 5 3 # 5 A 50 ASP A 58 ASP~? 21.11 O ACY A 402 A 327 GLU D 16 GLU~? 15.82 CH3 ACY B 401 A 339 ARG D 20 ARG~? 14.11 CH3 ACY B 401 coo 85.81 57.99 116.01 86.03 55.86 115.89 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 75.11 41.01 160.30 76.65 40.06 161.41 29.82 25.98 8.07 29.78 25.08 10.01 coo 82.23 40.35 159.87 85.09 40.67 161.01 23.40 25.12 9.78 26.24 26.16 10.42 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 6 3 # 6 A 50 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 327 GLU D 2 GLU.? 23.79 O ACY C 404 A 339 ARG D 4 ARG^? 20.82 O ACY C 404 coo 85.81 57.99 116.01 86.03 55.86 115.89 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 75.11 41.01 160.30 76.65 40.06 161.41 -6.17 33.52 -9.55 -6.78 32.15 -11.04 coo 82.23 40.35 159.87 85.09 40.67 161.01 0.89 37.39 -10.49 3.60 38.49 -11.58 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 7 3 # 7 A 50 ASP B 58 ASP~? 24.69 OXT ACY B 401 A 327 GLU C 13 GLU^? 12.93 O ACY C 404 A 339 ARG C 74 ARG^? 14.08 O ACY C 404 coo 85.81 57.99 116.01 86.03 55.86 115.89 33.22 2.96 0.74 34.69 1.59 1.17 coo 75.11 41.01 160.30 76.65 40.06 161.41 5.05 33.44 -24.76 4.47 35.34 -25.49 coo 82.23 40.35 159.87 85.09 40.67 161.01 9.75 38.11 -21.77 8.89 36.86 -19.09 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 8 3 # 8 A 50 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 327 GLU A 2 GLU.? 21.82 O ACY A 402 A 339 ARG A 4 ARG^? 24.06 O ACY A 402 coo 85.81 57.99 116.01 86.03 55.86 115.89 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 75.11 41.01 160.30 76.65 40.06 161.41 -6.06 7.32 -19.37 -7.28 7.04 -21.11 coo 82.23 40.35 159.87 85.09 40.67 161.01 -0.63 4.22 -13.49 -1.22 1.31 -14.35 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 9 3 # 9 A 50 ASP C 58 ASP~? 25.07 O3 GOL A 501 A 327 GLU A 2 GLU.? 21.82 O ACY A 402 A 339 ARG A 4 ARG^? 24.06 O ACY A 402 coo 85.81 57.99 116.01 86.03 55.86 115.89 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 75.11 41.01 160.30 76.65 40.06 161.41 -6.06 7.32 -19.37 -7.28 7.04 -21.11 coo 82.23 40.35 159.87 85.09 40.67 161.01 -0.63 4.22 -13.49 -1.22 1.31 -14.35 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 10 3 # 10 A 50 ASP C 58 ASP~? 25.07 O3 GOL A 501 A 327 GLU B 13 GLU^? 15.77 O ACY B 403 A 339 ARG B 74 ARG^? 16.09 O ACY B 403 coo 85.81 57.99 116.01 86.03 55.86 115.89 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 75.11 41.01 160.30 76.65 40.06 161.41 4.71 8.41 0.32 2.63 9.02 0.18 coo 82.23 40.35 159.87 85.09 40.67 161.01 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 11 3 # 11 A 50 ASP C 58 ASP~? 25.07 O3 GOL A 501 A 327 GLU B 16 GLU~? 16.20 CH3 ACY B 401 A 339 ARG B 20 ARG~? 14.42 CH3 ACY B 401 coo 85.81 57.99 116.01 86.03 55.86 115.89 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 75.11 41.01 160.30 76.65 40.06 161.41 6.77 16.82 9.46 6.30 17.54 11.41 coo 82.23 40.35 159.87 85.09 40.67 161.01 14.16 15.78 11.00 13.60 12.97 12.19 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 12 3 # 12 A 50 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 327 GLU A 16 GLU~? 11.52 O1 PO4 A 302 A 339 ARG A 15 ARG~? 13.13 O4 PO4 A 302 coo 85.81 57.99 116.01 86.03 55.86 115.89 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 75.11 41.01 160.30 76.65 40.06 161.41 27.41 13.54 -34.49 28.46 13.63 -36.35 coo 82.23 40.35 159.87 85.09 40.67 161.01 26.96 5.75 -30.48 27.16 2.82 -29.53 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 13 3 # 13 A 50 ASP D 58 ASP~? 23.91 CH3 ACY B 403 A 327 GLU A 13 GLU^? 12.48 O4 PO4 A 302 A 339 ARG A 74 ARG^? 14.15 O4 PO4 A 302 coo 85.81 57.99 116.01 86.03 55.86 115.89 2.43 37.89 1.30 0.84 39.23 1.50 coo 75.11 41.01 160.30 76.65 40.06 161.41 27.35 5.02 -24.86 28.03 3.18 -25.64 coo 82.23 40.35 159.87 85.09 40.67 161.01 23.62 1.58 -20.34 24.34 2.38 -17.47 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 14 3 # 14 A 50 ASP D 58 ASP~? 23.91 CH3 ACY B 403 A 327 GLU A 16 GLU~? 11.52 O1 PO4 A 302 A 339 ARG A 20 ARG~? 11.30 O1 PO4 A 302 coo 85.81 57.99 116.01 86.03 55.86 115.89 2.43 37.89 1.30 0.84 39.23 1.50 coo 75.11 41.01 160.30 76.65 40.06 161.41 27.41 13.54 -34.49 28.46 13.63 -36.35 coo 82.23 40.35 159.87 85.09 40.67 161.01 19.43 13.50 -36.40 19.41 10.58 -37.42 1hto_c00 source 1hto GLUTAMINE SYNTHETASE : 14 hits 1hto_c00 naa= 3 ULMN 3 1i29_c03 CSDB user 1 3 # 1 A 128 VAL C 22 VAL~? 4.72 CH3 ACY C 404 A 200 ASP C 14 ASP.? 7.62 O ACY C 404 A 226 LYS D 81 LYS.? 19.75 O ACY C 404 coo 19.13 38.05 1.41 19.72 38.80 -0.53 15.39 27.76 -29.43 14.55 28.26 -27.42 coo 24.51 43.28 11.18 25.17 44.50 9.58 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 34.47 51.09 7.19 28.58 51.18 7.53 4.59 37.20 -16.29 4.16 41.27 -17.63 1i29_c03 source 1i29 CSDB : 1 hits 1i29_c03 naa= 3 ULMN 3 1idt_c00 MINOR FMN-DEPENDENT NITROREDUCTASE user 1 3 # 1 A 14 LYS D 3 LYS.? 18.33 CH3 ACY B 403 A 74 LYS D 54 LYS.? 18.95 CH3 ACY B 403 A 165 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo 25.34 -34.49 45.28 21.58 -36.23 48.72 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 27.69 -28.18 47.27 24.45 -33.01 49.69 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 15.58 -28.67 55.46 14.00 -29.94 56.12 -1.81 16.10 -9.11 -1.93 15.47 -11.12 1idt_c00 source 1idt MINOR FMN-DEPENDENT NITROREDUCTASE : 1 hits 1idt_c00 naa= 3 ULMN 3 1idt_c01 MINOR FMN-DEPENDENT NITROREDUCTASE user 1 3 # 1 B 14 LYS D 3 LYS.? 18.33 CH3 ACY B 403 B 74 LYS D 54 LYS.? 18.95 CH3 ACY B 403 B 165 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo -11.70 -18.16 41.28 -8.37 -16.95 44.27 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo -14.25 -24.10 43.55 -12.53 -18.94 44.42 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo -3.83 -22.11 54.11 -2.14 -20.82 54.20 -1.81 16.10 -9.11 -1.93 15.47 -11.12 ULMN 3 1idt_c01 MINOR FMN-DEPENDENT NITROREDUCTASE user 2 3 # 2 B 14 LYS D 54 LYS.? 18.95 CH3 ACY B 403 B 74 LYS D 3 LYS.? 18.33 CH3 ACY B 403 B 165 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo -11.70 -18.16 41.28 -8.37 -16.95 44.27 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo -14.25 -24.10 43.55 -12.53 -18.94 44.42 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo -3.83 -22.11 54.11 -2.14 -20.82 54.20 -1.81 16.10 -9.11 -1.93 15.47 -11.12 1idt_c01 source 1idt MINOR FMN-DEPENDENT NITROREDUCTASE : 2 hits 1idt_c01 naa= 3 ULMN 3 1ig8_c00 HEXOKINASE PII user 1 3 # 1 A 158 SER A 30 SER.? -4.23 CH3 ACY A 402s A 173 ARG C 36 ARG^? -3.18 C2 GOL A 501s A 211 ASP A 32 ASP.? 10.92 O ACY A 402 coo 22.72 76.24 0.23 24.60 76.86 -1.25 6.58 16.18 -25.41 6.11 17.58 -27.30 coo 18.77 77.82 11.69 20.55 80.22 10.73 18.67 22.17 -22.86 17.03 22.41 -25.46 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 3.75 12.55 -21.98 2.34 11.90 -23.40 ULMN 3 1ig8_c00 HEXOKINASE PII user 2 3 # 2 A 158 SER B 30 SER.? 9.89 OXT ACY B 401 A 173 ARG D 36 ARG^? 3.12 O ACY B 401s A 211 ASP B 32 ASP.? 15.94 OXT ACY B 401 coo 22.72 76.24 0.23 24.60 76.86 -1.25 27.11 16.51 -0.32 27.88 17.99 1.39 coo 18.77 77.82 11.69 20.55 80.22 10.73 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 30.64 12.55 -3.88 32.46 12.19 -2.91 ULMN 3 1ig8_c00 HEXOKINASE PII user 3 3 # 3 A 158 SER C 30 SER.? 7.40 O1 PO4 A 302 A 173 ARG A 36 ARG^? 3.17 O2 GOL A 501s A 211 ASP C 32 ASP.? 15.02 O1 PO4 A 302 coo 22.72 76.24 0.23 24.60 76.86 -1.25 25.81 22.61 -26.89 26.10 20.85 -28.49 coo 18.77 77.82 11.69 20.55 80.22 10.73 14.40 16.71 -22.33 15.78 16.00 -25.01 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 29.38 26.56 -24.17 30.67 26.95 -25.70 ULMN 3 1ig8_c00 HEXOKINASE PII user 4 3 # 4 A 158 SER D 30 SER.? 8.07 CH3 ACY B 403 A 173 ARG B 36 ARG^? 3.17 C ACY B 401s A 211 ASP D 32 ASP.? 14.33 CH3 ACY B 403 coo 22.72 76.24 0.23 24.60 76.86 -1.25 8.81 24.50 0.42 8.52 22.82 2.10 coo 18.77 77.82 11.69 20.55 80.22 10.73 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 4.73 28.33 -3.00 2.76 28.70 -2.23 1ig8_c00 source 1ig8 HEXOKINASE PII : 4 hits 1ig8_c00 naa= 3 ULMN 3 1iph_c00 CATALASE HPII user 1 3 # 1 A 128 HIS A 27 HIS~? -3.83 OXT ACY A 402s A 167 SER A 30 SER.? -4.23 CH3 ACY A 402s A 201 ASN A 23 ASN~? 3.23 O3 PO4 A 302s coo 12.95 4.49 19.05 14.87 4.39 19.77 9.52 16.92 -31.25 8.29 18.47 -31.94 coo 10.44 7.96 22.51 12.16 7.57 20.82 6.58 16.18 -25.41 6.11 17.58 -27.30 coo 19.43 6.74 22.83 19.09 5.15 21.60 16.56 14.98 -29.71 17.96 15.58 -28.25 ULMN 3 1iph_c00 CATALASE HPII user 2 3 # 2 A 128 HIS A 27 HIS~? -3.83 OXT ACY A 402s A 167 SER A 30 SER.? -4.23 CH3 ACY A 402s A 201 ASN A 28 ASN~? 9.25 OXT ACY A 402 coo 12.95 4.49 19.05 14.87 4.39 19.77 9.52 16.92 -31.25 8.29 18.47 -31.94 coo 10.44 7.96 22.51 12.16 7.57 20.82 6.58 16.18 -25.41 6.11 17.58 -27.30 coo 19.43 6.74 22.83 19.09 5.15 21.60 7.12 11.54 -30.87 7.65 11.60 -32.93 ULMN 3 1iph_c00 CATALASE HPII user 3 3 # 3 A 128 HIS B 27 HIS~? 8.91 CH3 ACY B 401 A 167 SER B 30 SER.? 9.89 OXT ACY B 401 A 201 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo 12.95 4.49 19.05 14.87 4.39 19.77 24.22 18.07 5.55 25.63 19.33 6.45 coo 10.44 7.96 22.51 12.16 7.57 20.82 27.11 16.51 -0.32 27.88 17.99 1.39 coo 19.43 6.74 22.83 19.09 5.15 21.60 16.95 16.62 4.13 15.59 17.22 2.56 ULMN 3 1iph_c00 CATALASE HPII user 4 3 # 4 A 128 HIS C 27 HIS~? 7.34 O1 PO4 A 302 A 167 SER C 30 SER.? 7.40 O1 PO4 A 302 A 201 ASN C 23 ASN~? 3.34 CH3 ACY C 404s coo 12.95 4.49 19.05 14.87 4.39 19.77 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 10.44 7.96 22.51 12.16 7.57 20.82 25.81 22.61 -26.89 26.10 20.85 -28.49 coo 19.43 6.74 22.83 19.09 5.15 21.60 15.33 22.92 -30.05 14.25 22.35 -28.34 ULMN 3 1iph_c00 CATALASE HPII user 5 3 # 5 A 128 HIS D 27 HIS~? 8.84 CH3 ACY B 401 A 167 SER D 30 SER.? 8.07 CH3 ACY B 403 A 201 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo 12.95 4.49 19.05 14.87 4.39 19.77 12.53 22.86 5.89 11.39 21.93 7.39 coo 10.44 7.96 22.51 12.16 7.57 20.82 8.81 24.50 0.42 8.52 22.82 2.10 coo 19.43 6.74 22.83 19.09 5.15 21.60 19.37 24.14 3.44 20.48 23.43 1.80 1iph_c00 source 1iph CATALASE HPII : 5 hits 1iph_c00 naa= 3 ULMN 3 1iph_c01 CATALASE HPII user 1 3 # 1 B 128 HIS A 27 HIS~? -3.83 OXT ACY A 402s B 167 SER A 30 SER.? -4.23 CH3 ACY A 402s B 201 ASN A 23 ASN~? 3.23 O3 PO4 A 302s coo -12.95 -4.49 19.05 -14.87 -4.39 19.77 9.52 16.92 -31.25 8.29 18.47 -31.94 coo -10.44 -7.96 22.51 -12.16 -7.57 20.82 6.58 16.18 -25.41 6.11 17.58 -27.30 coo -19.43 -6.74 22.83 -19.09 -5.15 21.60 16.56 14.98 -29.71 17.96 15.58 -28.25 ULMN 3 1iph_c01 CATALASE HPII user 2 3 # 2 B 128 HIS A 27 HIS~? -3.83 OXT ACY A 402s B 167 SER A 30 SER.? -4.23 CH3 ACY A 402s B 201 ASN A 28 ASN~? 9.25 OXT ACY A 402 coo -12.95 -4.49 19.05 -14.87 -4.39 19.77 9.52 16.92 -31.25 8.29 18.47 -31.94 coo -10.44 -7.96 22.51 -12.16 -7.57 20.82 6.58 16.18 -25.41 6.11 17.58 -27.30 coo -19.43 -6.74 22.83 -19.09 -5.15 21.60 7.12 11.54 -30.87 7.65 11.60 -32.93 ULMN 3 1iph_c01 CATALASE HPII user 3 3 # 3 B 128 HIS B 27 HIS~? 8.91 CH3 ACY B 401 B 167 SER B 30 SER.? 9.89 OXT ACY B 401 B 201 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo -12.95 -4.49 19.05 -14.87 -4.39 19.77 24.22 18.07 5.55 25.63 19.33 6.45 coo -10.44 -7.96 22.51 -12.16 -7.57 20.82 27.11 16.51 -0.32 27.88 17.99 1.39 coo -19.43 -6.74 22.83 -19.09 -5.15 21.60 16.95 16.62 4.13 15.59 17.22 2.56 ULMN 3 1iph_c01 CATALASE HPII user 4 3 # 4 B 128 HIS C 27 HIS~? 7.34 O1 PO4 A 302 B 167 SER C 30 SER.? 7.40 O1 PO4 A 302 B 201 ASN C 23 ASN~? 3.34 CH3 ACY C 404s coo -12.95 -4.49 19.05 -14.87 -4.39 19.77 22.05 20.86 -32.07 23.10 19.40 -33.17 coo -10.44 -7.96 22.51 -12.16 -7.57 20.82 25.81 22.61 -26.89 26.10 20.85 -28.49 coo -19.43 -6.74 22.83 -19.09 -5.15 21.60 15.33 22.92 -30.05 14.25 22.35 -28.34 ULMN 3 1iph_c01 CATALASE HPII user 5 3 # 5 B 128 HIS D 27 HIS~? 8.84 CH3 ACY B 401 B 167 SER D 30 SER.? 8.07 CH3 ACY B 403 B 201 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo -12.95 -4.49 19.05 -14.87 -4.39 19.77 12.53 22.86 5.89 11.39 21.93 7.39 coo -10.44 -7.96 22.51 -12.16 -7.57 20.82 8.81 24.50 0.42 8.52 22.82 2.10 coo -19.43 -6.74 22.83 -19.09 -5.15 21.60 19.37 24.14 3.44 20.48 23.43 1.80 1iph_c01 source 1iph CATALASE HPII : 5 hits 1iph_c01 naa= 3 ULMN 3 1iph_c02 CATALASE HPII user 1 3 # 1 C 128 HIS A 27 HIS~? -3.83 OXT ACY A 402s C 167 SER A 30 SER.? -4.23 CH3 ACY A 402s C 201 ASN A 23 ASN~? 3.23 O3 PO4 A 302s coo -12.95 4.49 -19.05 -14.87 4.39 -19.77 9.52 16.92 -31.25 8.29 18.47 -31.94 coo -10.44 7.96 -22.51 -12.16 7.57 -20.82 6.58 16.18 -25.41 6.11 17.58 -27.30 coo -19.43 6.74 -22.83 -19.09 5.15 -21.60 16.56 14.98 -29.71 17.96 15.58 -28.25 ULMN 3 1iph_c02 CATALASE HPII user 2 3 # 2 C 128 HIS A 27 HIS~? -3.83 OXT ACY A 402s C 167 SER A 30 SER.? -4.23 CH3 ACY A 402s C 201 ASN A 28 ASN~? 9.25 OXT ACY A 402 coo -12.95 4.49 -19.05 -14.87 4.39 -19.77 9.52 16.92 -31.25 8.29 18.47 -31.94 coo -10.44 7.96 -22.51 -12.16 7.57 -20.82 6.58 16.18 -25.41 6.11 17.58 -27.30 coo -19.43 6.74 -22.83 -19.09 5.15 -21.60 7.12 11.54 -30.87 7.65 11.60 -32.93 ULMN 3 1iph_c02 CATALASE HPII user 3 3 # 3 C 128 HIS B 27 HIS~? 8.91 CH3 ACY B 401 C 167 SER B 30 SER.? 9.89 OXT ACY B 401 C 201 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo -12.95 4.49 -19.05 -14.87 4.39 -19.77 24.22 18.07 5.55 25.63 19.33 6.45 coo -10.44 7.96 -22.51 -12.16 7.57 -20.82 27.11 16.51 -0.32 27.88 17.99 1.39 coo -19.43 6.74 -22.83 -19.09 5.15 -21.60 16.95 16.62 4.13 15.59 17.22 2.56 ULMN 3 1iph_c02 CATALASE HPII user 4 3 # 4 C 128 HIS C 27 HIS~? 7.34 O1 PO4 A 302 C 167 SER C 30 SER.? 7.40 O1 PO4 A 302 C 201 ASN C 23 ASN~? 3.34 CH3 ACY C 404s coo -12.95 4.49 -19.05 -14.87 4.39 -19.77 22.05 20.86 -32.07 23.10 19.40 -33.17 coo -10.44 7.96 -22.51 -12.16 7.57 -20.82 25.81 22.61 -26.89 26.10 20.85 -28.49 coo -19.43 6.74 -22.83 -19.09 5.15 -21.60 15.33 22.92 -30.05 14.25 22.35 -28.34 ULMN 3 1iph_c02 CATALASE HPII user 5 3 # 5 C 128 HIS D 27 HIS~? 8.84 CH3 ACY B 401 C 167 SER D 30 SER.? 8.07 CH3 ACY B 403 C 201 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo -12.95 4.49 -19.05 -14.87 4.39 -19.77 12.53 22.86 5.89 11.39 21.93 7.39 coo -10.44 7.96 -22.51 -12.16 7.57 -20.82 8.81 24.50 0.42 8.52 22.82 2.10 coo -19.43 6.74 -22.83 -19.09 5.15 -21.60 19.37 24.14 3.44 20.48 23.43 1.80 1iph_c02 source 1iph CATALASE HPII : 5 hits 1iph_c02 naa= 3 ULMN 3 1iph_c03 CATALASE HPII user 1 3 # 1 D 128 HIS A 27 HIS~? -3.83 OXT ACY A 402s D 167 SER A 30 SER.? -4.23 CH3 ACY A 402s D 201 ASN A 23 ASN~? 3.23 O3 PO4 A 302s coo 12.95 -4.49 -19.05 14.87 -4.39 -19.77 9.52 16.92 -31.25 8.29 18.47 -31.94 coo 10.44 -7.96 -22.51 12.16 -7.57 -20.82 6.58 16.18 -25.41 6.11 17.58 -27.30 coo 19.43 -6.74 -22.83 19.09 -5.15 -21.60 16.56 14.98 -29.71 17.96 15.58 -28.25 ULMN 3 1iph_c03 CATALASE HPII user 2 3 # 2 D 128 HIS A 27 HIS~? -3.83 OXT ACY A 402s D 167 SER A 30 SER.? -4.23 CH3 ACY A 402s D 201 ASN A 28 ASN~? 9.25 OXT ACY A 402 coo 12.95 -4.49 -19.05 14.87 -4.39 -19.77 9.52 16.92 -31.25 8.29 18.47 -31.94 coo 10.44 -7.96 -22.51 12.16 -7.57 -20.82 6.58 16.18 -25.41 6.11 17.58 -27.30 coo 19.43 -6.74 -22.83 19.09 -5.15 -21.60 7.12 11.54 -30.87 7.65 11.60 -32.93 ULMN 3 1iph_c03 CATALASE HPII user 3 3 # 3 D 128 HIS B 27 HIS~? 8.91 CH3 ACY B 401 D 167 SER B 30 SER.? 9.89 OXT ACY B 401 D 201 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo 12.95 -4.49 -19.05 14.87 -4.39 -19.77 24.22 18.07 5.55 25.63 19.33 6.45 coo 10.44 -7.96 -22.51 12.16 -7.57 -20.82 27.11 16.51 -0.32 27.88 17.99 1.39 coo 19.43 -6.74 -22.83 19.09 -5.15 -21.60 16.95 16.62 4.13 15.59 17.22 2.56 ULMN 3 1iph_c03 CATALASE HPII user 4 3 # 4 D 128 HIS C 27 HIS~? 7.34 O1 PO4 A 302 D 167 SER C 30 SER.? 7.40 O1 PO4 A 302 D 201 ASN C 23 ASN~? 3.34 CH3 ACY C 404s coo 12.95 -4.49 -19.05 14.87 -4.39 -19.77 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 10.44 -7.96 -22.51 12.16 -7.57 -20.82 25.81 22.61 -26.89 26.10 20.85 -28.49 coo 19.43 -6.74 -22.83 19.09 -5.15 -21.60 15.33 22.92 -30.05 14.25 22.35 -28.34 ULMN 3 1iph_c03 CATALASE HPII user 5 3 # 5 D 128 HIS D 27 HIS~? 8.84 CH3 ACY B 401 D 167 SER D 30 SER.? 8.07 CH3 ACY B 403 D 201 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo 12.95 -4.49 -19.05 14.87 -4.39 -19.77 12.53 22.86 5.89 11.39 21.93 7.39 coo 10.44 -7.96 -22.51 12.16 -7.57 -20.82 8.81 24.50 0.42 8.52 22.82 2.10 coo 19.43 -6.74 -22.83 19.09 -5.15 -21.60 19.37 24.14 3.44 20.48 23.43 1.80 1iph_c03 source 1iph CATALASE HPII : 5 hits 1iph_c03 naa= 3 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 1 3 # 1 A 14 GLU B 24 GLU~? 12.08 CH3 ACY B 401 A 61 GLU D 24 GLU~? 11.43 CH3 ACY B 401 A 162 HIS B 27 HIS~? 8.91 CH3 ACY B 401 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 18.70 14.65 8.90 18.04 13.62 10.65 coo -4.89 20.85 5.22 -3.95 21.69 6.91 18.15 25.86 8.28 19.10 26.69 9.97 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 24.22 18.07 5.55 25.63 19.33 6.45 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 2 3 # 2 A 14 GLU C 24 GLU~? 11.35 C3 GOL A 501 A 61 GLU A 24 GLU~? 10.37 O3 PO4 A 302 A 162 HIS C 27 HIS~? 7.34 O1 PO4 A 302 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 18.84 25.84 -35.18 19.75 24.32 -36.38 coo -4.89 20.85 5.22 -3.95 21.69 6.91 14.49 13.16 -34.47 15.70 12.18 -35.93 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 22.05 20.86 -32.07 23.10 19.40 -33.17 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 3 3 # 3 A 14 GLU C 24 GLU~? 11.35 C3 GOL A 501 A 61 GLU C 31 GLU.? 14.58 O1 PO4 A 302 A 162 HIS C 27 HIS~? 7.34 O1 PO4 A 302 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 18.84 25.84 -35.18 19.75 24.32 -36.38 coo -4.89 20.85 5.22 -3.95 21.69 6.91 31.25 23.87 -27.43 32.95 24.08 -28.66 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 22.05 20.86 -32.07 23.10 19.40 -33.17 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 4 3 # 4 A 14 GLU D 24 GLU~? 11.43 CH3 ACY B 401 A 61 GLU B 24 GLU~? 12.08 CH3 ACY B 401 A 162 HIS D 27 HIS~? 8.84 CH3 ACY B 401 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 18.15 25.86 8.28 19.10 26.69 9.97 coo -4.89 20.85 5.22 -3.95 21.69 6.91 18.70 14.65 8.90 18.04 13.62 10.65 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 12.53 22.86 5.89 11.39 21.93 7.39 1j53_c00 source 1j53 DNA POLYMERASE III, EPSILON CHAIN : 4 hits 1j53_c00 naa= 3 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 A 2 GLU A 24 GLU~? 10.37 O3 PO4 A 302 A 56 LYS A 17 LYS~? 14.12 O3 PO4 A 302 A 258 ARG A 36 ARG^? 3.17 O2 GOL A 501s coo 42.33 1.56 26.99 42.38 2.91 28.66 14.49 13.16 -34.47 15.70 12.18 -35.93 coo 38.45 -0.44 19.89 37.36 0.90 25.90 22.94 9.69 -34.22 22.50 4.31 -36.79 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 14.40 16.71 -22.33 15.78 16.00 -25.01 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 A 2 GLU A 44 GLU~? 15.81 O4 PO4 A 302 A 56 LYS B 54 LYS.? 19.51 O4 PO4 A 302 A 258 ARG A 42 ARG~? 9.50 O4 PO4 A 302 coo 42.33 1.56 26.99 42.38 2.91 28.66 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 38.45 -0.44 19.89 37.36 0.90 25.90 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 31.60 18.55 -22.55 28.82 19.89 -22.65 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 A 2 GLU A 44 GLU~? 15.81 O4 PO4 A 302 A 56 LYS B 54 LYS.? 19.51 O4 PO4 A 302 A 258 ARG A 74 ARG^? 14.15 O4 PO4 A 302 coo 42.33 1.56 26.99 42.38 2.91 28.66 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 38.45 -0.44 19.89 37.36 0.90 25.90 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 23.62 1.58 -20.34 24.34 2.38 -17.47 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 A 2 GLU A 44 GLU~? 15.81 O4 PO4 A 302 A 56 LYS B 81 LYS.? 16.99 O4 PO4 A 302 A 258 ARG A 42 ARG~? 9.50 O4 PO4 A 302 coo 42.33 1.56 26.99 42.38 2.91 28.66 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 38.45 -0.44 19.89 37.36 0.90 25.90 29.08 3.04 -17.20 34.50 4.57 -18.92 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 31.60 18.55 -22.55 28.82 19.89 -22.65 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 5 3 # 5 A 2 GLU B 13 GLU^? 15.77 O ACY B 403 A 56 LYS A 81 LYS.? 21.98 O ACY B 403 A 258 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo 42.33 1.56 26.99 42.38 2.91 28.66 4.71 8.41 0.32 2.63 9.02 0.18 coo 38.45 -0.44 19.89 37.36 0.90 25.90 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 6 3 # 6 A 2 GLU B 24 GLU~? 12.08 CH3 ACY B 401 A 56 LYS B 17 LYS~? 19.82 CH3 ACY B 401 A 258 ARG B 36 ARG^? 3.17 C ACY B 401s coo 42.33 1.56 26.99 42.38 2.91 28.66 18.70 14.65 8.90 18.04 13.62 10.65 coo 38.45 -0.44 19.89 37.36 0.90 25.90 10.28 12.10 9.11 8.33 8.93 13.61 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 7 3 # 7 A 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 A 56 LYS A 3 LYS.? 16.38 O ACY A 402 A 258 ARG B 74 ARG^? 16.09 O ACY B 403 coo 42.33 1.56 26.99 42.38 2.91 28.66 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 38.45 -0.44 19.89 37.36 0.90 25.90 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 8 3 # 8 A 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 A 56 LYS A 54 LYS.? 19.07 O ACY A 402 A 258 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo 42.33 1.56 26.99 42.38 2.91 28.66 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 38.45 -0.44 19.89 37.36 0.90 25.90 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 9 3 # 9 A 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 A 56 LYS A 54 LYS.? 19.07 O ACY A 402 A 258 ARG B 74 ARG^? 16.09 O ACY B 403 coo 42.33 1.56 26.99 42.38 2.91 28.66 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 38.45 -0.44 19.89 37.36 0.90 25.90 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 10 3 # 10 A 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 A 56 LYS A 81 LYS.? 21.98 O ACY B 403 A 258 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo 42.33 1.56 26.99 42.38 2.91 28.66 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 38.45 -0.44 19.89 37.36 0.90 25.90 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 11 3 # 11 A 2 GLU C 43 GLU~? 17.47 O ACY C 404 A 56 LYS D 54 LYS.? 18.95 CH3 ACY B 403 A 258 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo 42.33 1.56 26.99 42.38 2.91 28.66 -1.82 27.43 -15.06 -1.58 27.20 -12.95 coo 38.45 -0.44 19.89 37.36 0.90 25.90 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 12 3 # 12 A 2 GLU C 44 GLU~? 16.01 O ACY C 404 A 56 LYS D 54 LYS.? 18.95 CH3 ACY B 403 A 258 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo 42.33 1.56 26.99 42.38 2.91 28.66 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 38.45 -0.44 19.89 37.36 0.90 25.90 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 13 3 # 13 A 2 GLU C 44 GLU~? 16.01 O ACY C 404 A 56 LYS D 54 LYS.? 18.95 CH3 ACY B 403 A 258 ARG C 74 ARG^? 14.08 O ACY C 404 coo 42.33 1.56 26.99 42.38 2.91 28.66 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 38.45 -0.44 19.89 37.36 0.90 25.90 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 9.75 38.11 -21.77 8.89 36.86 -19.09 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 14 3 # 14 A 2 GLU C 44 GLU~? 16.01 O ACY C 404 A 56 LYS D 81 LYS.? 19.75 O ACY C 404 A 258 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo 42.33 1.56 26.99 42.38 2.91 28.66 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 38.45 -0.44 19.89 37.36 0.90 25.90 4.59 37.20 -16.29 4.16 41.27 -17.63 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 15 3 # 15 A 2 GLU D 24 GLU~? 11.43 CH3 ACY B 401 A 56 LYS D 17 LYS~? 17.87 CH3 ACY B 401 A 258 ARG D 36 ARG^? 3.12 O ACY B 401s coo 42.33 1.56 26.99 42.38 2.91 28.66 18.15 25.86 8.28 19.10 26.69 9.97 coo 38.45 -0.44 19.89 37.36 0.90 25.90 26.90 28.52 7.20 25.78 33.34 9.99 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 15.90 23.27 -3.56 17.50 23.47 -0.92 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 16 3 # 16 A 2 GLU D 43 GLU~? 22.18 O4 PO4 A 302 A 56 LYS C 54 LYS.? 21.14 O4 PO4 A 302 A 258 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo 42.33 1.56 26.99 42.38 2.91 28.66 36.87 25.85 -11.48 36.80 25.51 -13.56 coo 38.45 -0.44 19.89 37.36 0.90 25.90 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 32.58 20.13 -5.26 29.93 18.65 -5.63 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 17 3 # 17 A 2 GLU D 44 GLU~? 21.69 OXT ACY B 401 A 56 LYS C 54 LYS.? 21.14 O4 PO4 A 302 A 258 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo 42.33 1.56 26.99 42.38 2.91 28.66 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 38.45 -0.44 19.89 37.36 0.90 25.90 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 32.58 20.13 -5.26 29.93 18.65 -5.63 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 18 3 # 18 A 2 GLU D 44 GLU~? 21.69 OXT ACY B 401 A 56 LYS C 54 LYS.? 21.14 O4 PO4 A 302 A 258 ARG D 74 ARG^? 19.24 OXT ACY B 401 coo 42.33 1.56 26.99 42.38 2.91 28.66 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 38.45 -0.44 19.89 37.36 0.90 25.90 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 25.93 38.34 -6.34 26.99 36.29 -8.39 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 19 3 # 19 A 2 GLU D 44 GLU~? 21.69 OXT ACY B 401 A 56 LYS C 81 LYS.? 25.54 OXT ACY B 401 A 258 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo 42.33 1.56 26.99 42.38 2.91 28.66 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 38.45 -0.44 19.89 37.36 0.90 25.90 31.22 35.67 -10.67 31.64 40.37 -10.68 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 32.58 20.13 -5.26 29.93 18.65 -5.63 1k82_c00 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 19 hits 1k82_c00 naa= 3 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 B 2 GLU A 24 GLU~? 10.37 O3 PO4 A 302 B 56 LYS A 17 LYS~? 14.12 O3 PO4 A 302 B 258 ARG A 36 ARG^? 3.17 O2 GOL A 501s coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 14.49 13.16 -34.47 15.70 12.18 -35.93 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 22.94 9.69 -34.22 22.50 4.31 -36.79 coo 2.64 1.83 34.81 1.56 1.13 32.02 14.40 16.71 -22.33 15.78 16.00 -25.01 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 B 2 GLU A 44 GLU~? 15.81 O4 PO4 A 302 B 56 LYS B 54 LYS.? 19.51 O4 PO4 A 302 B 258 ARG A 42 ARG~? 9.50 O4 PO4 A 302 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 2.64 1.83 34.81 1.56 1.13 32.02 31.60 18.55 -22.55 28.82 19.89 -22.65 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 B 2 GLU A 44 GLU~? 15.81 O4 PO4 A 302 B 56 LYS B 54 LYS.? 19.51 O4 PO4 A 302 B 258 ARG A 74 ARG^? 14.15 O4 PO4 A 302 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 2.64 1.83 34.81 1.56 1.13 32.02 23.62 1.58 -20.34 24.34 2.38 -17.47 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 B 2 GLU A 44 GLU~? 15.81 O4 PO4 A 302 B 56 LYS B 81 LYS.? 16.99 O4 PO4 A 302 B 258 ARG A 42 ARG~? 9.50 O4 PO4 A 302 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 29.08 3.04 -17.20 34.50 4.57 -18.92 coo 2.64 1.83 34.81 1.56 1.13 32.02 31.60 18.55 -22.55 28.82 19.89 -22.65 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 5 3 # 5 B 2 GLU B 13 GLU^? 15.77 O ACY B 403 B 56 LYS A 81 LYS.? 21.98 O ACY B 403 B 258 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 4.71 8.41 0.32 2.63 9.02 0.18 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 2.64 1.83 34.81 1.56 1.13 32.02 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 6 3 # 6 B 2 GLU B 24 GLU~? 12.08 CH3 ACY B 401 B 56 LYS B 17 LYS~? 19.82 CH3 ACY B 401 B 258 ARG B 36 ARG^? 3.17 C ACY B 401s coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 18.70 14.65 8.90 18.04 13.62 10.65 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 10.28 12.10 9.11 8.33 8.93 13.61 coo 2.64 1.83 34.81 1.56 1.13 32.02 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 7 3 # 7 B 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 B 56 LYS A 3 LYS.? 16.38 O ACY A 402 B 258 ARG B 74 ARG^? 16.09 O ACY B 403 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 2.64 1.83 34.81 1.56 1.13 32.02 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 8 3 # 8 B 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 B 56 LYS A 54 LYS.? 19.07 O ACY A 402 B 258 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 2.64 1.83 34.81 1.56 1.13 32.02 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 9 3 # 9 B 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 B 56 LYS A 54 LYS.? 19.07 O ACY A 402 B 258 ARG B 74 ARG^? 16.09 O ACY B 403 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 2.64 1.83 34.81 1.56 1.13 32.02 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 10 3 # 10 B 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 B 56 LYS A 81 LYS.? 21.98 O ACY B 403 B 258 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 2.64 1.83 34.81 1.56 1.13 32.02 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 11 3 # 11 B 2 GLU C 43 GLU~? 17.47 O ACY C 404 B 56 LYS D 54 LYS.? 18.95 CH3 ACY B 403 B 258 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 -1.82 27.43 -15.06 -1.58 27.20 -12.95 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 2.64 1.83 34.81 1.56 1.13 32.02 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 12 3 # 12 B 2 GLU C 44 GLU~? 16.01 O ACY C 404 B 56 LYS D 54 LYS.? 18.95 CH3 ACY B 403 B 258 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 2.64 1.83 34.81 1.56 1.13 32.02 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 13 3 # 13 B 2 GLU C 44 GLU~? 16.01 O ACY C 404 B 56 LYS D 54 LYS.? 18.95 CH3 ACY B 403 B 258 ARG C 74 ARG^? 14.08 O ACY C 404 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 2.64 1.83 34.81 1.56 1.13 32.02 9.75 38.11 -21.77 8.89 36.86 -19.09 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 14 3 # 14 B 2 GLU C 44 GLU~? 16.01 O ACY C 404 B 56 LYS D 81 LYS.? 19.75 O ACY C 404 B 258 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 4.59 37.20 -16.29 4.16 41.27 -17.63 coo 2.64 1.83 34.81 1.56 1.13 32.02 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 15 3 # 15 B 2 GLU D 24 GLU~? 11.43 CH3 ACY B 401 B 56 LYS D 17 LYS~? 17.87 CH3 ACY B 401 B 258 ARG D 36 ARG^? 3.12 O ACY B 401s coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 18.15 25.86 8.28 19.10 26.69 9.97 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 26.90 28.52 7.20 25.78 33.34 9.99 coo 2.64 1.83 34.81 1.56 1.13 32.02 15.90 23.27 -3.56 17.50 23.47 -0.92 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 16 3 # 16 B 2 GLU D 43 GLU~? 22.18 O4 PO4 A 302 B 56 LYS C 54 LYS.? 21.14 O4 PO4 A 302 B 258 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 36.87 25.85 -11.48 36.80 25.51 -13.56 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 2.64 1.83 34.81 1.56 1.13 32.02 32.58 20.13 -5.26 29.93 18.65 -5.63 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 17 3 # 17 B 2 GLU D 44 GLU~? 21.69 OXT ACY B 401 B 56 LYS C 54 LYS.? 21.14 O4 PO4 A 302 B 258 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 2.64 1.83 34.81 1.56 1.13 32.02 32.58 20.13 -5.26 29.93 18.65 -5.63 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 18 3 # 18 B 2 GLU D 44 GLU~? 21.69 OXT ACY B 401 B 56 LYS C 54 LYS.? 21.14 O4 PO4 A 302 B 258 ARG D 74 ARG^? 19.24 OXT ACY B 401 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 2.64 1.83 34.81 1.56 1.13 32.02 25.93 38.34 -6.34 26.99 36.29 -8.39 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 19 3 # 19 B 2 GLU D 44 GLU~? 21.69 OXT ACY B 401 B 56 LYS C 81 LYS.? 25.54 OXT ACY B 401 B 258 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 31.22 35.67 -10.67 31.64 40.37 -10.68 coo 2.64 1.83 34.81 1.56 1.13 32.02 32.58 20.13 -5.26 29.93 18.65 -5.63 1k82_c01 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 19 hits 1k82_c01 naa= 3 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 C 2 GLU A 24 GLU~? 10.37 O3 PO4 A 302 C 56 LYS A 17 LYS~? 14.12 O3 PO4 A 302 C 258 ARG A 36 ARG^? 3.17 O2 GOL A 501s coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 14.49 13.16 -34.47 15.70 12.18 -35.93 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 22.94 9.69 -34.22 22.50 4.31 -36.79 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 14.40 16.71 -22.33 15.78 16.00 -25.01 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 C 2 GLU A 44 GLU~? 15.81 O4 PO4 A 302 C 56 LYS B 54 LYS.? 19.51 O4 PO4 A 302 C 258 ARG A 42 ARG~? 9.50 O4 PO4 A 302 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 31.60 18.55 -22.55 28.82 19.89 -22.65 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 C 2 GLU A 44 GLU~? 15.81 O4 PO4 A 302 C 56 LYS B 54 LYS.? 19.51 O4 PO4 A 302 C 258 ARG A 74 ARG^? 14.15 O4 PO4 A 302 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 23.62 1.58 -20.34 24.34 2.38 -17.47 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 C 2 GLU A 44 GLU~? 15.81 O4 PO4 A 302 C 56 LYS B 81 LYS.? 16.99 O4 PO4 A 302 C 258 ARG A 42 ARG~? 9.50 O4 PO4 A 302 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 29.08 3.04 -17.20 34.50 4.57 -18.92 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 31.60 18.55 -22.55 28.82 19.89 -22.65 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 5 3 # 5 C 2 GLU B 13 GLU^? 15.77 O ACY B 403 C 56 LYS A 81 LYS.? 21.98 O ACY B 403 C 258 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 4.71 8.41 0.32 2.63 9.02 0.18 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 6 3 # 6 C 2 GLU B 24 GLU~? 12.08 CH3 ACY B 401 C 56 LYS B 17 LYS~? 19.82 CH3 ACY B 401 C 258 ARG B 36 ARG^? 3.17 C ACY B 401s coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 18.70 14.65 8.90 18.04 13.62 10.65 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 10.28 12.10 9.11 8.33 8.93 13.61 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 7 3 # 7 C 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 C 56 LYS A 54 LYS.? 19.07 O ACY A 402 C 258 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 8 3 # 8 C 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 C 56 LYS A 54 LYS.? 19.07 O ACY A 402 C 258 ARG B 74 ARG^? 16.09 O ACY B 403 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 9 3 # 9 C 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 C 56 LYS A 81 LYS.? 21.98 O ACY B 403 C 258 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 10 3 # 10 C 2 GLU C 43 GLU~? 17.47 O ACY C 404 C 56 LYS D 54 LYS.? 18.95 CH3 ACY B 403 C 258 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 -1.82 27.43 -15.06 -1.58 27.20 -12.95 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 11 3 # 11 C 2 GLU C 44 GLU~? 16.01 O ACY C 404 C 56 LYS D 54 LYS.? 18.95 CH3 ACY B 403 C 258 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 12 3 # 12 C 2 GLU C 44 GLU~? 16.01 O ACY C 404 C 56 LYS D 54 LYS.? 18.95 CH3 ACY B 403 C 258 ARG C 74 ARG^? 14.08 O ACY C 404 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 9.75 38.11 -21.77 8.89 36.86 -19.09 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 13 3 # 13 C 2 GLU C 44 GLU~? 16.01 O ACY C 404 C 56 LYS D 81 LYS.? 19.75 O ACY C 404 C 258 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 4.59 37.20 -16.29 4.16 41.27 -17.63 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 14 3 # 14 C 2 GLU D 24 GLU~? 11.43 CH3 ACY B 401 C 56 LYS D 17 LYS~? 17.87 CH3 ACY B 401 C 258 ARG D 36 ARG^? 3.12 O ACY B 401s coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 18.15 25.86 8.28 19.10 26.69 9.97 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 26.90 28.52 7.20 25.78 33.34 9.99 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 15.90 23.27 -3.56 17.50 23.47 -0.92 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 15 3 # 15 C 2 GLU D 43 GLU~? 22.18 O4 PO4 A 302 C 56 LYS C 54 LYS.? 21.14 O4 PO4 A 302 C 258 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 36.87 25.85 -11.48 36.80 25.51 -13.56 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 32.58 20.13 -5.26 29.93 18.65 -5.63 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 16 3 # 16 C 2 GLU D 44 GLU~? 21.69 OXT ACY B 401 C 56 LYS C 54 LYS.? 21.14 O4 PO4 A 302 C 258 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 32.58 20.13 -5.26 29.93 18.65 -5.63 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 17 3 # 17 C 2 GLU D 44 GLU~? 21.69 OXT ACY B 401 C 56 LYS C 54 LYS.? 21.14 O4 PO4 A 302 C 258 ARG D 74 ARG^? 19.24 OXT ACY B 401 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 25.93 38.34 -6.34 26.99 36.29 -8.39 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 18 3 # 18 C 2 GLU D 44 GLU~? 21.69 OXT ACY B 401 C 56 LYS C 81 LYS.? 25.54 OXT ACY B 401 C 258 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 31.22 35.67 -10.67 31.64 40.37 -10.68 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 32.58 20.13 -5.26 29.93 18.65 -5.63 1k82_c02 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 18 hits 1k82_c02 naa= 3 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 D 2 GLU A 24 GLU~? 10.37 O3 PO4 A 302 D 56 LYS A 17 LYS~? 14.12 O3 PO4 A 302 D 258 ARG A 36 ARG^? 3.17 O2 GOL A 501s coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 14.49 13.16 -34.47 15.70 12.18 -35.93 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 22.94 9.69 -34.22 22.50 4.31 -36.79 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 14.40 16.71 -22.33 15.78 16.00 -25.01 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 D 2 GLU A 44 GLU~? 15.81 O4 PO4 A 302 D 56 LYS B 54 LYS.? 19.51 O4 PO4 A 302 D 258 ARG A 42 ARG~? 9.50 O4 PO4 A 302 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 31.60 18.55 -22.55 28.82 19.89 -22.65 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 D 2 GLU A 44 GLU~? 15.81 O4 PO4 A 302 D 56 LYS B 54 LYS.? 19.51 O4 PO4 A 302 D 258 ARG A 74 ARG^? 14.15 O4 PO4 A 302 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 23.62 1.58 -20.34 24.34 2.38 -17.47 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 D 2 GLU A 44 GLU~? 15.81 O4 PO4 A 302 D 56 LYS B 81 LYS.? 16.99 O4 PO4 A 302 D 258 ARG A 42 ARG~? 9.50 O4 PO4 A 302 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 29.08 3.04 -17.20 34.50 4.57 -18.92 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 31.60 18.55 -22.55 28.82 19.89 -22.65 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 5 3 # 5 D 2 GLU B 13 GLU^? 15.77 O ACY B 403 D 56 LYS A 81 LYS.? 21.98 O ACY B 403 D 258 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 4.71 8.41 0.32 2.63 9.02 0.18 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 6 3 # 6 D 2 GLU B 24 GLU~? 12.08 CH3 ACY B 401 D 56 LYS B 17 LYS~? 19.82 CH3 ACY B 401 D 258 ARG B 36 ARG^? 3.17 C ACY B 401s coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 18.70 14.65 8.90 18.04 13.62 10.65 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 10.28 12.10 9.11 8.33 8.93 13.61 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 7 3 # 7 D 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 D 56 LYS A 54 LYS.? 19.07 O ACY A 402 D 258 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 8 3 # 8 D 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 D 56 LYS A 54 LYS.? 19.07 O ACY A 402 D 258 ARG B 74 ARG^? 16.09 O ACY B 403 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 9 3 # 9 D 2 GLU B 44 GLU~? 18.30 CH3 ACY B 403 D 56 LYS A 81 LYS.? 21.98 O ACY B 403 D 258 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 10 3 # 10 D 2 GLU C 43 GLU~? 17.47 O ACY C 404 D 56 LYS D 54 LYS.? 18.95 CH3 ACY B 403 D 258 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 -1.82 27.43 -15.06 -1.58 27.20 -12.95 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 11 3 # 11 D 2 GLU C 44 GLU~? 16.01 O ACY C 404 D 56 LYS D 54 LYS.? 18.95 CH3 ACY B 403 D 258 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 12 3 # 12 D 2 GLU C 44 GLU~? 16.01 O ACY C 404 D 56 LYS D 54 LYS.? 18.95 CH3 ACY B 403 D 258 ARG C 74 ARG^? 14.08 O ACY C 404 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 9.75 38.11 -21.77 8.89 36.86 -19.09 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 13 3 # 13 D 2 GLU C 44 GLU~? 16.01 O ACY C 404 D 56 LYS D 81 LYS.? 19.75 O ACY C 404 D 258 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 4.59 37.20 -16.29 4.16 41.27 -17.63 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 14 3 # 14 D 2 GLU D 24 GLU~? 11.43 CH3 ACY B 401 D 56 LYS D 17 LYS~? 17.87 CH3 ACY B 401 D 258 ARG D 36 ARG^? 3.12 O ACY B 401s coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 18.15 25.86 8.28 19.10 26.69 9.97 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 26.90 28.52 7.20 25.78 33.34 9.99 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 15.90 23.27 -3.56 17.50 23.47 -0.92 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 15 3 # 15 D 2 GLU D 43 GLU~? 22.18 O4 PO4 A 302 D 56 LYS C 54 LYS.? 21.14 O4 PO4 A 302 D 258 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 36.87 25.85 -11.48 36.80 25.51 -13.56 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 32.58 20.13 -5.26 29.93 18.65 -5.63 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 16 3 # 16 D 2 GLU D 44 GLU~? 21.69 OXT ACY B 401 D 56 LYS C 54 LYS.? 21.14 O4 PO4 A 302 D 258 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 32.58 20.13 -5.26 29.93 18.65 -5.63 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 17 3 # 17 D 2 GLU D 44 GLU~? 21.69 OXT ACY B 401 D 56 LYS C 54 LYS.? 21.14 O4 PO4 A 302 D 258 ARG D 74 ARG^? 19.24 OXT ACY B 401 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 25.93 38.34 -6.34 26.99 36.29 -8.39 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 18 3 # 18 D 2 GLU D 44 GLU~? 21.69 OXT ACY B 401 D 56 LYS C 81 LYS.? 25.54 OXT ACY B 401 D 258 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 31.22 35.67 -10.67 31.64 40.37 -10.68 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 32.58 20.13 -5.26 29.93 18.65 -5.63 1k82_c03 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 18 hits 1k82_c03 naa= 3 ULMN 3 1kqc_c00 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 1 3 # 1 A 14 LYS D 3 LYS.? 18.33 CH3 ACY B 403 A 74 LYS D 54 LYS.? 18.95 CH3 ACY B 403 A 165 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo 24.97 5.82 58.78 26.79 1.97 55.46 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 19.46 3.44 61.93 23.95 1.12 60.13 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 19.32 -6.09 50.65 20.51 -6.62 48.98 -1.81 16.10 -9.11 -1.93 15.47 -11.12 1kqc_c00 source 1kqc OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE : 1 hits 1kqc_c00 naa= 3 ULMN 3 1kqc_c01 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 1 3 # 1 B 14 LYS D 3 LYS.? 18.33 CH3 ACY B 403 B 74 LYS D 54 LYS.? 18.95 CH3 ACY B 403 B 165 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo 4.84 5.09 23.75 3.30 1.39 27.48 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 10.43 2.88 20.75 5.72 0.41 23.95 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 10.70 -6.39 32.24 9.53 -6.89 33.94 -1.81 16.10 -9.11 -1.93 15.47 -11.12 1kqc_c01 source 1kqc OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE : 1 hits 1kqc_c01 naa= 3 ULMN 3 1kqc_c02 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 1 3 # 1 C 14 LYS D 3 LYS.? 18.33 CH3 ACY B 403 C 74 LYS D 54 LYS.? 18.95 CH3 ACY B 403 C 165 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo 17.59 37.25 25.80 19.64 34.15 21.60 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 12.29 34.52 28.11 16.84 32.47 25.43 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 12.06 27.10 15.56 13.23 27.02 13.80 -1.81 16.10 -9.11 -1.93 15.47 -11.12 1kqc_c02 source 1kqc OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE : 1 hits 1kqc_c02 naa= 3 ULMN 3 1kqc_c03 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 1 3 # 1 D 14 LYS D 3 LYS.? 18.33 CH3 ACY B 403 D 74 LYS D 54 LYS.? 18.95 CH3 ACY B 403 D 165 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo -2.23 43.20 -8.84 -3.98 39.03 -6.02 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 3.33 41.47 -12.31 -1.15 38.64 -10.07 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 3.51 30.30 -2.73 2.31 29.63 -1.11 -1.81 16.10 -9.11 -1.93 15.47 -11.12 1kqc_c03 source 1kqc OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE : 1 hits 1kqc_c03 naa= 3 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 1 3 # 1 255 ASP A 14 ASP.? 7.78 O4 PO4 A 302 262 LYS A 17 LYS~? 14.12 O3 PO4 A 302 336 ARG A 74 ARG^? 14.15 O4 PO4 A 302 coo 61.88 50.78 12.96 63.84 50.60 13.71 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 63.59 44.40 18.32 63.20 49.74 17.95 22.94 9.69 -34.22 22.50 4.31 -36.79 coo 72.60 57.42 15.86 71.61 56.68 18.70 23.62 1.58 -20.34 24.34 2.38 -17.47 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 2 3 # 2 255 ASP B 14 ASP.? 10.32 CH3 ACY B 403 262 LYS B 17 LYS~? 19.82 CH3 ACY B 401 336 ARG B 74 ARG^? 16.09 O ACY B 403 coo 61.88 50.78 12.96 63.84 50.60 13.71 4.45 14.77 1.64 4.87 15.68 -0.19 coo 63.59 44.40 18.32 63.20 49.74 17.95 10.28 12.10 9.11 8.33 8.93 13.61 coo 72.60 57.42 15.86 71.61 56.68 18.70 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 3 3 # 3 255 ASP C 14 ASP.? 7.62 O ACY C 404 262 LYS C 17 LYS~? 14.11 CH3 ACY C 404 336 ARG C 74 ARG^? 14.08 O ACY C 404 coo 61.88 50.78 12.96 63.84 50.60 13.71 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 63.59 44.40 18.32 63.20 49.74 17.95 8.25 27.86 -34.26 8.79 32.54 -37.59 coo 72.60 57.42 15.86 71.61 56.68 18.70 9.75 38.11 -21.77 8.89 36.86 -19.09 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 4 3 # 4 255 ASP D 14 ASP.? 10.51 OXT ACY B 401 262 LYS D 17 LYS~? 17.87 CH3 ACY B 401 336 ARG B 36 ARG^? 3.17 C ACY B 401s coo 61.88 50.78 12.96 63.84 50.60 13.71 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 63.59 44.40 18.32 63.20 49.74 17.95 26.90 28.52 7.20 25.78 33.34 9.99 coo 72.60 57.42 15.86 71.61 56.68 18.70 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 5 3 # 5 255 ASP D 14 ASP.? 10.51 OXT ACY B 401 262 LYS D 17 LYS~? 17.87 CH3 ACY B 401 336 ARG D 36 ARG^? 3.12 O ACY B 401s coo 61.88 50.78 12.96 63.84 50.60 13.71 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 63.59 44.40 18.32 63.20 49.74 17.95 26.90 28.52 7.20 25.78 33.34 9.99 coo 72.60 57.42 15.86 71.61 56.68 18.70 15.90 23.27 -3.56 17.50 23.47 -0.92 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 6 3 # 6 255 ASP D 14 ASP.? 10.51 OXT ACY B 401 262 LYS D 17 LYS~? 17.87 CH3 ACY B 401 336 ARG D 74 ARG^? 19.24 OXT ACY B 401 coo 61.88 50.78 12.96 63.84 50.60 13.71 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 63.59 44.40 18.32 63.20 49.74 17.95 26.90 28.52 7.20 25.78 33.34 9.99 coo 72.60 57.42 15.86 71.61 56.68 18.70 25.93 38.34 -6.34 26.99 36.29 -8.39 1lam_c00 source 1lam LEUCINE AMINOPEPTIDASE : 6 hits 1lam_c00 naa= 3 ULMN 3 1lij_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 62 ALA~? 15.95 O ACY A 402 A 317 GLY A 61 GLY~? 18.12 O ACY A 402 A 318 ASP A 58 ASP~? 21.11 O ACY A 402 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 5.93 2.57 -26.12 4.84 3.32 -26.89 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 5.64 1.29 -22.54 5.70 2.04 -22.93 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1lij_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA B 62 ALA~? 18.65 OXT ACY B 401 A 317 GLY B 61 GLY~? 20.12 O ACY B 403 A 318 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 26.57 3.48 1.93 27.61 4.38 2.55 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 26.92 1.53 -1.34 26.95 2.31 -1.04 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 1lij_c01 ADENOSINE KINASE user 3 3 # 3 A 316 ALA C 62 ALA~? 18.30 CH3 ACY C 404 A 317 GLY C 61 GLY~? 19.35 CH3 ACY C 404 A 318 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 26.07 35.69 -29.35 27.06 34.87 -30.18 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 26.84 37.39 -26.02 26.76 36.64 -26.31 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 32.89 35.88 -28.31 34.37 37.32 -28.69 ULMN 3 1lij_c01 ADENOSINE KINASE user 4 3 # 4 A 316 ALA D 62 ALA~? 18.57 O ACY B 401 A 317 GLY D 61 GLY~? 20.13 CH3 ACY B 403 A 318 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 9.30 37.38 2.15 8.26 36.54 2.93 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 8.73 39.10 -1.19 8.75 38.34 -0.89 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 2.43 37.89 1.30 0.84 39.23 1.50 1lij_c01 source 1lij ADENOSINE KINASE : 4 hits 1lij_c01 naa= 3 ULMN 3 1lio_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 62 ALA~? 15.95 O ACY A 402 A 317 GLY A 61 GLY~? 18.12 O ACY A 402 A 318 ASP A 58 ASP~? 21.11 O ACY A 402 coo 27.04 23.54 41.85 25.72 24.19 42.18 5.93 2.57 -26.12 4.84 3.32 -26.89 coo 27.87 23.16 38.17 28.43 22.97 38.87 5.64 1.29 -22.54 5.70 2.04 -22.93 coo 32.11 22.71 40.58 33.42 24.22 39.78 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1lio_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA B 62 ALA~? 18.65 OXT ACY B 401 A 317 GLY B 61 GLY~? 20.12 O ACY B 403 A 318 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 27.04 23.54 41.85 25.72 24.19 42.18 26.57 3.48 1.93 27.61 4.38 2.55 coo 27.87 23.16 38.17 28.43 22.97 38.87 26.92 1.53 -1.34 26.95 2.31 -1.04 coo 32.11 22.71 40.58 33.42 24.22 39.78 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 1lio_c01 ADENOSINE KINASE user 3 3 # 3 A 316 ALA C 62 ALA~? 18.30 CH3 ACY C 404 A 317 GLY C 61 GLY~? 19.35 CH3 ACY C 404 A 318 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo 27.04 23.54 41.85 25.72 24.19 42.18 26.07 35.69 -29.35 27.06 34.87 -30.18 coo 27.87 23.16 38.17 28.43 22.97 38.87 26.84 37.39 -26.02 26.76 36.64 -26.31 coo 32.11 22.71 40.58 33.42 24.22 39.78 32.89 35.88 -28.31 34.37 37.32 -28.69 ULMN 3 1lio_c01 ADENOSINE KINASE user 4 3 # 4 A 316 ALA D 62 ALA~? 18.57 O ACY B 401 A 317 GLY D 61 GLY~? 20.13 CH3 ACY B 403 A 318 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 27.04 23.54 41.85 25.72 24.19 42.18 9.30 37.38 2.15 8.26 36.54 2.93 coo 27.87 23.16 38.17 28.43 22.97 38.87 8.73 39.10 -1.19 8.75 38.34 -0.89 coo 32.11 22.71 40.58 33.42 24.22 39.78 2.43 37.89 1.30 0.84 39.23 1.50 1lio_c01 source 1lio ADENOSINE KINASE : 4 hits 1lio_c01 naa= 3 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 32 ASP.? 10.92 O ACY A 402 A 279 GLU C 43 GLU~? 17.47 O ACY C 404 A 369 ASP A 58 ASP~? 21.11 O ACY A 402 coo 11.74 38.14 80.19 10.63 36.40 80.65 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 16.54 46.37 63.94 14.77 45.79 62.95 -1.82 27.43 -15.06 -1.58 27.20 -12.95 coo 12.19 31.08 87.29 11.13 32.66 86.38 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 32 ASP.? 10.92 O ACY A 402 A 279 GLU C 44 GLU~? 16.01 O ACY C 404 A 369 ASP A 58 ASP~? 21.11 O ACY A 402 coo 11.74 38.14 80.19 10.63 36.40 80.65 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 16.54 46.37 63.94 14.77 45.79 62.95 1.25 30.44 -16.59 -0.63 31.35 -16.34 coo 12.19 31.08 87.29 11.13 32.66 86.38 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 3 3 # 3 A 241 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 279 GLU D 13 GLU^? 19.04 OXT ACY B 401 A 369 ASP B 56 ASP~? 21.60 OXT ACY B 401 coo 11.74 38.14 80.19 10.63 36.40 80.65 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 16.54 46.37 63.94 14.77 45.79 62.95 29.88 33.09 -1.63 31.17 34.65 -1.02 coo 12.19 31.08 87.29 11.13 32.66 86.38 35.20 5.48 -3.85 34.81 5.79 -1.78 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 4 3 # 4 A 241 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 279 GLU D 44 GLU~? 21.69 OXT ACY B 401 A 369 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 11.74 38.14 80.19 10.63 36.40 80.65 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 16.54 46.37 63.94 14.77 45.79 62.95 34.05 29.14 -10.19 35.86 30.19 -10.55 coo 12.19 31.08 87.29 11.13 32.66 86.38 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 5 3 # 5 A 241 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 279 GLU A 44 GLU~? 15.81 O4 PO4 A 302 A 369 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo 11.74 38.14 80.19 10.63 36.40 80.65 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 16.54 46.37 63.94 14.77 45.79 62.95 32.63 9.21 -17.75 34.50 8.25 -17.69 coo 12.19 31.08 87.29 11.13 32.66 86.38 32.89 35.88 -28.31 34.37 37.32 -28.69 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 6 3 # 6 A 241 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 279 GLU B 13 GLU^? 15.77 O ACY B 403 A 369 ASP D 56 ASP~? 19.96 CH3 ACY B 403 coo 11.74 38.14 80.19 10.63 36.40 80.65 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 16.54 46.37 63.94 14.77 45.79 62.95 4.71 8.41 0.32 2.63 9.02 0.18 coo 12.19 31.08 87.29 11.13 32.66 86.38 0.36 35.17 -3.02 0.83 34.67 -1.05 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 7 3 # 7 A 241 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 279 GLU B 13 GLU^? 15.77 O ACY B 403 A 369 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 11.74 38.14 80.19 10.63 36.40 80.65 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 16.54 46.37 63.94 14.77 45.79 62.95 4.71 8.41 0.32 2.63 9.02 0.18 coo 12.19 31.08 87.29 11.13 32.66 86.38 2.43 37.89 1.30 0.84 39.23 1.50 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 8 3 # 8 A 241 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 279 GLU B 44 GLU~? 18.30 CH3 ACY B 403 A 369 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 11.74 38.14 80.19 10.63 36.40 80.65 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 16.54 46.37 63.94 14.77 45.79 62.95 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 12.19 31.08 87.29 11.13 32.66 86.38 2.43 37.89 1.30 0.84 39.23 1.50 1m53_c06 source 1m53 ISOMALTULOSE SYNTHASE : 8 hits 1m53_c06 naa= 3 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 1 3 # 1 159 ARG C 42 ARG~? 8.34 CH3 ACY A 402 229 SER A 30 SER.? -4.23 CH3 ACY A 402s 325 GLU A 31 GLU.? 11.52 CH3 ACY A 402 coo 2.54 15.84 18.57 3.24 17.85 16.30 1.71 20.80 -20.88 4.34 19.24 -20.78 coo 10.17 13.48 15.92 9.61 15.76 15.27 6.58 16.18 -25.41 6.11 17.58 -27.30 coo 5.42 13.04 19.75 5.74 13.81 17.79 0.44 16.93 -24.63 -1.32 16.41 -25.67 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 2 3 # 2 159 ARG D 42 ARG~? 11.96 OXT ACY B 401 229 SER B 30 SER.? 9.89 OXT ACY B 401 325 GLU B 31 GLU.? 14.62 OXT ACY B 401 coo 2.54 15.84 18.57 3.24 17.85 16.30 32.58 20.13 -5.26 29.93 18.65 -5.63 coo 10.17 13.48 15.92 9.61 15.76 15.27 27.11 16.51 -0.32 27.88 17.99 1.39 coo 5.42 13.04 19.75 5.74 13.81 17.79 33.31 16.38 -0.70 33.25 18.46 -1.14 1mbb_c00 source 1mbb URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYLGLUCOSAMI: 2 hits 1mbb_c00 naa= 3 ULMN 3 1mdr_c01 MANDELATE RACEMASE (E.C.5.1.2.2) user 1 3 # 1 164 LYS D 54 LYS.? 18.95 CH3 ACY B 403 166 LYS D 3 LYS.? 18.33 CH3 ACY B 403 324 SER A 30 SER.? -4.23 CH3 ACY A 402s coo 25.93 8.11 25.51 26.40 7.80 19.66 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 27.27 1.43 25.09 29.18 5.25 22.89 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 46.32 14.55 19.93 45.95 12.72 21.27 6.58 16.18 -25.41 6.11 17.58 -27.30 1mdr_c01 source 1mdr MANDELATE RACEMASE (E.C.5.1.2.2) : 1 hits 1mdr_c01 naa= 3 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 1 3 # 1 A 50 ASP A 32 ASP.? 10.92 O ACY A 402 A 55 TYR A 6 TYR^? 17.89 O ACY A 402 A 84 LYS A 3 LYS.? 16.38 O ACY A 402 coo 11.09 42.89 24.44 11.32 42.06 22.49 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 4.60 40.33 20.42 7.25 39.50 20.05 5.36 6.34 -15.79 3.13 4.70 -15.92 coo 9.71 44.83 15.47 10.13 41.43 19.93 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 2 3 # 2 A 50 ASP B 14 ASP.? 10.32 CH3 ACY B 403 A 55 TYR B 19 TYR~? 7.66 CH3 ACY B 403 A 84 LYS B 17 LYS~? 19.82 CH3 ACY B 401 coo 11.09 42.89 24.44 11.32 42.06 22.49 4.45 14.77 1.64 4.87 15.68 -0.19 coo 4.60 40.33 20.42 7.25 39.50 20.05 10.24 15.60 3.03 8.77 16.10 0.69 coo 9.71 44.83 15.47 10.13 41.43 19.93 10.28 12.10 9.11 8.33 8.93 13.61 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 3 3 # 3 A 50 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 55 TYR B 6 TYR^? 19.40 O ACY B 403 A 84 LYS B 3 LYS.? 19.35 OXT ACY B 401 coo 11.09 42.89 24.44 11.32 42.06 22.49 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 4.60 40.33 20.42 7.25 39.50 20.05 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 9.71 44.83 15.47 10.13 41.43 19.93 35.65 7.25 -8.40 36.12 12.24 -4.67 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 4 3 # 4 A 50 ASP C 14 ASP.? 7.62 O ACY C 404 A 55 TYR C 19 TYR~? -3.65 O ACY C 404s A 84 LYS C 17 LYS~? 14.11 CH3 ACY C 404 coo 11.09 42.89 24.44 11.32 42.06 22.49 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 4.60 40.33 20.42 7.25 39.50 20.05 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 9.71 44.83 15.47 10.13 41.43 19.93 8.25 27.86 -34.26 8.79 32.54 -37.59 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 5 3 # 5 A 50 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 55 TYR C 6 TYR^? 20.74 O2 GOL A 501 A 84 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 11.09 42.89 24.44 11.32 42.06 22.49 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 4.60 40.33 20.42 7.25 39.50 20.05 28.12 33.29 -18.50 30.13 35.12 -19.15 coo 9.71 44.83 15.47 10.13 41.43 19.93 35.92 31.10 -19.94 35.74 27.15 -23.97 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 6 3 # 6 A 50 ASP D 14 ASP.? 10.51 OXT ACY B 401 A 55 TYR D 19 TYR~? 6.50 OXT ACY B 401 A 84 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo 11.09 42.89 24.44 11.32 42.06 22.49 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 4.60 40.33 20.42 7.25 39.50 20.05 24.45 24.76 1.05 22.95 23.32 -0.81 coo 9.71 44.83 15.47 10.13 41.43 19.93 26.90 28.52 7.20 25.78 33.34 9.99 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 7 3 # 7 A 50 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 55 TYR D 6 TYR^? 18.56 CH3 ACY B 403 A 84 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo 11.09 42.89 24.44 11.32 42.06 22.49 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 4.60 40.33 20.42 7.25 39.50 20.05 7.30 34.85 -8.71 5.25 36.67 -8.19 coo 9.71 44.83 15.47 10.13 41.43 19.93 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 8 3 # 8 A 50 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 55 TYR D 6 TYR^? 18.56 CH3 ACY B 403 A 84 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 11.09 42.89 24.44 11.32 42.06 22.49 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 4.60 40.33 20.42 7.25 39.50 20.05 7.30 34.85 -8.71 5.25 36.67 -8.19 coo 9.71 44.83 15.47 10.13 41.43 19.93 3.89 29.44 -7.86 -1.70 27.89 -10.01 1mrq_c02 source 1mrq ALDO-KETO REDUCTASE FAMILY 1 MEMBER C1 : 8 hits 1mrq_c02 naa= 3 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 1 3 # 1 A 167 LYS A 3 LYS.? 16.38 O ACY A 402 A 169 LYS A 54 LYS.? 19.07 O ACY A 402 A 327 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo 20.73 15.53 25.54 22.09 15.64 19.40 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 24.31 10.25 23.71 29.02 12.05 20.75 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 21.86 20.40 18.59 22.12 18.33 18.33 -1.81 16.10 -9.11 -1.93 15.47 -11.12 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 2 3 # 2 A 167 LYS A 54 LYS.? 19.07 O ACY A 402 A 169 LYS A 3 LYS.? 16.38 O ACY A 402 A 327 GLU A 31 GLU.? 11.52 CH3 ACY A 402 coo 20.73 15.53 25.54 22.09 15.64 19.40 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 24.31 10.25 23.71 29.02 12.05 20.75 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 21.86 20.40 18.59 22.12 18.33 18.33 0.44 16.93 -24.63 -1.32 16.41 -25.67 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 3 3 # 3 A 167 LYS A 54 LYS.? 19.07 O ACY A 402 A 169 LYS A 3 LYS.? 16.38 O ACY A 402 A 327 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo 20.73 15.53 25.54 22.09 15.64 19.40 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 24.31 10.25 23.71 29.02 12.05 20.75 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 21.86 20.40 18.59 22.12 18.33 18.33 -1.81 16.10 -9.11 -1.93 15.47 -11.12 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 4 3 # 4 A 167 LYS A 54 LYS.? 19.07 O ACY A 402 A 169 LYS A 3 LYS.? 16.38 O ACY A 402 A 327 GLU B 44 GLU~? 18.30 CH3 ACY B 403 coo 20.73 15.53 25.54 22.09 15.64 19.40 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 24.31 10.25 23.71 29.02 12.05 20.75 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 21.86 20.40 18.59 22.12 18.33 18.33 0.81 11.28 -7.46 -1.17 10.55 -7.79 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 5 3 # 5 A 167 LYS B 54 LYS.? 19.51 O4 PO4 A 302 A 169 LYS B 3 LYS.? 19.35 OXT ACY B 401 A 327 GLU A 43 GLU~? 17.21 O4 PO4 A 302 coo 20.73 15.53 25.54 22.09 15.64 19.40 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 24.31 10.25 23.71 29.02 12.05 20.75 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 21.86 20.40 18.59 22.12 18.33 18.33 34.86 12.61 -16.78 35.59 13.22 -14.90 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 6 3 # 6 A 167 LYS B 54 LYS.? 19.51 O4 PO4 A 302 A 169 LYS B 3 LYS.? 19.35 OXT ACY B 401 A 327 GLU A 44 GLU~? 15.81 O4 PO4 A 302 coo 20.73 15.53 25.54 22.09 15.64 19.40 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 24.31 10.25 23.71 29.02 12.05 20.75 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 21.86 20.40 18.59 22.12 18.33 18.33 32.63 9.21 -17.75 34.50 8.25 -17.69 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 7 3 # 7 A 167 LYS B 54 LYS.? 19.51 O4 PO4 A 302 A 169 LYS B 3 LYS.? 19.35 OXT ACY B 401 A 327 GLU B 31 GLU.? 14.62 OXT ACY B 401 coo 20.73 15.53 25.54 22.09 15.64 19.40 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 24.31 10.25 23.71 29.02 12.05 20.75 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 21.86 20.40 18.59 22.12 18.33 18.33 33.31 16.38 -0.70 33.25 18.46 -1.14 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 8 3 # 8 A 167 LYS C 3 LYS.? 18.92 O1 PO4 A 302 A 169 LYS C 54 LYS.? 21.14 O4 PO4 A 302 A 327 GLU D 43 GLU~? 22.18 O4 PO4 A 302 coo 20.73 15.53 25.54 22.09 15.64 19.40 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 24.31 10.25 23.71 29.02 12.05 20.75 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 21.86 20.40 18.59 22.12 18.33 18.33 36.87 25.85 -11.48 36.80 25.51 -13.56 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 9 3 # 9 A 167 LYS C 54 LYS.? 21.14 O4 PO4 A 302 A 169 LYS C 3 LYS.? 18.92 O1 PO4 A 302 A 327 GLU C 31 GLU.? 14.58 O1 PO4 A 302 coo 20.73 15.53 25.54 22.09 15.64 19.40 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 24.31 10.25 23.71 29.02 12.05 20.75 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 21.86 20.40 18.59 22.12 18.33 18.33 31.25 23.87 -27.43 32.95 24.08 -28.66 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 10 3 # 10 A 167 LYS C 54 LYS.? 21.14 O4 PO4 A 302 A 169 LYS C 3 LYS.? 18.92 O1 PO4 A 302 A 327 GLU D 43 GLU~? 22.18 O4 PO4 A 302 coo 20.73 15.53 25.54 22.09 15.64 19.40 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 24.31 10.25 23.71 29.02 12.05 20.75 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 21.86 20.40 18.59 22.12 18.33 18.33 36.87 25.85 -11.48 36.80 25.51 -13.56 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 11 3 # 11 A 167 LYS C 54 LYS.? 21.14 O4 PO4 A 302 A 169 LYS C 3 LYS.? 18.92 O1 PO4 A 302 A 327 GLU D 44 GLU~? 21.69 OXT ACY B 401 coo 20.73 15.53 25.54 22.09 15.64 19.40 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 24.31 10.25 23.71 29.02 12.05 20.75 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 21.86 20.40 18.59 22.12 18.33 18.33 34.05 29.14 -10.19 35.86 30.19 -10.55 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 12 3 # 12 A 167 LYS D 54 LYS.? 18.95 CH3 ACY B 403 A 169 LYS D 3 LYS.? 18.33 CH3 ACY B 403 A 327 GLU C 44 GLU~? 16.01 O ACY C 404 coo 20.73 15.53 25.54 22.09 15.64 19.40 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 24.31 10.25 23.71 29.02 12.05 20.75 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 21.86 20.40 18.59 22.12 18.33 18.33 1.25 30.44 -16.59 -0.63 31.35 -16.34 ULMN 3 1muc_c00 MUCONATE LACTONIZING ENZYME user 13 3 # 13 A 167 LYS D 54 LYS.? 18.95 CH3 ACY B 403 A 169 LYS D 3 LYS.? 18.33 CH3 ACY B 403 A 327 GLU D 31 GLU.? 15.11 CH3 ACY B 403 coo 20.73 15.53 25.54 22.09 15.64 19.40 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 24.31 10.25 23.71 29.02 12.05 20.75 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 21.86 20.40 18.59 22.12 18.33 18.33 2.56 25.26 0.73 1.39 26.46 2.05 1muc_c00 source 1muc MUCONATE LACTONIZING ENZYME : 13 hits 1muc_c00 naa= 3 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 1 3 # 1 B 167 LYS A 3 LYS.? 16.38 O ACY A 402 B 169 LYS A 54 LYS.? 19.07 O ACY A 402 B 327 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 -1.81 16.10 -9.11 -1.93 15.47 -11.12 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 2 3 # 2 B 167 LYS A 54 LYS.? 19.07 O ACY A 402 B 169 LYS A 3 LYS.? 16.38 O ACY A 402 B 327 GLU A 31 GLU.? 11.52 CH3 ACY A 402 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 0.44 16.93 -24.63 -1.32 16.41 -25.67 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 3 3 # 3 B 167 LYS A 54 LYS.? 19.07 O ACY A 402 B 169 LYS A 3 LYS.? 16.38 O ACY A 402 B 327 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 -1.81 16.10 -9.11 -1.93 15.47 -11.12 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 4 3 # 4 B 167 LYS A 54 LYS.? 19.07 O ACY A 402 B 169 LYS A 3 LYS.? 16.38 O ACY A 402 B 327 GLU B 44 GLU~? 18.30 CH3 ACY B 403 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 0.81 11.28 -7.46 -1.17 10.55 -7.79 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 5 3 # 5 B 167 LYS B 54 LYS.? 19.51 O4 PO4 A 302 B 169 LYS B 3 LYS.? 19.35 OXT ACY B 401 B 327 GLU A 43 GLU~? 17.21 O4 PO4 A 302 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 34.86 12.61 -16.78 35.59 13.22 -14.90 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 6 3 # 6 B 167 LYS B 54 LYS.? 19.51 O4 PO4 A 302 B 169 LYS B 3 LYS.? 19.35 OXT ACY B 401 B 327 GLU A 44 GLU~? 15.81 O4 PO4 A 302 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 32.63 9.21 -17.75 34.50 8.25 -17.69 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 7 3 # 7 B 167 LYS B 54 LYS.? 19.51 O4 PO4 A 302 B 169 LYS B 3 LYS.? 19.35 OXT ACY B 401 B 327 GLU B 31 GLU.? 14.62 OXT ACY B 401 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 33.31 16.38 -0.70 33.25 18.46 -1.14 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 8 3 # 8 B 167 LYS C 3 LYS.? 18.92 O1 PO4 A 302 B 169 LYS C 54 LYS.? 21.14 O4 PO4 A 302 B 327 GLU D 43 GLU~? 22.18 O4 PO4 A 302 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 36.87 25.85 -11.48 36.80 25.51 -13.56 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 9 3 # 9 B 167 LYS C 54 LYS.? 21.14 O4 PO4 A 302 B 169 LYS C 3 LYS.? 18.92 O1 PO4 A 302 B 327 GLU C 31 GLU.? 14.58 O1 PO4 A 302 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 31.25 23.87 -27.43 32.95 24.08 -28.66 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 10 3 # 10 B 167 LYS C 54 LYS.? 21.14 O4 PO4 A 302 B 169 LYS C 3 LYS.? 18.92 O1 PO4 A 302 B 327 GLU D 43 GLU~? 22.18 O4 PO4 A 302 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 36.87 25.85 -11.48 36.80 25.51 -13.56 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 11 3 # 11 B 167 LYS C 54 LYS.? 21.14 O4 PO4 A 302 B 169 LYS C 3 LYS.? 18.92 O1 PO4 A 302 B 327 GLU D 44 GLU~? 21.69 OXT ACY B 401 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 35.92 31.10 -19.94 35.74 27.15 -23.97 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 34.05 29.14 -10.19 35.86 30.19 -10.55 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 12 3 # 12 B 167 LYS D 54 LYS.? 18.95 CH3 ACY B 403 B 169 LYS D 3 LYS.? 18.33 CH3 ACY B 403 B 327 GLU C 44 GLU~? 16.01 O ACY C 404 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 1.25 30.44 -16.59 -0.63 31.35 -16.34 ULMN 3 1muc_c01 MUCONATE LACTONIZING ENZYME user 13 3 # 13 B 167 LYS D 54 LYS.? 18.95 CH3 ACY B 403 B 169 LYS D 3 LYS.? 18.33 CH3 ACY B 403 B 327 GLU D 31 GLU.? 15.11 CH3 ACY B 403 coo 25.79 1.90 -25.69 27.00 2.59 -19.56 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 25.18 8.17 -23.75 30.94 6.65 -21.59 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 29.96 -1.07 -18.59 28.74 0.63 -18.32 2.56 25.26 0.73 1.39 26.46 2.05 1muc_c01 source 1muc MUCONATE LACTONIZING ENZYME : 13 hits 1muc_c01 naa= 3 ULMN 3 1nsf_c00 N-ETHYLMALEIMIDE SENSITIVE FACTOR user 1 3 # 1 549 LYS A 81 LYS.? 21.98 O ACY B 403 631 LYS B 66 LYS~? 18.61 CH3 ACY B 401 708 LYS A 3 LYS.? 16.38 O ACY A 402 coo 8.61 33.06 11.15 10.12 29.19 8.82 3.08 5.09 -7.58 2.00 0.68 -7.21 coo -11.99 27.40 17.14 -13.60 24.52 11.71 20.89 3.87 3.84 24.86 4.42 7.52 coo 18.16 32.86 9.85 16.06 28.20 13.56 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1nsf_c00 N-ETHYLMALEIMIDE SENSITIVE FACTOR user 2 3 # 2 549 LYS C 81 LYS.? 25.54 OXT ACY B 401 631 LYS D 66 LYS~? 18.65 CH3 ACY B 401 708 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 8.61 33.06 11.15 10.12 29.19 8.82 31.22 35.67 -10.67 31.64 40.37 -10.68 coo -11.99 27.40 17.14 -13.60 24.52 11.71 15.33 36.81 3.59 11.66 36.34 7.56 coo 18.16 32.86 9.85 16.06 28.20 13.56 35.92 31.10 -19.94 35.74 27.15 -23.97 ULMN 3 1nsf_c00 N-ETHYLMALEIMIDE SENSITIVE FACTOR user 3 3 # 3 549 LYS D 81 LYS.? 19.75 O ACY C 404 631 LYS C 66 LYS~? 17.26 CH3 ACY C 404 708 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo 8.61 33.06 11.15 10.12 29.19 8.82 4.59 37.20 -16.29 4.16 41.27 -17.63 coo -11.99 27.40 17.14 -13.60 24.52 11.71 20.24 35.37 -30.72 23.66 34.59 -34.92 coo 18.16 32.86 9.85 16.06 28.20 13.56 -0.81 32.81 -7.33 -0.70 30.79 -2.45 1nsf_c00 source 1nsf N-ETHYLMALEIMIDE SENSITIVE FACTOR : 3 hits 1nsf_c00 naa= 3 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 1 3 # 1 A 62 SER A 30 SER.? -4.23 CH3 ACY A 402s A 154 ASP C 14 ASP.? 7.62 O ACY C 404 A 261 ARG C 42 ARG~? 8.34 CH3 ACY A 402 coo 16.10 74.10 3.11 17.18 73.52 5.20 6.58 16.18 -25.41 6.11 17.58 -27.30 coo 16.07 84.71 8.14 15.20 82.81 8.14 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 10.59 77.85 4.81 13.09 76.36 5.76 1.71 20.80 -20.88 4.34 19.24 -20.78 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 2 3 # 2 A 62 SER C 30 SER.? 7.40 O1 PO4 A 302 A 154 ASP A 14 ASP.? 7.78 O4 PO4 A 302 A 261 ARG A 42 ARG~? 9.50 O4 PO4 A 302 coo 16.10 74.10 3.11 17.18 73.52 5.20 25.81 22.61 -26.89 26.10 20.85 -28.49 coo 16.07 84.71 8.14 15.20 82.81 8.14 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 10.59 77.85 4.81 13.09 76.36 5.76 31.60 18.55 -22.55 28.82 19.89 -22.65 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 3 3 # 3 A 62 SER D 30 SER.? 8.07 CH3 ACY B 403 A 154 ASP B 14 ASP.? 10.32 CH3 ACY B 403 A 261 ARG B 42 ARG~? 8.81 CH3 ACY B 403 coo 16.10 74.10 3.11 17.18 73.52 5.20 8.81 24.50 0.42 8.52 22.82 2.10 coo 16.07 84.71 8.14 15.20 82.81 8.14 4.45 14.77 1.64 4.87 15.68 -0.19 coo 10.59 77.85 4.81 13.09 76.36 5.76 2.83 20.50 -3.25 5.45 21.98 -3.93 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 4 3 # 4 A 62 SER D 71 SER.? 19.92 CH3 ACY B 401 A 154 ASP D 14 ASP.? 10.51 OXT ACY B 401 A 261 ARG D 15 ARG~? 18.11 CH3 ACY B 401 coo 16.10 74.10 3.11 17.18 73.52 5.20 25.95 36.51 3.79 28.23 36.90 4.60 coo 16.07 84.71 8.14 15.20 82.81 8.14 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 10.59 77.85 4.81 13.09 76.36 5.76 31.29 30.80 4.15 30.20 33.45 3.07 1o98_c00 source 1o98 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT PHOSPHOGLY: 4 hits 1o98_c00 naa= 3 ULMN 3 1ohh_c06 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 A 175 LYS A 66 LYS~? 16.67 O ACY A 402 A 208 GLN A 21 GLN~? 11.13 O3 PO4 A 302 A 209 LYS A 17 LYS~? 14.12 O3 PO4 A 302 coo 98.39 14.31 -19.34 101.13 12.36 -14.91 11.69 2.61 -28.49 7.34 2.61 -31.70 coo 107.44 7.66 -20.60 106.37 8.45 -22.25 18.22 8.15 -34.01 18.46 6.14 -34.67 coo 109.03 2.06 -20.49 104.00 -1.36 -18.88 22.94 9.69 -34.22 22.50 4.31 -36.79 ULMN 3 1ohh_c06 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 2 3 # 2 A 175 LYS B 66 LYS~? 18.61 CH3 ACY B 401 A 208 GLN B 21 GLN~? 15.57 CH3 ACY B 401 A 209 LYS B 17 LYS~? 19.82 CH3 ACY B 401 coo 98.39 14.31 -19.34 101.13 12.36 -14.91 20.89 3.87 3.84 24.86 4.42 7.52 coo 107.44 7.66 -20.60 106.37 8.45 -22.25 14.89 9.97 8.83 14.34 7.98 9.39 coo 109.03 2.06 -20.49 104.00 -1.36 -18.88 10.28 12.10 9.11 8.33 8.93 13.61 ULMN 3 1ohh_c06 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 3 3 # 3 A 175 LYS C 66 LYS~? 17.26 CH3 ACY C 404 A 208 GLN C 21 GLN~? 11.26 CH3 ACY C 404 A 209 LYS C 17 LYS~? 14.11 CH3 ACY C 404 coo 98.39 14.31 -19.34 101.13 12.36 -14.91 20.24 35.37 -30.72 23.66 34.59 -34.92 coo 107.44 7.66 -20.60 106.37 8.45 -22.25 13.04 29.36 -34.75 12.61 31.30 -35.54 coo 109.03 2.06 -20.49 104.00 -1.36 -18.88 8.25 27.86 -34.26 8.79 32.54 -37.59 ULMN 3 1ohh_c06 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 4 3 # 4 A 175 LYS D 66 LYS~? 18.65 CH3 ACY B 401 A 208 GLN D 21 GLN~? 15.00 CH3 ACY B 401 A 209 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo 98.39 14.31 -19.34 101.13 12.36 -14.91 15.33 36.81 3.59 11.66 36.34 7.56 coo 107.44 7.66 -20.60 106.37 8.45 -22.25 22.07 30.79 7.65 23.40 32.41 7.56 coo 109.03 2.06 -20.49 104.00 -1.36 -18.88 26.90 28.52 7.20 25.78 33.34 9.99 1ohh_c06 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 4 hits 1ohh_c06 naa= 3 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 B 175 LYS A 66 LYS~? 16.67 O ACY A 402 B 208 GLN A 21 GLN~? 11.13 O3 PO4 A 302 B 209 LYS A 17 LYS~? 14.12 O3 PO4 A 302 coo 105.03 46.01 19.55 106.59 42.35 15.55 11.69 2.61 -28.49 7.34 2.61 -31.70 coo 113.93 46.99 13.56 113.37 48.52 14.95 18.22 8.15 -34.01 18.46 6.14 -34.67 coo 115.66 49.12 8.60 111.19 49.52 4.73 22.94 9.69 -34.22 22.50 4.31 -36.79 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 2 3 # 2 B 175 LYS B 66 LYS~? 18.61 CH3 ACY B 401 B 208 GLN B 21 GLN~? 15.57 CH3 ACY B 401 B 209 LYS B 17 LYS~? 19.82 CH3 ACY B 401 coo 105.03 46.01 19.55 106.59 42.35 15.55 20.89 3.87 3.84 24.86 4.42 7.52 coo 113.93 46.99 13.56 113.37 48.52 14.95 14.89 9.97 8.83 14.34 7.98 9.39 coo 115.66 49.12 8.60 111.19 49.52 4.73 10.28 12.10 9.11 8.33 8.93 13.61 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 3 3 # 3 B 175 LYS C 66 LYS~? 17.26 CH3 ACY C 404 B 208 GLN C 21 GLN~? 11.26 CH3 ACY C 404 B 209 LYS C 17 LYS~? 14.11 CH3 ACY C 404 coo 105.03 46.01 19.55 106.59 42.35 15.55 20.24 35.37 -30.72 23.66 34.59 -34.92 coo 113.93 46.99 13.56 113.37 48.52 14.95 13.04 29.36 -34.75 12.61 31.30 -35.54 coo 115.66 49.12 8.60 111.19 49.52 4.73 8.25 27.86 -34.26 8.79 32.54 -37.59 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 4 3 # 4 B 175 LYS D 66 LYS~? 18.65 CH3 ACY B 401 B 208 GLN D 21 GLN~? 15.00 CH3 ACY B 401 B 209 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo 105.03 46.01 19.55 106.59 42.35 15.55 15.33 36.81 3.59 11.66 36.34 7.56 coo 113.93 46.99 13.56 113.37 48.52 14.95 22.07 30.79 7.65 23.40 32.41 7.56 coo 115.66 49.12 8.60 111.19 49.52 4.73 26.90 28.52 7.20 25.78 33.34 9.99 1ohh_c07 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 4 hits 1ohh_c07 naa= 3 ULMN 3 1ohh_c08 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 C 175 LYS A 66 LYS~? 16.67 O ACY A 402 C 208 GLN A 21 GLN~? 11.13 O3 PO4 A 302 C 209 LYS A 17 LYS~? 14.12 O3 PO4 A 302 coo 100.54 -2.78 25.52 103.29 2.02 24.05 11.69 2.61 -28.49 7.34 2.61 -31.70 coo 111.02 -1.31 30.92 109.87 -2.78 29.89 18.22 8.15 -34.01 18.46 6.14 -34.67 coo 113.62 1.19 33.65 109.52 3.92 36.47 22.94 9.69 -34.22 22.50 4.31 -36.79 ULMN 3 1ohh_c08 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 2 3 # 2 C 175 LYS B 17 LYS~? 19.82 CH3 ACY B 401 C 208 GLN B 69 GLN.? 20.62 O ACY B 403 C 209 LYS B 66 LYS~? 18.61 CH3 ACY B 401 coo 100.54 -2.78 25.52 103.29 2.02 24.05 10.28 12.10 9.11 8.33 8.93 13.61 coo 111.02 -1.31 30.92 109.87 -2.78 29.89 18.21 1.40 5.72 19.22 0.66 7.43 coo 113.62 1.19 33.65 109.52 3.92 36.47 20.89 3.87 3.84 24.86 4.42 7.52 ULMN 3 1ohh_c08 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 3 3 # 3 C 175 LYS B 66 LYS~? 18.61 CH3 ACY B 401 C 208 GLN B 21 GLN~? 15.57 CH3 ACY B 401 C 209 LYS B 17 LYS~? 19.82 CH3 ACY B 401 coo 100.54 -2.78 25.52 103.29 2.02 24.05 20.89 3.87 3.84 24.86 4.42 7.52 coo 111.02 -1.31 30.92 109.87 -2.78 29.89 14.89 9.97 8.83 14.34 7.98 9.39 coo 113.62 1.19 33.65 109.52 3.92 36.47 10.28 12.10 9.11 8.33 8.93 13.61 ULMN 3 1ohh_c08 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 4 3 # 4 C 175 LYS C 66 LYS~? 17.26 CH3 ACY C 404 C 208 GLN C 21 GLN~? 11.26 CH3 ACY C 404 C 209 LYS C 17 LYS~? 14.11 CH3 ACY C 404 coo 100.54 -2.78 25.52 103.29 2.02 24.05 20.24 35.37 -30.72 23.66 34.59 -34.92 coo 111.02 -1.31 30.92 109.87 -2.78 29.89 13.04 29.36 -34.75 12.61 31.30 -35.54 coo 113.62 1.19 33.65 109.52 3.92 36.47 8.25 27.86 -34.26 8.79 32.54 -37.59 ULMN 3 1ohh_c08 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 5 3 # 5 C 175 LYS D 66 LYS~? 18.65 CH3 ACY B 401 C 208 GLN D 21 GLN~? 15.00 CH3 ACY B 401 C 209 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo 100.54 -2.78 25.52 103.29 2.02 24.05 15.33 36.81 3.59 11.66 36.34 7.56 coo 111.02 -1.31 30.92 109.87 -2.78 29.89 22.07 30.79 7.65 23.40 32.41 7.56 coo 113.62 1.19 33.65 109.52 3.92 36.47 26.90 28.52 7.20 25.78 33.34 9.99 1ohh_c08 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 5 hits 1ohh_c08 naa= 3 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 A 24 ASP A 58 ASP~? 21.11 O ACY A 402 A 146 TYR A 6 TYR^? 17.89 O ACY A 402 A 177 LYS A 3 LYS.? 16.38 O ACY A 402 coo -3.50 124.89 25.05 -2.25 124.77 23.26 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 1.87 119.38 16.45 1.41 122.11 16.84 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -2.59 124.07 12.67 -0.91 126.17 18.42 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 A 24 ASP A 58 ASP~? 21.11 O ACY A 402 A 146 TYR A 6 TYR^? 17.89 O ACY A 402 A 177 LYS A 54 LYS.? 19.07 O ACY A 402 coo -3.50 124.89 25.05 -2.25 124.77 23.26 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 1.87 119.38 16.45 1.41 122.11 16.84 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -2.59 124.07 12.67 -0.91 126.17 18.42 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 A 24 ASP B 58 ASP~? 24.69 OXT ACY B 401 A 146 TYR B 6 TYR^? 19.40 O ACY B 403 A 177 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -3.50 124.89 25.05 -2.25 124.77 23.26 33.22 2.96 0.74 34.69 1.59 1.17 coo 1.87 119.38 16.45 1.41 122.11 16.84 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -2.59 124.07 12.67 -0.91 126.17 18.42 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 A 24 ASP C 58 ASP~? 25.07 O3 GOL A 501 A 146 TYR C 6 TYR^? 20.74 O2 GOL A 501 A 177 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -3.50 124.89 25.05 -2.25 124.77 23.26 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 1.87 119.38 16.45 1.41 122.11 16.84 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -2.59 124.07 12.67 -0.91 126.17 18.42 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 A 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 A 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 A 177 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo -3.50 124.89 25.05 -2.25 124.77 23.26 2.43 37.89 1.30 0.84 39.23 1.50 coo 1.87 119.38 16.45 1.41 122.11 16.84 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -2.59 124.07 12.67 -0.91 126.17 18.42 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 A 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 A 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 A 177 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -3.50 124.89 25.05 -2.25 124.77 23.26 2.43 37.89 1.30 0.84 39.23 1.50 coo 1.87 119.38 16.45 1.41 122.11 16.84 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -2.59 124.07 12.67 -0.91 126.17 18.42 3.89 29.44 -7.86 -1.70 27.89 -10.01 1ok4_c00 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 6 hits 1ok4_c00 naa= 3 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 B 24 ASP A 58 ASP~? 21.11 O ACY A 402 B 146 TYR A 6 TYR^? 17.89 O ACY A 402 B 177 LYS A 3 LYS.? 16.38 O ACY A 402 coo -7.43 109.06 51.23 -5.84 110.54 50.86 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 0.22 114.56 44.62 -0.76 115.18 47.18 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -4.18 120.17 46.85 -4.02 115.31 51.00 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 B 24 ASP A 58 ASP~? 21.11 O ACY A 402 B 146 TYR A 6 TYR^? 17.89 O ACY A 402 B 177 LYS A 54 LYS.? 19.07 O ACY A 402 coo -7.43 109.06 51.23 -5.84 110.54 50.86 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 0.22 114.56 44.62 -0.76 115.18 47.18 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -4.18 120.17 46.85 -4.02 115.31 51.00 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 B 24 ASP B 58 ASP~? 24.69 OXT ACY B 401 B 146 TYR B 6 TYR^? 19.40 O ACY B 403 B 177 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -7.43 109.06 51.23 -5.84 110.54 50.86 33.22 2.96 0.74 34.69 1.59 1.17 coo 0.22 114.56 44.62 -0.76 115.18 47.18 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -4.18 120.17 46.85 -4.02 115.31 51.00 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 B 24 ASP C 58 ASP~? 25.07 O3 GOL A 501 B 146 TYR C 6 TYR^? 20.74 O2 GOL A 501 B 177 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -7.43 109.06 51.23 -5.84 110.54 50.86 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 0.22 114.56 44.62 -0.76 115.18 47.18 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -4.18 120.17 46.85 -4.02 115.31 51.00 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 B 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 B 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 B 177 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo -7.43 109.06 51.23 -5.84 110.54 50.86 2.43 37.89 1.30 0.84 39.23 1.50 coo 0.22 114.56 44.62 -0.76 115.18 47.18 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -4.18 120.17 46.85 -4.02 115.31 51.00 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 B 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 B 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 B 177 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -7.43 109.06 51.23 -5.84 110.54 50.86 2.43 37.89 1.30 0.84 39.23 1.50 coo 0.22 114.56 44.62 -0.76 115.18 47.18 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -4.18 120.17 46.85 -4.02 115.31 51.00 3.89 29.44 -7.86 -1.70 27.89 -10.01 1ok4_c01 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 6 hits 1ok4_c01 naa= 3 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 C 24 ASP A 58 ASP~? 21.11 O ACY A 402 C 146 TYR A 6 TYR^? 17.89 O ACY A 402 C 177 LYS A 3 LYS.? 16.38 O ACY A 402 coo -13.49 79.65 43.90 -12.13 80.29 45.45 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -5.65 86.78 48.49 -7.16 84.72 49.65 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -11.22 87.18 53.49 -10.94 81.64 50.31 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 C 24 ASP A 58 ASP~? 21.11 O ACY A 402 C 146 TYR A 6 TYR^? 17.89 O ACY A 402 C 177 LYS A 54 LYS.? 19.07 O ACY A 402 coo -13.49 79.65 43.90 -12.13 80.29 45.45 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -5.65 86.78 48.49 -7.16 84.72 49.65 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -11.22 87.18 53.49 -10.94 81.64 50.31 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 C 24 ASP B 58 ASP~? 24.69 OXT ACY B 401 C 146 TYR B 6 TYR^? 19.40 O ACY B 403 C 177 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -13.49 79.65 43.90 -12.13 80.29 45.45 33.22 2.96 0.74 34.69 1.59 1.17 coo -5.65 86.78 48.49 -7.16 84.72 49.65 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -11.22 87.18 53.49 -10.94 81.64 50.31 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 C 24 ASP C 58 ASP~? 25.07 O3 GOL A 501 C 146 TYR C 6 TYR^? 20.74 O2 GOL A 501 C 177 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -13.49 79.65 43.90 -12.13 80.29 45.45 32.89 35.88 -28.31 34.37 37.32 -28.69 coo -5.65 86.78 48.49 -7.16 84.72 49.65 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -11.22 87.18 53.49 -10.94 81.64 50.31 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 C 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 C 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 C 177 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo -13.49 79.65 43.90 -12.13 80.29 45.45 2.43 37.89 1.30 0.84 39.23 1.50 coo -5.65 86.78 48.49 -7.16 84.72 49.65 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -11.22 87.18 53.49 -10.94 81.64 50.31 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 C 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 C 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 C 177 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -13.49 79.65 43.90 -12.13 80.29 45.45 2.43 37.89 1.30 0.84 39.23 1.50 coo -5.65 86.78 48.49 -7.16 84.72 49.65 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -11.22 87.18 53.49 -10.94 81.64 50.31 3.89 29.44 -7.86 -1.70 27.89 -10.01 1ok4_c02 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 6 hits 1ok4_c02 naa= 3 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 D 24 ASP A 58 ASP~? 21.11 O ACY A 402 D 146 TYR A 6 TYR^? 17.89 O ACY A 402 D 177 LYS A 3 LYS.? 16.38 O ACY A 402 coo -13.44 77.36 13.12 -12.53 75.97 14.48 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -7.85 74.44 22.75 -9.22 72.86 20.89 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -14.24 70.61 23.48 -12.55 71.73 17.42 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 D 24 ASP A 58 ASP~? 21.11 O ACY A 402 D 146 TYR A 6 TYR^? 17.89 O ACY A 402 D 177 LYS A 54 LYS.? 19.07 O ACY A 402 coo -13.44 77.36 13.12 -12.53 75.97 14.48 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -7.85 74.44 22.75 -9.22 72.86 20.89 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -14.24 70.61 23.48 -12.55 71.73 17.42 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 D 24 ASP B 58 ASP~? 24.69 OXT ACY B 401 D 146 TYR B 6 TYR^? 19.40 O ACY B 403 D 177 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -13.44 77.36 13.12 -12.53 75.97 14.48 33.22 2.96 0.74 34.69 1.59 1.17 coo -7.85 74.44 22.75 -9.22 72.86 20.89 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -14.24 70.61 23.48 -12.55 71.73 17.42 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 D 24 ASP C 58 ASP~? 25.07 O3 GOL A 501 D 146 TYR C 6 TYR^? 20.74 O2 GOL A 501 D 177 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -13.44 77.36 13.12 -12.53 75.97 14.48 32.89 35.88 -28.31 34.37 37.32 -28.69 coo -7.85 74.44 22.75 -9.22 72.86 20.89 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -14.24 70.61 23.48 -12.55 71.73 17.42 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 D 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 D 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 D 177 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo -13.44 77.36 13.12 -12.53 75.97 14.48 2.43 37.89 1.30 0.84 39.23 1.50 coo -7.85 74.44 22.75 -9.22 72.86 20.89 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -14.24 70.61 23.48 -12.55 71.73 17.42 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 D 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 D 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 D 177 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -13.44 77.36 13.12 -12.53 75.97 14.48 2.43 37.89 1.30 0.84 39.23 1.50 coo -7.85 74.44 22.75 -9.22 72.86 20.89 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -14.24 70.61 23.48 -12.55 71.73 17.42 3.89 29.44 -7.86 -1.70 27.89 -10.01 1ok4_c03 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 6 hits 1ok4_c03 naa= 3 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 E 24 ASP A 58 ASP~? 21.11 O ACY A 402 E 146 TYR A 6 TYR^? 17.89 O ACY A 402 E 177 LYS A 3 LYS.? 16.38 O ACY A 402 coo -7.12 105.25 1.43 -6.30 103.34 0.77 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -3.11 94.55 3.01 -3.83 95.92 0.66 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 E 24 ASP A 58 ASP~? 21.11 O ACY A 402 E 146 TYR A 6 TYR^? 17.89 O ACY A 402 E 177 LYS A 54 LYS.? 19.07 O ACY A 402 coo -7.12 105.25 1.43 -6.30 103.34 0.77 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -3.11 94.55 3.01 -3.83 95.92 0.66 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 E 24 ASP B 58 ASP~? 24.69 OXT ACY B 401 E 146 TYR B 6 TYR^? 19.40 O ACY B 403 E 177 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -7.12 105.25 1.43 -6.30 103.34 0.77 33.22 2.96 0.74 34.69 1.59 1.17 coo -3.11 94.55 3.01 -3.83 95.92 0.66 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 E 24 ASP C 58 ASP~? 25.07 O3 GOL A 501 E 146 TYR C 6 TYR^? 20.74 O2 GOL A 501 E 177 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -7.12 105.25 1.43 -6.30 103.34 0.77 32.89 35.88 -28.31 34.37 37.32 -28.69 coo -3.11 94.55 3.01 -3.83 95.92 0.66 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 E 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 E 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 E 177 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo -7.12 105.25 1.43 -6.30 103.34 0.77 2.43 37.89 1.30 0.84 39.23 1.50 coo -3.11 94.55 3.01 -3.83 95.92 0.66 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 E 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 E 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 E 177 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -7.12 105.25 1.43 -6.30 103.34 0.77 2.43 37.89 1.30 0.84 39.23 1.50 coo -3.11 94.55 3.01 -3.83 95.92 0.66 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 3.89 29.44 -7.86 -1.70 27.89 -10.01 1ok4_c04 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 6 hits 1ok4_c04 naa= 3 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 F 24 ASP A 58 ASP~? 21.11 O ACY A 402 F 146 TYR A 6 TYR^? 17.89 O ACY A 402 F 177 LYS A 3 LYS.? 16.38 O ACY A 402 coo -44.75 128.15 10.28 -45.68 129.67 11.55 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -50.43 131.90 19.60 -49.04 133.31 17.60 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -44.10 135.86 19.99 -45.67 134.21 14.07 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 F 24 ASP A 58 ASP~? 21.11 O ACY A 402 F 146 TYR A 6 TYR^? 17.89 O ACY A 402 F 177 LYS A 54 LYS.? 19.07 O ACY A 402 coo -44.75 128.15 10.28 -45.68 129.67 11.55 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -50.43 131.90 19.60 -49.04 133.31 17.60 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -44.10 135.86 19.99 -45.67 134.21 14.07 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 F 24 ASP B 58 ASP~? 24.69 OXT ACY B 401 F 146 TYR B 6 TYR^? 19.40 O ACY B 403 F 177 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -44.75 128.15 10.28 -45.68 129.67 11.55 33.22 2.96 0.74 34.69 1.59 1.17 coo -50.43 131.90 19.60 -49.04 133.31 17.60 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -44.10 135.86 19.99 -45.67 134.21 14.07 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 F 24 ASP C 58 ASP~? 25.07 O3 GOL A 501 F 146 TYR C 6 TYR^? 20.74 O2 GOL A 501 F 177 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -44.75 128.15 10.28 -45.68 129.67 11.55 32.89 35.88 -28.31 34.37 37.32 -28.69 coo -50.43 131.90 19.60 -49.04 133.31 17.60 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -44.10 135.86 19.99 -45.67 134.21 14.07 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 F 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 F 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 F 177 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo -44.75 128.15 10.28 -45.68 129.67 11.55 2.43 37.89 1.30 0.84 39.23 1.50 coo -50.43 131.90 19.60 -49.04 133.31 17.60 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -44.10 135.86 19.99 -45.67 134.21 14.07 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 F 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 F 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 F 177 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -44.75 128.15 10.28 -45.68 129.67 11.55 2.43 37.89 1.30 0.84 39.23 1.50 coo -50.43 131.90 19.60 -49.04 133.31 17.60 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -44.10 135.86 19.99 -45.67 134.21 14.07 3.89 29.44 -7.86 -1.70 27.89 -10.01 1ok4_c05 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 6 hits 1ok4_c05 naa= 3 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 G 24 ASP A 58 ASP~? 21.11 O ACY A 402 G 146 TYR A 6 TYR^? 17.89 O ACY A 402 G 177 LYS A 3 LYS.? 16.38 O ACY A 402 coo -44.97 128.78 41.20 -46.32 128.26 42.83 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -52.83 122.13 46.42 -51.31 124.30 47.39 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -47.30 122.24 51.49 -47.46 127.44 47.81 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 G 24 ASP A 58 ASP~? 21.11 O ACY A 402 G 146 TYR A 6 TYR^? 17.89 O ACY A 402 G 177 LYS A 54 LYS.? 19.07 O ACY A 402 coo -44.97 128.78 41.20 -46.32 128.26 42.83 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -52.83 122.13 46.42 -51.31 124.30 47.39 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -47.30 122.24 51.49 -47.46 127.44 47.81 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 G 24 ASP B 58 ASP~? 24.69 OXT ACY B 401 G 146 TYR B 6 TYR^? 19.40 O ACY B 403 G 177 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -44.97 128.78 41.20 -46.32 128.26 42.83 33.22 2.96 0.74 34.69 1.59 1.17 coo -52.83 122.13 46.42 -51.31 124.30 47.39 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -47.30 122.24 51.49 -47.46 127.44 47.81 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 G 24 ASP C 58 ASP~? 25.07 O3 GOL A 501 G 146 TYR C 6 TYR^? 20.74 O2 GOL A 501 G 177 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -44.97 128.78 41.20 -46.32 128.26 42.83 32.89 35.88 -28.31 34.37 37.32 -28.69 coo -52.83 122.13 46.42 -51.31 124.30 47.39 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -47.30 122.24 51.49 -47.46 127.44 47.81 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 G 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 G 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 G 177 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo -44.97 128.78 41.20 -46.32 128.26 42.83 2.43 37.89 1.30 0.84 39.23 1.50 coo -52.83 122.13 46.42 -51.31 124.30 47.39 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -47.30 122.24 51.49 -47.46 127.44 47.81 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 G 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 G 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 G 177 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -44.97 128.78 41.20 -46.32 128.26 42.83 2.43 37.89 1.30 0.84 39.23 1.50 coo -52.83 122.13 46.42 -51.31 124.30 47.39 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -47.30 122.24 51.49 -47.46 127.44 47.81 3.89 29.44 -7.86 -1.70 27.89 -10.01 1ok4_c06 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 6 hits 1ok4_c06 naa= 3 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 H 24 ASP A 58 ASP~? 21.11 O ACY A 402 H 146 TYR A 6 TYR^? 17.89 O ACY A 402 H 177 LYS A 3 LYS.? 16.38 O ACY A 402 coo -51.11 100.30 51.41 -52.67 98.82 51.12 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -58.70 94.17 45.32 -57.76 93.82 47.92 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -54.32 88.79 48.13 -54.61 94.04 51.74 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 H 24 ASP A 58 ASP~? 21.11 O ACY A 402 H 146 TYR A 6 TYR^? 17.89 O ACY A 402 H 177 LYS A 54 LYS.? 19.07 O ACY A 402 coo -51.11 100.30 51.41 -52.67 98.82 51.12 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -58.70 94.17 45.32 -57.76 93.82 47.92 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -54.32 88.79 48.13 -54.61 94.04 51.74 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 H 24 ASP B 58 ASP~? 24.69 OXT ACY B 401 H 146 TYR B 6 TYR^? 19.40 O ACY B 403 H 177 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -51.11 100.30 51.41 -52.67 98.82 51.12 33.22 2.96 0.74 34.69 1.59 1.17 coo -58.70 94.17 45.32 -57.76 93.82 47.92 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -54.32 88.79 48.13 -54.61 94.04 51.74 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 H 24 ASP C 58 ASP~? 25.07 O3 GOL A 501 H 146 TYR C 6 TYR^? 20.74 O2 GOL A 501 H 177 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -51.11 100.30 51.41 -52.67 98.82 51.12 32.89 35.88 -28.31 34.37 37.32 -28.69 coo -58.70 94.17 45.32 -57.76 93.82 47.92 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -54.32 88.79 48.13 -54.61 94.04 51.74 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 H 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 H 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 H 177 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo -51.11 100.30 51.41 -52.67 98.82 51.12 2.43 37.89 1.30 0.84 39.23 1.50 coo -58.70 94.17 45.32 -57.76 93.82 47.92 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -54.32 88.79 48.13 -54.61 94.04 51.74 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 H 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 H 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 H 177 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -51.11 100.30 51.41 -52.67 98.82 51.12 2.43 37.89 1.30 0.84 39.23 1.50 coo -58.70 94.17 45.32 -57.76 93.82 47.92 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -54.32 88.79 48.13 -54.61 94.04 51.74 3.89 29.44 -7.86 -1.70 27.89 -10.01 1ok4_c07 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 6 hits 1ok4_c07 naa= 3 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 I 24 ASP A 58 ASP~? 21.11 O ACY A 402 I 146 TYR A 6 TYR^? 17.89 O ACY A 402 I 177 LYS A 3 LYS.? 16.38 O ACY A 402 coo -54.65 81.97 26.87 -55.88 81.89 25.07 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -59.92 86.62 17.74 -59.42 83.94 18.40 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -55.38 81.61 14.50 -57.11 80.05 20.41 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 I 24 ASP A 58 ASP~? 21.11 O ACY A 402 I 146 TYR A 6 TYR^? 17.89 O ACY A 402 I 177 LYS A 54 LYS.? 19.07 O ACY A 402 coo -54.65 81.97 26.87 -55.88 81.89 25.07 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -59.92 86.62 17.74 -59.42 83.94 18.40 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -55.38 81.61 14.50 -57.11 80.05 20.41 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 I 24 ASP B 58 ASP~? 24.69 OXT ACY B 401 I 146 TYR B 6 TYR^? 19.40 O ACY B 403 I 177 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -54.65 81.97 26.87 -55.88 81.89 25.07 33.22 2.96 0.74 34.69 1.59 1.17 coo -59.92 86.62 17.74 -59.42 83.94 18.40 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -55.38 81.61 14.50 -57.11 80.05 20.41 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 I 24 ASP C 58 ASP~? 25.07 O3 GOL A 501 I 146 TYR C 6 TYR^? 20.74 O2 GOL A 501 I 177 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -54.65 81.97 26.87 -55.88 81.89 25.07 32.89 35.88 -28.31 34.37 37.32 -28.69 coo -59.92 86.62 17.74 -59.42 83.94 18.40 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -55.38 81.61 14.50 -57.11 80.05 20.41 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 I 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 I 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 I 177 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo -54.65 81.97 26.87 -55.88 81.89 25.07 2.43 37.89 1.30 0.84 39.23 1.50 coo -59.92 86.62 17.74 -59.42 83.94 18.40 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -55.38 81.61 14.50 -57.11 80.05 20.41 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 I 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 I 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 I 177 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -54.65 81.97 26.87 -55.88 81.89 25.07 2.43 37.89 1.30 0.84 39.23 1.50 coo -59.92 86.62 17.74 -59.42 83.94 18.40 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -55.38 81.61 14.50 -57.11 80.05 20.41 3.89 29.44 -7.86 -1.70 27.89 -10.01 1ok4_c08 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 6 hits 1ok4_c08 naa= 3 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 J 24 ASP A 58 ASP~? 21.11 O ACY A 402 J 146 TYR A 6 TYR^? 17.89 O ACY A 402 J 177 LYS A 3 LYS.? 16.38 O ACY A 402 coo -50.64 99.08 1.52 -51.52 100.83 0.67 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 J 24 ASP A 58 ASP~? 21.11 O ACY A 402 J 146 TYR A 6 TYR^? 17.89 O ACY A 402 J 177 LYS A 54 LYS.? 19.07 O ACY A 402 coo -50.64 99.08 1.52 -51.52 100.83 0.67 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 5.36 6.34 -15.79 3.13 4.70 -15.92 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 2.42 11.92 -16.67 -2.67 14.14 -13.69 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 3 3 # 3 J 24 ASP B 58 ASP~? 24.69 OXT ACY B 401 J 146 TYR B 6 TYR^? 19.40 O ACY B 403 J 177 LYS B 54 LYS.? 19.51 O4 PO4 A 302 coo -50.64 99.08 1.52 -51.52 100.83 0.67 33.22 2.96 0.74 34.69 1.59 1.17 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 27.43 5.57 -8.88 29.53 3.76 -8.64 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 31.00 10.85 -8.70 36.11 12.09 -12.03 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 4 3 # 4 J 24 ASP C 58 ASP~? 25.07 O3 GOL A 501 J 146 TYR C 6 TYR^? 20.74 O2 GOL A 501 J 177 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo -50.64 99.08 1.52 -51.52 100.83 0.67 32.89 35.88 -28.31 34.37 37.32 -28.69 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 28.12 33.29 -18.50 30.13 35.12 -19.15 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 5 3 # 5 J 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 J 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 J 177 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo -50.64 99.08 1.52 -51.52 100.83 0.67 2.43 37.89 1.30 0.84 39.23 1.50 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 6 3 # 6 J 24 ASP D 58 ASP~? 23.91 CH3 ACY B 403 J 146 TYR D 6 TYR^? 18.56 CH3 ACY B 403 J 177 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo -50.64 99.08 1.52 -51.52 100.83 0.67 2.43 37.89 1.30 0.84 39.23 1.50 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 7.30 34.85 -8.71 5.25 36.67 -8.19 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 3.89 29.44 -7.86 -1.70 27.89 -10.01 1ok4_c09 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 6 hits 1ok4_c09 naa= 3 ULMN 3 1onr_c00 TRANSALDOLASE B user 1 3 # 1 A 17 ASP A 56 ASP~? 17.92 O ACY A 402 A 96 GLU B 44 GLU~? 18.30 CH3 ACY B 403 A 132 LYS A 81 LYS.? 21.98 O ACY B 403 coo 31.23 12.29 16.44 30.82 11.56 18.39 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 26.82 3.20 24.36 27.99 4.86 24.98 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 29.99 0.62 22.18 30.38 6.69 20.81 3.08 5.09 -7.58 2.00 0.68 -7.21 1onr_c00 source 1onr TRANSALDOLASE B : 1 hits 1onr_c00 naa= 3 ULMN 3 1onr_c01 TRANSALDOLASE B user 1 3 # 1 B 17 ASP A 56 ASP~? 17.92 O ACY A 402 B 96 GLU B 44 GLU~? 18.30 CH3 ACY B 403 B 132 LYS A 81 LYS.? 21.98 O ACY B 403 coo 31.16 57.31 -0.94 30.73 56.64 1.01 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 26.69 48.45 7.18 27.85 50.13 7.74 0.81 11.28 -7.46 -1.17 10.55 -7.79 coo 29.82 45.80 5.07 30.26 51.81 3.56 3.08 5.09 -7.58 2.00 0.68 -7.21 1onr_c01 source 1onr TRANSALDOLASE B : 1 hits 1onr_c01 naa= 3 ULMN 3 1oyg_c00 LEVANSUCRASE user 1 3 # 1 A 86 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 247 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 342 GLU B 31 GLU.? 14.62 OXT ACY B 401 coo 44.36 35.68 9.71 43.29 36.20 11.51 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 41.40 28.81 12.91 40.82 30.90 12.97 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 40.37 33.11 18.06 39.99 34.93 17.06 33.31 16.38 -0.70 33.25 18.46 -1.14 ULMN 3 1oyg_c00 LEVANSUCRASE user 2 3 # 2 A 86 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 247 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 342 GLU D 31 GLU.? 15.11 CH3 ACY B 403 coo 44.36 35.68 9.71 43.29 36.20 11.51 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 41.40 28.81 12.91 40.82 30.90 12.97 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 40.37 33.11 18.06 39.99 34.93 17.06 2.56 25.26 0.73 1.39 26.46 2.05 1oyg_c00 source 1oyg LEVANSUCRASE : 2 hits 1oyg_c00 naa= 3 ULMN 3 1p1x_c00 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 1 3 # 1 A 102 ASP A 32 ASP.? 10.92 O ACY A 402 A 167 LYS A 54 LYS.? 19.07 O ACY A 402 A 201 LYS A 3 LYS.? 16.38 O ACY A 402 coo 26.53 8.31 20.37 28.45 8.41 19.40 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 24.92 6.08 13.38 27.75 4.33 18.83 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 29.08 5.53 11.69 30.46 5.61 17.93 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1p1x_c00 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 2 3 # 2 A 102 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 167 LYS C 54 LYS.? 21.14 O4 PO4 A 302 A 201 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 26.53 8.31 20.37 28.45 8.41 19.40 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 24.92 6.08 13.38 27.75 4.33 18.83 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 29.08 5.53 11.69 30.46 5.61 17.93 35.92 31.10 -19.94 35.74 27.15 -23.97 1p1x_c00 source 1p1x DEOXYRIBOSE-PHOSPHATE ALDOLASE : 2 hits 1p1x_c00 naa= 3 ULMN 3 1p1x_c01 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 1 3 # 1 B1102 ASP A 32 ASP.? 10.92 O ACY A 402 B1167 LYS A 54 LYS.? 19.07 O ACY A 402 B1201 LYS A 3 LYS.? 16.38 O ACY A 402 coo 26.10 12.11 49.61 24.19 12.48 50.51 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 27.70 11.69 56.92 24.82 8.55 52.12 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 23.50 11.64 58.67 22.19 10.19 52.59 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 1p1x_c01 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 2 3 # 2 B1102 ASP C 32 ASP.? 15.02 O1 PO4 A 302 B1167 LYS C 54 LYS.? 21.14 O4 PO4 A 302 B1201 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 26.10 12.11 49.61 24.19 12.48 50.51 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 27.70 11.69 56.92 24.82 8.55 52.12 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 23.50 11.64 58.67 22.19 10.19 52.59 35.92 31.10 -19.94 35.74 27.15 -23.97 1p1x_c01 source 1p1x DEOXYRIBOSE-PHOSPHATE ALDOLASE : 2 hits 1p1x_c01 naa= 3 ULMN 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 1 3 # 1 A 225 HIS A 27 HIS~? -3.83 OXT ACY A 402s A 259 TYR C 19 TYR~? -3.65 O ACY C 404s A 552 ASP B 56 ASP~? 21.60 OXT ACY B 401 coo 11.34 95.90 25.54 12.13 96.42 23.67 9.52 16.92 -31.25 8.29 18.47 -31.94 coo 14.91 97.39 18.63 13.39 95.60 20.20 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 46.37 82.54 38.83 45.97 84.66 38.77 35.20 5.48 -3.85 34.81 5.79 -1.78 ULMN 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 2 3 # 2 A 225 HIS B 27 HIS~? 8.91 CH3 ACY B 401 A 259 TYR D 19 TYR~? 6.50 OXT ACY B 401 A 552 ASP A 56 ASP~? 17.92 O ACY A 402 coo 11.34 95.90 25.54 12.13 96.42 23.67 24.22 18.07 5.55 25.63 19.33 6.45 coo 14.91 97.39 18.63 13.39 95.60 20.20 24.45 24.76 1.05 22.95 23.32 -0.81 coo 46.37 82.54 38.83 45.97 84.66 38.77 -2.03 5.92 -20.65 -1.35 5.51 -22.61 ULMN 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 3 3 # 3 A 225 HIS B 27 HIS~? 8.91 CH3 ACY B 401 A 259 TYR D 19 TYR~? 6.50 OXT ACY B 401 A 552 ASP A 58 ASP~? 21.11 O ACY A 402 coo 11.34 95.90 25.54 12.13 96.42 23.67 24.22 18.07 5.55 25.63 19.33 6.45 coo 14.91 97.39 18.63 13.39 95.60 20.20 24.45 24.76 1.05 22.95 23.32 -0.81 coo 46.37 82.54 38.83 45.97 84.66 38.77 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 4 3 # 4 A 225 HIS C 27 HIS~? 7.34 O1 PO4 A 302 A 259 TYR A 19 TYR~? -3.51 O4 PO4 A 302s A 552 ASP D 56 ASP~? 19.96 CH3 ACY B 403 coo 11.34 95.90 25.54 12.13 96.42 23.67 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 14.91 97.39 18.63 13.39 95.60 20.20 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 46.37 82.54 38.83 45.97 84.66 38.77 0.36 35.17 -3.02 0.83 34.67 -1.05 ULMN 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 5 3 # 5 A 225 HIS D 27 HIS~? 8.84 CH3 ACY B 401 A 259 TYR B 19 TYR~? 7.66 CH3 ACY B 403 A 552 ASP C 56 ASP~? 22.04 O3 GOL A 501 coo 11.34 95.90 25.54 12.13 96.42 23.67 12.53 22.86 5.89 11.39 21.93 7.39 coo 14.91 97.39 18.63 13.39 95.60 20.20 10.24 15.60 3.03 8.77 16.10 0.69 coo 46.37 82.54 38.83 45.97 84.66 38.77 34.87 33.34 -23.80 34.50 32.98 -25.83 1pj5_c00 source 1pj5 N,N-DIMETHYLGLYCINE OXIDASE : 5 hits 1pj5_c00 naa= 3 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 1 3 # 1 111 GLN D 21 GLN~? 15.00 CH3 ACY B 401 294 GLU D 13 GLU^? 19.04 OXT ACY B 401 304 ARG D 20 ARG~? 14.11 CH3 ACY B 401 coo 15.89 18.45 46.53 15.82 16.91 48.02 22.07 30.79 7.65 23.40 32.41 7.56 coo 22.84 13.44 52.91 20.84 13.18 52.38 29.88 33.09 -1.63 31.17 34.65 -1.02 coo 8.71 17.11 46.51 7.23 17.64 49.20 23.40 25.12 9.78 26.24 26.16 10.42 1pmi_c00 source 1pmi PHOSPHOMANNOSE ISOMERASE : 1 hits 1pmi_c00 naa= 3 ULMN 3 1pyl_c00 RIBONUCLEASE user 1 3 # 1 A 56 GLU A 16 GLU~? 11.52 O1 PO4 A 302 A 67 ARG A 20 ARG~? 11.30 O1 PO4 A 302 A 86 HIS C 27 HIS~? 7.34 O1 PO4 A 302 coo 18.15 3.28 18.56 20.10 2.92 19.20 27.41 13.54 -34.49 28.46 13.63 -36.35 coo 21.52 6.83 26.64 21.22 5.53 23.85 19.43 13.50 -36.40 19.41 10.58 -37.42 coo 22.36 -1.88 25.52 23.57 -0.73 24.25 22.05 20.86 -32.07 23.10 19.40 -33.17 ULMN 3 1pyl_c00 RIBONUCLEASE user 2 3 # 2 A 56 GLU B 16 GLU~? 16.20 CH3 ACY B 401 A 67 ARG B 20 ARG~? 14.42 CH3 ACY B 401 A 86 HIS D 27 HIS~? 8.84 CH3 ACY B 401 coo 18.15 3.28 18.56 20.10 2.92 19.20 6.77 16.82 9.46 6.30 17.54 11.41 coo 21.52 6.83 26.64 21.22 5.53 23.85 14.16 15.78 11.00 13.60 12.97 12.19 coo 22.36 -1.88 25.52 23.57 -0.73 24.25 12.53 22.86 5.89 11.39 21.93 7.39 1pyl_c00 source 1pyl RIBONUCLEASE : 2 hits 1pyl_c00 naa= 3 ULMN 3 1pyl_c01 RIBONUCLEASE user 1 3 # 1 B 56 GLU A 16 GLU~? 11.52 O1 PO4 A 302 B 67 ARG A 20 ARG~? 11.30 O1 PO4 A 302 B 86 HIS C 27 HIS~? 7.34 O1 PO4 A 302 coo 33.14 -5.53 11.32 32.45 -5.14 9.39 27.41 13.54 -34.49 28.46 13.63 -36.35 coo 31.86 -4.62 2.25 31.08 -4.78 5.21 19.43 13.50 -36.40 19.41 10.58 -37.42 coo 25.42 -9.42 7.20 25.63 -7.36 7.52 22.05 20.86 -32.07 23.10 19.40 -33.17 ULMN 3 1pyl_c01 RIBONUCLEASE user 2 3 # 2 B 56 GLU B 16 GLU~? 16.20 CH3 ACY B 401 B 67 ARG B 20 ARG~? 14.42 CH3 ACY B 401 B 86 HIS D 27 HIS~? 8.84 CH3 ACY B 401 coo 33.14 -5.53 11.32 32.45 -5.14 9.39 6.77 16.82 9.46 6.30 17.54 11.41 coo 31.86 -4.62 2.25 31.08 -4.78 5.21 14.16 15.78 11.00 13.60 12.97 12.19 coo 25.42 -9.42 7.20 25.63 -7.36 7.52 12.53 22.86 5.89 11.39 21.93 7.39 1pyl_c01 source 1pyl RIBONUCLEASE : 2 hits 1pyl_c01 naa= 3 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 A 48 LEU A 53 LEU.? 11.14 O ACY A 402 A 58 ASP A 32 ASP.? 10.92 O ACY A 402 A 120 LYS A 3 LYS.? 16.38 O ACY A 402 coo 34.02 69.29 75.26 34.82 67.82 76.74 6.22 11.03 -18.49 7.79 10.65 -19.94 coo 34.46 72.45 78.57 32.82 72.75 77.28 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 28.96 77.64 81.19 29.05 74.53 77.51 -2.74 8.66 -16.42 -3.35 11.52 -21.38 1pym_c00 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 1 hits 1pym_c00 naa= 3 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 155 HIS C 27 HIS~? 7.34 O1 PO4 A 302 A 236 ASP C 14 ASP.? 7.62 O ACY C 404 A 261 LYS D 81 LYS.? 19.75 O ACY C 404 coo 55.45 46.76 42.08 57.34 46.16 42.75 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 48.87 29.19 44.63 49.10 27.34 43.63 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 47.58 17.35 41.83 51.40 20.85 40.83 4.59 37.20 -16.29 4.16 41.27 -17.63 1qgn_c00 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c00 naa= 3 ULMN 3 1qgn_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 155 HIS C 27 HIS~? 7.34 O1 PO4 A 302 B 236 ASP C 14 ASP.? 7.62 O ACY C 404 B 261 LYS D 81 LYS.? 19.75 O ACY C 404 coo 17.23 -29.05 11.63 18.63 -29.78 10.25 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 4.59 37.20 -16.29 4.16 41.27 -17.63 1qgn_c01 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c01 naa= 3 ULMN 3 1qgn_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 C 155 HIS C 27 HIS~? 7.34 O1 PO4 A 302 C 236 ASP C 14 ASP.? 7.62 O ACY C 404 C 261 LYS D 81 LYS.? 19.75 O ACY C 404 coo 55.11 47.10 12.61 53.44 47.85 11.58 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 45.78 31.11 9.51 44.25 30.06 10.53 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 37.54 22.37 12.10 37.83 27.55 13.24 4.59 37.20 -16.29 4.16 41.27 -17.63 1qgn_c02 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c02 naa= 3 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 D 155 HIS C 27 HIS~? 7.34 O1 PO4 A 302 D 236 ASP C 14 ASP.? 7.62 O ACY C 404 D 261 LYS D 81 LYS.? 19.75 O ACY C 404 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 4.59 37.20 -16.29 4.16 41.27 -17.63 1qgn_c03 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c03 naa= 3 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 155 HIS C 27 HIS~? 7.34 O1 PO4 A 302 E 236 ASP C 14 ASP.? 7.62 O ACY C 404 E 261 LYS D 81 LYS.? 19.75 O ACY C 404 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 4.59 37.20 -16.29 4.16 41.27 -17.63 1qgn_c04 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c04 naa= 3 ULMN 3 1qgn_c05 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 155 HIS C 27 HIS~? 7.34 O1 PO4 A 302 F 236 ASP C 14 ASP.? 7.62 O ACY C 404 F 261 LYS D 81 LYS.? 19.75 O ACY C 404 coo 3.13 15.54 -65.72 2.08 14.15 -66.89 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 4.59 37.20 -16.29 4.16 41.27 -17.63 1qgn_c05 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c05 naa= 3 ULMN 3 1qgn_c06 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 G 155 HIS C 27 HIS~? 7.34 O1 PO4 A 302 G 236 ASP C 14 ASP.? 7.62 O ACY C 404 G 261 LYS D 81 LYS.? 19.75 O ACY C 404 coo 76.68 -27.27 -65.07 77.71 -25.72 -66.04 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 4.59 37.20 -16.29 4.16 41.27 -17.63 1qgn_c06 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c06 naa= 3 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 H 155 HIS C 27 HIS~? 7.34 O1 PO4 A 302 H 236 ASP C 14 ASP.? 7.62 O ACY C 404 H 261 LYS D 81 LYS.? 19.75 O ACY C 404 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 4.59 37.20 -16.29 4.16 41.27 -17.63 1qgn_c07 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c07 naa= 3 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 110 ARG B 36 ARG^? 3.17 C ACY B 401s C 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 C 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 39.01 29.77 22.02 37.48 31.30 19.84 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 39.51 34.34 13.63 37.63 32.61 14.79 24.45 24.76 1.05 22.95 23.32 -0.81 coo 45.78 31.11 9.51 44.25 30.06 10.53 29.91 25.87 -1.90 28.44 24.29 -2.10 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 110 ARG D 20 ARG~? 14.11 CH3 ACY B 401 C 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 C 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 39.01 29.77 22.02 37.48 31.30 19.84 23.40 25.12 9.78 26.24 26.16 10.42 coo 39.51 34.34 13.63 37.63 32.61 14.79 24.45 24.76 1.05 22.95 23.32 -0.81 coo 45.78 31.11 9.51 44.25 30.06 10.53 29.91 25.87 -1.90 28.44 24.29 -2.10 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 110 ARG D 36 ARG^? 3.12 O ACY B 401s C 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 C 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 39.01 29.77 22.02 37.48 31.30 19.84 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 39.51 34.34 13.63 37.63 32.61 14.79 24.45 24.76 1.05 22.95 23.32 -0.81 coo 45.78 31.11 9.51 44.25 30.06 10.53 29.91 25.87 -1.90 28.44 24.29 -2.10 1qgn_c16 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 3 hits 1qgn_c16 naa= 3 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 110 ARG B 36 ARG^? 3.17 C ACY B 401s D 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 D 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 24.45 24.76 1.05 22.95 23.32 -0.81 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 29.91 25.87 -1.90 28.44 24.29 -2.10 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 110 ARG D 20 ARG~? 14.11 CH3 ACY B 401 D 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 D 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 23.40 25.12 9.78 26.24 26.16 10.42 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 24.45 24.76 1.05 22.95 23.32 -0.81 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 29.91 25.87 -1.90 28.44 24.29 -2.10 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 110 ARG D 36 ARG^? 3.12 O ACY B 401s D 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 D 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 24.45 24.76 1.05 22.95 23.32 -0.81 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 29.91 25.87 -1.90 28.44 24.29 -2.10 1qgn_c17 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 3 hits 1qgn_c17 naa= 3 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 A 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 C 110 ARG B 36 ARG^? 3.17 C ACY B 401s coo 55.48 26.51 40.65 55.39 23.99 39.43 24.45 24.76 1.05 22.95 23.32 -0.81 coo 48.87 29.19 44.63 49.10 27.34 43.63 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 52.39 23.42 32.10 54.51 23.27 34.29 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 A 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 C 110 ARG D 20 ARG~? 14.11 CH3 ACY B 401 coo 55.48 26.51 40.65 55.39 23.99 39.43 24.45 24.76 1.05 22.95 23.32 -0.81 coo 48.87 29.19 44.63 49.10 27.34 43.63 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 52.39 23.42 32.10 54.51 23.27 34.29 23.40 25.12 9.78 26.24 26.16 10.42 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 A 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 C 110 ARG D 36 ARG^? 3.12 O ACY B 401s coo 55.48 26.51 40.65 55.39 23.99 39.43 24.45 24.76 1.05 22.95 23.32 -0.81 coo 48.87 29.19 44.63 49.10 27.34 43.63 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 52.39 23.42 32.10 54.51 23.27 34.29 15.90 23.27 -3.56 17.50 23.47 -0.92 1qgn_c18 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 3 hits 1qgn_c18 naa= 3 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 B 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 D 110 ARG B 36 ARG^? 3.17 C ACY B 401s coo 32.99 -16.32 11.66 35.01 -14.70 12.72 24.45 24.76 1.05 22.95 23.32 -0.81 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 B 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 D 110 ARG D 20 ARG~? 14.11 CH3 ACY B 401 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 24.45 24.76 1.05 22.95 23.32 -0.81 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 23.40 25.12 9.78 26.24 26.16 10.42 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 B 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 D 110 ARG D 36 ARG^? 3.12 O ACY B 401s coo 32.99 -16.32 11.66 35.01 -14.70 12.72 24.45 24.76 1.05 22.95 23.32 -0.81 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 15.90 23.27 -3.56 17.50 23.47 -0.92 1qgn_c19 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 3 hits 1qgn_c19 naa= 3 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 110 ARG B 36 ARG^? 3.17 C ACY B 401s G 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 G 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 24.45 24.76 1.05 22.95 23.32 -0.81 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 29.91 25.87 -1.90 28.44 24.29 -2.10 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 110 ARG D 20 ARG~? 14.11 CH3 ACY B 401 G 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 G 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 23.40 25.12 9.78 26.24 26.16 10.42 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 24.45 24.76 1.05 22.95 23.32 -0.81 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 29.91 25.87 -1.90 28.44 24.29 -2.10 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 E 110 ARG D 36 ARG^? 3.12 O ACY B 401s G 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 G 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 24.45 24.76 1.05 22.95 23.32 -0.81 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 29.91 25.87 -1.90 28.44 24.29 -2.10 1qgn_c20 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 3 hits 1qgn_c20 naa= 3 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 110 ARG B 36 ARG^? 3.17 C ACY B 401s H 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 H 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 24.45 24.76 1.05 22.95 23.32 -0.81 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 29.91 25.87 -1.90 28.44 24.29 -2.10 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 110 ARG D 20 ARG~? 14.11 CH3 ACY B 401 H 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 H 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 23.40 25.12 9.78 26.24 26.16 10.42 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 24.45 24.76 1.05 22.95 23.32 -0.81 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 29.91 25.87 -1.90 28.44 24.29 -2.10 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 F 110 ARG D 36 ARG^? 3.12 O ACY B 401s H 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 H 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 24.45 24.76 1.05 22.95 23.32 -0.81 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 29.91 25.87 -1.90 28.44 24.29 -2.10 1qgn_c21 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 3 hits 1qgn_c21 naa= 3 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 E 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 G 110 ARG B 36 ARG^? 3.17 C ACY B 401s coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 24.45 24.76 1.05 22.95 23.32 -0.81 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 E 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 G 110 ARG D 20 ARG~? 14.11 CH3 ACY B 401 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 24.45 24.76 1.05 22.95 23.32 -0.81 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 23.40 25.12 9.78 26.24 26.16 10.42 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 E 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 E 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 G 110 ARG D 36 ARG^? 3.12 O ACY B 401s coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 24.45 24.76 1.05 22.95 23.32 -0.81 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 15.90 23.27 -3.56 17.50 23.47 -0.92 1qgn_c22 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 3 hits 1qgn_c22 naa= 3 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 F 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 H 110 ARG B 36 ARG^? 3.17 C ACY B 401s coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 24.45 24.76 1.05 22.95 23.32 -0.81 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 19.55 17.55 -3.52 18.22 17.20 -0.77 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 F 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 H 110 ARG D 20 ARG~? 14.11 CH3 ACY B 401 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 24.45 24.76 1.05 22.95 23.32 -0.81 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 23.40 25.12 9.78 26.24 26.16 10.42 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 F 163 TYR D 19 TYR~? 6.50 OXT ACY B 401 F 236 ASP D 14 ASP.? 10.51 OXT ACY B 401 H 110 ARG D 36 ARG^? 3.12 O ACY B 401s coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 24.45 24.76 1.05 22.95 23.32 -0.81 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 15.90 23.27 -3.56 17.50 23.47 -0.92 1qgn_c23 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 3 hits 1qgn_c23 naa= 3 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 1 3 # 1 A 10 ASP A 32 ASP.? 10.92 O ACY A 402 A 186 ASN A 28 ASN~? 9.25 OXT ACY A 402 A 260 ALA A 62 ALA~? 15.95 O ACY A 402 coo 11.81 33.10 11.71 13.07 31.45 11.40 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 11.43 26.53 7.41 13.01 27.56 8.43 7.12 11.54 -30.87 7.65 11.60 -32.93 coo 21.53 26.33 6.96 20.26 25.69 7.52 5.93 2.57 -26.12 4.84 3.32 -26.89 1r4f_c00 source 1r4f IAG-NUCLEOSIDE HYDROLASE : 1 hits 1r4f_c00 naa= 3 ULMN 3 1roz_c00 DEOXYHYPUSINE SYNTHASE user 1 3 # 1 A 137 GLU B 13 GLU^? 15.77 O ACY B 403 A 288 HIS B 27 HIS~? 8.91 CH3 ACY B 401 A 329 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo 29.27 18.78 14.99 27.16 18.62 14.76 4.71 8.41 0.32 2.63 9.02 0.18 coo 49.52 10.06 10.36 50.99 9.65 8.92 24.22 18.07 5.55 25.63 19.33 6.45 coo 57.80 12.92 13.83 53.77 8.42 12.15 26.90 28.52 7.20 25.78 33.34 9.99 1roz_c00 source 1roz DEOXYHYPUSINE SYNTHASE : 1 hits 1roz_c00 naa= 3 ULMN 3 1roz_c01 DEOXYHYPUSINE SYNTHASE user 1 3 # 1 B 137 GLU B 13 GLU^? 15.77 O ACY B 403 B 288 HIS B 27 HIS~? 8.91 CH3 ACY B 401 B 329 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo 51.99 -1.20 48.77 51.89 -0.93 46.67 4.71 8.41 0.32 2.63 9.02 0.18 coo 31.44 -9.36 43.35 29.98 -10.83 43.65 24.22 18.07 5.55 25.63 19.33 6.45 coo 23.19 -4.89 44.25 27.28 -8.41 40.97 26.90 28.52 7.20 25.78 33.34 9.99 1roz_c01 source 1roz DEOXYHYPUSINE SYNTHASE : 1 hits 1roz_c01 naa= 3 ULMN 3 1smn_c00 EXTRACELLULAR ENDONUCLEASE user 1 3 # 1 A 87 ARG A 20 ARG~? 11.30 O1 PO4 A 302 A 89 HIS C 27 HIS~? 7.34 O1 PO4 A 302 A 119 ASN C 23 ASN~? 3.34 CH3 ACY C 404s coo 28.44 23.52 73.95 30.13 24.84 76.11 19.43 13.50 -36.40 19.41 10.58 -37.42 coo 21.34 20.13 69.47 22.14 19.11 71.12 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 19.69 29.00 71.61 19.80 26.98 72.20 15.33 22.92 -30.05 14.25 22.35 -28.34 ULMN 3 1smn_c00 EXTRACELLULAR ENDONUCLEASE user 2 3 # 2 A 87 ARG A 36 ARG^? 3.17 O2 GOL A 501s A 89 HIS A 27 HIS~? -3.83 OXT ACY A 402s A 119 ASN C 23 ASN~? 3.34 CH3 ACY C 404s coo 28.44 23.52 73.95 30.13 24.84 76.11 14.40 16.71 -22.33 15.78 16.00 -25.01 coo 21.34 20.13 69.47 22.14 19.11 71.12 9.52 16.92 -31.25 8.29 18.47 -31.94 coo 19.69 29.00 71.61 19.80 26.98 72.20 15.33 22.92 -30.05 14.25 22.35 -28.34 ULMN 3 1smn_c00 EXTRACELLULAR ENDONUCLEASE user 3 3 # 3 A 87 ARG B 20 ARG~? 14.42 CH3 ACY B 401 A 89 HIS D 27 HIS~? 8.84 CH3 ACY B 401 A 119 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo 28.44 23.52 73.95 30.13 24.84 76.11 14.16 15.78 11.00 13.60 12.97 12.19 coo 21.34 20.13 69.47 22.14 19.11 71.12 12.53 22.86 5.89 11.39 21.93 7.39 coo 19.69 29.00 71.61 19.80 26.98 72.20 19.37 24.14 3.44 20.48 23.43 1.80 ULMN 3 1smn_c00 EXTRACELLULAR ENDONUCLEASE user 4 3 # 4 A 87 ARG B 36 ARG^? 3.17 C ACY B 401s A 89 HIS B 27 HIS~? 8.91 CH3 ACY B 401 A 119 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo 28.44 23.52 73.95 30.13 24.84 76.11 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 21.34 20.13 69.47 22.14 19.11 71.12 24.22 18.07 5.55 25.63 19.33 6.45 coo 19.69 29.00 71.61 19.80 26.98 72.20 19.37 24.14 3.44 20.48 23.43 1.80 ULMN 3 1smn_c00 EXTRACELLULAR ENDONUCLEASE user 5 3 # 5 A 87 ARG C 36 ARG^? -3.18 C2 GOL A 501s A 89 HIS C 27 HIS~? 7.34 O1 PO4 A 302 A 119 ASN A 23 ASN~? 3.23 O3 PO4 A 302s coo 28.44 23.52 73.95 30.13 24.84 76.11 18.67 22.17 -22.86 17.03 22.41 -25.46 coo 21.34 20.13 69.47 22.14 19.11 71.12 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 19.69 29.00 71.61 19.80 26.98 72.20 16.56 14.98 -29.71 17.96 15.58 -28.25 ULMN 3 1smn_c00 EXTRACELLULAR ENDONUCLEASE user 6 3 # 6 A 87 ARG D 20 ARG~? 14.11 CH3 ACY B 401 A 89 HIS B 27 HIS~? 8.91 CH3 ACY B 401 A 119 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo 28.44 23.52 73.95 30.13 24.84 76.11 23.40 25.12 9.78 26.24 26.16 10.42 coo 21.34 20.13 69.47 22.14 19.11 71.12 24.22 18.07 5.55 25.63 19.33 6.45 coo 19.69 29.00 71.61 19.80 26.98 72.20 16.95 16.62 4.13 15.59 17.22 2.56 ULMN 3 1smn_c00 EXTRACELLULAR ENDONUCLEASE user 7 3 # 7 A 87 ARG D 36 ARG^? 3.12 O ACY B 401s A 89 HIS D 27 HIS~? 8.84 CH3 ACY B 401 A 119 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo 28.44 23.52 73.95 30.13 24.84 76.11 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 21.34 20.13 69.47 22.14 19.11 71.12 12.53 22.86 5.89 11.39 21.93 7.39 coo 19.69 29.00 71.61 19.80 26.98 72.20 16.95 16.62 4.13 15.59 17.22 2.56 1smn_c00 source 1smn EXTRACELLULAR ENDONUCLEASE : 7 hits 1smn_c00 naa= 3 ULMN 3 1smn_c01 EXTRACELLULAR ENDONUCLEASE user 1 3 # 1 B 87 ARG A 36 ARG^? 3.17 O2 GOL A 501s B 89 HIS A 27 HIS~? -3.83 OXT ACY A 402s B 119 ASN C 23 ASN~? 3.34 CH3 ACY C 404s coo -30.08 23.20 29.48 -31.80 24.60 27.35 14.40 16.71 -22.33 15.78 16.00 -25.01 coo -22.85 19.92 33.92 -23.63 18.94 32.24 9.52 16.92 -31.25 8.29 18.47 -31.94 coo -21.28 28.91 31.84 -21.35 26.90 31.17 15.33 22.92 -30.05 14.25 22.35 -28.34 ULMN 3 1smn_c01 EXTRACELLULAR ENDONUCLEASE user 2 3 # 2 B 87 ARG B 36 ARG^? 3.17 C ACY B 401s B 89 HIS B 27 HIS~? 8.91 CH3 ACY B 401 B 119 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo -30.08 23.20 29.48 -31.80 24.60 27.35 19.55 17.55 -3.52 18.22 17.20 -0.77 coo -22.85 19.92 33.92 -23.63 18.94 32.24 24.22 18.07 5.55 25.63 19.33 6.45 coo -21.28 28.91 31.84 -21.35 26.90 31.17 19.37 24.14 3.44 20.48 23.43 1.80 ULMN 3 1smn_c01 EXTRACELLULAR ENDONUCLEASE user 3 3 # 3 B 87 ARG C 20 ARG~? 11.83 CH3 ACY C 404 B 89 HIS A 27 HIS~? -3.83 OXT ACY A 402s B 119 ASN A 23 ASN~? 3.23 O3 PO4 A 302s coo -30.08 23.20 29.48 -31.80 24.60 27.35 11.69 24.38 -36.69 11.38 27.15 -38.05 coo -22.85 19.92 33.92 -23.63 18.94 32.24 9.52 16.92 -31.25 8.29 18.47 -31.94 coo -21.28 28.91 31.84 -21.35 26.90 31.17 16.56 14.98 -29.71 17.96 15.58 -28.25 ULMN 3 1smn_c01 EXTRACELLULAR ENDONUCLEASE user 4 3 # 4 B 87 ARG C 36 ARG^? -3.18 C2 GOL A 501s B 89 HIS C 27 HIS~? 7.34 O1 PO4 A 302 B 119 ASN A 23 ASN~? 3.23 O3 PO4 A 302s coo -30.08 23.20 29.48 -31.80 24.60 27.35 18.67 22.17 -22.86 17.03 22.41 -25.46 coo -22.85 19.92 33.92 -23.63 18.94 32.24 22.05 20.86 -32.07 23.10 19.40 -33.17 coo -21.28 28.91 31.84 -21.35 26.90 31.17 16.56 14.98 -29.71 17.96 15.58 -28.25 ULMN 3 1smn_c01 EXTRACELLULAR ENDONUCLEASE user 5 3 # 5 B 87 ARG D 20 ARG~? 14.11 CH3 ACY B 401 B 89 HIS B 27 HIS~? 8.91 CH3 ACY B 401 B 119 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo -30.08 23.20 29.48 -31.80 24.60 27.35 23.40 25.12 9.78 26.24 26.16 10.42 coo -22.85 19.92 33.92 -23.63 18.94 32.24 24.22 18.07 5.55 25.63 19.33 6.45 coo -21.28 28.91 31.84 -21.35 26.90 31.17 16.95 16.62 4.13 15.59 17.22 2.56 ULMN 3 1smn_c01 EXTRACELLULAR ENDONUCLEASE user 6 3 # 6 B 87 ARG D 36 ARG^? 3.12 O ACY B 401s B 89 HIS D 27 HIS~? 8.84 CH3 ACY B 401 B 119 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo -30.08 23.20 29.48 -31.80 24.60 27.35 15.90 23.27 -3.56 17.50 23.47 -0.92 coo -22.85 19.92 33.92 -23.63 18.94 32.24 12.53 22.86 5.89 11.39 21.93 7.39 coo -21.28 28.91 31.84 -21.35 26.90 31.17 16.95 16.62 4.13 15.59 17.22 2.56 1smn_c01 source 1smn EXTRACELLULAR ENDONUCLEASE : 6 hits 1smn_c01 naa= 3 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 1 3 # 1 E 166 ASP A 32 ASP.? 10.92 O ACY A 402 E 168 LYS A 54 LYS.? 19.07 O ACY A 402 E 201 THR A 59 THR~? 14.19 O ACY A 402 coo 5.36 16.20 22.10 3.88 17.00 23.31 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 5.06 22.32 18.11 1.02 22.08 22.74 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo -1.79 18.29 19.05 -1.19 20.28 19.71 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 2 3 # 2 E 166 ASP B 32 ASP.? 15.94 OXT ACY B 401 E 168 LYS B 3 LYS.? 19.35 OXT ACY B 401 E 201 THR B 59 THR~? 17.71 OXT ACY B 401 coo 5.36 16.20 22.10 3.88 17.00 23.31 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 5.06 22.32 18.11 1.02 22.08 22.74 35.65 7.25 -8.40 36.12 12.24 -4.67 coo -1.79 18.29 19.05 -1.19 20.28 19.71 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 3 3 # 3 E 166 ASP C 32 ASP.? 15.02 O1 PO4 A 302 E 168 LYS C 3 LYS.? 18.92 O1 PO4 A 302 E 201 THR C 59 THR~? 18.08 O3 GOL A 501 coo 5.36 16.20 22.10 3.88 17.00 23.31 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 5.06 22.32 18.11 1.02 22.08 22.74 35.92 31.10 -19.94 35.74 27.15 -23.97 coo -1.79 18.29 19.05 -1.19 20.28 19.71 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 4 3 # 4 E 166 ASP C 32 ASP.? 15.02 O1 PO4 A 302 E 168 LYS C 54 LYS.? 21.14 O4 PO4 A 302 E 201 THR C 59 THR~? 18.08 O3 GOL A 501 coo 5.36 16.20 22.10 3.88 17.00 23.31 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 5.06 22.32 18.11 1.02 22.08 22.74 31.19 27.76 -19.03 36.53 26.17 -16.12 coo -1.79 18.29 19.05 -1.19 20.28 19.71 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 5 3 # 5 E 166 ASP D 32 ASP.? 14.33 CH3 ACY B 403 E 168 LYS D 3 LYS.? 18.33 CH3 ACY B 403 E 201 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 5.36 16.20 22.10 3.88 17.00 23.31 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 5.06 22.32 18.11 1.02 22.08 22.74 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo -1.79 18.29 19.05 -1.19 20.28 19.71 5.37 35.06 -0.11 4.54 33.06 0.04 1stc_c02 source 1stc CAMP-DEPENDENT PROTEIN KINASE : 5 hits 1stc_c02 naa= 3 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 1 3 # 1 B 8 HIS A 27 HIS~? -3.83 OXT ACY A 402s B 80 GLU A 24 GLU~? 10.37 O3 PO4 A 302 B 223 ARG B 74 ARG^? 16.09 O ACY B 403 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 9.52 16.92 -31.25 8.29 18.47 -31.94 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 14.49 13.16 -34.47 15.70 12.18 -35.93 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 2 3 # 2 B 8 HIS A 27 HIS~? -3.83 OXT ACY A 402s B 80 GLU A 24 GLU~? 10.37 O3 PO4 A 302 B 223 ARG C 4 ARG^? 26.01 O3 GOL A 501 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 9.52 16.92 -31.25 8.29 18.47 -31.94 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 14.49 13.16 -34.47 15.70 12.18 -35.93 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 32.96 35.53 -16.77 35.10 36.37 -18.83 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 3 3 # 3 B 8 HIS B 27 HIS~? 8.91 CH3 ACY B 401 B 80 GLU B 24 GLU~? 12.08 CH3 ACY B 401 B 223 ARG A 74 ARG^? 14.15 O4 PO4 A 302 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 24.22 18.07 5.55 25.63 19.33 6.45 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 18.70 14.65 8.90 18.04 13.62 10.65 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 23.62 1.58 -20.34 24.34 2.38 -17.47 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 4 3 # 4 B 8 HIS C 27 HIS~? 7.34 O1 PO4 A 302 B 80 GLU C 24 GLU~? 11.35 C3 GOL A 501 B 223 ARG D 74 ARG^? 19.24 OXT ACY B 401 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 22.05 20.86 -32.07 23.10 19.40 -33.17 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 18.84 25.84 -35.18 19.75 24.32 -36.38 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 25.93 38.34 -6.34 26.99 36.29 -8.39 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 5 3 # 5 B 8 HIS D 27 HIS~? 8.84 CH3 ACY B 401 B 80 GLU D 24 GLU~? 11.43 CH3 ACY B 401 B 223 ARG B 4 ARG^? 24.35 O4 PO4 A 302 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 12.53 22.86 5.89 11.39 21.93 7.39 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 18.15 25.86 8.28 19.10 26.69 9.97 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 33.21 2.63 -10.81 34.08 0.01 -9.45 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 6 3 # 6 B 8 HIS D 27 HIS~? 8.84 CH3 ACY B 401 B 80 GLU D 24 GLU~? 11.43 CH3 ACY B 401 B 223 ARG C 74 ARG^? 14.08 O ACY C 404 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 12.53 22.86 5.89 11.39 21.93 7.39 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 18.15 25.86 8.28 19.10 26.69 9.97 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 9.75 38.11 -21.77 8.89 36.86 -19.09 1t0u_c01 source 1t0u URIDINE PHOSPHORYLASE : 6 hits 1t0u_c01 naa= 3 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 # 1 A 250 ALA A 62 ALA~? 15.95 O ACY A 402 A 251 GLY A 61 GLY~? 18.12 O ACY A 402 A 252 ASP A 58 ASP~? 21.11 O ACY A 402 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 5.93 2.57 -26.12 4.84 3.32 -26.89 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 5.64 1.29 -22.54 5.70 2.04 -22.93 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 # 2 A 250 ALA B 62 ALA~? 18.65 OXT ACY B 401 A 251 GLY B 61 GLY~? 20.12 O ACY B 403 A 252 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 26.57 3.48 1.93 27.61 4.38 2.55 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 26.92 1.53 -1.34 26.95 2.31 -1.04 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 3 3 # 3 A 250 ALA C 62 ALA~? 18.30 CH3 ACY C 404 A 251 GLY C 61 GLY~? 19.35 CH3 ACY C 404 A 252 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 26.07 35.69 -29.35 27.06 34.87 -30.18 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 26.84 37.39 -26.02 26.76 36.64 -26.31 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 32.89 35.88 -28.31 34.37 37.32 -28.69 1tz3_c02 source 1tz3 PUTATIVE SUGAR KINASE : 3 hits 1tz3_c02 naa= 3 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 # 1 B 250 ALA A 62 ALA~? 15.95 O ACY A 402 B 251 GLY A 61 GLY~? 18.12 O ACY A 402 B 252 ASP A 58 ASP~? 21.11 O ACY A 402 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 5.93 2.57 -26.12 4.84 3.32 -26.89 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 5.64 1.29 -22.54 5.70 2.04 -22.93 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 # 2 B 250 ALA B 62 ALA~? 18.65 OXT ACY B 401 B 251 GLY B 61 GLY~? 20.12 O ACY B 403 B 252 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 26.57 3.48 1.93 27.61 4.38 2.55 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 26.92 1.53 -1.34 26.95 2.31 -1.04 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 3 3 # 3 B 250 ALA C 62 ALA~? 18.30 CH3 ACY C 404 B 251 GLY C 61 GLY~? 19.35 CH3 ACY C 404 B 252 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 26.07 35.69 -29.35 27.06 34.87 -30.18 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 26.84 37.39 -26.02 26.76 36.64 -26.31 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 32.89 35.88 -28.31 34.37 37.32 -28.69 1tz3_c03 source 1tz3 PUTATIVE SUGAR KINASE : 3 hits 1tz3_c03 naa= 3 ULMN 3 1ula_c00 PURINE NUCLEOSIDE PHOSPHORYLASE (E.Cuser 1 3 # 1 86 HIS C 27 HIS~? 7.34 O1 PO4 A 302 89 GLU C 24 GLU~? 11.35 C3 GOL A 501 243 ASN A 28 ASN~? 9.25 OXT ACY A 402 coo 5.83 15.74 17.38 6.41 17.70 17.86 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 3.11 16.19 13.44 4.96 17.09 13.42 18.84 25.84 -35.18 19.75 24.32 -36.38 coo 0.53 21.81 31.33 1.05 20.47 29.70 7.12 11.54 -30.87 7.65 11.60 -32.93 1ula_c00 source 1ula PURINE NUCLEOSIDE PHOSPHORYLASE (E.C.2.4.2.1) : 1 hits 1ula_c00 naa= 3 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP B 56 ASP~? 21.60 OXT ACY B 401 218 GLU A 16 GLU~? 11.52 O1 PO4 A 302 329 ASP B 32 ASP.? 15.94 OXT ACY B 401 coo 49.16 35.16 15.19 51.08 34.43 15.65 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 70.09 11.71 8.46 70.56 12.89 6.77 27.41 13.54 -34.49 28.46 13.63 -36.35 coo 59.16 37.82 13.95 57.63 37.03 15.12 30.64 12.55 -3.88 32.46 12.19 -2.91 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP B 56 ASP~? 21.60 OXT ACY B 401 218 GLU B 16 GLU~? 16.20 CH3 ACY B 401 329 ASP B 32 ASP.? 15.94 OXT ACY B 401 coo 49.16 35.16 15.19 51.08 34.43 15.65 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 70.09 11.71 8.46 70.56 12.89 6.77 6.77 16.82 9.46 6.30 17.54 11.41 coo 59.16 37.82 13.95 57.63 37.03 15.12 30.64 12.55 -3.88 32.46 12.19 -2.91 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 # 3 199 ASP B 58 ASP~? 24.69 OXT ACY B 401 218 GLU B 16 GLU~? 16.20 CH3 ACY B 401 329 ASP B 32 ASP.? 15.94 OXT ACY B 401 coo 49.16 35.16 15.19 51.08 34.43 15.65 33.22 2.96 0.74 34.69 1.59 1.17 coo 70.09 11.71 8.46 70.56 12.89 6.77 6.77 16.82 9.46 6.30 17.54 11.41 coo 59.16 37.82 13.95 57.63 37.03 15.12 30.64 12.55 -3.88 32.46 12.19 -2.91 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 4 3 # 4 199 ASP D 58 ASP~? 23.91 CH3 ACY B 403 218 GLU D 16 GLU~? 15.82 CH3 ACY B 401 329 ASP D 32 ASP.? 14.33 CH3 ACY B 403 coo 49.16 35.16 15.19 51.08 34.43 15.65 2.43 37.89 1.30 0.84 39.23 1.50 coo 70.09 11.71 8.46 70.56 12.89 6.77 29.82 25.98 8.07 29.78 25.08 10.01 coo 59.16 37.82 13.95 57.63 37.03 15.12 4.73 28.33 -3.00 2.76 28.70 -2.23 1uok_c04 source 1uok OLIGO-1,6-GLUCOSIDASE : 4 hits 1uok_c04 naa= 3 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 32 ASP.? 10.92 O ACY A 402 242 GLU C 13 GLU^? 12.93 O ACY C 404 329 ASP A 56 ASP~? 17.92 O ACY A 402 coo 49.16 35.16 15.19 51.08 34.43 15.65 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 30.42 34.74 5.00 29.09 35.09 3.38 5.05 33.44 -24.76 4.47 35.34 -25.49 coo 59.16 37.82 13.95 57.63 37.03 15.12 -2.03 5.92 -20.65 -1.35 5.51 -22.61 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 32 ASP.? 10.92 O ACY A 402 242 GLU C 13 GLU^? 12.93 O ACY C 404 329 ASP A 58 ASP~? 21.11 O ACY A 402 coo 49.16 35.16 15.19 51.08 34.43 15.65 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 30.42 34.74 5.00 29.09 35.09 3.38 5.05 33.44 -24.76 4.47 35.34 -25.49 coo 59.16 37.82 13.95 57.63 37.03 15.12 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 3 3 # 3 199 ASP B 32 ASP.? 15.94 OXT ACY B 401 242 GLU D 13 GLU^? 19.04 OXT ACY B 401 329 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 49.16 35.16 15.19 51.08 34.43 15.65 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 30.42 34.74 5.00 29.09 35.09 3.38 29.88 33.09 -1.63 31.17 34.65 -1.02 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 4 3 # 4 199 ASP B 32 ASP.? 15.94 OXT ACY B 401 242 GLU D 24 GLU~? 11.43 CH3 ACY B 401 329 ASP B 56 ASP~? 21.60 OXT ACY B 401 coo 49.16 35.16 15.19 51.08 34.43 15.65 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 30.42 34.74 5.00 29.09 35.09 3.38 18.15 25.86 8.28 19.10 26.69 9.97 coo 59.16 37.82 13.95 57.63 37.03 15.12 35.20 5.48 -3.85 34.81 5.79 -1.78 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 5 3 # 5 199 ASP B 32 ASP.? 15.94 OXT ACY B 401 242 GLU D 24 GLU~? 11.43 CH3 ACY B 401 329 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 49.16 35.16 15.19 51.08 34.43 15.65 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 30.42 34.74 5.00 29.09 35.09 3.38 18.15 25.86 8.28 19.10 26.69 9.97 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 6 3 # 6 199 ASP C 32 ASP.? 15.02 O1 PO4 A 302 242 GLU A 13 GLU^? 12.48 O4 PO4 A 302 329 ASP C 56 ASP~? 22.04 O3 GOL A 501 coo 49.16 35.16 15.19 51.08 34.43 15.65 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 30.42 34.74 5.00 29.09 35.09 3.38 27.35 5.02 -24.86 28.03 3.18 -25.64 coo 59.16 37.82 13.95 57.63 37.03 15.12 34.87 33.34 -23.80 34.50 32.98 -25.83 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 7 3 # 7 199 ASP C 32 ASP.? 15.02 O1 PO4 A 302 242 GLU A 13 GLU^? 12.48 O4 PO4 A 302 329 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo 49.16 35.16 15.19 51.08 34.43 15.65 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 30.42 34.74 5.00 29.09 35.09 3.38 27.35 5.02 -24.86 28.03 3.18 -25.64 coo 59.16 37.82 13.95 57.63 37.03 15.12 32.89 35.88 -28.31 34.37 37.32 -28.69 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 8 3 # 8 199 ASP C 32 ASP.? 15.02 O1 PO4 A 302 242 GLU A 24 GLU~? 10.37 O3 PO4 A 302 329 ASP C 56 ASP~? 22.04 O3 GOL A 501 coo 49.16 35.16 15.19 51.08 34.43 15.65 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 30.42 34.74 5.00 29.09 35.09 3.38 14.49 13.16 -34.47 15.70 12.18 -35.93 coo 59.16 37.82 13.95 57.63 37.03 15.12 34.87 33.34 -23.80 34.50 32.98 -25.83 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 9 3 # 9 199 ASP C 32 ASP.? 15.02 O1 PO4 A 302 242 GLU A 24 GLU~? 10.37 O3 PO4 A 302 329 ASP C 58 ASP~? 25.07 O3 GOL A 501 coo 49.16 35.16 15.19 51.08 34.43 15.65 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 30.42 34.74 5.00 29.09 35.09 3.38 14.49 13.16 -34.47 15.70 12.18 -35.93 coo 59.16 37.82 13.95 57.63 37.03 15.12 32.89 35.88 -28.31 34.37 37.32 -28.69 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 10 3 # 10 199 ASP D 32 ASP.? 14.33 CH3 ACY B 403 242 GLU B 13 GLU^? 15.77 O ACY B 403 329 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 49.16 35.16 15.19 51.08 34.43 15.65 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 30.42 34.74 5.00 29.09 35.09 3.38 4.71 8.41 0.32 2.63 9.02 0.18 coo 59.16 37.82 13.95 57.63 37.03 15.12 2.43 37.89 1.30 0.84 39.23 1.50 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 11 3 # 11 199 ASP D 32 ASP.? 14.33 CH3 ACY B 403 242 GLU B 24 GLU~? 12.08 CH3 ACY B 401 329 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 49.16 35.16 15.19 51.08 34.43 15.65 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 30.42 34.74 5.00 29.09 35.09 3.38 18.70 14.65 8.90 18.04 13.62 10.65 coo 59.16 37.82 13.95 57.63 37.03 15.12 2.43 37.89 1.30 0.84 39.23 1.50 1uok_c05 source 1uok OLIGO-1,6-GLUCOSIDASE : 11 hits 1uok_c05 naa= 3 ULMN 3 1vzx_c02 2.04.01.0087 user 1 3 # 1 A 314 TYR A 19 TYR~? -3.51 O4 PO4 A 302s A 317 GLU A 16 GLU~? 11.52 O1 PO4 A 302 A 365 ARG A 42 ARG~? 9.50 O4 PO4 A 302 coo 1.77 6.56 57.05 3.05 7.44 59.37 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 3.06 2.85 52.79 4.83 3.89 53.24 27.41 13.54 -34.49 28.46 13.63 -36.35 coo 3.82 17.09 49.56 4.09 14.32 50.84 31.60 18.55 -22.55 28.82 19.89 -22.65 1vzx_c02 source 1vzx 2.04.01.0087 : 1 hits 1vzx_c02 naa= 3 ULMN 3 1vzx_c03 2.04.01.0087 user 1 3 # 1 B1314 TYR A 19 TYR~? -3.51 O4 PO4 A 302s B1317 GLU A 16 GLU~? 11.52 O1 PO4 A 302 B1365 ARG A 42 ARG~? 9.50 O4 PO4 A 302 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 27.41 13.54 -34.49 28.46 13.63 -36.35 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 31.60 18.55 -22.55 28.82 19.89 -22.65 1vzx_c03 source 1vzx 2.04.01.0087 : 1 hits 1vzx_c03 naa= 3 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR B 6 TYR^? 19.40 O ACY B 403 A 40 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 103 LEU B 63 LEU~? 13.38 OXT ACY B 401 coo 12.09 16.13 10.57 11.28 18.80 10.73 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 7.55 25.51 14.34 9.65 25.73 14.24 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 11.83 18.73 16.99 10.99 19.71 15.26 24.65 7.08 -0.67 23.48 8.88 -1.06 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR B 6 TYR^? 19.40 O ACY B 403 A 40 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 103 LEU B 53 LEU.? 13.04 OXT ACY B 401 coo 12.09 16.13 10.57 11.28 18.80 10.73 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 7.55 25.51 14.34 9.65 25.73 14.24 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 11.83 18.73 16.99 10.99 19.71 15.26 27.16 10.68 -6.72 25.64 10.50 -5.24 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 3 3 # 3 A 16 TYR B 6 TYR^? 19.40 O ACY B 403 A 40 ASP B 58 ASP~? 24.69 OXT ACY B 401 A 103 LEU B 63 LEU~? 13.38 OXT ACY B 401 coo 12.09 16.13 10.57 11.28 18.80 10.73 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 7.55 25.51 14.34 9.65 25.73 14.24 33.22 2.96 0.74 34.69 1.59 1.17 coo 11.83 18.73 16.99 10.99 19.71 15.26 24.65 7.08 -0.67 23.48 8.88 -1.06 1vzz_c00 source 1vzz STEROID DELTA-ISOMERASE : 3 hits 1vzz_c00 naa= 3 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 6 TYR^? 17.89 O ACY A 402 B 40 ASP A 32 ASP.? 10.92 O ACY A 402 B 103 LEU A 8 LEU^? 12.59 O3 PO4 A 302 coo 14.25 20.09 37.35 13.48 17.40 37.38 5.36 6.34 -15.79 3.13 4.70 -15.92 coo 9.39 10.77 34.53 11.50 10.63 34.41 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 12.89 17.60 31.13 12.34 16.51 32.90 12.36 8.18 -18.40 10.67 7.43 -19.49 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR B 6 TYR^? 19.40 O ACY B 403 B 40 ASP B 32 ASP.? 15.94 OXT ACY B 401 B 103 LEU B 63 LEU~? 13.38 OXT ACY B 401 coo 14.25 20.09 37.35 13.48 17.40 37.38 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 9.39 10.77 34.53 11.50 10.63 34.41 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 12.89 17.60 31.13 12.34 16.51 32.90 24.65 7.08 -0.67 23.48 8.88 -1.06 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 3 3 # 3 B 16 TYR B 6 TYR^? 19.40 O ACY B 403 B 40 ASP B 56 ASP~? 21.60 OXT ACY B 401 B 103 LEU B 53 LEU.? 13.04 OXT ACY B 401 coo 14.25 20.09 37.35 13.48 17.40 37.38 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 9.39 10.77 34.53 11.50 10.63 34.41 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 12.89 17.60 31.13 12.34 16.51 32.90 27.16 10.68 -6.72 25.64 10.50 -5.24 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 4 3 # 4 B 16 TYR B 6 TYR^? 19.40 O ACY B 403 B 40 ASP B 58 ASP~? 24.69 OXT ACY B 401 B 103 LEU B 63 LEU~? 13.38 OXT ACY B 401 coo 14.25 20.09 37.35 13.48 17.40 37.38 27.43 5.57 -8.88 29.53 3.76 -8.64 coo 9.39 10.77 34.53 11.50 10.63 34.41 33.22 2.96 0.74 34.69 1.59 1.17 coo 12.89 17.60 31.13 12.34 16.51 32.90 24.65 7.08 -0.67 23.48 8.88 -1.06 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 5 3 # 5 B 16 TYR D 6 TYR^? 18.56 CH3 ACY B 403 B 40 ASP D 56 ASP~? 19.96 CH3 ACY B 403 B 103 LEU D 53 LEU.? 11.83 CH3 ACY B 403 coo 14.25 20.09 37.35 13.48 17.40 37.38 7.30 34.85 -8.71 5.25 36.67 -8.19 coo 9.39 10.77 34.53 11.50 10.63 34.41 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 12.89 17.60 31.13 12.34 16.51 32.90 7.88 29.95 -6.35 9.51 30.11 -4.95 1vzz_c01 source 1vzz STEROID DELTA-ISOMERASE : 5 hits 1vzz_c01 naa= 3 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 1 3 # 1 A 105 HIS A 27 HIS~? -3.83 OXT ACY A 402s A 169 ASP C 14 ASP.? 7.62 O ACY C 404 A 288 GLU C 13 GLU^? 12.93 O ACY C 404 coo 67.72 35.99 30.87 69.77 36.13 31.33 9.52 16.92 -31.25 8.29 18.47 -31.94 coo 73.17 30.66 22.56 72.87 30.30 20.46 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 74.06 28.51 15.92 73.77 29.56 17.73 5.05 33.44 -24.76 4.47 35.34 -25.49 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 2 3 # 2 A 105 HIS B 27 HIS~? 8.91 CH3 ACY B 401 A 169 ASP D 14 ASP.? 10.51 OXT ACY B 401 A 288 GLU D 13 GLU^? 19.04 OXT ACY B 401 coo 67.72 35.99 30.87 69.77 36.13 31.33 24.22 18.07 5.55 25.63 19.33 6.45 coo 73.17 30.66 22.56 72.87 30.30 20.46 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 74.06 28.51 15.92 73.77 29.56 17.73 29.88 33.09 -1.63 31.17 34.65 -1.02 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 3 3 # 3 A 105 HIS C 27 HIS~? 7.34 O1 PO4 A 302 A 169 ASP A 14 ASP.? 7.78 O4 PO4 A 302 A 288 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo 67.72 35.99 30.87 69.77 36.13 31.33 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 73.17 30.66 22.56 72.87 30.30 20.46 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 74.06 28.51 15.92 73.77 29.56 17.73 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 4 3 # 4 A 105 HIS D 27 HIS~? 8.84 CH3 ACY B 401 A 169 ASP B 14 ASP.? 10.32 CH3 ACY B 403 A 288 GLU B 13 GLU^? 15.77 O ACY B 403 coo 67.72 35.99 30.87 69.77 36.13 31.33 12.53 22.86 5.89 11.39 21.93 7.39 coo 73.17 30.66 22.56 72.87 30.30 20.46 4.45 14.77 1.64 4.87 15.68 -0.19 coo 74.06 28.51 15.92 73.77 29.56 17.73 4.71 8.41 0.32 2.63 9.02 0.18 1w1o_c00 source 1w1o CYTOKININ DEHYDROGENASE 1 : 4 hits 1w1o_c00 naa= 3 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 # 1 A 183 GLY B 65 GLY~? 18.50 O ACY B 403 B 419 GLY B 61 GLY~? 20.12 O ACY B 403 B 420 ALA B 62 ALA~? 18.65 OXT ACY B 401 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 21.92 1.18 1.36 21.71 1.99 1.35 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 26.92 1.53 -1.34 26.95 2.31 -1.04 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 26.57 3.48 1.93 27.61 4.38 2.55 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 # 2 A 183 GLY C 65 GLY~? 16.36 CH3 ACY C 404 B 419 GLY C 61 GLY~? 19.35 CH3 ACY C 404 B 420 ALA C 62 ALA~? 18.30 CH3 ACY C 404 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 21.51 37.99 -28.31 21.31 37.17 -28.29 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 26.84 37.39 -26.02 26.76 36.64 -26.31 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 26.07 35.69 -29.35 27.06 34.87 -30.18 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 # 3 A 183 GLY D 65 GLY~? 19.54 O ACY B 401 B 419 GLY D 61 GLY~? 20.13 CH3 ACY B 403 B 420 ALA D 62 ALA~? 18.57 O ACY B 401 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 14.07 39.69 1.45 14.26 38.86 1.36 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 8.73 39.10 -1.19 8.75 38.34 -0.89 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 9.30 37.38 2.15 8.26 36.54 2.93 1xny_c00 source 1xny PROPIONYL-COA CARBOXYLASE COMPLEX B SUBUNIT : 3 hits 1xny_c00 naa= 3 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 B 124 ALA A 18 ALA~? 7.36 O3 PO4 A 302 B 126 ARG A 20 ARG~? 11.30 O1 PO4 A 302 B 138 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo 2.11 4.00 19.31 3.14 4.86 19.99 22.09 8.41 -30.71 23.04 7.81 -29.69 coo 2.45 5.53 11.28 3.59 7.56 13.29 19.43 13.50 -36.40 19.41 10.58 -37.42 coo 6.10 2.00 25.24 6.12 1.84 23.13 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 B 124 ALA A 47 ALA.? 3.81 O4 PO4 A 302 B 126 ARG A 42 ARG~? 9.50 O4 PO4 A 302 B 138 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo 2.11 4.00 19.31 3.14 4.86 19.99 25.04 12.46 -21.37 24.42 13.29 -22.47 coo 2.45 5.53 11.28 3.59 7.56 13.29 31.60 18.55 -22.55 28.82 19.89 -22.65 coo 6.10 2.00 25.24 6.12 1.84 23.13 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 B 124 ALA B 18 ALA~? 12.25 O ACY B 403 B 126 ARG B 20 ARG~? 14.42 CH3 ACY B 401 B 138 GLU B 13 GLU^? 15.77 O ACY B 403 coo 2.11 4.00 19.31 3.14 4.86 19.99 11.02 10.71 5.62 9.97 10.17 4.66 coo 2.45 5.53 11.28 3.59 7.56 13.29 14.16 15.78 11.00 13.60 12.97 12.19 coo 6.10 2.00 25.24 6.12 1.84 23.13 4.71 8.41 0.32 2.63 9.02 0.18 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 B 124 ALA C 18 ALA~? 7.41 CH3 ACY C 404 B 126 ARG C 20 ARG~? 11.83 CH3 ACY C 404 B 138 GLU C 13 GLU^? 12.93 O ACY C 404 coo 2.11 4.00 19.31 3.14 4.86 19.99 9.72 29.34 -31.05 8.94 30.10 -29.98 coo 2.45 5.53 11.28 3.59 7.56 13.29 11.69 24.38 -36.69 11.38 27.15 -38.05 coo 6.10 2.00 25.24 6.12 1.84 23.13 5.05 33.44 -24.76 4.47 35.34 -25.49 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 B 124 ALA C 47 ALA.? 3.99 O ACY C 404 B 126 ARG C 42 ARG~? 8.34 CH3 ACY A 402 B 138 GLU C 13 GLU^? 12.93 O ACY C 404 coo 2.11 4.00 19.31 3.14 4.86 19.99 8.20 26.83 -20.86 8.77 25.92 -21.92 coo 2.45 5.53 11.28 3.59 7.56 13.29 1.71 20.80 -20.88 4.34 19.24 -20.78 coo 6.10 2.00 25.24 6.12 1.84 23.13 5.05 33.44 -24.76 4.47 35.34 -25.49 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 B 124 ALA D 18 ALA~? 13.59 CH3 ACY B 401 B 126 ARG D 20 ARG~? 14.11 CH3 ACY B 401 B 138 GLU D 13 GLU^? 19.04 OXT ACY B 401 coo 2.11 4.00 19.31 3.14 4.86 19.99 25.69 30.05 3.92 26.57 30.60 2.82 coo 2.45 5.53 11.28 3.59 7.56 13.29 23.40 25.12 9.78 26.24 26.16 10.42 coo 6.10 2.00 25.24 6.12 1.84 23.13 29.88 33.09 -1.63 31.17 34.65 -1.02 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 B 124 ALA D 47 ALA.? 9.74 OXT ACY B 401 B 126 ARG D 42 ARG~? 11.96 OXT ACY B 401 B 138 GLU D 13 GLU^? 19.04 OXT ACY B 401 coo 2.11 4.00 19.31 3.14 4.86 19.99 26.66 26.58 -5.77 26.10 25.95 -4.54 coo 2.45 5.53 11.28 3.59 7.56 13.29 32.58 20.13 -5.26 29.93 18.65 -5.63 coo 6.10 2.00 25.24 6.12 1.84 23.13 29.88 33.09 -1.63 31.17 34.65 -1.02 1xs1_c07 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 7 hits 1xs1_c07 naa= 3 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 C 124 ALA A 18 ALA~? 7.36 O3 PO4 A 302 C 126 ARG A 20 ARG~? 11.30 O1 PO4 A 302 C 138 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 22.09 8.41 -30.71 23.04 7.81 -29.69 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 19.43 13.50 -36.40 19.41 10.58 -37.42 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 C 124 ALA A 47 ALA.? 3.81 O4 PO4 A 302 C 126 ARG A 42 ARG~? 9.50 O4 PO4 A 302 C 138 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 25.04 12.46 -21.37 24.42 13.29 -22.47 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 31.60 18.55 -22.55 28.82 19.89 -22.65 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 C 124 ALA B 18 ALA~? 12.25 O ACY B 403 C 126 ARG B 20 ARG~? 14.42 CH3 ACY B 401 C 138 GLU B 13 GLU^? 15.77 O ACY B 403 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 11.02 10.71 5.62 9.97 10.17 4.66 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 14.16 15.78 11.00 13.60 12.97 12.19 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 4.71 8.41 0.32 2.63 9.02 0.18 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 C 124 ALA B 47 ALA.? 6.54 O ACY B 403 C 126 ARG B 42 ARG~? 8.81 CH3 ACY B 403 C 138 GLU B 13 GLU^? 15.77 O ACY B 403 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 8.57 14.17 -4.14 9.32 15.04 -3.15 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 2.83 20.50 -3.25 5.45 21.98 -3.93 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 4.71 8.41 0.32 2.63 9.02 0.18 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 C 124 ALA C 18 ALA~? 7.41 CH3 ACY C 404 C 126 ARG C 20 ARG~? 11.83 CH3 ACY C 404 C 138 GLU C 13 GLU^? 12.93 O ACY C 404 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 9.72 29.34 -31.05 8.94 30.10 -29.98 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 11.69 24.38 -36.69 11.38 27.15 -38.05 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 5.05 33.44 -24.76 4.47 35.34 -25.49 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 C 124 ALA C 47 ALA.? 3.99 O ACY C 404 C 126 ARG C 42 ARG~? 8.34 CH3 ACY A 402 C 138 GLU C 13 GLU^? 12.93 O ACY C 404 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 8.20 26.83 -20.86 8.77 25.92 -21.92 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 1.71 20.80 -20.88 4.34 19.24 -20.78 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 5.05 33.44 -24.76 4.47 35.34 -25.49 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 C 124 ALA D 18 ALA~? 13.59 CH3 ACY B 401 C 126 ARG D 20 ARG~? 14.11 CH3 ACY B 401 C 138 GLU D 13 GLU^? 19.04 OXT ACY B 401 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 25.69 30.05 3.92 26.57 30.60 2.82 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 23.40 25.12 9.78 26.24 26.16 10.42 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 29.88 33.09 -1.63 31.17 34.65 -1.02 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 8 3 # 8 C 124 ALA D 47 ALA.? 9.74 OXT ACY B 401 C 126 ARG D 42 ARG~? 11.96 OXT ACY B 401 C 138 GLU D 13 GLU^? 19.04 OXT ACY B 401 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 26.66 26.58 -5.77 26.10 25.95 -4.54 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 32.58 20.13 -5.26 29.93 18.65 -5.63 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 29.88 33.09 -1.63 31.17 34.65 -1.02 1xs1_c08 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 8 hits 1xs1_c08 naa= 3 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 D 124 ALA A 18 ALA~? 7.36 O3 PO4 A 302 D 126 ARG A 20 ARG~? 11.30 O1 PO4 A 302 D 138 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 22.09 8.41 -30.71 23.04 7.81 -29.69 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 19.43 13.50 -36.40 19.41 10.58 -37.42 coo 6.23 0.50 57.10 5.93 0.72 59.19 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 D 124 ALA A 47 ALA.? 3.81 O4 PO4 A 302 D 126 ARG A 42 ARG~? 9.50 O4 PO4 A 302 D 138 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 25.04 12.46 -21.37 24.42 13.29 -22.47 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 31.60 18.55 -22.55 28.82 19.89 -22.65 coo 6.23 0.50 57.10 5.93 0.72 59.19 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 D 124 ALA B 18 ALA~? 12.25 O ACY B 403 D 126 ARG B 20 ARG~? 14.42 CH3 ACY B 401 D 138 GLU B 13 GLU^? 15.77 O ACY B 403 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 11.02 10.71 5.62 9.97 10.17 4.66 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 14.16 15.78 11.00 13.60 12.97 12.19 coo 6.23 0.50 57.10 5.93 0.72 59.19 4.71 8.41 0.32 2.63 9.02 0.18 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 D 124 ALA B 47 ALA.? 6.54 O ACY B 403 D 126 ARG B 42 ARG~? 8.81 CH3 ACY B 403 D 138 GLU B 13 GLU^? 15.77 O ACY B 403 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 8.57 14.17 -4.14 9.32 15.04 -3.15 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 2.83 20.50 -3.25 5.45 21.98 -3.93 coo 6.23 0.50 57.10 5.93 0.72 59.19 4.71 8.41 0.32 2.63 9.02 0.18 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 D 124 ALA C 18 ALA~? 7.41 CH3 ACY C 404 D 126 ARG C 20 ARG~? 11.83 CH3 ACY C 404 D 138 GLU C 13 GLU^? 12.93 O ACY C 404 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 9.72 29.34 -31.05 8.94 30.10 -29.98 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 11.69 24.38 -36.69 11.38 27.15 -38.05 coo 6.23 0.50 57.10 5.93 0.72 59.19 5.05 33.44 -24.76 4.47 35.34 -25.49 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 D 124 ALA C 47 ALA.? 3.99 O ACY C 404 D 126 ARG C 42 ARG~? 8.34 CH3 ACY A 402 D 138 GLU C 13 GLU^? 12.93 O ACY C 404 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 8.20 26.83 -20.86 8.77 25.92 -21.92 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 1.71 20.80 -20.88 4.34 19.24 -20.78 coo 6.23 0.50 57.10 5.93 0.72 59.19 5.05 33.44 -24.76 4.47 35.34 -25.49 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 D 124 ALA D 18 ALA~? 13.59 CH3 ACY B 401 D 126 ARG D 20 ARG~? 14.11 CH3 ACY B 401 D 138 GLU D 13 GLU^? 19.04 OXT ACY B 401 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 25.69 30.05 3.92 26.57 30.60 2.82 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 23.40 25.12 9.78 26.24 26.16 10.42 coo 6.23 0.50 57.10 5.93 0.72 59.19 29.88 33.09 -1.63 31.17 34.65 -1.02 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 8 3 # 8 D 124 ALA D 47 ALA.? 9.74 OXT ACY B 401 D 126 ARG D 42 ARG~? 11.96 OXT ACY B 401 D 138 GLU D 13 GLU^? 19.04 OXT ACY B 401 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 26.66 26.58 -5.77 26.10 25.95 -4.54 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 32.58 20.13 -5.26 29.93 18.65 -5.63 coo 6.23 0.50 57.10 5.93 0.72 59.19 29.88 33.09 -1.63 31.17 34.65 -1.02 1xs1_c09 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 8 hits 1xs1_c09 naa= 3 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 E 124 ALA A 18 ALA~? 7.36 O3 PO4 A 302 E 126 ARG A 20 ARG~? 11.30 O1 PO4 A 302 E 138 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo -4.56 10.03 62.36 -4.38 11.31 61.55 22.09 8.41 -30.71 23.04 7.81 -29.69 coo -3.02 12.00 70.07 -1.94 13.84 67.82 19.43 13.50 -36.40 19.41 10.58 -37.42 coo -8.67 12.22 56.54 -8.68 12.09 58.65 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 E 124 ALA A 47 ALA.? 3.81 O4 PO4 A 302 E 126 ARG A 42 ARG~? 9.50 O4 PO4 A 302 E 138 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo -4.56 10.03 62.36 -4.38 11.31 61.55 25.04 12.46 -21.37 24.42 13.29 -22.47 coo -3.02 12.00 70.07 -1.94 13.84 67.82 31.60 18.55 -22.55 28.82 19.89 -22.65 coo -8.67 12.22 56.54 -8.68 12.09 58.65 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 E 124 ALA B 18 ALA~? 12.25 O ACY B 403 E 126 ARG B 20 ARG~? 14.42 CH3 ACY B 401 E 138 GLU B 13 GLU^? 15.77 O ACY B 403 coo -4.56 10.03 62.36 -4.38 11.31 61.55 11.02 10.71 5.62 9.97 10.17 4.66 coo -3.02 12.00 70.07 -1.94 13.84 67.82 14.16 15.78 11.00 13.60 12.97 12.19 coo -8.67 12.22 56.54 -8.68 12.09 58.65 4.71 8.41 0.32 2.63 9.02 0.18 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 E 124 ALA B 47 ALA.? 6.54 O ACY B 403 E 126 ARG B 42 ARG~? 8.81 CH3 ACY B 403 E 138 GLU B 13 GLU^? 15.77 O ACY B 403 coo -4.56 10.03 62.36 -4.38 11.31 61.55 8.57 14.17 -4.14 9.32 15.04 -3.15 coo -3.02 12.00 70.07 -1.94 13.84 67.82 2.83 20.50 -3.25 5.45 21.98 -3.93 coo -8.67 12.22 56.54 -8.68 12.09 58.65 4.71 8.41 0.32 2.63 9.02 0.18 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 E 124 ALA C 18 ALA~? 7.41 CH3 ACY C 404 E 126 ARG C 20 ARG~? 11.83 CH3 ACY C 404 E 138 GLU C 13 GLU^? 12.93 O ACY C 404 coo -4.56 10.03 62.36 -4.38 11.31 61.55 9.72 29.34 -31.05 8.94 30.10 -29.98 coo -3.02 12.00 70.07 -1.94 13.84 67.82 11.69 24.38 -36.69 11.38 27.15 -38.05 coo -8.67 12.22 56.54 -8.68 12.09 58.65 5.05 33.44 -24.76 4.47 35.34 -25.49 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 E 124 ALA C 47 ALA.? 3.99 O ACY C 404 E 126 ARG C 42 ARG~? 8.34 CH3 ACY A 402 E 138 GLU C 13 GLU^? 12.93 O ACY C 404 coo -4.56 10.03 62.36 -4.38 11.31 61.55 8.20 26.83 -20.86 8.77 25.92 -21.92 coo -3.02 12.00 70.07 -1.94 13.84 67.82 1.71 20.80 -20.88 4.34 19.24 -20.78 coo -8.67 12.22 56.54 -8.68 12.09 58.65 5.05 33.44 -24.76 4.47 35.34 -25.49 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 E 124 ALA D 18 ALA~? 13.59 CH3 ACY B 401 E 126 ARG D 20 ARG~? 14.11 CH3 ACY B 401 E 138 GLU D 13 GLU^? 19.04 OXT ACY B 401 coo -4.56 10.03 62.36 -4.38 11.31 61.55 25.69 30.05 3.92 26.57 30.60 2.82 coo -3.02 12.00 70.07 -1.94 13.84 67.82 23.40 25.12 9.78 26.24 26.16 10.42 coo -8.67 12.22 56.54 -8.68 12.09 58.65 29.88 33.09 -1.63 31.17 34.65 -1.02 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 8 3 # 8 E 124 ALA D 47 ALA.? 9.74 OXT ACY B 401 E 126 ARG D 42 ARG~? 11.96 OXT ACY B 401 E 138 GLU D 13 GLU^? 19.04 OXT ACY B 401 coo -4.56 10.03 62.36 -4.38 11.31 61.55 26.66 26.58 -5.77 26.10 25.95 -4.54 coo -3.02 12.00 70.07 -1.94 13.84 67.82 32.58 20.13 -5.26 29.93 18.65 -5.63 coo -8.67 12.22 56.54 -8.68 12.09 58.65 29.88 33.09 -1.63 31.17 34.65 -1.02 1xs1_c10 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 8 hits 1xs1_c10 naa= 3 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 F 124 ALA A 18 ALA~? 7.36 O3 PO4 A 302 F 126 ARG A 20 ARG~? 11.30 O1 PO4 A 302 F 138 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 22.09 8.41 -30.71 23.04 7.81 -29.69 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 19.43 13.50 -36.40 19.41 10.58 -37.42 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 F 124 ALA A 47 ALA.? 3.81 O4 PO4 A 302 F 126 ARG A 42 ARG~? 9.50 O4 PO4 A 302 F 138 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 25.04 12.46 -21.37 24.42 13.29 -22.47 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 31.60 18.55 -22.55 28.82 19.89 -22.65 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 F 124 ALA B 18 ALA~? 12.25 O ACY B 403 F 126 ARG B 20 ARG~? 14.42 CH3 ACY B 401 F 138 GLU B 13 GLU^? 15.77 O ACY B 403 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 11.02 10.71 5.62 9.97 10.17 4.66 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 14.16 15.78 11.00 13.60 12.97 12.19 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 4.71 8.41 0.32 2.63 9.02 0.18 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 F 124 ALA B 47 ALA.? 6.54 O ACY B 403 F 126 ARG B 42 ARG~? 8.81 CH3 ACY B 403 F 138 GLU B 13 GLU^? 15.77 O ACY B 403 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 8.57 14.17 -4.14 9.32 15.04 -3.15 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 2.83 20.50 -3.25 5.45 21.98 -3.93 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 4.71 8.41 0.32 2.63 9.02 0.18 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 F 124 ALA C 18 ALA~? 7.41 CH3 ACY C 404 F 126 ARG C 20 ARG~? 11.83 CH3 ACY C 404 F 138 GLU C 13 GLU^? 12.93 O ACY C 404 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 9.72 29.34 -31.05 8.94 30.10 -29.98 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 11.69 24.38 -36.69 11.38 27.15 -38.05 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 5.05 33.44 -24.76 4.47 35.34 -25.49 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 F 124 ALA C 47 ALA.? 3.99 O ACY C 404 F 126 ARG C 42 ARG~? 8.34 CH3 ACY A 402 F 138 GLU C 13 GLU^? 12.93 O ACY C 404 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 8.20 26.83 -20.86 8.77 25.92 -21.92 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 1.71 20.80 -20.88 4.34 19.24 -20.78 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 5.05 33.44 -24.76 4.47 35.34 -25.49 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 F 124 ALA D 18 ALA~? 13.59 CH3 ACY B 401 F 126 ARG D 20 ARG~? 14.11 CH3 ACY B 401 F 138 GLU D 13 GLU^? 19.04 OXT ACY B 401 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 25.69 30.05 3.92 26.57 30.60 2.82 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 23.40 25.12 9.78 26.24 26.16 10.42 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 29.88 33.09 -1.63 31.17 34.65 -1.02 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 8 3 # 8 F 124 ALA D 47 ALA.? 9.74 OXT ACY B 401 F 126 ARG D 42 ARG~? 11.96 OXT ACY B 401 F 138 GLU D 13 GLU^? 19.04 OXT ACY B 401 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 26.66 26.58 -5.77 26.10 25.95 -4.54 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 32.58 20.13 -5.26 29.93 18.65 -5.63 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 29.88 33.09 -1.63 31.17 34.65 -1.02 1xs1_c11 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 8 hits 1xs1_c11 naa= 3 ULMN 3 1ylu_c00 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 1 3 # 1 A 14 LYS D 3 LYS.? 18.33 CH3 ACY B 403 A 74 LYS D 54 LYS.? 18.95 CH3 ACY B 403 A 165 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo 18.28 7.83 36.39 22.82 8.75 39.52 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 14.16 13.09 37.03 20.00 12.44 37.49 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 22.22 16.06 48.76 23.94 15.33 49.78 -1.81 16.10 -9.11 -1.93 15.47 -11.12 1ylu_c00 source 1ylu OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE : 1 hits 1ylu_c00 naa= 3 ULMN 3 1ylu_c01 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 1 3 # 1 B 14 LYS D 3 LYS.? 18.33 CH3 ACY B 403 B 74 LYS D 54 LYS.? 18.95 CH3 ACY B 403 B 165 GLU B 43 GLU~? 18.31 CH3 ACY B 403 coo 13.51 0.92 76.10 12.98 6.13 74.68 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 19.89 -0.55 76.51 17.10 4.32 77.43 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 21.39 11.56 68.52 20.24 13.13 67.73 -1.81 16.10 -9.11 -1.93 15.47 -11.12 1ylu_c01 source 1ylu OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE : 1 hits 1ylu_c01 naa= 3 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 1 3 # 1 A 369 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 371 LYS C 3 LYS.? 18.92 O1 PO4 A 302 A 407 THR C 59 THR~? 18.08 O3 GOL A 501 coo -5.17 31.09 15.73 -7.07 31.12 16.73 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -4.43 30.92 22.89 -6.61 31.91 19.71 35.92 31.10 -19.94 35.74 27.15 -23.97 coo -8.38 36.02 19.06 -8.83 34.10 19.89 29.94 33.15 -27.01 30.78 31.19 -27.05 1zrz_c02 source 1zrz PROTEIN KINASE C, IOTA : 1 hits 1zrz_c02 naa= 3 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 # 1 193 ASP A 32 ASP.? 10.92 O ACY A 402 231 ASP B 14 ASP.? 10.32 CH3 ACY B 403 294 ASP A 56 ASP~? 17.92 O ACY A 402 coo 27.89 102.52 14.98 29.35 101.92 13.57 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 14.74 93.05 -1.00 14.30 94.22 0.73 4.45 14.77 1.64 4.87 15.68 -0.19 coo 33.16 106.80 7.72 33.34 104.87 6.92 -2.03 5.92 -20.65 -1.35 5.51 -22.61 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 # 2 193 ASP B 32 ASP.? 15.94 OXT ACY B 401 231 ASP A 14 ASP.? 7.78 O4 PO4 A 302 294 ASP B 56 ASP~? 21.60 OXT ACY B 401 coo 27.89 102.52 14.98 29.35 101.92 13.57 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 14.74 93.05 -1.00 14.30 94.22 0.73 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 33.16 106.80 7.72 33.34 104.87 6.92 35.20 5.48 -3.85 34.81 5.79 -1.78 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 3 3 # 3 193 ASP B 56 ASP~? 21.60 OXT ACY B 401 231 ASP A 14 ASP.? 7.78 O4 PO4 A 302 294 ASP B 32 ASP.? 15.94 OXT ACY B 401 coo 27.89 102.52 14.98 29.35 101.92 13.57 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 14.74 93.05 -1.00 14.30 94.22 0.73 28.88 11.61 -26.71 29.05 13.35 -27.94 coo 33.16 106.80 7.72 33.34 104.87 6.92 30.64 12.55 -3.88 32.46 12.19 -2.91 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 4 3 # 4 193 ASP C 32 ASP.? 15.02 O1 PO4 A 302 231 ASP D 14 ASP.? 10.51 OXT ACY B 401 294 ASP C 56 ASP~? 22.04 O3 GOL A 501 coo 27.89 102.52 14.98 29.35 101.92 13.57 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 14.74 93.05 -1.00 14.30 94.22 0.73 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 33.16 106.80 7.72 33.34 104.87 6.92 34.87 33.34 -23.80 34.50 32.98 -25.83 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 5 3 # 5 193 ASP D 32 ASP.? 14.33 CH3 ACY B 403 231 ASP C 14 ASP.? 7.62 O ACY C 404 294 ASP D 56 ASP~? 19.96 CH3 ACY B 403 coo 27.89 102.52 14.98 29.35 101.92 13.57 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 14.74 93.05 -1.00 14.30 94.22 0.73 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 33.16 106.80 7.72 33.34 104.87 6.92 0.36 35.17 -3.02 0.83 34.67 -1.05 2amg_c06 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 5 hits 2amg_c06 naa= 3 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 1 3 # 1 A 14 ARG A 42 ARG~? 9.50 O4 PO4 A 302 A 161 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 174 TYR C 6 TYR^? 20.74 O2 GOL A 501 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 31.60 18.55 -22.55 28.82 19.89 -22.65 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 28.12 33.29 -18.50 30.13 35.12 -19.15 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 2 3 # 2 A 14 ARG B 42 ARG~? 8.81 CH3 ACY B 403 A 161 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 174 TYR D 6 TYR^? 18.56 CH3 ACY B 403 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 2.83 20.50 -3.25 5.45 21.98 -3.93 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 7.30 34.85 -8.71 5.25 36.67 -8.19 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 3 3 # 3 A 14 ARG B 74 ARG^? 16.09 O ACY B 403 A 161 ASP B 14 ASP.? 10.32 CH3 ACY B 403 A 174 TYR B 19 TYR~? 7.66 CH3 ACY B 403 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 8.52 3.16 -3.88 8.54 3.61 -6.93 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 4.45 14.77 1.64 4.87 15.68 -0.19 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 10.24 15.60 3.03 8.77 16.10 0.69 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 4 3 # 4 A 14 ARG C 42 ARG~? 8.34 CH3 ACY A 402 A 161 ASP A 56 ASP~? 17.92 O ACY A 402 A 174 TYR A 6 TYR^? 17.89 O ACY A 402 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 1.71 20.80 -20.88 4.34 19.24 -20.78 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 5.36 6.34 -15.79 3.13 4.70 -15.92 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 5 3 # 5 A 14 ARG C 74 ARG^? 14.08 O ACY C 404 A 161 ASP C 14 ASP.? 7.62 O ACY C 404 A 174 TYR C 19 TYR~? -3.65 O ACY C 404s coo 14.43 -13.26 8.40 11.75 -14.25 9.60 9.75 38.11 -21.77 8.89 36.86 -19.09 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 8.78 24.90 -28.00 7.24 25.17 -25.66 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 6 3 # 6 A 14 ARG D 74 ARG^? 19.24 OXT ACY B 401 A 161 ASP D 14 ASP.? 10.51 OXT ACY B 401 A 174 TYR D 19 TYR~? 6.50 OXT ACY B 401 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 25.93 38.34 -6.34 26.99 36.29 -8.39 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 24.45 24.76 1.05 22.95 23.32 -0.81 2c7v_c08 source 2c7v PTERIDINE REDUCTASE : 6 hits 2c7v_c08 naa= 3 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 1 3 # 1 B 14 ARG A 42 ARG~? 9.50 O4 PO4 A 302 B 161 ASP C 56 ASP~? 22.04 O3 GOL A 501 B 174 TYR C 6 TYR^? 20.74 O2 GOL A 501 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 31.60 18.55 -22.55 28.82 19.89 -22.65 coo -14.86 10.19 8.14 -14.82 12.31 8.42 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -21.46 12.70 8.53 -19.04 12.30 7.24 28.12 33.29 -18.50 30.13 35.12 -19.15 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 2 3 # 2 B 14 ARG B 42 ARG~? 8.81 CH3 ACY B 403 B 161 ASP D 56 ASP~? 19.96 CH3 ACY B 403 B 174 TYR D 6 TYR^? 18.56 CH3 ACY B 403 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 2.83 20.50 -3.25 5.45 21.98 -3.93 coo -14.86 10.19 8.14 -14.82 12.31 8.42 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -21.46 12.70 8.53 -19.04 12.30 7.24 7.30 34.85 -8.71 5.25 36.67 -8.19 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 3 3 # 3 B 14 ARG B 74 ARG^? 16.09 O ACY B 403 B 161 ASP B 14 ASP.? 10.32 CH3 ACY B 403 B 174 TYR B 19 TYR~? 7.66 CH3 ACY B 403 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 8.52 3.16 -3.88 8.54 3.61 -6.93 coo -14.86 10.19 8.14 -14.82 12.31 8.42 4.45 14.77 1.64 4.87 15.68 -0.19 coo -21.46 12.70 8.53 -19.04 12.30 7.24 10.24 15.60 3.03 8.77 16.10 0.69 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 4 3 # 4 B 14 ARG C 42 ARG~? 8.34 CH3 ACY A 402 B 161 ASP A 56 ASP~? 17.92 O ACY A 402 B 174 TYR A 6 TYR^? 17.89 O ACY A 402 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 1.71 20.80 -20.88 4.34 19.24 -20.78 coo -14.86 10.19 8.14 -14.82 12.31 8.42 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -21.46 12.70 8.53 -19.04 12.30 7.24 5.36 6.34 -15.79 3.13 4.70 -15.92 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 5 3 # 5 B 14 ARG C 74 ARG^? 14.08 O ACY C 404 B 161 ASP C 14 ASP.? 7.62 O ACY C 404 B 174 TYR C 19 TYR~? -3.65 O ACY C 404s coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 9.75 38.11 -21.77 8.89 36.86 -19.09 coo -14.86 10.19 8.14 -14.82 12.31 8.42 3.61 26.88 -25.47 3.45 24.89 -26.21 coo -21.46 12.70 8.53 -19.04 12.30 7.24 8.78 24.90 -28.00 7.24 25.17 -25.66 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 6 3 # 6 B 14 ARG D 74 ARG^? 19.24 OXT ACY B 401 B 161 ASP D 14 ASP.? 10.51 OXT ACY B 401 B 174 TYR D 19 TYR~? 6.50 OXT ACY B 401 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 25.93 38.34 -6.34 26.99 36.29 -8.39 coo -14.86 10.19 8.14 -14.82 12.31 8.42 29.91 25.87 -1.90 28.44 24.29 -2.10 coo -21.46 12.70 8.53 -19.04 12.30 7.24 24.45 24.76 1.05 22.95 23.32 -0.81 2c7v_c09 source 2c7v PTERIDINE REDUCTASE : 6 hits 2c7v_c09 naa= 3 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 1 3 # 1 C 14 ARG A 42 ARG~? 9.50 O4 PO4 A 302 C 161 ASP C 56 ASP~? 22.04 O3 GOL A 501 C 174 TYR C 6 TYR^? 20.74 O2 GOL A 501 coo 2.84 19.43 40.34 1.59 20.35 37.65 31.60 18.55 -22.55 28.82 19.89 -22.65 coo -0.62 11.10 28.05 -0.65 13.15 27.46 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 5.94 13.28 27.17 3.53 13.05 28.58 28.12 33.29 -18.50 30.13 35.12 -19.15 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 2 3 # 2 C 14 ARG B 42 ARG~? 8.81 CH3 ACY B 403 C 161 ASP D 56 ASP~? 19.96 CH3 ACY B 403 C 174 TYR D 6 TYR^? 18.56 CH3 ACY B 403 coo 2.84 19.43 40.34 1.59 20.35 37.65 2.83 20.50 -3.25 5.45 21.98 -3.93 coo -0.62 11.10 28.05 -0.65 13.15 27.46 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 5.94 13.28 27.17 3.53 13.05 28.58 7.30 34.85 -8.71 5.25 36.67 -8.19 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 3 3 # 3 C 14 ARG B 74 ARG^? 16.09 O ACY B 403 C 161 ASP B 14 ASP.? 10.32 CH3 ACY B 403 C 174 TYR B 19 TYR~? 7.66 CH3 ACY B 403 coo 2.84 19.43 40.34 1.59 20.35 37.65 8.52 3.16 -3.88 8.54 3.61 -6.93 coo -0.62 11.10 28.05 -0.65 13.15 27.46 4.45 14.77 1.64 4.87 15.68 -0.19 coo 5.94 13.28 27.17 3.53 13.05 28.58 10.24 15.60 3.03 8.77 16.10 0.69 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 4 3 # 4 C 14 ARG C 42 ARG~? 8.34 CH3 ACY A 402 C 161 ASP A 56 ASP~? 17.92 O ACY A 402 C 174 TYR A 6 TYR^? 17.89 O ACY A 402 coo 2.84 19.43 40.34 1.59 20.35 37.65 1.71 20.80 -20.88 4.34 19.24 -20.78 coo -0.62 11.10 28.05 -0.65 13.15 27.46 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 5.94 13.28 27.17 3.53 13.05 28.58 5.36 6.34 -15.79 3.13 4.70 -15.92 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 5 3 # 5 C 14 ARG C 74 ARG^? 14.08 O ACY C 404 C 161 ASP C 14 ASP.? 7.62 O ACY C 404 C 174 TYR C 19 TYR~? -3.65 O ACY C 404s coo 2.84 19.43 40.34 1.59 20.35 37.65 9.75 38.11 -21.77 8.89 36.86 -19.09 coo -0.62 11.10 28.05 -0.65 13.15 27.46 3.61 26.88 -25.47 3.45 24.89 -26.21 coo 5.94 13.28 27.17 3.53 13.05 28.58 8.78 24.90 -28.00 7.24 25.17 -25.66 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 6 3 # 6 C 14 ARG D 74 ARG^? 19.24 OXT ACY B 401 C 161 ASP D 14 ASP.? 10.51 OXT ACY B 401 C 174 TYR D 19 TYR~? 6.50 OXT ACY B 401 coo 2.84 19.43 40.34 1.59 20.35 37.65 25.93 38.34 -6.34 26.99 36.29 -8.39 coo -0.62 11.10 28.05 -0.65 13.15 27.46 29.91 25.87 -1.90 28.44 24.29 -2.10 coo 5.94 13.28 27.17 3.53 13.05 28.58 24.45 24.76 1.05 22.95 23.32 -0.81 2c7v_c10 source 2c7v PTERIDINE REDUCTASE : 6 hits 2c7v_c10 naa= 3 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 1 3 # 1 D 14 ARG A 42 ARG~? 9.50 O4 PO4 A 302 D 161 ASP C 56 ASP~? 22.04 O3 GOL A 501 D 174 TYR C 6 TYR^? 20.74 O2 GOL A 501 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 31.60 18.55 -22.55 28.82 19.89 -22.65 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 28.12 33.29 -18.50 30.13 35.12 -19.15 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 2 3 # 2 D 14 ARG B 42 ARG~? 8.81 CH3 ACY B 403 D 161 ASP D 56 ASP~? 19.96 CH3 ACY B 403 D 174 TYR D 6 TYR^? 18.56 CH3 ACY B 403 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 2.83 20.50 -3.25 5.45 21.98 -3.93 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 7.30 34.85 -8.71 5.25 36.67 -8.19 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 3 3 # 3 D 14 ARG B 74 ARG^? 16.09 O ACY B 403 D 161 ASP B 14 ASP.? 10.32 CH3 ACY B 403 D 174 TYR B 19 TYR~? 7.66 CH3 ACY B 403 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 8.52 3.16 -3.88 8.54 3.61 -6.93 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 4.45 14.77 1.64 4.87 15.68 -0.19 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 10.24 15.60 3.03 8.77 16.10 0.69 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 4 3 # 4 D 14 ARG C 42 ARG~? 8.34 CH3 ACY A 402 D 161 ASP A 56 ASP~? 17.92 O ACY A 402 D 174 TYR A 6 TYR^? 17.89 O ACY A 402 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 1.71 20.80 -20.88 4.34 19.24 -20.78 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 5.36 6.34 -15.79 3.13 4.70 -15.92 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 5 3 # 5 D 14 ARG C 74 ARG^? 14.08 O ACY C 404 D 161 ASP C 14 ASP.? 7.62 O ACY C 404 D 174 TYR C 19 TYR~? -3.65 O ACY C 404s coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 9.75 38.11 -21.77 8.89 36.86 -19.09 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 3.61 26.88 -25.47 3.45 24.89 -26.21 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 8.78 24.90 -28.00 7.24 25.17 -25.66 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 6 3 # 6 D 14 ARG D 74 ARG^? 19.24 OXT ACY B 401 D 161 ASP D 14 ASP.? 10.51 OXT ACY B 401 D 174 TYR D 19 TYR~? 6.50 OXT ACY B 401 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 25.93 38.34 -6.34 26.99 36.29 -8.39 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 29.91 25.87 -1.90 28.44 24.29 -2.10 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 24.45 24.76 1.05 22.95 23.32 -0.81 2c7v_c11 source 2c7v PTERIDINE REDUCTASE : 6 hits 2c7v_c11 naa= 3 ULMN 3 2cpu_c01 ALPHA-AMYLASE user 1 3 # 1 A 197 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 233 GLU C 31 GLU.? 14.58 O1 PO4 A 302 A 300 ASN C 28 ASN~? 11.75 O3 GOL A 501 coo 12.51 17.07 49.46 12.44 16.89 47.35 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 6.52 19.14 48.16 7.77 18.42 46.61 31.25 23.87 -27.43 32.95 24.08 -28.66 coo 9.30 22.40 41.76 10.10 20.96 40.36 24.24 26.01 -32.95 22.97 25.58 -34.62 2cpu_c01 source 2cpu ALPHA-AMYLASE : 1 hits 2cpu_c01 naa= 3 ULMN 3 2dbt_c00 CHITINASE C user 1 3 # 1 A 147 GLU B 16 GLU~? 16.20 CH3 ACY B 401 A 156 GLU B 13 GLU^? 15.77 O ACY B 403 A 194 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo 74.14 15.91 8.55 72.08 15.36 8.63 6.77 16.82 9.46 6.30 17.54 11.41 coo 67.47 20.07 1.34 65.99 20.06 2.88 4.71 8.41 0.32 2.63 9.02 0.18 coo 67.44 25.26 13.91 67.54 23.65 15.28 16.95 16.62 4.13 15.59 17.22 2.56 ULMN 3 2dbt_c00 CHITINASE C user 2 3 # 2 A 147 GLU D 16 GLU~? 15.82 CH3 ACY B 401 A 156 GLU D 13 GLU^? 19.04 OXT ACY B 401 A 194 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo 74.14 15.91 8.55 72.08 15.36 8.63 29.82 25.98 8.07 29.78 25.08 10.01 coo 67.47 20.07 1.34 65.99 20.06 2.88 29.88 33.09 -1.63 31.17 34.65 -1.02 coo 67.44 25.26 13.91 67.54 23.65 15.28 19.37 24.14 3.44 20.48 23.43 1.80 2dbt_c00 source 2dbt CHITINASE C : 2 hits 2dbt_c00 naa= 3 ULMN 3 2dbt_c01 CHITINASE C user 1 3 # 1 B 147 GLU D 13 GLU^? 19.04 OXT ACY B 401 B 156 GLU D 16 GLU~? 15.82 CH3 ACY B 401 B 194 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo 45.64 63.11 17.20 47.48 62.43 16.45 29.88 33.09 -1.63 31.17 34.65 -1.02 coo 54.43 67.89 19.82 55.62 67.90 18.07 29.82 25.98 8.07 29.78 25.08 10.01 coo 49.79 70.75 7.78 50.10 68.90 6.86 19.37 24.14 3.44 20.48 23.43 1.80 ULMN 3 2dbt_c01 CHITINASE C user 2 3 # 2 B 147 GLU D 16 GLU~? 15.82 CH3 ACY B 401 B 156 GLU D 13 GLU^? 19.04 OXT ACY B 401 B 194 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo 45.64 63.11 17.20 47.48 62.43 16.45 29.82 25.98 8.07 29.78 25.08 10.01 coo 54.43 67.89 19.82 55.62 67.90 18.07 29.88 33.09 -1.63 31.17 34.65 -1.02 coo 49.79 70.75 7.78 50.10 68.90 6.86 19.37 24.14 3.44 20.48 23.43 1.80 2dbt_c01 source 2dbt CHITINASE C : 2 hits 2dbt_c01 naa= 3 ULMN 3 2dbt_c02 CHITINASE C user 1 3 # 1 C 147 GLU B 16 GLU~? 16.20 CH3 ACY B 401 C 156 GLU B 13 GLU^? 15.77 O ACY B 403 C 194 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo 41.23 29.31 13.28 43.03 29.85 12.29 6.77 16.82 9.46 6.30 17.54 11.41 coo 44.75 23.09 5.51 46.77 22.91 6.12 4.71 8.41 0.32 2.63 9.02 0.18 coo 49.75 21.00 18.12 50.45 23.02 18.26 16.95 16.62 4.13 15.59 17.22 2.56 ULMN 3 2dbt_c02 CHITINASE C user 2 3 # 2 C 147 GLU D 16 GLU~? 15.82 CH3 ACY B 401 C 156 GLU D 13 GLU^? 19.04 OXT ACY B 401 C 194 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo 41.23 29.31 13.28 43.03 29.85 12.29 29.82 25.98 8.07 29.78 25.08 10.01 coo 44.75 23.09 5.51 46.77 22.91 6.12 29.88 33.09 -1.63 31.17 34.65 -1.02 coo 49.75 21.00 18.12 50.45 23.02 18.26 19.37 24.14 3.44 20.48 23.43 1.80 ULMN 3 2dbt_c02 CHITINASE C user 3 3 # 3 C 147 GLU D 16 GLU~? 15.82 CH3 ACY B 401 C 156 GLU D 24 GLU~? 11.43 CH3 ACY B 401 C 194 ASN B 28 ASN~? 12.29 CH3 ACY B 401 coo 41.23 29.31 13.28 43.03 29.85 12.29 29.82 25.98 8.07 29.78 25.08 10.01 coo 44.75 23.09 5.51 46.77 22.91 6.12 18.15 25.86 8.28 19.10 26.69 9.97 coo 49.75 21.00 18.12 50.45 23.02 18.26 25.98 12.60 5.56 25.16 13.05 7.49 2dbt_c02 source 2dbt CHITINASE C : 3 hits 2dbt_c02 naa= 3 ULMN 3 2dw7_c35 BLL6730 PROTEIN user 1 3 # 1 D 182 LYS A 3 LYS.? 16.38 O ACY A 402 D 184 LYS A 54 LYS.? 19.07 O ACY A 402 D 345 ASP A 58 ASP~? 21.11 O ACY A 402 coo 29.31 -12.29 40.88 26.50 -8.82 44.94 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 23.25 -10.73 37.68 24.08 -6.91 41.08 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 35.01 -2.71 35.14 36.51 -4.14 34.87 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 2dw7_c35 BLL6730 PROTEIN user 2 3 # 2 D 182 LYS D 3 LYS.? 18.33 CH3 ACY B 403 D 184 LYS D 54 LYS.? 18.95 CH3 ACY B 403 D 345 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 29.31 -12.29 40.88 26.50 -8.82 44.94 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 23.25 -10.73 37.68 24.08 -6.91 41.08 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 35.01 -2.71 35.14 36.51 -4.14 34.87 2.43 37.89 1.30 0.84 39.23 1.50 2dw7_c35 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c35 naa= 3 ULMN 3 2dw7_c36 BLL6730 PROTEIN user 1 3 # 1 E 182 LYS A 3 LYS.? 16.38 O ACY A 402 E 184 LYS A 54 LYS.? 19.07 O ACY A 402 E 345 ASP A 58 ASP~? 21.11 O ACY A 402 coo -21.16 62.58 121.86 -16.35 60.33 119.23 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo -23.22 55.98 120.74 -18.11 55.31 120.43 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo -17.15 59.71 133.33 -17.96 61.54 134.01 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 2dw7_c36 BLL6730 PROTEIN user 2 3 # 2 E 182 LYS D 3 LYS.? 18.33 CH3 ACY B 403 E 184 LYS D 54 LYS.? 18.95 CH3 ACY B 403 E 345 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo -21.16 62.58 121.86 -16.35 60.33 119.23 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo -23.22 55.98 120.74 -18.11 55.31 120.43 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo -17.15 59.71 133.33 -17.96 61.54 134.01 2.43 37.89 1.30 0.84 39.23 1.50 2dw7_c36 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c36 naa= 3 ULMN 3 2dw7_c37 BLL6730 PROTEIN user 1 3 # 1 F 182 LYS A 3 LYS.? 16.38 O ACY A 402 F 184 LYS A 54 LYS.? 19.07 O ACY A 402 F 345 ASP A 58 ASP~? 21.11 O ACY A 402 coo 10.64 34.02 91.30 6.30 35.60 95.11 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 13.75 39.76 94.12 11.42 37.23 97.89 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 16.35 26.90 99.56 16.81 25.90 97.75 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 2dw7_c37 BLL6730 PROTEIN user 2 3 # 2 F 182 LYS B 3 LYS.? 19.35 OXT ACY B 401 F 184 LYS B 54 LYS.? 19.51 O4 PO4 A 302 F 345 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 10.64 34.02 91.30 6.30 35.60 95.11 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 13.75 39.76 94.12 11.42 37.23 97.89 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 16.35 26.90 99.56 16.81 25.90 97.75 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 2dw7_c37 BLL6730 PROTEIN user 3 3 # 3 F 182 LYS D 3 LYS.? 18.33 CH3 ACY B 403 F 184 LYS D 54 LYS.? 18.95 CH3 ACY B 403 F 345 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 10.64 34.02 91.30 6.30 35.60 95.11 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 13.75 39.76 94.12 11.42 37.23 97.89 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 16.35 26.90 99.56 16.81 25.90 97.75 2.43 37.89 1.30 0.84 39.23 1.50 2dw7_c37 source 2dw7 BLL6730 PROTEIN : 3 hits 2dw7_c37 naa= 3 ULMN 3 2dw7_c39 BLL6730 PROTEIN user 1 3 # 1 H 182 LYS A 3 LYS.? 16.38 O ACY A 402 H 184 LYS A 54 LYS.? 19.07 O ACY A 402 H 345 ASP A 58 ASP~? 21.11 O ACY A 402 coo 71.58 83.18 80.51 66.88 79.77 79.84 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 73.65 78.64 75.66 68.14 79.07 75.04 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 67.43 90.73 71.39 68.27 92.30 72.52 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 2dw7_c39 BLL6730 PROTEIN user 2 3 # 2 H 182 LYS D 3 LYS.? 18.33 CH3 ACY B 403 H 184 LYS D 54 LYS.? 18.95 CH3 ACY B 403 H 345 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 71.58 83.18 80.51 66.88 79.77 79.84 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 73.65 78.64 75.66 68.14 79.07 75.04 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 67.43 90.73 71.39 68.27 92.30 72.52 2.43 37.89 1.30 0.84 39.23 1.50 2dw7_c39 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c39 naa= 3 ULMN 3 2dw7_c40 BLL6730 PROTEIN user 1 3 # 1 I 182 LYS A 3 LYS.? 16.38 O ACY A 402 I 184 LYS A 54 LYS.? 19.07 O ACY A 402 I 345 ASP A 58 ASP~? 21.11 O ACY A 402 coo 60.20 96.92 42.53 57.60 93.13 38.67 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 54.31 95.46 46.01 55.34 91.59 42.65 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 66.35 87.81 48.53 68.10 89.01 48.77 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 2dw7_c40 BLL6730 PROTEIN user 2 3 # 2 I 182 LYS D 3 LYS.? 18.33 CH3 ACY B 403 I 184 LYS D 54 LYS.? 18.95 CH3 ACY B 403 I 345 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 60.20 96.92 42.53 57.60 93.13 38.67 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 54.31 95.46 46.01 55.34 91.59 42.65 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 66.35 87.81 48.53 68.10 89.01 48.77 2.43 37.89 1.30 0.84 39.23 1.50 2dw7_c40 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c40 naa= 3 ULMN 3 2dw7_c45 BLL6730 PROTEIN user 1 3 # 1 N 182 LYS A 3 LYS.? 16.38 O ACY A 402 N 184 LYS A 54 LYS.? 19.07 O ACY A 402 N 345 ASP A 58 ASP~? 21.11 O ACY A 402 coo 22.75 -28.13 87.31 18.89 -29.87 83.00 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 16.58 -26.28 90.12 15.40 -29.80 86.61 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 22.32 -38.59 93.74 24.34 -38.41 94.32 -0.40 1.81 -24.05 -0.18 0.11 -25.35 ULMN 3 2dw7_c45 BLL6730 PROTEIN user 2 3 # 2 N 182 LYS B 3 LYS.? 19.35 OXT ACY B 401 N 184 LYS B 54 LYS.? 19.51 O4 PO4 A 302 N 345 ASP B 58 ASP~? 24.69 OXT ACY B 401 coo 22.75 -28.13 87.31 18.89 -29.87 83.00 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 16.58 -26.28 90.12 15.40 -29.80 86.61 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 22.32 -38.59 93.74 24.34 -38.41 94.32 33.22 2.96 0.74 34.69 1.59 1.17 ULMN 3 2dw7_c45 BLL6730 PROTEIN user 3 3 # 3 N 182 LYS D 3 LYS.? 18.33 CH3 ACY B 403 N 184 LYS D 54 LYS.? 18.95 CH3 ACY B 403 N 345 ASP D 58 ASP~? 23.91 CH3 ACY B 403 coo 22.75 -28.13 87.31 18.89 -29.87 83.00 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 16.58 -26.28 90.12 15.40 -29.80 86.61 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 22.32 -38.59 93.74 24.34 -38.41 94.32 2.43 37.89 1.30 0.84 39.23 1.50 2dw7_c45 source 2dw7 BLL6730 PROTEIN : 3 hits 2dw7_c45 naa= 3 ULMN 3 2hdh_c02 L-3-HYDROXYACYL COA DEHYDROGENASE user 1 3 # 1 B 137 SER A 30 SER.? -4.23 CH3 ACY A 402s B 158 HIS A 27 HIS~? -3.83 OXT ACY A 402s B 208 ASN A 28 ASN~? 9.25 OXT ACY A 402 coo 50.29 50.10 71.46 47.85 50.06 71.46 6.58 16.18 -25.41 6.11 17.58 -27.30 coo 48.67 45.40 71.68 47.67 46.90 70.60 9.52 16.92 -31.25 8.29 18.47 -31.94 coo 48.91 49.12 65.17 47.29 49.14 66.54 7.12 11.54 -30.87 7.65 11.60 -32.93 ULMN 3 2hdh_c02 L-3-HYDROXYACYL COA DEHYDROGENASE user 2 3 # 2 B 137 SER B 30 SER.? 9.89 OXT ACY B 401 B 158 HIS B 27 HIS~? 8.91 CH3 ACY B 401 B 208 ASN B 28 ASN~? 12.29 CH3 ACY B 401 coo 50.29 50.10 71.46 47.85 50.06 71.46 27.11 16.51 -0.32 27.88 17.99 1.39 coo 48.67 45.40 71.68 47.67 46.90 70.60 24.22 18.07 5.55 25.63 19.33 6.45 coo 48.91 49.12 65.17 47.29 49.14 66.54 25.98 12.60 5.56 25.16 13.05 7.49 ULMN 3 2hdh_c02 L-3-HYDROXYACYL COA DEHYDROGENASE user 3 3 # 3 B 137 SER C 30 SER.? 7.40 O1 PO4 A 302 B 158 HIS C 27 HIS~? 7.34 O1 PO4 A 302 B 208 ASN C 28 ASN~? 11.75 O3 GOL A 501 coo 50.29 50.10 71.46 47.85 50.06 71.46 25.81 22.61 -26.89 26.10 20.85 -28.49 coo 48.67 45.40 71.68 47.67 46.90 70.60 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 48.91 49.12 65.17 47.29 49.14 66.54 24.24 26.01 -32.95 22.97 25.58 -34.62 ULMN 3 2hdh_c02 L-3-HYDROXYACYL COA DEHYDROGENASE user 4 3 # 4 B 137 SER D 30 SER.? 8.07 CH3 ACY B 403 B 158 HIS D 27 HIS~? 8.84 CH3 ACY B 401 B 208 ASN D 28 ASN~? 12.25 CH3 ACY B 401 coo 50.29 50.10 71.46 47.85 50.06 71.46 8.81 24.50 0.42 8.52 22.82 2.10 coo 48.67 45.40 71.68 47.67 46.90 70.60 12.53 22.86 5.89 11.39 21.93 7.39 coo 48.91 49.12 65.17 47.29 49.14 66.54 10.83 28.19 6.10 11.90 27.91 7.93 2hdh_c02 source 2hdh L-3-HYDROXYACYL COA DEHYDROGENASE : 4 hits 2hdh_c02 naa= 3 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 177 PHE A 29 PHE~? 10.35 O ACY A 402 A 263 ASP A 58 ASP~? 21.11 O ACY A 402 A 292 LYS A 3 LYS.? 16.38 O ACY A 402 coo 51.51 50.32 16.39 52.13 49.68 13.75 6.52 10.08 -26.44 5.88 7.60 -27.67 coo 54.43 44.82 23.74 55.21 45.06 21.80 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 63.95 45.30 16.71 59.11 49.15 16.05 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 A 177 PHE B 29 PHE~? 13.95 OXT ACY B 401 A 263 ASP B 58 ASP~? 24.69 OXT ACY B 401 A 292 LYS B 3 LYS.? 19.35 OXT ACY B 401 coo 51.51 50.32 16.39 52.13 49.68 13.75 26.40 10.51 1.39 26.72 8.16 2.92 coo 54.43 44.82 23.74 55.21 45.06 21.80 33.22 2.96 0.74 34.69 1.59 1.17 coo 63.95 45.30 16.71 59.11 49.15 16.05 35.65 7.25 -8.40 36.12 12.24 -4.67 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 A 177 PHE C 29 PHE~? 13.92 O3 GOL A 501 A 263 ASP C 58 ASP~? 25.07 O3 GOL A 501 A 292 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 51.51 50.32 16.39 52.13 49.68 13.75 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 54.43 44.82 23.74 55.21 45.06 21.80 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 63.95 45.30 16.71 59.11 49.15 16.05 35.92 31.10 -19.94 35.74 27.15 -23.97 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 4 3 # 4 A 177 PHE D 29 PHE~? 13.75 O ACY B 401 A 263 ASP D 58 ASP~? 23.91 CH3 ACY B 403 A 292 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo 51.51 50.32 16.39 52.13 49.68 13.75 9.63 30.41 1.98 9.49 32.86 3.31 coo 54.43 44.82 23.74 55.21 45.06 21.80 2.43 37.89 1.30 0.84 39.23 1.50 coo 63.95 45.30 16.71 59.11 49.15 16.05 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 5 3 # 5 A 177 PHE D 29 PHE~? 13.75 O ACY B 401 A 263 ASP D 58 ASP~? 23.91 CH3 ACY B 403 A 292 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 51.51 50.32 16.39 52.13 49.68 13.75 9.63 30.41 1.98 9.49 32.86 3.31 coo 54.43 44.82 23.74 55.21 45.06 21.80 2.43 37.89 1.30 0.84 39.23 1.50 coo 63.95 45.30 16.71 59.11 49.15 16.05 3.89 29.44 -7.86 -1.70 27.89 -10.01 2oat_c03 source 2oat ORNITHINE AMINOTRANSFERASE : 5 hits 2oat_c03 naa= 3 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 B 177 PHE A 29 PHE~? 10.35 O ACY A 402 B 263 ASP A 58 ASP~? 21.11 O ACY A 402 B 292 LYS A 3 LYS.? 16.38 O ACY A 402 coo 49.99 26.05 6.28 51.46 26.87 8.49 6.52 10.08 -26.44 5.88 7.60 -27.67 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 60.53 31.67 0.97 57.79 27.51 3.63 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 B 177 PHE B 29 PHE~? 13.95 OXT ACY B 401 B 263 ASP B 58 ASP~? 24.69 OXT ACY B 401 B 292 LYS B 3 LYS.? 19.35 OXT ACY B 401 coo 49.99 26.05 6.28 51.46 26.87 8.49 26.40 10.51 1.39 26.72 8.16 2.92 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 33.22 2.96 0.74 34.69 1.59 1.17 coo 60.53 31.67 0.97 57.79 27.51 3.63 35.65 7.25 -8.40 36.12 12.24 -4.67 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 B 177 PHE C 29 PHE~? 13.92 O3 GOL A 501 B 263 ASP C 58 ASP~? 25.07 O3 GOL A 501 B 292 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 49.99 26.05 6.28 51.46 26.87 8.49 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 60.53 31.67 0.97 57.79 27.51 3.63 35.92 31.10 -19.94 35.74 27.15 -23.97 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 4 3 # 4 B 177 PHE C 29 PHE~? 13.92 O3 GOL A 501 B 263 ASP C 58 ASP~? 25.07 O3 GOL A 501 B 292 LYS C 54 LYS.? 21.14 O4 PO4 A 302 coo 49.99 26.05 6.28 51.46 26.87 8.49 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 60.53 31.67 0.97 57.79 27.51 3.63 31.19 27.76 -19.03 36.53 26.17 -16.12 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 5 3 # 5 B 177 PHE D 29 PHE~? 13.75 O ACY B 401 B 263 ASP D 58 ASP~? 23.91 CH3 ACY B 403 B 292 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo 49.99 26.05 6.28 51.46 26.87 8.49 9.63 30.41 1.98 9.49 32.86 3.31 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 2.43 37.89 1.30 0.84 39.23 1.50 coo 60.53 31.67 0.97 57.79 27.51 3.63 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 6 3 # 6 B 177 PHE D 29 PHE~? 13.75 O ACY B 401 B 263 ASP D 58 ASP~? 23.91 CH3 ACY B 403 B 292 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 49.99 26.05 6.28 51.46 26.87 8.49 9.63 30.41 1.98 9.49 32.86 3.31 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 2.43 37.89 1.30 0.84 39.23 1.50 coo 60.53 31.67 0.97 57.79 27.51 3.63 3.89 29.44 -7.86 -1.70 27.89 -10.01 2oat_c04 source 2oat ORNITHINE AMINOTRANSFERASE : 6 hits 2oat_c04 naa= 3 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 C 177 PHE A 29 PHE~? 10.35 O ACY A 402 C 263 ASP A 58 ASP~? 21.11 O ACY A 402 C 292 LYS A 3 LYS.? 16.38 O ACY A 402 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 6.52 10.08 -26.44 5.88 7.60 -27.67 coo 19.84 12.02 9.33 18.68 11.23 7.75 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo 12.82 3.49 4.98 17.80 5.59 1.90 -2.74 8.66 -16.42 -3.35 11.52 -21.38 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 C 177 PHE B 29 PHE~? 13.95 OXT ACY B 401 C 263 ASP B 58 ASP~? 24.69 OXT ACY B 401 C 292 LYS B 3 LYS.? 19.35 OXT ACY B 401 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 26.40 10.51 1.39 26.72 8.16 2.92 coo 19.84 12.02 9.33 18.68 11.23 7.75 33.22 2.96 0.74 34.69 1.59 1.17 coo 12.82 3.49 4.98 17.80 5.59 1.90 35.65 7.25 -8.40 36.12 12.24 -4.67 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 C 177 PHE C 29 PHE~? 13.92 O3 GOL A 501 C 263 ASP C 58 ASP~? 25.07 O3 GOL A 501 C 292 LYS C 3 LYS.? 18.92 O1 PO4 A 302 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 25.57 28.47 -28.89 26.01 30.76 -30.46 coo 19.84 12.02 9.33 18.68 11.23 7.75 32.89 35.88 -28.31 34.37 37.32 -28.69 coo 12.82 3.49 4.98 17.80 5.59 1.90 35.92 31.10 -19.94 35.74 27.15 -23.97 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 4 3 # 4 C 177 PHE D 29 PHE~? 13.75 O ACY B 401 C 263 ASP D 58 ASP~? 23.91 CH3 ACY B 403 C 292 LYS D 3 LYS.? 18.33 CH3 ACY B 403 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 9.63 30.41 1.98 9.49 32.86 3.31 coo 19.84 12.02 9.33 18.68 11.23 7.75 2.43 37.89 1.30 0.84 39.23 1.50 coo 12.82 3.49 4.98 17.80 5.59 1.90 -0.81 32.81 -7.33 -0.70 30.79 -2.45 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 5 3 # 5 C 177 PHE D 29 PHE~? 13.75 O ACY B 401 C 263 ASP D 58 ASP~? 23.91 CH3 ACY B 403 C 292 LYS D 54 LYS.? 18.95 CH3 ACY B 403 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 9.63 30.41 1.98 9.49 32.86 3.31 coo 19.84 12.02 9.33 18.68 11.23 7.75 2.43 37.89 1.30 0.84 39.23 1.50 coo 12.82 3.49 4.98 17.80 5.59 1.90 3.89 29.44 -7.86 -1.70 27.89 -10.01 2oat_c05 source 2oat ORNITHINE AMINOTRANSFERASE : 5 hits 2oat_c05 naa= 3 ULMN 3 2phk_c02 MC-PEPTIDE user 1 3 # 1 A 149 ASP A 32 ASP.? 10.92 O ACY A 402 A 151 LYS A 54 LYS.? 19.07 O ACY A 402 A 186 THR A 59 THR~? 14.19 O ACY A 402 coo 41.42 17.90 44.98 43.39 18.36 45.61 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 45.75 16.58 39.61 47.43 18.26 45.54 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 45.88 23.02 44.72 46.99 21.16 44.68 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 3 2phk_c02 MC-PEPTIDE user 2 3 # 2 A 149 ASP A 56 ASP~? 17.92 O ACY A 402 A 151 LYS A 3 LYS.? 16.38 O ACY A 402 A 186 THR A 59 THR~? 14.19 O ACY A 402 coo 41.42 17.90 44.98 43.39 18.36 45.61 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 45.75 16.58 39.61 47.43 18.26 45.54 -2.74 8.66 -16.42 -3.35 11.52 -21.38 coo 45.88 23.02 44.72 46.99 21.16 44.68 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 3 2phk_c02 MC-PEPTIDE user 3 3 # 3 A 149 ASP A 56 ASP~? 17.92 O ACY A 402 A 151 LYS A 54 LYS.? 19.07 O ACY A 402 A 186 THR A 59 THR~? 14.19 O ACY A 402 coo 41.42 17.90 44.98 43.39 18.36 45.61 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 45.75 16.58 39.61 47.43 18.26 45.54 2.42 11.92 -16.67 -2.67 14.14 -13.69 coo 45.88 23.02 44.72 46.99 21.16 44.68 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 3 2phk_c02 MC-PEPTIDE user 4 3 # 4 A 149 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 151 LYS B 3 LYS.? 19.35 OXT ACY B 401 A 186 THR B 59 THR~? 17.71 OXT ACY B 401 coo 41.42 17.90 44.98 43.39 18.36 45.61 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 45.75 16.58 39.61 47.43 18.26 45.54 35.65 7.25 -8.40 36.12 12.24 -4.67 coo 45.88 23.02 44.72 46.99 21.16 44.68 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 3 2phk_c02 MC-PEPTIDE user 5 3 # 5 A 149 ASP B 32 ASP.? 15.94 OXT ACY B 401 A 151 LYS B 54 LYS.? 19.51 O4 PO4 A 302 A 186 THR B 59 THR~? 17.71 OXT ACY B 401 coo 41.42 17.90 44.98 43.39 18.36 45.61 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 45.75 16.58 39.61 47.43 18.26 45.54 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 45.88 23.02 44.72 46.99 21.16 44.68 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 3 2phk_c02 MC-PEPTIDE user 6 3 # 6 A 149 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 151 LYS B 54 LYS.? 19.51 O4 PO4 A 302 A 186 THR B 59 THR~? 17.71 OXT ACY B 401 coo 41.42 17.90 44.98 43.39 18.36 45.61 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 45.75 16.58 39.61 47.43 18.26 45.54 31.00 10.85 -8.70 36.11 12.09 -12.03 coo 45.88 23.02 44.72 46.99 21.16 44.68 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 3 2phk_c02 MC-PEPTIDE user 7 3 # 7 A 149 ASP C 32 ASP.? 15.02 O1 PO4 A 302 A 151 LYS C 54 LYS.? 21.14 O4 PO4 A 302 A 186 THR C 59 THR~? 18.08 O3 GOL A 501 coo 41.42 17.90 44.98 43.39 18.36 45.61 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 45.75 16.58 39.61 47.43 18.26 45.54 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 45.88 23.02 44.72 46.99 21.16 44.68 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 3 2phk_c02 MC-PEPTIDE user 8 3 # 8 A 149 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 151 LYS C 54 LYS.? 21.14 O4 PO4 A 302 A 186 THR C 59 THR~? 18.08 O3 GOL A 501 coo 41.42 17.90 44.98 43.39 18.36 45.61 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 45.75 16.58 39.61 47.43 18.26 45.54 31.19 27.76 -19.03 36.53 26.17 -16.12 coo 45.88 23.02 44.72 46.99 21.16 44.68 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 3 2phk_c02 MC-PEPTIDE user 9 3 # 9 A 149 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 151 LYS D 3 LYS.? 18.33 CH3 ACY B 403 A 186 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 41.42 17.90 44.98 43.39 18.36 45.61 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 45.75 16.58 39.61 47.43 18.26 45.54 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 45.88 23.02 44.72 46.99 21.16 44.68 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 3 2phk_c02 MC-PEPTIDE user 10 3 # 10 A 149 ASP D 32 ASP.? 14.33 CH3 ACY B 403 A 151 LYS D 54 LYS.? 18.95 CH3 ACY B 403 A 186 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 41.42 17.90 44.98 43.39 18.36 45.61 4.73 28.33 -3.00 2.76 28.70 -2.23 coo 45.75 16.58 39.61 47.43 18.26 45.54 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 45.88 23.02 44.72 46.99 21.16 44.68 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 3 2phk_c02 MC-PEPTIDE user 11 3 # 11 A 149 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 151 LYS D 3 LYS.? 18.33 CH3 ACY B 403 A 186 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 41.42 17.90 44.98 43.39 18.36 45.61 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 45.75 16.58 39.61 47.43 18.26 45.54 -0.81 32.81 -7.33 -0.70 30.79 -2.45 coo 45.88 23.02 44.72 46.99 21.16 44.68 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 3 2phk_c02 MC-PEPTIDE user 12 3 # 12 A 149 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 151 LYS D 54 LYS.? 18.95 CH3 ACY B 403 A 186 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 41.42 17.90 44.98 43.39 18.36 45.61 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 45.75 16.58 39.61 47.43 18.26 45.54 3.89 29.44 -7.86 -1.70 27.89 -10.01 coo 45.88 23.02 44.72 46.99 21.16 44.68 5.37 35.06 -0.11 4.54 33.06 0.04 2phk_c02 source 2phk MC-PEPTIDE : 12 hits 2phk_c02 naa= 3 ULMN 3 2tps_c00 THIAMIN PHOSPHATE SYNTHASE user 1 3 # 1 A 59 ARG A 74 ARG^? 14.15 O4 PO4 A 302 A 130 SER A 71 SER.? 14.37 O3 PO4 A 302 A 159 LYS B 81 LYS.? 16.99 O4 PO4 A 302 coo 18.35 45.84 20.99 16.20 47.83 21.89 23.62 1.58 -20.34 24.34 2.38 -17.47 coo 15.14 43.67 10.77 15.61 44.43 13.04 22.27 1.75 -30.01 24.19 0.64 -30.91 coo 11.57 48.49 22.18 13.51 49.99 17.21 29.08 3.04 -17.20 34.50 4.57 -18.92 ULMN 3 2tps_c00 THIAMIN PHOSPHATE SYNTHASE user 2 3 # 2 A 59 ARG B 74 ARG^? 16.09 O ACY B 403 A 130 SER B 71 SER.? 18.15 O ACY B 403 A 159 LYS A 81 LYS.? 21.98 O ACY B 403 coo 18.35 45.84 20.99 16.20 47.83 21.89 8.52 3.16 -3.88 8.54 3.61 -6.93 coo 15.14 43.67 10.77 15.61 44.43 13.04 10.28 3.95 5.29 8.36 4.42 6.81 coo 11.57 48.49 22.18 13.51 49.99 17.21 3.08 5.09 -7.58 2.00 0.68 -7.21 2tps_c00 source 2tps THIAMIN PHOSPHATE SYNTHASE : 2 hits 2tps_c00 naa= 3 ULMN 3 2tps_c01 THIAMIN PHOSPHATE SYNTHASE user 1 3 # 1 B 59 ARG A 74 ARG^? 14.15 O4 PO4 A 302 B 130 SER A 71 SER.? 14.37 O3 PO4 A 302 B 159 LYS A 76 LYS^? 19.05 O4 PO4 A 302 coo 58.72 31.58 20.45 60.80 29.39 20.94 23.62 1.58 -20.34 24.34 2.38 -17.47 coo 61.66 35.17 10.39 61.29 34.14 12.56 22.27 1.75 -30.01 24.19 0.64 -30.91 coo 65.38 28.77 21.17 63.49 28.03 16.12 15.29 2.83 -16.82 18.24 -1.47 -14.60 ULMN 3 2tps_c01 THIAMIN PHOSPHATE SYNTHASE user 2 3 # 2 B 59 ARG A 74 ARG^? 14.15 O4 PO4 A 302 B 130 SER A 71 SER.? 14.37 O3 PO4 A 302 B 159 LYS B 81 LYS.? 16.99 O4 PO4 A 302 coo 58.72 31.58 20.45 60.80 29.39 20.94 23.62 1.58 -20.34 24.34 2.38 -17.47 coo 61.66 35.17 10.39 61.29 34.14 12.56 22.27 1.75 -30.01 24.19 0.64 -30.91 coo 65.38 28.77 21.17 63.49 28.03 16.12 29.08 3.04 -17.20 34.50 4.57 -18.92 ULMN 3 2tps_c01 THIAMIN PHOSPHATE SYNTHASE user 3 3 # 3 B 59 ARG B 74 ARG^? 16.09 O ACY B 403 B 130 SER B 71 SER.? 18.15 O ACY B 403 B 159 LYS A 81 LYS.? 21.98 O ACY B 403 coo 58.72 31.58 20.45 60.80 29.39 20.94 8.52 3.16 -3.88 8.54 3.61 -6.93 coo 61.66 35.17 10.39 61.29 34.14 12.56 10.28 3.95 5.29 8.36 4.42 6.81 coo 65.38 28.77 21.17 63.49 28.03 16.12 3.08 5.09 -7.58 2.00 0.68 -7.21 ULMN 3 2tps_c01 THIAMIN PHOSPHATE SYNTHASE user 4 3 # 4 B 59 ARG D 74 ARG^? 19.24 OXT ACY B 401 B 130 SER D 71 SER.? 19.92 CH3 ACY B 401 B 159 LYS D 76 LYS^? 21.99 O ACY C 404 coo 58.72 31.58 20.45 60.80 29.39 20.94 25.93 38.34 -6.34 26.99 36.29 -8.39 coo 61.66 35.17 10.39 61.29 34.14 12.56 25.95 36.51 3.79 28.23 36.90 4.60 coo 65.38 28.77 21.17 63.49 28.03 16.12 17.64 37.25 -8.68 17.76 41.25 -12.78 2tps_c01 source 2tps THIAMIN PHOSPHATE SYNTHASE : 4 hits 2tps_c01 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 23 ASN~? 3.23 O3 PO4 A 302s coo 5.80 63.03 55.85 5.52 65.03 56.45 16.56 14.98 -29.71 17.96 15.58 -28.25 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 28 ASN~? 9.25 OXT ACY A 402 coo 5.80 63.03 55.85 5.52 65.03 56.45 7.12 11.54 -30.87 7.65 11.60 -32.93 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 3 1 # 3 A 461 ASN A 45 ASN.? 12.55 O4 PO4 A 302 coo 5.80 63.03 55.85 5.52 65.03 56.45 32.44 10.60 -24.76 34.17 11.84 -25.00 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 4 1 # 4 A 461 ASN A 57 ASN~? 22.26 O ACY A 402 coo 5.80 63.03 55.85 5.52 65.03 56.45 -0.12 1.54 -18.79 1.16 0.01 -18.06 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 5 1 # 5 A 461 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo 5.80 63.03 55.85 5.52 65.03 56.45 16.95 16.62 4.13 15.59 17.22 2.56 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 6 1 # 6 A 461 ASN B 28 ASN~? 12.29 CH3 ACY B 401 coo 5.80 63.03 55.85 5.52 65.03 56.45 25.98 12.60 5.56 25.16 13.05 7.49 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 7 1 # 7 A 461 ASN B 45 ASN.? 15.97 CH3 ACY B 403 coo 5.80 63.03 55.85 5.52 65.03 56.45 0.86 13.33 -0.64 -0.92 14.50 -0.39 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 8 1 # 8 A 461 ASN B 57 ASN~? 25.28 OXT ACY B 401 coo 5.80 63.03 55.85 5.52 65.03 56.45 33.18 0.69 -4.23 33.49 0.22 -6.29 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 9 1 # 9 A 461 ASN C 23 ASN~? 3.34 CH3 ACY C 404s coo 5.80 63.03 55.85 5.52 65.03 56.45 15.33 22.92 -30.05 14.25 22.35 -28.34 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 10 1 # 10 A 461 ASN C 28 ASN~? 11.75 O3 GOL A 501 coo 5.80 63.03 55.85 5.52 65.03 56.45 24.24 26.01 -32.95 22.97 25.58 -34.62 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 11 1 # 11 A 461 ASN C 45 ASN.? 12.65 O ACY C 404 coo 5.80 63.03 55.85 5.52 65.03 56.45 0.39 28.73 -23.35 -1.25 27.48 -23.64 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 12 1 # 12 A 461 ASN C 57 ASN~? 25.85 CH3 ACY C 404 coo 5.80 63.03 55.85 5.52 65.03 56.45 32.80 38.18 -23.48 33.37 38.78 -21.52 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 13 1 # 13 A 461 ASN D 23 ASN~? 4.18 CH3 ACY B 401 coo 5.80 63.03 55.85 5.52 65.03 56.45 19.37 24.14 3.44 20.48 23.43 1.80 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 14 1 # 14 A 461 ASN D 28 ASN~? 12.25 CH3 ACY B 401 coo 5.80 63.03 55.85 5.52 65.03 56.45 10.83 28.19 6.10 11.90 27.91 7.93 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 15 1 # 15 A 461 ASN D 45 ASN.? 18.79 OXT ACY B 401 coo 5.80 63.03 55.85 5.52 65.03 56.45 34.52 27.70 -3.27 36.36 26.60 -3.23 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 16 1 # 16 A 461 ASN D 57 ASN~? 23.97 CH3 ACY B 403 coo 5.80 63.03 55.85 5.52 65.03 56.45 2.35 39.89 -3.73 2.59 40.70 -5.67 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 16 hits 1kbk_p00 naa= 1 ULMN 3 1uy2_p00 ENDO-1,4-BETA-XYLANASE A user 1 3 # 1 A 51 TYR A 19 TYR~? -3.51 O4 PO4 A 302s A 108 ASN C 23 ASN~? 3.34 CH3 ACY C 404s A 135 ASN A 23 ASN~? 3.23 O3 PO4 A 302s coo 17.59 4.66 17.88 15.38 5.96 18.97 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 12.36 16.24 15.27 12.06 14.29 16.05 15.33 22.92 -30.05 14.25 22.35 -28.34 coo 18.05 11.56 12.71 17.57 10.75 14.60 16.56 14.98 -29.71 17.96 15.58 -28.25 ULMN 3 1uy2_p00 ENDO-1,4-BETA-XYLANASE A user 2 3 # 2 A 51 TYR B 19 TYR~? 7.66 CH3 ACY B 403 A 108 ASN D 23 ASN~? 4.18 CH3 ACY B 401 A 135 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo 17.59 4.66 17.88 15.38 5.96 18.97 10.24 15.60 3.03 8.77 16.10 0.69 coo 12.36 16.24 15.27 12.06 14.29 16.05 19.37 24.14 3.44 20.48 23.43 1.80 coo 18.05 11.56 12.71 17.57 10.75 14.60 16.95 16.62 4.13 15.59 17.22 2.56 ULMN 3 1uy2_p00 ENDO-1,4-BETA-XYLANASE A user 3 3 # 3 A 51 TYR C 19 TYR~? -3.65 O ACY C 404s A 108 ASN A 23 ASN~? 3.23 O3 PO4 A 302s A 135 ASN C 23 ASN~? 3.34 CH3 ACY C 404s coo 17.59 4.66 17.88 15.38 5.96 18.97 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 12.36 16.24 15.27 12.06 14.29 16.05 16.56 14.98 -29.71 17.96 15.58 -28.25 coo 18.05 11.56 12.71 17.57 10.75 14.60 15.33 22.92 -30.05 14.25 22.35 -28.34 1uy2_p00 source 1uy2 ENDO-1,4-BETA-XYLANASE A : 3 hits 1uy2_p00 naa= 3 ULMN 3 1uy4_p00 ENDO-1,4-BETA-XYLANASE A user 1 3 # 1 A 51 TYR A 19 TYR~? -3.51 O4 PO4 A 302s A 108 ASN C 23 ASN~? 3.34 CH3 ACY C 404s A 135 ASN A 23 ASN~? 3.23 O3 PO4 A 302s coo 17.50 4.57 17.85 15.28 5.88 18.97 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 12.22 15.98 15.24 11.94 14.05 16.09 15.33 22.92 -30.05 14.25 22.35 -28.34 coo 17.94 11.43 12.65 17.42 10.61 14.53 16.56 14.98 -29.71 17.96 15.58 -28.25 ULMN 3 1uy4_p00 ENDO-1,4-BETA-XYLANASE A user 2 3 # 2 A 51 TYR B 19 TYR~? 7.66 CH3 ACY B 403 A 108 ASN D 23 ASN~? 4.18 CH3 ACY B 401 A 135 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo 17.50 4.57 17.85 15.28 5.88 18.97 10.24 15.60 3.03 8.77 16.10 0.69 coo 12.22 15.98 15.24 11.94 14.05 16.09 19.37 24.14 3.44 20.48 23.43 1.80 coo 17.94 11.43 12.65 17.42 10.61 14.53 16.95 16.62 4.13 15.59 17.22 2.56 ULMN 3 1uy4_p00 ENDO-1,4-BETA-XYLANASE A user 3 3 # 3 A 51 TYR C 19 TYR~? -3.65 O ACY C 404s A 108 ASN A 23 ASN~? 3.23 O3 PO4 A 302s A 135 ASN C 23 ASN~? 3.34 CH3 ACY C 404s coo 17.50 4.57 17.85 15.28 5.88 18.97 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 12.22 15.98 15.24 11.94 14.05 16.09 16.56 14.98 -29.71 17.96 15.58 -28.25 coo 17.94 11.43 12.65 17.42 10.61 14.53 15.33 22.92 -30.05 14.25 22.35 -28.34 1uy4_p00 source 1uy4 ENDO-1,4-BETA-XYLANASE A : 3 hits 1uy4_p00 naa= 3 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 1 3 # 1 A 270 ASN A 28 ASN~? 9.25 OXT ACY A 402 A 384 ASN A 45 ASN.? 12.55 O4 PO4 A 302 A 385 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo 22.28 63.17 110.61 22.47 65.06 111.53 7.12 11.54 -30.87 7.65 11.60 -32.93 coo 7.06 50.07 96.17 8.50 48.54 96.31 32.44 10.60 -24.76 34.17 11.84 -25.00 coo 11.59 49.83 99.41 10.92 47.97 100.16 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 2 3 # 2 A 270 ASN A 45 ASN.? 12.55 O4 PO4 A 302 A 384 ASN B 57 ASN~? 25.28 OXT ACY B 401 A 385 GLU B 2 GLU.? 29.03 OXT ACY B 401 coo 22.28 63.17 110.61 22.47 65.06 111.53 32.44 10.60 -24.76 34.17 11.84 -25.00 coo 7.06 50.07 96.17 8.50 48.54 96.31 33.18 0.69 -4.23 33.49 0.22 -6.29 coo 11.59 49.83 99.41 10.92 47.97 100.16 39.73 3.44 -6.86 41.69 3.03 -6.17 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 3 3 # 3 A 270 ASN B 28 ASN~? 12.29 CH3 ACY B 401 A 384 ASN B 45 ASN.? 15.97 CH3 ACY B 403 A 385 GLU B 13 GLU^? 15.77 O ACY B 403 coo 22.28 63.17 110.61 22.47 65.06 111.53 25.98 12.60 5.56 25.16 13.05 7.49 coo 7.06 50.07 96.17 8.50 48.54 96.31 0.86 13.33 -0.64 -0.92 14.50 -0.39 coo 11.59 49.83 99.41 10.92 47.97 100.16 4.71 8.41 0.32 2.63 9.02 0.18 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 4 3 # 4 A 270 ASN B 57 ASN~? 25.28 OXT ACY B 401 A 384 ASN A 45 ASN.? 12.55 O4 PO4 A 302 A 385 GLU A 13 GLU^? 12.48 O4 PO4 A 302 coo 22.28 63.17 110.61 22.47 65.06 111.53 33.18 0.69 -4.23 33.49 0.22 -6.29 coo 7.06 50.07 96.17 8.50 48.54 96.31 32.44 10.60 -24.76 34.17 11.84 -25.00 coo 11.59 49.83 99.41 10.92 47.97 100.16 27.35 5.02 -24.86 28.03 3.18 -25.64 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 5 3 # 5 A 270 ASN C 28 ASN~? 11.75 O3 GOL A 501 A 384 ASN C 45 ASN.? 12.65 O ACY C 404 A 385 GLU C 13 GLU^? 12.93 O ACY C 404 coo 22.28 63.17 110.61 22.47 65.06 111.53 24.24 26.01 -32.95 22.97 25.58 -34.62 coo 7.06 50.07 96.17 8.50 48.54 96.31 0.39 28.73 -23.35 -1.25 27.48 -23.64 coo 11.59 49.83 99.41 10.92 47.97 100.16 5.05 33.44 -24.76 4.47 35.34 -25.49 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 6 3 # 6 A 270 ASN C 45 ASN.? 12.65 O ACY C 404 A 384 ASN C 28 ASN~? 11.75 O3 GOL A 501 A 385 GLU C 24 GLU~? 11.35 C3 GOL A 501 coo 22.28 63.17 110.61 22.47 65.06 111.53 0.39 28.73 -23.35 -1.25 27.48 -23.64 coo 7.06 50.07 96.17 8.50 48.54 96.31 24.24 26.01 -32.95 22.97 25.58 -34.62 coo 11.59 49.83 99.41 10.92 47.97 100.16 18.84 25.84 -35.18 19.75 24.32 -36.38 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 7 3 # 7 A 270 ASN C 57 ASN~? 25.85 CH3 ACY C 404 A 384 ASN C 23 ASN~? 3.34 CH3 ACY C 404s A 385 GLU C 24 GLU~? 11.35 C3 GOL A 501 coo 22.28 63.17 110.61 22.47 65.06 111.53 32.80 38.18 -23.48 33.37 38.78 -21.52 coo 7.06 50.07 96.17 8.50 48.54 96.31 15.33 22.92 -30.05 14.25 22.35 -28.34 coo 11.59 49.83 99.41 10.92 47.97 100.16 18.84 25.84 -35.18 19.75 24.32 -36.38 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 8 3 # 8 A 270 ASN D 28 ASN~? 12.25 CH3 ACY B 401 A 384 ASN D 45 ASN.? 18.79 OXT ACY B 401 A 385 GLU D 13 GLU^? 19.04 OXT ACY B 401 coo 22.28 63.17 110.61 22.47 65.06 111.53 10.83 28.19 6.10 11.90 27.91 7.93 coo 7.06 50.07 96.17 8.50 48.54 96.31 34.52 27.70 -3.27 36.36 26.60 -3.23 coo 11.59 49.83 99.41 10.92 47.97 100.16 29.88 33.09 -1.63 31.17 34.65 -1.02 2v3r_p00 source 2v3r EXOGLUCANASE 1 : 8 hits 2v3r_p00 naa= 3 ULMN 3 1bdv_d00 GENE REGULATION/DNA user 1 3 # 1 A 9 GLN A 21 GLN~? 11.13 O3 PO4 A 302 A 11 ASN A 23 ASN~? 3.23 O3 PO4 A 302s A 13 ARG A 36 ARG^? 3.17 O2 GOL A 501s coo 33.45 2.10 7.21 34.51 1.09 5.67 18.22 8.15 -34.01 18.46 6.14 -34.67 coo 38.37 -1.60 11.46 39.03 -3.43 10.75 16.56 14.98 -29.71 17.96 15.58 -28.25 coo 41.73 -6.32 12.94 43.25 -5.49 10.40 14.40 16.71 -22.33 15.78 16.00 -25.01 ULMN 3 1bdv_d00 GENE REGULATION/DNA user 2 3 # 2 A 9 GLN C 21 GLN~? 11.26 CH3 ACY C 404 A 11 ASN C 23 ASN~? 3.34 CH3 ACY C 404s A 13 ARG C 36 ARG^? -3.18 C2 GOL A 501s coo 33.45 2.10 7.21 34.51 1.09 5.67 13.04 29.36 -34.75 12.61 31.30 -35.54 coo 38.37 -1.60 11.46 39.03 -3.43 10.75 15.33 22.92 -30.05 14.25 22.35 -28.34 coo 41.73 -6.32 12.94 43.25 -5.49 10.40 18.67 22.17 -22.86 17.03 22.41 -25.46 ULMN 3 1bdv_d00 GENE REGULATION/DNA user 3 3 # 3 A 9 GLN D 21 GLN~? 15.00 CH3 ACY B 401 A 11 ASN D 23 ASN~? 4.18 CH3 ACY B 401 A 13 ARG D 36 ARG^? 3.12 O ACY B 401s coo 33.45 2.10 7.21 34.51 1.09 5.67 22.07 30.79 7.65 23.40 32.41 7.56 coo 38.37 -1.60 11.46 39.03 -3.43 10.75 19.37 24.14 3.44 20.48 23.43 1.80 coo 41.73 -6.32 12.94 43.25 -5.49 10.40 15.90 23.27 -3.56 17.50 23.47 -0.92 1bdv_d00 source 1bdv GENE REGULATION/DNA : 3 hits 1bdv_d00 naa= 3 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 1 3 # 1 I 303 TYR A 19 TYR~? -3.51 O4 PO4 A 302s I 306 VAL A 22 VAL~? 4.55 O3 PO4 A 302 I 308 VAL A 73 VAL^? 8.74 O3 PO4 A 302 coo 26.18 35.24 6.87 24.33 35.18 8.97 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 23.55 29.53 9.81 23.15 27.39 10.24 16.60 10.22 -28.59 17.67 9.89 -26.69 coo 16.43 30.18 9.35 15.05 30.67 11.01 21.05 4.24 -25.11 19.42 5.57 -25.83 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 2 3 # 2 I 303 TYR A 39 TYR^? 11.39 O4 PO4 A 302 I 306 VAL A 37 VAL^? 8.84 O2 GOL A 501 I 308 VAL B 37 VAL^? 5.98 OXT ACY B 403 coo 26.18 35.24 6.87 24.33 35.18 8.97 24.81 16.29 -15.55 27.22 16.47 -14.15 coo 23.55 29.53 9.81 23.15 27.39 10.24 17.04 17.64 -17.11 17.34 17.90 -14.97 coo 16.43 30.18 9.35 15.05 30.67 11.01 17.01 18.06 -8.75 16.74 18.09 -10.92 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 3 3 # 3 I 303 TYR B 19 TYR~? 7.66 CH3 ACY B 403 I 306 VAL B 22 VAL~? 8.48 O ACY B 403 I 308 VAL B 73 VAL^? 12.21 O ACY B 403 coo 26.18 35.24 6.87 24.33 35.18 8.97 10.24 15.60 3.03 8.77 16.10 0.69 coo 23.55 29.53 9.81 23.15 27.39 10.24 16.61 11.81 3.31 15.59 11.32 1.37 coo 16.43 30.18 9.35 15.05 30.67 11.01 11.55 6.02 0.34 13.36 7.14 0.85 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 4 3 # 4 I 303 TYR B 39 TYR^? 10.21 CH3 ACY B 403 I 306 VAL B 37 VAL^? 5.98 OXT ACY B 403 I 308 VAL A 37 VAL^? 8.84 O2 GOL A 501 coo 26.18 35.24 6.87 24.33 35.18 8.97 9.18 17.36 -10.32 6.76 17.67 -11.73 coo 23.55 29.53 9.81 23.15 27.39 10.24 17.01 18.06 -8.75 16.74 18.09 -10.92 coo 16.43 30.18 9.35 15.05 30.67 11.01 17.04 17.64 -17.11 17.34 17.90 -14.97 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 5 3 # 5 I 303 TYR C 19 TYR~? -3.65 O ACY C 404s I 306 VAL C 22 VAL~? 4.72 CH3 ACY C 404 I 308 VAL C 73 VAL^? 9.08 CH3 ACY C 404 coo 26.18 35.24 6.87 24.33 35.18 8.97 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 23.55 29.53 9.81 23.15 27.39 10.24 15.39 27.76 -29.43 14.55 28.26 -27.42 coo 16.43 30.18 9.35 15.05 30.67 11.01 11.45 34.30 -26.12 13.01 32.88 -26.82 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 6 3 # 6 I 303 TYR C 39 TYR^? 11.15 O ACY C 404 I 306 VAL C 37 VAL^? 9.01 O2 GOL A 501 I 308 VAL D 37 VAL^? 6.82 OXT ACY B 403 coo 26.18 35.24 6.87 24.33 35.18 8.97 9.18 23.50 -14.87 7.01 23.51 -13.16 coo 23.55 29.53 9.81 23.15 27.39 10.24 16.59 22.00 -17.28 16.57 21.91 -15.07 coo 16.43 30.18 9.35 15.05 30.67 11.01 17.84 22.40 -9.10 17.86 22.18 -11.26 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 7 3 # 7 I 303 TYR D 19 TYR~? 6.50 OXT ACY B 401 I 306 VAL D 22 VAL~? 9.17 CH3 ACY B 401 I 308 VAL D 73 VAL^? 14.68 OXT ACY B 401 coo 26.18 35.24 6.87 24.33 35.18 8.97 24.45 24.76 1.05 22.95 23.32 -0.81 coo 23.55 29.53 9.81 23.15 27.39 10.24 19.65 28.95 2.48 20.43 29.41 0.45 coo 16.43 30.18 9.35 15.05 30.67 11.01 24.19 34.78 -1.27 22.55 33.50 -0.51 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 8 3 # 8 I 303 TYR D 39 TYR^? 13.45 OXT ACY B 401 I 306 VAL D 37 VAL^? 6.82 OXT ACY B 403 I 308 VAL C 37 VAL^? 9.01 O2 GOL A 501 coo 26.18 35.24 6.87 24.33 35.18 8.97 25.37 22.88 -11.59 27.59 22.45 -13.28 coo 23.55 29.53 9.81 23.15 27.39 10.24 17.84 22.40 -9.10 17.86 22.18 -11.26 coo 16.43 30.18 9.35 15.05 30.67 11.01 16.59 22.00 -17.28 16.57 21.91 -15.07 1cqt_d00 source 1cqt GENE REGULATION/DNA : 8 hits 1cqt_d00 naa= 3 ULMN 3 1hwt_d00 GENE REGULATION/DNA user 1 3 # 1 C 70 ARG D 74 ARG^? 19.24 OXT ACY B 401 C 71 LYS D 76 LYS^? 21.99 O ACY C 404 C 72 VAL D 75 VAL^? 16.15 O ACY B 401 coo 23.89 33.54 29.21 26.59 34.86 28.68 25.93 38.34 -6.34 26.99 36.29 -8.39 coo 25.82 26.89 29.68 23.33 22.98 25.84 17.64 37.25 -8.68 17.76 41.25 -12.78 coo 28.86 29.08 30.37 28.04 31.02 29.93 19.55 36.19 -5.61 17.76 36.01 -4.35 1hwt_d00 source 1hwt GENE REGULATION/DNA : 1 hits 1hwt_d00 naa= 3 ULMN 3 1r4i_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 563 LYS A 76 LYS^? 19.05 O4 PO4 A 302 A 564 VAL A 75 VAL^? 12.20 O3 PO4 A 302 A 568 ARG A 74 ARG^? 14.15 O4 PO4 A 302 coo -6.60 80.79 55.64 -8.55 79.48 61.01 15.29 2.83 -16.82 18.24 -1.47 -14.60 coo -9.25 78.14 55.31 -11.11 77.94 56.39 16.85 3.56 -20.20 14.87 3.56 -21.29 coo -12.31 74.86 52.32 -13.99 74.91 54.92 23.62 1.58 -20.34 24.34 2.38 -17.47 ULMN 3 1r4i_d00 TRANSCRIPTION/DNA user 2 3 # 2 A 563 LYS B 76 LYS^? 19.88 O ACY B 403 A 564 VAL B 75 VAL^? 13.43 O ACY B 403 A 568 ARG B 74 ARG^? 16.09 O ACY B 403 coo -6.60 80.79 55.64 -8.55 79.48 61.01 17.16 3.18 -7.74 14.10 -1.32 -8.74 coo -9.25 78.14 55.31 -11.11 77.94 56.39 15.56 4.47 -4.49 17.48 4.39 -3.41 coo -12.31 74.86 52.32 -13.99 74.91 54.92 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 1r4i_d00 TRANSCRIPTION/DNA user 3 3 # 3 A 563 LYS C 76 LYS^? 21.01 CH3 ACY C 404 A 564 VAL C 75 VAL^? 12.78 CH3 ACY C 404 A 568 ARG C 74 ARG^? 14.08 O ACY C 404 coo -6.60 80.79 55.64 -8.55 79.48 61.01 18.27 36.67 -18.82 19.78 40.82 -15.57 coo -9.25 78.14 55.31 -11.11 77.94 56.39 16.36 35.61 -21.93 18.18 35.66 -23.23 coo -12.31 74.86 52.32 -13.99 74.91 54.92 9.75 38.11 -21.77 8.89 36.86 -19.09 ULMN 3 1r4i_d00 TRANSCRIPTION/DNA user 4 3 # 4 A 563 LYS D 76 LYS^? 21.99 O ACY C 404 A 564 VAL D 75 VAL^? 16.15 O ACY B 401 A 568 ARG D 74 ARG^? 19.24 OXT ACY B 401 coo -6.60 80.79 55.64 -8.55 79.48 61.01 17.64 37.25 -8.68 17.76 41.25 -12.78 coo -9.25 78.14 55.31 -11.11 77.94 56.39 19.55 36.19 -5.61 17.76 36.01 -4.35 coo -12.31 74.86 52.32 -13.99 74.91 54.92 25.93 38.34 -6.34 26.99 36.29 -8.39 1r4i_d00 source 1r4i TRANSCRIPTION/DNA : 4 hits 1r4i_d00 naa= 3 ULMN 3 2bsq_d00 TRANSCRIPTION user 1 3 # 1 E 3 SER A 64 SER~? 15.31 O3 PO4 A 302 E 5 VAL A 75 VAL^? 12.20 O3 PO4 A 302 E 7 ARG A 74 ARG^? 14.15 O4 PO4 A 302 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 10.65 3.01 -23.11 9.92 3.29 -20.88 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 16.85 3.56 -20.20 14.87 3.56 -21.29 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 23.62 1.58 -20.34 24.34 2.38 -17.47 ULMN 3 2bsq_d00 TRANSCRIPTION user 2 3 # 2 E 3 SER B 64 SER~? 17.70 O ACY B 403 E 5 VAL B 75 VAL^? 13.43 O ACY B 403 E 7 ARG B 74 ARG^? 16.09 O ACY B 403 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 22.02 3.65 -1.58 23.48 2.13 -2.69 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 15.56 4.47 -4.49 17.48 4.39 -3.41 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 2bsq_d00 TRANSCRIPTION user 3 3 # 3 E 3 SER C 64 SER~? 15.58 CH3 ACY C 404 E 5 VAL C 75 VAL^? 12.78 CH3 ACY C 404 E 7 ARG C 74 ARG^? 14.08 O ACY C 404 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 21.88 35.45 -25.50 23.03 35.45 -23.37 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 16.36 35.61 -21.93 18.18 35.66 -23.23 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 9.75 38.11 -21.77 8.89 36.86 -19.09 ULMN 3 2bsq_d00 TRANSCRIPTION user 4 3 # 4 E 3 SER D 64 SER~? 17.41 O ACY B 401 E 5 VAL D 75 VAL^? 16.15 O ACY B 401 E 7 ARG D 74 ARG^? 19.24 OXT ACY B 401 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 13.59 37.31 -1.52 12.51 37.27 -3.67 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 19.55 36.19 -5.61 17.76 36.01 -4.35 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 25.93 38.34 -6.34 26.99 36.29 -8.39 ULMN 3 2bsq_d00 TRANSCRIPTION user 5 3 # 5 E 3 SER D 71 SER.? 19.92 CH3 ACY B 401 E 5 VAL D 73 VAL^? 14.68 OXT ACY B 401 E 7 ARG D 74 ARG^? 19.24 OXT ACY B 401 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 25.95 36.51 3.79 28.23 36.90 4.60 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 24.19 34.78 -1.27 22.55 33.50 -0.51 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 25.93 38.34 -6.34 26.99 36.29 -8.39 2bsq_d00 source 2bsq TRANSCRIPTION : 5 hits 2bsq_d00 naa= 3 ULMN 4 2c7a_d00 RECEPTOR/DNA user 1 4 # 1 B 588 LYS D 76 LYS^? 21.99 O ACY C 404 B 589 VAL D 75 VAL^? 16.15 O ACY B 401 B 593 ARG D 74 ARG^? 19.24 OXT ACY B 401 B 637 ARG D 36 ARG^? 3.12 O ACY B 401s coo 15.04 42.21 35.01 15.60 47.38 33.10 17.64 37.25 -8.68 17.76 41.25 -12.78 coo 16.13 44.67 37.72 14.94 46.37 38.42 19.55 36.19 -5.61 17.76 36.01 -4.35 coo 17.98 46.28 41.95 15.61 48.20 41.79 25.93 38.34 -6.34 26.99 36.29 -8.39 coo 20.10 48.80 24.99 18.70 47.38 22.62 15.90 23.27 -3.56 17.50 23.47 -0.92 2c7a_d00 source 2c7a RECEPTOR/DNA : 1 hits 2c7a_d00 naa= 4 ULMN 3 2er8_d00 TRANSCRIPTION ACTIVATOR/DNA user 1 3 # 1 C 43 GLN A 21 GLN~? 11.13 O3 PO4 A 302 C 44 LYS A 17 LYS~? 14.12 O3 PO4 A 302 C 75 ARG A 20 ARG~? 11.30 O1 PO4 A 302 coo 34.33 34.01 1.06 32.24 34.35 1.22 18.22 8.15 -34.01 18.46 6.14 -34.67 coo 36.27 30.15 5.40 32.93 24.83 5.96 22.94 9.69 -34.22 22.50 4.31 -36.79 coo 30.88 29.31 6.12 29.39 29.02 3.47 19.43 13.50 -36.40 19.41 10.58 -37.42 ULMN 3 2er8_d00 TRANSCRIPTION ACTIVATOR/DNA user 2 3 # 2 C 43 GLN B 21 GLN~? 15.57 CH3 ACY B 401 C 44 LYS B 17 LYS~? 19.82 CH3 ACY B 401 C 75 ARG B 15 ARG~? 16.56 O ACY B 403 coo 34.33 34.01 1.06 32.24 34.35 1.22 14.89 9.97 8.83 14.34 7.98 9.39 coo 36.27 30.15 5.40 32.93 24.83 5.96 10.28 12.10 9.11 8.33 8.93 13.61 coo 30.88 29.31 6.12 29.39 29.02 3.47 6.05 9.06 5.74 4.48 7.37 3.69 ULMN 3 2er8_d00 TRANSCRIPTION ACTIVATOR/DNA user 3 3 # 3 C 43 GLN B 21 GLN~? 15.57 CH3 ACY B 401 C 44 LYS B 17 LYS~? 19.82 CH3 ACY B 401 C 75 ARG B 20 ARG~? 14.42 CH3 ACY B 401 coo 34.33 34.01 1.06 32.24 34.35 1.22 14.89 9.97 8.83 14.34 7.98 9.39 coo 36.27 30.15 5.40 32.93 24.83 5.96 10.28 12.10 9.11 8.33 8.93 13.61 coo 30.88 29.31 6.12 29.39 29.02 3.47 14.16 15.78 11.00 13.60 12.97 12.19 ULMN 3 2er8_d00 TRANSCRIPTION ACTIVATOR/DNA user 4 3 # 4 C 43 GLN D 21 GLN~? 15.00 CH3 ACY B 401 C 44 LYS D 17 LYS~? 17.87 CH3 ACY B 401 C 75 ARG D 20 ARG~? 14.11 CH3 ACY B 401 coo 34.33 34.01 1.06 32.24 34.35 1.22 22.07 30.79 7.65 23.40 32.41 7.56 coo 36.27 30.15 5.40 32.93 24.83 5.96 26.90 28.52 7.20 25.78 33.34 9.99 coo 30.88 29.31 6.12 29.39 29.02 3.47 23.40 25.12 9.78 26.24 26.16 10.42 2er8_d00 source 2er8 TRANSCRIPTION ACTIVATOR/DNA : 4 hits 2er8_d00 naa= 3 ULMN 3 2ky8_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 24 ARG A 15 ARG~? 13.13 O4 PO4 A 302 A 32 LYS A 17 LYS~? 14.12 O3 PO4 A 302 A 46 ARG A 74 ARG^? 14.15 O4 PO4 A 302 coo -8.00 4.27 27.74 -7.09 2.66 30.09 26.96 5.75 -30.48 27.16 2.82 -29.53 coo -5.15 8.65 26.69 -4.26 5.48 32.02 22.94 9.69 -34.22 22.50 4.31 -36.79 coo -0.17 -5.20 27.14 -1.15 -5.34 29.97 23.62 1.58 -20.34 24.34 2.38 -17.47 ULMN 3 2ky8_d00 TRANSCRIPTION/DNA user 2 3 # 2 A 24 ARG A 74 ARG^? 14.15 O4 PO4 A 302 A 32 LYS B 81 LYS.? 16.99 O4 PO4 A 302 A 46 ARG A 15 ARG~? 13.13 O4 PO4 A 302 coo -8.00 4.27 27.74 -7.09 2.66 30.09 23.62 1.58 -20.34 24.34 2.38 -17.47 coo -5.15 8.65 26.69 -4.26 5.48 32.02 29.08 3.04 -17.20 34.50 4.57 -18.92 coo -0.17 -5.20 27.14 -1.15 -5.34 29.97 26.96 5.75 -30.48 27.16 2.82 -29.53 ULMN 3 2ky8_d00 TRANSCRIPTION/DNA user 3 3 # 3 A 24 ARG B 15 ARG~? 16.56 O ACY B 403 A 32 LYS B 17 LYS~? 19.82 CH3 ACY B 401 A 46 ARG B 74 ARG^? 16.09 O ACY B 403 coo -8.00 4.27 27.74 -7.09 2.66 30.09 6.05 9.06 5.74 4.48 7.37 3.69 coo -5.15 8.65 26.69 -4.26 5.48 32.02 10.28 12.10 9.11 8.33 8.93 13.61 coo -0.17 -5.20 27.14 -1.15 -5.34 29.97 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 2ky8_d00 TRANSCRIPTION/DNA user 4 3 # 4 A 24 ARG B 74 ARG^? 16.09 O ACY B 403 A 32 LYS A 81 LYS.? 21.98 O ACY B 403 A 46 ARG B 15 ARG~? 16.56 O ACY B 403 coo -8.00 4.27 27.74 -7.09 2.66 30.09 8.52 3.16 -3.88 8.54 3.61 -6.93 coo -5.15 8.65 26.69 -4.26 5.48 32.02 3.08 5.09 -7.58 2.00 0.68 -7.21 coo -0.17 -5.20 27.14 -1.15 -5.34 29.97 6.05 9.06 5.74 4.48 7.37 3.69 ULMN 3 2ky8_d00 TRANSCRIPTION/DNA user 5 3 # 5 A 24 ARG C 15 ARG~? 13.01 CH3 ACY C 404 A 32 LYS C 17 LYS~? 14.11 CH3 ACY C 404 A 46 ARG C 74 ARG^? 14.08 O ACY C 404 coo -8.00 4.27 27.74 -7.09 2.66 30.09 3.85 31.88 -30.47 5.01 34.67 -29.91 coo -5.15 8.65 26.69 -4.26 5.48 32.02 8.25 27.86 -34.26 8.79 32.54 -37.59 coo -0.17 -5.20 27.14 -1.15 -5.34 29.97 9.75 38.11 -21.77 8.89 36.86 -19.09 ULMN 3 2ky8_d00 TRANSCRIPTION/DNA user 6 3 # 6 A 24 ARG D 15 ARG~? 18.11 CH3 ACY B 401 A 32 LYS D 17 LYS~? 17.87 CH3 ACY B 401 A 46 ARG D 42 ARG~? 11.96 OXT ACY B 401 coo -8.00 4.27 27.74 -7.09 2.66 30.09 31.29 30.80 4.15 30.20 33.45 3.07 coo -5.15 8.65 26.69 -4.26 5.48 32.02 26.90 28.52 7.20 25.78 33.34 9.99 coo -0.17 -5.20 27.14 -1.15 -5.34 29.97 32.58 20.13 -5.26 29.93 18.65 -5.63 2ky8_d00 source 2ky8 TRANSCRIPTION/DNA : 6 hits 2ky8_d00 naa= 3 ULMN 3 3kmp_d00 TRANSCRIPTION REGULATOR/DNA user 1 3 # 1 A 74 ARG A 15 ARG~? 13.13 O4 PO4 A 302 A 76 GLN A 21 GLN~? 11.13 O3 PO4 A 302 A 81 LYS A 17 LYS~? 14.12 O3 PO4 A 302 coo -17.53 -1.82 -11.90 -18.53 0.50 -13.59 26.96 5.75 -30.48 27.16 2.82 -29.53 coo -11.64 3.92 -10.28 -12.34 5.87 -10.62 18.22 8.15 -34.01 18.46 6.14 -34.67 coo -12.79 -0.17 -12.32 -15.96 3.61 -9.93 22.94 9.69 -34.22 22.50 4.31 -36.79 ULMN 3 3kmp_d00 TRANSCRIPTION REGULATOR/DNA user 2 3 # 2 A 74 ARG B 15 ARG~? 16.56 O ACY B 403 A 76 GLN B 21 GLN~? 15.57 CH3 ACY B 401 A 81 LYS B 17 LYS~? 19.82 CH3 ACY B 401 coo -17.53 -1.82 -11.90 -18.53 0.50 -13.59 6.05 9.06 5.74 4.48 7.37 3.69 coo -11.64 3.92 -10.28 -12.34 5.87 -10.62 14.89 9.97 8.83 14.34 7.98 9.39 coo -12.79 -0.17 -12.32 -15.96 3.61 -9.93 10.28 12.10 9.11 8.33 8.93 13.61 ULMN 3 3kmp_d00 TRANSCRIPTION REGULATOR/DNA user 3 3 # 3 A 74 ARG D 15 ARG~? 18.11 CH3 ACY B 401 A 76 GLN D 21 GLN~? 15.00 CH3 ACY B 401 A 81 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo -17.53 -1.82 -11.90 -18.53 0.50 -13.59 31.29 30.80 4.15 30.20 33.45 3.07 coo -11.64 3.92 -10.28 -12.34 5.87 -10.62 22.07 30.79 7.65 23.40 32.41 7.56 coo -12.79 -0.17 -12.32 -15.96 3.61 -9.93 26.90 28.52 7.20 25.78 33.34 9.99 3kmp_d00 source 3kmp TRANSCRIPTION REGULATOR/DNA : 3 hits 3kmp_d00 naa= 3 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 1 4 # 1 B 122 ARG A 36 ARG^? 3.17 O2 GOL A 501s B 148 LYS B 76 LYS^? 19.88 O ACY B 403 B 151 LEU B 8 LEU^? 11.94 O ACY B 403 B 154 ILE B 7 ILE^? 13.52 O4 PO4 A 302 coo 13.00 32.05 60.31 16.02 31.73 59.80 14.40 16.71 -22.33 15.78 16.00 -25.01 coo 11.05 44.13 44.68 12.77 44.45 49.56 17.16 3.18 -7.74 14.10 -1.32 -8.74 coo 11.72 38.91 44.77 13.11 39.67 46.23 20.45 8.27 -6.75 22.05 7.43 -5.62 coo 7.03 36.97 46.99 7.83 37.90 47.52 22.03 7.99 -12.37 22.12 9.24 -13.14 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 2 4 # 2 B 122 ARG A 36 ARG^? 3.17 O2 GOL A 501s B 148 LYS B 81 LYS.? 16.99 O4 PO4 A 302 B 151 LEU B 80 LEU.? 12.30 O4 PO4 A 302 B 154 ILE B 7 ILE^? 13.52 O4 PO4 A 302 coo 13.00 32.05 60.31 16.02 31.73 59.80 14.40 16.71 -22.33 15.78 16.00 -25.01 coo 11.05 44.13 44.68 12.77 44.45 49.56 29.08 3.04 -17.20 34.50 4.57 -18.92 coo 11.72 38.91 44.77 13.11 39.67 46.23 27.70 6.95 -15.67 27.76 8.61 -17.03 coo 7.03 36.97 46.99 7.83 37.90 47.52 22.03 7.99 -12.37 22.12 9.24 -13.14 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 3 4 # 3 B 122 ARG A 36 ARG^? 3.17 O2 GOL A 501s B 148 LYS C 76 LYS^? 21.01 CH3 ACY C 404 B 151 LEU C 8 LEU^? 12.64 CH3 ACY C 404 B 154 ILE C 10 ILE^? 7.70 CH3 ACY C 404 coo 13.00 32.05 60.31 16.02 31.73 59.80 14.40 16.71 -22.33 15.78 16.00 -25.01 coo 11.05 44.13 44.68 12.77 44.45 49.56 18.27 36.67 -18.82 19.78 40.82 -15.57 coo 11.72 38.91 44.77 13.11 39.67 46.23 21.32 31.19 -19.92 21.03 32.05 -21.83 coo 7.03 36.97 46.99 7.83 37.90 47.52 15.33 30.47 -22.05 15.97 30.11 -23.26 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 4 4 # 4 B 122 ARG B 36 ARG^? 3.17 C ACY B 401s B 148 LYS A 76 LYS^? 19.05 O4 PO4 A 302 B 151 LEU A 8 LEU^? 12.59 O3 PO4 A 302 B 154 ILE A 7 ILE^? 13.11 O ACY B 403 coo 13.00 32.05 60.31 16.02 31.73 59.80 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 11.05 44.13 44.68 12.77 44.45 49.56 15.29 2.83 -16.82 18.24 -1.47 -14.60 coo 11.72 38.91 44.77 13.11 39.67 46.23 12.36 8.18 -18.40 10.67 7.43 -19.49 coo 7.03 36.97 46.99 7.83 37.90 47.52 10.96 8.75 -12.74 11.31 9.18 -11.55 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 5 4 # 5 B 122 ARG B 36 ARG^? 3.17 C ACY B 401s B 148 LYS A 81 LYS.? 21.98 O ACY B 403 B 151 LEU A 80 LEU.? 14.12 O ACY B 403 B 154 ILE A 7 ILE^? 13.11 O ACY B 403 coo 13.00 32.05 60.31 16.02 31.73 59.80 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 11.05 44.13 44.68 12.77 44.45 49.56 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 11.72 38.91 44.77 13.11 39.67 46.23 5.31 8.37 -9.38 5.46 10.13 -8.12 coo 7.03 36.97 46.99 7.83 37.90 47.52 10.96 8.75 -12.74 11.31 9.18 -11.55 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 6 4 # 6 B 122 ARG B 36 ARG^? 3.17 C ACY B 401s B 148 LYS D 76 LYS^? 21.99 O ACY C 404 B 151 LEU D 8 LEU^? 13.41 CH3 ACY B 403 B 154 ILE D 10 ILE^? 11.07 OXT ACY B 401 coo 13.00 32.05 60.31 16.02 31.73 59.80 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 11.05 44.13 44.68 12.77 44.45 49.56 17.64 37.25 -8.68 17.76 41.25 -12.78 coo 11.72 38.91 44.77 13.11 39.67 46.23 14.22 32.15 -7.19 12.95 33.21 -5.89 coo 7.03 36.97 46.99 7.83 37.90 47.52 19.88 31.06 -4.96 19.20 30.84 -3.80 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 7 4 # 7 B 122 ARG C 36 ARG^? -3.18 C2 GOL A 501s B 148 LYS A 76 LYS^? 19.05 O4 PO4 A 302 B 151 LEU A 8 LEU^? 12.59 O3 PO4 A 302 B 154 ILE A 10 ILE^? 7.33 O3 PO4 A 302 coo 13.00 32.05 60.31 16.02 31.73 59.80 18.67 22.17 -22.86 17.03 22.41 -25.46 coo 11.05 44.13 44.68 12.77 44.45 49.56 15.29 2.83 -16.82 18.24 -1.47 -14.60 coo 11.72 38.91 44.77 13.11 39.67 46.23 12.36 8.18 -18.40 10.67 7.43 -19.49 coo 7.03 36.97 46.99 7.83 37.90 47.52 17.74 8.61 -21.02 16.94 8.75 -22.20 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 8 4 # 8 B 122 ARG C 36 ARG^? -3.18 C2 GOL A 501s B 148 LYS D 81 LYS.? 19.75 O ACY C 404 B 151 LEU D 80 LEU.? 12.87 O ACY C 404 B 154 ILE D 7 ILE^? 14.04 O ACY C 404 coo 13.00 32.05 60.31 16.02 31.73 59.80 18.67 22.17 -22.86 17.03 22.41 -25.46 coo 11.05 44.13 44.68 12.77 44.45 49.56 4.59 37.20 -16.29 4.16 41.27 -17.63 coo 11.72 38.91 44.77 13.11 39.67 46.23 6.24 33.06 -15.25 6.15 31.32 -16.57 coo 7.03 36.97 46.99 7.83 37.90 47.52 12.28 32.19 -12.69 12.41 31.90 -13.86 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 9 4 # 9 B 122 ARG C 42 ARG~? 8.34 CH3 ACY A 402 B 148 LYS A 81 LYS.? 21.98 O ACY B 403 B 151 LEU A 80 LEU.? 14.12 O ACY B 403 B 154 ILE A 7 ILE^? 13.11 O ACY B 403 coo 13.00 32.05 60.31 16.02 31.73 59.80 1.71 20.80 -20.88 4.34 19.24 -20.78 coo 11.05 44.13 44.68 12.77 44.45 49.56 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 11.72 38.91 44.77 13.11 39.67 46.23 5.31 8.37 -9.38 5.46 10.13 -8.12 coo 7.03 36.97 46.99 7.83 37.90 47.52 10.96 8.75 -12.74 11.31 9.18 -11.55 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 10 4 # 10 B 122 ARG D 36 ARG^? 3.12 O ACY B 401s B 148 LYS B 76 LYS^? 19.88 O ACY B 403 B 151 LEU B 8 LEU^? 11.94 O ACY B 403 B 154 ILE B 10 ILE^? 8.11 O ACY B 403 coo 13.00 32.05 60.31 16.02 31.73 59.80 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 11.05 44.13 44.68 12.77 44.45 49.56 17.16 3.18 -7.74 14.10 -1.32 -8.74 coo 11.72 38.91 44.77 13.11 39.67 46.23 20.45 8.27 -6.75 22.05 7.43 -5.62 coo 7.03 36.97 46.99 7.83 37.90 47.52 15.39 9.59 -4.07 16.29 9.81 -3.04 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 11 4 # 11 B 122 ARG D 36 ARG^? 3.12 O ACY B 401s B 148 LYS C 76 LYS^? 21.01 CH3 ACY C 404 B 151 LEU C 8 LEU^? 12.64 CH3 ACY C 404 B 154 ILE C 7 ILE^? 16.60 OXT ACY B 403 coo 13.00 32.05 60.31 16.02 31.73 59.80 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 11.05 44.13 44.68 12.77 44.45 49.56 18.27 36.67 -18.82 19.78 40.82 -15.57 coo 11.72 38.91 44.77 13.11 39.67 46.23 21.32 31.19 -19.92 21.03 32.05 -21.83 coo 7.03 36.97 46.99 7.83 37.90 47.52 23.06 31.41 -14.35 22.93 31.20 -13.14 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 12 4 # 12 B 122 ARG D 36 ARG^? 3.12 O ACY B 401s B 148 LYS C 81 LYS.? 25.54 OXT ACY B 401 B 151 LEU C 80 LEU.? 17.79 OXT ACY B 401 B 154 ILE C 7 ILE^? 16.60 OXT ACY B 403 coo 13.00 32.05 60.31 16.02 31.73 59.80 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 11.05 44.13 44.68 12.77 44.45 49.56 31.22 35.67 -10.67 31.64 40.37 -10.68 coo 11.72 38.91 44.77 13.11 39.67 46.23 29.11 32.06 -11.79 29.12 30.45 -10.32 coo 7.03 36.97 46.99 7.83 37.90 47.52 23.06 31.41 -14.35 22.93 31.20 -13.14 3odc_d00 source 3odc DNA BINDING PROTEIN/DNA : 12 hits 3odc_d00 naa= 4 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 G 386 ARG A 36 ARG^? 3.17 O2 GOL A 501s G 387 HIS A 27 HIS~? -3.83 OXT ACY A 402s G 390 SER A 30 SER.? -4.23 CH3 ACY A 402s coo 93.17 52.97 31.81 95.66 54.71 32.14 14.40 16.71 -22.33 15.78 16.00 -25.01 coo 95.60 53.07 40.31 97.10 52.52 41.67 9.52 16.92 -31.25 8.29 18.47 -31.94 coo 93.25 46.91 38.79 94.12 47.43 36.62 6.58 16.18 -25.41 6.11 17.58 -27.30 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 G 386 ARG B 36 ARG^? 3.17 C ACY B 401s G 387 HIS B 27 HIS~? 8.91 CH3 ACY B 401 G 390 SER B 30 SER.? 9.89 OXT ACY B 401 coo 93.17 52.97 31.81 95.66 54.71 32.14 19.55 17.55 -3.52 18.22 17.20 -0.77 coo 95.60 53.07 40.31 97.10 52.52 41.67 24.22 18.07 5.55 25.63 19.33 6.45 coo 93.25 46.91 38.79 94.12 47.43 36.62 27.11 16.51 -0.32 27.88 17.99 1.39 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 3 3 # 3 G 386 ARG C 36 ARG^? -3.18 C2 GOL A 501s G 387 HIS C 27 HIS~? 7.34 O1 PO4 A 302 G 390 SER C 30 SER.? 7.40 O1 PO4 A 302 coo 93.17 52.97 31.81 95.66 54.71 32.14 18.67 22.17 -22.86 17.03 22.41 -25.46 coo 95.60 53.07 40.31 97.10 52.52 41.67 22.05 20.86 -32.07 23.10 19.40 -33.17 coo 93.25 46.91 38.79 94.12 47.43 36.62 25.81 22.61 -26.89 26.10 20.85 -28.49 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 4 3 # 4 G 386 ARG D 36 ARG^? 3.12 O ACY B 401s G 387 HIS D 27 HIS~? 8.84 CH3 ACY B 401 G 390 SER D 30 SER.? 8.07 CH3 ACY B 403 coo 93.17 52.97 31.81 95.66 54.71 32.14 15.90 23.27 -3.56 17.50 23.47 -0.92 coo 95.60 53.07 40.31 97.10 52.52 41.67 12.53 22.86 5.89 11.39 21.93 7.39 coo 93.25 46.91 38.79 94.12 47.43 36.62 8.81 24.50 0.42 8.52 22.82 2.10 3qrf_d00 source 3qrf DNA BINDING PROTEIN/DNA : 4 hits 3qrf_d00 naa= 3 ULMN 3 3qsv_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 81 ARG A 15 ARG~? 13.13 O4 PO4 A 302 A 83 GLN A 21 GLN~? 11.13 O3 PO4 A 302 A 88 LYS A 17 LYS~? 14.12 O3 PO4 A 302 coo 19.97 2.61 -45.02 18.79 3.68 -42.41 26.96 5.75 -30.48 27.16 2.82 -29.53 coo 24.10 10.39 -42.90 23.65 10.53 -40.83 18.22 8.15 -34.01 18.46 6.14 -34.67 coo 20.32 8.01 -45.76 23.08 6.63 -41.24 22.94 9.69 -34.22 22.50 4.31 -36.79 ULMN 3 3qsv_d00 TRANSCRIPTION/DNA user 2 3 # 2 A 81 ARG B 15 ARG~? 16.56 O ACY B 403 A 83 GLN B 21 GLN~? 15.57 CH3 ACY B 401 A 88 LYS B 17 LYS~? 19.82 CH3 ACY B 401 coo 19.97 2.61 -45.02 18.79 3.68 -42.41 6.05 9.06 5.74 4.48 7.37 3.69 coo 24.10 10.39 -42.90 23.65 10.53 -40.83 14.89 9.97 8.83 14.34 7.98 9.39 coo 20.32 8.01 -45.76 23.08 6.63 -41.24 10.28 12.10 9.11 8.33 8.93 13.61 ULMN 3 3qsv_d00 TRANSCRIPTION/DNA user 3 3 # 3 A 81 ARG C 15 ARG~? 13.01 CH3 ACY C 404 A 83 GLN C 21 GLN~? 11.26 CH3 ACY C 404 A 88 LYS C 17 LYS~? 14.11 CH3 ACY C 404 coo 19.97 2.61 -45.02 18.79 3.68 -42.41 3.85 31.88 -30.47 5.01 34.67 -29.91 coo 24.10 10.39 -42.90 23.65 10.53 -40.83 13.04 29.36 -34.75 12.61 31.30 -35.54 coo 20.32 8.01 -45.76 23.08 6.63 -41.24 8.25 27.86 -34.26 8.79 32.54 -37.59 ULMN 3 3qsv_d00 TRANSCRIPTION/DNA user 4 3 # 4 A 81 ARG D 15 ARG~? 18.11 CH3 ACY B 401 A 83 GLN D 21 GLN~? 15.00 CH3 ACY B 401 A 88 LYS D 17 LYS~? 17.87 CH3 ACY B 401 coo 19.97 2.61 -45.02 18.79 3.68 -42.41 31.29 30.80 4.15 30.20 33.45 3.07 coo 24.10 10.39 -42.90 23.65 10.53 -40.83 22.07 30.79 7.65 23.40 32.41 7.56 coo 20.32 8.01 -45.76 23.08 6.63 -41.24 26.90 28.52 7.20 25.78 33.34 9.99 3qsv_d00 source 3qsv TRANSCRIPTION/DNA : 4 hits 3qsv_d00 naa= 3 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 A 21 GLN A 21 GLN~? 11.13 O3 PO4 A 302 A 41 TYR A 19 TYR~? -3.51 O4 PO4 A 302s A 43 ASN A 23 ASN~? 3.23 O3 PO4 A 302s coo 22.03 6.35 12.16 20.71 6.08 10.54 18.22 8.15 -34.01 18.46 6.14 -34.67 coo 18.67 0.21 9.03 16.70 -1.66 8.55 23.53 13.07 -28.35 25.34 12.98 -26.20 coo 14.90 7.30 8.78 14.25 8.14 6.97 16.56 14.98 -29.71 17.96 15.58 -28.25 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 A 21 GLN B 21 GLN~? 15.57 CH3 ACY B 401 A 41 TYR B 19 TYR~? 7.66 CH3 ACY B 403 A 43 ASN B 23 ASN~? 4.38 CH3 ACY B 401 coo 22.03 6.35 12.16 20.71 6.08 10.54 14.89 9.97 8.83 14.34 7.98 9.39 coo 18.67 0.21 9.03 16.70 -1.66 8.55 10.24 15.60 3.03 8.77 16.10 0.69 coo 14.90 7.30 8.78 14.25 8.14 6.97 16.95 16.62 4.13 15.59 17.22 2.56 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 3 3 # 3 A 21 GLN C 21 GLN~? 11.26 CH3 ACY C 404 A 41 TYR C 19 TYR~? -3.65 O ACY C 404s A 43 ASN C 23 ASN~? 3.34 CH3 ACY C 404s coo 22.03 6.35 12.16 20.71 6.08 10.54 13.04 29.36 -34.75 12.61 31.30 -35.54 coo 18.67 0.21 9.03 16.70 -1.66 8.55 8.78 24.90 -28.00 7.24 25.17 -25.66 coo 14.90 7.30 8.78 14.25 8.14 6.97 15.33 22.92 -30.05 14.25 22.35 -28.34 3ssc_d00 source 3ssc DNA BINDING PROTEIN/DNA : 3 hits 3ssc_d00 naa= 3 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 A 78 ARG A 15 ARG~? 13.13 O4 PO4 A 302 A 82 LYS A 17 LYS~? 14.12 O3 PO4 A 302 A 97 ARG A 74 ARG^? 14.15 O4 PO4 A 302 coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 26.96 5.75 -30.48 27.16 2.82 -29.53 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 22.94 9.69 -34.22 22.50 4.31 -36.79 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 23.62 1.58 -20.34 24.34 2.38 -17.47 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 A 78 ARG A 74 ARG^? 14.15 O4 PO4 A 302 A 82 LYS B 81 LYS.? 16.99 O4 PO4 A 302 A 97 ARG A 15 ARG~? 13.13 O4 PO4 A 302 coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 23.62 1.58 -20.34 24.34 2.38 -17.47 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 29.08 3.04 -17.20 34.50 4.57 -18.92 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 26.96 5.75 -30.48 27.16 2.82 -29.53 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 3 3 # 3 A 78 ARG B 15 ARG~? 16.56 O ACY B 403 A 82 LYS B 17 LYS~? 19.82 CH3 ACY B 401 A 97 ARG B 74 ARG^? 16.09 O ACY B 403 coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 6.05 9.06 5.74 4.48 7.37 3.69 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 10.28 12.10 9.11 8.33 8.93 13.61 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 4 3 # 4 A 78 ARG B 74 ARG^? 16.09 O ACY B 403 A 82 LYS A 81 LYS.? 21.98 O ACY B 403 A 97 ARG B 15 ARG~? 16.56 O ACY B 403 coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 8.52 3.16 -3.88 8.54 3.61 -6.93 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 3.08 5.09 -7.58 2.00 0.68 -7.21 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 6.05 9.06 5.74 4.48 7.37 3.69 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 5 3 # 5 A 78 ARG C 15 ARG~? 13.01 CH3 ACY C 404 A 82 LYS C 17 LYS~? 14.11 CH3 ACY C 404 A 97 ARG C 74 ARG^? 14.08 O ACY C 404 coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 3.85 31.88 -30.47 5.01 34.67 -29.91 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 8.25 27.86 -34.26 8.79 32.54 -37.59 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 9.75 38.11 -21.77 8.89 36.86 -19.09 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 6 3 # 6 A 78 ARG C 74 ARG^? 14.08 O ACY C 404 A 82 LYS D 81 LYS.? 19.75 O ACY C 404 A 97 ARG C 15 ARG~? 13.01 CH3 ACY C 404 coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 9.75 38.11 -21.77 8.89 36.86 -19.09 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 4.59 37.20 -16.29 4.16 41.27 -17.63 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 3.85 31.88 -30.47 5.01 34.67 -29.91 4er8_d00 source 4er8 DNA BINDING PROTEIN/DNA : 6 hits 4er8_d00 naa= 3 ULMN 3 4hn5_d00 TRANSCRIPTION/DNA user 1 3 # 1 B 442 LYS A 76 LYS^? 19.05 O4 PO4 A 302 B 443 VAL A 75 VAL^? 12.20 O3 PO4 A 302 B 447 ARG A 74 ARG^? 14.15 O4 PO4 A 302 coo -11.49 8.72 29.13 -11.20 3.78 25.16 15.29 2.83 -16.82 18.24 -1.47 -14.60 coo -11.96 6.22 31.96 -10.74 4.61 32.81 16.85 3.56 -20.20 14.87 3.56 -21.29 coo -14.58 4.58 36.41 -12.11 2.82 36.84 23.62 1.58 -20.34 24.34 2.38 -17.47 ULMN 3 4hn5_d00 TRANSCRIPTION/DNA user 2 3 # 2 B 442 LYS B 76 LYS^? 19.88 O ACY B 403 B 443 VAL B 75 VAL^? 13.43 O ACY B 403 B 447 ARG B 74 ARG^? 16.09 O ACY B 403 coo -11.49 8.72 29.13 -11.20 3.78 25.16 17.16 3.18 -7.74 14.10 -1.32 -8.74 coo -11.96 6.22 31.96 -10.74 4.61 32.81 15.56 4.47 -4.49 17.48 4.39 -3.41 coo -14.58 4.58 36.41 -12.11 2.82 36.84 8.52 3.16 -3.88 8.54 3.61 -6.93 ULMN 3 4hn5_d00 TRANSCRIPTION/DNA user 3 3 # 3 B 442 LYS C 76 LYS^? 21.01 CH3 ACY C 404 B 443 VAL C 75 VAL^? 12.78 CH3 ACY C 404 B 447 ARG C 74 ARG^? 14.08 O ACY C 404 coo -11.49 8.72 29.13 -11.20 3.78 25.16 18.27 36.67 -18.82 19.78 40.82 -15.57 coo -11.96 6.22 31.96 -10.74 4.61 32.81 16.36 35.61 -21.93 18.18 35.66 -23.23 coo -14.58 4.58 36.41 -12.11 2.82 36.84 9.75 38.11 -21.77 8.89 36.86 -19.09 ULMN 3 4hn5_d00 TRANSCRIPTION/DNA user 4 3 # 4 B 442 LYS D 76 LYS^? 21.99 O ACY C 404 B 443 VAL D 75 VAL^? 16.15 O ACY B 401 B 447 ARG D 74 ARG^? 19.24 OXT ACY B 401 coo -11.49 8.72 29.13 -11.20 3.78 25.16 17.64 37.25 -8.68 17.76 41.25 -12.78 coo -11.96 6.22 31.96 -10.74 4.61 32.81 19.55 36.19 -5.61 17.76 36.01 -4.35 coo -14.58 4.58 36.41 -12.11 2.82 36.84 25.93 38.34 -6.34 26.99 36.29 -8.39 4hn5_d00 source 4hn5 TRANSCRIPTION/DNA : 4 hits 4hn5_d00 naa= 3 ULMN 3 3hde_o00 LYSOZYME user 1 3 # 1 A 35 GLU A 2 GLU.? 21.82 O ACY A 402 A 44 ASP A 32 ASP.? 10.92 O ACY A 402 A 50 THR A 59 THR~? 14.19 O ACY A 402 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 -6.06 7.32 -19.37 -7.28 7.04 -21.11 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 3.75 12.55 -21.98 2.34 11.90 -23.40 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 3 3hde_o00 LYSOZYME user 2 3 # 2 A 35 GLU A 2 GLU.? 21.82 O ACY A 402 A 44 ASP A 58 ASP~? 21.11 O ACY A 402 A 50 THR A 59 THR~? 14.19 O ACY A 402 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 -6.06 7.32 -19.37 -7.28 7.04 -21.11 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -0.40 1.81 -24.05 -0.18 0.11 -25.35 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 3 3hde_o00 LYSOZYME user 3 3 # 3 A 35 GLU A 31 GLU.? 11.52 CH3 ACY A 402 A 44 ASP A 56 ASP~? 17.92 O ACY A 402 A 50 THR A 55 THR.? 13.99 O ACY A 402 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 0.44 16.93 -24.63 -1.32 16.41 -25.67 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 3 3hde_o00 LYSOZYME user 4 3 # 4 A 35 GLU A 31 GLU.? 11.52 CH3 ACY A 402 A 44 ASP A 56 ASP~? 17.92 O ACY A 402 A 50 THR A 59 THR~? 14.19 O ACY A 402 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 0.44 16.93 -24.63 -1.32 16.41 -25.67 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 3 3hde_o00 LYSOZYME user 5 3 # 5 A 35 GLU B 2 GLU.? 29.03 OXT ACY B 401 A 44 ASP B 58 ASP~? 24.69 OXT ACY B 401 A 50 THR B 59 THR~? 17.71 OXT ACY B 401 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 39.73 3.44 -6.86 41.69 3.03 -6.17 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 33.22 2.96 0.74 34.69 1.59 1.17 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 3 3hde_o00 LYSOZYME user 6 3 # 6 A 35 GLU B 31 GLU.? 14.62 OXT ACY B 401 A 44 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 50 THR B 55 THR.? 17.12 OXT ACY B 401 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 33.31 16.38 -0.70 33.25 18.46 -1.14 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 3 3hde_o00 LYSOZYME user 7 3 # 7 A 35 GLU B 31 GLU.? 14.62 OXT ACY B 401 A 44 ASP B 56 ASP~? 21.60 OXT ACY B 401 A 50 THR B 59 THR~? 17.71 OXT ACY B 401 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 33.31 16.38 -0.70 33.25 18.46 -1.14 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 3 3hde_o00 LYSOZYME user 8 3 # 8 A 35 GLU C 31 GLU.? 14.58 O1 PO4 A 302 A 44 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 50 THR C 55 THR.? 17.79 O3 GOL A 501 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 31.25 23.87 -27.43 32.95 24.08 -28.66 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 32.26 29.93 -21.97 30.77 30.39 -23.54 ULMN 3 3hde_o00 LYSOZYME user 9 3 # 9 A 35 GLU C 31 GLU.? 14.58 O1 PO4 A 302 A 44 ASP C 56 ASP~? 22.04 O3 GOL A 501 A 50 THR C 59 THR~? 18.08 O3 GOL A 501 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 31.25 23.87 -27.43 32.95 24.08 -28.66 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 3 3hde_o00 LYSOZYME user 10 3 # 10 A 35 GLU C 31 GLU.? 14.58 O1 PO4 A 302 A 44 ASP C 58 ASP~? 25.07 O3 GOL A 501 A 50 THR C 59 THR~? 18.08 O3 GOL A 501 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 31.25 23.87 -27.43 32.95 24.08 -28.66 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 32.89 35.88 -28.31 34.37 37.32 -28.69 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 3 3hde_o00 LYSOZYME user 11 3 # 11 A 35 GLU D 2 GLU.? 23.79 O ACY C 404 A 44 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 50 THR D 55 THR.? 15.68 CH3 ACY B 403 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 -6.17 33.52 -9.55 -6.78 32.15 -11.04 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 2.98 31.79 -5.06 4.48 32.25 -3.56 ULMN 3 3hde_o00 LYSOZYME user 12 3 # 12 A 35 GLU D 31 GLU.? 15.11 CH3 ACY B 403 A 44 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 50 THR D 55 THR.? 15.68 CH3 ACY B 403 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 2.56 25.26 0.73 1.39 26.46 2.05 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 2.98 31.79 -5.06 4.48 32.25 -3.56 ULMN 3 3hde_o00 LYSOZYME user 13 3 # 13 A 35 GLU D 31 GLU.? 15.11 CH3 ACY B 403 A 44 ASP D 56 ASP~? 19.96 CH3 ACY B 403 A 50 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 2.56 25.26 0.73 1.39 26.46 2.05 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 5.37 35.06 -0.11 4.54 33.06 0.04 3hde_o00 source 3HDE LYSOZYME : 13 hits 3hde_o00 naa= 3 ULMN 3 3hde_o01 LYSOZYME user 1 3 # 1 B 35 GLU A 2 GLU.? 21.82 O ACY A 402 B 44 ASP A 32 ASP.? 10.92 O ACY A 402 B 50 THR A 59 THR~? 14.19 O ACY A 402 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 -6.06 7.32 -19.37 -7.28 7.04 -21.11 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 3.75 12.55 -21.98 2.34 11.90 -23.40 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 3 3hde_o01 LYSOZYME user 2 3 # 2 B 35 GLU A 31 GLU.? 11.52 CH3 ACY A 402 B 44 ASP A 56 ASP~? 17.92 O ACY A 402 B 50 THR A 55 THR.? 13.99 O ACY A 402 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 0.44 16.93 -24.63 -1.32 16.41 -25.67 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 3 3hde_o01 LYSOZYME user 3 3 # 3 B 35 GLU A 31 GLU.? 11.52 CH3 ACY A 402 B 44 ASP A 56 ASP~? 17.92 O ACY A 402 B 50 THR A 59 THR~? 14.19 O ACY A 402 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 0.44 16.93 -24.63 -1.32 16.41 -25.67 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 3 3hde_o01 LYSOZYME user 4 3 # 4 B 35 GLU A 43 GLU~? 17.21 O4 PO4 A 302 B 44 ASP B 32 ASP.? 15.94 OXT ACY B 401 B 50 THR B 55 THR.? 17.12 OXT ACY B 401 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 34.86 12.61 -16.78 35.59 13.22 -14.90 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 3 3hde_o01 LYSOZYME user 5 3 # 5 B 35 GLU B 2 GLU.? 29.03 OXT ACY B 401 B 44 ASP B 32 ASP.? 15.94 OXT ACY B 401 B 50 THR B 55 THR.? 17.12 OXT ACY B 401 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 39.73 3.44 -6.86 41.69 3.03 -6.17 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 3 3hde_o01 LYSOZYME user 6 3 # 6 B 35 GLU B 2 GLU.? 29.03 OXT ACY B 401 B 44 ASP B 32 ASP.? 15.94 OXT ACY B 401 B 50 THR B 59 THR~? 17.71 OXT ACY B 401 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 39.73 3.44 -6.86 41.69 3.03 -6.17 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 30.64 12.55 -3.88 32.46 12.19 -2.91 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 3 3hde_o01 LYSOZYME user 7 3 # 7 B 35 GLU B 2 GLU.? 29.03 OXT ACY B 401 B 44 ASP B 58 ASP~? 24.69 OXT ACY B 401 B 50 THR B 59 THR~? 17.71 OXT ACY B 401 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 39.73 3.44 -6.86 41.69 3.03 -6.17 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 33.22 2.96 0.74 34.69 1.59 1.17 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 3 3hde_o01 LYSOZYME user 8 3 # 8 B 35 GLU B 31 GLU.? 14.62 OXT ACY B 401 B 44 ASP B 56 ASP~? 21.60 OXT ACY B 401 B 50 THR B 55 THR.? 17.12 OXT ACY B 401 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 33.31 16.38 -0.70 33.25 18.46 -1.14 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 3 3hde_o01 LYSOZYME user 9 3 # 9 B 35 GLU B 31 GLU.? 14.62 OXT ACY B 401 B 44 ASP B 56 ASP~? 21.60 OXT ACY B 401 B 50 THR B 59 THR~? 17.71 OXT ACY B 401 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 33.31 16.38 -0.70 33.25 18.46 -1.14 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 35.20 5.48 -3.85 34.81 5.79 -1.78 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 3 3hde_o01 LYSOZYME user 10 3 # 10 B 35 GLU B 31 GLU.? 14.62 OXT ACY B 401 B 44 ASP B 58 ASP~? 24.69 OXT ACY B 401 B 50 THR B 59 THR~? 17.71 OXT ACY B 401 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 33.31 16.38 -0.70 33.25 18.46 -1.14 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 33.22 2.96 0.74 34.69 1.59 1.17 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 3 3hde_o01 LYSOZYME user 11 3 # 11 B 35 GLU C 2 GLU.? 25.10 O1 PO4 A 302 B 44 ASP C 32 ASP.? 15.02 O1 PO4 A 302 B 50 THR C 59 THR~? 18.08 O3 GOL A 501 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 40.20 31.59 -19.52 40.69 30.01 -20.87 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 29.38 26.56 -24.17 30.67 26.95 -25.70 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 3 3hde_o01 LYSOZYME user 12 3 # 12 B 35 GLU C 2 GLU.? 25.10 O1 PO4 A 302 B 44 ASP C 58 ASP~? 25.07 O3 GOL A 501 B 50 THR C 59 THR~? 18.08 O3 GOL A 501 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 40.20 31.59 -19.52 40.69 30.01 -20.87 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 32.89 35.88 -28.31 34.37 37.32 -28.69 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 3 3hde_o01 LYSOZYME user 13 3 # 13 B 35 GLU C 31 GLU.? 14.58 O1 PO4 A 302 B 44 ASP C 56 ASP~? 22.04 O3 GOL A 501 B 50 THR C 59 THR~? 18.08 O3 GOL A 501 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 31.25 23.87 -27.43 32.95 24.08 -28.66 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 34.87 33.34 -23.80 34.50 32.98 -25.83 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 3 3hde_o01 LYSOZYME user 14 3 # 14 B 35 GLU C 31 GLU.? 14.58 O1 PO4 A 302 B 44 ASP C 58 ASP~? 25.07 O3 GOL A 501 B 50 THR C 59 THR~? 18.08 O3 GOL A 501 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 31.25 23.87 -27.43 32.95 24.08 -28.66 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 32.89 35.88 -28.31 34.37 37.32 -28.69 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 3 3hde_o01 LYSOZYME user 15 3 # 15 B 35 GLU C 43 GLU~? 17.47 O ACY C 404 B 44 ASP D 32 ASP.? 14.33 CH3 ACY B 403 B 50 THR D 55 THR.? 15.68 CH3 ACY B 403 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 -1.82 27.43 -15.06 -1.58 27.20 -12.95 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 2.98 31.79 -5.06 4.48 32.25 -3.56 ULMN 3 3hde_o01 LYSOZYME user 16 3 # 16 B 35 GLU D 2 GLU.? 23.79 O ACY C 404 B 44 ASP D 32 ASP.? 14.33 CH3 ACY B 403 B 50 THR D 55 THR.? 15.68 CH3 ACY B 403 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 -6.17 33.52 -9.55 -6.78 32.15 -11.04 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 4.73 28.33 -3.00 2.76 28.70 -2.23 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 2.98 31.79 -5.06 4.48 32.25 -3.56 ULMN 3 3hde_o01 LYSOZYME user 17 3 # 17 B 35 GLU D 31 GLU.? 15.11 CH3 ACY B 403 B 44 ASP D 56 ASP~? 19.96 CH3 ACY B 403 B 50 THR D 59 THR~? 16.58 CH3 ACY B 403 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 2.56 25.26 0.73 1.39 26.46 2.05 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 0.36 35.17 -3.02 0.83 34.67 -1.05 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 5.37 35.06 -0.11 4.54 33.06 0.04 ULMN 3 3hde_o01 LYSOZYME user 18 3 # 18 B 35 GLU D 31 GLU.? 15.11 CH3 ACY B 403 B 44 ASP D 58 ASP~? 23.91 CH3 ACY B 403 B 50 THR D 59 THR~? 16.58 CH3 ACY B 403 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 2.56 25.26 0.73 1.39 26.46 2.05 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 2.43 37.89 1.30 0.84 39.23 1.50 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 5.37 35.06 -0.11 4.54 33.06 0.04 3hde_o01 source 3HDE LYSOZYME : 18 hits 3hde_o01 naa= 3 ULMN 3 3hde_o02 LYSOZYME user 1 3 # 1 C 35 GLU A 2 GLU.? 21.82 O ACY A 402 C 44 ASP A 32 ASP.? 10.92 O ACY A 402 C 50 THR A 59 THR~? 14.19 O ACY A 402 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 -6.06 7.32 -19.37 -7.28 7.04 -21.11 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 3.75 12.55 -21.98 2.34 11.90 -23.40 coo 25.48 4.87 1.60 23.90 4.95 0.15 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 3 3hde_o02 LYSOZYME user 2 3 # 2 C 35 GLU A 31 GLU.? 11.52 CH3 ACY A 402 C 44 ASP A 56 ASP~? 17.92 O ACY A 402 C 50 THR A 55 THR.? 13.99 O ACY A 402 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 0.44 16.93 -24.63 -1.32 16.41 -25.67 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 25.48 4.87 1.60 23.90 4.95 0.15 0.90 9.48 -19.14 2.18 8.78 -20.76 ULMN 3 3hde_o02 LYSOZYME user 3 3 # 3 C 35 GLU A 31 GLU.? 11.52 CH3 ACY A 402 C 44 ASP A 56 ASP~? 17.92 O ACY A 402 C 50 THR A 59 THR~? 14.19 O ACY A 402 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 0.44 16.93 -24.63 -1.32 16.41 -25.67 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 -2.03 5.92 -20.65 -1.35 5.51 -22.61 coo 25.48 4.87 1.60 23.90 4.95 0.15 2.48 5.35 -23.92 1.78 7.38 -24.24 ULMN 3 3hde_o02 LYSOZYME user 4 3 # 4 C 35 GLU A 43 GLU~? 17.21 O4 PO4 A 302 C 44 ASP B 32 ASP.? 15.94 OXT ACY B 401 C 50 THR B 55 THR.? 17.12 OXT ACY B 401 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 34.86 12.61 -16.78 35.59 13.22 -14.90 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 25.48 4.87 1.60 23.90 4.95 0.15 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 3 3hde_o02 LYSOZYME user 5 3 # 5 C 35 GLU B 2 GLU.? 29.03 OXT ACY B 401 C 44 ASP B 32 ASP.? 15.94 OXT ACY B 401 C 50 THR B 55 THR.? 17.12 OXT ACY B 401 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 39.73 3.44 -6.86 41.69 3.03 -6.17 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 25.48 4.87 1.60 23.90 4.95 0.15 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 3 3hde_o02 LYSOZYME user 6 3 # 6 C 35 GLU B 2 GLU.? 29.03 OXT ACY B 401 C 44 ASP B 32 ASP.? 15.94 OXT ACY B 401 C 50 THR B 59 THR~? 17.71 OXT ACY B 401 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 39.73 3.44 -6.86 41.69 3.03 -6.17 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 30.64 12.55 -3.88 32.46 12.19 -2.91 coo 25.48 4.87 1.60 23.90 4.95 0.15 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 3 3hde_o02 LYSOZYME user 7 3 # 7 C 35 GLU B 31 GLU.? 14.62 OXT ACY B 401 C 44 ASP B 56 ASP~? 21.60 OXT ACY B 401 C 50 THR B 55 THR.? 17.12 OXT ACY B 401 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 33.31 16.38 -0.70 33.25 18.46 -1.14 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 25.48 4.87 1.60 23.90 4.95 0.15 32.20 8.69 -5.88 30.77 8.33 -4.30 ULMN 3 3hde_o02 LYSOZYME user 8 3 # 8 C 35 GLU B 31 GLU.? 14.62 OXT ACY B 401 C 44 ASP B 56 ASP~? 21.60 OXT ACY B 401 C 50 THR B 59 THR~? 17.71 OXT ACY B 401 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 33.31 16.38 -0.70 33.25 18.46 -1.14 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 35.20 5.48 -3.85 34.81 5.79 -1.78 coo 25.48 4.87 1.60 23.90 4.95 0.15 30.30 5.71 -0.52 31.18 7.66 -0.59 ULMN 3 3hde_o02 LYSOZYME user 9 3 # 9 C 35 GLU C 2 GLU.? 25.10 O1 PO4 A 302 C 44 ASP C 32 ASP.? 15.02 O1 PO4 A 302 C 50 THR C 59 THR~? 18.08 O3 GOL A 501 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 40.20 31.59 -19.52 40.69 30.01 -20.87 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 29.38 26.56 -24.17 30.67 26.95 -25.70 coo 25.48 4.87 1.60 23.90 4.95 0.15 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 3 3hde_o02 LYSOZYME user 10 3 # 10 C 35 GLU C 31 GLU.? 14.58 O1 PO4 A 302 C 44 ASP C 56 ASP~? 22.04 O3 GOL A 501 C 50 THR C 59 THR~? 18.08 O3 GOL A 501 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 31.25 23.87 -27.43 32.95 24.08 -28.66 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 34.87 33.34 -23.80 34.50 32.98 -25.83 coo 25.48 4.87 1.60 23.90 4.95 0.15 29.94 33.15 -27.01 30.78 31.19 -27.05 ULMN 3 3hde_o02 LYSOZYME user 11 3 # 11 C 35 GLU D 31 GLU.? 15.11 CH3 ACY B 403 C 44 ASP D 56 ASP~? 19.96 CH3 ACY B 403 C 50 THR D 59 THR~? 16.58 CH3 ACY B 403 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 2.56 25.26 0.73 1.39 26.46 2.05 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 0.36 35.17 -3.02 0.83 34.67 -1.05 coo 25.48 4.87 1.60 23.90 4.95 0.15 5.37 35.06 -0.11 4.54 33.06 0.04 3hde_o02 source 3HDE LYSOZYME : 11 hits 3hde_o02 naa= 3